A0A096NKL0_PAPAN Loading...

Shisa like 1

AlphaFold DB , UniProt , Accession A0A096NKL0, Species PAPAN (Papio anubis, Olive baboon), Gene SHISAL1, Length 199 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.6Very low58.6Low238 Ų238102.9 Ų102.9100%1.17258%0.576SS**  073.70-71.8170.2148.900109.4
2T51.2Low59.8Low105 Ų105102.2 Ų102.264%0.64457%0.569SS**  trans-126.1-6.7178.742.60000112.2
3S53.5Low60.8Low77 Ų7798 Ų9854%0.53856%0.556SS.*Hα-helixtrans-74.4-29-170.8-171.20000114.1Q7S3-Q7 WeakPolarHBondContact O-CB 3.42Å; S3-Q7 WeakPolarHBondContact O-CG 3.48Å; S3-Q7 PolarHBondContact O-N 2.88Å; S3-Q7 VanDerWaalsContact O-N 3.13Å; S3-Q7 PolarHBondContact O-OE1 3.45Å
4C53Low61.9Low101 Ų10197.1 Ų97.168%0.68255%0.553SS**Hα-helixtrans-75-38.6-172.7-152.80000112.4S8C4-S8 PolarHBondContact O-N 3.11Å
5G54.6Low62.8Low9 Ų996.9 Ų96.99%0.09355%0.549CS..Hα-helixtrans-75.7-33.8176.900000113.7S8 L9G5-S8 PolarHBondContact O-OG 3.01Å; G5-L9 WeakPolarHBondContact O-CG 3.39Å; G5-L9 PolarHBondContact O-N 3.36Å
6Q57.4Low63.3Low125 Ų12597.8 Ų97.858%0.58455%0.545SS*.Hα-helixtrans-66.9-39.9173.8-160.396900111.1N10Q6-N10 WeakPolarHBondContact O-CB 3.38Å; Q6-N10 PolarHBondContact O-N 3.09Å; Q6-N10 PolarHBondContact O-ND2 3.17Å
7Q61.6Low63.7Low119 Ų11996.2 Ų96.256%0.55654%0.543SS*.Hα-helixtrans-64.9-43.3176.3-88.2176.7-4100112.3S3 L9 N10 V11S3-Q7 WeakPolarHBondContact O-CB 3.42Å; S3-Q7 WeakPolarHBondContact O-CG 3.48Å; S3-Q7 PolarHBondContact O-N 2.88Å; S3-Q7 VanDerWaalsContact O-N 3.13Å; S3-Q7 PolarHBondContact O-OE1 3.45Å; Q7-L9 PolarHBondContact O-N 3.1Å; Q7-N10 PolarHBondContact O-N 3.19Å; Q7-V11 WeakPolarHBondContact O-CB 3.01Å; Q7-V11 VanDerWaalsContact O-CG2 3.24Å; Q7-V11 WeakPolarHBondContact O-CG2 3.47Å; Q7-V11 PolarHBondContact O-N 2.99Å
8S64.4Low63.8Low63 Ų6397 Ų9744%0.44155%0.545SS..Hα-helixtrans-64.7-40.1178.964.70000112.2C4 G5 V11 L12C4-S8 PolarHBondContact O-N 3.11Å; G5-S8 PolarHBondContact O-OG 3.01Å; S8-V11 PolarHBondContact O-N 3.41Å; S8-L12 WeakPolarHBondContact O-CB 3.41Å; S8-L12 PolarHBondContact O-N 3.19Å
9L67.4Low63.8Low114 Ų11497.3 Ų97.360%0.59754%0.544SS*.Hα-helixtrans-65.9-40.8175.1-73.1172.1000112.5G5 Q7 L12 A13G5-L9 WeakPolarHBondContact O-CG 3.39Å; G5-L9 PolarHBondContact O-N 3.36Å; Q7-L9 PolarHBondContact O-N 3.1Å; L9-L12 PolarHBondContact O-N 3.43Å; L9-A13 WeakPolarHBondContact O-CB 3.14Å; L9-A13 PolarHBondContact O-N 3.38Å
10N68.3Low63.6Low92 Ų9297.7 Ų97.749%0.49254%0.54SS..Hα-helixtrans-65.2-41.1175.9-74.4-22.9000111.8Q6 Q7 L12 A13 V14Q6-N10 WeakPolarHBondContact O-CB 3.38Å; Q6-N10 PolarHBondContact O-N 3.09Å; Q6-N10 PolarHBondContact O-ND2 3.17Å; Q7-N10 PolarHBondContact O-N 3.19Å; N10-L12 VanDerWaalsContact C-N 3.35Å; N10-A13 PolarHBondContact O-N 3.14Å; N10-V14 WeakPolarHBondContact O-CB 3.37Å; N10-V14 VanDerWaalsContact O-CG2 3.23Å; N10-V14 WeakPolarHBondContact O-CG2 3.21Å; N10-V14 PolarHBondContact O-N 3.42Å
11V73.3Confident63.1Low89 Ų8996.6 Ų96.654%0.53954%0.539SS..Hα-helixtrans-63.8-42.4176170.20000110.9Q7 S8 V14 L15Q7-V11 WeakPolarHBondContact O-CB 3.01Å; Q7-V11 VanDerWaalsContact O-CG2 3.24Å; Q7-V11 WeakPolarHBondContact O-CG2 3.47Å; Q7-V11 PolarHBondContact O-N 2.99Å; S8-V11 PolarHBondContact O-N 3.41Å; V11-V14 PolarHBondContact O-N 2.9Å; V11-L15 HydrophobicContact CG1-CD1 4.03Å; V11-L15 WeakPolarHBondContact O-CB 3.37Å; V11-L15 PolarHBondContact O-N 3.48Å
12L73.4Confident63.8Low94 Ų9488.1 Ų88.149%0.49251%0.507SS..Hα-helixtrans-62.9-45.2176.3-157.686.4000111.2S8 L9 N10 V14 L15 F16S8-L12 WeakPolarHBondContact O-CB 3.41Å; S8-L12 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 3.43Å; N10-L12 VanDerWaalsContact C-N 3.35Å; L12-V14 PolarHBondContact O-N 3.48Å; L12-L15 PolarHBondContact O-N 3.41Å; L12-F16 HydrophobicContact CD1-CE2 4.34Å; L12-F16 HydrophobicContact CD2-CD2 4.26Å; L12-F16 HydrophobicContact CD2-CE2 3.68Å; L12-F16 HydrophobicContact CG-CD2 3.93Å; L12-F16 HydrophobicContact CG-CE2 3.6Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.37Å
13A73.3Confident64Low48 Ų4888.4 Ų88.440%0.39751%0.508SS..Hα-helixtrans-61.1-44.1176.900000111.9L9 N10 F16 S17L9-A13 WeakPolarHBondContact O-CB 3.14Å; L9-A13 PolarHBondContact O-N 3.38Å; N10-A13 PolarHBondContact O-N 3.14Å; A13-F16 PolarHBondContact O-N 3.3Å; A13-S17 PolarHBondContact O-N 3.35Å; A13-S17 PolarHBondContact O-OG 3.04Å; A13-S17 VanDerWaalsContact O-OG 3.07Å
14V75Confident63.9Low85 Ų8589.9 Ų89.952%0.51551%0.51SS..Hα-helixtrans-62.9-44.4176.1170.40000111.1N10 V11 L12 F16 S17 L18N10-V14 WeakPolarHBondContact O-CB 3.37Å; N10-V14 VanDerWaalsContact O-CG2 3.23Å; N10-V14 WeakPolarHBondContact O-CG2 3.21Å; N10-V14 PolarHBondContact O-N 3.42Å; V11-V14 PolarHBondContact O-N 2.9Å; L12-V14 PolarHBondContact O-N 3.48Å; V14-F16 PolarHBondContact O-N 3.23Å; V14-S17 PolarHBondContact O-N 2.99Å; V14-L18 HydrophobicContact CG1-CD1 3.91Å; V14-L18 HydrophobicContact CG1-CG 4.37Å; V14-L18 WeakPolarHBondContact O-CB 3.38Å; V14-L18 VanDerWaalsContact O-CG 3.27Å; V14-L18 WeakPolarHBondContact O-CG 3.5Å; V14-L18 PolarHBondContact O-N 2.84Å
15L76.4Confident63.8Low94 Ų9488.4 Ų88.449%0.49250%0.501SS..Hα-helixtrans-58.9-46.5175.2-91.6157.4000111.8V11 L12 L18 L19V11-L15 HydrophobicContact CG1-CD1 4.03Å; V11-L15 WeakPolarHBondContact O-CB 3.37Å; V11-L15 PolarHBondContact O-N 3.48Å; L12-L15 PolarHBondContact O-N 3.41Å; L15-L18 PolarHBondContact O-N 2.72Å; L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 VanDerWaalsContact O-CG 3.27Å; L15-L19 WeakPolarHBondContact O-CG 3.48Å; L15-L19 PolarHBondContact O-N 3.26Å
16F70.1Confident63.7Low111 Ų11190.7 Ų90.749%0.48752%0.518SS..Hα-helixtrans-60.9-47.8175.5-80.4-62.8000111.4L12 A13 V14 L18 L19 F20L12-F16 HydrophobicContact CD1-CE2 4.34Å; L12-F16 HydrophobicContact CD2-CD2 4.26Å; L12-F16 HydrophobicContact CD2-CE2 3.68Å; L12-F16 HydrophobicContact CG-CD2 3.93Å; L12-F16 HydrophobicContact CG-CE2 3.6Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.37Å; A13-F16 PolarHBondContact O-N 3.3Å; V14-F16 PolarHBondContact O-N 3.23Å; F16-L18 VanDerWaalsContact C-N 3.31Å; F16-L18 PolarHBondContact O-N 3.24Å; F16-L19 PolarHBondContact O-N 2.83Å; F16-F20 WeakPolarHBondContact O-CD2 3.32Å; F16-F20 PolarHBondContact O-N 2.81Å
17S69.8Low63.6Low72 Ų7287.1 Ų87.150%0.50350%0.501SS..Hα-helixtrans-58.4-40177.4-63.30000113.1A13 V14 S21A13-S17 PolarHBondContact O-N 3.35Å; A13-S17 PolarHBondContact O-OG 3.04Å; A13-S17 VanDerWaalsContact O-OG 3.07Å; V14-S17 PolarHBondContact O-N 2.99Å; S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 3.37Å; S17-S21 VanDerWaalsContact O-N 3.08Å; S17-S21 PolarHBondContact O-OG 2.98Å
18L66.6Low63.5Low110 Ų11086 Ų8658%0.57650%0.495SS*.Hα-helixtrans-67-42176.2-71.1170.9000111.9V14 L15 F16 S21 A22V14-L18 HydrophobicContact CG1-CD1 3.91Å; V14-L18 HydrophobicContact CG1-CG 4.37Å; V14-L18 WeakPolarHBondContact O-CB 3.38Å; V14-L18 VanDerWaalsContact O-CG 3.27Å; V14-L18 WeakPolarHBondContact O-CG 3.5Å; V14-L18 PolarHBondContact O-N 2.84Å; L15-L18 PolarHBondContact O-N 2.72Å; F16-L18 VanDerWaalsContact C-N 3.31Å; F16-L18 PolarHBondContact O-N 3.24Å; L18-S21 PolarHBondContact O-N 3.42Å; L18-A22 PolarHBondContact O-N 3.13Å
19L63.4Low63.5Low103 Ų10389.3 Ų89.354%0.53950%0.498SS..Hα-helixtrans-65.6-43.9177.6-72.1168.4000111.9L15 F16 S21 A22 V23L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 VanDerWaalsContact O-CG 3.27Å; L15-L19 WeakPolarHBondContact O-CG 3.48Å; L15-L19 PolarHBondContact O-N 3.26Å; F16-L19 PolarHBondContact O-N 2.83Å; L19-S21 VanDerWaalsContact C-N 3.3Å; L19-S21 PolarHBondContact O-N 3.2Å; L19-A22 PolarHBondContact O-N 2.97Å; L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 2.93Å; L19-V23 VanDerWaalsContact O-N 3.09Å
20F58.9Low63.6Low105 Ų10586 Ų8646%0.46148%0.482SS..Hα-helixtrans-59.2-42174-85.8-74.6000111.7F16 V23 L24 L99F16-F20 WeakPolarHBondContact O-CD2 3.32Å; F16-F20 PolarHBondContact O-N 2.81Å; F20-V23 PolarHBondContact O-N 3.43Å; F20-L24 WeakPolarHBondContact O-CD1 3.24Å; F20-L24 WeakPolarHBondContact O-CG 3.4Å; F20-L24 PolarHBondContact O-N 2.92Å; F20-L99 HydrophobicContact CE1-CD1 4.42Å
21S53.4Low64Low74 Ų7481.6 Ų81.652%0.51746%0.459SS..Hα-helixtrans-65.1-40.3178.7-56.10000112.5S17 L18 L19 S25S17-S21 WeakPolarHBondContact O-CB 3.44Å; S17-S21 PolarHBondContact O-N 3.37Å; S17-S21 VanDerWaalsContact O-N 3.08Å; S17-S21 PolarHBondContact O-OG 2.98Å; L18-S21 PolarHBondContact O-N 3.42Å; L19-S21 VanDerWaalsContact C-N 3.3Å; L19-S21 PolarHBondContact O-N 3.2Å; S21-S25 PolarHBondContact O-N 3.49Å
22A55.3Low64Low61 Ų6181.9 Ų81.950%0.50445%0.454SS..Hα-helixtrans-67-39.8178.400000112.6L18 L19 S25 A26L18-A22 PolarHBondContact O-N 3.13Å; L19-A22 PolarHBondContact O-N 2.97Å; A22-S25 PolarHBondContact O-N 3.38Å; A22-A26 PolarHBondContact O-N 3.4Å
23V53.9Low64.2Low110 Ų11080.5 Ų80.567%0.66745%0.451SS*.Hα-helixtrans-66.4-40.7178.6172.70000111.4L19 F20 S25L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 2.93Å; L19-V23 VanDerWaalsContact O-N 3.09Å; F20-V23 PolarHBondContact O-N 3.43Å; V23-S25 PolarHBondContact O-N 3.18Å
24L51.8Low64.2Low109 Ų10979.7 Ų79.757%0.57144%0.438SS*.Hα-helixtrans-66-36176.7-74.5158.7000112.6F20F20-L24 WeakPolarHBondContact O-CD1 3.24Å; F20-L24 WeakPolarHBondContact O-CG 3.4Å; F20-L24 PolarHBondContact O-N 2.92Å
25S51.2Low64.2Low70 Ų7079.9 Ų79.949%0.4944%0.439SS..Hα-helixtrans-70-32.8-179.4-1800000113.4S21 A22 V23 H27S21-S25 PolarHBondContact O-N 3.49Å; A22-S25 PolarHBondContact O-N 3.38Å; V23-S25 PolarHBondContact O-N 3.18Å; S25-H27 PolarHBondContact O-N 2.98Å
26A52.8Low64.2Low56 Ų5675.7 Ų75.746%0.46342%0.417SS..Hα-helixtrans-64.3-26.1-177.900000113.1A22 F28 R29A22-A26 PolarHBondContact O-N 3.4Å; A26-F28 VanDerWaalsContact C-N 3.3Å; A26-F28 PolarHBondContact O-N 3.34Å; A26-R29 PolarHBondContact O-N 2.99Å
27H55.1Low64.5Low50 Ų5076.7 Ų76.723%0.23142%0.423CS..G310 helixtrans-70.3-22.3-173.1-156-59000113.9S25 E32 Y91S25-H27 PolarHBondContact O-N 2.98Å; H27-E32 IonicContact CE1-OE1 3.81Å; H27-E32 PolarHBondContact CE1-OE1 2.87Å; H27-E32 IonicContact CE1-OE2 3.58Å; H27-E32 IonicContact NE2-OE1 3.39Å; H27-Y91 WeakPolarHBondContact CB-OH 3.17Å; H27-Y91 PolarHBondContact CE1-OH 3.35Å; H27-Y91 VanDerWaalsContact CE1-OH 3.25Å; H27-Y91 AromaticContact ND1-CZ 3.89Å; H27-Y91 PolarHBondContact ND1-OH 3.48Å
28F58.8Low65Low95 Ų9579.8 Ų79.842%0.41743%0.428SS..G310 helixtrans-82.9-14.5179-67.7-77.8000114A26 V30 C59 Y91A26-F28 VanDerWaalsContact C-N 3.3Å; A26-F28 PolarHBondContact O-N 3.34Å; F28-V30 VanDerWaalsContact C-N 3.33Å; F28-C59 PolarHBondContact O-N 3.3Å; F28-Y91 HydrophobicContact CZ-CE1 4.41Å
29R65.4Low65.5Low133 Ų13377.5 Ų77.550%0.50243%0.43SS..G310 helixtrans-89.6-2.4176.8-58.6-162.9177.8170.70.6113.1A26 C47A26-R29 PolarHBondContact O-N 2.99Å; R29-C47 PolarHBondContact O-N 3.47Å
30V69.6Low66.4Low45 Ų4579 Ų7927%0.27343%0.429SS..EExtended strand (participates in β ladder)trans-118.9117.6-178.2-165.30000109F28 E32 H46F28-V30 VanDerWaalsContact C-N 3.33Å; V30-E32 PolarHBondContact O-N 2.86Å; V30-H46 WeakPolarHBondContact CG2-CE1 3.25Å; V30-H46 WeakPolarHBondContact CG2-ND1 3.3Å
31C75.8Confident67.3Low0 Ų080.4 Ų80.40%043%0.432CS..EExtended strand (participates in β ladder)trans-78.2110.3166.3-70.50000108.8G44 F45 C59 K68C31-G44 CarbonylContact O-C 3.56Å; C31-G44 WeakPolarHBondContact O-CA 3.38Å; C31-F45 HydrophobicContact CB-CD1 4.1Å; C31-F45 HydrophobicContact CB-CD2 4.11Å; C31-F45 HydrophobicContact CB-CE1 3.87Å; C31-F45 HydrophobicContact CB-CE2 3.88Å; C31-F45 HydrophobicContact CB-CG 4.22Å; C31-F45 HydrophobicContact CB-CZ 3.75Å; C31-F45 WeakPolarHBondContact CB-O 3.2Å; C31-F45 PolarHBondContact N-O 2.91Å; C31-F45 PolarHBondContact O-N 3.41Å; C31-F45 WeakPolarHBondContact SG-CE2 3.31Å; C31-F45 WeakPolarHBondContact SG-CZ 3.48Å; C31-C59 WeakPolarHBondContact CA-SG 3.26Å; C31-C59 HydrophobicContact CB-CB 4.09Å; C31-C59 WeakPolarHBondContact CB-SG 3.37Å; C31-C59 VanDerWaalsContact SG-CA 3.59Å; C31-C59 WeakPolarHBondContact SG-CB 3.18Å; C31-C59 CovalentContact SG-SG 2.02Å; C31-C59 PolarHBondContact SG-SG 2.79Å; C31-K68 HydrophobicContact CB-CB 4.48Å; C31-K68 HydrophobicContact CB-CD 4.31Å
32E74.2Confident68.6Low95 Ų9579.4 Ų79.444%0.44442%0.419SS..  trans-61.4149.2174.3-67-17912800112H27 V30 K68H27-E32 IonicContact CE1-OE1 3.81Å; H27-E32 PolarHBondContact CE1-OE1 2.87Å; H27-E32 IonicContact CE1-OE2 3.58Å; H27-E32 IonicContact NE2-OE1 3.39Å; V30-E32 PolarHBondContact O-N 2.86Å; E32-K68 PolarHBondContact O-NZ 3.32Å
33P77.6Confident69.8Low65 Ų6584.4 Ų84.442%0.42243%0.43SS..  trans-56.2146.317424.5-33.4000111.3Y41 H42P33-Y41 HydrophobicContact CB-CE1 4.48Å; P33-Y41 HydrophobicContact CB-CE2 4Å; P33-Y41 WeakPolarHBondContact CB-OH 3.48Å; P33-H42 VanDerWaalsContact CA-O 3.24Å; P33-H42 WeakPolarHBondContact CA-O 3.27Å; P33-H42 WeakPolarHBondContact CB-O 3.46Å
34Y72.6Confident71Confident30 Ų3081 Ų8112%0.11842%0.416CS..EExtended strand (participates in β ladder)trans-144.6155.6-178.463.7-84.9000111.1H42 V66 F67 K68Y34-H42 HydrophobicContact CD1-CB 4.08Å; Y34-H42 HydrophobicContact CD2-CB 4.2Å; Y34-H42 HydrophobicContact CE1-CB 3.74Å; Y34-H42 HydrophobicContact CE2-CB 3.87Å; Y34-H42 AromaticContact CE2-CD2 3.7Å; Y34-H42 AromaticContact CE2-CG 3.8Å; Y34-H42 HydrophobicContact CG-CB 4.31Å; Y34-H42 AromaticContact CZ-CG 3.8Å; Y34-H42 PolarHBondContact N-O 3.4Å; Y34-H42 VanDerWaalsContact N-O 3.11Å; Y34-H42 WeakPolarHBondContact O-CB 3.4Å; Y34-H42 PolarHBondContact O-N 3.45Å; Y34-V66 HydrophobicContact CD2-CG1 3.89Å; Y34-V66 WeakPolarHBondContact CD2-O 3.42Å; Y34-V66 HydrophobicContact CE2-CG1 4.2Å; Y34-V66 WeakPolarHBondContact CE2-O 3.28Å; Y34-F67 HydrophobicContact CE2-CD1 4.45Å; Y34-F67 WeakPolarHBondContact OH-CA 3.41Å; Y34-F67 WeakPolarHBondContact OH-CD1 3.32Å; Y34-K68 HydrophobicContact CD1-CB 4.35Å; Y34-K68 HydrophobicContact CD1-CD 3.57Å; Y34-K68 HydrophobicContact CD1-CG 3.78Å; Y34-K68 HydrophobicContact CE1-CB 3.8Å; Y34-K68 HydrophobicContact CE1-CD 3.92Å; Y34-K68 HydrophobicContact CE1-CG 3.69Å; Y34-K68 HydrophobicContact CG-CD 4.29Å; Y34-K68 HydrophobicContact CG-CG 4.4Å; Y34-K68 PolarHBondContact OH-N 3.31Å
35T75.8Confident72.4Confident89 Ų8977 Ų7755%0.54639%0.394SS..EExtended strand (participates in β ladder)trans-101128.3172.147.50000109.8R40 Y41T35-R40 CarbonylContact C-O 3.57Å; T35-R40 WeakPolarHBondContact CA-O 3.39Å; T35-Y41 HydrophobicContact CG2-CD2 4.08Å
36D76.7Confident73.8Confident7 Ų780 Ų804%0.03740%0.4CS..  trans-64.4162.5174-168.220.5000111.1K38 G39 R40 V66D36-K38 PolarHBondContact O-N 2.86Å; D36-G39 WeakPolarHBondContact O-CA 3.37Å; D36-G39 PolarHBondContact O-N 3.17Å; D36-R40 HydrophobicContact CB-CB 4.28Å; D36-R40 PolarHBondContact N-O 2.95Å; D36-R40 IonicContact OD2-NH2 3.99Å; D36-V66 VanDerWaalsContact OD1-CB 3.3Å; D36-V66 WeakPolarHBondContact OD1-CB 3.33Å
37H76.4Confident75Confident132 Ų13277.8 Ų77.861%0.61138%0.382SS*.THydrogen-bonded Turntrans-58.3-20173.459.6-75.3000113G39 V66H37-G39 VanDerWaalsContact C-N 3.31Å; H37-V66 HydrophobicContact CB-CG2 4.02Å
38K80.1Confident75.9Confident137 Ų13778.2 Ų78.260%0.59639%0.389SS*.THydrogen-bonded Turntrans-87.99173.4-66173.5179.3179.50113.5D36 R40D36-K38 PolarHBondContact O-N 2.86Å; K38-R40 PolarHBondContact O-N 3Å
39G77.4Confident76.7Confident61 Ų6179.9 Ų79.963%0.62939%0.392SS*.SBendtrans71.211.5-177.800000114.5D36 H37D36-G39 WeakPolarHBondContact O-CA 3.37Å; D36-G39 PolarHBondContact O-N 3.17Å; H37-G39 VanDerWaalsContact C-N 3.31Å
40R81.3Confident77.1Confident134 Ų13482.5 Ų82.551%0.50642%0.416SS..  trans-82.6128.5179.7-69.5-173.4-73-179.51.8110.1T35 D36 K38 H42T35-R40 CarbonylContact C-O 3.57Å; T35-R40 WeakPolarHBondContact CA-O 3.39Å; D36-R40 HydrophobicContact CB-CB 4.28Å; D36-R40 PolarHBondContact N-O 2.95Å; D36-R40 IonicContact OD2-NH2 3.99Å; K38-R40 PolarHBondContact O-N 3Å; R40-H42 PolarHBondContact O-CD2 2.88Å
41Y79.3Confident77.3Confident136 Ų13685.9 Ų85.953%0.53344%0.441SS..EExtended strand (participates in β ladder)trans-80.9127.7179.6-176.4-97.1000111P33 T35 F43P33-Y41 HydrophobicContact CB-CE1 4.48Å; P33-Y41 HydrophobicContact CB-CE2 4Å; P33-Y41 WeakPolarHBondContact CB-OH 3.48Å; T35-Y41 HydrophobicContact CG2-CD2 4.08Å; Y41-F43 HydrophobicContact CD1-CD1 4.4Å; Y41-F43 HydrophobicContact CD1-CE1 4.33Å; Y41-F43 AromaticContact CE1-CD1 3.8Å; Y41-F43 HydrophobicContact CE1-CD1 3.8Å; Y41-F43 AromaticContact CE1-CE1 3.96Å; Y41-F43 HydrophobicContact CE1-CE1 3.96Å; Y41-F43 HydrophobicContact CE1-CG 4.41Å
42H80.1Confident77.2Confident53 Ų5388.7 Ų88.725%0.24546%0.456CS..EExtended strand (participates in β ladder)trans-110.9126.9174.6-69-89.3000109.9P33 Y34 R40 F67P33-H42 VanDerWaalsContact CA-O 3.24Å; P33-H42 WeakPolarHBondContact CA-O 3.27Å; P33-H42 WeakPolarHBondContact CB-O 3.46Å; Y34-H42 HydrophobicContact CD1-CB 4.08Å; Y34-H42 HydrophobicContact CD2-CB 4.2Å; Y34-H42 HydrophobicContact CE1-CB 3.74Å; Y34-H42 HydrophobicContact CE2-CB 3.87Å; Y34-H42 AromaticContact CE2-CD2 3.7Å; Y34-H42 AromaticContact CE2-CG 3.8Å; Y34-H42 HydrophobicContact CG-CB 4.31Å; Y34-H42 AromaticContact CZ-CG 3.8Å; Y34-H42 PolarHBondContact N-O 3.4Å; Y34-H42 VanDerWaalsContact N-O 3.11Å; Y34-H42 WeakPolarHBondContact O-CB 3.4Å; Y34-H42 PolarHBondContact O-N 3.45Å; R40-H42 PolarHBondContact O-CD2 2.88Å; H42-F67 AromaticContact CE1-CE1 3.7Å; H42-F67 AromaticContact NE2-CE1 3.77Å
43F79.6Confident77.3Confident166 Ų16689.1 Ų89.173%0.72846%0.462SS*.  trans-64.8145.4176.6-59.8-78.9000111.4Y41Y41-F43 HydrophobicContact CD1-CD1 4.4Å; Y41-F43 HydrophobicContact CD1-CE1 4.33Å; Y41-F43 AromaticContact CE1-CD1 3.8Å; Y41-F43 HydrophobicContact CE1-CD1 3.8Å; Y41-F43 AromaticContact CE1-CE1 3.96Å; Y41-F43 HydrophobicContact CE1-CE1 3.96Å; Y41-F43 HydrophobicContact CE1-CG 4.41Å
44G79.4Confident77.4Confident37 Ų3794.7 Ų94.738%0.38148%0.479SS..  trans-67.4151.6171.500000111.7C31C31-G44 CarbonylContact O-C 3.56Å; C31-G44 WeakPolarHBondContact O-CA 3.38Å
45F81.3Confident77.5Confident25 Ų2596.3 Ų96.311%0.1149%0.492CS..EExtended strand (participates in β ladder)trans-144.6153.4-179.658.7-91.2000111.7C31 K68C31-F45 HydrophobicContact CB-CD1 4.1Å; C31-F45 HydrophobicContact CB-CD2 4.11Å; C31-F45 HydrophobicContact CB-CE1 3.87Å; C31-F45 HydrophobicContact CB-CE2 3.88Å; C31-F45 HydrophobicContact CB-CG 4.22Å; C31-F45 HydrophobicContact CB-CZ 3.75Å; C31-F45 WeakPolarHBondContact CB-O 3.2Å; C31-F45 PolarHBondContact N-O 2.91Å; C31-F45 PolarHBondContact O-N 3.41Å; C31-F45 WeakPolarHBondContact SG-CE2 3.31Å; C31-F45 WeakPolarHBondContact SG-CZ 3.48Å; F45-K68 HydrophobicContact CE1-CB 4.48Å; F45-K68 HydrophobicContact CZ-CB 4.28Å; F45-K68 WeakPolarHBondContact CZ-O 3.4Å
46H80.4Confident77.6Confident133 Ų13394.6 Ų94.662%0.61648%0.477SS*.EExtended strand (participates in β ladder)trans-93.2143.9177.1-71.8-91.7000111.3V30V30-H46 WeakPolarHBondContact CG2-CE1 3.25Å; V30-H46 WeakPolarHBondContact CG2-ND1 3.3Å
47C77.8Confident77.6Confident10 Ų1096.1 Ų96.17%0.06849%0.485CS..SBendtrans-104.3141.2172.4-64.10000110.5R29 F56 C70R29-C47 PolarHBondContact O-N 3.47Å; C47-F56 WeakPolarHBondContact CB-O 3.43Å; C47-C70 VanDerWaalsContact CA-SG 3.53Å; C47-C70 HydrophobicContact CB-CB 3.84Å; C47-C70 WeakPolarHBondContact CB-SG 3.48Å; C47-C70 VanDerWaalsContact SG-CA 3.5Å; C47-C70 WeakPolarHBondContact SG-CB 3.44Å; C47-C70 CovalentContact SG-SG 2.04Å; C47-C70 PolarHBondContact SG-SG 3.07Å
48P74.4Confident77.4Confident60 Ų6091.1 Ų91.139%0.3946%0.463SS..SBendcis-80.4146.4-1.531.6-32.7000112.2D52 F56P48-D52 HydrophobicContact CB-CB 4.3Å; P48-F56 WeakPolarHBondContact CA-O 3.27Å; P48-F56 WeakPolarHBondContact CB-O 3.48Å
49R76.3Confident77.3Confident129 Ų12985.5 Ų85.549%0.48744%0.44SS..  trans-71.5160.9167.8-64.3-177.7161.4-179.4-3.9110S51 D52R49-S51 PolarHBondContact O-N 3.37Å; R49-D52 HydrophobicContact CB-CB 4.38Å; R49-D52 VanDerWaalsContact CB-OD2 3.26Å; R49-D52 WeakPolarHBondContact CB-OD2 3.23Å; R49-D52 PolarHBondContact N-OD2 3.39Å; R49-D52 PolarHBondContact O-N 2.81Å
50L73.6Confident77.3Confident189 Ų18982.6 Ų82.699%0.9941%0.411SS*.THydrogen-bonded Turntrans-59-23.3177.6-157.672.7000113.1
51S72.5Confident77Confident116 Ų11679.5 Ų79.581%0.81140%0.402SS*.THydrogen-bonded Turntrans-91-11.6176.3-171.10000113.6R49R49-S51 PolarHBondContact O-N 3.37Å
52D74.9Confident76.7Confident58 Ų5877.1 Ų77.131%0.3140%0.395SS..SBendtrans-93.8153.2-176.4-64.7-29.2000110.3P48 R49 F56P48-D52 HydrophobicContact CB-CB 4.3Å; R49-D52 HydrophobicContact CB-CB 4.38Å; R49-D52 VanDerWaalsContact CB-OD2 3.26Å; R49-D52 WeakPolarHBondContact CB-OD2 3.23Å; R49-D52 PolarHBondContact N-OD2 3.39Å; R49-D52 PolarHBondContact O-N 2.81Å; D52-F56 HydrophobicContact CB-CB 4.26Å
53N76.6Confident76.1Confident105 Ų10580.9 Ų80.956%0.56142%0.417SS*.  trans-69.4149.9175.4-171.8-15.9000110.1T55 F56N53-T55 PolarHBondContact O-N 3.39Å; N53-F56 HydrophobicContact CB-CD2 3.68Å; N53-F56 HydrophobicContact CB-CE2 3.83Å; N53-F56 WeakPolarHBondContact O-CB 3.35Å; N53-F56 PolarHBondContact O-N 3.34Å
54K79.5Confident75Confident181 Ų18179.8 Ų79.879%0.78742%0.419SS*.THydrogen-bonded Turntrans-58-21.6-175.6-170.3170.9-177.7172.30113.8F56 I57K54-F56 VanDerWaalsContact C-N 3.28Å; K54-F56 PolarHBondContact O-N 2.79Å; K54-I57 WeakPolarHBondContact O-CG2 3.47Å
55T74.4Confident74.2Confident65 Ų6581 Ų8140%0.39942%0.419SS..THydrogen-bonded Turntrans-76.1-11.9177.555.20000113.7N53 I57 N72N53-T55 PolarHBondContact O-N 3.39Å; T55-I57 PolarHBondContact O-N 2.92Å; T55-I57 VanDerWaalsContact O-N 3.14Å; T55-N72 PolarHBondContact O-OD1 2.88Å
56F77.3Confident73.3Confident52 Ų5281.8 Ų81.823%0.22843%0.426CS..  trans-91.570.8-175.3-70.7-108000110.5C47 P48 D52 N53 K54 C70 C71C47-F56 WeakPolarHBondContact CB-O 3.43Å; P48-F56 WeakPolarHBondContact CA-O 3.27Å; P48-F56 WeakPolarHBondContact CB-O 3.48Å; D52-F56 HydrophobicContact CB-CB 4.26Å; N53-F56 HydrophobicContact CB-CD2 3.68Å; N53-F56 HydrophobicContact CB-CE2 3.83Å; N53-F56 WeakPolarHBondContact O-CB 3.35Å; N53-F56 PolarHBondContact O-N 3.34Å; K54-F56 VanDerWaalsContact C-N 3.28Å; K54-F56 PolarHBondContact O-N 2.79Å; F56-C70 HydrophobicContact CB-CB 4.08Å; F56-C70 WeakPolarHBondContact CD1-O 3.33Å; F56-C71 CarbonylContact C-O 3.44Å; F56-C71 WeakPolarHBondContact CA-O 3.47Å; F56-C71 VanDerWaalsContact CD1-CA 3.47Å
57I76.6Confident72.7Confident40 Ų4079.7 Ų79.721%0.20542%0.415CS..  trans-96.8-9.1-173.665171.8000114K54 T55K54-I57 WeakPolarHBondContact O-CG2 3.47Å; T55-I57 PolarHBondContact O-N 2.92Å; T55-I57 VanDerWaalsContact O-N 3.14Å
58L73.4Confident72.8Confident26 Ų2681.6 Ų81.614%0.13642%0.422CS..EExtended strand (participates in β ladder)trans-110.1149.8-174.9-63.5105.8000112.2C70 C71 E73 F76L58-C70 CarbonylContact O-C 3.49Å; L58-C70 WeakPolarHBondContact O-CA 3.43Å; L58-C71 PolarHBondContact N-O 3.34Å; L58-C71 PolarHBondContact O-N 2.89Å; L58-C71 PolarHBondContact O-SG 2.83Å; L58-E73 HydrophobicContact CD1-CB 4.28Å; L58-E73 HydrophobicContact CD1-CG 3.5Å; L58-F76 HydrophobicContact CB-CB 4.45Å; L58-F76 HydrophobicContact CB-CD2 3.81Å; L58-F76 HydrophobicContact CB-CE2 4.34Å; L58-F76 HydrophobicContact CB-CG 4.3Å; L58-F76 HydrophobicContact CD2-CB 4.4Å; L58-F76 HydrophobicContact CD2-CD1 4.01Å; L58-F76 HydrophobicContact CD2-CD2 3.84Å; L58-F76 HydrophobicContact CD2-CE1 4.19Å; L58-F76 HydrophobicContact CD2-CE2 3.98Å; L58-F76 HydrophobicContact CD2-CG 3.84Å; L58-F76 HydrophobicContact CD2-CZ 4.18Å; L58-F76 HydrophobicContact CG-CD2 4.43Å
59C77.4Confident73Confident19 Ų1982.7 Ų82.713%0.12842%0.419CS..EExtended strand (participates in β ladder)trans-84.9117171.2-169.30000111.2F28 C31 M80F28-C59 PolarHBondContact O-N 3.3Å; C31-C59 WeakPolarHBondContact CA-SG 3.26Å; C31-C59 HydrophobicContact CB-CB 4.09Å; C31-C59 WeakPolarHBondContact CB-SG 3.37Å; C31-C59 VanDerWaalsContact SG-CA 3.59Å; C31-C59 WeakPolarHBondContact SG-CB 3.18Å; C31-C59 CovalentContact SG-SG 2.02Å; C31-C59 PolarHBondContact SG-SG 2.79Å; C59-M80 WeakPolarHBondContact O-CE 3.12Å
60C77.1Confident73.2Confident1 Ų177 Ų771%0.00740%0.399CS..EExtended strand (participates in β ladder)trans-106.9156170.7-80.30000111.9K68 Y69 C71 F76C60-K68 CarbonylContact O-C 3.58Å; C60-K68 WeakPolarHBondContact O-CA 3.41Å; C60-Y69 HydrophobicContact CB-CD1 4.42Å; C60-Y69 HydrophobicContact CB-CD2 4.47Å; C60-Y69 HydrophobicContact CB-CE1 3.99Å; C60-Y69 HydrophobicContact CB-CE2 4.05Å; C60-Y69 PolarHBondContact N-O 2.85Å; C60-Y69 PolarHBondContact O-N 3.49Å; C60-C71 HydrophobicContact CB-CB 3.55Å; C60-C71 WeakPolarHBondContact CB-SG 3.35Å; C60-C71 WeakPolarHBondContact SG-CB 3.26Å; C60-C71 CovalentContact SG-SG 2.01Å; C60-C71 PolarHBondContact SG-SG 2.91Å; C60-F76 WeakPolarHBondContact SG-CA 3.44Å
61H76.1Confident73.4Confident68 Ų6868 Ų6832%0.31535%0.352SS..EExtended strand (participates in β ladder)trans-133.6133.1170.3168.5-91.8000107.2T65 V66 K68 V79H61-T65 PolarHBondContact CD2-O 3.33Å; H61-T65 PolarHBondContact CE1-O 3.22Å; H61-T65 PolarHBondContact NE2-O 3.34Å; H61-V66 PolarHBondContact CD2-O 3.37Å; H61-V66 VanDerWaalsContact NE2-CA 3.3Å; H61-V66 WeakPolarHBondContact NE2-CA 3.47Å; H61-K68 HydrophobicContact CB-CG 4.35Å; H61-V79 VanDerWaalsContact O-CG1 3.3Å; H61-V79 WeakPolarHBondContact O-CG1 3.36Å
62H72.8Confident73.7Confident87 Ų8764.7 Ų64.740%0.40333%0.325SS..EExtended strand (participates in β ladder)trans-86.2127.6179-169.176.8000109.1N64 T65 Y69H62-N64 PolarHBondContact O-N 3.1Å; H62-T65 WeakPolarHBondContact CB-OG1 3.31Å; H62-T65 CarbonylContact O-C 3.43Å; H62-T65 PolarHBondContact O-N 3.19Å; H62-Y69 HydrophobicContact CB-CE1 4.13Å
63N66.6Low73.5Confident132 Ų13267.7 Ų67.771%0.70634%0.338SS*.THydrogen-bonded Turntrans-48-31-174.9-164.9-6.9000113.7
64N56.2Low73.1Confident142 Ų14267.2 Ų67.276%0.75934%0.338SS*.THydrogen-bonded Turntrans-97.80.1-178.3-154.614.9000115.6H62H62-N64 PolarHBondContact O-N 3.1Å
65T62.3Low72.6Confident62 Ų6262.6 Ų62.638%0.3832%0.319SS..EExtended strand (participates in β ladder)trans-140.4129.9179.764.40000110.5H61 H62 F67H61-T65 PolarHBondContact CD2-O 3.33Å; H61-T65 PolarHBondContact CE1-O 3.22Å; H61-T65 PolarHBondContact NE2-O 3.34Å; H62-T65 WeakPolarHBondContact CB-OG1 3.31Å; H62-T65 CarbonylContact O-C 3.43Å; H62-T65 PolarHBondContact O-N 3.19Å; T65-F67 PolarHBondContact O-N 2.91Å
66V63.6Low72.2Confident43 Ų4361.2 Ų61.226%0.26131%0.308SS..EExtended strand (participates in β ladder)trans-61.7-6.6179.7-167.60000113.6Y34 D36 H37 H61 K68Y34-V66 HydrophobicContact CD2-CG1 3.89Å; Y34-V66 WeakPolarHBondContact CD2-O 3.42Å; Y34-V66 HydrophobicContact CE2-CG1 4.2Å; Y34-V66 WeakPolarHBondContact CE2-O 3.28Å; D36-V66 VanDerWaalsContact OD1-CB 3.3Å; D36-V66 WeakPolarHBondContact OD1-CB 3.33Å; H37-V66 HydrophobicContact CB-CG2 4.02Å; H61-V66 PolarHBondContact CD2-O 3.37Å; H61-V66 VanDerWaalsContact NE2-CA 3.3Å; H61-V66 WeakPolarHBondContact NE2-CA 3.47Å; V66-K68 PolarHBondContact O-N 3.29Å
67F67.8Low71.5Confident88 Ų8864.7 Ų64.739%0.38633%0.325SS..EExtended strand (participates in β ladder)trans-76123.8-178.1-59.9-66.8000113.1Y34 H42 T65Y34-F67 HydrophobicContact CE2-CD1 4.45Å; Y34-F67 WeakPolarHBondContact OH-CA 3.41Å; Y34-F67 WeakPolarHBondContact OH-CD1 3.32Å; H42-F67 AromaticContact CE1-CE1 3.7Å; H42-F67 AromaticContact NE2-CE1 3.77Å; T65-F67 PolarHBondContact O-N 2.91Å
68K78.8Confident70.8Confident50 Ų5066.5 Ų66.522%0.21735%0.346CS..EExtended strand (participates in β ladder)trans-84.6143.5167.7-56-176.6-174.5174.30110.1C31 E32 Y34 F45 C60 H61 V66C31-K68 HydrophobicContact CB-CB 4.48Å; C31-K68 HydrophobicContact CB-CD 4.31Å; E32-K68 PolarHBondContact O-NZ 3.32Å; Y34-K68 HydrophobicContact CD1-CB 4.35Å; Y34-K68 HydrophobicContact CD1-CD 3.57Å; Y34-K68 HydrophobicContact CD1-CG 3.78Å; Y34-K68 HydrophobicContact CE1-CB 3.8Å; Y34-K68 HydrophobicContact CE1-CD 3.92Å; Y34-K68 HydrophobicContact CE1-CG 3.69Å; Y34-K68 HydrophobicContact CG-CD 4.29Å; Y34-K68 HydrophobicContact CG-CG 4.4Å; Y34-K68 PolarHBondContact OH-N 3.31Å; F45-K68 HydrophobicContact CE1-CB 4.48Å; F45-K68 HydrophobicContact CZ-CB 4.28Å; F45-K68 WeakPolarHBondContact CZ-O 3.4Å; C60-K68 CarbonylContact O-C 3.58Å; C60-K68 WeakPolarHBondContact O-CA 3.41Å; H61-K68 HydrophobicContact CB-CG 4.35Å; V66-K68 PolarHBondContact O-N 3.29Å
69Y78.7Confident70.1Confident83 Ų8367.2 Ų67.233%0.32535%0.351SS..EExtended strand (participates in β ladder)trans-146.1159.9178.364.4-80000111.1C60 H62 C71C60-Y69 HydrophobicContact CB-CD1 4.42Å; C60-Y69 HydrophobicContact CB-CD2 4.47Å; C60-Y69 HydrophobicContact CB-CE1 3.99Å; C60-Y69 HydrophobicContact CB-CE2 4.05Å; C60-Y69 PolarHBondContact N-O 2.85Å; C60-Y69 PolarHBondContact O-N 3.49Å; H62-Y69 HydrophobicContact CB-CE1 4.13Å; Y69-C71 HydrophobicContact CD2-CB 4.48Å; Y69-C71 HydrophobicContact CE2-CB 4.06Å
70C81.1Confident69.3Low10 Ų1069.4 Ų69.47%0.06836%0.361CS..EExtended strand (participates in β ladder)trans-76.9137.8174.8-59.60000109.7C47 F56 L58C47-C70 VanDerWaalsContact CA-SG 3.53Å; C47-C70 HydrophobicContact CB-CB 3.84Å; C47-C70 WeakPolarHBondContact CB-SG 3.48Å; C47-C70 VanDerWaalsContact SG-CA 3.5Å; C47-C70 WeakPolarHBondContact SG-CB 3.44Å; C47-C70 CovalentContact SG-SG 2.04Å; C47-C70 PolarHBondContact SG-SG 3.07Å; F56-C70 HydrophobicContact CB-CB 4.08Å; F56-C70 WeakPolarHBondContact CD1-O 3.33Å; L58-C70 CarbonylContact O-C 3.49Å; L58-C70 WeakPolarHBondContact O-CA 3.43Å
71C77.1Confident68.2Low0 Ų076.5 Ų76.50%039%0.394CS..EExtended strand (participates in β ladder)trans-137.6162.1-178.7610000111.3F56 L58 C60 Y69 E75F56-C71 CarbonylContact C-O 3.44Å; F56-C71 WeakPolarHBondContact CA-O 3.47Å; F56-C71 VanDerWaalsContact CD1-CA 3.47Å; L58-C71 PolarHBondContact N-O 3.34Å; L58-C71 PolarHBondContact O-N 2.89Å; L58-C71 PolarHBondContact O-SG 2.83Å; C60-C71 HydrophobicContact CB-CB 3.55Å; C60-C71 WeakPolarHBondContact CB-SG 3.35Å; C60-C71 WeakPolarHBondContact SG-CB 3.26Å; C60-C71 CovalentContact SG-SG 2.01Å; C60-C71 PolarHBondContact SG-SG 2.91Å; Y69-C71 HydrophobicContact CD2-CB 4.48Å; Y69-C71 HydrophobicContact CE2-CB 4.06Å; C71-E75 HydrophobicContact CB-CB 4.15Å
72N79.6Confident67Low46 Ų4674.4 Ų74.425%0.24639%0.388CS..  trans-79.7163.9171.3-167.511.1000111.1T55 T74 E75 F76T55-N72 PolarHBondContact O-OD1 2.88Å; N72-T74 VanDerWaalsContact C-N 3.28Å; N72-T74 PolarHBondContact O-N 3.07Å; N72-E75 PolarHBondContact O-N 3.49Å; N72-E75 VanDerWaalsContact O-N 3.16Å; N72-F76 WeakPolarHBondContact O-CB 3.44Å; N72-F76 PolarHBondContact O-N 3.37Å
73E71.3Confident65.6Low122 Ų12276.6 Ų76.657%0.5740%0.403SS*.Hα-helixtrans-53.7-41.2178.1-69171.2-175.400113L58 F76 Q77L58-E73 HydrophobicContact CD1-CB 4.28Å; L58-E73 HydrophobicContact CD1-CG 3.5Å; E73-F76 WeakPolarHBondContact O-CB 3.49Å; E73-F76 PolarHBondContact O-N 3.39Å; E73-Q77 PolarHBondContact O-N 3Å; E73-Q77 VanDerWaalsContact O-N 3.07Å
74T68.6Low64.8Low94 Ų9478.3 Ų78.358%0.57741%0.411SS*.Hα-helixtrans-69.8-37.3-179.955.20000112.7N72 A78N72-T74 VanDerWaalsContact C-N 3.28Å; N72-T74 PolarHBondContact O-N 3.07Å; T74-A78 PolarHBondContact O-N 2.89Å
75E67.9Low64.2Low84 Ų8477.4 Ų77.439%0.39341%0.411SS..Hα-helixtrans-75.4-34.6176.5-68.4-170.8159.500111.2C71 N72 Q77 A78 V79C71-E75 HydrophobicContact CB-CB 4.15Å; N72-E75 PolarHBondContact O-N 3.49Å; N72-E75 VanDerWaalsContact O-N 3.16Å; E75-Q77 VanDerWaalsContact C-N 3.33Å; E75-Q77 PolarHBondContact O-N 2.9Å; E75-A78 PolarHBondContact O-N 3.45Å; E75-V79 VanDerWaalsContact O-CB 3.27Å; E75-V79 WeakPolarHBondContact O-CB 3.05Å; E75-V79 VanDerWaalsContact O-CG2 3.28Å; E75-V79 WeakPolarHBondContact O-CG2 3.41Å; E75-V79 PolarHBondContact O-N 3.09Å
76F66Low63.4Low37 Ų3777.6 Ų77.616%0.16242%0.419CS..Hα-helixtrans-58.1-46.4172.2-177.8-92.8000111.7L58 C60 N72 E73 A78 M80L58-F76 HydrophobicContact CB-CB 4.45Å; L58-F76 HydrophobicContact CB-CD2 3.81Å; L58-F76 HydrophobicContact CB-CE2 4.34Å; L58-F76 HydrophobicContact CB-CG 4.3Å; L58-F76 HydrophobicContact CD2-CB 4.4Å; L58-F76 HydrophobicContact CD2-CD1 4.01Å; L58-F76 HydrophobicContact CD2-CD2 3.84Å; L58-F76 HydrophobicContact CD2-CE1 4.19Å; L58-F76 HydrophobicContact CD2-CE2 3.98Å; L58-F76 HydrophobicContact CD2-CG 3.84Å; L58-F76 HydrophobicContact CD2-CZ 4.18Å; L58-F76 HydrophobicContact CG-CD2 4.43Å; C60-F76 WeakPolarHBondContact SG-CA 3.44Å; N72-F76 WeakPolarHBondContact O-CB 3.44Å; N72-F76 PolarHBondContact O-N 3.37Å; E73-F76 WeakPolarHBondContact O-CB 3.49Å; E73-F76 PolarHBondContact O-N 3.39Å; F76-A78 VanDerWaalsContact C-N 3.31Å; F76-A78 PolarHBondContact O-N 3.31Å; F76-M80 HydrophobicContact CD2-CE 3.72Å; F76-M80 HydrophobicContact CD2-SD 4.23Å; F76-M80 HydrophobicContact CE1-SD 4.21Å; F76-M80 HydrophobicContact CE2-CE 3.13Å; F76-M80 HydrophobicContact CE2-SD 3.38Å; F76-M80 WeakPolarHBondContact CE2-SD 3.2Å; F76-M80 HydrophobicContact CZ-CE 3.82Å; F76-M80 HydrophobicContact CZ-SD 3.35Å; F76-M80 WeakPolarHBondContact CZ-SD 3.48Å; F76-M80 VanDerWaalsContact O-CB 3.24Å; F76-M80 WeakPolarHBondContact O-CB 2.98Å; F76-M80 PolarHBondContact O-N 3.31Å
77Q62.9Low62.5Low124 Ų12479.3 Ų79.358%0.57943%0.432SS*.Hα-helixtrans-64.1-36.1178.2-166.1174.5-4.700112.5E73 E75E73-Q77 PolarHBondContact O-N 3Å; E73-Q77 VanDerWaalsContact O-N 3.07Å; E75-Q77 VanDerWaalsContact C-N 3.33Å; E75-Q77 PolarHBondContact O-N 2.9Å
78A60.6Low61.4Low79 Ų7978.1 Ų78.165%0.65344%0.435SS*.Hα-helixtrans-80.3-39.6-179.200000113.9T74 E75 F76T74-A78 PolarHBondContact O-N 2.89Å; E75-A78 PolarHBondContact O-N 3.45Å; F76-A78 VanDerWaalsContact C-N 3.31Å; F76-A78 PolarHBondContact O-N 3.31Å
79V60.1Low59.8Low40 Ų4083.9 Ų83.924%0.24246%0.463CS..Hα-helixtrans-90.5-37.4-171.7177.30000112.3H61 E75 Q81H61-V79 VanDerWaalsContact O-CG1 3.3Å; H61-V79 WeakPolarHBondContact O-CG1 3.36Å; E75-V79 VanDerWaalsContact O-CB 3.27Å; E75-V79 WeakPolarHBondContact O-CB 3.05Å; E75-V79 VanDerWaalsContact O-CG2 3.28Å; E75-V79 WeakPolarHBondContact O-CG2 3.41Å; E75-V79 PolarHBondContact O-N 3.09Å; V79-Q81 PolarHBondContact O-N 3.41Å
80M60.5Low58.2Low66 Ų6682.7 Ų82.733%0.32548%0.476SS..THydrogen-bonded Turntrans-81.14.2178.7-158.2172.6-73.100112.5C59 F76 A82C59-M80 WeakPolarHBondContact O-CE 3.12Å; F76-M80 HydrophobicContact CD2-CE 3.72Å; F76-M80 HydrophobicContact CD2-SD 4.23Å; F76-M80 HydrophobicContact CE1-SD 4.21Å; F76-M80 HydrophobicContact CE2-CE 3.13Å; F76-M80 HydrophobicContact CE2-SD 3.38Å; F76-M80 WeakPolarHBondContact CE2-SD 3.2Å; F76-M80 HydrophobicContact CZ-CE 3.82Å; F76-M80 HydrophobicContact CZ-SD 3.35Å; F76-M80 WeakPolarHBondContact CZ-SD 3.48Å; F76-M80 VanDerWaalsContact O-CB 3.24Å; F76-M80 WeakPolarHBondContact O-CB 2.98Å; F76-M80 PolarHBondContact O-N 3.31Å; M80-A82 VanDerWaalsContact C-N 3.27Å; M80-A82 PolarHBondContact O-N 3.18Å
81Q53.2Low56.7Low149 Ų14985.7 Ų85.770%0.69649%0.486SS*.THydrogen-bonded Turntrans50.646.9178-149.5169.4-13.900112.3V79 N83V79-Q81 PolarHBondContact O-N 3.41Å; Q81-N83 PolarHBondContact O-N 3.33Å; Q81-N83 VanDerWaalsContact O-N 3.11Å
82A51.3Low55.2Low24 Ų2490.5 Ų90.520%0.19851%0.51CS..  trans-82.979.1178.300000111.2M80 L84M80-A82 VanDerWaalsContact C-N 3.27Å; M80-A82 PolarHBondContact O-N 3.18Å; A82-L84 PolarHBondContact O-N 2.97Å
83N43.5Very low53.7Low133 Ų13394.9 Ų94.971%0.71153%0.529SS*.  -65.1114.9127-92.3-18.2000104.1Q81 T85 A86Q81-N83 PolarHBondContact O-N 3.33Å; Q81-N83 VanDerWaalsContact O-N 3.11Å; N83-T85 PolarHBondContact O-N 3.44Å; N83-A86 PolarHBondContact O-N 2.91Å
84L50.1Low52.9Low168 Ų16895.1 Ų95.188%0.8853%0.534SS*.THydrogen-bonded Turntrans-54.712.6-179-91.6120.6000115.5A82A82-L84 PolarHBondContact O-N 2.97Å
85T44.4Very low52.4Low123 Ų12393.2 Ų93.276%0.75552%0.52SS*.THydrogen-bonded Turntrans-109.1-21.9-177.1-19.10000113.6N83N83-T85 PolarHBondContact O-N 3.44Å
86A44.8Very low52.1Low66 Ų6695.7 Ų95.755%0.54553%0.527SS..THydrogen-bonded Turntrans-101.7-28.4-170.600000115.1N83 S88N83-A86 PolarHBondContact O-N 2.91Å; A86-S88 PolarHBondContact O-N 2.89Å
87S44.5Very low52.3Low79 Ų7998.2 Ų98.255%0.55255%0.546SS*.THydrogen-bonded Turntrans-8417.2179.7-159.30000113.7E89S87-E89 VanDerWaalsContact C-N 3.35Å
88S44.2Very low52.7Low64 Ų6495.1 Ų95.145%0.44854%0.541SS..Hα-helixtrans-76.3-24.5166.7-177.10000111.1A86 M92A86-S88 PolarHBondContact O-N 2.89Å; S88-M92 WeakPolarHBondContact O-CB 3.33Å; S88-M92 WeakPolarHBondContact O-CG 3.39Å; S88-M92 PolarHBondContact O-N 3.44Å; S88-M92 WeakPolarHBondContact OG-CG 3.31Å
89E44.6Very low53.3Low171 Ų17195.6 Ų95.680%0.79953%0.532SS*.Hα-helixtrans-80-31-167.1-67.3-170.8147.200114.1S87S87-E89 VanDerWaalsContact C-N 3.35Å
90G46.2Very low54.1Low58 Ų5896.9 Ų96.960%0.59854%0.537SS*.Hα-helixtrans-89-30.3178.200000114.8
91Y48.6Very low55Low72 Ų7295.5 Ų95.528%0.28254%0.54SS..Hα-helixtrans-85.7-16.8-178.1-153.5-96.5000113H27 F28 N95H27-Y91 WeakPolarHBondContact CB-OH 3.17Å; H27-Y91 PolarHBondContact CE1-OH 3.35Å; H27-Y91 VanDerWaalsContact CE1-OH 3.25Å; H27-Y91 AromaticContact ND1-CZ 3.89Å; H27-Y91 PolarHBondContact ND1-OH 3.48Å; F28-Y91 HydrophobicContact CZ-CE1 4.41Å; Y91-N95 WeakPolarHBondContact CE1-ND2 3.22Å
92M46.6Very low56.3Low102 Ų10293.1 Ų93.150%0.50254%0.536SS..Hα-helixtrans-81.3-5.2177-72.5-73.2107.600114.2S88 Y96S88-M92 WeakPolarHBondContact O-CB 3.33Å; S88-M92 WeakPolarHBondContact O-CG 3.39Å; S88-M92 PolarHBondContact O-N 3.44Å; S88-M92 WeakPolarHBondContact OG-CG 3.31Å; M92-Y96 WeakPolarHBondContact O-CB 2.97Å
93H47.1Very low57.8Low137 Ų137100.4 Ų100.463%0.63456%0.558SS**Hα-helixtrans-98.8-43.4180-147.764.1000113.3T97H93-T97 PolarHBondContact O-OG1 3.49Å
94N55.2Low59.7Low127 Ų12797.5 Ų97.568%0.67954%0.542SS*.Hα-helixtrans-75.1-37.3-175.3-66.46.4000112.1
95N57.6Low61.5Low54 Ų5497.5 Ų97.529%0.28953%0.531SS..Hα-helixtrans-88.6-22.5179.1-73.7-50.3000113.3Y91 L99Y91-N95 WeakPolarHBondContact CE1-ND2 3.22Å; N95-L99 WeakPolarHBondContact O-CB 3.06Å; N95-L99 PolarHBondContact O-N 3.28Å
96Y61.9Low63.4Low136 Ų13693.3 Ų93.353%0.53351%0.513SS..Hα-helixtrans-69.4-39.3178.7-174.3-99000111.8M92 L99 L100M92-Y96 WeakPolarHBondContact O-CB 2.97Å; Y96-L99 PolarHBondContact O-N 2.96Å; Y96-L100 HydrophobicContact CE1-CD1 3.9Å; Y96-L100 WeakPolarHBondContact O-CA 3.32Å; Y96-L100 WeakPolarHBondContact O-CB 3.38Å; Y96-L100 PolarHBondContact O-N 3.35Å
97T69.7Low65.2Low91 Ų9194.7 Ų94.756%0.55851%0.507SS*.Hα-helixtrans-66.1-42.4177.8-53.70000111.8H93 G101H93-T97 PolarHBondContact O-OG1 3.49Å; T97-G101 PolarHBondContact O-N 3.27Å
98A72Confident67.1Low59 Ų5996.9 Ų96.949%0.48851%0.507SS..Hα-helixtrans-68.2-44.2176.300000112G101 V102A98-G101 PolarHBondContact O-N 2.85Å; A98-V102 WeakPolarHBondContact O-CG2 3.03Å; A98-V102 PolarHBondContact O-N 2.88Å
99L74.3Confident69.3Low88 Ų8896.9 Ų96.946%0.46150%0.504SS..Hα-helixtrans-63.9-42.6176.8-173.671.7000111.5F20 N95 Y96 G101 V102 W103F20-L99 HydrophobicContact CE1-CD1 4.42Å; N95-L99 WeakPolarHBondContact O-CB 3.06Å; N95-L99 PolarHBondContact O-N 3.28Å; Y96-L99 PolarHBondContact O-N 2.96Å; L99-G101 VanDerWaalsContact C-N 3.33Å; L99-V102 PolarHBondContact O-N 3.18Å; L99-W103 VanDerWaalsContact O-CB 3.23Å; L99-W103 WeakPolarHBondContact O-CB 3.38Å; L99-W103 PolarHBondContact O-N 3.49Å
100L76.1Confident71.3Confident67 Ų6793.4 Ų93.435%0.35149%0.49SS..Hα-helixtrans-63.1-41.2174.5-169.1105.9000110.3Y96 W103 I104Y96-L100 HydrophobicContact CE1-CD1 3.9Å; Y96-L100 WeakPolarHBondContact O-CA 3.32Å; Y96-L100 WeakPolarHBondContact O-CB 3.38Å; Y96-L100 PolarHBondContact O-N 3.35Å; L100-W103 PolarHBondContact O-N 3Å; L100-I104 HydrophobicContact CD2-CD1 3.55Å; L100-I104 HydrophobicContact CG-CD1 3.66Å; L100-I104 HydrophobicContact CG-CG1 4.33Å; L100-I104 VanDerWaalsContact O-CB 3.29Å; L100-I104 WeakPolarHBondContact O-CB 3.46Å; L100-I104 WeakPolarHBondContact O-CD1 2.94Å; L100-I104 WeakPolarHBondContact O-CG1 3.41Å; L100-I104 PolarHBondContact O-N 2.72Å
101G79.3Confident73Confident37 Ų3795 Ų9538%0.38148%0.483SS..Hα-helixtrans-60.7-49174.100000112.7T97 A98 L99 W103 I104 Y105T97-G101 PolarHBondContact O-N 3.27Å; A98-G101 PolarHBondContact O-N 2.85Å; L99-G101 VanDerWaalsContact C-N 3.33Å; G101-W103 VanDerWaalsContact C-N 3.31Å; G101-W103 PolarHBondContact O-N 3.14Å; G101-I104 PolarHBondContact O-N 3.29Å; G101-Y105 WeakPolarHBondContact O-CB 3.48Å; G101-Y105 PolarHBondContact O-N 3.31Å
102V81.3Confident75Confident100 Ų10097 Ų9761%0.60650%0.498SS*.Hα-helixtrans-62.3-40176173.10000111A98 L99 G106A98-V102 WeakPolarHBondContact O-CG2 3.03Å; A98-V102 PolarHBondContact O-N 2.88Å; L99-V102 PolarHBondContact O-N 3.18Å; V102-G106 WeakPolarHBondContact O-CA 3.05Å; V102-G106 PolarHBondContact O-N 2.96Å
103W82.1Confident77Confident176 Ų17697.2 Ų97.267%0.66750%0.501SS*.Hα-helixtrans-68.4-46.3179.5-167.376.3000112.1L99 L100 G101 F107L99-W103 VanDerWaalsContact O-CB 3.23Å; L99-W103 WeakPolarHBondContact O-CB 3.38Å; L99-W103 PolarHBondContact O-N 3.49Å; L100-W103 PolarHBondContact O-N 3Å; G101-W103 VanDerWaalsContact C-N 3.31Å; G101-W103 PolarHBondContact O-N 3.14Å; W103-F107 WeakPolarHBondContact O-CB 3.23Å; W103-F107 PolarHBondContact O-N 3.5Å
104I82.6Confident78.7Confident72 Ų7293.5 Ų93.537%0.36949%0.488SS..Hα-helixtrans-62.9-49.6176.8-70167.2000110.1L100 G101 F107 F108L100-I104 HydrophobicContact CD2-CD1 3.55Å; L100-I104 HydrophobicContact CG-CD1 3.66Å; L100-I104 HydrophobicContact CG-CG1 4.33Å; L100-I104 VanDerWaalsContact O-CB 3.29Å; L100-I104 WeakPolarHBondContact O-CB 3.46Å; L100-I104 WeakPolarHBondContact O-CD1 2.94Å; L100-I104 WeakPolarHBondContact O-CG1 3.41Å; L100-I104 PolarHBondContact O-N 2.72Å; G101-I104 PolarHBondContact O-N 3.29Å; I104-F107 WeakPolarHBondContact O-CB 2.98Å; I104-F107 PolarHBondContact O-N 3.17Å; I104-F108 HydrophobicContact CG2-CD2 3.75Å; I104-F108 HydrophobicContact CG2-CE2 3.59Å; I104-F108 WeakPolarHBondContact O-CD2 3.5Å; I104-F108 PolarHBondContact O-N 2.04Å
105Y87.5Confident80.2Confident168 Ų16892.9 Ų92.966%0.65948%0.484SS*.Hα-helixtrans-62.6-46.8179.1179.8-95.6000111.7G101 F107 F108 V109G101-Y105 WeakPolarHBondContact O-CB 3.48Å; G101-Y105 PolarHBondContact O-N 3.31Å; Y105-F107 VanDerWaalsContact C-N 3.29Å; Y105-F107 PolarHBondContact O-N 3.08Å; Y105-F108 PolarHBondContact O-N 3.24Å; Y105-V109 HydrophobicContact CD1-CG2 4.15Å; Y105-V109 HydrophobicContact CE1-CG2 3.7Å; Y105-V109 HydrophobicContact CE2-CG2 4.38Å; Y105-V109 WeakPolarHBondContact O-CG2 3.38Å; Y105-V109 PolarHBondContact O-N 3Å
106G84.6Confident81.6Confident36 Ų3695.6 Ų95.637%0.37150%0.498SS..Hα-helixtrans-60.2-39.1176.200000112.4V102 V109 L110V102-G106 WeakPolarHBondContact O-CA 3.05Å; V102-G106 PolarHBondContact O-N 2.96Å; G106-V109 PolarHBondContact O-N 3.19Å; G106-L110 VanDerWaalsContact O-CB 3.31Å; G106-L110 WeakPolarHBondContact O-CB 3.24Å; G106-L110 PolarHBondContact O-N 2.85Å
107F82.8Confident82.6Confident94 Ų9492.6 Ų92.641%0.41249%0.491SS..Hα-helixtrans-63.1-44.6174.2178.4-96.3000112W103 I104 Y105 L110 M111W103-F107 WeakPolarHBondContact O-CB 3.23Å; W103-F107 PolarHBondContact O-N 3.5Å; I104-F107 WeakPolarHBondContact O-CB 2.98Å; I104-F107 PolarHBondContact O-N 3.17Å; Y105-F107 VanDerWaalsContact C-N 3.29Å; Y105-F107 PolarHBondContact O-N 3.08Å; F107-L110 PolarHBondContact O-N 3.32Å; F107-M111 HydrophobicContact CD1-CG 4.14Å; F107-M111 HydrophobicContact CD2-CE 4.21Å; F107-M111 HydrophobicContact CE1-CE 4.27Å; F107-M111 HydrophobicContact CE1-CG 3.76Å; F107-M111 HydrophobicContact CE2-CE 3.3Å; F107-M111 HydrophobicContact CE2-CG 4.21Å; F107-M111 HydrophobicContact CZ-CE 3.34Å; F107-M111 HydrophobicContact CZ-CG 3.82Å; F107-M111 HydrophobicContact CZ-SD 4.29Å; F107-M111 WeakPolarHBondContact O-CB 3.2Å; F107-M111 VanDerWaalsContact O-CG 3.31Å; F107-M111 WeakPolarHBondContact O-CG 3.15Å; F107-M111 PolarHBondContact O-N 3.34Å
108F85.9Confident83.2Confident126 Ų12692.8 Ų92.855%0.55349%0.488SS*.Hα-helixtrans-62.3-44.8175.9-83.8-69.1000112.3I104 Y105 L110 M111 L112I104-F108 HydrophobicContact CG2-CD2 3.75Å; I104-F108 HydrophobicContact CG2-CE2 3.59Å; I104-F108 WeakPolarHBondContact O-CD2 3.5Å; I104-F108 PolarHBondContact O-N 2.04Å; Y105-F108 PolarHBondContact O-N 3.24Å; F108-L110 VanDerWaalsContact C-N 3.34Å; F108-L110 PolarHBondContact O-N 3Å; F108-M111 PolarHBondContact O-N 3.45Å; F108-L112 WeakPolarHBondContact O-CG 3.47Å; F108-L112 PolarHBondContact O-N 2.85Å
109V89.8Confident83.7Confident64 Ų6497.9 Ų97.939%0.38850%0.496SS..Hα-helixtrans-62-43.4176.4173.60000111Y105 G106 M111 L112 L113Y105-V109 HydrophobicContact CD1-CG2 4.15Å; Y105-V109 HydrophobicContact CE1-CG2 3.7Å; Y105-V109 HydrophobicContact CE2-CG2 4.38Å; Y105-V109 WeakPolarHBondContact O-CG2 3.38Å; Y105-V109 PolarHBondContact O-N 3Å; G106-V109 PolarHBondContact O-N 3.19Å; V109-M111 PolarHBondContact O-N 2.83Å; V109-L112 PolarHBondContact O-N 3.29Å; V109-L113 WeakPolarHBondContact O-CB 3.24Å; V109-L113 PolarHBondContact O-N 3.48Å
110L86.3Confident84.1Confident98 Ų98100.2 Ų100.251%0.51350%0.5SS..Hα-helixtrans-61.4-44.2175.7-176.970000111.4G106 F107 F108 L113 V114G106-L110 VanDerWaalsContact O-CB 3.31Å; G106-L110 WeakPolarHBondContact O-CB 3.24Å; G106-L110 PolarHBondContact O-N 2.85Å; F107-L110 PolarHBondContact O-N 3.32Å; F108-L110 VanDerWaalsContact C-N 3.34Å; F108-L110 PolarHBondContact O-N 3Å; L110-L113 PolarHBondContact O-N 2.83Å; L110-V114 WeakPolarHBondContact O-CG2 3.27Å; L110-V114 PolarHBondContact O-N 2.97Å
111M81.8Confident84.1Confident90 Ų9097.6 Ų97.644%0.44349%0.487SS..Hα-helixtrans-63.5-42.1177.7-76.6-62.2161.600112F107 F108 V109 L113 V114 L115F107-M111 HydrophobicContact CD1-CG 4.14Å; F107-M111 HydrophobicContact CD2-CE 4.21Å; F107-M111 HydrophobicContact CE1-CE 4.27Å; F107-M111 HydrophobicContact CE1-CG 3.76Å; F107-M111 HydrophobicContact CE2-CE 3.3Å; F107-M111 HydrophobicContact CE2-CG 4.21Å; F107-M111 HydrophobicContact CZ-CE 3.34Å; F107-M111 HydrophobicContact CZ-CG 3.82Å; F107-M111 HydrophobicContact CZ-SD 4.29Å; F107-M111 WeakPolarHBondContact O-CB 3.2Å; F107-M111 VanDerWaalsContact O-CG 3.31Å; F107-M111 WeakPolarHBondContact O-CG 3.15Å; F107-M111 PolarHBondContact O-N 3.34Å; F108-M111 PolarHBondContact O-N 3.45Å; V109-M111 PolarHBondContact O-N 2.83Å; M111-L113 VanDerWaalsContact C-N 3.35Å; M111-V114 PolarHBondContact O-N 3.27Å; M111-L115 VanDerWaalsContact O-CB 3.28Å; M111-L115 WeakPolarHBondContact O-CB 3.47Å; M111-L115 PolarHBondContact O-N 3.16Å
112L90.1Very high83.9Confident115 Ų11599.3 Ų99.360%0.60250%0.497SS*.Hα-helixtrans-63.2-41174.5-70.9172.8000111.7F108 V109 L115 D116F108-L112 WeakPolarHBondContact O-CG 3.47Å; F108-L112 PolarHBondContact O-N 2.85Å; V109-L112 PolarHBondContact O-N 3.29Å; L112-L115 PolarHBondContact O-N 3.39Å; L112-D116 VanDerWaalsContact O-CB 3.3Å; L112-D116 WeakPolarHBondContact O-CB 3.29Å; L112-D116 PolarHBondContact O-N 2.88Å
113L89.1Confident83.7Confident106 Ų106101.3 Ų101.356%0.55550%0.501SS*.Hα-helixtrans-65.4-42.9177.6-163.2162.2000111.4V109 L110 M111 D116 L117V109-L113 WeakPolarHBondContact O-CB 3.24Å; V109-L113 PolarHBondContact O-N 3.48Å; L110-L113 PolarHBondContact O-N 2.83Å; M111-L113 VanDerWaalsContact C-N 3.35Å; L113-D116 PolarHBondContact O-N 2.8Å; L113-L117 VanDerWaalsContact O-CB 3.32Å; L113-L117 WeakPolarHBondContact O-CB 2.99Å; L113-L117 PolarHBondContact O-N 2.88Å
114V83.3Confident83.5Confident60 Ų6095.7 Ų95.736%0.36449%0.485SS..Hα-helixtrans-64-42.5174.1171.40000110.7L110 M111 L117 L118L110-V114 WeakPolarHBondContact O-CG2 3.27Å; L110-V114 PolarHBondContact O-N 2.97Å; M111-V114 PolarHBondContact O-N 3.27Å; V114-L117 PolarHBondContact O-N 2.85Å; V114-L118 HydrophobicContact CG1-CD1 3.81Å; V114-L118 HydrophobicContact CG1-CG 4.22Å; V114-L118 VanDerWaalsContact O-CB 3.31Å; V114-L118 WeakPolarHBondContact O-CB 3.47Å; V114-L118 WeakPolarHBondContact O-CG 3.47Å; V114-L118 PolarHBondContact O-N 2.02Å
115L86.8Confident82.8Confident113 Ų11396.5 Ų96.559%0.59248%0.484SS*.Hα-helixtrans-65.6-40.5179.2-166.269.6000111.7M111 L112 L118 Y119M111-L115 VanDerWaalsContact O-CB 3.28Å; M111-L115 WeakPolarHBondContact O-CB 3.47Å; M111-L115 PolarHBondContact O-N 3.16Å; L112-L115 PolarHBondContact O-N 3.39Å; L115-L118 PolarHBondContact O-N 3.37Å; L115-Y119 VanDerWaalsContact O-CB 3.25Å; L115-Y119 WeakPolarHBondContact O-CB 3.28Å; L115-Y119 PolarHBondContact O-N 3.31Å
116D86.9Confident81.6Confident111 Ų11195.3 Ų95.359%0.59449%0.489SS*.Hα-helixtrans-63-47.2174.1-175.773.7000111.2L112 L113 L118 Y119 Y120L112-D116 VanDerWaalsContact O-CB 3.3Å; L112-D116 WeakPolarHBondContact O-CB 3.29Å; L112-D116 PolarHBondContact O-N 2.88Å; L113-D116 PolarHBondContact O-N 2.8Å; D116-L118 VanDerWaalsContact C-N 3.32Å; D116-L118 PolarHBondContact O-N 2.78Å; D116-Y119 PolarHBondContact O-N 2.88Å; D116-Y120 VanDerWaalsContact O-CB 3.31Å; D116-Y120 WeakPolarHBondContact O-CB 3.35Å; D116-Y120 PolarHBondContact O-N 3.3Å
117L83.3Confident80.7Confident74 Ų7498.8 Ų98.839%0.38750%0.497SS..Hα-helixtrans-60.4-42.5174.9-178.264.8000111.5L113 V114 S121L113-L117 VanDerWaalsContact O-CB 3.32Å; L113-L117 WeakPolarHBondContact O-CB 2.99Å; L113-L117 PolarHBondContact O-N 2.88Å; V114-L117 PolarHBondContact O-N 2.85Å; L117-S121 WeakPolarHBondContact O-CB 3.15Å; L117-S121 PolarHBondContact O-N 3.49Å; L117-S121 PolarHBondContact O-OG 2.84Å
118L81Confident80Confident94 Ų9495 Ų9549%0.49248%0.483SS..Hα-helixtrans-66-44.3177.3-75.9172.7000111.3V114 L115 D116 S121 A122V114-L118 HydrophobicContact CG1-CD1 3.81Å; V114-L118 HydrophobicContact CG1-CG 4.22Å; V114-L118 VanDerWaalsContact O-CB 3.31Å; V114-L118 WeakPolarHBondContact O-CB 3.47Å; V114-L118 WeakPolarHBondContact O-CG 3.47Å; V114-L118 PolarHBondContact O-N 2.02Å; L115-L118 PolarHBondContact O-N 3.37Å; D116-L118 VanDerWaalsContact C-N 3.32Å; D116-L118 PolarHBondContact O-N 2.78Å; L118-S121 WeakPolarHBondContact CA-OG 3.22Å; L118-S121 CarbonylContact O-C 3.59Å; L118-S121 PolarHBondContact O-N 3.39Å; L118-S121 PolarHBondContact O-OG 2.85Å; L118-A122 WeakPolarHBondContact O-CB 3.38Å; L118-A122 PolarHBondContact O-N 3.48Å
119Y83.8Confident79.1Confident167 Ų16794.5 Ų94.566%0.65548%0.48SS*.Hα-helixtrans-61.6-47.6177.2179.4-101.8000111.3L115 D116 S121 A122 M123L115-Y119 VanDerWaalsContact O-CB 3.25Å; L115-Y119 WeakPolarHBondContact O-CB 3.28Å; L115-Y119 PolarHBondContact O-N 3.31Å; D116-Y119 PolarHBondContact O-N 2.88Å; Y119-S121 VanDerWaalsContact C-N 3.31Å; Y119-S121 PolarHBondContact O-N 2.76Å; Y119-A122 PolarHBondContact O-N 3.39Å; Y119-M123 PolarHBondContact O-N 3.25Å
120Y82.5Confident77.9Confident137 Ų13796.4 Ų96.454%0.53749%0.492SS..Hα-helixtrans-60.5-41.4174.4-177.7-97.5000111.8D116 A122 M123 N124D116-Y120 VanDerWaalsContact O-CB 3.31Å; D116-Y120 WeakPolarHBondContact O-CB 3.35Å; D116-Y120 PolarHBondContact O-N 3.3Å; Y120-A122 VanDerWaalsContact C-N 3.35Å; Y120-M123 PolarHBondContact O-N 2.88Å; Y120-N124 WeakPolarHBondContact CE2-ND2 3.38Å; Y120-N124 WeakPolarHBondContact O-CB 3.5Å; Y120-N124 PolarHBondContact O-N 2.81Å; Y120-N124 PolarHBondContact O-ND2 3.11Å
121S74.9Confident76.9Confident12 Ų1299.1 Ų99.18%0.08450%0.496CS..Hα-helixtrans-68.1-32.1176.9790000113L117 L118 Y119 N124 Y125 C128L117-S121 WeakPolarHBondContact O-CB 3.15Å; L117-S121 PolarHBondContact O-N 3.49Å; L117-S121 PolarHBondContact O-OG 2.84Å; L118-S121 WeakPolarHBondContact CA-OG 3.22Å; L118-S121 CarbonylContact O-C 3.59Å; L118-S121 PolarHBondContact O-N 3.39Å; L118-S121 PolarHBondContact O-OG 2.85Å; Y119-S121 VanDerWaalsContact C-N 3.31Å; Y119-S121 PolarHBondContact O-N 2.76Å; S121-N124 CarbonylContact O-C 3.58Å; S121-Y125 WeakPolarHBondContact O-CA 3.42Å; S121-Y125 WeakPolarHBondContact O-CB 3Å; S121-Y125 PolarHBondContact O-N 3.24Å; S121-C128 WeakPolarHBondContact CB-SG 3.38Å
122A76Confident76.1Confident72 Ų7296.3 Ų96.360%0.59548%0.483SS*.Hα-helixtrans-71.2-39.4175.500000110.7L118 Y119 Y120L118-A122 WeakPolarHBondContact O-CB 3.38Å; L118-A122 PolarHBondContact O-N 3.48Å; Y119-A122 PolarHBondContact O-N 3.39Å; Y120-A122 VanDerWaalsContact C-N 3.35Å
123M77.1Confident74.8Confident142 Ų14293 Ų9370%0.747%0.473SS*.Hα-helixtrans-71.5-33.1177-161.466.6-179.500112.6Y119 Y120Y119-M123 PolarHBondContact O-N 3.25Å; Y120-M123 PolarHBondContact O-N 2.88Å
124N78.1Confident73.5Confident58 Ų5897.9 Ų97.931%0.3148%0.483SS..THydrogen-bonded Turntrans-120.143-177.6-63.8-74.4000112.6Y120 S121 D126 I127 C128Y120-N124 WeakPolarHBondContact CE2-ND2 3.38Å; Y120-N124 WeakPolarHBondContact O-CB 3.5Å; Y120-N124 PolarHBondContact O-N 2.81Å; Y120-N124 PolarHBondContact O-ND2 3.11Å; S121-N124 CarbonylContact O-C 3.58Å; N124-D126 VanDerWaalsContact C-N 3.27Å; N124-D126 PolarHBondContact O-N 2.88Å; N124-D126 VanDerWaalsContact O-N 3.17Å; N124-I127 PolarHBondContact O-N 3.27Å; N124-I127 VanDerWaalsContact O-N 3.14Å; N124-C128 PolarHBondContact O-N 3.07Å; N124-C128 VanDerWaalsContact O-N 3.1Å
125Y66.3Low72.4Confident90 Ų90103.1 Ų103.135%0.35350%0.497SS..Hα-helixtrans-54.2-38.5-170.3-175.2-101.4000114.3S121 I127 C128 K129 M142S121-Y125 WeakPolarHBondContact O-CA 3.42Å; S121-Y125 WeakPolarHBondContact O-CB 3Å; S121-Y125 PolarHBondContact O-N 3.24Å; Y125-I127 VanDerWaalsContact C-N 3.33Å; Y125-I127 PolarHBondContact O-N 3.26Å; Y125-C128 PolarHBondContact O-N 3.41Å; Y125-K129 WeakPolarHBondContact O-CB 3.46Å; Y125-K129 PolarHBondContact O-N 2.8Å; Y125-M142 HydrophobicContact CE2-CE 3.72Å
126D63.5Low71Confident143 Ų14399.2 Ų99.277%0.76548%0.483SS*.Hα-helixtrans-64.9-34.8-177.5-66.8-43.9000113.1N124N124-D126 VanDerWaalsContact C-N 3.27Å; N124-D126 PolarHBondContact O-N 2.88Å; N124-D126 VanDerWaalsContact O-N 3.17Å
127I65.4Low69.7Low108 Ų10898.7 Ų98.755%0.55448%0.48SS*.Hα-helixtrans-82-40.7178-58.5174.5000109.9N124 Y125 K129 Y131N124-I127 PolarHBondContact O-N 3.27Å; N124-I127 VanDerWaalsContact O-N 3.14Å; Y125-I127 VanDerWaalsContact C-N 3.33Å; Y125-I127 PolarHBondContact O-N 3.26Å; I127-K129 PolarHBondContact O-N 3.47Å; I127-Y131 HydrophobicContact CG2-CE2 4.2Å; I127-Y131 WeakPolarHBondContact O-CD2 3.3Å
128C67.4Low68.5Low15 Ų15102.7 Ų102.710%0.10150%0.496CS..Hα-helixtrans-74.4-24.7-173.3-151.60000113.3S121 N124 Y125 V130 Y131 L132S121-C128 WeakPolarHBondContact CB-SG 3.38Å; N124-C128 PolarHBondContact O-N 3.07Å; N124-C128 VanDerWaalsContact O-N 3.1Å; Y125-C128 PolarHBondContact O-N 3.41Å; C128-V130 PolarHBondContact O-N 3.03Å; C128-Y131 PolarHBondContact O-N 2.01Å; C128-Y131 VanDerWaalsContact O-N 3.09Å; C128-L132 HydrophobicContact CB-CD1 4.36Å; C128-L132 WeakPolarHBondContact O-CB 3.38Å; C128-L132 WeakPolarHBondContact O-CG 2.88Å; C128-L132 PolarHBondContact O-N 3.44Å
129K68.1Low67.1Low116 Ų11699.6 Ų99.650%0.50449%0.487SS..Hα-helixtrans-54.5-36.7177.8-176.6179.2177.6-178.70113.4Y125 I127 A133Y125-K129 WeakPolarHBondContact O-CB 3.46Å; Y125-K129 PolarHBondContact O-N 2.8Å; I127-K129 PolarHBondContact O-N 3.47Å; K129-A133 WeakPolarHBondContact O-CB 3.4Å; K129-A133 PolarHBondContact O-N 3.34Å
130V63.7Low65.6Low103 Ų103103.1 Ų103.162%0.62450%0.499SS*.Hα-helixtrans-70.6-40.3179.1-178.60000111.2C128 R134C128-V130 PolarHBondContact O-N 3.03Å; V130-R134 WeakPolarHBondContact O-CB 3.5Å; V130-R134 PolarHBondContact O-N 3.25Å; V130-R134 VanDerWaalsContact O-N 3.11Å
131Y66.2Low64.2Low156 Ų156106.2 Ų106.261%0.61251%0.51SS*.Hα-helixtrans-71.2-43.3178.4-67.1-77.8000112I127 C128 R134 W135I127-Y131 HydrophobicContact CG2-CE2 4.2Å; I127-Y131 WeakPolarHBondContact O-CD2 3.3Å; C128-Y131 PolarHBondContact O-N 2.01Å; C128-Y131 VanDerWaalsContact O-N 3.09Å; Y131-R134 PolarHBondContact O-N 3.28Å; Y131-W135 PolarHBondContact O-N 3.34Å
132L65.4Low63.1Low30 Ų30108.4 Ų108.416%0.15752%0.52CS..Hα-helixtrans-64.8-39.8176.1-70.8168.8000112.2C128 R134 W135 G136 I137 M142C128-L132 HydrophobicContact CB-CD1 4.36Å; C128-L132 WeakPolarHBondContact O-CB 3.38Å; C128-L132 WeakPolarHBondContact O-CG 2.88Å; C128-L132 PolarHBondContact O-N 3.44Å; L132-R134 VanDerWaalsContact C-N 3.32Å; L132-R134 PolarHBondContact O-N 2.87Å; L132-W135 PolarHBondContact O-N 2.83Å; L132-G136 PolarHBondContact O-N 3.29Å; L132-I137 PolarHBondContact O-N 2.8Å; L132-M142 HydrophobicContact CB-CE 4.21Å; L132-M142 HydrophobicContact CD1-CE 3.7Å
133A61.2Low62Low47 Ų47114 Ų11439%0.38853%0.53SS..Hα-helixtrans-64.7-36.4174.400000112.3K129 G136K129-A133 WeakPolarHBondContact O-CB 3.4Å; K129-A133 PolarHBondContact O-N 3.34Å; A133-G136 PolarHBondContact O-N 3.46Å
134R62.5Low60.6Low207 Ų207113.1 Ų113.178%0.78152%0.524SS*.Hα-helixtrans-71.5-30177.4-170.2171.8-179.7168-0.4112.8V130 Y131 L132 G136V130-R134 WeakPolarHBondContact O-CB 3.5Å; V130-R134 PolarHBondContact O-N 3.25Å; V130-R134 VanDerWaalsContact O-N 3.11Å; Y131-R134 PolarHBondContact O-N 3.28Å; L132-R134 VanDerWaalsContact C-N 3.32Å; L132-R134 PolarHBondContact O-N 2.87Å; R134-G136 PolarHBondContact O-N 3.5Å
135W59.6Low59.2Low171 Ų171116.4 Ų116.465%0.64854%0.542SS*.THydrogen-bonded Turntrans-79.10.6173.1-85.418.9000114.2Y131 L132 I137Y131-W135 PolarHBondContact O-N 3.34Å; L132-W135 PolarHBondContact O-N 2.83Å; W135-I137 PolarHBondContact O-N 3.38Å
136G58Low58.4Low30 Ų30118.1 Ų118.131%0.30956%0.564SS.*THydrogen-bonded Turntrans76.57.4173.500000114.3L132 A133 R134 Q138L132-G136 PolarHBondContact O-N 3.29Å; A133-G136 PolarHBondContact O-N 3.46Å; R134-G136 PolarHBondContact O-N 3.5Å; G136-Q138 PolarHBondContact O-N 3.4Å
137I59.3Low57.6Low101 Ų101122.4 Ų122.452%0.51857%0.57SS.*  trans-78.364.8168.3-49.4176.3000107.4L132 W135 G139L132-I137 PolarHBondContact O-N 2.8Å; W135-I137 PolarHBondContact O-N 3.38Å; I137-G139 PolarHBondContact O-N 3.27Å
138Q57.8Low56.7Low158 Ų158128.4 Ų128.474%0.73859%0.585SS**  trans-7369.2164.4-86.2-87.6-26.300107.4G136 R140G136-Q138 PolarHBondContact O-N 3.4Å; Q138-R140 PolarHBondContact O-N 2.65Å; Q138-R140 VanDerWaalsContact O-N 3.17Å
139G52.9Low55.8Low28 Ų28139.2 Ų139.229%0.28962%0.624SS.*  trans-62.8118.417500000108.5I137 W141 M142I137-G139 PolarHBondContact O-N 3.27Å; G139-W141 PolarHBondContact O-N 3.22Å; G139-M142 WeakPolarHBondContact O-CB 2.81Å; G139-M142 PolarHBondContact O-N 3.29Å
140R51.8Low54.5Low241 Ų241136.3 Ų136.391%0.90963%0.627SS**G310 helixtrans-48-21.6160.3-108.4-177.7-163.5-135.85112.3Q138 M142 K143Q138-R140 PolarHBondContact O-N 2.65Å; Q138-R140 VanDerWaalsContact O-N 3.17Å; R140-M142 VanDerWaalsContact C-N 3.35Å; R140-K143 PolarHBondContact O-N 3.18Å
141W53.7Low53.3Low203 Ų203137.6 Ų137.677%0.76963%0.63SS**G310 helixtrans-68.7-21.9174-166.280.7000114.7G139 K143G139-W141 PolarHBondContact O-N 3.22Å; W141-K143 VanDerWaalsContact C-N 3.28Å; W141-K143 PolarHBondContact O-N 2.89Å
142M51.3Low52.2Low58 Ų58137.1 Ų137.129%0.28665%0.646SS.*G310 helixtrans-75.1-13.5174.6-85-178.5146.700113.5Y125 L132 G139 R140 Q144Y125-M142 HydrophobicContact CE2-CE 3.72Å; L132-M142 HydrophobicContact CB-CE 4.21Å; L132-M142 HydrophobicContact CD1-CE 3.7Å; G139-M142 WeakPolarHBondContact O-CB 2.81Å; G139-M142 PolarHBondContact O-N 3.29Å; R140-M142 VanDerWaalsContact C-N 3.35Å; M142-Q144 PolarHBondContact O-N 2.88Å
143K52.2Low51.2Low188 Ų188139.9 Ų139.982%0.81767%0.673SS**  trans-79.662.8164.6-73.2-167178.4-172.40109.1R140 W141 D145R140-K143 PolarHBondContact O-N 3.18Å; W141-K143 VanDerWaalsContact C-N 3.28Å; W141-K143 PolarHBondContact O-N 2.89Å; K143-D145 PolarHBondContact O-N 2.65Å
144Q48.3Very low50.4Low124 Ų124148.6 Ų148.658%0.57970%0.696SS**  trans-76.6114.3157.4-77.2-172.8-8.300106.8M142 P146M142-Q144 PolarHBondContact O-N 2.88Å; Q144-P146 WeakPolarHBondContact O-CD 3.1Å
145D48.2Very low49.3Very low128 Ų128143 Ų14368%0.68469%0.694SS**  trans-49.6122.7166.8-83-54.5000108.6K143 R147 R148K143-D145 PolarHBondContact O-N 2.65Å; D145-R147 PolarHBondContact O-N 3.4Å; D145-R148 PolarHBondContact O-N 3.22Å
146P49.5Very low48.3Very low125 Ų125140.7 Ų140.781%0.81270%0.701SS**THydrogen-bonded Turntrans-58-5.2177.8-23.332.1000114.1Q144Q144-P146 WeakPolarHBondContact O-CD 3.1Å
147R47.9Very low47.3Very low234 Ų234150.7 Ų150.788%0.88373%0.729SS**THydrogen-bonded Turntrans-81.3-18.9-175.9-67.4-83.6-162.8159.23.9114.2D145D145-R147 PolarHBondContact O-N 3.4Å
148R46.9Very low46.4Very low233 Ų233152.1 Ų152.188%0.87975%0.746SS**SBendtrans-95.3-15-171.1-156.7173.7-177.9-162.60.1115.1D145D145-R148 PolarHBondContact O-N 3.22Å
149W47.3Very low45.9Very low243 Ų243147.5 Ų147.592%0.9274%0.74SS**SBendtrans-118.440.1178-143.4-85.9000112.5
150G40.9Very low45Very low54 Ų54155.3 Ų155.356%0.55777%0.769SS**  trans-97.4103.6176.500000112.1
151N38.5Very low44.1Very low131 Ų131155.2 Ų155.270%0.70177%0.769SS**  trans62113.5153.6-65.6-54.1000119.2A153N151-A153 PolarHBondContact O-N 2.82Å; N151-A153 VanDerWaalsContact O-N 3.1Å
152P43.9Very low43.4Very low145 Ų145150.2 Ų150.294%0.94277%0.771SS**THydrogen-bonded Turntrans-68.62.2160.128.2-32.3000113.7
153A44Very low42.7Very low88 Ų88153.6 Ų153.673%0.72780%0.797SS**THydrogen-bonded Turntrans-98.918.4-171.300000115.7N151N151-A153 PolarHBondContact O-N 2.82Å; N151-A153 VanDerWaalsContact O-N 3.1Å
154R44.5Very low41.9Very low230 Ų230153.5 Ų153.587%0.86880%0.799SS**  trans-136.973.7174-145166.9-166.8143.10.7112.3
155A37.8Very low41.5Very low89 Ų89153.2 Ų153.274%0.73681%0.808SS**PPolyproline II helixtrans-54.3132.7158.500000109.3R157A155-R157 PolarHBondContact O-N 3.05Å
156P39Very low40.8Very low123 Ų123156.4 Ų156.480%0.79982%0.819SS**PPolyproline II helixtrans-70.8120.1173.2-10.525.6000109.1P158P156-P158 WeakPolarHBondContact O-CD 3.3Å
157R38.1Very low40.3Very low240 Ų240155.7 Ų155.791%0.90681%0.814SS**PPolyproline II helixtrans-67.6123.6158.6-90.8-178168155.6-2.9107.5A155 G159A155-R157 PolarHBondContact O-N 3.05Å; R157-G159 PolarHBondContact O-N 3.11Å
158P39.7Very low39.6Very low132 Ų132150.1 Ų150.186%0.85781%0.811SS**SBendtrans-77.2106.9175.129.5-28.9000108.2P156P156-P158 WeakPolarHBondContact O-CD 3.3Å
159G46.4Very low39.5Very low60 Ų60145.3 Ų145.362%0.61981%0.81SS**  trans154.869.3173.700000113.6R157R157-G159 PolarHBondContact O-N 3.11Å
160Q34.3Very low38.6Very low192 Ų192137.1 Ų137.190%0.89780%0.801SS**  trans-147.4111.2153.9-147.993.81400108.5
161R33Very low38.5Very low240 Ų240141 Ų14191%0.90682%0.816SS**PPolyproline II helixtrans-51.8138.7174.5-75175.7-175.4137.41.8110.4P163R161-P163 WeakPolarHBondContact O-CD 3.3Å
162A39.3Very low38.3Very low98 Ų98142.5 Ų142.581%0.8182%0.824SS**PPolyproline II helixtrans-58.9137.516700000110.7
163P37.2Very low38.3Very low128 Ų128140.5 Ų140.583%0.83181%0.811SS**PPolyproline II helixtrans-99.9126.6160.5-4.124.6000110.8R161R161-P163 WeakPolarHBondContact O-CD 3.3Å
164Q35.5Very low37.5Very low187 Ų187145.1 Ų145.187%0.87482%0.817SS**PPolyproline II helixtrans-61.6152.7171.5-166.9170-4.900111.8
165P38.5Very low36.6Very low117 Ų117138.5 Ų138.576%0.7681%0.811SS**PPolyproline II helixtrans-91.8136.2-172.932.9-30.8000113.3
166Q33.8Very low36.9Very low195 Ų195139.4 Ų139.491%0.91181%0.81SS**  trans-160.3149.6147.9-114.5178-1600112.9
167P40.8Very low36.5Very low110 Ų110142.2 Ų142.271%0.71481%0.812SS**  trans-110.5152.7-169.138.1-27000114.7
168S32.8Very low36.2Very low117 Ų117134.7 Ų134.782%0.81880%0.802SS**  trans148151130.4-64.10000113.5
169P43.3Very low35.9Very low132 Ų132134 Ų13486%0.85780%0.795SS**  trans-99152.2-16237.2-31.3000114.5
170G28.6Very low35.4Very low71 Ų71140 Ų14073%0.73281%0.806SS**  trans-161.9154.7167.400000112.7
171P39.5Very low35.3Very low136 Ų136136.4 Ų136.488%0.88380%0.798SS**  trans-92.2156.1-162.32.718.7000114.8
172L33.8Very low35.5Very low162 Ų162132.6 Ų132.685%0.84879%0.794SS**  trans-35.3159.4167.8-91.1134.9000115.6
173P43.7Very low35Very low103 Ų103139.3 Ų139.367%0.66980%0.799SS**  -155.1-178.453.333.6-7.4000119.4
174Q28.2Very low34.8Very low186 Ų186136.8 Ų136.887%0.86980%0.796SS**  trans99.5132.3153.2-86.9149.8-52.300122.6
175A26.3Very low34.6Very low90 Ų90135.2 Ų135.274%0.74479%0.794SS**  trans-83.5-159.2-175.800000112.7
176P44.2Very low34.2Very low109 Ų109133 Ų13371%0.70879%0.785SS**  cis-135-176.9-17.731.5-8.8000113.8
177Q30.1Very low34.2Very low181 Ų181132.5 Ų132.585%0.84678%0.782SS**  trans127153.2141.6-67.9-103.8-36.400119.4
178A31.7Very low34Very low83 Ų83132.7 Ų132.769%0.68679%0.786SS**  trans7988.8172.200000115.6
179V32.6Very low35.1Very low117 Ų117132.9 Ų132.971%0.70979%0.785SS**  46.299.568.6-172.10000112.6
180H36.3Very low35.4Very low186 Ų186132.2 Ų132.286%0.86178%0.781SS**  trans-154.6122.7134.2-83.4-34.9000112.1
181T32.1Very low36Very low116 Ų116135.8 Ų135.871%0.71278%0.782SS**  trans-47.7142.3166.540.70000117.4
182L37.1Very low36Very low160 Ų160138.5 Ų138.584%0.83879%0.785SS**  175107.4124.4-120.583.5000108.7
183R29.6Very low36.2Very low239 Ų239135.5 Ų135.590%0.90277%0.774SS**  65117.589.9-161.5177.3-168.2-1753.3114.5
184G32.3Very low36Very low76 Ų76139.4 Ų139.478%0.78478%0.781SS**  trans166.297.8163.800000113.5
185D31.2Very low36.5Very low154 Ų154138.6 Ų138.682%0.82478%0.777SS**  trans-73.6157.6-173.5-78.6-61.9000116.7
186A29.8Very low37.1Very low69 Ų69140 Ų14057%0.5778%0.782SS**  trans78.3122.6138.100000121.4
187H34.3Very low37.1Very low185 Ų185140.6 Ų140.686%0.85679%0.788SS**  165131.898.8-81.389.1000111.1
188S36.2Very low37.8Very low114 Ų114137.6 Ų137.680%0.79779%0.787SS**  trans-107.2-177.1162.1-59.20000109.3
189P57.1Low38.2Very low121 Ų121142.2 Ų142.279%0.78683%0.825SS**  -108.6-161.4-84.436.6-17.9000111.2
190P48.9Very low38.4Very low119 Ų119143.5 Ų143.577%0.77383%0.831SS**  -153.8170.685.537.7-16.2000117.8
191L41Very low38.6Very low146 Ų146141.2 Ų141.276%0.76483%0.829SS**  trans-42.2145.6160.7-100.374.7000114.3
192M39.7Very low38.9Very low193 Ų193142.6 Ų142.695%0.95184%0.836SS**  trans-146.7145.9140.6-86.1-56.4171.500111.4
193T38.3Very low39Very low98 Ų98141.6 Ų141.660%0.60184%0.835SS**  trans-119.8159.1-164.8-28.30000109.9
194F38.2Very low39.6Very low185 Ų185135.5 Ų135.581%0.81183%0.831SS**  trans70.6148.6167-74.5-81.5000116.7
195Q38.4Very low40.1Very low170 Ų170139.5 Ų139.579%0.79484%0.835SS**  cis-163140.229.1-145.5176.320.200110.4
196S40.9Very low40.7Very low120 Ų120138.4 Ų138.484%0.83984%0.835SS**  trans-77138.4159.1-74.90000109.8
197S42.9Very low41.6Very low121 Ų121143.8 Ų143.885%0.84686%0.856SS**  trans-154123.1152-104.60000110.3
198S44.2Very low42.2Very low118 Ų118140.3 Ų140.383%0.82586%0.856SS**  trans-96.4140166.348.10000109.4
199A40.4Very low42.7Very low179 Ų179142.7 Ų142.7100%1.47986%0.861SS**  trans-154.80148.300000107.7

Retrieved 199 of 199 residues in 30.5 ms (Link to these results)