## Copyright 2002 by mmPython Development Group (see AUTHORS file) ## This code is part of the mmPython distrobution and governed by ## its license. Please see the LICENSE file that should have been ## included as part of this package. PenultimateRotamerMap = {} PenultimateRotamerMap["ARG"] = [] PenultimateRotamerMap["LYS"] = [] PenultimateRotamerMap["MET"] = [] PenultimateRotamerMap["GLU"] = [] PenultimateRotamerMap["GLN"] = [] PenultimateRotamerMap["ASP"] = [] PenultimateRotamerMap["ASN"] = [] PenultimateRotamerMap["ILE"] = [] PenultimateRotamerMap["LEU"] = [] PenultimateRotamerMap["HIS"] = [] PenultimateRotamerMap["TRP"] = [] PenultimateRotamerMap["TYR"] = [] PenultimateRotamerMap["PHE"] = [] PenultimateRotamerMap["PRO"] = [] PenultimateRotamerMap["THR"] = [] PenultimateRotamerMap["VAL"] = [] PenultimateRotamerMap["SER"] = [] PenultimateRotamerMap["CYS"] = [] PenultimateRotamerMap["DIS"] = [] def angdist(a1, a2): if (a1>=0 and a2>=0) or (a1<0 and a2<0): return abs(a1 - a2) else: a1_180 = 180 - abs(a1) a2_180 = 180 - abs(a2) diff0 = abs(a1 - a2) diff180 = a1_180 + a2_180 return min(diff0, diff180) def FindBestRotamer(aa_res): """Compare the chi1 angle with those of the standard rotamer library of the residue and return a list of rotamers which have the nearest values.""" try: rotamer_list = PenultimateRotamerMap[aa_res.res_name] except KeyError: return None, None (chi1, chi2, chi3, chi4) = aa_res.calc_torsion_chi() best_rotamer = None min_sum = None for rotamer in rotamer_list: sum = 0.0 if chi1 and rotamer.chi1_comm: d1 = angdist(chi1, rotamer.chi1_comm) sum += d1*d1 if chi2 and rotamer.chi2_comm: d2 = angdist(chi2, rotamer.chi2_comm) sum += d2*d2 if chi3 and rotamer.chi3_comm: d3 = angdist(chi3, rotamer.chi3_comm) sum += d3*d3 if chi4 and rotamer.chi4_comm: d4 = angdist(chi4, rotamer.chi4_comm) sum += d4*d4 if not min_sum or sum < min_sum: min_sum = sum best_rotamer = rotamer elif sum == min_sum: pass ## print " chi1 = (%s, %s)" % (chi1, best_rotamer.chi1_comm) ## print " chi2 = (%s, %s)" % (chi2, best_rotamer.chi2_comm) ## print " chi3 = (%s, %s)" % (chi3, best_rotamer.chi3_comm) ## print " chi4 = (%s, %s)" % (chi4, best_rotamer.chi4_comm) return min_sum, best_rotamer class PenultimateRotamer: def __init__(self, name = None, observations = None, percent = None, percent_alpha = None, percent_beta = None, percent_other = None, attri = None, chi1_mode = None, chi1_comm = None, chi1_range = None, chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None): self.name = name self.observations = observations self.percent = percent self.percent_alpha = percent_alpha self.percent_beta = percent_beta self.percent_other = percent_other self.attri = attri self.chi1_mode = chi1_mode self.chi1_comm = chi1_comm self.chi1_range = chi1_range self.chi1_hwhhfa = chi1_hwhhfa self.chi1_hwhhfc = chi1_hwhhfc self.chi2_mode = chi2_mode self.chi2_comm = chi2_comm self.chi2_range = chi2_range self.chi2_hwhhfa = chi2_hwhhfa self.chi2_hwhhfc = chi2_hwhhfc self.chi3_mode = chi3_mode self.chi3_comm = chi3_comm self.chi3_range = chi3_range self.chi3_hwhhfa = chi3_hwhhfa self.chi3_hwhhfc = chi3_hwhhfc self.chi4_mode = chi4_mode self.chi4_comm = chi4_comm self.chi4_range = chi4_range self.chi4_hwhhfa = chi4_hwhhfa self.chi4_hwhhfc = chi4_hwhhfc def __str__(self): return "%s: %s" % (self.name, str(self.percent)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptp85", observations = 3, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptp180", observations = 11, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 71, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 14, chi2_mode = 171, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -16), chi2_hwhhfc = 17, chi3_mode = 65, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (5, -5), chi3_hwhhfc = 10, chi4_mode = -161, chi4_comm = -175, chi4_range = (155, -145), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 13)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptt85", observations = 16, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 65, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 13, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 14, chi3_mode = -179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (7, -7), chi3_hwhhfc = 13, chi4_mode = 88, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (11, -11), chi4_hwhhfc = 17)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptt180", observations = 16, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 59, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = None, chi3_mode = -178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (10, -10), chi3_hwhhfc = None, chi4_mode = -177, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (19, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptt-85", observations = 15, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 66, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (7, -7), chi3_hwhhfc = None, chi4_mode = -83, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptm180", observations = 6, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 175, chi4_range = (145, -155), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ptm-85", observations = 5, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.0, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "tpp85", observations = 11, percent = 0.010000, percent_alpha = 0.03, percent_beta = 0.01, percent_other = 0.0, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = 57, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = 57, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (7, -7), chi3_hwhhfc = None, chi4_mode = 85, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "tpp180", observations = 8, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.0, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = -175, chi4_range = (155, -145), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "tpt85", observations = 20, percent = 0.020000, percent_alpha = 0.03, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = 64, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (7, -7), chi2_hwhhfc = None, chi3_mode = 180, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = None, chi4_mode = 86, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "tpt180", observations = 15, percent = 0.020000, percent_alpha = 0.03, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = 179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = 60, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (8, -15), chi2_hwhhfc = None, chi3_mode = 178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 163, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (11, -11), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttp85", observations = 33, percent = 0.040000, percent_alpha = 0.05, percent_beta = 0.03, percent_other = 0.03, attri = "major", chi1_mode = -179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (12, -12), chi2_hwhhfc = None, chi3_mode = 65, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 83, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttp180", observations = 25, percent = 0.030000, percent_alpha = 0.05, percent_beta = 0.03, percent_other = 0.01, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -14), chi2_hwhhfc = None, chi3_mode = 65, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = -162, chi4_comm = -175, chi4_range = (155, -145), chi4_hwhhfa = (30, -12), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttp-105", observations = 9, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = -105, chi4_range = (-135, -75), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttt85", observations = 19, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = -175, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = 176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = None, chi3_mode = 179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (7, -7), chi3_hwhhfc = None, chi4_mode = 83, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttt180", observations = 33, percent = 0.040000, percent_alpha = 0.03, percent_beta = 0.07, percent_other = 0.03, attri = "major", chi1_mode = -179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (7, -7), chi3_hwhhfc = None, chi4_mode = 170, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (10, -32), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttt-85", observations = 26, percent = 0.030000, percent_alpha = 0.03, percent_beta = 0.03, percent_other = 0.02, attri = "major", chi1_mode = -179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 179, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = None, chi3_mode = 180, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = None, chi4_mode = -86, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (10, -10), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttm105", observations = 10, percent = 0.010000, percent_alpha = 0.02, percent_beta = 0.01, percent_other = 0.0, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 170, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -13), chi2_hwhhfc = None, chi3_mode = -66, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (9, -9), chi3_hwhhfc = None, chi4_mode = 107, chi4_comm = 105, chi4_range = (75, 135), chi4_hwhhfa = (9, -9), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttm180", observations = 13, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.04, percent_other = 0.01, attri = "major", chi1_mode = 180, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = None, chi3_mode = -67, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (6, -6), chi3_hwhhfc = None, chi4_mode = 176, chi4_comm = 175, chi4_range = (145, -155), chi4_hwhhfa = (10, -10), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "ttm-85", observations = 28, percent = 0.030000, percent_alpha = 0.03, percent_beta = 0.03, percent_other = 0.03, attri = "major", chi1_mode = -175, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (11, -11), chi2_hwhhfc = None, chi3_mode = -65, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (10, -10), chi3_hwhhfc = None, chi4_mode = -84, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtp85", observations = 22, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.03, percent_other = 0.02, attri = "major", chi1_mode = -69, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (12, -12), chi2_hwhhfc = None, chi3_mode = 64, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 84, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtp180", observations = 45, percent = 0.050000, percent_alpha = 0.04, percent_beta = 0.03, percent_other = 0.06, attri = "major", chi1_mode = -65, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = 176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (14, -14), chi2_hwhhfc = None, chi3_mode = 64, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = -174, chi4_comm = -175, chi4_range = (155, -145), chi4_hwhhfa = (14, -14), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtp-105", observations = 7, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.01, attri = "major", chi1_mode = -62, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (6, -6), chi1_hwhhfc = None, chi2_mode = 179, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = None, chi3_mode = 67, chi3_comm = 65, chi3_range = (35, 95), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = -113, chi4_comm = -105, chi4_range = (-135, -75), chi4_hwhhfa = (6, -14), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtt85", observations = 34, percent = 0.040000, percent_alpha = 0.04, percent_beta = 0.04, percent_other = 0.03, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = 178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (18, -10), chi2_hwhhfc = None, chi3_mode = 179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 83, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = (10, -18), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtt180", observations = 89, percent = 0.090000, percent_alpha = 0.09, percent_beta = 0.05, percent_other = 0.12, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -177, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 174, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (16, -16), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtt-85", observations = 53, percent = 0.060000, percent_alpha = 0.04, percent_beta = 0.07, percent_other = 0.06, attri = "major", chi1_mode = -66, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = -177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = -83, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtm105", observations = 15, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.02, attri = "major", chi1_mode = -68, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = None, chi2_mode = -179, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -65, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 103, chi4_comm = 105, chi4_range = (75, 135), chi4_hwhhfa = (10, -10), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtm180", observations = 48, percent = 0.050000, percent_alpha = 0.01, percent_beta = 0.04, percent_other = 0.08, attri = "major", chi1_mode = -68, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = 173, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (12, -12), chi2_hwhhfc = None, chi3_mode = -64, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = 180, chi4_comm = 175, chi4_range = (145, -155), chi4_hwhhfa = (34, -12), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mtm-85", observations = 54, percent = 0.060000, percent_alpha = 0.13, percent_beta = 0.02, percent_other = 0.03, attri = "major", chi1_mode = -69, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -167, chi2_comm = -167, chi2_range = (165, -135), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -63, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = -86, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mmt85", observations = 7, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 85, chi4_range = (55, 115), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mmt180", observations = 18, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.03, percent_other = 0.02, attri = "major", chi1_mode = -63, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = -66, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (6, -6), chi3_hwhhfc = None, chi4_mode = -168, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (30, -18), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mmt-85", observations = 22, percent = 0.020000, percent_alpha = 0.0, percent_beta = 0.04, percent_other = 0.03, attri = "major", chi1_mode = -60, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -72, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (10, -10), chi3_hwhhfc = None, chi4_mode = -92, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mmm180", observations = 11, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = -64, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = -74, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (10, -10), chi2_hwhhfc = None, chi3_mode = -67, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (6, -6), chi3_hwhhfc = None, chi4_mode = 172, chi4_comm = 175, chi4_range = (145, -155), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["ARG"].append(PenultimateRotamer( name = "mmm-85", observations = 22, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.03, percent_other = 0.03, attri = "major", chi1_mode = -62, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = -64, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -61, chi3_comm = -65, chi3_range = (-95, -35), chi3_hwhhfa = (10, -10), chi3_hwhhfc = None, chi4_mode = -82, chi4_comm = -85, chi4_range = (-115, -55), chi4_hwhhfa = (8, -8), chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ptpt", observations = 7, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 68, chi3_range = (40, 100), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "pttp", observations = 13, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.02, attri = "major", chi1_mode = 63, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 13, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 14, chi3_mode = 172, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 14, chi4_mode = 61, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = (9, -9), chi4_hwhhfc = 11)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "pttt", observations = 29, percent = 0.020000, percent_alpha = 0.0, percent_beta = 0.04, percent_other = 0.03, attri = "major", chi1_mode = 64, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 13, chi2_mode = 179, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = 180, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 13, chi4_mode = 180, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 10)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "pttm", observations = 8, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ptmt", observations = 5, percent = 0.000000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 68, chi3_range = (-100, -40), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tptp", observations = 11, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = 179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = 13, chi2_mode = 59, chi2_comm = 68, chi2_range = (40, 100), chi2_hwhhfa = None, chi2_hwhhfc = 12, chi3_mode = 163, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = 10, chi4_mode = 60, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = None, chi4_hwhhfc = 11)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tptt", observations = 32, percent = 0.030000, percent_alpha = 0.05, percent_beta = 0.01, percent_other = 0.02, attri = "major", chi1_mode = 179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (4, -4), chi1_hwhhfc = 10, chi2_mode = 62, chi2_comm = 68, chi2_range = (40, 100), chi2_hwhhfa = (3, -3), chi2_hwhhfc = 10, chi3_mode = 173, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (1, -1), chi3_hwhhfc = 13, chi4_mode = 171, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (1, -12), chi4_hwhhfc = 14)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tptm", observations = 7, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.0, attri = "major", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = 14, chi2_mode = None, chi2_comm = 68, chi2_range = (40, 100), chi2_hwhhfa = None, chi2_hwhhfc = 9, chi3_mode = None, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = 12, chi4_mode = None, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = None, chi4_hwhhfc = 10)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ttpp", observations = 12, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.0, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 68, chi3_range = (40, 100), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ttpt", observations = 25, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.05, percent_other = 0.01, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 14, chi2_mode = 169, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 12, chi3_mode = 71, chi3_comm = 68, chi3_range = (40, 100), chi3_hwhhfa = (13, -13), chi3_hwhhfc = 14, chi4_mode = 172, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 14)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tttp", observations = 49, percent = 0.040000, percent_alpha = 0.05, percent_beta = 0.05, percent_other = 0.03, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 14, chi2_mode = -170, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -177, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 12, chi4_mode = 69, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 12)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tttt", observations = 162, percent = 0.130000, percent_alpha = 0.17, percent_beta = 0.19, percent_other = 0.1, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 13, chi2_mode = 178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = 179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 15, chi4_mode = 180, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (7, -7), chi4_hwhhfc = 13)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "tttm", observations = 37, percent = 0.030000, percent_alpha = 0.04, percent_beta = 0.02, percent_other = 0.03, attri = "major", chi1_mode = -176, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 12, chi2_mode = -175, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -167, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 15, chi4_mode = -59, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 13)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ttmt", observations = 20, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.04, percent_other = 0.01, attri = "major", chi1_mode = -174, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = -160, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 14, chi3_mode = -54, chi3_comm = -68, chi3_range = (-100, -40), chi3_hwhhfa = (7, -7), chi3_hwhhfc = 10, chi4_mode = -174, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (9, -9), chi4_hwhhfc = 15)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "ttmm", observations = 5, percent = 0.000000, percent_alpha = 0.01, percent_beta = 0.0, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = -68, chi3_range = (-100, -40), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mptt", observations = 4, percent = 0.000000, percent_alpha = 0.0, percent_beta = 0.0, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -90, chi1_range = (-120, -60), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 68, chi2_range = (40, 100), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mtpp", observations = 12, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = -62, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = -177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 9, chi3_mode = 71, chi3_comm = 68, chi3_range = (40, 100), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 10, chi4_mode = 68, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = (6, -6), chi4_hwhhfc = 13)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mtpt", observations = 38, percent = 0.030000, percent_alpha = 0.04, percent_beta = 0.02, percent_other = 0.03, attri = "major", chi1_mode = -69, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 12, chi2_mode = 174, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = 65, chi3_comm = 68, chi3_range = (40, 100), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 11, chi4_mode = 175, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (11, -11), chi4_hwhhfc = 9)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mttp", observations = 42, percent = 0.030000, percent_alpha = 0.02, percent_beta = 0.04, percent_other = 0.04, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 13, chi2_mode = -176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 13, chi3_mode = 175, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 14, chi4_mode = 71, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = (11, -11), chi4_hwhhfc = 14)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mttt", observations = 244, percent = 0.200000, percent_alpha = 0.23, percent_beta = 0.14, percent_other = 0.21, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 14, chi2_mode = 179, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = 179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 12, chi4_mode = 179, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (10, -10), chi4_hwhhfc = 14)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mttm", observations = 56, percent = 0.050000, percent_alpha = 0.03, percent_beta = 0.05, percent_other = 0.06, attri = "major", chi1_mode = -65, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 13, chi2_mode = 180, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 12, chi3_mode = -178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 13, chi4_mode = -63, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = (10, -10), chi4_hwhhfc = 14)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mtmt", observations = 40, percent = 0.030000, percent_alpha = 0.06, percent_beta = 0.02, percent_other = 0.03, attri = "major", chi1_mode = -68, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 12, chi2_mode = -171, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -68, chi3_comm = -68, chi3_range = (-100, -40), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 14, chi4_mode = -175, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (9, -9), chi4_hwhhfc = 13)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mtmm", observations = 12, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = -68, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 12, chi2_mode = -178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 12, chi3_mode = -68, chi3_comm = -68, chi3_range = (-100, -40), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 12, chi4_mode = -63, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = (8, -8), chi4_hwhhfc = 11)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mmtp", observations = 9, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.0, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = 65, chi4_range = (35, 95), chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mmtt", observations = 77, percent = 0.060000, percent_alpha = 0.03, percent_beta = 0.05, percent_other = 0.08, attri = "major", chi1_mode = -61, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 12, chi2_mode = -64, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -177, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 13, chi4_mode = -179, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (9, -9), chi4_hwhhfc = 13)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mmtm", observations = 18, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.02, attri = "major", chi1_mode = -64, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = -68, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 12, chi3_mode = -176, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 10, chi4_mode = -71, chi4_comm = -65, chi4_range = (-95, -35), chi4_hwhhfa = (10, -10), chi4_hwhhfc = 15)) PenultimateRotamerMap["LYS"].append(PenultimateRotamer( name = "mmmt", observations = 10, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = -59, chi1_comm = -62, chi1_range = (-90, -30), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 12, chi2_mode = -59, chi2_comm = -68, chi2_range = (-100, -40), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 13, chi3_mode = -70, chi3_comm = -68, chi3_range = (-100, -40), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 10, chi4_mode = -173, chi4_comm = 180, chi4_range = (150, -150), chi4_hwhhfa = (10, -10), chi4_hwhhfc = 15)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "ptp", observations = 12, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.03, percent_other = 0.03, attri = "major", chi1_mode = 68, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (11, -5), chi1_hwhhfc = 11, chi2_mode = -167, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (21, -6), chi2_hwhhfc = 17, chi3_mode = 88, chi3_comm = 75, chi3_range = (45, 105), chi3_hwhhfa = (9, -9), chi3_hwhhfc = 12, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "ptm", observations = 17, percent = 0.030000, percent_alpha = 0.01, percent_beta = 0.06, percent_other = 0.04, attri = "major", chi1_mode = 67, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (5, -5), chi1_hwhhfc = 9, chi2_mode = 174, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 10, chi3_mode = -78, chi3_comm = -75, chi3_range = (-105, -45), chi3_hwhhfa = (6, -6), chi3_hwhhfc = 9, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "tpp", observations = 30, percent = 0.050000, percent_alpha = 0.08, percent_beta = 0.02, percent_other = 0.05, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 66, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (14, -9), chi2_hwhhfc = 15, chi3_mode = 75, chi3_comm = 75, chi3_range = (45, 105), chi3_hwhhfa = (14, -10), chi3_hwhhfc = 15, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "tpt", observations = 9, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.04, percent_other = 0.01, attri = "major", chi1_mode = 179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = 67, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (4, -4), chi2_hwhhfc = 8, chi3_mode = -179, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (6, -6), chi3_hwhhfc = 9, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "ttp", observations = 28, percent = 0.050000, percent_alpha = 0.07, percent_beta = 0.07, percent_other = 0.02, attri = "major", chi1_mode = 176, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 11, chi3_mode = 73, chi3_comm = 75, chi3_range = (45, 105), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 11, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "ttt", observations = 17, percent = 0.030000, percent_alpha = 0.05, percent_beta = 0.02, percent_other = 0.02, attri = "major", chi1_mode = 180, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (5, -5), chi1_hwhhfc = 9, chi2_mode = 171, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 9, chi3_mode = 174, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (12, -18), chi3_hwhhfc = 19, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "ttm", observations = 36, percent = 0.070000, percent_alpha = 0.03, percent_beta = 0.1, percent_other = 0.08, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 176, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = -78, chi3_comm = -75, chi3_range = (-105, -45), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 13, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mtp", observations = 92, percent = 0.170000, percent_alpha = 0.22, percent_beta = 0.1, percent_other = 0.17, attri = "major", chi1_mode = -68, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 10, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 12, chi3_mode = 72, chi3_comm = 75, chi3_range = (45, 105), chi3_hwhhfa = (10, -10), chi3_hwhhfc = 14, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mtt", observations = 43, percent = 0.080000, percent_alpha = 0.09, percent_beta = 0.08, percent_other = 0.07, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = -178, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (8, -14), chi3_hwhhfc = 15, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mtm", observations = 58, percent = 0.110000, percent_alpha = 0.12, percent_beta = 0.11, percent_other = 0.09, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 12, chi2_mode = -177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 11, chi3_mode = -76, chi3_comm = -75, chi3_range = (-105, -45), chi3_hwhhfa = (12, -12), chi3_hwhhfc = 16, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mmp", observations = 15, percent = 0.030000, percent_alpha = 0.03, percent_beta = 0.01, percent_other = 0.04, attri = "major", chi1_mode = -64, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = -63, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = 103, chi3_comm = 103, chi3_range = (75, 135), chi3_hwhhfa = (7, -7), chi3_hwhhfc = 10, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mmt", observations = 10, percent = 0.020000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.03, attri = "major", chi1_mode = -63, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 12, chi2_mode = -64, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = (11, -11), chi2_hwhhfc = 14, chi3_mode = 180, chi3_comm = 180, chi3_range = (150, -150), chi3_hwhhfa = (15, -15), chi3_hwhhfc = 19, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["MET"].append(PenultimateRotamer( name = "mmm", observations = 105, percent = 0.190000, percent_alpha = 0.21, percent_beta = 0.16, percent_other = 0.19, attri = "major", chi1_mode = -66, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 11, chi2_mode = -60, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -67, chi3_comm = -70, chi3_range = (-100, -40), chi3_hwhhfa = (15, -10), chi3_hwhhfc = 16, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "pt-20 ", observations = 80, percent = 0.050000, percent_alpha = 0.01, percent_beta = 0.09, percent_other = 0.07, attri = "major", chi1_mode = 63, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = -175, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = -18, chi3_comm = -20, chi3_range = (-90, 90), chi3_hwhhfa = (15, -23), chi3_hwhhfc = 23, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "pm0", observations = 32, percent = 0.020000, percent_alpha = 0.0, percent_beta = 0.0, percent_other = 0.04, attri = "major", chi1_mode = 71, chi1_comm = 70, chi1_range = (40, 100), chi1_hwhhfa = (11, -11), chi1_hwhhfc = 14, chi2_mode = -79, chi2_comm = -80, chi2_range = (-110, -50), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = 5, chi3_comm = 0, chi3_range = (-50, 50), chi3_hwhhfa = (13, -13), chi3_hwhhfc = 17, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "tp10", observations = 91, percent = 0.060000, percent_alpha = 0.1, percent_beta = 0.02, percent_other = 0.06, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = 65, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = 13, chi3_comm = 10, chi3_range = (-10, 90), chi3_hwhhfa = (10, -16), chi3_hwhhfc = 17, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "tt 0 ", observations = 350, percent = 0.240000, percent_alpha = 0.25, percent_beta = 0.42, percent_other = 0.18, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = 178, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 14, chi3_mode = 2, chi3_comm = 0, chi3_range = (-90, 90), chi3_hwhhfa = (25, -25), chi3_hwhhfc = 30, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "tm-20", observations = 17, percent = 0.010000, percent_alpha = 0.01, percent_beta = 0.01, percent_other = 0.01, attri = "major", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = 13, chi2_mode = None, chi2_comm = -80, chi2_range = (-115, -55), chi2_hwhhfa = None, chi2_hwhhfc = 13, chi3_mode = None, chi3_comm = -25, chi3_range = (-50, 10), chi3_hwhhfa = None, chi3_hwhhfc = 15, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "mp0", observations = 88, percent = 0.060000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.1, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = 85, chi2_comm = 85, chi2_range = (55, 115), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 13, chi3_mode = -3, chi3_comm = 0, chi3_range = (-60, 60), chi3_hwhhfa = (16, -25), chi3_hwhhfc = 25, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "mt-10 ", observations = 484, percent = 0.330000, percent_alpha = 0.36, percent_beta = 0.29, percent_other = 0.32, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 13, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (12, -12), chi2_hwhhfc = 16, chi3_mode = -10, chi3_comm = -10, chi3_range = (-90, 90), chi3_hwhhfa = (23, -18), chi3_hwhhfc = 25, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLU"].append(PenultimateRotamer( name = "mm-40", observations = 197, percent = 0.130000, percent_alpha = 0.19, percent_beta = 0.07, percent_other = 0.12, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 14, chi2_mode = -58, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 14, chi3_mode = -40, chi3_comm = -40, chi3_range = (-90, 30), chi3_hwhhfa = (15, -26), chi3_hwhhfc = 25, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "pt 20", observations = 37, percent = 0.040000, percent_alpha = 0.01, percent_beta = 0.05, percent_other = 0.06, attri = "major", chi1_mode = 64, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 13, chi2_mode = 180, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 14, chi3_mode = 20, chi3_comm = 20, chi3_range = (-90, 90), chi3_hwhhfa = (8, -8), chi3_hwhhfc = 16, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "pm0", observations = 15, percent = 0.020000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.03, attri = "minor", chi1_mode = None, chi1_comm = 70, chi1_range = (45, 105), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = -75, chi2_range = (-105, -45), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 0, chi3_range = (-60, 60), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "tp-100", observations = 14, percent = 0.020000, percent_alpha = 0.04, percent_beta = 0.02, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = -100, chi3_range = (-150, 0), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "tp60", observations = 78, percent = 0.090000, percent_alpha = 0.13, percent_beta = 0.09, percent_other = 0.07, attri = "major", chi1_mode = -175, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 14, chi2_mode = 64, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 15, chi3_mode = 60, chi3_comm = 60, chi3_range = (0, 90), chi3_hwhhfa = (11, -21), chi3_hwhhfc = 24, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "tt 0", observations = 140, percent = 0.160000, percent_alpha = 0.16, percent_beta = 0.29, percent_other = 0.12, attri = "major", chi1_mode = -174, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 14, chi2_mode = 173, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 13, chi3_mode = -5, chi3_comm = 0, chi3_range = (-90, 90), chi3_hwhhfa = (52, -11), chi3_hwhhfc = 40, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "mp0", observations = 24, percent = 0.030000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.05, attri = "minor", chi1_mode = None, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 85, chi2_range = (55, 115), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 0, chi3_range = (-60, 60), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "mt -30", observations = 304, percent = 0.350000, percent_alpha = 0.4, percent_beta = 0.26, percent_other = 0.36, attri = "major", chi1_mode = -67, chi1_comm = -67, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 16, chi2_mode = 177, chi2_comm = 180, chi2_range = (150, -150), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 15, chi3_mode = -25, chi3_comm = -25, chi3_range = (-90, 90), chi3_hwhhfa = (29, -29), chi3_hwhhfc = 37, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "mm-40", observations = 127, percent = 0.150000, percent_alpha = 0.12, percent_beta = 0.13, percent_other = 0.17, attri = "major", chi1_mode = -66, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 16, chi2_mode = -60, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 18, chi3_mode = -40, chi3_comm = -40, chi3_range = (-95, 0), chi3_hwhhfa = (14, -19), chi3_hwhhfc = 26, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["GLN"].append(PenultimateRotamer( name = "mm100", observations = 22, percent = 0.030000, percent_alpha = 0.04, percent_beta = 0.01, percent_other = 0.02, attri = "minor", chi1_mode = None, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = -65, chi2_range = (-95, -35), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = 100, chi3_range = (0, 150), chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASP"].append(PenultimateRotamer( name = "p-10", observations = 203, percent = 0.100000, percent_alpha = 0.01, percent_beta = 0.02, percent_other = 0.13, attri = "major", chi1_mode = 61, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = -4, chi2_comm = -10, chi2_range = (-90, 0), chi2_hwhhfa = (13, -21), chi2_hwhhfc = 19, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASP"].append(PenultimateRotamer( name = "p30", observations = 194, percent = 0.090000, percent_alpha = 0.01, percent_beta = 0.05, percent_other = 0.12, attri = "major", chi1_mode = 65, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = 8, chi2_mode = 9, chi2_comm = 30, chi2_range = (0, 90), chi2_hwhhfa = None, chi2_hwhhfc = 14, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASP"].append(PenultimateRotamer( name = "t 0 ", observations = 438, percent = 0.210000, percent_alpha = 0.08, percent_beta = 0.44, percent_other = 0.2, attri = "major", chi1_mode = -176, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 12, chi2_mode = 1, chi2_comm = 0, chi2_range = (-50, 50), chi2_hwhhfa = (16, -16), chi2_hwhhfc = 30, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASP"].append(PenultimateRotamer( name = "t70", observations = 118, percent = 0.060000, percent_alpha = 0.11, percent_beta = 0.07, percent_other = 0.04, attri = "major", chi1_mode = -179, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 12, chi2_mode = 65, chi2_comm = 65, chi2_range = (50, 90), chi2_hwhhfa = (13, -13), chi2_hwhhfc = 18, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASP"].append(PenultimateRotamer( name = "m -20 ", observations = 1088, percent = 0.510000, percent_alpha = 0.77, percent_beta = 0.38, percent_other = 0.47, attri = "major", chi1_mode = -71, chi1_comm = -70, chi1_range = (-100, -40), chi1_hwhhfa = None, chi1_hwhhfc = 10, chi2_mode = -15, chi2_comm = -15, chi2_range = (-90, 20), chi2_hwhhfa = None, chi2_hwhhfc = 16, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "p-10", observations = 103, percent = 0.070000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.1, attri = "major", chi1_mode = 63, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (8, -3), chi1_hwhhfc = 8, chi2_mode = -13, chi2_comm = -10, chi2_range = (-90, 0), chi2_hwhhfa = (10, -4), chi2_hwhhfc = 9, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "p30", observations = 132, percent = 0.090000, percent_alpha = 0.0, percent_beta = 0.07, percent_other = 0.12, attri = "major", chi1_mode = 64, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (3, -3), chi1_hwhhfc = 6, chi2_mode = 34, chi2_comm = 30, chi2_range = (0, 90), chi2_hwhhfa = (5, -5), chi2_hwhhfc = 7, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "t-20", observations = 177, percent = 0.120000, percent_alpha = 0.05, percent_beta = 0.21, percent_other = 0.12, attri = "major", chi1_mode = -174, chi1_comm = -174, chi1_range = (155, -145), chi1_hwhhfa = (3, -3), chi1_hwhhfc = 5, chi2_mode = -20, chi2_comm = -20, chi2_range = (-120, 0), chi2_hwhhfa = (11, -26), chi2_hwhhfc = 21, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "t30", observations = 228, percent = 0.150000, percent_alpha = 0.13, percent_beta = 0.18, percent_other = 0.15, attri = "major", chi1_mode = -168, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (11, -11), chi1_hwhhfc = 14, chi2_mode = 31, chi2_comm = 30, chi2_range = (0, 80), chi2_hwhhfa = (23, -17), chi2_hwhhfc = 22, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "m-20", observations = 580, percent = 0.390000, percent_alpha = 0.65, percent_beta = 0.28, percent_other = 0.33, attri = "major", chi1_mode = -71, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = -23, chi2_comm = -20, chi2_range = (-60, 10), chi2_hwhhfa = (17, -17), chi2_hwhhfc = 20, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "m-80", observations = 118, percent = 0.080000, percent_alpha = 0.08, percent_beta = 0.09, percent_other = 0.08, attri = "major", chi1_mode = -71, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 9, chi2_mode = -76, chi2_comm = -75, chi2_range = (-100, -60), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 9, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ASN"].append(PenultimateRotamer( name = "m120", observations = 58, percent = 0.040000, percent_alpha = 0.03, percent_beta = 0.03, percent_other = 0.04, attri = "major", chi1_mode = -64, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 9, chi2_mode = 132, chi2_comm = 120, chi2_range = (60, 160), chi2_hwhhfa = (7, -24), chi2_hwhhfc = 18, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "pp", observations = 10, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.0, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 100, chi2_range = (70, 130), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "pt", observations = 216, percent = 0.130000, percent_alpha = 0.04, percent_beta = 0.13, percent_other = 0.22, attri = "major", chi1_mode = 61, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 171, chi2_comm = 170, chi2_range = (140, -160), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "tp", observations = 36, percent = 0.020000, percent_alpha = 0.02, percent_beta = 0.01, percent_other = 0.04, attri = "major", chi1_mode = -169, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 13, chi2_mode = 66, chi2_comm = 66, chi2_range = (35, 95), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 11, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "tt", observations = 127, percent = 0.080000, percent_alpha = 0.01, percent_beta = 0.08, percent_other = 0.14, attri = "major", chi1_mode = -174, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (13, -8), chi1_hwhhfc = 13, chi2_mode = 167, chi2_comm = 170, chi2_range = (135, -165), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 11, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "mp", observations = 19, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (2, -2), chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 100, chi2_range = (70, 130), chi2_hwhhfa = (2, -2), chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "mt", observations = 993, percent = 0.600000, percent_alpha = 0.81, percent_beta = 0.58, percent_other = 0.41, attri = "major", chi1_mode = -66, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = 169, chi2_comm = 170, chi2_range = (140, -160), chi2_hwhhfa = (8, -8), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["ILE"].append(PenultimateRotamer( name = "mm", observations = 242, percent = 0.150000, percent_alpha = 0.1, percent_beta = 0.16, percent_other = 0.17, attri = "major", chi1_mode = -57, chi1_comm = -57, chi1_range = (-85, -25), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = -59, chi2_comm = -59, chi2_range = (-90, -30), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LEU"].append(PenultimateRotamer( name = "pp", observations = 21, percent = 0.010000, percent_alpha = 0.0, percent_beta = 0.02, percent_other = 0.01, attri = "minor", chi1_mode = None, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = None, chi1_hwhhfc = None, chi2_mode = None, chi2_comm = 80, chi2_range = (50, 110), chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LEU"].append(PenultimateRotamer( name = "tp", observations = 750, percent = 0.290000, percent_alpha = 0.3, percent_beta = 0.36, percent_other = 0.23, attri = "major", chi1_mode = 177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = 63, chi2_comm = 65, chi2_range = (35, 95), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LEU"].append(PenultimateRotamer( name = "tt", observations = 49, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.03, percent_other = 0.01, attri = "major", chi1_mode = -172, chi1_comm = -172, chi1_range = (160, -140), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = 147, chi2_comm = 147, chi2_range = (120, 180), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 9, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LEU"].append(PenultimateRotamer( name = "mp", observations = 63, percent = 0.020000, percent_alpha = 0.01, percent_beta = 0.05, percent_other = 0.02, attri = "major", chi1_mode = -85, chi1_comm = -85, chi1_range = (-115, -55), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 11, chi2_mode = 66, chi2_comm = 65, chi2_range = (45, 105), chi2_hwhhfa = (8, -12), chi2_hwhhfc = 14, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["LEU"].append(PenultimateRotamer( name = "mt", observations = 1548, percent = 0.590000, percent_alpha = 0.62, percent_beta = 0.46, percent_other = 0.66, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 11, chi2_mode = 174, chi2_comm = 174, chi2_range = (150, -150), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 11, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "p-80", observations = 51, percent = 0.090000, percent_alpha = 0.0, percent_beta = 0.06, percent_other = 0.13, attri = "major", chi1_mode = 60, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = -75, chi2_comm = -75, chi2_range = (-120, -50), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 12, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "p80", observations = 26, percent = 0.040000, percent_alpha = 0.0, percent_beta = 0.04, percent_other = 0.06, attri = "major", chi1_mode = 61, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (13, -13), chi1_hwhhfc = 13, chi2_mode = 78, chi2_comm = 78, chi2_range = (50, 120), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "t-160", observations = 31, percent = 0.050000, percent_alpha = 0.05, percent_beta = 0.14, percent_other = 0.01, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 12, chi2_mode = -163, chi2_comm = -163, chi2_range = (150, -120), chi2_hwhhfa = (27, -9), chi2_hwhhfc = 20, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "t-80", observations = 64, percent = 0.110000, percent_alpha = 0.17, percent_beta = 0.09, percent_other = 0.09, attri = "major", chi1_mode = -173, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = -81, chi2_comm = -81, chi2_range = (-120, -50), chi2_hwhhfa = (12, -28), chi2_hwhhfc = 22, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "t60", observations = 94, percent = 0.160000, percent_alpha = 0.24, percent_beta = 0.17, percent_other = 0.12, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 13, chi2_mode = 62, chi2_comm = 62, chi2_range = (50, 120), chi2_hwhhfa = (25, -8), chi2_hwhhfc = 19, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "m-70", observations = 174, percent = 0.290000, percent_alpha = 0.26, percent_beta = 0.3, percent_other = 0.3, attri = "major", chi1_mode = -60, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 11, chi2_mode = -69, chi2_comm = -69, chi2_range = (-120, -30), chi2_hwhhfa = (20, -20), chi2_hwhhfc = 23, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "m170", observations = 44, percent = 0.070000, percent_alpha = 0.09, percent_beta = 0.03, percent_other = 0.09, attri = "major", chi1_mode = -63, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 10, chi2_mode = 165, chi2_comm = 165, chi2_range = (120, -160), chi2_hwhhfa = (8, -20), chi2_hwhhfc = 16, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["HIS"].append(PenultimateRotamer( name = "m80", observations = 78, percent = 0.130000, percent_alpha = 0.14, percent_beta = 0.1, percent_other = 0.14, attri = "major", chi1_mode = -66, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 11, chi2_mode = 83, chi2_comm = 83, chi2_range = (50, 120), chi2_hwhhfa = (21, -11), chi2_hwhhfc = 18, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "p-90", observations = 67, percent = 0.110000, percent_alpha = 0.02, percent_beta = 0.13, percent_other = 0.14, attri = "major", chi1_mode = 58, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (12, -7), chi1_hwhhfc = 12, chi2_mode = -87, chi2_comm = -90, chi2_range = (-130, -60), chi2_hwhhfa = (7, -7), chi2_hwhhfc = 10, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "p90", observations = 34, percent = 0.060000, percent_alpha = 0.01, percent_beta = 0.09, percent_other = 0.06, attri = "major", chi1_mode = 60, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (13, -7), chi1_hwhhfc = 12, chi2_mode = 92, chi2_comm = 90, chi2_range = (60, 130), chi2_hwhhfa = (6, -6), chi2_hwhhfc = 8, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "t-105", observations = 100, percent = 0.160000, percent_alpha = 0.27, percent_beta = 0.1, percent_other = 0.14, attri = "major", chi1_mode = 178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (16, -12), chi1_hwhhfc = 16, chi2_mode = -105, chi2_comm = -105, chi2_range = (-130, -60), chi2_hwhhfa = (12, -12), chi2_hwhhfc = 14, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "t90", observations = 109, percent = 0.180000, percent_alpha = 0.28, percent_beta = 0.14, percent_other = 0.15, attri = "major", chi1_mode = -178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = 88, chi2_comm = 90, chi2_range = (0, 100), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 11, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "m-90", observations = 31, percent = 0.050000, percent_alpha = 0.0, percent_beta = 0.07, percent_other = 0.07, attri = "major", chi1_mode = -70, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = -87, chi2_comm = -90, chi2_range = (-130, -60), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 12, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "m0", observations = 48, percent = 0.080000, percent_alpha = 0.15, percent_beta = 0.02, percent_other = 0.08, attri = "major", chi1_mode = -66, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 9, chi2_mode = -4, chi2_comm = -4, chi2_range = (-40, 20), chi2_hwhhfa = (9, -26), chi2_hwhhfc = 20, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TRP"].append(PenultimateRotamer( name = "m95", observations = 195, percent = 0.320000, percent_alpha = 0.22, percent_beta = 0.43, percent_other = 0.29, attri = "major", chi1_mode = -69, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 11, chi2_mode = 95, chi2_comm = 95, chi2_range = (60, 130), chi2_hwhhfa = (16, -16), chi2_hwhhfc = 19, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TYR"].append(PenultimateRotamer( name = "p90", observations = 182, percent = 0.130000, percent_alpha = 0.01, percent_beta = 0.21, percent_other = 0.12, attri = "major", chi1_mode = 63, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 13, chi2_mode = 89, chi2_comm = 90, chi2_range = (60, 90), chi2_hwhhfa = (10, -10), chi2_hwhhfc = 13, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TYR"].append(PenultimateRotamer( name = "t80", observations = 486, percent = 0.340000, percent_alpha = 0.55, percent_beta = 0.25, percent_other = 0.3, attri = "major", chi1_mode = 176, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 11, chi2_mode = 77, chi2_comm = 80, chi2_range = (20, 90), chi2_hwhhfa = (12, -12), chi2_hwhhfc = 14, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TYR"].append(PenultimateRotamer( name = "m-85", observations = 618, percent = 0.430000, percent_alpha = 0.26, percent_beta = 0.5, percent_other = 0.45, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 11, chi2_mode = -87, chi2_comm = -85, chi2_range = (50, 90), chi2_hwhhfa = (16, -16), chi2_hwhhfc = 21, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["TYR"].append(PenultimateRotamer( name = "m -30 ", observations = 124, percent = 0.090000, percent_alpha = 0.15, percent_beta = 0.04, percent_other = 0.09, attri = "major", chi1_mode = -64, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 11, chi2_mode = -42, chi2_comm = -30, chi2_range = (-50, 0), chi2_hwhhfa = (31, -6), chi2_hwhhfc = 18, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PHE"].append(PenultimateRotamer( name = "p90", observations = 202, percent = 0.130000, percent_alpha = 0.01, percent_beta = 0.24, percent_other = 0.11, attri = "major", chi1_mode = 59, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 11, chi2_mode = 88, chi2_comm = 90, chi2_range = (60, 90), chi2_hwhhfa = (9, -9), chi2_hwhhfc = 11, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PHE"].append(PenultimateRotamer( name = "t80", observations = 522, percent = 0.330000, percent_alpha = 0.57, percent_beta = 0.18, percent_other = 0.29, attri = "major", chi1_mode = 177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (11, -11), chi1_hwhhfc = 13, chi2_mode = 80, chi2_comm = 80, chi2_range = (20, 90), chi2_hwhhfa = (11, -18), chi2_hwhhfc = 17, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PHE"].append(PenultimateRotamer( name = "m-85", observations = 697, percent = 0.440000, percent_alpha = 0.29, percent_beta = 0.51, percent_other = 0.47, attri = "major", chi1_mode = -64, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 12, chi2_mode = -83, chi2_comm = -85, chi2_range = (50, 90), chi2_hwhhfa = (14, -14), chi2_hwhhfc = 17, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PHE"].append(PenultimateRotamer( name = "m -30 ", observations = 149, percent = 0.090000, percent_alpha = 0.12, percent_beta = 0.05, percent_other = 0.11, attri = "major", chi1_mode = -64, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 9, chi2_mode = -19, chi2_comm = -30, chi2_range = (-50, 0), chi2_hwhhfa = (14, -21), chi2_hwhhfc = 20, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PRO"].append(PenultimateRotamer( name = "Cg_endo", observations = 379, percent = 0.440000, percent_alpha = 0.23, percent_beta = 0.54, percent_other = 0.43, attri = "major", chi1_mode = 30, chi1_comm = 30, chi1_range = (15, 60), chi1_hwhhfa = (5, -5), chi1_hwhhfc = 7, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PRO"].append(PenultimateRotamer( name = "Cg_exo", observations = 372, percent = 0.430000, percent_alpha = 0.68, percent_beta = 0.28, percent_other = 0.44, attri = "major", chi1_mode = -29, chi1_comm = -30, chi1_range = (-60, -15), chi1_hwhhfa = (5, -5), chi1_hwhhfc = 6, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["PRO"].append(PenultimateRotamer( name = "cis_Cg_endo", observations = 56, percent = 0.060000, percent_alpha = 0.0, percent_beta = 0.01, percent_other = 0.07, attri = "major", chi1_mode = 31, chi1_comm = 30, chi1_range = (15, 60), chi1_hwhhfa = (4, -4), chi1_hwhhfc = 5, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["THR"].append(PenultimateRotamer( name = "p", observations = 1200, percent = 0.490000, percent_alpha = 0.25, percent_beta = 0.31, percent_other = 0.65, attri = "major", chi1_mode = 59, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (9, -9), chi1_hwhhfc = 10, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["THR"].append(PenultimateRotamer( name = "t", observations = 169, percent = 0.070000, percent_alpha = 0.0, percent_beta = 0.13, percent_other = 0.06, attri = "major", chi1_mode = -171, chi1_comm = -175, chi1_range = (155, -145), chi1_hwhhfa = (10, -10), chi1_hwhhfc = 6, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["THR"].append(PenultimateRotamer( name = "m", observations = 1062, percent = 0.430000, percent_alpha = 0.74, percent_beta = 0.55, percent_other = 0.29, attri = "major", chi1_mode = -61, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 7, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["VAL"].append(PenultimateRotamer( name = "p", observations = 169, percent = 0.060000, percent_alpha = 0.02, percent_beta = 0.08, percent_other = 0.08, attri = "major", chi1_mode = 63, chi1_comm = 63, chi1_range = (35, 95), chi1_hwhhfa = (8, -8), chi1_hwhhfc = 8, chi2_mode = None, chi2_comm = -177, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["VAL"].append(PenultimateRotamer( name = "t", observations = 1931, percent = 0.730000, percent_alpha = 0.9, percent_beta = 0.72, percent_other = 0.63, attri = "major", chi1_mode = 175, chi1_comm = 175, chi1_range = (145, -155), chi1_hwhhfa = (4, -4), chi1_hwhhfc = 8, chi2_mode = None, chi2_comm = -65, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["VAL"].append(PenultimateRotamer( name = "m", observations = 526, percent = 0.200000, percent_alpha = 0.07, percent_beta = 0.2, percent_other = 0.28, attri = "major", chi1_mode = -64, chi1_comm = -60, chi1_range = (-90, -30), chi1_hwhhfa = (5, -5), chi1_hwhhfc = 7, chi2_mode = None, chi2_comm = 60, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["SER"].append(PenultimateRotamer( name = "p", observations = 1201, percent = 0.480000, percent_alpha = 0.33, percent_beta = 0.36, percent_other = 0.55, attri = "major", chi1_mode = 64, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 10, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["SER"].append(PenultimateRotamer( name = "t", observations = 541, percent = 0.220000, percent_alpha = 0.22, percent_beta = 0.34, percent_other = 0.18, attri = "major", chi1_mode = 178, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (7, -7), chi1_hwhhfc = 11, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["SER"].append(PenultimateRotamer( name = "m", observations = 714, percent = 0.290000, percent_alpha = 0.44, percent_beta = 0.29, percent_other = 0.25, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (6, -6), chi1_hwhhfc = 9, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["CYS"].append(PenultimateRotamer( name = "p", observations = 64, percent = 0.230000, percent_alpha = 0.05, percent_beta = 0.23, percent_other = 0.34, attri = "major", chi1_mode = 55, chi1_comm = 62, chi1_range = (30, 90), chi1_hwhhfa = (22, -3), chi1_hwhhfc = 14, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["CYS"].append(PenultimateRotamer( name = "t", observations = 74, percent = 0.260000, percent_alpha = 0.2, percent_beta = 0.45, percent_other = 0.21, attri = "major", chi1_mode = -177, chi1_comm = -177, chi1_range = (155, -145), chi1_hwhhfa = (12, -5), chi1_hwhhfc = 10, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["CYS"].append(PenultimateRotamer( name = "m", observations = 142, percent = 0.500000, percent_alpha = 0.75, percent_beta = 0.32, percent_other = 0.43, attri = "major", chi1_mode = -65, chi1_comm = -65, chi1_range = (-95, -35), chi1_hwhhfa = (15, -5), chi1_hwhhfc = 11, chi2_mode = None, chi2_comm = None, chi2_range = None, chi2_hwhhfa = None, chi2_hwhhfc = None, chi3_mode = None, chi3_comm = None, chi3_range = None, chi3_hwhhfa = None, chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "mmm", observations = 70, percent = 0.360000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = -61, chi1_comm = None, chi1_range = (-95, -30), chi1_hwhhfa = (11, -11), chi1_hwhhfc = None, chi2_mode = -81, chi2_comm = None, chi2_range = (-110, -50), chi2_hwhhfa = (9, -9), chi2_hwhhfc = None, chi3_mode = -75, chi3_comm = None, chi3_range = (-120, -40), chi3_hwhhfa = (16, -16), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "ppp", observations = 15, percent = 0.080000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = 63, chi1_comm = None, chi1_range = (30, 90), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 85, chi2_comm = None, chi2_range = (55, 115), chi2_hwhhfa = (14, -9), chi2_hwhhfc = None, chi3_mode = 85, chi3_comm = None, chi3_range = (60, 115), chi3_hwhhfa = (11, -11), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "mpp", observations = 33, percent = 0.170000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = -65, chi1_comm = None, chi1_range = (-100, -35), chi1_hwhhfa = (12, -12), chi1_hwhhfc = None, chi2_mode = 100, chi2_comm = None, chi2_range = (70, 130), chi2_hwhhfa = (9, -9), chi2_hwhhfc = None, chi3_mode = 85, chi3_comm = None, chi3_range = (50, 115), chi3_hwhhfa = (14, -14), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "pmm", observations = 6, percent = 0.030000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "minor", chi1_mode = 90, chi1_comm = None, chi1_range = (60, 120), chi1_hwhhfa = (10, -18), chi1_hwhhfc = None, chi2_mode = -91, chi2_comm = None, chi2_range = (-120, -60), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -64, chi3_comm = None, chi3_range = (-95, -35), chi3_hwhhfa = (15, -15), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "mpm", observations = 11, percent = 0.060000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = -86, chi1_comm = None, chi1_range = (-120, -40), chi1_hwhhfa = (11, -11), chi1_hwhhfc = None, chi2_mode = 102, chi2_comm = None, chi2_range = (70, 130), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -102, chi3_comm = None, chi3_range = (-160, -90), chi3_hwhhfa = (9, -9), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "mmt", observations = 19, percent = 0.100000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = -92, chi1_comm = None, chi1_range = (-120, -30), chi1_hwhhfa = (15, -10), chi1_hwhhfc = None, chi2_mode = -90, chi2_comm = None, chi2_range = (-120, -60), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -149, chi3_comm = None, chi3_range = (150, -120), chi3_hwhhfa = (12, -12), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "ppt", observations = 16, percent = 0.080000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "major", chi1_mode = 52, chi1_comm = None, chi1_range = (30, 95), chi1_hwhhfa = (10, -10), chi1_hwhhfc = None, chi2_mode = 82, chi2_comm = None, chi2_range = (50, 110), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = 180, chi3_comm = None, chi3_range = (150, -120), chi3_hwhhfa = (9, -9), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "mpt", observations = 5, percent = 0.030000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "minor", chi1_mode = -68, chi1_comm = None, chi1_range = (-100, -40), chi1_hwhhfa = (13, -8), chi1_hwhhfc = None, chi2_mode = 96, chi2_comm = None, chi2_range = (65, 125), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = 147, chi3_comm = None, chi3_range = (115, 175), chi3_hwhhfa = (14, -14), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "tmt", observations = 6, percent = 0.030000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "minor", chi1_mode = 172, chi1_comm = None, chi1_range = (140, -160), chi1_hwhhfa = (9, -9), chi1_hwhhfc = None, chi2_mode = -83, chi2_comm = None, chi2_range = (-115, -55), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = -168, chi3_comm = None, chi3_range = (160, -140), chi3_hwhhfa = (11, -11), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) PenultimateRotamerMap["DIS"].append(PenultimateRotamer( name = "tpt", observations = 1, percent = 0.010000, percent_alpha = None, percent_beta = None, percent_other = None, attri = "minor", chi1_mode = 122, chi1_comm = None, chi1_range = (95, 150), chi1_hwhhfa = (8, -8), chi1_hwhhfc = None, chi2_mode = 87, chi2_comm = None, chi2_range = (55, 155), chi2_hwhhfa = (8, -8), chi2_hwhhfc = None, chi3_mode = 163, chi3_comm = None, chi3_range = (130, -170), chi3_hwhhfa = (8, -8), chi3_hwhhfc = None, chi4_mode = None, chi4_comm = None, chi4_range = None, chi4_hwhhfa = None, chi4_hwhhfc = None)) ### if __name__ == "__main__": for (res_name, rot_list) in PenultimateRotamerMap.items(): print res_name for rot in rot_list: print " ",rot ###