A0A077ZHM2_TRITR Loading...

G-protein coupled receptors family 1 profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZHM2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 336 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
1M54.7Low82.2Confident247 Ų247121.4 Ų121.4100%1.21763%0.625SS**  0136.30-74.8165.285.400108.8R3M1-R3 PolarHBondContact O-N 3.28Å
2N72.7Confident82.9Confident116 Ų116115.6 Ų115.662%0.6261%0.609SS**  trans-63105.9-154.1-101.2-19.3000116.2S4 A5 Q6N2-S4 PolarHBondContact O-N 3.01Å; N2-A5 HydrophobicContact CB-CB 3.64Å; N2-A5 PolarHBondContact O-N 3.35Å; N2-Q6 PolarHBondContact O-N 3.18Å
3R80.1Confident83.7Confident205 Ų205114.5 Ų114.577%0.77460%0.604SS**Hα-helixtrans-58.6-36168.8-165.9177.8-176.9-1751112.1M1 Q6 I7M1-R3 PolarHBondContact O-N 3.28Å; R3-Q6 PolarHBondContact O-N 3.33Å; R3-I7 HydrophobicContact CG-CD1 4.09Å; R3-I7 VanDerWaalsContact O-CG1 3.27Å; R3-I7 WeakPolarHBondContact O-CG1 3.48Å; R3-I7 PolarHBondContact O-N 2.97Å
4S81.2Confident84.4Confident77 Ų77113.5 Ų113.554%0.53860%0.598SS.*Hα-helixtrans-64.2-45177.253.20000113.1N2 Q6 I7 S8N2-S4 PolarHBondContact O-N 3.01Å; S4-Q6 VanDerWaalsContact C-N 3.32Å; S4-Q6 PolarHBondContact O-N 3.48Å; S4-I7 PolarHBondContact O-N 3.07Å; S4-S8 WeakPolarHBondContact O-CB 3.27Å; S4-S8 PolarHBondContact O-N 3.4Å
5A83.4Confident84.8Confident44 Ų44109.9 Ų109.936%0.36459%0.586SS.*Hα-helixtrans-66.7-35.2177.700000111.9N2 K9N2-A5 HydrophobicContact CB-CB 3.64Å; N2-A5 PolarHBondContact O-N 3.35Å; A5-K9 WeakPolarHBondContact O-CG 3.42Å; A5-K9 PolarHBondContact O-N 3.43Å; A5-K9 VanDerWaalsContact O-N 3.11Å
6Q85.9Confident85.2Confident138 Ų138110.6 Ų110.665%0.64559%0.585SS**Hα-helixtrans-67.6-45.6175.4-168.8174.1-16.800111.4N2 R3 S4 S8 K9 T10N2-Q6 PolarHBondContact O-N 3.18Å; R3-Q6 PolarHBondContact O-N 3.33Å; S4-Q6 VanDerWaalsContact C-N 3.32Å; S4-Q6 PolarHBondContact O-N 3.48Å; Q6-S8 PolarHBondContact O-N 3.11Å; Q6-K9 PolarHBondContact O-N 3.21Å; Q6-T10 PolarHBondContact O-N 3.45Å; Q6-T10 PolarHBondContact O-OG1 3.42Å; Q6-T10 VanDerWaalsContact O-OG1 3.07Å
7I87.2Confident85.6Confident89 Ų89111.7 Ų111.746%0.45659%0.586SS.*Hα-helixtrans-60.1-44.7175.8-68.8165.5000111R3 S4 K9 T10 I11R3-I7 HydrophobicContact CG-CD1 4.09Å; R3-I7 VanDerWaalsContact O-CG1 3.27Å; R3-I7 WeakPolarHBondContact O-CG1 3.48Å; R3-I7 PolarHBondContact O-N 2.97Å; S4-I7 PolarHBondContact O-N 3.07Å; I7-K9 PolarHBondContact O-N 3.46Å; I7-T10 PolarHBondContact O-N 3.46Å; I7-I11 HydrophobicContact CG2-CD1 3.74Å; I7-I11 HydrophobicContact CG2-CG1 4.36Å; I7-I11 WeakPolarHBondContact O-CG1 3.43Å; I7-I11 PolarHBondContact O-N 3.01Å
8S88.9Confident85.8Confident79 Ų79109.9 Ų109.955%0.55258%0.581SS**Hα-helixtrans-61.4-42.3178.8178.90000112.4S4 Q6 I11 A12S4-S8 WeakPolarHBondContact O-CB 3.27Å; S4-S8 PolarHBondContact O-N 3.4Å; Q6-S8 PolarHBondContact O-N 3.11Å; S8-I11 PolarHBondContact O-N 3.42Å; S8-A12 WeakPolarHBondContact O-CB 3.36Å; S8-A12 PolarHBondContact O-N 3Å
9K89.1Confident86Confident153 Ų153110.6 Ų110.667%0.66558%0.584SS**Hα-helixtrans-63.4-41.4173.8-74.6-178.1179.1-173.20112.4A5 Q6 I7 A12 N13A5-K9 WeakPolarHBondContact O-CG 3.42Å; A5-K9 PolarHBondContact O-N 3.43Å; A5-K9 VanDerWaalsContact O-N 3.11Å; Q6-K9 PolarHBondContact O-N 3.21Å; I7-K9 PolarHBondContact O-N 3.46Å; K9-A12 PolarHBondContact O-N 3Å; K9-N13 PolarHBondContact O-N 3.39Å; K9-N13 PolarHBondContact O-OD1 3.32Å
10T90.5Very high86.2Confident87 Ų87109.3 Ų109.353%0.53458%0.577SS.*Hα-helixtrans-63.2-43.2177.1-57.80000111.8Q6 I7 N13 L14Q6-T10 PolarHBondContact O-N 3.45Å; Q6-T10 PolarHBondContact O-OG1 3.42Å; Q6-T10 VanDerWaalsContact O-OG1 3.07Å; I7-T10 PolarHBondContact O-N 3.46Å; T10-N13 PolarHBondContact O-N 2.93Å; T10-L14 WeakPolarHBondContact O-CB 3.4Å; T10-L14 PolarHBondContact O-N 3.43Å
11I90.2Very high86.3Confident100 Ų100109.6 Ų109.651%0.51358%0.578SS.*Hα-helixtrans-64.1-43.2177.1-67168.8000110.8I7 S8 L14 S15I7-I11 HydrophobicContact CG2-CD1 3.74Å; I7-I11 HydrophobicContact CG2-CG1 4.36Å; I7-I11 WeakPolarHBondContact O-CG1 3.43Å; I7-I11 PolarHBondContact O-N 3.01Å; S8-I11 PolarHBondContact O-N 3.42Å; I11-L14 PolarHBondContact O-N 3.45Å; I11-S15 WeakPolarHBondContact O-CB 3.5Å; I11-S15 PolarHBondContact O-N 2.69Å; I11-S15 PolarHBondContact O-OG 3.32Å
12A90.7Very high87.7Confident52 Ų52101.6 Ų101.643%0.4354%0.543SS..Hα-helixtrans-61.9-45.2177.800000112.2S8 K9 S15 Q16S8-A12 WeakPolarHBondContact O-CB 3.36Å; S8-A12 PolarHBondContact O-N 3Å; K9-A12 PolarHBondContact O-N 3Å; A12-S15 PolarHBondContact O-N 2.95Å; A12-Q16 PolarHBondContact O-N 2.93Å
13N93.2Very high88.2Confident101 Ų10198.9 Ų98.954%0.5453%0.534SS..Hα-helixtrans-62.8-45.6177.3-71.70.8000111.8K9 T10 S15 Q16 E17K9-N13 PolarHBondContact O-N 3.39Å; K9-N13 PolarHBondContact O-OD1 3.32Å; T10-N13 PolarHBondContact O-N 2.93Å; N13-S15 VanDerWaalsContact C-N 3.31Å; N13-S15 PolarHBondContact O-N 3.49Å; N13-Q16 PolarHBondContact O-N 3Å; N13-E17 WeakPolarHBondContact O-CG 3.4Å; N13-E17 PolarHBondContact O-N 3.23Å
14L93.6Very high88.4Confident101 Ų10193.7 Ų93.753%0.52952%0.521SS..Hα-helixtrans-61.9-40.5177.4-176.167.4000111.6T10 I11 Q16 E17 V18T10-L14 WeakPolarHBondContact O-CB 3.4Å; T10-L14 PolarHBondContact O-N 3.43Å; I11-L14 PolarHBondContact O-N 3.45Å; L14-Q16 VanDerWaalsContact C-N 3.32Å; L14-Q16 PolarHBondContact O-N 3.04Å; L14-E17 PolarHBondContact O-N 3.42Å; L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.45Å
15S91.2Very high88.4Confident60 Ų6093.3 Ų93.342%0.4252%0.515SS..Hα-helixtrans-62.1-41.3177.3-54.30000111.4I11 A12 N13 V18 L19I11-S15 WeakPolarHBondContact O-CB 3.5Å; I11-S15 PolarHBondContact O-N 2.69Å; I11-S15 PolarHBondContact O-OG 3.32Å; A12-S15 PolarHBondContact O-N 2.95Å; N13-S15 VanDerWaalsContact C-N 3.31Å; N13-S15 PolarHBondContact O-N 3.49Å; S15-V18 PolarHBondContact O-N 3.01Å; S15-L19 WeakPolarHBondContact O-CB 3.34Å; S15-L19 WeakPolarHBondContact O-CG 3.49Å; S15-L19 PolarHBondContact O-N 2.89Å
16Q91.3Very high88.2Confident121 Ų12195 Ų9557%0.56552%0.522SS*.Hα-helixtrans-71.7-37178.4-167.6164.2-11.500112.5A12 N13 L14 L19 N20A12-Q16 PolarHBondContact O-N 2.93Å; N13-Q16 PolarHBondContact O-N 3Å; L14-Q16 VanDerWaalsContact C-N 3.32Å; L14-Q16 PolarHBondContact O-N 3.04Å; Q16-L19 PolarHBondContact O-N 3.37Å; Q16-N20 WeakPolarHBondContact O-CB 3.28Å; Q16-N20 PolarHBondContact O-N 2.9Å; Q16-N20 PolarHBondContact O-ND2 3.45Å
17E91.8Very high87.8Confident129 Ų12994 Ų9460%0.60352%0.517SS*.Hα-helixtrans-62.1-43.9171.6-77.2177.6-17700112N13 L14 N20 L21N13-E17 WeakPolarHBondContact O-CG 3.4Å; N13-E17 PolarHBondContact O-N 3.23Å; L14-E17 PolarHBondContact O-N 3.42Å; E17-N20 PolarHBondContact O-N 2.95Å; E17-L21 WeakPolarHBondContact O-CB 3.41Å; E17-L21 PolarHBondContact O-N 3.41Å
18V89.5Confident87.4Confident80 Ų8096.1 Ų96.149%0.48552%0.523SS..Hα-helixtrans-64.8-41.5177.2170.90000111.6L14 S15 L21 T22L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.45Å; S15-V18 PolarHBondContact O-N 3.01Å; V18-L21 PolarHBondContact O-N 2.81Å; V18-T22 WeakPolarHBondContact O-CB 3.46Å; V18-T22 PolarHBondContact O-N 3.24Å; V18-T22 PolarHBondContact O-OG1 3.29Å
19L88.9Confident86.8Confident122 Ų12298.6 Ų98.664%0.63953%0.526SS*.Hα-helixtrans-62.3-47.2175.3-77.9167.2000111.6S15 Q16 L21 T22 S23S15-L19 WeakPolarHBondContact O-CB 3.34Å; S15-L19 WeakPolarHBondContact O-CG 3.49Å; S15-L19 PolarHBondContact O-N 2.89Å; Q16-L19 PolarHBondContact O-N 3.37Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 2.96Å; L19-T22 PolarHBondContact O-N 3.34Å; L19-S23 PolarHBondContact O-N 3.38Å; L19-S23 PolarHBondContact O-OG 3.43Å
20N89.6Confident86.2Confident84 Ų8494 Ų9445%0.44951%0.513SS..Hα-helixtrans-63-37.3177-71.2-13.4000112.1Q16 E17 S23 N24Q16-N20 WeakPolarHBondContact O-CB 3.28Å; Q16-N20 PolarHBondContact O-N 2.9Å; Q16-N20 PolarHBondContact O-ND2 3.45Å; E17-N20 PolarHBondContact O-N 2.95Å; N20-S23 WeakPolarHBondContact CA-OG 3.37Å; N20-S23 PolarHBondContact O-OG 3.32Å; N20-N24 VanDerWaalsContact O-CB 3.27Å; N20-N24 WeakPolarHBondContact O-CB 3.27Å; N20-N24 PolarHBondContact O-N 3.3Å; N20-N24 PolarHBondContact O-ND2 3Å; N20-N24 PolarHBondContact O-OD1 2.92Å
21L88.3Confident85.8Confident116 Ų11694.2 Ų94.261%0.60751%0.511SS*.Hα-helixtrans-66.2-43176.4-163.577.6000110.7E17 V18 L19 N24 V25E17-L21 WeakPolarHBondContact O-CB 3.41Å; E17-L21 PolarHBondContact O-N 3.41Å; V18-L21 PolarHBondContact O-N 2.81Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 2.96Å; L21-N24 PolarHBondContact O-N 3.45Å; L21-V25 WeakPolarHBondContact O-CB 3.29Å; L21-V25 WeakPolarHBondContact O-CG2 3.39Å; L21-V25 PolarHBondContact O-N 3.46Å
22T84.9Confident85.4Confident79 Ų7993.4 Ų93.449%0.48551%0.507SS..Hα-helixtrans-69.3-40.1-179.1-52.80000111.4V18 L19 V25 T26V18-T22 WeakPolarHBondContact O-CB 3.46Å; V18-T22 PolarHBondContact O-N 3.24Å; V18-T22 PolarHBondContact O-OG1 3.29Å; L19-T22 PolarHBondContact O-N 3.34Å; T22-V25 PolarHBondContact O-N 2.9Å; T22-T26 WeakPolarHBondContact O-CB 3.21Å; T22-T26 PolarHBondContact O-N 2.84Å; T22-T26 PolarHBondContact O-OG1 2.89Å
23S82.8Confident84.8Confident59 Ų5993.6 Ų93.641%0.41351%0.509SS..Hα-helixtrans-62.2-45.8173.164.60000111.4L19 N20 V25 T26 E27L19-S23 PolarHBondContact O-N 3.38Å; L19-S23 PolarHBondContact O-OG 3.43Å; N20-S23 WeakPolarHBondContact CA-OG 3.37Å; N20-S23 PolarHBondContact O-OG 3.32Å; S23-V25 PolarHBondContact O-N 3.39Å; S23-T26 PolarHBondContact O-N 2.74Å; S23-E27 VanDerWaalsContact O-CB 3.29Å; S23-E27 WeakPolarHBondContact O-CB 3.45Å; S23-E27 PolarHBondContact O-N 2.94Å
24N84.4Confident84.4Confident96 Ų9692.6 Ų92.651%0.51351%0.507SS..Hα-helixtrans-65.5-37.7179.3-70.1-6.1000112.3N20 L21 K28N20-N24 VanDerWaalsContact O-CB 3.27Å; N20-N24 WeakPolarHBondContact O-CB 3.27Å; N20-N24 PolarHBondContact O-N 3.3Å; N20-N24 PolarHBondContact O-ND2 3Å; N20-N24 PolarHBondContact O-OD1 2.92Å; L21-N24 PolarHBondContact O-N 3.45Å; N24-K28 WeakPolarHBondContact O-CB 3.36Å; N24-K28 PolarHBondContact O-N 3.28Å
25V81.7Confident84Confident69 Ų6994.4 Ų94.442%0.41851%0.511SS..Hα-helixtrans-65.7-46.2175169.90000110.4L21 T22 S23 K28 E29L21-V25 WeakPolarHBondContact O-CB 3.29Å; L21-V25 WeakPolarHBondContact O-CG2 3.39Å; L21-V25 PolarHBondContact O-N 3.46Å; T22-V25 PolarHBondContact O-N 2.9Å; S23-V25 PolarHBondContact O-N 3.39Å; V25-K28 PolarHBondContact O-N 2.87Å; V25-E29 HydrophobicContact CG1-CG 4.41Å; V25-E29 WeakPolarHBondContact O-CB 3.4Å; V25-E29 WeakPolarHBondContact O-CG 3.17Å; V25-E29 PolarHBondContact O-N 3.29Å
26T78.5Confident83.8Confident81 Ų8197.4 Ų97.450%0.49752%0.518SS..Hα-helixtrans-64.8-43.1-180-52.10000111.2T22 S23 E29 S30T22-T26 WeakPolarHBondContact O-CB 3.21Å; T22-T26 PolarHBondContact O-N 2.84Å; T22-T26 PolarHBondContact O-OG1 2.89Å; S23-T26 PolarHBondContact O-N 2.74Å; T26-E29 PolarHBondContact O-N 3.41Å; T26-S30 WeakPolarHBondContact O-CB 3.48Å; T26-S30 PolarHBondContact O-N 2.91Å; T26-S30 PolarHBondContact O-OG 3.38Å
27E77.6Confident83.5Confident115 Ų11596 Ų9654%0.53751%0.512SS..Hα-helixtrans-62.6-44.7175.7-173.4179.2174.800110.7S23 S30 N31S23-E27 VanDerWaalsContact O-CB 3.29Å; S23-E27 WeakPolarHBondContact O-CB 3.45Å; S23-E27 PolarHBondContact O-N 2.94Å; E27-S30 WeakPolarHBondContact CA-OG 3.37Å; E27-S30 PolarHBondContact O-N 2.84Å; E27-S30 PolarHBondContact O-OG 3.44Å; E27-N31 WeakPolarHBondContact O-CB 3.47Å; E27-N31 PolarHBondContact O-N 3.29Å; E27-N31 PolarHBondContact O-ND2 2.92Å
28K78.4Confident83.4Confident135 Ų13592.6 Ų92.659%0.58750%0.499SS*.Hα-helixtrans-61.9-47.6175.9-173.6179.6177.5-174.40112.2N24 V25 S30 N31 D32N24-K28 WeakPolarHBondContact O-CB 3.36Å; N24-K28 PolarHBondContact O-N 3.28Å; V25-K28 PolarHBondContact O-N 2.87Å; K28-S30 VanDerWaalsContact C-N 3.28Å; K28-S30 PolarHBondContact O-N 2.7Å; K28-N31 PolarHBondContact O-N 2.98Å; K28-D32 WeakPolarHBondContact O-CB 3.31Å; K28-D32 PolarHBondContact O-N 2.92Å
29E76.1Confident83.5Confident130 Ų13091.6 Ų91.661%0.60749%0.493SS*.Hα-helixtrans-60-39.4176.4-74.5-179.5164.400111.6V25 T26 A33V25-E29 HydrophobicContact CG1-CG 4.41Å; V25-E29 WeakPolarHBondContact O-CB 3.4Å; V25-E29 WeakPolarHBondContact O-CG 3.17Å; V25-E29 PolarHBondContact O-N 3.29Å; T26-E29 PolarHBondContact O-N 3.41Å; E29-A33 VanDerWaalsContact O-CB 3.31Å; E29-A33 WeakPolarHBondContact O-CB 3.35Å; E29-A33 PolarHBondContact O-N 2.96Å
30S77.5Confident83.5Confident58 Ų5888.4 Ų88.441%0.40647%0.473SS..Hα-helixtrans-66.7-39.5175.876.70000112.6T26 E27 K28 T34T26-S30 WeakPolarHBondContact O-CB 3.48Å; T26-S30 PolarHBondContact O-N 2.91Å; T26-S30 PolarHBondContact O-OG 3.38Å; E27-S30 WeakPolarHBondContact CA-OG 3.37Å; E27-S30 PolarHBondContact O-N 2.84Å; E27-S30 PolarHBondContact O-OG 3.44Å; K28-S30 VanDerWaalsContact C-N 3.28Å; K28-S30 PolarHBondContact O-N 2.7Å; S30-T34 WeakPolarHBondContact O-CB 3.43Å; S30-T34 PolarHBondContact O-N 2.85Å; S30-T34 PolarHBondContact O-OG1 3.19Å
31N82.7Confident83.6Confident90 Ų9084.7 Ų84.748%0.48145%0.453SS..Hα-helixtrans-68.9-42.4177.5-73.7-25.4000111.4E27 K28 T34 F35E27-N31 WeakPolarHBondContact O-CB 3.47Å; E27-N31 PolarHBondContact O-N 3.29Å; E27-N31 PolarHBondContact O-ND2 2.92Å; K28-N31 PolarHBondContact O-N 2.98Å; N31-T34 PolarHBondContact O-N 2.71Å; N31-F35 WeakPolarHBondContact O-CB 3.35Å; N31-F35 PolarHBondContact O-N 3Å
32D81.2Confident83.9Confident83 Ų8385.6 Ų85.644%0.44445%0.448SS..Hα-helixtrans-64.5-45.5177.5-72.4-18.1000110.7K28 T34 F35 E36K28-D32 WeakPolarHBondContact O-CB 3.31Å; K28-D32 PolarHBondContact O-N 2.92Å; D32-T34 VanDerWaalsContact C-N 3.34Å; D32-T34 PolarHBondContact O-N 3.38Å; D32-F35 PolarHBondContact O-N 3.15Å; D32-E36 WeakPolarHBondContact O-CG 3.48Å; D32-E36 PolarHBondContact O-N 3.38Å
33A78.1Confident84.4Confident56 Ų5684.8 Ų84.846%0.46344%0.44SS..Hα-helixtrans-62.1-40.917600000112.4E29 Q37E29-A33 VanDerWaalsContact O-CB 3.31Å; E29-A33 WeakPolarHBondContact O-CB 3.35Å; E29-A33 PolarHBondContact O-N 2.96Å; A33-Q37 WeakPolarHBondContact O-CB 3.29Å; A33-Q37 PolarHBondContact O-N 3.39Å
34T83.8Confident84.9Confident80 Ų8082.2 Ų82.249%0.49142%0.422SS..Hα-helixtrans-64.2-44.9176.2-57.30000110.8S30 N31 D32 Q37 T38S30-T34 WeakPolarHBondContact O-CB 3.43Å; S30-T34 PolarHBondContact O-N 2.85Å; S30-T34 PolarHBondContact O-OG1 3.19Å; N31-T34 PolarHBondContact O-N 2.71Å; D32-T34 VanDerWaalsContact C-N 3.34Å; D32-T34 PolarHBondContact O-N 3.38Å; T34-Q37 PolarHBondContact O-N 3.29Å; T34-T38 PolarHBondContact O-N 3.46Å; T34-T38 PolarHBondContact O-OG1 3.19Å
35F86.8Confident85.5Confident140 Ų14078.2 Ų78.261%0.61440%0.401SS*.Hα-helixtrans-60.7-47.1177.3178.1-101.4000112.1N31 D32 Q37 T38 V39N31-F35 WeakPolarHBondContact O-CB 3.35Å; N31-F35 PolarHBondContact O-N 3Å; D32-F35 PolarHBondContact O-N 3.15Å; F35-Q37 VanDerWaalsContact C-N 3.31Å; F35-Q37 PolarHBondContact O-N 3.07Å; F35-T38 PolarHBondContact O-N 2.89Å; F35-V39 HydrophobicContact CD1-CG2 4.26Å; F35-V39 HydrophobicContact CD2-CG2 4.38Å; F35-V39 HydrophobicContact CE1-CG2 3.82Å; F35-V39 HydrophobicContact CE2-CG2 3.95Å; F35-V39 HydrophobicContact CZ-CG2 3.66Å; F35-V39 WeakPolarHBondContact O-CG2 3.46Å; F35-V39 PolarHBondContact O-N 2.92Å
36E86.2Confident86.2Confident122 Ų12278.4 Ų78.457%0.5740%0.402SS*.Hα-helixtrans-59.6-40.8176.7-74-169.3174.400112.4D32 R40D32-E36 WeakPolarHBondContact O-CG 3.48Å; D32-E36 PolarHBondContact O-N 3.38Å; E36-R40 VanDerWaalsContact O-CB 3.25Å; E36-R40 WeakPolarHBondContact O-CB 3.39Å; E36-R40 PolarHBondContact O-N 3.32Å
37Q85Confident87Confident93 Ų9375 Ų7544%0.43538%0.381SS..Hα-helixtrans-65.4-43.7176.3-176.2174.3-4.500111.7A33 T34 F35 R40 N41A33-Q37 WeakPolarHBondContact O-CB 3.29Å; A33-Q37 PolarHBondContact O-N 3.39Å; T34-Q37 PolarHBondContact O-N 3.29Å; F35-Q37 VanDerWaalsContact C-N 3.31Å; F35-Q37 PolarHBondContact O-N 3.07Å; Q37-R40 PolarHBondContact O-N 3.16Å; Q37-N41 WeakPolarHBondContact O-CB 3.47Å; Q37-N41 PolarHBondContact O-N 2.95Å; Q37-N41 PolarHBondContact O-ND2 3.27Å
38T89.2Confident88Confident56 Ų5669.5 Ų69.534%0.34436%0.356SS..Hα-helixtrans-61-48.4176.5-59.20000111.4T34 F35 R40 N41 W42 L97T34-T38 PolarHBondContact O-N 3.46Å; T34-T38 PolarHBondContact O-OG1 3.19Å; F35-T38 PolarHBondContact O-N 2.89Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 3.15Å; T38-N41 PolarHBondContact O-N 3.44Å; T38-W42 VanDerWaalsContact O-CD1 3.23Å; T38-W42 PolarHBondContact O-N 3.03Å; T38-L97 HydrophobicContact CG2-CD2 4.19Å
39V91.4Very high88.9Confident59 Ų5966.4 Ų66.436%0.35835%0.345SS..Hα-helixtrans-59.5-45.8177.8171.30000110.7F35 N41 W42 I43F35-V39 HydrophobicContact CD1-CG2 4.26Å; F35-V39 HydrophobicContact CD2-CG2 4.38Å; F35-V39 HydrophobicContact CE1-CG2 3.82Å; F35-V39 HydrophobicContact CE2-CG2 3.95Å; F35-V39 HydrophobicContact CZ-CG2 3.66Å; F35-V39 WeakPolarHBondContact O-CG2 3.46Å; F35-V39 PolarHBondContact O-N 2.92Å; V39-N41 PolarHBondContact O-N 3.12Å; V39-W42 WeakPolarHBondContact O-CB 3.31Å; V39-W42 PolarHBondContact O-N 3.29Å; V39-I43 HydrophobicContact CG1-CD1 4.09Å; V39-I43 WeakPolarHBondContact O-CG1 3.24Å; V39-I43 PolarHBondContact O-N 3.3Å
40R89.9Confident89.9Confident56 Ų5664.4 Ų64.421%0.21134%0.338CS..Hα-helixtrans-58.1-48.2177.3-176.2-169.9-53.2-96.8-3112E36 Q37 T38 W42 I43 F44 S283E36-R40 VanDerWaalsContact O-CB 3.25Å; E36-R40 WeakPolarHBondContact O-CB 3.39Å; E36-R40 PolarHBondContact O-N 3.32Å; Q37-R40 PolarHBondContact O-N 3.16Å; T38-R40 VanDerWaalsContact C-N 3.33Å; T38-R40 PolarHBondContact O-N 3.15Å; R40-W42 VanDerWaalsContact C-N 3.31Å; R40-W42 PolarHBondContact O-N 3.11Å; R40-I43 PolarHBondContact O-N 2.77Å; R40-I43 VanDerWaalsContact O-N 3.15Å; R40-F44 HydrophobicContact CG-CD2 4.08Å; R40-F44 HydrophobicContact CG-CE2 3.78Å; R40-F44 VanDerWaalsContact O-CD2 3.3Å; R40-F44 WeakPolarHBondContact O-CD2 3.47Å; R40-F44 PolarHBondContact O-N 3.33Å; R40-F44 VanDerWaalsContact O-N 3.09Å; R40-S283 PolarHBondContact NH1-OG 3.37Å
41N91.8Very high90.8Very high5 Ų561.7 Ų61.73%0.02732%0.319CS..Hα-helixtrans-62.1-39.5179.1-75.7-21.2000111.7Q37 T38 V39 I43 F44 V45 H93 Q96 L97Q37-N41 WeakPolarHBondContact O-CB 3.47Å; Q37-N41 PolarHBondContact O-N 2.95Å; Q37-N41 PolarHBondContact O-ND2 3.27Å; T38-N41 PolarHBondContact O-N 3.44Å; V39-N41 PolarHBondContact O-N 3.12Å; N41-I43 PolarHBondContact O-N 3.49Å; N41-F44 PolarHBondContact O-N 3.21Å; N41-V45 WeakPolarHBondContact O-CG2 3.48Å; N41-V45 PolarHBondContact O-N 3.23Å; N41-H93 HydrophobicContact CB-CB 4.27Å; N41-H93 PolarHBondContact OD1-ND1 3.04Å; N41-Q96 VanDerWaalsContact ND2-CB 3.31Å; N41-Q96 WeakPolarHBondContact ND2-CB 3.42Å; N41-L97 HydrophobicContact CB-CD2 3.58Å; N41-L97 HydrophobicContact CB-CG 4.07Å
42W94.6Very high91.6Very high135 Ų13559.4 Ų59.451%0.51131%0.306SS..Hα-helixtrans-60.6-42.1172.4-85114000112.9T38 V39 R40 F44 V45 V46 L97T38-W42 VanDerWaalsContact O-CD1 3.23Å; T38-W42 PolarHBondContact O-N 3.03Å; V39-W42 WeakPolarHBondContact O-CB 3.31Å; V39-W42 PolarHBondContact O-N 3.29Å; R40-W42 VanDerWaalsContact C-N 3.31Å; R40-W42 PolarHBondContact O-N 3.11Å; W42-F44 VanDerWaalsContact C-N 3.33Å; W42-F44 PolarHBondContact O-N 2.95Å; W42-V45 PolarHBondContact O-N 3.13Å; W42-V46 WeakPolarHBondContact O-CB 2.99Å; W42-V46 VanDerWaalsContact O-CG2 3.31Å; W42-V46 WeakPolarHBondContact O-CG2 3.37Å; W42-V46 PolarHBondContact O-N 2.96Å; W42-L97 HydrophobicContact CD2-CD1 3.8Å; W42-L97 HydrophobicContact CD2-CD2 4.33Å; W42-L97 HydrophobicContact CE3-CD1 4.02Å; W42-L97 HydrophobicContact CG-CD1 4.31Å; W42-L97 HydrophobicContact CG-CD2 4.12Å; W42-L97 HydrophobicContact CH2-CD1 4.24Å; W42-L97 HydrophobicContact CZ2-CD1 4.03Å; W42-L97 HydrophobicContact CZ3-CD1 4.23Å
43I94.5Very high92.3Very high63 Ų6362.5 Ų62.532%0.32332%0.316SS..Hα-helixtrans-62.4-42.1177.5-62.2163.5000110.7V39 R40 N41 S47 L286V39-I43 HydrophobicContact CG1-CD1 4.09Å; V39-I43 WeakPolarHBondContact O-CG1 3.24Å; V39-I43 PolarHBondContact O-N 3.3Å; R40-I43 PolarHBondContact O-N 2.77Å; R40-I43 VanDerWaalsContact O-N 3.15Å; N41-I43 PolarHBondContact O-N 3.49Å; I43-S47 WeakPolarHBondContact O-CB 3.35Å; I43-S47 PolarHBondContact O-N 3.2Å; I43-S47 PolarHBondContact O-OG 3.42Å; I43-L286 HydrophobicContact CB-CD1 3.86Å; I43-L286 HydrophobicContact CD1-CD2 4.39Å; I43-L286 HydrophobicContact CG2-CD1 3.43Å; I43-L286 VanDerWaalsContact CG2-CD1 3.43Å; I43-L286 HydrophobicContact CG2-CD2 4.3Å; I43-L286 HydrophobicContact CG2-CG 4.08Å
44F94.6Very high93.2Very high4 Ų460.5 Ų60.52%0.01830%0.299CS..Hα-helixtrans-61.4-46.2174.6-81-67000112.4R40 N41 W42 S47 G48 Y89 H93 W285 L286 A289R40-F44 HydrophobicContact CG-CD2 4.08Å; R40-F44 HydrophobicContact CG-CE2 3.78Å; R40-F44 VanDerWaalsContact O-CD2 3.3Å; R40-F44 WeakPolarHBondContact O-CD2 3.47Å; R40-F44 PolarHBondContact O-N 3.33Å; R40-F44 VanDerWaalsContact O-N 3.09Å; N41-F44 PolarHBondContact O-N 3.21Å; W42-F44 VanDerWaalsContact C-N 3.33Å; W42-F44 PolarHBondContact O-N 2.95Å; F44-S47 PolarHBondContact O-N 2.87Å; F44-G48 PolarHBondContact O-N 3.08Å; F44-Y89 AromaticContact CD1-CD1 3.58Å; F44-Y89 HydrophobicContact CD1-CD1 3.58Å; F44-Y89 AromaticContact CD1-CE1 3.74Å; F44-Y89 HydrophobicContact CD1-CE1 3.74Å; F44-Y89 HydrophobicContact CD1-CG 4.33Å; F44-Y89 HydrophobicContact CE1-CD1 4.1Å; F44-Y89 AromaticContact CE1-CE1 3.78Å; F44-Y89 HydrophobicContact CE1-CE1 3.78Å; F44-Y89 HydrophobicContact CG-CD1 4.41Å; F44-H93 HydrophobicContact CB-CB 3.9Å; F44-H93 AromaticContact CD1-NE2 3.9Å; F44-H93 AromaticContact CD2-CE1 3.38Å; F44-H93 WeakPolarHBondContact CD2-CE1 3.37Å; F44-H93 AromaticContact CD2-CG 3.93Å; F44-H93 AromaticContact CD2-ND1 3.54Å; F44-H93 AromaticContact CD2-NE2 3.72Å; F44-H93 AromaticContact CE2-CE1 3.66Å; F44-H93 AromaticContact CG-CD2 3.63Å; F44-H93 AromaticContact CG-CE1 3.78Å; F44-H93 AromaticContact CG-CG 3.85Å; F44-H93 AromaticContact CG-ND1 3.95Å; F44-H93 AromaticContact CG-NE2 3.63Å; F44-W285 HydrophobicContact CE1-CB 4.14Å; F44-W285 WeakPolarHBondContact CE1-O 3.42Å; F44-W285 HydrophobicContact CZ-CB 3.83Å; F44-L286 HydrophobicContact CD1-CD1 4.35Å; F44-L286 HydrophobicContact CD2-CD1 4.13Å; F44-L286 HydrophobicContact CE1-CD1 4.17Å; F44-L286 HydrophobicContact CE2-CD1 3.94Å; F44-L286 HydrophobicContact CG-CD1 4.33Å; F44-L286 HydrophobicContact CZ-CB 4.24Å; F44-L286 HydrophobicContact CZ-CD1 3.95Å; F44-A289 HydrophobicContact CD1-CB 3.59Å; F44-A289 HydrophobicContact CE1-CB 3.79Å
45V95.8Very high93.9Very high12 Ų1256.7 Ų56.77%0.07328%0.276CS..Hα-helixtrans-62.5-48.2179.5170.60000110.9N41 W42 S47 G48 I49 H93 L97N41-V45 WeakPolarHBondContact O-CG2 3.48Å; N41-V45 PolarHBondContact O-N 3.23Å; W42-V45 PolarHBondContact O-N 3.13Å; V45-S47 VanDerWaalsContact C-N 3.34Å; V45-S47 PolarHBondContact O-N 3.28Å; V45-G48 PolarHBondContact O-N 3.45Å; V45-I49 HydrophobicContact CG1-CD1 3.94Å; V45-I49 VanDerWaalsContact O-CG1 3.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.45Å; V45-I49 PolarHBondContact O-N 3.38Å; V45-H93 HydrophobicContact CG2-CB 4.02Å; V45-L97 HydrophobicContact CG2-CD1 3.93Å
46V96.7Very high94.3Very high73 Ų7352.4 Ų52.444%0.44226%0.263SS..Hα-helixtrans-62.4-42.8177.71720000111W42 G48 I49 L50W42-V46 WeakPolarHBondContact O-CB 2.99Å; W42-V46 VanDerWaalsContact O-CG2 3.31Å; W42-V46 WeakPolarHBondContact O-CG2 3.37Å; W42-V46 PolarHBondContact O-N 2.96Å; V46-G48 VanDerWaalsContact C-N 3.33Å; V46-G48 PolarHBondContact O-N 3.49Å; V46-I49 PolarHBondContact O-N 3.07Å; V46-L50 HydrophobicContact CG1-CD1 4.1Å; V46-L50 HydrophobicContact CG1-CG 4.49Å; V46-L50 WeakPolarHBondContact O-CB 3.47Å; V46-L50 WeakPolarHBondContact O-CG 3.31Å; V46-L50 PolarHBondContact O-N 3.07Å
47S95.9Very high94.8Very high10 Ų1048.6 Ų48.67%0.0725%0.253CS..Hα-helixtrans-63.1-39.9176.5-59.20000111.7I43 F44 V45 L50 A51I43-S47 WeakPolarHBondContact O-CB 3.35Å; I43-S47 PolarHBondContact O-N 3.2Å; I43-S47 PolarHBondContact O-OG 3.42Å; F44-S47 PolarHBondContact O-N 2.87Å; V45-S47 VanDerWaalsContact C-N 3.34Å; V45-S47 PolarHBondContact O-N 3.28Å; S47-L50 PolarHBondContact O-N 2.88Å; S47-A51 VanDerWaalsContact O-CB 3.31Å; S47-A51 WeakPolarHBondContact O-CB 3.37Å; S47-A51 PolarHBondContact O-N 3.26Å
48G97.2Very high95.2Very high0 Ų044.3 Ų44.30%023%0.233CC..Hα-helixtrans-64.5-42.8175.200000112.8F44 V45 V46 A51 I52F44-G48 PolarHBondContact O-N 3.08Å; V45-G48 PolarHBondContact O-N 3.45Å; V46-G48 VanDerWaalsContact C-N 3.33Å; V46-G48 PolarHBondContact O-N 3.49Å; G48-A51 PolarHBondContact O-N 3.15Å; G48-I52 WeakPolarHBondContact O-CG1 3.25Å; G48-I52 PolarHBondContact O-N 3.45Å
49I97.7Very high95.4Very high70 Ų7042.7 Ų42.736%0.35922%0.222SC..Hα-helixtrans-60.4-49.4174.5-69.9168.4000110.4V45 V46 A51 I52 F53 I90V45-I49 HydrophobicContact CG1-CD1 3.94Å; V45-I49 VanDerWaalsContact O-CG1 3.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.45Å; V45-I49 PolarHBondContact O-N 3.38Å; V46-I49 PolarHBondContact O-N 3.07Å; I49-A51 VanDerWaalsContact C-N 3.28Å; I49-A51 PolarHBondContact O-N 2.91Å; I49-I52 PolarHBondContact O-N 3.32Å; I49-F53 HydrophobicContact CG2-CD2 3.64Å; I49-F53 HydrophobicContact CG2-CE2 3.66Å; I49-F53 VanDerWaalsContact O-CD2 3.26Å; I49-F53 WeakPolarHBondContact O-CD2 3.25Å; I49-F53 PolarHBondContact O-N 2.92Å; I49-I90 HydrophobicContact CG1-CD1 3.68Å; I49-I90 HydrophobicContact CG1-CG1 4.22Å
50L97.3Very high95.5Very high88 Ų8843 Ų4346%0.46122%0.224SC..Hα-helixtrans-59.4-41176.8-72.6172.6000111.4V46 S47 I52 F53 A54 S293V46-L50 HydrophobicContact CG1-CD1 4.1Å; V46-L50 HydrophobicContact CG1-CG 4.49Å; V46-L50 WeakPolarHBondContact O-CB 3.47Å; V46-L50 WeakPolarHBondContact O-CG 3.31Å; V46-L50 PolarHBondContact O-N 3.07Å; S47-L50 PolarHBondContact O-N 2.88Å; L50-I52 PolarHBondContact O-N 2.98Å; L50-F53 PolarHBondContact O-N 3.23Å; L50-A54 WeakPolarHBondContact O-CB 3Å; L50-A54 PolarHBondContact O-N 2.99Å; L50-S293 WeakPolarHBondContact CB-OG 3.12Å
51A97.5Very high95.6Very high0 Ų042.1 Ų42.10%022%0.223CC..Hα-helixtrans-62.7-44.8179.600000111S47 G48 I49 N55 L292 S293S47-A51 VanDerWaalsContact O-CB 3.31Å; S47-A51 WeakPolarHBondContact O-CB 3.37Å; S47-A51 PolarHBondContact O-N 3.26Å; G48-A51 PolarHBondContact O-N 3.15Å; I49-A51 VanDerWaalsContact C-N 3.28Å; I49-A51 PolarHBondContact O-N 2.91Å; A51-N55 WeakPolarHBondContact O-CB 3.2Å; A51-N55 PolarHBondContact O-N 3.46Å; A51-N55 PolarHBondContact O-ND2 3.02Å; A51-L292 HydrophobicContact CB-CB 3.78Å; A51-L292 HydrophobicContact CB-CD1 4.21Å; A51-S293 WeakPolarHBondContact CA-OG 3.27Å; A51-S293 PolarHBondContact N-OG 3.41Å
52I97.7Very high95.5Very high42 Ų4242.5 Ų42.522%0.21523%0.225CC..Hα-helixtrans-61.2-53.4176.8-67166.8000110.4G48 I49 L50 S56 V87 I90G48-I52 WeakPolarHBondContact O-CG1 3.25Å; G48-I52 PolarHBondContact O-N 3.45Å; I49-I52 PolarHBondContact O-N 3.32Å; L50-I52 PolarHBondContact O-N 2.98Å; I52-S56 WeakPolarHBondContact O-CB 3.21Å; I52-S56 PolarHBondContact O-N 3.43Å; I52-S56 PolarHBondContact O-OG 3.37Å; I52-V87 HydrophobicContact CD1-CG2 3.7Å; I52-V87 HydrophobicContact CG1-CG2 4.16Å; I52-I90 HydrophobicContact CD1-CD1 3.51Å
53F97.3Very high95.3Very high149 Ų14943.9 Ų43.965%0.65423%0.231SC*.Hα-helixtrans-66.9-46.9-174.7-78.5-66.1000112.4I49 L50 A57I49-F53 HydrophobicContact CG2-CD2 3.64Å; I49-F53 HydrophobicContact CG2-CE2 3.66Å; I49-F53 VanDerWaalsContact O-CD2 3.26Å; I49-F53 WeakPolarHBondContact O-CD2 3.25Å; I49-F53 PolarHBondContact O-N 2.92Å; L50-F53 PolarHBondContact O-N 3.23Å; F53-A57 WeakPolarHBondContact O-CB 3.43Å; F53-A57 PolarHBondContact O-N 2.92Å
54A96.8Very high95Very high13 Ų1350.4 Ų50.411%0.10725%0.252CS..Hα-helixtrans-63.8-44.7-179.400000111.3L50 A57 L58 A296 I297 I300L50-A54 WeakPolarHBondContact O-CB 3Å; L50-A54 PolarHBondContact O-N 2.99Å; A54-A57 PolarHBondContact O-N 3.29Å; A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 3.12Å; A54-A296 HydrophobicContact CB-CB 3.88Å; A54-I297 HydrophobicContact CB-CG1 3.95Å; A54-I300 WeakPolarHBondContact O-CD1 3.49Å
55N97.7Very high94.4Very high0 Ų053 Ų530%027%0.27CS..Hα-helixtrans-75.8-31.8-178.8-71.1-75.3000113A51 L58 L59 A79 S82 A83 L292 A296A51-N55 WeakPolarHBondContact O-CB 3.2Å; A51-N55 PolarHBondContact O-N 3.46Å; A51-N55 PolarHBondContact O-ND2 3.02Å; N55-L58 PolarHBondContact O-N 2.9Å; N55-L59 WeakPolarHBondContact O-CB 3.33Å; N55-L59 WeakPolarHBondContact O-CG 3.14Å; N55-L59 PolarHBondContact O-N 2.93Å; N55-A79 HydrophobicContact CB-CB 4.02Å; N55-A79 VanDerWaalsContact CB-O 3.25Å; N55-A79 WeakPolarHBondContact CB-O 3.41Å; N55-A79 WeakPolarHBondContact OD1-CA 2.85Å; N55-S82 VanDerWaalsContact ND2-CB 3.35Å; N55-S82 WeakPolarHBondContact ND2-CB 3.38Å; N55-A83 HydrophobicContact CB-CB 4.35Å; N55-L292 PolarHBondContact ND2-O 2.86Å; N55-A296 WeakPolarHBondContact OD1-CB 3.38Å
56S96.6Very high93.4Very high50 Ų5059 Ų5935%0.3530%0.302SS..Hα-helixtrans-65.5-40.6171.5-60.20000111.9I52 L58 L59 T60I52-S56 WeakPolarHBondContact O-CB 3.21Å; I52-S56 PolarHBondContact O-N 3.43Å; I52-S56 PolarHBondContact O-OG 3.37Å; S56-L58 VanDerWaalsContact C-N 3.35Å; S56-L59 PolarHBondContact O-N 3.25Å; S56-T60 WeakPolarHBondContact O-CB 3.35Å; S56-T60 PolarHBondContact O-N 3.33Å; S56-T60 PolarHBondContact O-OG1 3.23Å
57A95Very high92.1Very high43 Ų4358 Ų5836%0.35529%0.294SS..Hα-helixtrans-63.1-42.7172.700000111.1F53 A54 T60 L61 I300F53-A57 WeakPolarHBondContact O-CB 3.43Å; F53-A57 PolarHBondContact O-N 2.92Å; A54-A57 PolarHBondContact O-N 3.29Å; A57-T60 WeakPolarHBondContact O-CB 2.95Å; A57-T60 PolarHBondContact O-N 3.18Å; A57-L61 WeakPolarHBondContact O-CG 3.39Å; A57-L61 PolarHBondContact O-N 3.05Å; A57-I300 HydrophobicContact CB-CD1 3.8Å
58L93.9Very high90.8Very high2 Ų263.3 Ų63.31%0.0133%0.326CS..Hα-helixtrans-62.1-46175.9176.559.7000112.2A54 N55 S56 T60 L61 I62 I75 A79 Y295 A296 R299 I300A54-L58 WeakPolarHBondContact O-CB 3.41Å; A54-L58 PolarHBondContact O-N 3.12Å; N55-L58 PolarHBondContact O-N 2.9Å; S56-L58 VanDerWaalsContact C-N 3.35Å; L58-T60 VanDerWaalsContact C-N 3.3Å; L58-T60 PolarHBondContact O-N 3.05Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 3.34Å; L58-I62 HydrophobicContact CD1-CD1 4.23Å; L58-I62 HydrophobicContact CD1-CG1 4.32Å; L58-I62 HydrophobicContact CG-CD1 4.06Å; L58-I62 WeakPolarHBondContact O-CG1 3.36Å; L58-I62 PolarHBondContact O-N 2.91Å; L58-I75 HydrophobicContact CD2-CG2 3.99Å; L58-A79 HydrophobicContact CD2-CB 4.1Å; L58-A79 HydrophobicContact CG-CB 4.46Å; L58-Y295 HydrophobicContact CD2-CD1 4.35Å; L58-Y295 HydrophobicContact CD2-CE1 4.17Å; L58-A296 HydrophobicContact CB-CB 4.23Å; L58-A296 HydrophobicContact CD2-CB 4.02Å; L58-R299 HydrophobicContact CD1-CB 4.18Å; L58-R299 HydrophobicContact CD1-CG 3.87Å; L58-I300 HydrophobicContact CB-CD1 4.48Å
59L94.6Very high90.1Very high22 Ų2269.4 Ų69.412%0.11535%0.353CS..Hα-helixtrans-55.8-47.5174.5-79.1168.7000110.8N55 S56 L61 I62 Y63 A76 A79 L80N55-L59 WeakPolarHBondContact O-CB 3.33Å; N55-L59 WeakPolarHBondContact O-CG 3.14Å; N55-L59 PolarHBondContact O-N 2.93Å; S56-L59 PolarHBondContact O-N 3.25Å; L59-L61 VanDerWaalsContact C-N 3.31Å; L59-L61 PolarHBondContact O-N 3.43Å; L59-I62 PolarHBondContact O-N 3.4Å; L59-I62 VanDerWaalsContact O-N 3.13Å; L59-Y63 HydrophobicContact CB-CD2 4.38Å; L59-Y63 HydrophobicContact CB-CE2 4.26Å; L59-Y63 HydrophobicContact CD2-CE2 4.09Å; L59-Y63 WeakPolarHBondContact O-CD2 3.07Å; L59-Y63 PolarHBondContact O-N 3.23Å; L59-A76 HydrophobicContact CD2-CB 3.76Å; L59-A76 WeakPolarHBondContact CD2-O 3.36Å; L59-A79 HydrophobicContact CD1-CB 4.4Å; L59-A79 HydrophobicContact CD2-CB 4.02Å; L59-A79 HydrophobicContact CG-CB 3.79Å; L59-L80 HydrophobicContact CD1-CB 4.43Å
60T92.7Very high89.4Confident65 Ų6566.5 Ų66.540%0.39934%0.339SS..Hα-helixtrans-58.2-42.9177.7-57.50000111.8S56 A57 L58 R64S56-T60 WeakPolarHBondContact O-CB 3.35Å; S56-T60 PolarHBondContact O-N 3.33Å; S56-T60 PolarHBondContact O-OG1 3.23Å; A57-T60 WeakPolarHBondContact O-CB 2.95Å; A57-T60 PolarHBondContact O-N 3.18Å; L58-T60 VanDerWaalsContact C-N 3.3Å; L58-T60 PolarHBondContact O-N 3.05Å; T60-R64 HydrophobicContact CG2-CG 4.43Å; T60-R64 WeakPolarHBondContact O-CB 3.41Å; T60-R64 VanDerWaalsContact O-CG 3.28Å; T60-R64 WeakPolarHBondContact O-CG 3.41Å; T60-R64 PolarHBondContact O-N 3.06Å
61L90.7Very high88.9Confident39 Ų3963.4 Ų63.420%0.20432%0.321CS..Hα-helixtrans-63.3-42.5176-71.6176.1000112.2A57 L58 L59 R64 S65 I300 H303A57-L61 WeakPolarHBondContact O-CG 3.39Å; A57-L61 PolarHBondContact O-N 3.05Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 3.34Å; L59-L61 VanDerWaalsContact C-N 3.31Å; L59-L61 PolarHBondContact O-N 3.43Å; L61-R64 PolarHBondContact O-N 2.88Å; L61-S65 WeakPolarHBondContact O-CB 3.3Å; L61-S65 PolarHBondContact O-N 3.28Å; L61-I300 HydrophobicContact CD1-CB 4.41Å; L61-I300 HydrophobicContact CD1-CG1 3.79Å; L61-H303 HydrophobicContact CD1-CB 4.41Å
62I90.6Very high88.5Confident13 Ų1363.9 Ų63.97%0.06732%0.324CS..Hα-helixtrans-62.1-51.1177.7-66.4166000110.1L58 L59 R64 S65 N72 I75 A76 R299L58-I62 HydrophobicContact CD1-CD1 4.23Å; L58-I62 HydrophobicContact CD1-CG1 4.32Å; L58-I62 HydrophobicContact CG-CD1 4.06Å; L58-I62 WeakPolarHBondContact O-CG1 3.36Å; L58-I62 PolarHBondContact O-N 2.91Å; L59-I62 PolarHBondContact O-N 3.4Å; L59-I62 VanDerWaalsContact O-N 3.13Å; I62-R64 VanDerWaalsContact C-N 3.33Å; I62-R64 PolarHBondContact O-N 2.05Å; I62-S65 PolarHBondContact O-N 2.93Å; I62-S65 VanDerWaalsContact O-N 3.17Å; I62-S65 PolarHBondContact O-OG 2.93Å; I62-N72 HydrophobicContact CG2-CB 3.97Å; I62-I75 HydrophobicContact CD1-CB 4.22Å; I62-I75 HydrophobicContact CD1-CG2 3.85Å; I62-A76 HydrophobicContact CD1-CB 4.24Å; I62-R299 VanDerWaalsContact CD1-NH1 3.28Å; I62-R299 VanDerWaalsContact CG1-NH1 3.33Å
63Y89.6Confident88.2Confident163 Ų16365.1 Ų65.164%0.63933%0.328SS*.Hα-helixtrans-61.4-41179.5-73.8-61.6000112.1L59 S65 N66L59-Y63 HydrophobicContact CB-CD2 4.38Å; L59-Y63 HydrophobicContact CB-CE2 4.26Å; L59-Y63 HydrophobicContact CD2-CE2 4.09Å; L59-Y63 WeakPolarHBondContact O-CD2 3.07Å; L59-Y63 PolarHBondContact O-N 3.23Å; Y63-S65 VanDerWaalsContact C-N 3.31Å; Y63-S65 PolarHBondContact O-N 3.42Å; Y63-N66 PolarHBondContact O-N 2.87Å; Y63-N66 PolarHBondContact O-OD1 3.12Å
64R88Confident88Confident201 Ų20158.5 Ų58.576%0.75830%0.299SS*.Hα-helixtrans-67.8-28.6176.9-76-176.7176.2-171.2-0.4113.8T60 L61 I62 N66T60-R64 HydrophobicContact CG2-CG 4.43Å; T60-R64 WeakPolarHBondContact O-CB 3.41Å; T60-R64 VanDerWaalsContact O-CG 3.28Å; T60-R64 WeakPolarHBondContact O-CG 3.41Å; T60-R64 PolarHBondContact O-N 3.06Å; L61-R64 PolarHBondContact O-N 2.88Å; I62-R64 VanDerWaalsContact C-N 3.33Å; I62-R64 PolarHBondContact O-N 2.05Å; R64-N66 PolarHBondContact O-N 3.41Å
65S82.9Confident87.9Confident57 Ų5758 Ų5840%0.39929%0.294SS..Hα-helixtrans-69.6-15.9178.7730000113.3L61 I62 Y63 D67L61-S65 WeakPolarHBondContact O-CB 3.3Å; L61-S65 PolarHBondContact O-N 3.28Å; I62-S65 PolarHBondContact O-N 2.93Å; I62-S65 VanDerWaalsContact O-N 3.17Å; I62-S65 PolarHBondContact O-OG 2.93Å; Y63-S65 VanDerWaalsContact C-N 3.31Å; Y63-S65 PolarHBondContact O-N 3.42Å; S65-D67 PolarHBondContact O-N 2.72Å; S65-D67 PolarHBondContact OG-N 3.29Å
66N74.1Confident87.7Confident138 Ų13858.6 Ų58.674%0.73830%0.299SS*.THydrogen-bonded Turntrans49.121.6-172.7-72.9-31.2000113.8Y63 R64 V68Y63-N66 PolarHBondContact O-N 2.87Å; Y63-N66 PolarHBondContact O-OD1 3.12Å; R64-N66 PolarHBondContact O-N 3.41Å; N66-V68 PolarHBondContact O-N 3.19Å; N66-V68 VanDerWaalsContact O-N 3.16Å
67D70.2Confident87.6Confident53 Ų5356.9 Ų56.928%0.28329%0.289SS..  trans-85.893.6-176.8-175.23.1000109.8S65 K69 N72S65-D67 PolarHBondContact O-N 2.72Å; S65-D67 PolarHBondContact OG-N 3.29Å; D67-K69 PolarHBondContact O-N 3.38Å; D67-K69 VanDerWaalsContact OD1-CD 3.24Å; D67-K69 WeakPolarHBondContact OD1-CD 3.29Å; D67-K69 VanDerWaalsContact OD1-CE 3.27Å; D67-K69 WeakPolarHBondContact OD1-CE 3.48Å; D67-K69 WeakPolarHBondContact OD1-CG 3.26Å; D67-K69 PolarHBondContact OD1-N 3.29Å; D67-K69 IonicContact OD1-NZ 3.5Å; D67-K69 PolarHBondContact OD1-NZ 2.96Å; D67-K69 IonicContact OD2-NZ 2.75Å; D67-K69 PolarHBondContact OD2-NZ 2.64Å; D67-N72 WeakPolarHBondContact CB-ND2 3.3Å; D67-N72 WeakPolarHBondContact O-CB 3.28Å; D67-N72 PolarHBondContact O-ND2 3.12Å; D67-N72 PolarHBondContact OD2-ND2 3.02Å; D67-N72 VanDerWaalsContact OD2-ND2 3.07Å
68V69.3Low87.7Confident121 Ų12155 Ų5573%0.73327%0.273SS*.  trans-70.29.6-176.2-65.70000115N66 A70N66-V68 PolarHBondContact O-N 3.19Å; N66-V68 VanDerWaalsContact O-N 3.16Å; V68-A70 PolarHBondContact O-N 2.82Å
69K81.3Confident87.8Confident128 Ų12854.9 Ų54.956%0.55727%0.273SS*.  trans-55.5139.3176.3-76.7170.1-158.2140.20111.7D67 R71 N72 K73D67-K69 PolarHBondContact O-N 3.38Å; D67-K69 VanDerWaalsContact OD1-CD 3.24Å; D67-K69 WeakPolarHBondContact OD1-CD 3.29Å; D67-K69 VanDerWaalsContact OD1-CE 3.27Å; D67-K69 WeakPolarHBondContact OD1-CE 3.48Å; D67-K69 WeakPolarHBondContact OD1-CG 3.26Å; D67-K69 PolarHBondContact OD1-N 3.29Å; D67-K69 IonicContact OD1-NZ 3.5Å; D67-K69 PolarHBondContact OD1-NZ 2.96Å; D67-K69 IonicContact OD2-NZ 2.75Å; D67-K69 PolarHBondContact OD2-NZ 2.64Å; K69-R71 PolarHBondContact O-N 3.18Å; K69-R71 VanDerWaalsContact O-N 3.08Å; K69-N72 PolarHBondContact O-N 3.22Å; K69-K73 PolarHBondContact O-N 2.93Å
70A83.6Confident87.9Confident10 Ų1058 Ų588%0.08329%0.289CS..Hα-helixtrans-37.7-51.6172.300000113.2V68 N72 K73 F74 I157V68-A70 PolarHBondContact O-N 2.82Å; A70-N72 VanDerWaalsContact C-N 3.34Å; A70-N72 PolarHBondContact O-N 3.01Å; A70-K73 WeakPolarHBondContact O-CB 3.18Å; A70-K73 PolarHBondContact O-N 3.39Å; A70-K73 VanDerWaalsContact O-N 3.09Å; A70-F74 HydrophobicContact CB-CE2 4.1Å; A70-F74 VanDerWaalsContact O-CD2 3.27Å; A70-F74 WeakPolarHBondContact O-CD2 3.42Å; A70-F74 PolarHBondContact O-N 3.39Å; A70-F74 VanDerWaalsContact O-N 3.15Å; A70-I157 HydrophobicContact CB-CD1 3.16Å; A70-I157 HydrophobicContact CB-CG1 3.97Å
71R86.3Confident88.1Confident22 Ų2254.9 Ų54.98%0.08327%0.27CS..Hα-helixtrans-57-41.5-179.7-166.4173.3-57.7170.321.6113.8K69 K73 F74 I75 D139 E243 I250K69-R71 PolarHBondContact O-N 3.18Å; K69-R71 VanDerWaalsContact O-N 3.08Å; R71-K73 VanDerWaalsContact C-N 3.31Å; R71-K73 PolarHBondContact O-N 3Å; R71-F74 PolarHBondContact O-N 3.21Å; R71-I75 HydrophobicContact CG-CD1 3.97Å; R71-I75 VanDerWaalsContact O-CG1 3.26Å; R71-I75 WeakPolarHBondContact O-CG1 3.29Å; R71-I75 PolarHBondContact O-N 3.03Å; R71-D139 IonicContact CZ-OD2 2.77Å; R71-D139 IonicContact NE-OD2 3.37Å; R71-D139 PolarHBondContact NE-OD2 2.87Å; R71-D139 VanDerWaalsContact NE-OD2 3.08Å; R71-D139 IonicContact NH2-OD2 2.81Å; R71-D139 PolarHBondContact NH2-OD2 3.44Å; R71-D139 VanDerWaalsContact NH2-OD2 3.07Å; R71-E243 IonicContact CZ-OE2 3.5Å; R71-E243 IonicContact NH1-OE2 3.08Å; R71-E243 PolarHBondContact NH1-OE2 3.15Å; R71-E243 IonicContact NH2-OE2 3.07Å; R71-E243 PolarHBondContact NH2-OE2 3.23Å; R71-I250 HydrophobicContact CG-CD1 4.37Å
72N89.5Confident88.5Confident11 Ų1153 Ų536%0.05926%0.26CS..Hα-helixtrans-69.1-32.5178.9-74.2-27.4000111.8I62 D67 K69 A70 I75 A76 R299I62-N72 HydrophobicContact CG2-CB 3.97Å; D67-N72 WeakPolarHBondContact CB-ND2 3.3Å; D67-N72 WeakPolarHBondContact O-CB 3.28Å; D67-N72 PolarHBondContact O-ND2 3.12Å; D67-N72 PolarHBondContact OD2-ND2 3.02Å; D67-N72 VanDerWaalsContact OD2-ND2 3.07Å; K69-N72 PolarHBondContact O-N 3.22Å; A70-N72 VanDerWaalsContact C-N 3.34Å; A70-N72 PolarHBondContact O-N 3.01Å; N72-I75 PolarHBondContact O-N 2.95Å; N72-A76 VanDerWaalsContact O-CB 3.29Å; N72-A76 WeakPolarHBondContact O-CB 3.41Å; N72-A76 PolarHBondContact O-N 3.15Å; N72-R299 PolarHBondContact OD1-NH2 2.67Å
73K91.4Very high88.8Confident67 Ų6753 Ų5329%0.29126%0.262SS..Hα-helixtrans-62.3-44.1171.3-63.3-178.9175.2177.60110.8K69 A70 R71 A76 G77 I157 N158K69-K73 PolarHBondContact O-N 2.93Å; A70-K73 WeakPolarHBondContact O-CB 3.18Å; A70-K73 PolarHBondContact O-N 3.39Å; A70-K73 VanDerWaalsContact O-N 3.09Å; R71-K73 VanDerWaalsContact C-N 3.31Å; R71-K73 PolarHBondContact O-N 3Å; K73-A76 WeakPolarHBondContact O-CB 3.48Å; K73-A76 PolarHBondContact O-N 3.47Å; K73-G77 PolarHBondContact O-N 3.43Å; K73-I157 HydrophobicContact CD-CG2 3.85Å; K73-N158 PolarHBondContact NZ-OD1 2.97Å
74F93.6Very high89.2Confident10 Ų1046.6 Ų46.64%0.04424%0.24CC..Hα-helixtrans-68.7-39.6177.2-53.8-42.7000112.8A70 R71 A76 G77 Y78 S132 Y135 M136 D139 I157A70-F74 HydrophobicContact CB-CE2 4.1Å; A70-F74 VanDerWaalsContact O-CD2 3.27Å; A70-F74 WeakPolarHBondContact O-CD2 3.42Å; A70-F74 PolarHBondContact O-N 3.39Å; A70-F74 VanDerWaalsContact O-N 3.15Å; R71-F74 PolarHBondContact O-N 3.21Å; F74-A76 VanDerWaalsContact C-N 3.29Å; F74-A76 PolarHBondContact O-N 3.46Å; F74-G77 PolarHBondContact O-N 3.19Å; F74-Y78 PolarHBondContact O-N 3.04Å; F74-S132 WeakPolarHBondContact O-CB 3.47Å; F74-Y135 AromaticContact CD1-CD2 3.78Å; F74-Y135 HydrophobicContact CD1-CD2 3.78Å; F74-Y135 HydrophobicContact CD1-CG 4.17Å; F74-Y135 AromaticContact CE1-CD2 3.57Å; F74-Y135 HydrophobicContact CE1-CD2 3.57Å; F74-Y135 AromaticContact CE1-CG 3.95Å; F74-Y135 HydrophobicContact CE1-CG 3.95Å; F74-Y135 HydrophobicContact CZ-CD2 4.38Å; F74-Y135 HydrophobicContact CZ-CG 4.36Å; F74-M136 HydrophobicContact CB-CG 3.61Å; F74-M136 HydrophobicContact CD2-CG 4.47Å; F74-M136 HydrophobicContact CG-CG 4.48Å; F74-D139 HydrophobicContact CD2-CB 4.37Å; F74-D139 HydrophobicContact CE2-CB 4.08Å; F74-I157 HydrophobicContact CE1-CG2 4.09Å; F74-I157 HydrophobicContact CZ-CB 4.5Å; F74-I157 HydrophobicContact CZ-CG1 4.09Å; F74-I157 HydrophobicContact CZ-CG2 3.94Å
75I93.4Very high89.6Confident3 Ų337 Ų372%0.01520%0.204CC..Hα-helixtrans-65.5-35.6174.2-62.3163.3000111L58 I62 R71 N72 Y78 A79 M136 Y295L58-I75 HydrophobicContact CD2-CG2 3.99Å; I62-I75 HydrophobicContact CD1-CB 4.22Å; I62-I75 HydrophobicContact CD1-CG2 3.85Å; R71-I75 HydrophobicContact CG-CD1 3.97Å; R71-I75 VanDerWaalsContact O-CG1 3.26Å; R71-I75 WeakPolarHBondContact O-CG1 3.29Å; R71-I75 PolarHBondContact O-N 3.03Å; N72-I75 PolarHBondContact O-N 2.95Å; I75-Y78 PolarHBondContact O-N 3.38Å; I75-A79 WeakPolarHBondContact O-CB 3.37Å; I75-A79 PolarHBondContact O-N 3.09Å; I75-M136 HydrophobicContact CG1-SD 3.53Å; I75-M136 VanDerWaalsContact CG1-SD 3.53Å; I75-Y295 WeakPolarHBondContact CD1-OH 3.06Å; I75-Y295 HydrophobicContact CG2-CE1 3.75Å
76A94.2Very high90.3Very high12 Ų1234.3 Ų34.310%0.09919%0.185CC..Hα-helixtrans-64.2-41.9172.900000111.4L59 I62 N72 K73 F74 A79 L80L59-A76 HydrophobicContact CD2-CB 3.76Å; L59-A76 WeakPolarHBondContact CD2-O 3.36Å; I62-A76 HydrophobicContact CD1-CB 4.24Å; N72-A76 VanDerWaalsContact O-CB 3.29Å; N72-A76 WeakPolarHBondContact O-CB 3.41Å; N72-A76 PolarHBondContact O-N 3.15Å; K73-A76 WeakPolarHBondContact O-CB 3.48Å; K73-A76 PolarHBondContact O-N 3.47Å; F74-A76 VanDerWaalsContact C-N 3.29Å; F74-A76 PolarHBondContact O-N 3.46Å; A76-A79 PolarHBondContact O-N 3.29Å; A76-L80 WeakPolarHBondContact O-CB 3.36Å; A76-L80 PolarHBondContact O-N 3.26Å
77G95.5Very high91.4Very high14 Ų1430.5 Ų30.514%0.14417%0.166CC..Hα-helixtrans-55.9-52.2171.400000112.1K73 F74 A79 L80 G81 L128 S132K73-G77 PolarHBondContact O-N 3.43Å; F74-G77 PolarHBondContact O-N 3.19Å; G77-A79 VanDerWaalsContact C-N 3.32Å; G77-A79 PolarHBondContact O-N 2.9Å; G77-L80 PolarHBondContact O-N 3.27Å; G77-G81 PolarHBondContact O-N 3.28Å; G77-L128 WeakPolarHBondContact O-CG 3.49Å; G77-S132 WeakPolarHBondContact CA-OG 3.38Å
78Y95.6Very high92.6Very high3 Ų328 Ų281%0.01215%0.153CC..Hα-helixtrans-54.6-46.6175.3170.8-85.9000112.3F74 I75 G81 S82 V129 S132 I133 I253 Y295F74-Y78 PolarHBondContact O-N 3.04Å; I75-Y78 PolarHBondContact O-N 3.38Å; Y78-G81 PolarHBondContact O-N 3.35Å; Y78-S82 WeakPolarHBondContact CE1-OG 3.3Å; Y78-S82 WeakPolarHBondContact O-CB 3.29Å; Y78-S82 PolarHBondContact O-N 3.47Å; Y78-S82 PolarHBondContact O-OG 3.1Å; Y78-V129 HydrophobicContact CD2-CB 4.41Å; Y78-V129 HydrophobicContact CD2-CG1 3.83Å; Y78-V129 HydrophobicContact CD2-CG2 4.29Å; Y78-V129 HydrophobicContact CE2-CG1 3.78Å; Y78-V129 HydrophobicContact CE2-CG2 4.49Å; Y78-S132 PolarHBondContact N-OG 3.11Å; Y78-I133 HydrophobicContact CD2-CD1 3.95Å; Y78-I133 HydrophobicContact CD2-CG1 3.92Å; Y78-I133 HydrophobicContact CE2-CD1 3.97Å; Y78-I133 HydrophobicContact CE2-CG1 4.4Å; Y78-I253 HydrophobicContact CD1-CD1 3.65Å; Y78-I253 HydrophobicContact CD2-CD1 3.4Å; Y78-I253 VanDerWaalsContact CD2-CD1 3.4Å; Y78-I253 HydrophobicContact CD2-CG1 4.14Å; Y78-I253 HydrophobicContact CE1-CD1 3.73Å; Y78-I253 HydrophobicContact CE1-CG1 4.35Å; Y78-I253 HydrophobicContact CE2-CD1 3.43Å; Y78-I253 VanDerWaalsContact CE2-CD1 3.43Å; Y78-I253 HydrophobicContact CE2-CG1 3.7Å; Y78-I253 HydrophobicContact CG-CD1 3.51Å; Y78-Y295 HydrophobicContact CD1-CD1 4.16Å; Y78-Y295 AromaticContact CE1-CD1 3.9Å; Y78-Y295 HydrophobicContact CE1-CD1 3.9Å
79A96.7Very high93.9Very high0 Ų022.6 Ų22.60%012%0.119CC..Hα-helixtrans-66.5-41.5-178.100000111.4N55 L58 L59 I75 A76 G77 S82 A83N55-A79 HydrophobicContact CB-CB 4.02Å; N55-A79 VanDerWaalsContact CB-O 3.25Å; N55-A79 WeakPolarHBondContact CB-O 3.41Å; N55-A79 WeakPolarHBondContact OD1-CA 2.85Å; L58-A79 HydrophobicContact CD2-CB 4.1Å; L58-A79 HydrophobicContact CG-CB 4.46Å; L59-A79 HydrophobicContact CD1-CB 4.4Å; L59-A79 HydrophobicContact CD2-CB 4.02Å; L59-A79 HydrophobicContact CG-CB 3.79Å; I75-A79 WeakPolarHBondContact O-CB 3.37Å; I75-A79 PolarHBondContact O-N 3.09Å; A76-A79 PolarHBondContact O-N 3.29Å; G77-A79 VanDerWaalsContact C-N 3.32Å; G77-A79 PolarHBondContact O-N 2.9Å; A79-S82 PolarHBondContact O-N 2.78Å; A79-A83 WeakPolarHBondContact O-CB 3.38Å; A79-A83 PolarHBondContact O-N 3.15Å
80L97.1Very high94.5Very high87 Ų8719 Ų1946%0.45511%0.106SC..Hα-helixtrans-62-47.4174.4178.861.2000111.2L59 A76 G77 S82 A83 V84 L128L59-L80 HydrophobicContact CD1-CB 4.43Å; A76-L80 WeakPolarHBondContact O-CB 3.36Å; A76-L80 PolarHBondContact O-N 3.26Å; G77-L80 PolarHBondContact O-N 3.27Å; L80-S82 PolarHBondContact O-N 3.42Å; L80-A83 PolarHBondContact O-N 3.18Å; L80-V84 HydrophobicContact CD1-CG2 4.45Å; L80-V84 WeakPolarHBondContact O-CG2 3.5Å; L80-V84 PolarHBondContact O-N 2.97Å; L80-L128 HydrophobicContact CB-CD2 4.03Å; L80-L128 HydrophobicContact CD2-CD2 3.97Å; L80-L128 HydrophobicContact CG-CD2 3.83Å
81G97.8Very high94.9Very high0 Ų020.3 Ų20.30%011%0.112CC..Hα-helixtrans-60-44.717700000112.2G77 Y78 A83 V84 L85G77-G81 PolarHBondContact O-N 3.28Å; Y78-G81 PolarHBondContact O-N 3.35Å; G81-A83 VanDerWaalsContact C-N 3.32Å; G81-A83 PolarHBondContact O-N 3.29Å; G81-V84 PolarHBondContact O-N 3.17Å; G81-L85 WeakPolarHBondContact O-CG 3.38Å; G81-L85 PolarHBondContact O-N 2.85Å
82S97.5Very high95.1Very high0 Ų020.3 Ų20.30%011%0.114CC..Hα-helixtrans-62-37.7176.7-59.70000112.6N55 Y78 A79 L80 G86N55-S82 VanDerWaalsContact ND2-CB 3.35Å; N55-S82 WeakPolarHBondContact ND2-CB 3.38Å; Y78-S82 WeakPolarHBondContact CE1-OG 3.3Å; Y78-S82 WeakPolarHBondContact O-CB 3.29Å; Y78-S82 PolarHBondContact O-N 3.47Å; Y78-S82 PolarHBondContact O-OG 3.1Å; A79-S82 PolarHBondContact O-N 2.78Å; L80-S82 PolarHBondContact O-N 3.42Å; S82-G86 PolarHBondContact O-N 3.05Å
83A97.9Very high95.2Very high12 Ų1220.7 Ų20.710%0.09912%0.115CC..Hα-helixtrans-68.2-42.2174.800000111.7N55 A79 L80 G81 G86 V87N55-A83 HydrophobicContact CB-CB 4.35Å; A79-A83 WeakPolarHBondContact O-CB 3.38Å; A79-A83 PolarHBondContact O-N 3.15Å; L80-A83 PolarHBondContact O-N 3.18Å; G81-A83 VanDerWaalsContact C-N 3.32Å; G81-A83 PolarHBondContact O-N 3.29Å; A83-G86 WeakPolarHBondContact O-CA 3.36Å; A83-G86 PolarHBondContact O-N 3.12Å; A83-G86 VanDerWaalsContact O-N 3.13Å; A83-V87 PolarHBondContact O-N 2.91Å
84V97.8Very high95.2Very high30 Ų3018.6 Ų18.618%0.18211%0.113CC..Hα-helixtrans-60.8-44.5175.3171.10000111.1L80 G81 G86 V87 G88 L121 I124L80-V84 HydrophobicContact CD1-CG2 4.45Å; L80-V84 WeakPolarHBondContact O-CG2 3.5Å; L80-V84 PolarHBondContact O-N 2.97Å; G81-V84 PolarHBondContact O-N 3.17Å; V84-G86 VanDerWaalsContact C-N 3.3Å; V84-G86 PolarHBondContact O-N 3.37Å; V84-V87 PolarHBondContact O-N 3.44Å; V84-G88 PolarHBondContact O-N 3.18Å; V84-L121 HydrophobicContact CG1-CB 4.15Å; V84-L121 HydrophobicContact CG1-CD2 4.05Å; V84-L121 WeakPolarHBondContact CG1-O 3.28Å; V84-I124 HydrophobicContact CG1-CB 4.32Å; V84-I124 HydrophobicContact CG1-CG2 4.15Å
85L96.8Very high95Very high0 Ų019.9 Ų19.90%012%0.118CC..Hα-helixtrans-59.6-41.6172.3-70.9178.8000111.9G81 V87 G88 Y89 F122 D126 V129 L292G81-L85 WeakPolarHBondContact O-CG 3.38Å; G81-L85 PolarHBondContact O-N 2.85Å; L85-V87 VanDerWaalsContact C-N 3.3Å; L85-V87 PolarHBondContact O-N 3.21Å; L85-G88 CarbonylContact O-C 3.56Å; L85-G88 WeakPolarHBondContact O-CA 3.25Å; L85-G88 PolarHBondContact O-N 2.77Å; L85-Y89 HydrophobicContact CB-CE2 4.38Å; L85-Y89 VanDerWaalsContact O-CD2 3.23Å; L85-Y89 WeakPolarHBondContact O-CD2 3.42Å; L85-Y89 PolarHBondContact O-N 2.65Å; L85-F122 HydrophobicContact CD2-CB 4.46Å; L85-F122 HydrophobicContact CD2-CD1 3.9Å; L85-D126 WeakPolarHBondContact CD2-OD1 3.45Å; L85-V129 HydrophobicContact CD1-CG2 4.15Å; L85-L292 HydrophobicContact CB-CD1 3.53Å; L85-L292 HydrophobicContact CD1-CD1 4.04Å; L85-L292 HydrophobicContact CD1-CD2 3.67Å; L85-L292 HydrophobicContact CG-CD1 4.43Å
86G97.3Very high94.7Very high0 Ų021.4 Ų21.40%013%0.125CC..Hα-helixtrans-56.5-43175.200000112.7S82 A83 V84 Y89 I90S82-G86 PolarHBondContact O-N 3.05Å; A83-G86 WeakPolarHBondContact O-CA 3.36Å; A83-G86 PolarHBondContact O-N 3.12Å; A83-G86 VanDerWaalsContact O-N 3.13Å; V84-G86 VanDerWaalsContact C-N 3.3Å; V84-G86 PolarHBondContact O-N 3.37Å; G86-Y89 PolarHBondContact O-N 3.18Å; G86-I90 WeakPolarHBondContact O-CG1 3.47Å; G86-I90 PolarHBondContact O-N 2.91Å; G86-I90 VanDerWaalsContact O-N 3.12Å
87V97.3Very high94.5Very high58 Ų5822.8 Ų22.835%0.35213%0.13SC..Hα-helixtrans-63.1-43.8172.8-178.30000110.5I52 A83 V84 L85 Y89 I90 V91 L121I52-V87 HydrophobicContact CD1-CG2 3.7Å; I52-V87 HydrophobicContact CG1-CG2 4.16Å; A83-V87 PolarHBondContact O-N 2.91Å; V84-V87 PolarHBondContact O-N 3.44Å; L85-V87 VanDerWaalsContact C-N 3.3Å; L85-V87 PolarHBondContact O-N 3.21Å; V87-Y89 VanDerWaalsContact C-N 3.34Å; V87-Y89 PolarHBondContact O-N 3.04Å; V87-I90 PolarHBondContact O-N 3.4Å; V87-V91 HydrophobicContact CG1-CG2 4.18Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.4Å; V87-V91 PolarHBondContact O-N 3.5Å; V87-L121 HydrophobicContact CB-CD1 4.07Å; V87-L121 HydrophobicContact CG1-CD1 3.65Å
88G95.7Very high94.1Very high0 Ų027.5 Ų27.50%015%0.149CC..Hα-helixtrans-55.9-45.2176.300000113V84 L85 V91 N92V84-G88 PolarHBondContact O-N 3.18Å; L85-G88 CarbonylContact O-C 3.56Å; L85-G88 WeakPolarHBondContact O-CA 3.25Å; L85-G88 PolarHBondContact O-N 2.77Å; G88-V91 PolarHBondContact O-N 3.41Å; G88-N92 VanDerWaalsContact O-CB 3.26Å; G88-N92 WeakPolarHBondContact O-CB 3.26Å; G88-N92 PolarHBondContact O-N 2.99Å
89Y95Very high93.3Very high7 Ų734.2 Ų34.23%0.02719%0.192CC..Hα-helixtrans-65.2-43.1177.6-73.8-59.4000112.3F44 L85 G86 V87 N92 H93 F122 Q288 A289 L292F44-Y89 AromaticContact CD1-CD1 3.58Å; F44-Y89 HydrophobicContact CD1-CD1 3.58Å; F44-Y89 AromaticContact CD1-CE1 3.74Å; F44-Y89 HydrophobicContact CD1-CE1 3.74Å; F44-Y89 HydrophobicContact CD1-CG 4.33Å; F44-Y89 HydrophobicContact CE1-CD1 4.1Å; F44-Y89 AromaticContact CE1-CE1 3.78Å; F44-Y89 HydrophobicContact CE1-CE1 3.78Å; F44-Y89 HydrophobicContact CG-CD1 4.41Å; L85-Y89 HydrophobicContact CB-CE2 4.38Å; L85-Y89 VanDerWaalsContact O-CD2 3.23Å; L85-Y89 WeakPolarHBondContact O-CD2 3.42Å; L85-Y89 PolarHBondContact O-N 2.65Å; G86-Y89 PolarHBondContact O-N 3.18Å; V87-Y89 VanDerWaalsContact C-N 3.34Å; V87-Y89 PolarHBondContact O-N 3.04Å; Y89-N92 PolarHBondContact O-N 3.45Å; Y89-H93 AromaticContact CD1-CD2 3.94Å; Y89-H93 AromaticContact CD1-NE2 3.97Å; Y89-H93 WeakPolarHBondContact O-CB 3.47Å; Y89-H93 PolarHBondContact O-CD2 3.5Å; Y89-H93 PolarHBondContact O-N 3.25Å; Y89-F122 AromaticContact CD1-CE1 3.9Å; Y89-F122 HydrophobicContact CD1-CE1 3.9Å; Y89-F122 AromaticContact CD1-CZ 3.95Å; Y89-F122 HydrophobicContact CD1-CZ 3.95Å; Y89-F122 HydrophobicContact CD2-CE1 4.47Å; Y89-F122 HydrophobicContact CE1-CE1 4.09Å; Y89-F122 HydrophobicContact CE1-CZ 4.25Å; Y89-F122 HydrophobicContact CG-CE1 4.09Å; Y89-F122 HydrophobicContact CG-CZ 4.48Å; Y89-Q288 PolarHBondContact OH-OE1 3.19Å; Y89-A289 HydrophobicContact CD2-CB 4.18Å; Y89-A289 HydrophobicContact CE1-CB 4.15Å; Y89-A289 HydrophobicContact CE2-CB 3.77Å; Y89-L292 HydrophobicContact CD2-CD1 4.11Å; Y89-L292 HydrophobicContact CE2-CD1 3.65Å
90I95.3Very high92.4Very high53 Ų5338.8 Ų38.827%0.27222%0.224SC..Hα-helixtrans-61.7-47.1177.3-66.7169.1000110.5I49 I52 G86 V87 G94I49-I90 HydrophobicContact CG1-CD1 3.68Å; I49-I90 HydrophobicContact CG1-CG1 4.22Å; I52-I90 HydrophobicContact CD1-CD1 3.51Å; G86-I90 WeakPolarHBondContact O-CG1 3.47Å; G86-I90 PolarHBondContact O-N 2.91Å; G86-I90 VanDerWaalsContact O-N 3.12Å; V87-I90 PolarHBondContact O-N 3.4Å; I90-G94 WeakPolarHBondContact O-CA 3.45Å; I90-G94 PolarHBondContact O-N 3.46Å
91V92.4Very high91.5Very high37 Ų3737.1 Ų37.122%0.22421%0.214CC..Hα-helixtrans-63.9-44.7179.5173.40000110.8V87 G88 R95 F117 N118V87-V91 HydrophobicContact CG1-CG2 4.18Å; V87-V91 VanDerWaalsContact O-CG2 3.28Å; V87-V91 WeakPolarHBondContact O-CG2 3.4Å; V87-V91 PolarHBondContact O-N 3.5Å; G88-V91 PolarHBondContact O-N 3.41Å; V91-R95 WeakPolarHBondContact O-CD 3.39Å; V91-R95 WeakPolarHBondContact O-CG 3.3Å; V91-F117 HydrophobicContact CB-CE1 4.44Å; V91-F117 HydrophobicContact CB-CZ 4.21Å; V91-F117 HydrophobicContact CG1-CD1 4.06Å; V91-F117 HydrophobicContact CG1-CE1 3.47Å; V91-F117 VanDerWaalsContact CG1-CE1 3.47Å; V91-F117 HydrophobicContact CG1-CE2 4.46Å; V91-F117 HydrophobicContact CG1-CZ 3.72Å; V91-F117 HydrophobicContact CG2-CE1 4.08Å; V91-F117 HydrophobicContact CG2-CE2 4.13Å; V91-F117 HydrophobicContact CG2-CZ 3.48Å; V91-F117 VanDerWaalsContact CG2-CZ 3.48Å; V91-N118 HydrophobicContact CB-CB 4.16Å; V91-N118 HydrophobicContact CG1-CB 3.93Å
92N90.6Very high90.4Very high23 Ų2344.9 Ų44.912%0.12325%0.25CC..Hα-helixtrans-70.9-43.6-175.7-174.850.9000113.6G88 Y89 R95 Q96 N118 F122G88-N92 VanDerWaalsContact O-CB 3.26Å; G88-N92 WeakPolarHBondContact O-CB 3.26Å; G88-N92 PolarHBondContact O-N 2.99Å; Y89-N92 PolarHBondContact O-N 3.45Å; N92-R95 VanDerWaalsContact O-CG 3.25Å; N92-R95 WeakPolarHBondContact O-CG 3.42Å; N92-R95 PolarHBondContact O-NE 2.89Å; N92-R95 VanDerWaalsContact O-NE 3.12Å; N92-R95 PolarHBondContact OD1-NH2 2.91Å; N92-Q96 PolarHBondContact O-NE2 3.47Å; N92-N118 HydrophobicContact CB-CB 4.03Å; N92-N118 PolarHBondContact OD1-ND2 3.01Å; N92-F122 HydrophobicContact CB-CE2 4.21Å; N92-F122 HydrophobicContact CB-CZ 4Å
93H91.4Very high89.2Confident18 Ų1846.8 Ų46.88%0.08326%0.257CS..Hα-helixtrans-97.4-27.1-173.5-64.9-81.7000112.6N41 F44 V45 Y89 Q96 L97N41-H93 HydrophobicContact CB-CB 4.27Å; N41-H93 PolarHBondContact OD1-ND1 3.04Å; F44-H93 HydrophobicContact CB-CB 3.9Å; F44-H93 AromaticContact CD1-NE2 3.9Å; F44-H93 AromaticContact CD2-CE1 3.38Å; F44-H93 WeakPolarHBondContact CD2-CE1 3.37Å; F44-H93 AromaticContact CD2-CG 3.93Å; F44-H93 AromaticContact CD2-ND1 3.54Å; F44-H93 AromaticContact CD2-NE2 3.72Å; F44-H93 AromaticContact CE2-CE1 3.66Å; F44-H93 AromaticContact CG-CD2 3.63Å; F44-H93 AromaticContact CG-CE1 3.78Å; F44-H93 AromaticContact CG-CG 3.85Å; F44-H93 AromaticContact CG-ND1 3.95Å; F44-H93 AromaticContact CG-NE2 3.63Å; V45-H93 HydrophobicContact CG2-CB 4.02Å; Y89-H93 AromaticContact CD1-CD2 3.94Å; Y89-H93 AromaticContact CD1-NE2 3.97Å; Y89-H93 WeakPolarHBondContact O-CB 3.47Å; Y89-H93 PolarHBondContact O-CD2 3.5Å; Y89-H93 PolarHBondContact O-N 3.25Å; H93-Q96 PolarHBondContact O-N 2.98Å; H93-Q96 VanDerWaalsContact O-N 3.17Å; H93-L97 PolarHBondContact O-N 3.48Å
94G91.3Very high87.9Confident24 Ų2447 Ų4725%0.24726%0.258CS..Hα-helixtrans-62.1-43.8175.500000112.2I90 Q96 L97I90-G94 WeakPolarHBondContact O-CA 3.45Å; I90-G94 PolarHBondContact O-N 3.46Å; G94-Q96 PolarHBondContact O-N 3.32Å; G94-L97 WeakPolarHBondContact O-CB 3.48Å; G94-L97 PolarHBondContact O-N 3.13Å
95R88.3Confident86.8Confident37 Ų3752.2 Ų52.214%0.1428%0.28CS..G310 helixtrans-58.6-35.5173.667.6-174.8177.4166-8.1112.8V91 N92 L97 E98 F101 W103 C116V91-R95 WeakPolarHBondContact O-CD 3.39Å; V91-R95 WeakPolarHBondContact O-CG 3.3Å; N92-R95 VanDerWaalsContact O-CG 3.25Å; N92-R95 WeakPolarHBondContact O-CG 3.42Å; N92-R95 PolarHBondContact O-NE 2.89Å; N92-R95 VanDerWaalsContact O-NE 3.12Å; N92-R95 PolarHBondContact OD1-NH2 2.91Å; R95-L97 PolarHBondContact O-N 3.37Å; R95-E98 WeakPolarHBondContact O-CB 3.19Å; R95-E98 PolarHBondContact O-N 3.43Å; R95-F101 HydrophobicContact CB-CD2 4.02Å; R95-F101 HydrophobicContact CB-CE2 3.86Å; R95-F101 HydrophobicContact CG-CD2 4.21Å; R95-F101 HydrophobicContact CG-CE2 3.66Å; R95-F101 HydrophobicContact CG-CZ 4Å; R95-F101 VanDerWaalsContact O-CB 3.25Å; R95-F101 WeakPolarHBondContact O-CB 3.37Å; R95-F101 WeakPolarHBondContact O-CD2 3.42Å; R95-F101 WeakPolarHBondContact O-CG 3.09Å; R95-W103 VanDerWaalsContact CZ-CZ3 3.46Å; R95-C116 PolarHBondContact NH1-SG 3.22Å
96Q88.1Confident85.8Confident34 Ų3458 Ų5816%0.15931%0.311CS..G310 helixtrans-76.6-4.2-179.8-63.5178.354.400113N41 N92 H93 G94 F101 W103N41-Q96 VanDerWaalsContact ND2-CB 3.31Å; N41-Q96 WeakPolarHBondContact ND2-CB 3.42Å; N92-Q96 PolarHBondContact O-NE2 3.47Å; H93-Q96 PolarHBondContact O-N 2.98Å; H93-Q96 VanDerWaalsContact O-N 3.17Å; G94-Q96 PolarHBondContact O-N 3.32Å; Q96-F101 HydrophobicContact CB-CD1 4.41Å; Q96-F101 HydrophobicContact CB-CE1 4.49Å; Q96-F101 HydrophobicContact CG-CD1 4.15Å; Q96-F101 HydrophobicContact CG-CE1 3.74Å; Q96-F101 HydrophobicContact CG-CZ 4.18Å; Q96-W103 HydrophobicContact CG-CZ2 4.31Å
97L89.6Confident85.2Confident41 Ų4160.4 Ų60.422%0.21532%0.323CS..G310 helixtrans-88.9-13.1171.1-64.9172.7000112.2T38 N41 W42 V45 H93 G94 R95 P99T38-L97 HydrophobicContact CG2-CD2 4.19Å; N41-L97 HydrophobicContact CB-CD2 3.58Å; N41-L97 HydrophobicContact CB-CG 4.07Å; W42-L97 HydrophobicContact CD2-CD1 3.8Å; W42-L97 HydrophobicContact CD2-CD2 4.33Å; W42-L97 HydrophobicContact CE3-CD1 4.02Å; W42-L97 HydrophobicContact CG-CD1 4.31Å; W42-L97 HydrophobicContact CG-CD2 4.12Å; W42-L97 HydrophobicContact CH2-CD1 4.24Å; W42-L97 HydrophobicContact CZ2-CD1 4.03Å; W42-L97 HydrophobicContact CZ3-CD1 4.23Å; V45-L97 HydrophobicContact CG2-CD1 3.93Å; H93-L97 PolarHBondContact O-N 3.48Å; G94-L97 WeakPolarHBondContact O-CB 3.48Å; G94-L97 PolarHBondContact O-N 3.13Å; R95-L97 PolarHBondContact O-N 3.37Å; L97-P99 WeakPolarHBondContact O-CD 3.5Å
98E86.8Confident84.7Confident114 Ų11458.9 Ų58.953%0.53332%0.315SS..SBendtrans-69.8126.6175.6-65.6177.5-17000109.6R95 S100 F101R95-E98 WeakPolarHBondContact O-CB 3.19Å; R95-E98 PolarHBondContact O-N 3.43Å; E98-S100 PolarHBondContact O-N 3.31Å; E98-F101 HydrophobicContact CB-CB 4.11Å; E98-F101 WeakPolarHBondContact O-CB 3.36Å; E98-F101 PolarHBondContact O-N 3.37Å
99P78.1Confident84.3Confident143 Ų14358.9 Ų58.993%0.92932%0.315SS*.THydrogen-bonded Turntrans-60.5-28.6-179.9-25.434.4000113.7L97 F101L97-P99 WeakPolarHBondContact O-CD 3.5Å; P99-F101 VanDerWaalsContact C-N 3.31Å
100S78.4Confident84Confident96 Ų9661.3 Ų61.367%0.67133%0.328SS*.THydrogen-bonded Turntrans-87.53.5176.3540000113.4E98 Q102E98-S100 PolarHBondContact O-N 3.31Å; S100-Q102 PolarHBondContact O-N 2.87Å
101F78.2Confident83.7Confident52 Ų5264 Ų6423%0.22834%0.339CS..  trans-63.5114.9-178.2-178-103.8000110R95 Q96 E98 P99 W103R95-F101 HydrophobicContact CB-CD2 4.02Å; R95-F101 HydrophobicContact CB-CE2 3.86Å; R95-F101 HydrophobicContact CG-CD2 4.21Å; R95-F101 HydrophobicContact CG-CE2 3.66Å; R95-F101 HydrophobicContact CG-CZ 4Å; R95-F101 VanDerWaalsContact O-CB 3.25Å; R95-F101 WeakPolarHBondContact O-CB 3.37Å; R95-F101 WeakPolarHBondContact O-CD2 3.42Å; R95-F101 WeakPolarHBondContact O-CG 3.09Å; Q96-F101 HydrophobicContact CB-CD1 4.41Å; Q96-F101 HydrophobicContact CB-CE1 4.49Å; Q96-F101 HydrophobicContact CG-CD1 4.15Å; Q96-F101 HydrophobicContact CG-CE1 3.74Å; Q96-F101 HydrophobicContact CG-CZ 4.18Å; E98-F101 HydrophobicContact CB-CB 4.11Å; E98-F101 WeakPolarHBondContact O-CB 3.36Å; E98-F101 PolarHBondContact O-N 3.37Å; P99-F101 VanDerWaalsContact C-N 3.31Å; F101-W103 AromaticContact CE1-CD1 3.99Å; F101-W103 AromaticContact CE1-CD2 3.76Å; F101-W103 HydrophobicContact CE1-CD2 3.76Å; F101-W103 AromaticContact CE1-CE2 3.58Å; F101-W103 HydrophobicContact CE1-CE3 4.31Å; F101-W103 HydrophobicContact CE1-CG 4.05Å; F101-W103 HydrophobicContact CE1-CZ2 4Å; F101-W103 AromaticContact CE1-NE1 3.72Å; F101-W103 AromaticContact CZ-CD2 3.77Å; F101-W103 HydrophobicContact CZ-CD2 3.77Å; F101-W103 AromaticContact CZ-CE2 3.91Å; F101-W103 AromaticContact CZ-CE3 3.85Å; F101-W103 HydrophobicContact CZ-CE3 3.85Å; F101-W103 HydrophobicContact CZ-CG 4.32Å; F101-W103 HydrophobicContact CZ-CH2 4.25Å; F101-W103 HydrophobicContact CZ-CZ2 4.15Å; F101-W103 HydrophobicContact CZ-CZ3 4.09Å
102Q74.7Confident83.5Confident163 Ų16362.2 Ų62.276%0.76233%0.328SS*.  trans-116.7137.2166.5-68.2-177.6-2400107.3S100S100-Q102 PolarHBondContact O-N 2.87Å
103W72.7Confident83.5Confident40 Ų4061.2 Ų61.215%0.15232%0.323CS..PPolyproline II helixtrans-61.1137170.3-74.6103.8000108.5R95 Q96 F101 E105 I188 C189 Y190R95-W103 VanDerWaalsContact CZ-CZ3 3.46Å; Q96-W103 HydrophobicContact CG-CZ2 4.31Å; F101-W103 AromaticContact CE1-CD1 3.99Å; F101-W103 AromaticContact CE1-CD2 3.76Å; F101-W103 HydrophobicContact CE1-CD2 3.76Å; F101-W103 AromaticContact CE1-CE2 3.58Å; F101-W103 HydrophobicContact CE1-CE3 4.31Å; F101-W103 HydrophobicContact CE1-CG 4.05Å; F101-W103 HydrophobicContact CE1-CZ2 4Å; F101-W103 AromaticContact CE1-NE1 3.72Å; F101-W103 AromaticContact CZ-CD2 3.77Å; F101-W103 HydrophobicContact CZ-CD2 3.77Å; F101-W103 AromaticContact CZ-CE2 3.91Å; F101-W103 AromaticContact CZ-CE3 3.85Å; F101-W103 HydrophobicContact CZ-CE3 3.85Å; F101-W103 HydrophobicContact CZ-CG 4.32Å; F101-W103 HydrophobicContact CZ-CH2 4.25Å; F101-W103 HydrophobicContact CZ-CZ2 4.15Å; F101-W103 HydrophobicContact CZ-CZ3 4.09Å; W103-E105 PolarHBondContact O-N 3.38Å; W103-I188 HydrophobicContact CB-CB 4.48Å; W103-I188 HydrophobicContact CB-CG1 4.44Å; W103-I188 HydrophobicContact CB-CG2 3.81Å; W103-I188 HydrophobicContact CD2-CG2 3.66Å; W103-I188 HydrophobicContact CE3-CG2 4.14Å; W103-I188 HydrophobicContact CG-CG2 3.5Å; W103-I188 VanDerWaalsContact CG-CG2 3.5Å; W103-C189 HydrophobicContact CE3-CB 4Å; W103-C189 HydrophobicContact CZ3-CB 4.16Å; W103-C189 WeakPolarHBondContact CZ3-O 3.32Å; W103-Y190 HydrophobicContact CZ2-CE1 4.1Å
104P70Confident83.4Confident17 Ų1764.9 Ų64.911%0.1135%0.347CS..PPolyproline II helixtrans-60.4116.4172.2-15.728.3000108.5M107 Q115P104-M107 HydrophobicContact CB-CE 3.42Å; P104-M107 VanDerWaalsContact CB-CE 3.42Å; P104-M107 HydrophobicContact CB-CG 4.14Å; P104-M107 HydrophobicContact CB-SD 3.35Å; P104-M107 WeakPolarHBondContact CB-SD 3.29Å; P104-M107 HydrophobicContact CG-CE 4.46Å; P104-M107 HydrophobicContact CG-SD 4.29Å; P104-Q115 VanDerWaalsContact CG-CD 3.41Å
105E74Confident83.1Confident140 Ų14068.7 Ų68.765%0.65436%0.358SS*.PPolyproline II helixtrans-88.5152.8179.3-62.5-174.4176.800110.5W103 M107W103-E105 PolarHBondContact O-N 3.38Å; E105-M107 VanDerWaalsContact C-N 3.31Å; E105-M107 PolarHBondContact O-N 3.36Å
106N77.7Confident83Confident120 Ų12067 Ų6764%0.64235%0.351SS*.SBendtrans56.839.6171.9-57.1-47.7000114.7V185 L186N106-V185 VanDerWaalsContact C-CG1 3.48Å; N106-V185 HydrophobicContact CB-CG1 3.89Å; N106-L186 WeakPolarHBondContact CA-O 3.45Å; N106-L186 PolarHBondContact N-O 2.98Å; N106-L186 VanDerWaalsContact N-O 3.13Å
107M83.7Confident83Confident52 Ų5269.9 Ų69.926%0.25636%0.364SS..BIsolated β-bridgetrans-101.6151.3176.5-71.9-166.7178.500112.3P104 E105 E111 Q115 L186P104-M107 HydrophobicContact CB-CE 3.42Å; P104-M107 VanDerWaalsContact CB-CE 3.42Å; P104-M107 HydrophobicContact CB-CG 4.14Å; P104-M107 HydrophobicContact CB-SD 3.35Å; P104-M107 WeakPolarHBondContact CB-SD 3.29Å; P104-M107 HydrophobicContact CG-CE 4.46Å; P104-M107 HydrophobicContact CG-SD 4.29Å; E105-M107 VanDerWaalsContact C-N 3.31Å; E105-M107 PolarHBondContact O-N 3.36Å; M107-E111 HydrophobicContact CB-CB 4.2Å; M107-E111 HydrophobicContact SD-CB 4.26Å; M107-Q115 PolarHBondContact SD-OE1 2.9Å; M107-Q115 VanDerWaalsContact SD-OE1 3.41Å; M107-L186 PolarHBondContact N-O 2.88Å; M107-L186 PolarHBondContact O-N 3.05Å
108S86.9Confident83.2Confident26 Ų2668.2 Ų68.218%0.18236%0.355CS..  trans-68.4156.8167.269.50000110.9L110 E111 C112S108-L110 PolarHBondContact O-N 3.16Å; S108-E111 VanDerWaalsContact CB-OE2 3.26Å; S108-E111 WeakPolarHBondContact CB-OE2 3.33Å; S108-E111 PolarHBondContact N-OE2 2.78Å; S108-E111 PolarHBondContact O-N 3.33Å; S108-E111 VanDerWaalsContact OG-CG 3.29Å; S108-E111 WeakPolarHBondContact OG-CG 3.47Å; S108-E111 PolarHBondContact OG-N 2.9Å; S108-E111 PolarHBondContact OG-OE2 2.87Å; S108-C112 PolarHBondContact O-N 3.38Å
109P87.2Confident83.3Confident0 Ų062.9 Ų62.90%033%0.33CS..Hα-helixtrans-59.7-34.2-179.9-15.124.2000112.6C112 M113 A179 N182 T184 L186 M194P109-C112 PolarHBondContact O-N 3.28Å; P109-M113 WeakPolarHBondContact O-CB 3.49Å; P109-M113 WeakPolarHBondContact O-CG 3.42Å; P109-M113 PolarHBondContact O-N 3.45Å; P109-A179 HydrophobicContact CB-CB 4.22Å; P109-N182 VanDerWaalsContact CD-O 3.28Å; P109-N182 WeakPolarHBondContact CD-O 3.14Å; P109-N182 HydrophobicContact CG-CB 3.91Å; P109-N182 VanDerWaalsContact CG-O 3.3Å; P109-N182 WeakPolarHBondContact CG-O 3.43Å; P109-T184 WeakPolarHBondContact CD-O 3.24Å; P109-L186 HydrophobicContact CB-CD1 3.96Å; P109-L186 HydrophobicContact CG-CD1 3.5Å; P109-M194 WeakPolarHBondContact CB-O 3.12Å
110L89.6Confident84.1Confident58 Ų5857.2 Ų57.230%0.30429%0.293SS..Hα-helixtrans-67.2-44.4177.1-176.762.5000112.2S108 C112 M113 V114 W176 A180S108-L110 PolarHBondContact O-N 3.16Å; L110-C112 VanDerWaalsContact C-N 3.33Å; L110-M113 WeakPolarHBondContact O-CB 3.5Å; L110-M113 PolarHBondContact O-N 3.37Å; L110-V114 WeakPolarHBondContact O-CG2 3.33Å; L110-V114 PolarHBondContact O-N 2.92Å; L110-W176 HydrophobicContact CD1-CE3 3.81Å; L110-W176 HydrophobicContact CD1-CZ3 3.87Å; L110-A180 HydrophobicContact CD1-CB 4.29Å; L110-A180 HydrophobicContact CD2-CB 4.32Å
111E88.8Confident84.9Confident109 Ų10954.1 Ų54.151%0.50927%0.269SS..Hα-helixtrans-61.9-44.1175.4-71.8161.5145.300110.7M107 S108 M113 V114 Q115M107-E111 HydrophobicContact CB-CB 4.2Å; M107-E111 HydrophobicContact SD-CB 4.26Å; S108-E111 VanDerWaalsContact CB-OE2 3.26Å; S108-E111 WeakPolarHBondContact CB-OE2 3.33Å; S108-E111 PolarHBondContact N-OE2 2.78Å; S108-E111 PolarHBondContact O-N 3.33Å; S108-E111 VanDerWaalsContact OG-CG 3.29Å; S108-E111 WeakPolarHBondContact OG-CG 3.47Å; S108-E111 PolarHBondContact OG-N 2.9Å; S108-E111 PolarHBondContact OG-OE2 2.87Å; E111-M113 VanDerWaalsContact C-N 3.33Å; E111-M113 PolarHBondContact O-N 2.71Å; E111-V114 PolarHBondContact O-N 2.96Å; E111-Q115 PolarHBondContact O-N 3.46Å
112C88.3Confident85.7Confident0 Ų052.8 Ų52.80%026%0.263CS..Hα-helixtrans-58.2-43172.9-80.40000112S108 P109 L110 Q115 C116 C189 M194S108-C112 PolarHBondContact O-N 3.38Å; P109-C112 PolarHBondContact O-N 3.28Å; L110-C112 VanDerWaalsContact C-N 3.33Å; C112-Q115 PolarHBondContact O-N 3.36Å; C112-C116 WeakPolarHBondContact O-CA 3.3Å; C112-C116 WeakPolarHBondContact O-CB 3.35Å; C112-C116 PolarHBondContact O-N 2.88Å; C112-C116 PolarHBondContact O-SG 2.91Å; C112-C189 HydrophobicContact CB-CB 3.7Å; C112-C189 WeakPolarHBondContact CB-SG 3.35Å; C112-C189 VanDerWaalsContact SG-CA 3.59Å; C112-C189 WeakPolarHBondContact SG-CB 3.33Å; C112-C189 CovalentContact SG-SG 2.05Å; C112-C189 PolarHBondContact SG-SG 3.29Å; C112-M194 VanDerWaalsContact C-SD 3.59Å; C112-M194 HydrophobicContact CB-CE 4.36Å; C112-M194 HydrophobicContact CB-CG 3.56Å; C112-M194 HydrophobicContact CB-SD 3.57Å; C112-M194 VanDerWaalsContact CB-SD 3.57Å
113M89Confident86.6Confident1 Ų145 Ų451%0.00523%0.227CC..Hα-helixtrans-63.8-38.5177.8-80.6-76.4-75.200113P109 L110 E111 C116 F117 I119 A175 W176 A179 M194 V195P109-M113 WeakPolarHBondContact O-CB 3.49Å; P109-M113 WeakPolarHBondContact O-CG 3.42Å; P109-M113 PolarHBondContact O-N 3.45Å; L110-M113 WeakPolarHBondContact O-CB 3.5Å; L110-M113 PolarHBondContact O-N 3.37Å; E111-M113 VanDerWaalsContact C-N 3.33Å; E111-M113 PolarHBondContact O-N 2.71Å; M113-C116 CarbonylContact O-C 3.39Å; M113-F117 PolarHBondContact O-N 3.23Å; M113-I119 HydrophobicContact CE-CG2 4.22Å; M113-I119 HydrophobicContact SD-CB 4.05Å; M113-I119 HydrophobicContact SD-CD1 3.84Å; M113-I119 HydrophobicContact SD-CG1 4.48Å; M113-I119 HydrophobicContact SD-CG2 3.84Å; M113-A175 HydrophobicContact CE-CB 4.49Å; M113-W176 HydrophobicContact CB-CE3 4.38Å; M113-W176 HydrophobicContact CB-CH2 4.11Å; M113-W176 HydrophobicContact CB-CZ3 4Å; M113-W176 HydrophobicContact CE-CD2 3.95Å; M113-W176 HydrophobicContact CE-CG 4.1Å; M113-W176 HydrophobicContact CE-CZ2 4.35Å; M113-A179 HydrophobicContact CG-CB 3.67Å; M113-M194 HydrophobicContact CG-CB 4.17Å; M113-M194 HydrophobicContact CG-SD 4.27Å; M113-M194 HydrophobicContact SD-CB 4.29Å; M113-M194 HydrophobicContact SD-SD 4.32Å; M113-V195 HydrophobicContact SD-CG2 4.08Å
114V89.3Confident87.8Confident96 Ų9645.7 Ų45.758%0.58223%0.232SC*.Hα-helixtrans-66.1-45.9176.3172.10000110.8L110 E111 W176L110-V114 WeakPolarHBondContact O-CG2 3.33Å; L110-V114 PolarHBondContact O-N 2.92Å; E111-V114 PolarHBondContact O-N 2.96Å; V114-W176 HydrophobicContact CG2-CH2 3.98Å; V114-W176 HydrophobicContact CG2-CZ3 3.84Å
115Q85.5Confident89.1Confident104 Ų10444.9 Ų44.949%0.48623%0.227SC..Hα-helixtrans-72.3-33.7179.5-170.1169.8300112.5P104 M107 E111 C112P104-Q115 VanDerWaalsContact CG-CD 3.41Å; M107-Q115 PolarHBondContact SD-OE1 2.9Å; M107-Q115 VanDerWaalsContact SD-OE1 3.41Å; E111-Q115 PolarHBondContact O-N 3.46Å; C112-Q115 PolarHBondContact O-N 3.36Å
116C85.9Confident90.1Very high0 Ų038.3 Ų38.30%020%0.197CC..THydrogen-bonded Turntrans-105.556.2-178.4-49.60000111.2R95 C112 M113 N118 I119 M194R95-C116 PolarHBondContact NH1-SG 3.22Å; C112-C116 WeakPolarHBondContact O-CA 3.3Å; C112-C116 WeakPolarHBondContact O-CB 3.35Å; C112-C116 PolarHBondContact O-N 2.88Å; C112-C116 PolarHBondContact O-SG 2.91Å; M113-C116 CarbonylContact O-C 3.39Å; C116-N118 WeakPolarHBondContact CB-OD1 3.35Å; C116-N118 PolarHBondContact O-N 3.12Å; C116-N118 PolarHBondContact O-OD1 3.03Å; C116-I119 PolarHBondContact O-N 3.49Å; C116-M194 HydrophobicContact CB-CE 3.76Å; C116-M194 HydrophobicContact CB-SD 4.03Å
117F89.5Confident91.1Very high96 Ų9633 Ų3342%0.42117%0.168SC..THydrogen-bonded Turntrans-61.5-11.9-176.877.9-86.3000114.3V91 M113 I119 T120 L121V91-F117 HydrophobicContact CB-CE1 4.44Å; V91-F117 HydrophobicContact CB-CZ 4.21Å; V91-F117 HydrophobicContact CG1-CD1 4.06Å; V91-F117 HydrophobicContact CG1-CE1 3.47Å; V91-F117 VanDerWaalsContact CG1-CE1 3.47Å; V91-F117 HydrophobicContact CG1-CE2 4.46Å; V91-F117 HydrophobicContact CG1-CZ 3.72Å; V91-F117 HydrophobicContact CG2-CE1 4.08Å; V91-F117 HydrophobicContact CG2-CE2 4.13Å; V91-F117 HydrophobicContact CG2-CZ 3.48Å; V91-F117 VanDerWaalsContact CG2-CZ 3.48Å; M113-F117 PolarHBondContact O-N 3.23Å; F117-I119 PolarHBondContact O-N 3.09Å; F117-I119 VanDerWaalsContact O-N 3.12Å; F117-T120 WeakPolarHBondContact O-CB 3.32Å; F117-T120 PolarHBondContact O-N 2.83Å; F117-L121 HydrophobicContact CD2-CD1 3.93Å; F117-L121 HydrophobicContact CD2-CG 4.1Å; F117-L121 HydrophobicContact CE2-CD1 3.59Å; F117-L121 HydrophobicContact CE2-CG 4.21Å; F117-L121 PolarHBondContact O-N 3.26Å
118N91.9Very high91.7Very high5 Ų531.7 Ų31.73%0.02716%0.162CC..Hα-helixtrans-53.5-28.617465.2-81.9000113.2V91 N92 C116 T120 L121 F122V91-N118 HydrophobicContact CB-CB 4.16Å; V91-N118 HydrophobicContact CG1-CB 3.93Å; N92-N118 HydrophobicContact CB-CB 4.03Å; N92-N118 PolarHBondContact OD1-ND2 3.01Å; C116-N118 WeakPolarHBondContact CB-OD1 3.35Å; C116-N118 PolarHBondContact O-N 3.12Å; C116-N118 PolarHBondContact O-OD1 3.03Å; N118-T120 VanDerWaalsContact C-N 3.34Å; N118-T120 PolarHBondContact O-N 3.34Å; N118-L121 WeakPolarHBondContact O-CB 3.27Å; N118-L121 PolarHBondContact O-N 3.41Å; N118-F122 HydrophobicContact CB-CE2 4.42Å; N118-F122 WeakPolarHBondContact ND2-CE2 3.23Å; N118-F122 WeakPolarHBondContact O-CD2 3.27Å; N118-F122 WeakPolarHBondContact O-CG 3.35Å; N118-F122 PolarHBondContact O-N 3.4Å
119I90.3Very high92.1Very high2 Ų230.5 Ų30.51%0.0115%0.154CC..Hα-helixtrans-62.5-42.8176.1-61.8-169.9000111.5M113 C116 F117 L121 F122 K123 H191 M194 V195M113-I119 HydrophobicContact CE-CG2 4.22Å; M113-I119 HydrophobicContact SD-CB 4.05Å; M113-I119 HydrophobicContact SD-CD1 3.84Å; M113-I119 HydrophobicContact SD-CG1 4.48Å; M113-I119 HydrophobicContact SD-CG2 3.84Å; C116-I119 PolarHBondContact O-N 3.49Å; F117-I119 PolarHBondContact O-N 3.09Å; F117-I119 VanDerWaalsContact O-N 3.12Å; I119-L121 VanDerWaalsContact C-N 3.27Å; I119-L121 PolarHBondContact O-N 3.46Å; I119-F122 PolarHBondContact O-N 2.86Å; I119-K123 HydrophobicContact CG2-CD 4.46Å; I119-K123 PolarHBondContact O-N 2.95Å; I119-H191 HydrophobicContact CD1-CB 4.17Å; I119-H191 VanDerWaalsContact CG2-CD2 3.47Å; I119-H191 WeakPolarHBondContact CG2-CD2 3.33Å; I119-M194 HydrophobicContact CD1-CB 4.17Å; I119-M194 HydrophobicContact CD1-CE 3.59Å; I119-M194 HydrophobicContact CD1-CG 4.34Å; I119-M194 HydrophobicContact CD1-SD 3.33Å; I119-M194 WeakPolarHBondContact CD1-SD 3.49Å; I119-V195 HydrophobicContact CG2-CG2 4.08Å
120T94.1Very high92.5Very high25 Ų2530.6 Ų30.615%0.15315%0.154CC..Hα-helixtrans-63.7-39.8177.2-61.70000110.2F117 N118 K123 I124 V172 W176F117-T120 WeakPolarHBondContact O-CB 3.32Å; F117-T120 PolarHBondContact O-N 2.83Å; N118-T120 VanDerWaalsContact C-N 3.34Å; N118-T120 PolarHBondContact O-N 3.34Å; T120-K123 PolarHBondContact O-N 3.31Å; T120-I124 HydrophobicContact CG2-CD1 3.81Å; T120-I124 HydrophobicContact CG2-CG1 4.5Å; T120-I124 VanDerWaalsContact O-CG1 3.24Å; T120-I124 WeakPolarHBondContact O-CG1 3.35Å; T120-I124 PolarHBondContact O-N 2.95Å; T120-V172 HydrophobicContact CG2-CG1 3.93Å; T120-W176 PolarHBondContact OG1-NE1 3.3Å
121L96Very high92.9Very high30 Ų3028.1 Ų28.116%0.15714%0.141CC..Hα-helixtrans-63.6-44175.3-61178.4000112.1V84 V87 F117 N118 I119 I124 G125V84-L121 HydrophobicContact CG1-CB 4.15Å; V84-L121 HydrophobicContact CG1-CD2 4.05Å; V84-L121 WeakPolarHBondContact CG1-O 3.28Å; V87-L121 HydrophobicContact CB-CD1 4.07Å; V87-L121 HydrophobicContact CG1-CD1 3.65Å; F117-L121 HydrophobicContact CD2-CD1 3.93Å; F117-L121 HydrophobicContact CD2-CG 4.1Å; F117-L121 HydrophobicContact CE2-CD1 3.59Å; F117-L121 HydrophobicContact CE2-CG 4.21Å; F117-L121 PolarHBondContact O-N 3.26Å; N118-L121 WeakPolarHBondContact O-CB 3.27Å; N118-L121 PolarHBondContact O-N 3.41Å; I119-L121 VanDerWaalsContact C-N 3.27Å; I119-L121 PolarHBondContact O-N 3.46Å; L121-I124 PolarHBondContact O-N 3.24Å; L121-G125 PolarHBondContact O-N 3.4Å
122F94.4Very high93.2Very high24 Ų2423.1 Ų23.111%0.10512%0.119CC..Hα-helixtrans-59.2-50.7176.2-66.2-33.3000111.5L85 Y89 N92 N118 I119 I124 G125 D126L85-F122 HydrophobicContact CD2-CB 4.46Å; L85-F122 HydrophobicContact CD2-CD1 3.9Å; Y89-F122 AromaticContact CD1-CE1 3.9Å; Y89-F122 HydrophobicContact CD1-CE1 3.9Å; Y89-F122 AromaticContact CD1-CZ 3.95Å; Y89-F122 HydrophobicContact CD1-CZ 3.95Å; Y89-F122 HydrophobicContact CD2-CE1 4.47Å; Y89-F122 HydrophobicContact CE1-CE1 4.09Å; Y89-F122 HydrophobicContact CE1-CZ 4.25Å; Y89-F122 HydrophobicContact CG-CE1 4.09Å; Y89-F122 HydrophobicContact CG-CZ 4.48Å; N92-F122 HydrophobicContact CB-CE2 4.21Å; N92-F122 HydrophobicContact CB-CZ 4Å; N118-F122 HydrophobicContact CB-CE2 4.42Å; N118-F122 WeakPolarHBondContact ND2-CE2 3.23Å; N118-F122 WeakPolarHBondContact O-CD2 3.27Å; N118-F122 WeakPolarHBondContact O-CG 3.35Å; N118-F122 PolarHBondContact O-N 3.4Å; I119-F122 PolarHBondContact O-N 2.86Å; F122-I124 PolarHBondContact O-N 2.9Å; F122-G125 PolarHBondContact O-N 3.46Å; F122-D126 VanDerWaalsContact O-CB 3.29Å; F122-D126 WeakPolarHBondContact O-CB 3.31Å; F122-D126 VanDerWaalsContact O-CG 3.29Å; F122-D126 PolarHBondContact O-N 2.94Å
123K94.5Very high93.5Very high1 Ų123.2 Ų23.20%0.00412%0.119CC..Hα-helixtrans-57.8-45.2178.8-74.6-175.8156.3-74.20113.5I119 T120 L127 D171 V172 A175 H203I119-K123 HydrophobicContact CG2-CD 4.46Å; I119-K123 PolarHBondContact O-N 2.95Å; T120-K123 PolarHBondContact O-N 3.31Å; K123-L127 WeakPolarHBondContact O-CB 3.35Å; K123-L127 PolarHBondContact O-N 2.76Å; K123-D171 WeakPolarHBondContact CD-OD2 3.08Å; K123-D171 IonicContact NZ-OD1 3.27Å; K123-D171 PolarHBondContact NZ-OD1 3.43Å; K123-D171 IonicContact NZ-OD2 2.78Å; K123-D171 PolarHBondContact NZ-OD2 3.12Å; K123-V172 HydrophobicContact CB-CG2 4.13Å; K123-A175 HydrophobicContact CD-CB 3.69Å; K123-A175 VanDerWaalsContact CE-CB 3.45Å; K123-H203 VanDerWaalsContact NZ-CB 3.3Å; K123-H203 PolarHBondContact NZ-ND1 3.44Å
124I97.2Very high93.8Very high53 Ų5324.3 Ų24.327%0.27213%0.125SC..Hα-helixtrans-63.7-50.1177.3-67.9168.5000110.3V84 T120 L121 F122 L128 I168 V172V84-I124 HydrophobicContact CG1-CB 4.32Å; V84-I124 HydrophobicContact CG1-CG2 4.15Å; T120-I124 HydrophobicContact CG2-CD1 3.81Å; T120-I124 HydrophobicContact CG2-CG1 4.5Å; T120-I124 VanDerWaalsContact O-CG1 3.24Å; T120-I124 WeakPolarHBondContact O-CG1 3.35Å; T120-I124 PolarHBondContact O-N 2.95Å; L121-I124 PolarHBondContact O-N 3.24Å; F122-I124 PolarHBondContact O-N 2.9Å; I124-L128 WeakPolarHBondContact O-CB 3.25Å; I124-L128 PolarHBondContact O-N 3.26Å; I124-I168 HydrophobicContact CB-CG2 4.18Å; I124-I168 HydrophobicContact CG1-CG2 3.78Å; I124-I168 HydrophobicContact CG2-CG2 4.23Å; I124-V172 HydrophobicContact CD1-CG2 4.47Å; I124-V172 HydrophobicContact CG1-CG2 3.77Å
125G97.3Very high94.1Very high0 Ų020.5 Ų20.50%010%0.1CC..Hα-helixtrans-65.9-47.7-174.300000113L121 F122 L128 V129L121-G125 PolarHBondContact O-N 3.4Å; F122-G125 PolarHBondContact O-N 3.46Å; G125-L128 PolarHBondContact O-N 2.77Å; G125-V129 WeakPolarHBondContact O-CB 3.3Å; G125-V129 VanDerWaalsContact O-CG2 3.32Å; G125-V129 WeakPolarHBondContact O-CG2 3.35Å; G125-V129 PolarHBondContact O-N 3.47Å
126D95.9Very high94.4Very high3 Ų315.6 Ų15.62%0.0168%0.077CC..Hα-helixtrans-61.2-49.2-178.9-73.8-35000110.9L85 F122 L128 V129 V130 H203 L207 Q288L85-D126 WeakPolarHBondContact CD2-OD1 3.45Å; F122-D126 VanDerWaalsContact O-CB 3.29Å; F122-D126 WeakPolarHBondContact O-CB 3.31Å; F122-D126 VanDerWaalsContact O-CG 3.29Å; F122-D126 PolarHBondContact O-N 2.94Å; D126-L128 PolarHBondContact O-N 2.88Å; D126-V129 PolarHBondContact O-N 3.35Å; D126-V130 PolarHBondContact O-N 2.92Å; D126-H203 IonicContact OD2-NE2 3.85Å; D126-L207 HydrophobicContact CB-CD1 3.7Å; D126-L207 HydrophobicContact CB-CD2 3.9Å; D126-L207 HydrophobicContact CB-CG 4.45Å; D126-Q288 PolarHBondContact OD1-NE2 3.45Å
127L96.7Very high94.8Very high9 Ų915.6 Ų15.65%0.0478%0.077CC..Hα-helixtrans-64.3-42.3177.7-78.5174.7000111.8K123 V129 V130 I131 I168 D171 L207K123-L127 WeakPolarHBondContact O-CB 3.35Å; K123-L127 PolarHBondContact O-N 2.76Å; L127-V129 VanDerWaalsContact C-N 3.32Å; L127-V129 PolarHBondContact O-N 2.84Å; L127-V130 PolarHBondContact O-N 2.89Å; L127-I131 HydrophobicContact CB-CD1 4.32Å; L127-I131 HydrophobicContact CD2-CD1 4.39Å; L127-I131 WeakPolarHBondContact O-CB 3.21Å; L127-I131 WeakPolarHBondContact O-CD1 3.17Å; L127-I131 WeakPolarHBondContact O-CG1 3.22Å; L127-I131 PolarHBondContact O-N 3.23Å; L127-I168 HydrophobicContact CB-CD1 4.4Å; L127-I168 HydrophobicContact CB-CG1 3.73Å; L127-I168 HydrophobicContact CD1-CG1 4.21Å; L127-D171 HydrophobicContact CD1-CB 3.52Å; L127-L207 HydrophobicContact CD2-CD2 3.93Å; L127-L207 HydrophobicContact CG-CD2 4.32Å
128L96.8Very high94.9Very high23 Ų2313.8 Ų13.812%0.127%0.071CC..Hα-helixtrans-63.7-39.5179-175.457.4000111.5G77 L80 I124 G125 D126 S132 T164 I168G77-L128 WeakPolarHBondContact O-CG 3.49Å; L80-L128 HydrophobicContact CB-CD2 4.03Å; L80-L128 HydrophobicContact CD2-CD2 3.97Å; L80-L128 HydrophobicContact CG-CD2 3.83Å; I124-L128 WeakPolarHBondContact O-CB 3.25Å; I124-L128 PolarHBondContact O-N 3.26Å; G125-L128 PolarHBondContact O-N 2.77Å; D126-L128 PolarHBondContact O-N 2.88Å; L128-S132 WeakPolarHBondContact O-CB 3.23Å; L128-S132 PolarHBondContact O-N 3.49Å; L128-S132 PolarHBondContact O-OG 3.38Å; L128-T164 HydrophobicContact CD1-CG2 4.01Å; L128-I168 HydrophobicContact CB-CD1 3.91Å; L128-I168 HydrophobicContact CD1-CD1 4.26Å
129V96.2Very high94.8Very high1 Ų113.9 Ų13.91%0.0067%0.072CC..Hα-helixtrans-63.2-57.5174.4164.20000110.8Y78 L85 G125 D126 L127 I131 S132 I133Y78-V129 HydrophobicContact CD2-CB 4.41Å; Y78-V129 HydrophobicContact CD2-CG1 3.83Å; Y78-V129 HydrophobicContact CD2-CG2 4.29Å; Y78-V129 HydrophobicContact CE2-CG1 3.78Å; Y78-V129 HydrophobicContact CE2-CG2 4.49Å; L85-V129 HydrophobicContact CD1-CG2 4.15Å; G125-V129 WeakPolarHBondContact O-CB 3.3Å; G125-V129 VanDerWaalsContact O-CG2 3.32Å; G125-V129 WeakPolarHBondContact O-CG2 3.35Å; G125-V129 PolarHBondContact O-N 3.47Å; D126-V129 PolarHBondContact O-N 3.35Å; L127-V129 VanDerWaalsContact C-N 3.32Å; L127-V129 PolarHBondContact O-N 2.84Å; V129-I131 PolarHBondContact O-N 3.07Å; V129-S132 WeakPolarHBondContact O-CB 3.38Å; V129-S132 PolarHBondContact O-N 3.12Å; V129-I133 HydrophobicContact CG1-CD1 3.87Å; V129-I133 VanDerWaalsContact O-CG1 3.32Å; V129-I133 WeakPolarHBondContact O-CG1 3.4Å; V129-I133 PolarHBondContact O-N 3.44Å
130V95.9Very high94.7Very high3 Ų313.9 Ų13.92%0.0187%0.072CC..Hα-helixtrans-68-39.1-171.579.70000112.3D126 L127 S132 I133 L134 L207 M210D126-V130 PolarHBondContact O-N 2.92Å; L127-V130 PolarHBondContact O-N 2.89Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.26Å; V130-I133 PolarHBondContact O-N 2.81Å; V130-L134 PolarHBondContact O-N 3.28Å; V130-L207 HydrophobicContact CB-CD2 4.38Å; V130-L207 HydrophobicContact CG1-CD2 3.69Å; V130-M210 HydrophobicContact CB-CB 4.45Å; V130-M210 HydrophobicContact CG1-CB 4.02Å; V130-M210 HydrophobicContact CG1-SD 3.76Å; V130-M210 HydrophobicContact CG2-CB 3.58Å
131I96.4Very high94.4Very high5 Ų514.4 Ų14.43%0.0267%0.074CC..Hα-helixtrans-66.5-39.9177.2-66.9170000110.1L127 V129 I133 L134 Y135 T164 V167 M210L127-I131 HydrophobicContact CB-CD1 4.32Å; L127-I131 HydrophobicContact CD2-CD1 4.39Å; L127-I131 WeakPolarHBondContact O-CB 3.21Å; L127-I131 WeakPolarHBondContact O-CD1 3.17Å; L127-I131 WeakPolarHBondContact O-CG1 3.22Å; L127-I131 PolarHBondContact O-N 3.23Å; V129-I131 PolarHBondContact O-N 3.07Å; I131-I133 VanDerWaalsContact C-N 3.31Å; I131-I133 PolarHBondContact O-N 3.19Å; I131-L134 WeakPolarHBondContact O-CB 3.26Å; I131-L134 PolarHBondContact O-N 3.47Å; I131-Y135 HydrophobicContact CG2-CD1 4.45Å; I131-Y135 HydrophobicContact CG2-CD2 3.96Å; I131-Y135 HydrophobicContact CG2-CE1 3.99Å; I131-Y135 HydrophobicContact CG2-CE2 3.46Å; I131-Y135 VanDerWaalsContact CG2-CE2 3.46Å; I131-Y135 HydrophobicContact CG2-CG 4.44Å; I131-Y135 VanDerWaalsContact CG2-CZ 3.46Å; I131-Y135 PolarHBondContact O-N 3.16Å; I131-T164 HydrophobicContact CB-CG2 4.27Å; I131-T164 HydrophobicContact CD1-CG2 4.12Å; I131-T164 HydrophobicContact CG2-CG2 3.89Å; I131-T164 WeakPolarHBondContact CG2-OG1 3.3Å; I131-V167 HydrophobicContact CD1-CB 4.46Å; I131-V167 HydrophobicContact CD1-CG1 4.09Å; I131-M210 HydrophobicContact CD1-SD 4.44Å; I131-M210 HydrophobicContact CG1-CE 4.34Å; I131-M210 HydrophobicContact CG1-SD 3.65Å
132S95.8Very high94Very high5 Ų515.3 Ų15.34%0.0358%0.08CC..Hα-helixtrans-61.2-40.8175.6-66.60000111.9F74 G77 Y78 L128 V129 V130 Y135 M136F74-S132 WeakPolarHBondContact O-CB 3.47Å; G77-S132 WeakPolarHBondContact CA-OG 3.38Å; Y78-S132 PolarHBondContact N-OG 3.11Å; L128-S132 WeakPolarHBondContact O-CB 3.23Å; L128-S132 PolarHBondContact O-N 3.49Å; L128-S132 PolarHBondContact O-OG 3.38Å; V129-S132 WeakPolarHBondContact O-CB 3.38Å; V129-S132 PolarHBondContact O-N 3.12Å; V130-S132 VanDerWaalsContact C-N 3.34Å; V130-S132 PolarHBondContact O-N 3.26Å; S132-Y135 PolarHBondContact O-N 2.94Å; S132-M136 WeakPolarHBondContact O-CG 3.3Å; S132-M136 PolarHBondContact O-N 3.01Å
133I94.9Very high93.5Very high1 Ų115.8 Ų15.81%0.0059%0.089CC..Hα-helixtrans-66.6-40.7176.7-64.6169.6000111.3Y78 V129 V130 I131 Y135 M136 S137 I253 I254 S257Y78-I133 HydrophobicContact CD2-CD1 3.95Å; Y78-I133 HydrophobicContact CD2-CG1 3.92Å; Y78-I133 HydrophobicContact CE2-CD1 3.97Å; Y78-I133 HydrophobicContact CE2-CG1 4.4Å; V129-I133 HydrophobicContact CG1-CD1 3.87Å; V129-I133 VanDerWaalsContact O-CG1 3.32Å; V129-I133 WeakPolarHBondContact O-CG1 3.4Å; V129-I133 PolarHBondContact O-N 3.44Å; V130-I133 PolarHBondContact O-N 2.81Å; I131-I133 VanDerWaalsContact C-N 3.31Å; I131-I133 PolarHBondContact O-N 3.19Å; I133-Y135 VanDerWaalsContact C-N 3.33Å; I133-Y135 PolarHBondContact O-N 3.32Å; I133-M136 HydrophobicContact CB-CE 4.25Å; I133-M136 HydrophobicContact CG1-CE 3.78Å; I133-M136 PolarHBondContact O-N 2.98Å; I133-S137 PolarHBondContact O-N 3.48Å; I133-S137 PolarHBondContact O-OG 2.96Å; I133-I253 HydrophobicContact CG1-CD1 4.46Å; I133-I254 HydrophobicContact CG2-CG1 3.73Å; I133-S257 WeakPolarHBondContact CD1-OG 3.44Å
134L95.6Very high93Very high25 Ų2516.3 Ų16.313%0.1319%0.092CC..Hα-helixtrans-58.8-46.9173.9-178.461000110.9V130 I131 M136 S137 I138 L213 S214 F217V130-L134 PolarHBondContact O-N 3.28Å; I131-L134 WeakPolarHBondContact O-CB 3.26Å; I131-L134 PolarHBondContact O-N 3.47Å; L134-M136 PolarHBondContact O-N 2.94Å; L134-S137 WeakPolarHBondContact O-CB 3.41Å; L134-S137 PolarHBondContact O-N 2.99Å; L134-S137 VanDerWaalsContact O-N 3.11Å; L134-I138 HydrophobicContact CD1-CD1 4.31Å; L134-I138 HydrophobicContact CG-CD1 4.07Å; L134-I138 WeakPolarHBondContact O-CG1 3.49Å; L134-I138 PolarHBondContact O-N 3.29Å; L134-L213 HydrophobicContact CD1-CB 4.27Å; L134-S214 WeakPolarHBondContact CA-OG 3.35Å; L134-S214 WeakPolarHBondContact CB-OG 3.45Å; L134-S214 PolarHBondContact N-OG 3.39Å; L134-F217 HydrophobicContact CD1-CD2 3.77Å; L134-F217 HydrophobicContact CD1-CE2 4Å
135Y94.9Very high92.2Very high16 Ų1617.6 Ų17.66%0.06310%0.102CC..Hα-helixtrans-66.9-34.4178.1-66.5-14.1000113.5F74 I131 S132 I133 S137 I138 D139 L160 F163 T164F74-Y135 AromaticContact CD1-CD2 3.78Å; F74-Y135 HydrophobicContact CD1-CD2 3.78Å; F74-Y135 HydrophobicContact CD1-CG 4.17Å; F74-Y135 AromaticContact CE1-CD2 3.57Å; F74-Y135 HydrophobicContact CE1-CD2 3.57Å; F74-Y135 AromaticContact CE1-CG 3.95Å; F74-Y135 HydrophobicContact CE1-CG 3.95Å; F74-Y135 HydrophobicContact CZ-CD2 4.38Å; F74-Y135 HydrophobicContact CZ-CG 4.36Å; I131-Y135 HydrophobicContact CG2-CD1 4.45Å; I131-Y135 HydrophobicContact CG2-CD2 3.96Å; I131-Y135 HydrophobicContact CG2-CE1 3.99Å; I131-Y135 HydrophobicContact CG2-CE2 3.46Å; I131-Y135 VanDerWaalsContact CG2-CE2 3.46Å; I131-Y135 HydrophobicContact CG2-CG 4.44Å; I131-Y135 VanDerWaalsContact CG2-CZ 3.46Å; I131-Y135 PolarHBondContact O-N 3.16Å; S132-Y135 PolarHBondContact O-N 2.94Å; I133-Y135 VanDerWaalsContact C-N 3.33Å; I133-Y135 PolarHBondContact O-N 3.32Å; Y135-S137 VanDerWaalsContact C-N 3.27Å; Y135-S137 PolarHBondContact O-N 3.17Å; Y135-I138 HydrophobicContact CD1-CD1 4.38Å; Y135-I138 PolarHBondContact O-N 3.37Å; Y135-D139 WeakPolarHBondContact O-CB 3.43Å; Y135-D139 PolarHBondContact O-N 3.46Å; Y135-L160 HydrophobicContact CD1-CD1 4.22Å; Y135-L160 HydrophobicContact CD2-CB 4.23Å; Y135-L160 HydrophobicContact CE1-CB 4.42Å; Y135-L160 HydrophobicContact CE1-CD1 4.2Å; Y135-L160 HydrophobicContact CE1-CD2 3.82Å; Y135-L160 HydrophobicContact CE1-CG 4.37Å; Y135-L160 HydrophobicContact CE2-CB 3.61Å; Y135-L160 HydrophobicContact CE2-CD1 4.49Å; Y135-L160 HydrophobicContact CE2-CD2 4.48Å; Y135-L160 HydrophobicContact CE2-CG 4.4Å; Y135-L160 HydrophobicContact CG-CD1 4.41Å; Y135-L160 PolarHBondContact OH-O 3.39Å; Y135-F163 WeakPolarHBondContact OH-CD1 3.34Å; Y135-T164 WeakPolarHBondContact CE2-OG1 3.45Å; Y135-T164 PolarHBondContact OH-OG1 3.34Å
136M92.6Very high91.1Very high0 Ų022.4 Ų22.40%013%0.133CC..Hα-helixtrans-61.3-38.4170.3-75.8-173-79.200112F74 I75 S132 I133 L134 D139 G140 I250 I253F74-M136 HydrophobicContact CB-CG 3.61Å; F74-M136 HydrophobicContact CD2-CG 4.47Å; F74-M136 HydrophobicContact CG-CG 4.48Å; I75-M136 HydrophobicContact CG1-SD 3.53Å; I75-M136 VanDerWaalsContact CG1-SD 3.53Å; S132-M136 WeakPolarHBondContact O-CG 3.3Å; S132-M136 PolarHBondContact O-N 3.01Å; I133-M136 HydrophobicContact CB-CE 4.25Å; I133-M136 HydrophobicContact CG1-CE 3.78Å; I133-M136 PolarHBondContact O-N 2.98Å; L134-M136 PolarHBondContact O-N 2.94Å; M136-D139 PolarHBondContact O-N 2.92Å; M136-G140 PolarHBondContact O-N 3.48Å; M136-G140 VanDerWaalsContact O-N 3.09Å; M136-I250 HydrophobicContact CB-CG2 4.41Å; M136-I250 HydrophobicContact SD-CG2 4.46Å; M136-I253 HydrophobicContact CE-CD1 3.69Å; M136-I253 HydrophobicContact CE-CG2 4.04Å
137S93.2Very high90.1Very high0 Ų026.3 Ų26.30%017%0.174CC..Hα-helixtrans-68.6-42.2178.3-53.40000111.3I133 L134 Y135 G140 L141 S214 I254I133-S137 PolarHBondContact O-N 3.48Å; I133-S137 PolarHBondContact O-OG 2.96Å; L134-S137 WeakPolarHBondContact O-CB 3.41Å; L134-S137 PolarHBondContact O-N 2.99Å; L134-S137 VanDerWaalsContact O-N 3.11Å; Y135-S137 VanDerWaalsContact C-N 3.27Å; Y135-S137 PolarHBondContact O-N 3.17Å; S137-G140 PolarHBondContact O-N 3.12Å; S137-L141 PolarHBondContact O-N 2.86Å; S137-L141 VanDerWaalsContact O-N 3.16Å; S137-S214 WeakPolarHBondContact CB-O 3.34Å; S137-S214 PolarHBondContact OG-O 3.18Å; S137-S214 VanDerWaalsContact OG-O 3.12Å; S137-I254 WeakPolarHBondContact OG-CD1 3.26Å
138I92Very high89.1Confident59 Ų5929.1 Ų29.130%0.30319%0.191SC..Hα-helixtrans-66.8-40.9174.6-65.2169.6000111.3L134 Y135 G140 L141 T142 F217L134-I138 HydrophobicContact CD1-CD1 4.31Å; L134-I138 HydrophobicContact CG-CD1 4.07Å; L134-I138 WeakPolarHBondContact O-CG1 3.49Å; L134-I138 PolarHBondContact O-N 3.29Å; Y135-I138 HydrophobicContact CD1-CD1 4.38Å; Y135-I138 PolarHBondContact O-N 3.37Å; I138-G140 VanDerWaalsContact C-N 3.26Å; I138-G140 PolarHBondContact O-N 3.28Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 2.78Å; I138-L141 VanDerWaalsContact O-N 3.1Å; I138-T142 HydrophobicContact CG2-CG2 4.2Å; I138-T142 WeakPolarHBondContact O-CG2 3.4Å; I138-T142 PolarHBondContact O-N 2.93Å; I138-T142 PolarHBondContact O-OG1 3.36Å; I138-F217 HydrophobicContact CG1-CD2 4.04Å; I138-F217 HydrophobicContact CG1-CE2 4.39Å
139D90Very high88.4Confident7 Ų732 Ų324%0.03721%0.207CC..Hα-helixtrans-56.8-43173.6-178.162.1000110.8R71 F74 Y135 M136 L141 T142 A143 K153R71-D139 IonicContact CZ-OD2 2.77Å; R71-D139 IonicContact NE-OD2 3.37Å; R71-D139 PolarHBondContact NE-OD2 2.87Å; R71-D139 VanDerWaalsContact NE-OD2 3.08Å; R71-D139 IonicContact NH2-OD2 2.81Å; R71-D139 PolarHBondContact NH2-OD2 3.44Å; R71-D139 VanDerWaalsContact NH2-OD2 3.07Å; F74-D139 HydrophobicContact CD2-CB 4.37Å; F74-D139 HydrophobicContact CE2-CB 4.08Å; Y135-D139 WeakPolarHBondContact O-CB 3.43Å; Y135-D139 PolarHBondContact O-N 3.46Å; M136-D139 PolarHBondContact O-N 2.92Å; D139-L141 VanDerWaalsContact C-N 3.35Å; D139-L141 PolarHBondContact O-N 3.44Å; D139-T142 WeakPolarHBondContact CA-OG1 3.32Å; D139-T142 PolarHBondContact O-N 2.91Å; D139-T142 PolarHBondContact O-OG1 2.92Å; D139-A143 WeakPolarHBondContact O-CB 3.44Å; D139-A143 PolarHBondContact O-N 3.12Å; D139-K153 WeakPolarHBondContact OD1-CE 3.33Å; D139-K153 IonicContact OD1-NZ 3.2Å; D139-K153 PolarHBondContact OD1-NZ 3.49Å
140G88.4Confident87.6Confident1 Ų136.9 Ų36.91%0.0124%0.239CC..Hα-helixtrans-57.9-42.5174.300000113.4M136 S137 I138 I144M136-G140 PolarHBondContact O-N 3.48Å; M136-G140 VanDerWaalsContact O-N 3.09Å; S137-G140 PolarHBondContact O-N 3.12Å; I138-G140 VanDerWaalsContact C-N 3.26Å; I138-G140 PolarHBondContact O-N 3.28Å; G140-I144 WeakPolarHBondContact O-CD1 3.33Å; G140-I144 WeakPolarHBondContact O-CG1 3.29Å
141L88.6Confident87Confident36 Ų3644.6 Ų44.619%0.18827%0.268CS..Hα-helixtrans-65.9-47.6174.9-72170.9000111.9S137 I138 D139 A143 I144 F217 I220 A221 M224S137-L141 PolarHBondContact O-N 2.86Å; S137-L141 VanDerWaalsContact O-N 3.16Å; I138-L141 WeakPolarHBondContact O-CB 3.45Å; I138-L141 PolarHBondContact O-N 2.78Å; I138-L141 VanDerWaalsContact O-N 3.1Å; D139-L141 VanDerWaalsContact C-N 3.35Å; D139-L141 PolarHBondContact O-N 3.44Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.07Å; L141-I144 WeakPolarHBondContact O-CB 3.42Å; L141-I144 PolarHBondContact O-N 3.45Å; L141-I144 VanDerWaalsContact O-N 3.13Å; L141-F217 HydrophobicContact CD1-CB 3.82Å; L141-F217 HydrophobicContact CD1-CD1 4.24Å; L141-F217 HydrophobicContact CD1-CG 4.03Å; L141-I220 HydrophobicContact CD2-CB 4.36Å; L141-I220 HydrophobicContact CD2-CG2 3.88Å; L141-A221 HydrophobicContact CD2-CB 3.61Å; L141-A221 HydrophobicContact CG-CB 3.89Å; L141-M224 HydrophobicContact CD2-SD 4.12Å
142T86.7Confident86.5Confident49 Ų4947.8 Ų47.830%0.30129%0.289SS..Hα-helixtrans-66.4-29.2-177.362.50000112.8I138 D139 I144 V145I138-T142 HydrophobicContact CG2-CG2 4.2Å; I138-T142 WeakPolarHBondContact O-CG2 3.4Å; I138-T142 PolarHBondContact O-N 2.93Å; I138-T142 PolarHBondContact O-OG1 3.36Å; D139-T142 WeakPolarHBondContact CA-OG1 3.32Å; D139-T142 PolarHBondContact O-N 2.91Å; D139-T142 PolarHBondContact O-OG1 2.92Å; T142-I144 PolarHBondContact O-N 2.99Å; T142-V145 PolarHBondContact O-N 3.31Å
143A84.1Confident86.1Confident35 Ų3550.4 Ų50.429%0.28930%0.299SS..THydrogen-bonded Turntrans-63.3-20.8175.600000113.3D139 L141 E243D139-A143 WeakPolarHBondContact O-CB 3.44Å; D139-A143 PolarHBondContact O-N 3.12Å; L141-A143 VanDerWaalsContact C-N 3.28Å; L141-A143 PolarHBondContact O-N 3.07Å; A143-E243 HydrophobicContact CB-CG 4.45Å
144I83.4Confident85.6Confident12 Ų1255.1 Ų55.16%0.06232%0.321CS..THydrogen-bonded Turntrans-87.8-23.2-179.9-56.8163.9000111.2G140 L141 T142 P146 A221 M224 L225 R228 M240G140-I144 WeakPolarHBondContact O-CD1 3.33Å; G140-I144 WeakPolarHBondContact O-CG1 3.29Å; L141-I144 WeakPolarHBondContact O-CB 3.42Å; L141-I144 PolarHBondContact O-N 3.45Å; L141-I144 VanDerWaalsContact O-N 3.13Å; T142-I144 PolarHBondContact O-N 2.99Å; I144-P146 WeakPolarHBondContact O-CD 3.21Å; I144-A221 HydrophobicContact CD1-CB 4.3Å; I144-A221 WeakPolarHBondContact CD1-O 3.37Å; I144-M224 HydrophobicContact CD1-CB 3.85Å; I144-M224 HydrophobicContact CG2-CB 4.42Å; I144-M224 HydrophobicContact CG2-CE 4.35Å; I144-L225 HydrophobicContact CD1-CB 3.89Å; I144-L225 HydrophobicContact CD1-CD1 4.48Å; I144-L225 HydrophobicContact CG1-CB 4.31Å; I144-L225 HydrophobicContact CG1-CD1 3.97Å; I144-R228 HydrophobicContact CG2-CB 4.4Å; I144-R228 HydrophobicContact CG2-CG 3.88Å; I144-M240 HydrophobicContact CG2-CE 4.5Å
145V81.5Confident85.3Confident79 Ų7961 Ų6148%0.47935%0.346SS..SBendtrans-81.4115.3-178-178.20000109.2T142 V148T142-V145 PolarHBondContact O-N 3.31Å; V145-V148 HydrophobicContact CB-CG2 4.43Å; V145-V148 HydrophobicContact CG1-CG2 4.42Å
146P73.2Confident85.2Confident102 Ų10264.2 Ų64.266%0.66237%0.367SS*.THydrogen-bonded Turntrans-69.2149175.929.5-33.5000110.9I144I144-P146 WeakPolarHBondContact O-CD 3.21Å
147G75.5Confident85Confident84 Ų8464.9 Ų64.987%0.86637%0.37SS*.THydrogen-bonded Turntrans91.45.3170.300000116.2N149G147-N149 PolarHBondContact O-N 3.12Å
148V76Confident84.9Confident69 Ų6967.8 Ų67.842%0.41839%0.386SS..  trans-69.1115.8172.4-175.90000109.4V145 K153V145-V148 HydrophobicContact CB-CG2 4.43Å; V145-V148 HydrophobicContact CG1-CG2 4.42Å; V148-K153 HydrophobicContact CG1-CB 3.95Å
149N81.5Confident84.9Confident83 Ų8366.9 Ų66.944%0.44439%0.391SS..  trans-61.4126.8174.5178.6-12.6000109.9G147 Y151 T152 K153G147-N149 PolarHBondContact O-N 3.12Å; N149-Y151 VanDerWaalsContact C-N 3.26Å; N149-Y151 PolarHBondContact O-N 3.32Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.34Å; N149-Y151 PolarHBondContact OD1-N 2.87Å; N149-T152 PolarHBondContact O-N 3.44Å; N149-K153 PolarHBondContact O-N 2.87Å
150P80.3Confident85.1Confident104 Ų10468.8 Ų68.868%0.67540%0.401SS*.Hα-helixtrans-56.7-37.1178.322.6-34.4000113.4K153 E154P150-K153 PolarHBondContact O-N 3.33Å; P150-E154 PolarHBondContact O-N 3.28Å
151Y83.4Confident85.3Confident164 Ų16472.3 Ų72.364%0.64342%0.422SS*.Hα-helixtrans-65.4-46.4178178.9-98.6000111.8N149 K153 E154 K155N149-Y151 VanDerWaalsContact C-N 3.26Å; N149-Y151 PolarHBondContact O-N 3.32Å; N149-Y151 WeakPolarHBondContact OD1-CB 3.34Å; N149-Y151 PolarHBondContact OD1-N 2.87Å; Y151-K153 VanDerWaalsContact C-N 3.31Å; Y151-K153 PolarHBondContact O-N 3.47Å; Y151-E154 PolarHBondContact O-N 3.26Å; Y151-K155 PolarHBondContact O-N 2.93Å
152T85.7Confident85.5Confident73 Ų7380.5 Ų80.545%0.44845%0.451SS..Hα-helixtrans-62.7-41.6175.5-54.70000110.8N149 E154 K155 V156N149-T152 PolarHBondContact O-N 3.44Å; T152-E154 PolarHBondContact O-N 2.85Å; T152-K155 PolarHBondContact O-N 3.39Å; T152-V156 HydrophobicContact CG2-CG2 4.47Å; T152-V156 VanDerWaalsContact O-CG2 3.3Å; T152-V156 WeakPolarHBondContact O-CG2 3.47Å; T152-V156 PolarHBondContact O-N 3.42Å
153K85.8Confident85.9Confident59 Ų5983.6 Ų83.626%0.25746%0.46SS..Hα-helixtrans-57.9-47.7176.2-179.8168179.7167.10111.1D139 V148 N149 P150 Y151 V156 I157D139-K153 WeakPolarHBondContact OD1-CE 3.33Å; D139-K153 IonicContact OD1-NZ 3.2Å; D139-K153 PolarHBondContact OD1-NZ 3.49Å; V148-K153 HydrophobicContact CG1-CB 3.95Å; N149-K153 PolarHBondContact O-N 2.87Å; P150-K153 PolarHBondContact O-N 3.33Å; Y151-K153 VanDerWaalsContact C-N 3.31Å; Y151-K153 PolarHBondContact O-N 3.47Å; K153-V156 PolarHBondContact O-N 3.06Å; K153-I157 HydrophobicContact CD-CD1 4.5Å; K153-I157 HydrophobicContact CG-CD1 3.67Å; K153-I157 HydrophobicContact CG-CG1 4.47Å; K153-I157 VanDerWaalsContact O-CD1 3.24Å; K153-I157 WeakPolarHBondContact O-CD1 3.41Å; K153-I157 WeakPolarHBondContact O-CG1 3.44Å; K153-I157 PolarHBondContact O-N 2.99Å
154E86.4Confident86.5Confident100 Ų10082.4 Ų82.447%0.46745%0.449SS..Hα-helixtrans-61.3-45.2178.2-177.3170.2-168.900112.7P150 Y151 T152 V156 I157 N158P150-E154 PolarHBondContact O-N 3.28Å; Y151-E154 PolarHBondContact O-N 3.26Å; T152-E154 PolarHBondContact O-N 2.85Å; E154-V156 VanDerWaalsContact C-N 3.32Å; E154-V156 PolarHBondContact O-N 2.99Å; E154-I157 PolarHBondContact O-N 3.3Å; E154-N158 PolarHBondContact O-N 3.26Å
155K89.3Confident87.1Confident150 Ų15083.8 Ų83.865%0.65247%0.466SS*.Hα-helixtrans-59.2-43.4176.7-172.6176.5-179.3178.10111.8Y151 T152 N158 G159Y151-K155 PolarHBondContact O-N 2.93Å; T152-K155 PolarHBondContact O-N 3.39Å; K155-N158 PolarHBondContact O-N 2.99Å; K155-G159 PolarHBondContact O-N 3.13Å
156V90.9Very high87.8Confident83 Ų8385.7 Ų85.750%0.50347%0.468SS..Hα-helixtrans-62.1-46.5176.1171.10000110.6T152 K153 E154 N158 G159 L160T152-V156 HydrophobicContact CG2-CG2 4.47Å; T152-V156 VanDerWaalsContact O-CG2 3.3Å; T152-V156 WeakPolarHBondContact O-CG2 3.47Å; T152-V156 PolarHBondContact O-N 3.42Å; K153-V156 PolarHBondContact O-N 3.06Å; E154-V156 VanDerWaalsContact C-N 3.32Å; E154-V156 PolarHBondContact O-N 2.99Å; V156-N158 PolarHBondContact O-N 2.97Å; V156-G159 PolarHBondContact O-N 3.44Å; V156-L160 HydrophobicContact CG1-CD1 4.2Å; V156-L160 HydrophobicContact CG1-CG 4.34Å; V156-L160 WeakPolarHBondContact O-CG 3.42Å; V156-L160 PolarHBondContact O-N 3Å
157I89.6Confident88.9Confident13 Ų1382.3 Ų82.37%0.06745%0.445CS..Hα-helixtrans-60.6-46.1179-66.9153.9000111.4A70 K73 F74 K153 E154 G159 L160 V161A70-I157 HydrophobicContact CB-CD1 3.16Å; A70-I157 HydrophobicContact CB-CG1 3.97Å; K73-I157 HydrophobicContact CD-CG2 3.85Å; F74-I157 HydrophobicContact CE1-CG2 4.09Å; F74-I157 HydrophobicContact CZ-CB 4.5Å; F74-I157 HydrophobicContact CZ-CG1 4.09Å; F74-I157 HydrophobicContact CZ-CG2 3.94Å; K153-I157 HydrophobicContact CD-CD1 4.5Å; K153-I157 HydrophobicContact CG-CD1 3.67Å; K153-I157 HydrophobicContact CG-CG1 4.47Å; K153-I157 VanDerWaalsContact O-CD1 3.24Å; K153-I157 WeakPolarHBondContact O-CD1 3.41Å; K153-I157 WeakPolarHBondContact O-CG1 3.44Å; K153-I157 PolarHBondContact O-N 2.99Å; E154-I157 PolarHBondContact O-N 3.3Å; I157-G159 VanDerWaalsContact C-N 3.28Å; I157-G159 PolarHBondContact O-N 3.03Å; I157-L160 WeakPolarHBondContact O-CB 3.44Å; I157-L160 PolarHBondContact O-N 3.38Å; I157-V161 WeakPolarHBondContact O-CG2 3.3Å; I157-V161 PolarHBondContact O-N 3.21Å
158N90.2Very high90Very high62 Ų6279.2 Ų79.233%0.33241%0.409SS..Hα-helixtrans-64.1-37.3178.3-67.5-16.6000111K73 E154 K155 V156 V161 W162K73-N158 PolarHBondContact NZ-OD1 2.97Å; E154-N158 PolarHBondContact O-N 3.26Å; K155-N158 PolarHBondContact O-N 2.99Å; V156-N158 PolarHBondContact O-N 2.97Å; N158-V161 PolarHBondContact O-N 2.83Å; N158-W162 VanDerWaalsContact O-CD1 3.25Å; N158-W162 PolarHBondContact O-N 2.88Å
159G93.1Very high91Very high39 Ų3978.3 Ų78.340%0.40241%0.409SS..Hα-helixtrans-61.9-41.6171.800000113.2K155 V156 I157 V161 W162 F163K155-G159 PolarHBondContact O-N 3.13Å; V156-G159 PolarHBondContact O-N 3.44Å; I157-G159 VanDerWaalsContact C-N 3.28Å; I157-G159 PolarHBondContact O-N 3.03Å; G159-V161 VanDerWaalsContact C-N 3.33Å; G159-V161 PolarHBondContact O-N 3.47Å; G159-W162 PolarHBondContact O-N 2.88Å; G159-F163 WeakPolarHBondContact O-CB 3.23Å; G159-F163 PolarHBondContact O-N 3.19Å
160L93.8Very high91.7Very high47 Ų4778.8 Ų78.825%0.24641%0.411CS..Hα-helixtrans-63.9-36.5176.1-71.5177.9000112.4Y135 V156 I157 F163 T164Y135-L160 HydrophobicContact CD1-CD1 4.22Å; Y135-L160 HydrophobicContact CD2-CB 4.23Å; Y135-L160 HydrophobicContact CE1-CB 4.42Å; Y135-L160 HydrophobicContact CE1-CD1 4.2Å; Y135-L160 HydrophobicContact CE1-CD2 3.82Å; Y135-L160 HydrophobicContact CE1-CG 4.37Å; Y135-L160 HydrophobicContact CE2-CB 3.61Å; Y135-L160 HydrophobicContact CE2-CD1 4.49Å; Y135-L160 HydrophobicContact CE2-CD2 4.48Å; Y135-L160 HydrophobicContact CE2-CG 4.4Å; Y135-L160 HydrophobicContact CG-CD1 4.41Å; Y135-L160 PolarHBondContact OH-O 3.39Å; V156-L160 HydrophobicContact CG1-CD1 4.2Å; V156-L160 HydrophobicContact CG1-CG 4.34Å; V156-L160 WeakPolarHBondContact O-CG 3.42Å; V156-L160 PolarHBondContact O-N 3Å; I157-L160 WeakPolarHBondContact O-CB 3.44Å; I157-L160 PolarHBondContact O-N 3.38Å; L160-F163 PolarHBondContact O-N 3.04Å; L160-T164 WeakPolarHBondContact O-CB 3.46Å; L160-T164 PolarHBondContact O-N 2.85Å; L160-T164 PolarHBondContact O-OG1 3.48Å
161V91.6Very high92.4Very high76 Ų7674.7 Ų74.746%0.46138%0.383SS..Hα-helixtrans-62.5-48.1173.9172.10000110.8I157 N158 G159 F163 T164 G165I157-V161 WeakPolarHBondContact O-CG2 3.3Å; I157-V161 PolarHBondContact O-N 3.21Å; N158-V161 PolarHBondContact O-N 2.83Å; G159-V161 VanDerWaalsContact C-N 3.33Å; G159-V161 PolarHBondContact O-N 3.47Å; V161-F163 VanDerWaalsContact C-N 3.34Å; V161-F163 PolarHBondContact O-N 3.44Å; V161-T164 WeakPolarHBondContact O-CB 3.49Å; V161-T164 PolarHBondContact O-N 3.13Å; V161-G165 PolarHBondContact O-N 3.31Å; V161-G165 VanDerWaalsContact O-N 3.14Å
162W94.1Very high93Very high208 Ų20867.8 Ų67.879%0.78836%0.358SS*.Hα-helixtrans-61.6-42.7175.6-79.4112.1000112.3N158 G159 T164 G165 F166N158-W162 VanDerWaalsContact O-CD1 3.25Å; N158-W162 PolarHBondContact O-N 2.88Å; G159-W162 PolarHBondContact O-N 2.88Å; W162-T164 VanDerWaalsContact C-N 3.3Å; W162-T164 PolarHBondContact O-N 3.44Å; W162-G165 PolarHBondContact O-N 3.01Å; W162-F166 PolarHBondContact O-N 3.35Å
163F95.4Very high93.4Very high114 Ų11469.7 Ų69.750%0.536%0.363SS..Hα-helixtrans-61-38.9176.2-179.1-100.1000112.1Y135 G159 L160 V161 F166 V167Y135-F163 WeakPolarHBondContact OH-CD1 3.34Å; G159-F163 WeakPolarHBondContact O-CB 3.23Å; G159-F163 PolarHBondContact O-N 3.19Å; L160-F163 PolarHBondContact O-N 3.04Å; V161-F163 VanDerWaalsContact C-N 3.34Å; V161-F163 PolarHBondContact O-N 3.44Å; F163-F166 WeakPolarHBondContact O-CB 3.42Å; F163-F166 PolarHBondContact O-N 3.44Å; F163-V167 HydrophobicContact CD1-CG2 4.05Å; F163-V167 HydrophobicContact CE1-CG2 3.59Å; F163-V167 HydrophobicContact CE2-CG2 4.08Å; F163-V167 HydrophobicContact CG-CG2 4.5Å; F163-V167 HydrophobicContact CZ-CG2 3.61Å; F163-V167 WeakPolarHBondContact O-CG2 3.31Å; F163-V167 PolarHBondContact O-N 2.88Å
164T95.6Very high93.8Very high10 Ų1071 Ų716%0.06137%0.369CS..Hα-helixtrans-60.7-48.6174.9-57.50000111.2L128 I131 Y135 L160 V161 W162 F166 V167 I168L128-T164 HydrophobicContact CD1-CG2 4.01Å; I131-T164 HydrophobicContact CB-CG2 4.27Å; I131-T164 HydrophobicContact CD1-CG2 4.12Å; I131-T164 HydrophobicContact CG2-CG2 3.89Å; I131-T164 WeakPolarHBondContact CG2-OG1 3.3Å; Y135-T164 WeakPolarHBondContact CE2-OG1 3.45Å; Y135-T164 PolarHBondContact OH-OG1 3.34Å; L160-T164 WeakPolarHBondContact O-CB 3.46Å; L160-T164 PolarHBondContact O-N 2.85Å; L160-T164 PolarHBondContact O-OG1 3.48Å; V161-T164 WeakPolarHBondContact O-CB 3.49Å; V161-T164 PolarHBondContact O-N 3.13Å; W162-T164 VanDerWaalsContact C-N 3.3Å; W162-T164 PolarHBondContact O-N 3.44Å; T164-F166 VanDerWaalsContact C-N 3.27Å; T164-F166 PolarHBondContact O-N 2.91Å; T164-V167 PolarHBondContact O-N 2.93Å; T164-I168 HydrophobicContact CG2-CD1 3.8Å; T164-I168 HydrophobicContact CG2-CG1 4.5Å; T164-I168 VanDerWaalsContact O-CG1 3.31Å; T164-I168 WeakPolarHBondContact O-CG1 3.23Å; T164-I168 PolarHBondContact O-N 3.48Å
165G96Very high94.2Very high40 Ų4066.2 Ų66.241%0.41235%0.347SS..Hα-helixtrans-58.8-40.1176.600000112.3V161 W162 A169V161-G165 PolarHBondContact O-N 3.31Å; V161-G165 VanDerWaalsContact O-N 3.14Å; W162-G165 PolarHBondContact O-N 3.01Å; G165-A169 VanDerWaalsContact O-CB 3.31Å; G165-A169 WeakPolarHBondContact O-CB 3.19Å; G165-A169 PolarHBondContact O-N 2.96Å
166F97Very high94.4Very high119 Ų11962.6 Ų62.652%0.52233%0.329SS..Hα-helixtrans-64-48.5175.8177-104.6000112.9W162 F163 T164 I168 A169 L170W162-F166 PolarHBondContact O-N 3.35Å; F163-F166 WeakPolarHBondContact O-CB 3.42Å; F163-F166 PolarHBondContact O-N 3.44Å; T164-F166 VanDerWaalsContact C-N 3.27Å; T164-F166 PolarHBondContact O-N 2.91Å; F166-I168 VanDerWaalsContact C-N 3.34Å; F166-I168 PolarHBondContact O-N 3.05Å; F166-A169 PolarHBondContact O-N 3.27Å; F166-L170 HydrophobicContact CD1-CD1 4.03Å; F166-L170 HydrophobicContact CD1-CG 4.49Å; F166-L170 HydrophobicContact CE1-CD1 3.35Å; F166-L170 HydrophobicContact CE1-CG 4.11Å; F166-L170 HydrophobicContact CE2-CD1 4.16Å; F166-L170 HydrophobicContact CE2-CD2 4.29Å; F166-L170 HydrophobicContact CE2-CG 4.14Å; F166-L170 HydrophobicContact CZ-CD1 3.44Å; F166-L170 VanDerWaalsContact CZ-CD1 3.44Å; F166-L170 HydrophobicContact CZ-CD2 4.24Å; F166-L170 HydrophobicContact CZ-CG 3.93Å; F166-L170 WeakPolarHBondContact O-CG 3.35Å; F166-L170 PolarHBondContact O-N 2.93Å
167V96.5Very high94.6Very high31 Ų3163 Ų6319%0.18833%0.327CS..Hα-helixtrans-60.7-43.9178.6170.70000111.3I131 F163 T164 L170 D171I131-V167 HydrophobicContact CD1-CB 4.46Å; I131-V167 HydrophobicContact CD1-CG1 4.09Å; F163-V167 HydrophobicContact CD1-CG2 4.05Å; F163-V167 HydrophobicContact CE1-CG2 3.59Å; F163-V167 HydrophobicContact CE2-CG2 4.08Å; F163-V167 HydrophobicContact CG-CG2 4.5Å; F163-V167 HydrophobicContact CZ-CG2 3.61Å; F163-V167 WeakPolarHBondContact O-CG2 3.31Å; F163-V167 PolarHBondContact O-N 2.88Å; T164-V167 PolarHBondContact O-N 2.93Å; V167-L170 PolarHBondContact O-N 3.45Å; V167-D171 PolarHBondContact O-N 3.33Å
168I97.2Very high94.7Very high19 Ų1963.6 Ų63.610%0.09733%0.333CS..Hα-helixtrans-61.6-47.3176.4-68.8169.3000110.6I124 L127 L128 T164 F166 L170 D171 V172I124-I168 HydrophobicContact CB-CG2 4.18Å; I124-I168 HydrophobicContact CG1-CG2 3.78Å; I124-I168 HydrophobicContact CG2-CG2 4.23Å; L127-I168 HydrophobicContact CB-CD1 4.4Å; L127-I168 HydrophobicContact CB-CG1 3.73Å; L127-I168 HydrophobicContact CD1-CG1 4.21Å; L128-I168 HydrophobicContact CB-CD1 3.91Å; L128-I168 HydrophobicContact CD1-CD1 4.26Å; T164-I168 HydrophobicContact CG2-CD1 3.8Å; T164-I168 HydrophobicContact CG2-CG1 4.5Å; T164-I168 VanDerWaalsContact O-CG1 3.31Å; T164-I168 WeakPolarHBondContact O-CG1 3.23Å; T164-I168 PolarHBondContact O-N 3.48Å; F166-I168 VanDerWaalsContact C-N 3.34Å; F166-I168 PolarHBondContact O-N 3.05Å; I168-L170 VanDerWaalsContact C-N 3.3Å; I168-L170 PolarHBondContact O-N 3.47Å; I168-D171 PolarHBondContact O-N 3.48Å; I168-V172 HydrophobicContact CG2-CG2 4.33Å; I168-V172 WeakPolarHBondContact O-CB 3.35Å; I168-V172 WeakPolarHBondContact O-CG2 3.47Å; I168-V172 PolarHBondContact O-N 2.95Å
169A97.2Very high94.7Very high51 Ų5160.6 Ų60.642%0.42132%0.317SS..Hα-helixtrans-59.6-42.1178.900000111.5G165 F166 M173G165-A169 VanDerWaalsContact O-CB 3.31Å; G165-A169 WeakPolarHBondContact O-CB 3.19Å; G165-A169 PolarHBondContact O-N 2.96Å; F166-A169 PolarHBondContact O-N 3.27Å; A169-M173 WeakPolarHBondContact O-CB 3.28Å; A169-M173 WeakPolarHBondContact O-CG 3.28Å; A169-M173 PolarHBondContact O-N 3.24Å
170L96.4Very high94.6Very high92 Ų9260.3 Ų60.348%0.48231%0.311SS..Hα-helixtrans-63.1-45.9176-73.6-175000112.8F166 V167 I168 M173 F174F166-L170 HydrophobicContact CD1-CD1 4.03Å; F166-L170 HydrophobicContact CD1-CG 4.49Å; F166-L170 HydrophobicContact CE1-CD1 3.35Å; F166-L170 HydrophobicContact CE1-CG 4.11Å; F166-L170 HydrophobicContact CE2-CD1 4.16Å; F166-L170 HydrophobicContact CE2-CD2 4.29Å; F166-L170 HydrophobicContact CE2-CG 4.14Å; F166-L170 HydrophobicContact CZ-CD1 3.44Å; F166-L170 VanDerWaalsContact CZ-CD1 3.44Å; F166-L170 HydrophobicContact CZ-CD2 4.24Å; F166-L170 HydrophobicContact CZ-CG 3.93Å; F166-L170 WeakPolarHBondContact O-CG 3.35Å; F166-L170 PolarHBondContact O-N 2.93Å; V167-L170 PolarHBondContact O-N 3.45Å; I168-L170 VanDerWaalsContact C-N 3.3Å; I168-L170 PolarHBondContact O-N 3.47Å; L170-M173 PolarHBondContact O-N 2.91Å; L170-F174 VanDerWaalsContact O-CB 3.3Å; L170-F174 WeakPolarHBondContact O-CB 3.32Å; L170-F174 PolarHBondContact O-N 2.95Å
171D95.5Very high94.5Very high18 Ų1863.4 Ų63.410%0.09633%0.331CS..Hα-helixtrans-63.8-42.8180-176.377000112K123 L127 V167 I168 F174 A175 H203K123-D171 WeakPolarHBondContact CD-OD2 3.08Å; K123-D171 IonicContact NZ-OD1 3.27Å; K123-D171 PolarHBondContact NZ-OD1 3.43Å; K123-D171 IonicContact NZ-OD2 2.78Å; K123-D171 PolarHBondContact NZ-OD2 3.12Å; L127-D171 HydrophobicContact CD1-CB 3.52Å; V167-D171 PolarHBondContact O-N 3.33Å; I168-D171 PolarHBondContact O-N 3.48Å; D171-F174 PolarHBondContact O-N 3.35Å; D171-A175 PolarHBondContact O-N 3.31Å; D171-H203 IonicContact OD1-CG 3.98Å; D171-H203 IonicContact OD1-ND1 3.44Å; D171-H203 PolarHBondContact OD1-ND1 2.88Å; D171-H203 IonicContact OD2-CE1 3.61Å; D171-H203 IonicContact OD2-CG 3.84Å; D171-H203 IonicContact OD2-ND1 2.87Å; D171-H203 PolarHBondContact OD2-ND1 2.95Å
172V95.7Very high94.2Very high20 Ų2062.1 Ų62.112%0.12132%0.322CS..Hα-helixtrans-63.8-50.5175.5172.20000110.2T120 K123 I124 I168 F174 A175 W176T120-V172 HydrophobicContact CG2-CG1 3.93Å; K123-V172 HydrophobicContact CB-CG2 4.13Å; I124-V172 HydrophobicContact CD1-CG2 4.47Å; I124-V172 HydrophobicContact CG1-CG2 3.77Å; I168-V172 HydrophobicContact CG2-CG2 4.33Å; I168-V172 WeakPolarHBondContact O-CB 3.35Å; I168-V172 WeakPolarHBondContact O-CG2 3.47Å; I168-V172 PolarHBondContact O-N 2.95Å; V172-F174 VanDerWaalsContact C-N 3.28Å; V172-F174 PolarHBondContact O-N 2.91Å; V172-A175 WeakPolarHBondContact O-CB 3.41Å; V172-A175 PolarHBondContact O-N 2.68Å; V172-A175 VanDerWaalsContact O-N 3.12Å; V172-W176 VanDerWaalsContact O-CD1 3.24Å; V172-W176 PolarHBondContact O-N 3.01Å
173M95.2Very high93.6Very high113 Ų11359.2 Ų59.256%0.55732%0.315SS*.Hα-helixtrans-56.7-43.2177.9-77.1-69-6400111.7A169 L170 A175 W176 I177A169-M173 WeakPolarHBondContact O-CB 3.28Å; A169-M173 WeakPolarHBondContact O-CG 3.28Å; A169-M173 PolarHBondContact O-N 3.24Å; L170-M173 PolarHBondContact O-N 2.91Å; M173-A175 VanDerWaalsContact C-N 3.32Å; M173-A175 PolarHBondContact O-N 2.99Å; M173-W176 PolarHBondContact O-N 3.41Å; M173-I177 HydrophobicContact CE-CD1 4.36Å; M173-I177 WeakPolarHBondContact O-CB 3.44Å; M173-I177 VanDerWaalsContact O-CG1 3.23Å; M173-I177 WeakPolarHBondContact O-CG1 3.29Å; M173-I177 PolarHBondContact O-N 2.95Å
174F94.2Very high93Very high86 Ų8657.8 Ų57.838%0.37732%0.316SS..Hα-helixtrans-62.8-39.8178.3-174.2-124.7000112.1L170 D171 V172 S178 S199 I202L170-F174 VanDerWaalsContact O-CB 3.3Å; L170-F174 WeakPolarHBondContact O-CB 3.32Å; L170-F174 PolarHBondContact O-N 2.95Å; D171-F174 PolarHBondContact O-N 3.35Å; V172-F174 VanDerWaalsContact C-N 3.28Å; V172-F174 PolarHBondContact O-N 2.91Å; F174-S178 VanDerWaalsContact O-CB 3.25Å; F174-S178 WeakPolarHBondContact O-CB 3.48Å; F174-S178 PolarHBondContact O-N 3.35Å; F174-S199 VanDerWaalsContact CE1-CA 3.48Å; F174-I202 HydrophobicContact CE1-CD1 3.95Å; F174-I202 HydrophobicContact CZ-CD1 4.5Å
175A92.8Very high92.3Very high0 Ų061.7 Ų61.70%034%0.339CS..Hα-helixtrans-63.9-45.5175.300000112.4M113 K123 D171 V172 M173 S178 A179 V195 S199M113-A175 HydrophobicContact CE-CB 4.49Å; K123-A175 HydrophobicContact CD-CB 3.69Å; K123-A175 VanDerWaalsContact CE-CB 3.45Å; D171-A175 PolarHBondContact O-N 3.31Å; V172-A175 WeakPolarHBondContact O-CB 3.41Å; V172-A175 PolarHBondContact O-N 2.68Å; V172-A175 VanDerWaalsContact O-N 3.12Å; M173-A175 VanDerWaalsContact C-N 3.32Å; M173-A175 PolarHBondContact O-N 2.99Å; A175-S178 PolarHBondContact O-N 3.28Å; A175-A179 PolarHBondContact O-N 3.39Å; A175-V195 HydrophobicContact CB-CG1 4.21Å; A175-S199 WeakPolarHBondContact CA-OG 3.49Å
176W94.7Very high91.4Very high73 Ų7360 Ų6028%0.27732%0.321SS..Hα-helixtrans-65.6-42.8178-82.393.2000112.5L110 M113 V114 T120 V172 M173 S178 A179 A180L110-W176 HydrophobicContact CD1-CE3 3.81Å; L110-W176 HydrophobicContact CD1-CZ3 3.87Å; M113-W176 HydrophobicContact CB-CE3 4.38Å; M113-W176 HydrophobicContact CB-CH2 4.11Å; M113-W176 HydrophobicContact CB-CZ3 4Å; M113-W176 HydrophobicContact CE-CD2 3.95Å; M113-W176 HydrophobicContact CE-CG 4.1Å; M113-W176 HydrophobicContact CE-CZ2 4.35Å; V114-W176 HydrophobicContact CG2-CH2 3.98Å; V114-W176 HydrophobicContact CG2-CZ3 3.84Å; T120-W176 PolarHBondContact OG1-NE1 3.3Å; V172-W176 VanDerWaalsContact O-CD1 3.24Å; V172-W176 PolarHBondContact O-N 3.01Å; M173-W176 PolarHBondContact O-N 3.41Å; W176-S178 VanDerWaalsContact C-N 3.34Å; W176-A179 PolarHBondContact O-N 2.93Å; W176-A180 WeakPolarHBondContact O-CB 3.38Å; W176-A180 PolarHBondContact O-N 2.98Å
177I93.8Very high90Very high91 Ų9158.9 Ų58.947%0.46733%0.325SS..Hα-helixtrans-62.1-45174.7-68.8165.6000110M173 A179 A180 V181M173-I177 HydrophobicContact CE-CD1 4.36Å; M173-I177 WeakPolarHBondContact O-CB 3.44Å; M173-I177 VanDerWaalsContact O-CG1 3.23Å; M173-I177 WeakPolarHBondContact O-CG1 3.29Å; M173-I177 PolarHBondContact O-N 2.95Å; I177-A179 VanDerWaalsContact C-N 3.3Å; I177-A179 PolarHBondContact O-N 2.87Å; I177-A180 PolarHBondContact O-N 3.45Å; I177-A180 VanDerWaalsContact O-N 3.16Å; I177-V181 HydrophobicContact CG2-CG2 4.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.33Å; I177-V181 PolarHBondContact O-N 3.36Å
178S91.8Very high89Confident26 Ų2660.2 Ų60.218%0.18233%0.33CS..Hα-helixtrans-59.5-41.3177.9-176.80000112.3F174 A175 W176 N182 G196F174-S178 VanDerWaalsContact O-CB 3.25Å; F174-S178 WeakPolarHBondContact O-CB 3.48Å; F174-S178 PolarHBondContact O-N 3.35Å; A175-S178 PolarHBondContact O-N 3.28Å; W176-S178 VanDerWaalsContact C-N 3.34Å; S178-N182 WeakPolarHBondContact O-CB 3.4Å; S178-N182 PolarHBondContact O-N 2.96Å; S178-G196 WeakPolarHBondContact OG-CA 3.21Å; S178-G196 PolarHBondContact OG-N 3.18Å
179A91Very high88Confident0 Ų059.3 Ų59.30%033%0.326CS..Hα-helixtrans-70.3-34.9176.300000112.5P109 M113 A175 W176 I177P109-A179 HydrophobicContact CB-CB 4.22Å; M113-A179 HydrophobicContact CG-CB 3.67Å; A175-A179 PolarHBondContact O-N 3.39Å; W176-A179 PolarHBondContact O-N 2.93Å; I177-A179 VanDerWaalsContact C-N 3.3Å; I177-A179 PolarHBondContact O-N 2.87Å
180A91.4Very high87Confident33 Ų3362.8 Ų62.827%0.27333%0.329SS..Hα-helixtrans-70.4-36.8178.900000113L110 W176 I177 K183L110-A180 HydrophobicContact CD1-CB 4.29Å; L110-A180 HydrophobicContact CD2-CB 4.32Å; W176-A180 WeakPolarHBondContact O-CB 3.38Å; W176-A180 PolarHBondContact O-N 2.98Å; I177-A180 PolarHBondContact O-N 3.45Å; I177-A180 VanDerWaalsContact O-N 3.16Å; A180-K183 WeakPolarHBondContact O-CE 3.44Å; A180-K183 PolarHBondContact O-NZ 3.25Å
181V90.9Very high85.9Confident111 Ų11160 Ų6067%0.67331%0.314SS*.Hα-helixtrans-76-36.1179.4173.20000111.4I177 K183I177-V181 HydrophobicContact CG2-CG2 4.27Å; I177-V181 WeakPolarHBondContact O-CG2 3.33Å; I177-V181 PolarHBondContact O-N 3.36Å; V181-K183 PolarHBondContact O-N 3.49Å
182N85.7Confident84.9Confident49 Ų4965.5 Ų65.526%0.26233%0.333SS..  trans-72.8123.7176.9-172.15.3000110.7P109 S178 T184P109-N182 VanDerWaalsContact CD-O 3.28Å; P109-N182 WeakPolarHBondContact CD-O 3.14Å; P109-N182 HydrophobicContact CG-CB 3.91Å; P109-N182 VanDerWaalsContact CG-O 3.3Å; P109-N182 WeakPolarHBondContact CG-O 3.43Å; S178-N182 WeakPolarHBondContact O-CB 3.4Å; S178-N182 PolarHBondContact O-N 2.96Å; N182-T184 PolarHBondContact ND2-OG1 3.03Å; N182-T184 VanDerWaalsContact ND2-OG1 3.15Å; N182-T184 WeakPolarHBondContact OD1-CG2 3.3Å; N182-T184 PolarHBondContact OD1-N 3.37Å; N182-T184 PolarHBondContact OD1-OG1 2.85Å
183K81.6Confident83.7Confident148 Ų14866.6 Ų66.664%0.64334%0.344SS*.  trans-110.34.8179.5-58.8-54.2-171.7-165.90113.4A180 V181 V185A180-K183 WeakPolarHBondContact O-CE 3.44Å; A180-K183 PolarHBondContact O-NZ 3.25Å; V181-K183 PolarHBondContact O-N 3.49Å; K183-V185 PolarHBondContact O-N 3.41Å
184T83.1Confident82.8Confident84 Ų8461.3 Ų61.352%0.51532%0.318SS..PPolyproline II helixtrans-62.2128.7175.957.70000109.3P109 N182 L186P109-T184 WeakPolarHBondContact CD-O 3.24Å; N182-T184 PolarHBondContact ND2-OG1 3.03Å; N182-T184 VanDerWaalsContact ND2-OG1 3.15Å; N182-T184 WeakPolarHBondContact OD1-CG2 3.3Å; N182-T184 PolarHBondContact OD1-N 3.37Å; N182-T184 PolarHBondContact OD1-OG1 2.85Å; T184-L186 VanDerWaalsContact O-CD1 3.3Å; T184-L186 WeakPolarHBondContact O-CD1 3.3Å; T184-L186 PolarHBondContact O-N 2.68Å
185V80Confident82.2Confident91 Ų9157.3 Ų57.355%0.55230%0.301SS*.PPolyproline II helixtrans-69.9127.1174.71760000109N106 K183N106-V185 VanDerWaalsContact C-CG1 3.48Å; N106-V185 HydrophobicContact CB-CG1 3.89Å; K183-V185 PolarHBondContact O-N 3.41Å
186L76.8Confident81.7Confident6 Ų658.1 Ų58.13%0.03131%0.309CS..BIsolated β-bridgetrans-91.1137.1177.1-80.477000110.1N106 M107 P109 T184 I188 A193 M194N106-L186 WeakPolarHBondContact CA-O 3.45Å; N106-L186 PolarHBondContact N-O 2.98Å; N106-L186 VanDerWaalsContact N-O 3.13Å; M107-L186 PolarHBondContact N-O 2.88Å; M107-L186 PolarHBondContact O-N 3.05Å; P109-L186 HydrophobicContact CB-CD1 3.96Å; P109-L186 HydrophobicContact CG-CD1 3.5Å; T184-L186 VanDerWaalsContact O-CD1 3.3Å; T184-L186 WeakPolarHBondContact O-CD1 3.3Å; T184-L186 PolarHBondContact O-N 2.68Å; L186-I188 VanDerWaalsContact C-N 3.3Å; L186-I188 WeakPolarHBondContact CD2-O 3.41Å; L186-A193 VanDerWaalsContact CD2-C 3.48Å; L186-A193 HydrophobicContact CD2-CB 3.37Å; L186-A193 HydrophobicContact CG-CB 4.13Å; L186-M194 HydrophobicContact CD2-CG 4.15Å
187P68.9Low81.3Confident94 Ų9461.1 Ų61.161%0.6133%0.326SS*.SBendtrans-70.4-31.3169.529-33.5000111.5
188I74.1Confident81Confident59 Ų5965.4 Ų65.430%0.30334%0.338SS..SBendtrans-145.3137-176.1-60.5173.2000109.5W103 L186 Y190W103-I188 HydrophobicContact CB-CB 4.48Å; W103-I188 HydrophobicContact CB-CG1 4.44Å; W103-I188 HydrophobicContact CB-CG2 3.81Å; W103-I188 HydrophobicContact CD2-CG2 3.66Å; W103-I188 HydrophobicContact CE3-CG2 4.14Å; W103-I188 HydrophobicContact CG-CG2 3.5Å; W103-I188 VanDerWaalsContact CG-CG2 3.5Å; L186-I188 VanDerWaalsContact C-N 3.3Å; L186-I188 WeakPolarHBondContact CD2-O 3.41Å; I188-Y190 VanDerWaalsContact C-N 3.34Å; I188-Y190 HydrophobicContact CB-CD2 4.06Å; I188-Y190 HydrophobicContact CB-CE2 4.21Å; I188-Y190 HydrophobicContact CD1-CE2 4.19Å; I188-Y190 HydrophobicContact CG2-CD2 3.5Å; I188-Y190 VanDerWaalsContact CG2-CD2 3.5Å; I188-Y190 HydrophobicContact CG2-CE2 3.5Å; I188-Y190 VanDerWaalsContact CG2-CE2 3.5Å; I188-Y190 HydrophobicContact CG2-CG 4.18Å; I188-Y190 PolarHBondContact O-N 3.49Å
189C78.2Confident80.9Confident1 Ų164.2 Ų64.21%0.00733%0.329CS..  trans-74.977.1173.7-58.70000112.2W103 C112 M194W103-C189 HydrophobicContact CE3-CB 4Å; W103-C189 HydrophobicContact CZ3-CB 4.16Å; W103-C189 WeakPolarHBondContact CZ3-O 3.32Å; C112-C189 HydrophobicContact CB-CB 3.7Å; C112-C189 WeakPolarHBondContact CB-SG 3.35Å; C112-C189 VanDerWaalsContact SG-CA 3.59Å; C112-C189 WeakPolarHBondContact SG-CB 3.33Å; C112-C189 CovalentContact SG-SG 2.05Å; C112-C189 PolarHBondContact SG-SG 3.29Å; C189-M194 HydrophobicContact CB-CE 3.56Å; C189-M194 HydrophobicContact CB-SD 4.42Å; C189-M194 WeakPolarHBondContact O-CE 3.41Å
190Y74.3Confident80.8Confident124 Ų12464.8 Ų64.849%0.48633%0.332SS..  trans-97.9149.8166.7-80.8-60.3000113.4W103 I188 R192 A193 M194W103-Y190 HydrophobicContact CZ2-CE1 4.1Å; I188-Y190 VanDerWaalsContact C-N 3.34Å; I188-Y190 HydrophobicContact CB-CD2 4.06Å; I188-Y190 HydrophobicContact CB-CE2 4.21Å; I188-Y190 HydrophobicContact CD1-CE2 4.19Å; I188-Y190 HydrophobicContact CG2-CD2 3.5Å; I188-Y190 VanDerWaalsContact CG2-CD2 3.5Å; I188-Y190 HydrophobicContact CG2-CE2 3.5Å; I188-Y190 VanDerWaalsContact CG2-CE2 3.5Å; I188-Y190 HydrophobicContact CG2-CG 4.18Å; I188-Y190 PolarHBondContact O-N 3.49Å; Y190-R192 PolarHBondContact O-N 2.96Å; Y190-A193 PolarHBondContact O-N 3.39Å; Y190-M194 WeakPolarHBondContact O-CG 3.19Å; Y190-M194 PolarHBondContact O-N 3.13Å
191H74.4Confident80.8Confident34 Ų3464.9 Ų64.916%0.15733%0.328CS..Hα-helixtrans-51.1-50.9-178.5179.8-92.3000113.3I119 A193 M194 V195 F200 Y204I119-H191 HydrophobicContact CD1-CB 4.17Å; I119-H191 VanDerWaalsContact CG2-CD2 3.47Å; I119-H191 WeakPolarHBondContact CG2-CD2 3.33Å; H191-A193 PolarHBondContact O-N 2.83Å; H191-M194 PolarHBondContact O-N 2.97Å; H191-V195 PolarHBondContact O-N 3.22Å; H191-F200 AromaticContact CE1-CD2 3.64Å; H191-F200 AromaticContact ND1-CD2 3.41Å; H191-F200 WeakPolarHBondContact ND1-CD2 3.26Å; H191-F200 AromaticContact ND1-CE2 3.53Å; H191-Y204 AromaticContact CE1-CE2 3.55Å; H191-Y204 AromaticContact CE1-CZ 3.94Å; H191-Y204 PolarHBondContact CE1-OH 2.89Å; H191-Y204 AromaticContact ND1-CE2 3.93Å
192R75Confident80.9Confident132 Ų13264.5 Ų64.550%0.49832%0.321SS..Hα-helixtrans-64.5-25.5179.2-177.6176.7-114.91705113.4Y190 F200 S272Y190-R192 PolarHBondContact O-N 2.96Å; R192-F200 HydrophobicContact CB-CD2 4.19Å; R192-F200 HydrophobicContact CB-CE2 4.05Å; R192-F200 HydrophobicContact CG-CD2 4.4Å; R192-F200 HydrophobicContact CG-CE2 4.4Å; R192-S272 PolarHBondContact NH1-OG 2.86Å; R192-S272 VanDerWaalsContact NH2-CB 3.3Å; R192-S272 PolarHBondContact NH2-OG 3.47Å; R192-S272 VanDerWaalsContact NH2-OG 3.07Å
193A70.2Confident81.3Confident44 Ų4462.4 Ų62.436%0.36431%0.309SS..Hα-helixtrans-86.8-35.4-179.600000111.6L186 Y190 H191L186-A193 VanDerWaalsContact CD2-C 3.48Å; L186-A193 HydrophobicContact CD2-CB 3.37Å; L186-A193 HydrophobicContact CG-CB 4.13Å; Y190-A193 PolarHBondContact O-N 3.39Å; H191-A193 PolarHBondContact O-N 2.83Å
194M75.3Confident81.8Confident2 Ų255.9 Ų55.91%0.0128%0.281CS..Hα-helixtrans-72.5-42.7-179-70.9-175.8-125.600112.9P109 C112 M113 C116 I119 L186 C189 Y190 H191P109-M194 WeakPolarHBondContact CB-O 3.12Å; C112-M194 VanDerWaalsContact C-SD 3.59Å; C112-M194 HydrophobicContact CB-CE 4.36Å; C112-M194 HydrophobicContact CB-CG 3.56Å; C112-M194 HydrophobicContact CB-SD 3.57Å; C112-M194 VanDerWaalsContact CB-SD 3.57Å; M113-M194 HydrophobicContact CG-CB 4.17Å; M113-M194 HydrophobicContact CG-SD 4.27Å; M113-M194 HydrophobicContact SD-CB 4.29Å; M113-M194 HydrophobicContact SD-SD 4.32Å; C116-M194 HydrophobicContact CB-CE 3.76Å; C116-M194 HydrophobicContact CB-SD 4.03Å; I119-M194 HydrophobicContact CD1-CB 4.17Å; I119-M194 HydrophobicContact CD1-CE 3.59Å; I119-M194 HydrophobicContact CD1-CG 4.34Å; I119-M194 HydrophobicContact CD1-SD 3.33Å; I119-M194 WeakPolarHBondContact CD1-SD 3.49Å; L186-M194 HydrophobicContact CD2-CG 4.15Å; C189-M194 HydrophobicContact CB-CE 3.56Å; C189-M194 HydrophobicContact CB-SD 4.42Å; C189-M194 WeakPolarHBondContact O-CE 3.41Å; Y190-M194 WeakPolarHBondContact O-CG 3.19Å; Y190-M194 PolarHBondContact O-N 3.13Å; H191-M194 PolarHBondContact O-N 2.97Å
195V83.2Confident82.4Confident1 Ų156.9 Ų56.91%0.00628%0.275CS..SBendtrans-94.1132.8-177.3-177.20000107.7M113 I119 A175 H191 S199M113-V195 HydrophobicContact SD-CG2 4.08Å; I119-V195 HydrophobicContact CG2-CG2 4.08Å; A175-V195 HydrophobicContact CB-CG1 4.21Å; H191-V195 PolarHBondContact O-N 3.22Å; V195-S199 VanDerWaalsContact CG1-CB 3.4Å; V195-S199 VanDerWaalsContact CG1-OG 3.23Å; V195-S199 WeakPolarHBondContact CG1-OG 3.1Å
196G82.1Confident83.1Confident17 Ų1753.6 Ų53.618%0.17526%0.26CS..  trans-58.9149.7177.700000111.6S178 Y198 S199 F200S178-G196 WeakPolarHBondContact OG-CA 3.21Å; S178-G196 PolarHBondContact OG-N 3.18Å; G196-Y198 PolarHBondContact O-N 2.59Å; G196-Y198 VanDerWaalsContact O-N 3.12Å; G196-S199 PolarHBondContact O-N 2.92Å; G196-F200 PolarHBondContact O-N 3.01Å
197E84.5Confident83.9Confident137 Ų13753.6 Ų53.664%0.6426%0.26SS*.Hα-helixtrans-52.1-41.1-172.8-173.4175.9-177.300112.8F200 L201E197-F200 WeakPolarHBondContact O-CB 3.21Å; E197-F200 PolarHBondContact O-N 2.83Å; E197-L201 HydrophobicContact CG-CD1 3.95Å; E197-L201 HydrophobicContact CG-CG 4.37Å; E197-L201 WeakPolarHBondContact O-CB 3.36Å; E197-L201 VanDerWaalsContact O-CG 3.29Å; E197-L201 WeakPolarHBondContact O-CG 3.5Å; E197-L201 PolarHBondContact O-N 3.28Å
198Y87.8Confident85.2Confident181 Ų18149.5 Ų49.571%0.7123%0.233SC*.Hα-helixtrans-63.9-43.1177.1-66.2-73.3000113.4G196 F200 L201 I202G196-Y198 PolarHBondContact O-N 2.59Å; G196-Y198 VanDerWaalsContact O-N 3.12Å; Y198-F200 VanDerWaalsContact C-N 3.33Å; Y198-L201 PolarHBondContact O-N 2.91Å; Y198-I202 WeakPolarHBondContact O-CB 3.14Å; Y198-I202 VanDerWaalsContact O-CG1 3.27Å; Y198-I202 WeakPolarHBondContact O-CG1 3.14Å; Y198-I202 PolarHBondContact O-N 3.33Å
199S90Very high86.2Confident0 Ų050 Ų500%024%0.241CC..Hα-helixtrans-69.4-34.4178.6175.30000111.7F174 A175 V195 G196 H203F174-S199 VanDerWaalsContact CE1-CA 3.48Å; A175-S199 WeakPolarHBondContact CA-OG 3.49Å; V195-S199 VanDerWaalsContact CG1-CB 3.4Å; V195-S199 VanDerWaalsContact CG1-OG 3.23Å; V195-S199 WeakPolarHBondContact CG1-OG 3.1Å; G196-S199 PolarHBondContact O-N 2.92Å; S199-H203 VanDerWaalsContact O-CB 3.28Å; S199-H203 WeakPolarHBondContact O-CB 3.33Å; S199-H203 PolarHBondContact O-N 2.88Å
200F89.9Confident87.1Confident12 Ų1252.2 Ų52.25%0.05325%0.252CS..Hα-helixtrans-61.8-52.4170178.4-82.7000111.4H191 R192 G196 E197 Y198 H203 Y204 L269H191-F200 AromaticContact CE1-CD2 3.64Å; H191-F200 AromaticContact ND1-CD2 3.41Å; H191-F200 WeakPolarHBondContact ND1-CD2 3.26Å; H191-F200 AromaticContact ND1-CE2 3.53Å; R192-F200 HydrophobicContact CB-CD2 4.19Å; R192-F200 HydrophobicContact CB-CE2 4.05Å; R192-F200 HydrophobicContact CG-CD2 4.4Å; R192-F200 HydrophobicContact CG-CE2 4.4Å; G196-F200 PolarHBondContact O-N 3.01Å; E197-F200 WeakPolarHBondContact O-CB 3.21Å; E197-F200 PolarHBondContact O-N 2.83Å; Y198-F200 VanDerWaalsContact C-N 3.33Å; F200-H203 PolarHBondContact O-N 3.39Å; F200-Y204 AromaticContact CD1-CD2 4Å; F200-Y204 HydrophobicContact CD1-CD2 4Å; F200-Y204 AromaticContact CD2-CD2 3.89Å; F200-Y204 HydrophobicContact CD2-CD2 3.89Å; F200-Y204 AromaticContact CD2-CE2 3.61Å; F200-Y204 HydrophobicContact CD2-CE2 3.61Å; F200-Y204 AromaticContact CE1-CD2 3.74Å; F200-Y204 HydrophobicContact CE1-CD2 3.74Å; F200-Y204 HydrophobicContact CE1-CE2 4.24Å; F200-Y204 AromaticContact CE2-CD2 3.65Å; F200-Y204 HydrophobicContact CE2-CD2 3.65Å; F200-Y204 AromaticContact CE2-CE2 3.26Å; F200-Y204 HydrophobicContact CE2-CE2 3.26Å; F200-Y204 HydrophobicContact CG-CD2 4.04Å; F200-Y204 HydrophobicContact CG-CE2 4.23Å; F200-Y204 AromaticContact CZ-CD2 3.55Å; F200-Y204 HydrophobicContact CZ-CD2 3.55Å; F200-Y204 AromaticContact CZ-CE2 3.6Å; F200-Y204 HydrophobicContact CZ-CE2 3.6Å; F200-Y204 VanDerWaalsContact O-CD2 3.29Å; F200-Y204 WeakPolarHBondContact O-CD2 3.18Å; F200-Y204 PolarHBondContact O-N 3.24Å; F200-Y204 VanDerWaalsContact O-N 3.13Å; F200-L269 HydrophobicContact CE1-CD2 4.05Å
201L90.9Very high88Confident36 Ų3646.4 Ų46.419%0.18823%0.23CC..Hα-helixtrans-66.7-45.3-175.2-73175.1000112.6E197 Y198 H203 Y204 W205 F273E197-L201 HydrophobicContact CG-CD1 3.95Å; E197-L201 HydrophobicContact CG-CG 4.37Å; E197-L201 WeakPolarHBondContact O-CB 3.36Å; E197-L201 VanDerWaalsContact O-CG 3.29Å; E197-L201 WeakPolarHBondContact O-CG 3.5Å; E197-L201 PolarHBondContact O-N 3.28Å; Y198-L201 PolarHBondContact O-N 2.91Å; L201-H203 VanDerWaalsContact C-N 3.27Å; L201-H203 PolarHBondContact O-N 3.46Å; L201-Y204 PolarHBondContact O-N 3.4Å; L201-W205 VanDerWaalsContact O-CB 3.27Å; L201-W205 WeakPolarHBondContact O-CB 3.28Å; L201-W205 PolarHBondContact O-N 3.01Å; L201-F273 HydrophobicContact CD2-CZ 4.37Å
202I92.5Very high89.1Confident103 Ų10348.8 Ų48.853%0.52824%0.238SC..Hα-helixtrans-58.7-43.1178.6-73.5169.4000110.5F174 Y198 G206F174-I202 HydrophobicContact CE1-CD1 3.95Å; F174-I202 HydrophobicContact CZ-CD1 4.5Å; Y198-I202 WeakPolarHBondContact O-CB 3.14Å; Y198-I202 VanDerWaalsContact O-CG1 3.27Å; Y198-I202 WeakPolarHBondContact O-CG1 3.14Å; Y198-I202 PolarHBondContact O-N 3.33Å; I202-G206 WeakPolarHBondContact O-CA 3.44Å; I202-G206 PolarHBondContact O-N 2.92Å
203H94.6Very high90.1Very high4 Ų446.2 Ų46.22%0.01923%0.234CC..Hα-helixtrans-62-59.3179.2-177.878.9000111.4K123 D126 D171 S199 F200 L201 G206 L207K123-H203 VanDerWaalsContact NZ-CB 3.3Å; K123-H203 PolarHBondContact NZ-ND1 3.44Å; D126-H203 IonicContact OD2-NE2 3.85Å; D171-H203 IonicContact OD1-CG 3.98Å; D171-H203 IonicContact OD1-ND1 3.44Å; D171-H203 PolarHBondContact OD1-ND1 2.88Å; D171-H203 IonicContact OD2-CE1 3.61Å; D171-H203 IonicContact OD2-CG 3.84Å; D171-H203 IonicContact OD2-ND1 2.87Å; D171-H203 PolarHBondContact OD2-ND1 2.95Å; S199-H203 VanDerWaalsContact O-CB 3.28Å; S199-H203 WeakPolarHBondContact O-CB 3.33Å; S199-H203 PolarHBondContact O-N 2.88Å; F200-H203 PolarHBondContact O-N 3.39Å; L201-H203 VanDerWaalsContact C-N 3.27Å; L201-H203 PolarHBondContact O-N 3.46Å; H203-G206 WeakPolarHBondContact O-CA 3.45Å; H203-G206 PolarHBondContact O-N 3.37Å; H203-G206 VanDerWaalsContact O-N 3.12Å; H203-L207 WeakPolarHBondContact O-CG 3.43Å; H203-L207 PolarHBondContact O-N 2.63Å
204Y92.8Very high91.3Very high12 Ų1244.1 Ų44.15%0.04722%0.217CC..Hα-helixtrans-70.8-37.2-173.7-72.7-64.8000113.7H191 F200 L201 G206 L207 V208 I265 W285H191-Y204 AromaticContact CE1-CE2 3.55Å; H191-Y204 AromaticContact CE1-CZ 3.94Å; H191-Y204 PolarHBondContact CE1-OH 2.89Å; H191-Y204 AromaticContact ND1-CE2 3.93Å; F200-Y204 AromaticContact CD1-CD2 4Å; F200-Y204 HydrophobicContact CD1-CD2 4Å; F200-Y204 AromaticContact CD2-CD2 3.89Å; F200-Y204 HydrophobicContact CD2-CD2 3.89Å; F200-Y204 AromaticContact CD2-CE2 3.61Å; F200-Y204 HydrophobicContact CD2-CE2 3.61Å; F200-Y204 AromaticContact CE1-CD2 3.74Å; F200-Y204 HydrophobicContact CE1-CD2 3.74Å; F200-Y204 HydrophobicContact CE1-CE2 4.24Å; F200-Y204 AromaticContact CE2-CD2 3.65Å; F200-Y204 HydrophobicContact CE2-CD2 3.65Å; F200-Y204 AromaticContact CE2-CE2 3.26Å; F200-Y204 HydrophobicContact CE2-CE2 3.26Å; F200-Y204 HydrophobicContact CG-CD2 4.04Å; F200-Y204 HydrophobicContact CG-CE2 4.23Å; F200-Y204 AromaticContact CZ-CD2 3.55Å; F200-Y204 HydrophobicContact CZ-CD2 3.55Å; F200-Y204 AromaticContact CZ-CE2 3.6Å; F200-Y204 HydrophobicContact CZ-CE2 3.6Å; F200-Y204 VanDerWaalsContact O-CD2 3.29Å; F200-Y204 WeakPolarHBondContact O-CD2 3.18Å; F200-Y204 PolarHBondContact O-N 3.24Å; F200-Y204 VanDerWaalsContact O-N 3.13Å; L201-Y204 PolarHBondContact O-N 3.4Å; Y204-G206 VanDerWaalsContact C-N 3.27Å; Y204-G206 PolarHBondContact O-N 2.93Å; Y204-L207 HydrophobicContact CD1-CD1 3.92Å; Y204-L207 HydrophobicContact CE1-CD1 4.2Å; Y204-L207 PolarHBondContact O-N 3.27Å; Y204-V208 WeakPolarHBondContact O-CG2 3.47Å; Y204-V208 PolarHBondContact O-N 3.45Å; Y204-I265 HydrophobicContact CD1-CG2 4.07Å; Y204-W285 HydrophobicContact CD1-CH2 4.06Å; Y204-W285 AromaticContact CE1-CH2 3.32Å; Y204-W285 HydrophobicContact CE1-CH2 3.32Å; Y204-W285 HydrophobicContact CE1-CZ2 4.07Å; Y204-W285 HydrophobicContact CE1-CZ3 4.21Å; Y204-W285 AromaticContact CZ-CH2 3.79Å
205W94Very high92.3Very high104 Ų10445.3 Ų45.339%0.39422%0.224SC..Hα-helixtrans-65.9-33.6170.6-80.4113.1000111.9L201 V208 C209 L269 F273L201-W205 VanDerWaalsContact O-CB 3.27Å; L201-W205 WeakPolarHBondContact O-CB 3.28Å; L201-W205 PolarHBondContact O-N 3.01Å; W205-V208 HydrophobicContact CE3-CB 4.39Å; W205-V208 HydrophobicContact CE3-CG1 4.25Å; W205-V208 HydrophobicContact CZ3-CG1 4.27Å; W205-V208 PolarHBondContact O-N 3.27Å; W205-C209 WeakPolarHBondContact O-CB 3.08Å; W205-C209 PolarHBondContact O-N 3.42Å; W205-C209 PolarHBondContact O-SG 3.04Å; W205-L269 HydrophobicContact CD2-CD1 3.92Å; W205-L269 HydrophobicContact CE3-CD1 4.31Å; W205-L269 HydrophobicContact CG-CD1 4.22Å; W205-L269 HydrophobicContact CZ2-CB 4.42Å; W205-L269 HydrophobicContact CZ2-CD1 4.34Å; W205-F273 HydrophobicContact CZ2-CE2 4.27Å
206G94.7Very high92.9Very high23 Ų2349.5 Ų49.524%0.23725%0.245CC..Hα-helixtrans-59.2-5017100000112.1I202 H203 Y204 V208 C209 M210I202-G206 WeakPolarHBondContact O-CA 3.44Å; I202-G206 PolarHBondContact O-N 2.92Å; H203-G206 WeakPolarHBondContact O-CA 3.45Å; H203-G206 PolarHBondContact O-N 3.37Å; H203-G206 VanDerWaalsContact O-N 3.12Å; Y204-G206 VanDerWaalsContact C-N 3.27Å; Y204-G206 PolarHBondContact O-N 2.93Å; G206-V208 PolarHBondContact O-N 3.25Å; G206-C209 PolarHBondContact O-N 3.18Å; G206-M210 WeakPolarHBondContact O-CB 3.35Å; G206-M210 WeakPolarHBondContact O-CG 3.36Å; G206-M210 PolarHBondContact O-N 3.5Å
207L95.4Very high93.5Very high6 Ų652 Ų523%0.03125%0.251CS..Hα-helixtrans-57.9-47.7176.3-63.1-176000111.6D126 L127 V130 H203 Y204 M210 G211 I265D126-L207 HydrophobicContact CB-CD1 3.7Å; D126-L207 HydrophobicContact CB-CD2 3.9Å; D126-L207 HydrophobicContact CB-CG 4.45Å; L127-L207 HydrophobicContact CD2-CD2 3.93Å; L127-L207 HydrophobicContact CG-CD2 4.32Å; V130-L207 HydrophobicContact CB-CD2 4.38Å; V130-L207 HydrophobicContact CG1-CD2 3.69Å; H203-L207 WeakPolarHBondContact O-CG 3.43Å; H203-L207 PolarHBondContact O-N 2.63Å; Y204-L207 HydrophobicContact CD1-CD1 3.92Å; Y204-L207 HydrophobicContact CE1-CD1 4.2Å; Y204-L207 PolarHBondContact O-N 3.27Å; L207-M210 PolarHBondContact O-N 3.45Å; L207-G211 PolarHBondContact O-N 3.01Å; L207-I265 HydrophobicContact CD1-CD1 4.4Å
208V95.1Very high93.9Very high7 Ų745.8 Ų45.84%0.04222%0.222CC..Hα-helixtrans-58.1-55.2177.3168.30000110.2Y204 W205 G206 M210 G211 Y212 I265 S266 L269Y204-V208 WeakPolarHBondContact O-CG2 3.47Å; Y204-V208 PolarHBondContact O-N 3.45Å; W205-V208 HydrophobicContact CE3-CB 4.39Å; W205-V208 HydrophobicContact CE3-CG1 4.25Å; W205-V208 HydrophobicContact CZ3-CG1 4.27Å; W205-V208 PolarHBondContact O-N 3.27Å; G206-V208 PolarHBondContact O-N 3.25Å; V208-M210 VanDerWaalsContact C-N 3.31Å; V208-M210 PolarHBondContact O-N 3.44Å; V208-G211 PolarHBondContact O-N 3.46Å; V208-G211 VanDerWaalsContact O-N 3.12Å; V208-Y212 HydrophobicContact CG1-CD2 3.84Å; V208-Y212 HydrophobicContact CG1-CE2 3.82Å; V208-Y212 VanDerWaalsContact O-CD2 3.3Å; V208-Y212 WeakPolarHBondContact O-CD2 3.43Å; V208-Y212 PolarHBondContact O-N 3.4Å; V208-I265 HydrophobicContact CG2-CB 4.06Å; V208-I265 HydrophobicContact CG2-CG2 3.58Å; V208-S266 VanDerWaalsContact CG1-OG 3.32Å; V208-S266 WeakPolarHBondContact CG1-OG 3.41Å; V208-L269 HydrophobicContact CG2-CD1 4.12Å
209C95.9Very high94.2Very high69 Ų6940.7 Ų40.747%0.46621%0.21SC..Hα-helixtrans-54.7-46.8179.7-74.10000111.9W205 G206 Y212 L213W205-C209 WeakPolarHBondContact O-CB 3.08Å; W205-C209 PolarHBondContact O-N 3.42Å; W205-C209 PolarHBondContact O-SG 3.04Å; G206-C209 PolarHBondContact O-N 3.18Å; C209-Y212 PolarHBondContact O-N 3.26Å; C209-L213 WeakPolarHBondContact O-CB 3.25Å; C209-L213 WeakPolarHBondContact O-CG 3.45Å; C209-L213 PolarHBondContact O-N 3.29Å
210M95.5Very high94.4Very high48 Ų4844.1 Ų44.124%0.23623%0.227CC..Hα-helixtrans-65.5-39.1178.7-69.2-174-171.500112.5V130 I131 G206 L207 V208 L213 S214V130-M210 HydrophobicContact CB-CB 4.45Å; V130-M210 HydrophobicContact CG1-CB 4.02Å; V130-M210 HydrophobicContact CG1-SD 3.76Å; V130-M210 HydrophobicContact CG2-CB 3.58Å; I131-M210 HydrophobicContact CD1-SD 4.44Å; I131-M210 HydrophobicContact CG1-CE 4.34Å; I131-M210 HydrophobicContact CG1-SD 3.65Å; G206-M210 WeakPolarHBondContact O-CB 3.35Å; G206-M210 WeakPolarHBondContact O-CG 3.36Å; G206-M210 PolarHBondContact O-N 3.5Å; L207-M210 PolarHBondContact O-N 3.45Å; V208-M210 VanDerWaalsContact C-N 3.31Å; V208-M210 PolarHBondContact O-N 3.44Å; M210-L213 PolarHBondContact O-N 2.91Å; M210-S214 WeakPolarHBondContact O-CB 3.38Å; M210-S214 PolarHBondContact O-N 3.43Å; M210-S214 PolarHBondContact O-OG 2.94Å
211G95.1Very high94.5Very high2 Ų243.6 Ų43.62%0.02123%0.225CC..Hα-helixtrans-63-44.7176.900000112.8L207 V208 T215L207-G211 PolarHBondContact O-N 3.01Å; V208-G211 PolarHBondContact O-N 3.46Å; V208-G211 VanDerWaalsContact O-N 3.12Å; G211-T215 PolarHBondContact O-N 2.85Å; G211-T215 VanDerWaalsContact O-N 3.17Å; G211-T215 PolarHBondContact O-OG1 3.44Å
212Y96.5Very high94.6Very high84 Ų8443.8 Ų43.833%0.32923%0.226SC..Hα-helixtrans-66.7-45.9175.2-82.9-97.5000111.9V208 C209 S214 T215 I216 F258 A262 S266V208-Y212 HydrophobicContact CG1-CD2 3.84Å; V208-Y212 HydrophobicContact CG1-CE2 3.82Å; V208-Y212 VanDerWaalsContact O-CD2 3.3Å; V208-Y212 WeakPolarHBondContact O-CD2 3.43Å; V208-Y212 PolarHBondContact O-N 3.4Å; C209-Y212 PolarHBondContact O-N 3.26Å; Y212-S214 VanDerWaalsContact C-N 3.31Å; Y212-S214 PolarHBondContact O-N 2.98Å; Y212-T215 WeakPolarHBondContact O-CB 3.42Å; Y212-T215 PolarHBondContact O-N 3.5Å; Y212-T215 VanDerWaalsContact O-N 3.16Å; Y212-I216 WeakPolarHBondContact O-CG1 3.42Å; Y212-I216 PolarHBondContact O-N 3.43Å; Y212-F258 AromaticContact CD1-CE2 3.89Å; Y212-F258 HydrophobicContact CD1-CE2 3.89Å; Y212-F258 AromaticContact CE1-CE2 3.63Å; Y212-F258 HydrophobicContact CE1-CE2 3.63Å; Y212-F258 HydrophobicContact CE1-CZ 4.23Å; Y212-F258 HydrophobicContact CG-CE2 4.46Å; Y212-F258 AromaticContact CZ-CE2 3.98Å; Y212-A262 HydrophobicContact CD2-CB 4.26Å; Y212-A262 HydrophobicContact CE2-CB 4.22Å; Y212-S266 WeakPolarHBondContact CE2-OG 3.39Å
213L96.4Very high94.5Very high79 Ų7943.3 Ų43.341%0.41422%0.223SC..Hα-helixtrans-59-43177.7-75.2173.4000112L134 C209 M210 T215 I216 F217L134-L213 HydrophobicContact CD1-CB 4.27Å; C209-L213 WeakPolarHBondContact O-CB 3.25Å; C209-L213 WeakPolarHBondContact O-CG 3.45Å; C209-L213 PolarHBondContact O-N 3.29Å; M210-L213 PolarHBondContact O-N 2.91Å; L213-T215 VanDerWaalsContact C-N 3.32Å; L213-T215 PolarHBondContact O-N 3.31Å; L213-I216 PolarHBondContact O-N 3.11Å; L213-F217 WeakPolarHBondContact O-CB 3.29Å; L213-F217 WeakPolarHBondContact O-CG 3.42Å; L213-F217 PolarHBondContact O-N 3.47Å
214S95.6Very high94.4Very high0 Ų046.2 Ų46.20%024%0.238CC..Hα-helixtrans-57.2-47.7175.5-58.90000111.3L134 S137 M210 Y212 F217 Y218L134-S214 WeakPolarHBondContact CA-OG 3.35Å; L134-S214 WeakPolarHBondContact CB-OG 3.45Å; L134-S214 PolarHBondContact N-OG 3.39Å; S137-S214 WeakPolarHBondContact CB-O 3.34Å; S137-S214 PolarHBondContact OG-O 3.18Å; S137-S214 VanDerWaalsContact OG-O 3.12Å; M210-S214 WeakPolarHBondContact O-CB 3.38Å; M210-S214 PolarHBondContact O-N 3.43Å; M210-S214 PolarHBondContact O-OG 2.94Å; Y212-S214 VanDerWaalsContact C-N 3.31Å; Y212-S214 PolarHBondContact O-N 2.98Å; S214-F217 PolarHBondContact O-N 3.26Å; S214-Y218 VanDerWaalsContact O-CB 3.31Å; S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 2.89Å
215T95.3Very high94.2Very high26 Ų2645.7 Ų45.716%0.1624%0.236CC..Hα-helixtrans-62.1-47.2179.6-55.50000111.4G211 Y212 L213 Y218 V219 I254 F258G211-T215 PolarHBondContact O-N 2.85Å; G211-T215 VanDerWaalsContact O-N 3.17Å; G211-T215 PolarHBondContact O-OG1 3.44Å; Y212-T215 WeakPolarHBondContact O-CB 3.42Å; Y212-T215 PolarHBondContact O-N 3.5Å; Y212-T215 VanDerWaalsContact O-N 3.16Å; L213-T215 VanDerWaalsContact C-N 3.32Å; L213-T215 PolarHBondContact O-N 3.31Å; T215-Y218 PolarHBondContact O-N 3.16Å; T215-V219 WeakPolarHBondContact O-CG2 3.39Å; T215-V219 PolarHBondContact O-N 3.43Å; T215-I254 HydrophobicContact CG2-CG2 4.49Å; T215-F258 HydrophobicContact CG2-CB 4.36Å; T215-F258 HydrophobicContact CG2-CD2 4.06Å; T215-F258 HydrophobicContact CG2-CG 4.11Å
216I95.6Very high93.9Very high89 Ų8948 Ų4846%0.45625%0.249SC..Hα-helixtrans-60.1-51178.5-68.6165.7000110.6Y212 L213 Y218 V219 I220Y212-I216 WeakPolarHBondContact O-CG1 3.42Å; Y212-I216 PolarHBondContact O-N 3.43Å; L213-I216 PolarHBondContact O-N 3.11Å; I216-Y218 VanDerWaalsContact C-N 3.27Å; I216-Y218 PolarHBondContact O-N 2.92Å; I216-V219 PolarHBondContact O-N 3.14Å; I216-I220 HydrophobicContact CG2-CD1 3.8Å; I216-I220 VanDerWaalsContact O-CG1 3.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.31Å; I216-I220 PolarHBondContact O-N 3.29Å
217F94.9Very high93.7Very high69 Ų6956 Ų5630%0.30327%0.271SS..Hα-helixtrans-59.8-38.7179-73.2-18.1000112.5L134 I138 L141 L213 S214 I220 A221L134-F217 HydrophobicContact CD1-CD2 3.77Å; L134-F217 HydrophobicContact CD1-CE2 4Å; I138-F217 HydrophobicContact CG1-CD2 4.04Å; I138-F217 HydrophobicContact CG1-CE2 4.39Å; L141-F217 HydrophobicContact CD1-CB 3.82Å; L141-F217 HydrophobicContact CD1-CD1 4.24Å; L141-F217 HydrophobicContact CD1-CG 4.03Å; L213-F217 WeakPolarHBondContact O-CB 3.29Å; L213-F217 WeakPolarHBondContact O-CG 3.42Å; L213-F217 PolarHBondContact O-N 3.47Å; S214-F217 PolarHBondContact O-N 3.26Å; F217-I220 PolarHBondContact O-N 3.36Å; F217-A221 WeakPolarHBondContact O-CB 3.14Å; F217-A221 PolarHBondContact O-N 2.95Å
218Y93.7Very high93.2Very high7 Ų761.8 Ų61.83%0.02729%0.293CS..Hα-helixtrans-70.3-41.2178.1-175.4-98.3000113.1S214 T215 I216 I220 A221 I222 M247 I250 I251 I254S214-Y218 VanDerWaalsContact O-CB 3.31Å; S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 2.89Å; T215-Y218 PolarHBondContact O-N 3.16Å; I216-Y218 VanDerWaalsContact C-N 3.27Å; I216-Y218 PolarHBondContact O-N 2.92Å; Y218-I220 VanDerWaalsContact C-N 3.32Å; Y218-I220 PolarHBondContact O-N 3Å; Y218-A221 WeakPolarHBondContact O-CB 3.34Å; Y218-A221 PolarHBondContact O-N 3.25Å; Y218-I222 HydrophobicContact CD1-CG1 4.16Å; Y218-I222 HydrophobicContact CE1-CD1 4.23Å; Y218-I222 HydrophobicContact CE1-CG1 3.68Å; Y218-I222 HydrophobicContact CE2-CG1 4.48Å; Y218-I222 WeakPolarHBondContact O-CG1 3.31Å; Y218-I222 PolarHBondContact O-N 3.44Å; Y218-M247 HydrophobicContact CD2-CE 3.8Å; Y218-M247 HydrophobicContact CE2-CE 3.49Å; Y218-M247 VanDerWaalsContact CE2-CE 3.49Å; Y218-M247 PolarHBondContact OH-O 2.78Å; Y218-I250 HydrophobicContact CE2-CB 4.04Å; Y218-I250 HydrophobicContact CE2-CG2 4.01Å; Y218-I251 HydrophobicContact CE1-CB 4.11Å; Y218-I251 HydrophobicContact CE1-CG1 3.98Å; Y218-I251 WeakPolarHBondContact OH-CA 3.43Å; Y218-I251 WeakPolarHBondContact OH-CB 3.35Å; Y218-I251 PolarHBondContact OH-N 3.48Å; Y218-I251 VanDerWaalsContact OH-N 3.13Å; Y218-I254 HydrophobicContact CD1-CB 4.45Å; Y218-I254 HydrophobicContact CD1-CD1 3.85Å; Y218-I254 HydrophobicContact CD1-CG2 4.13Å; Y218-I254 HydrophobicContact CD2-CD1 3.11Å; Y218-I254 HydrophobicContact CE1-CD1 4.32Å; Y218-I254 HydrophobicContact CE2-CD1 3.64Å; Y218-I254 HydrophobicContact CG-CD1 3.21Å; Y218-I254 HydrophobicContact CG-CG1 4.42Å; Y218-I254 HydrophobicContact CG-CG2 4.26Å
219V94Very high92.7Very high75 Ų7564.6 Ų64.646%0.45531%0.305SS..Hα-helixtrans-59.7-45.7173.9169.60000110.3T215 I216 A221 I222 I223T215-V219 WeakPolarHBondContact O-CG2 3.39Å; T215-V219 PolarHBondContact O-N 3.43Å; I216-V219 PolarHBondContact O-N 3.14Å; V219-A221 VanDerWaalsContact C-N 3.32Å; V219-A221 PolarHBondContact O-N 3.25Å; V219-I222 PolarHBondContact O-N 3.35Å; V219-I223 HydrophobicContact CG1-CD1 3.79Å; V219-I223 HydrophobicContact CG1-CG1 4.5Å; V219-I223 VanDerWaalsContact O-CG1 3.3Å; V219-I223 WeakPolarHBondContact O-CG1 3.42Å; V219-I223 PolarHBondContact O-N 3.27Å
220I94.5Very high92.2Very high72 Ų7265.8 Ų65.837%0.36932%0.319SS..Hα-helixtrans-58.2-46.2174.5-67.5168.6000110.4L141 I216 F217 Y218 I222 I223 M224L141-I220 HydrophobicContact CD2-CB 4.36Å; L141-I220 HydrophobicContact CD2-CG2 3.88Å; I216-I220 HydrophobicContact CG2-CD1 3.8Å; I216-I220 VanDerWaalsContact O-CG1 3.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.31Å; I216-I220 PolarHBondContact O-N 3.29Å; F217-I220 PolarHBondContact O-N 3.36Å; Y218-I220 VanDerWaalsContact C-N 3.32Å; Y218-I220 PolarHBondContact O-N 3Å; I220-I222 PolarHBondContact O-N 2.91Å; I220-I223 PolarHBondContact O-N 2.98Å; I220-M224 HydrophobicContact CG2-CG 4.19Å; I220-M224 HydrophobicContact CG2-SD 3.71Å; I220-M224 WeakPolarHBondContact O-CB 3.5Å; I220-M224 VanDerWaalsContact O-CG 3.31Å; I220-M224 WeakPolarHBondContact O-CG 3.46Å; I220-M224 PolarHBondContact O-N 3.43Å
221A92.2Very high91.8Very high0 Ų067 Ų670%033%0.332CS..Hα-helixtrans-58.8-45.9178.500000112.1L141 I144 F217 Y218 V219 I223 M224 L225 M247L141-A221 HydrophobicContact CD2-CB 3.61Å; L141-A221 HydrophobicContact CG-CB 3.89Å; I144-A221 HydrophobicContact CD1-CB 4.3Å; I144-A221 WeakPolarHBondContact CD1-O 3.37Å; F217-A221 WeakPolarHBondContact O-CB 3.14Å; F217-A221 PolarHBondContact O-N 2.95Å; Y218-A221 WeakPolarHBondContact O-CB 3.34Å; Y218-A221 PolarHBondContact O-N 3.25Å; V219-A221 VanDerWaalsContact C-N 3.32Å; V219-A221 PolarHBondContact O-N 3.25Å; A221-I223 PolarHBondContact O-N 3.03Å; A221-M224 PolarHBondContact O-N 2.92Å; A221-L225 WeakPolarHBondContact O-CB 3.41Å; A221-L225 PolarHBondContact O-N 3.28Å; A221-M247 HydrophobicContact CB-CE 3.52Å
222I91.8Very high91.4Very high41 Ų4167.4 Ų67.421%0.2134%0.335CS..Hα-helixtrans-63-44.1177.6-69.8-66.7000111.6Y218 V219 I220 L225 K226 M247Y218-I222 HydrophobicContact CD1-CG1 4.16Å; Y218-I222 HydrophobicContact CE1-CD1 4.23Å; Y218-I222 HydrophobicContact CE1-CG1 3.68Å; Y218-I222 HydrophobicContact CE2-CG1 4.48Å; Y218-I222 WeakPolarHBondContact O-CG1 3.31Å; Y218-I222 PolarHBondContact O-N 3.44Å; V219-I222 PolarHBondContact O-N 3.35Å; I220-I222 PolarHBondContact O-N 2.91Å; I222-L225 PolarHBondContact O-N 3.41Å; I222-K226 WeakPolarHBondContact O-CB 3.39Å; I222-K226 PolarHBondContact O-N 2.87Å; I222-M247 HydrophobicContact CD1-CB 3.94Å; I222-M247 HydrophobicContact CD1-CE 3.52Å; I222-M247 HydrophobicContact CD1-SD 4.19Å; I222-M247 HydrophobicContact CG1-CE 3.81Å
223I91.9Very high90.8Very high92 Ų9268 Ų6847%0.47235%0.351SS..Hα-helixtrans-61.8-48.8177.7-67.7167.4000110.1V219 I220 A221 L225 K226 R227V219-I223 HydrophobicContact CG1-CD1 3.79Å; V219-I223 HydrophobicContact CG1-CG1 4.5Å; V219-I223 VanDerWaalsContact O-CG1 3.3Å; V219-I223 WeakPolarHBondContact O-CG1 3.42Å; V219-I223 PolarHBondContact O-N 3.27Å; I220-I223 PolarHBondContact O-N 2.98Å; A221-I223 PolarHBondContact O-N 3.03Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 3.3Å; I223-K226 PolarHBondContact O-N 3.35Å; I223-R227 WeakPolarHBondContact O-CG 3.45Å; I223-R227 PolarHBondContact O-N 3.34Å
224M90.8Very high90.4Very high65 Ų6566.6 Ų66.632%0.3236%0.356SS..Hα-helixtrans-60.6-43.5178.1-74.2-179.966.700111.7L141 I144 I220 A221 R227 R228L141-M224 HydrophobicContact CD2-SD 4.12Å; I144-M224 HydrophobicContact CD1-CB 3.85Å; I144-M224 HydrophobicContact CG2-CB 4.42Å; I144-M224 HydrophobicContact CG2-CE 4.35Å; I220-M224 HydrophobicContact CG2-CG 4.19Å; I220-M224 HydrophobicContact CG2-SD 3.71Å; I220-M224 WeakPolarHBondContact O-CB 3.5Å; I220-M224 VanDerWaalsContact O-CG 3.31Å; I220-M224 WeakPolarHBondContact O-CG 3.46Å; I220-M224 PolarHBondContact O-N 3.43Å; A221-M224 PolarHBondContact O-N 2.92Å; M224-R227 PolarHBondContact O-N 2.93Å; M224-R228 VanDerWaalsContact O-CB 3.29Å; M224-R228 WeakPolarHBondContact O-CB 3.38Å; M224-R228 VanDerWaalsContact O-CG 3.3Å; M224-R228 WeakPolarHBondContact O-CG 3.36Å; M224-R228 PolarHBondContact O-N 3.48Å
225L88.9Confident89.9Confident2 Ų272.8 Ų72.81%0.0139%0.388CS..Hα-helixtrans-64.3-42.1179.5-172.770.2000111.2I144 A221 I222 I223 K229 M240 E243 Y244 M247I144-L225 HydrophobicContact CD1-CB 3.89Å; I144-L225 HydrophobicContact CD1-CD1 4.48Å; I144-L225 HydrophobicContact CG1-CB 4.31Å; I144-L225 HydrophobicContact CG1-CD1 3.97Å; A221-L225 WeakPolarHBondContact O-CB 3.41Å; A221-L225 PolarHBondContact O-N 3.28Å; I222-L225 PolarHBondContact O-N 3.41Å; I223-L225 VanDerWaalsContact C-N 3.34Å; I223-L225 PolarHBondContact O-N 3.3Å; L225-K229 WeakPolarHBondContact O-CB 3.18Å; L225-K229 PolarHBondContact O-N 2.93Å; L225-M240 HydrophobicContact CD1-CE 3.26Å; L225-M240 HydrophobicContact CD1-SD 3.69Å; L225-M240 HydrophobicContact CG-CE 4.21Å; L225-E243 HydrophobicContact CD1-CB 4.3Å; L225-Y244 VanDerWaalsContact CD2-CA 3.49Å; L225-Y244 HydrophobicContact CD2-CD2 3.86Å; L225-Y244 HydrophobicContact CD2-CG 4.3Å; L225-Y244 HydrophobicContact CG-CD2 4.49Å; L225-M247 HydrophobicContact CD2-CG 4.4Å; L225-M247 HydrophobicContact CD2-SD 3.51Å; L225-M247 VanDerWaalsContact CD2-SD 3.51Å
226K88.7Confident89.4Confident152 Ų15277.7 Ų77.766%0.66140%0.404SS*.Hα-helixtrans-62-45.7175.3-171.7177.5-179.7-177.70111.5I222 I223 A230I222-K226 WeakPolarHBondContact O-CB 3.39Å; I222-K226 PolarHBondContact O-N 2.87Å; I223-K226 PolarHBondContact O-N 3.35Å; K226-A230 PolarHBondContact O-N 3.26Å
227R89.4Confident89Confident190 Ų19077.7 Ų77.772%0.71740%0.402SS*.Hα-helixtrans-64.1-47178.2-70-179.874.4174.64111.9I223 M224 A230 S231I223-R227 WeakPolarHBondContact O-CG 3.45Å; I223-R227 PolarHBondContact O-N 3.34Å; M224-R227 PolarHBondContact O-N 2.93Å; R227-A230 PolarHBondContact O-N 2.95Å; R227-S231 PolarHBondContact O-N 3.29Å
228R86.2Confident88.5Confident129 Ų12978.9 Ų78.949%0.48741%0.41SS..Hα-helixtrans-69.9-33.2-179.3-74-79-167.3-104.8-1.4112.6I144 M224 S231 S232 M240I144-R228 HydrophobicContact CG2-CB 4.4Å; I144-R228 HydrophobicContact CG2-CG 3.88Å; M224-R228 VanDerWaalsContact O-CB 3.29Å; M224-R228 WeakPolarHBondContact O-CB 3.38Å; M224-R228 VanDerWaalsContact O-CG 3.3Å; M224-R228 WeakPolarHBondContact O-CG 3.36Å; M224-R228 PolarHBondContact O-N 3.48Å; R228-S231 CarbonylContact O-C 3.59Å; R228-S231 PolarHBondContact O-N 2.83Å; R228-S231 PolarHBondContact O-OG 2.97Å; R228-S232 WeakPolarHBondContact O-CB 3.4Å; R228-S232 PolarHBondContact O-N 3.44Å; R228-S232 PolarHBondContact O-OG 2.95Å; R228-M240 HydrophobicContact CB-CE 3.24Å; R228-M240 HydrophobicContact CG-CE 4.38Å
229K84.6Confident88.2Confident65 Ų6583.9 Ų83.928%0.28343%0.434SS..Hα-helixtrans-60.9-46.2172.1180-176.7174.6-173.40110.8L225 S231 S232 M240L225-K229 WeakPolarHBondContact O-CB 3.18Å; L225-K229 PolarHBondContact O-N 2.93Å; K229-S231 PolarHBondContact O-N 3.2Å; K229-S232 PolarHBondContact O-N 2.75Å; K229-M240 HydrophobicContact CB-CB 4.33Å
230A85.4Confident87.7Confident94 Ų9481 Ų8178%0.77742%0.415SS*.Hα-helixtrans-64.9-26.9178.200000113.5K226 R227K226-A230 PolarHBondContact O-N 3.26Å; R227-A230 PolarHBondContact O-N 2.95Å
231S87.4Confident87.4Confident73 Ų7383.1 Ų83.151%0.5142%0.422SS..THydrogen-bonded Turntrans-99.34.718076.20000114.3R227 R228 K229R227-S231 PolarHBondContact O-N 3.29Å; R228-S231 CarbonylContact O-C 3.59Å; R228-S231 PolarHBondContact O-N 2.83Å; R228-S231 PolarHBondContact O-OG 2.97Å; K229-S231 PolarHBondContact O-N 3.2Å
232S85.1Confident87.1Confident11 Ų1191.6 Ų91.68%0.07745%0.454CS..  trans-107.1143-177.4-67.50000110.5R228 K229 R236R228-S232 WeakPolarHBondContact O-CB 3.4Å; R228-S232 PolarHBondContact O-N 3.44Å; R228-S232 PolarHBondContact O-OG 2.95Å; K229-S232 PolarHBondContact O-N 2.75Å; S232-R236 PolarHBondContact OG-NE 3.35Å
233S85.2Confident86.8Confident96 Ų9692.4 Ų92.467%0.67146%0.457SS*.  trans-125.2161.317555.90000110.7
234G88.2Confident86.6Confident50 Ų5090.9 Ų90.952%0.51545%0.446SS..THydrogen-bonded Turntrans65.5-139.1175.500000113.8R236 E237 I238G234-R236 PolarHBondContact O-N 3.04Å; G234-E237 WeakPolarHBondContact O-CB 3.31Å; G234-E237 PolarHBondContact O-N 3.02Å; G234-E237 VanDerWaalsContact O-N 3.12Å; G234-I238 PolarHBondContact O-N 2.81Å
235I84.9Confident86.4Confident130 Ų13091.9 Ų91.967%0.66745%0.449SS*.Hα-helixtrans-57.9-36.5-176-62.4172000111.6E237 I238 Q239I235-E237 VanDerWaalsContact C-N 3.34Å; I235-E237 PolarHBondContact O-N 3.35Å; I235-I238 PolarHBondContact O-N 3.42Å; I235-Q239 HydrophobicContact CG2-CG 4.43Å; I235-Q239 WeakPolarHBondContact O-CG 3.41Å; I235-Q239 PolarHBondContact O-N 3.2Å
236R83.8Confident86.2Confident130 Ų13094.4 Ų94.449%0.49147%0.465SS..Hα-helixtrans-65.2-37.8-179.7-169.4165.973.2-170.5-3.4111.8S232 G234 I238 Q239 M240S232-R236 PolarHBondContact OG-NE 3.35Å; G234-R236 PolarHBondContact O-N 3.04Å; R236-I238 VanDerWaalsContact C-N 3.33Å; R236-I238 PolarHBondContact O-N 2.92Å; R236-Q239 PolarHBondContact O-N 2.86Å; R236-M240 HydrophobicContact CG-CG 4.26Å; R236-M240 WeakPolarHBondContact O-CB 3.49Å; R236-M240 WeakPolarHBondContact O-CG 3.31Å; R236-M240 PolarHBondContact O-N 2.86Å
237E86.5Confident86Confident89 Ų8987.2 Ų87.242%0.41643%0.434SS..Hα-helixtrans-61.2-43.4175.9-167.4-165.8159.600111.6G234 I235 M240 K241G234-E237 WeakPolarHBondContact O-CB 3.31Å; G234-E237 PolarHBondContact O-N 3.02Å; G234-E237 VanDerWaalsContact O-N 3.12Å; I235-E237 VanDerWaalsContact C-N 3.34Å; I235-E237 PolarHBondContact O-N 3.35Å; E237-M240 PolarHBondContact O-N 2.84Å; E237-K241 WeakPolarHBondContact O-CB 3.47Å; E237-K241 PolarHBondContact O-N 3.32Å
238I86.1Confident85.9Confident93 Ų9382.2 Ų82.248%0.47742%0.417SS..Hα-helixtrans-63.5-44.6178.5-61.7172.4000110.8G234 I235 R236 M240 K241 R242G234-I238 PolarHBondContact O-N 2.81Å; I235-I238 PolarHBondContact O-N 3.42Å; R236-I238 VanDerWaalsContact C-N 3.33Å; R236-I238 PolarHBondContact O-N 2.92Å; I238-M240 VanDerWaalsContact C-N 3.35Å; I238-M240 PolarHBondContact O-N 3.44Å; I238-K241 PolarHBondContact O-N 3.34Å; I238-R242 WeakPolarHBondContact O-CG 3.37Å; I238-R242 PolarHBondContact O-N 2.86Å
239Q85.7Confident85.9Confident113 Ų11379.5 Ų79.553%0.52841%0.41SS..Hα-helixtrans-58.9-47175.5-72.2174.1-24.700111.1I235 R236 K241 R242 E243I235-Q239 HydrophobicContact CG2-CG 4.43Å; I235-Q239 WeakPolarHBondContact O-CG 3.41Å; I235-Q239 PolarHBondContact O-N 3.2Å; R236-Q239 PolarHBondContact O-N 2.86Å; Q239-K241 VanDerWaalsContact C-N 3.34Å; Q239-K241 PolarHBondContact O-N 3.09Å; Q239-R242 PolarHBondContact O-N 3.19Å; Q239-E243 PolarHBondContact O-N 3.26Å
240M84.6Confident86Confident13 Ų1376.5 Ų76.56%0.06440%0.397CS..Hα-helixtrans-64.9-36.2179.2-66-69-73.300112.5I144 L225 R228 K229 R236 E237 I238 Y244I144-M240 HydrophobicContact CG2-CE 4.5Å; L225-M240 HydrophobicContact CD1-CE 3.26Å; L225-M240 HydrophobicContact CD1-SD 3.69Å; L225-M240 HydrophobicContact CG-CE 4.21Å; R228-M240 HydrophobicContact CB-CE 3.24Å; R228-M240 HydrophobicContact CG-CE 4.38Å; K229-M240 HydrophobicContact CB-CB 4.33Å; R236-M240 HydrophobicContact CG-CG 4.26Å; R236-M240 WeakPolarHBondContact O-CB 3.49Å; R236-M240 WeakPolarHBondContact O-CG 3.31Å; R236-M240 PolarHBondContact O-N 2.86Å; E237-M240 PolarHBondContact O-N 2.84Å; I238-M240 VanDerWaalsContact C-N 3.35Å; I238-M240 PolarHBondContact O-N 3.44Å; M240-Y244 VanDerWaalsContact O-CB 3.3Å; M240-Y244 WeakPolarHBondContact O-CB 3.47Å; M240-Y244 PolarHBondContact O-N 3.34Å
241K87.5Confident86.3Confident118 Ų11876.7 Ų76.751%0.51338%0.384SS..Hα-helixtrans-64.2-42.8173.5-173.1175.6-179.7176.80111.3E237 I238 Q239 Y244 E245E237-K241 WeakPolarHBondContact O-CB 3.47Å; E237-K241 PolarHBondContact O-N 3.32Å; I238-K241 PolarHBondContact O-N 3.34Å; Q239-K241 VanDerWaalsContact C-N 3.34Å; Q239-K241 PolarHBondContact O-N 3.09Å; K241-Y244 PolarHBondContact O-N 3.49Å; K241-E245 WeakPolarHBondContact O-CG 3.46Å; K241-E245 PolarHBondContact O-N 2.85Å; K241-E245 VanDerWaalsContact O-N 3.12Å
242R86.1Confident86.4Confident178 Ų17875.3 Ų75.367%0.67237%0.37SS*.Hα-helixtrans-64-48.6176.1-69.9177.5-174.2-173.92.3111.3I238 Q239 Y244 E245 V246I238-R242 WeakPolarHBondContact O-CG 3.37Å; I238-R242 PolarHBondContact O-N 2.86Å; Q239-R242 PolarHBondContact O-N 3.19Å; R242-Y244 VanDerWaalsContact C-N 3.27Å; R242-Y244 PolarHBondContact O-N 2.95Å; R242-E245 PolarHBondContact O-N 2.83Å; R242-V246 WeakPolarHBondContact O-CG2 3.47Å; R242-V246 PolarHBondContact O-N 3.43Å; R242-V246 VanDerWaalsContact O-N 3.08Å
243E86.1Confident86.7Confident57 Ų5774.9 Ų74.927%0.26637%0.368SS..Hα-helixtrans-59.9-38.6177.8-73.2-54.4142.900112.2R71 A143 L225 Q239 V246 M247R71-E243 IonicContact CZ-OE2 3.5Å; R71-E243 IonicContact NH1-OE2 3.08Å; R71-E243 PolarHBondContact NH1-OE2 3.15Å; R71-E243 IonicContact NH2-OE2 3.07Å; R71-E243 PolarHBondContact NH2-OE2 3.23Å; A143-E243 HydrophobicContact CB-CG 4.45Å; L225-E243 HydrophobicContact CD1-CB 4.3Å; Q239-E243 PolarHBondContact O-N 3.26Å; E243-V246 PolarHBondContact O-N 3.1Å; E243-M247 WeakPolarHBondContact O-CB 3.26Å; E243-M247 WeakPolarHBondContact O-CG 3.48Å; E243-M247 PolarHBondContact O-N 3.35Å
244Y87.2Confident87Confident61 Ų6170.6 Ų70.624%0.23934%0.337CS..Hα-helixtrans-63.2-43.7176.1-178.9-110.4000113L225 M240 K241 R242 V246 M247 K248L225-Y244 VanDerWaalsContact CD2-CA 3.49Å; L225-Y244 HydrophobicContact CD2-CD2 3.86Å; L225-Y244 HydrophobicContact CD2-CG 4.3Å; L225-Y244 HydrophobicContact CG-CD2 4.49Å; M240-Y244 VanDerWaalsContact O-CB 3.3Å; M240-Y244 WeakPolarHBondContact O-CB 3.47Å; M240-Y244 PolarHBondContact O-N 3.34Å; K241-Y244 PolarHBondContact O-N 3.49Å; R242-Y244 VanDerWaalsContact C-N 3.27Å; R242-Y244 PolarHBondContact O-N 2.95Å; Y244-V246 VanDerWaalsContact C-N 3.3Å; Y244-V246 PolarHBondContact O-N 2.85Å; Y244-M247 PolarHBondContact O-N 3.33Å; Y244-K248 HydrophobicContact CD1-CD 4.38Å; Y244-K248 HydrophobicContact CE1-CD 4.06Å; Y244-K248 HydrophobicContact CE1-CG 4.41Å; Y244-K248 WeakPolarHBondContact O-CG 3.41Å; Y244-K248 PolarHBondContact O-N 3.21Å
245E86.6Confident87.2Confident85 Ų8569.4 Ų69.440%0.39733%0.325SS..Hα-helixtrans-65.7-33.6176.6-68.1-50.513400112.5K241 R242 K248K241-E245 WeakPolarHBondContact O-CG 3.46Å; K241-E245 PolarHBondContact O-N 2.85Å; K241-E245 VanDerWaalsContact O-N 3.12Å; R242-E245 PolarHBondContact O-N 2.83Å; E245-K248 IonicContact OE1-NZ 3.44Å; E245-K248 PolarHBondContact OE1-NZ 3.29Å; E245-K248 WeakPolarHBondContact OE2-CD 3.32Å; E245-K248 IonicContact OE2-NZ 2.78Å; E245-K248 PolarHBondContact OE2-NZ 2.8Å
246V84.2Confident87.5Confident55 Ų5564.5 Ų64.533%0.33330%0.3SS..Hα-helixtrans-74.1-42.5174.4-170.80000110.9R242 E243 Y244 K248 Q249R242-V246 WeakPolarHBondContact O-CG2 3.47Å; R242-V246 PolarHBondContact O-N 3.43Å; R242-V246 VanDerWaalsContact O-N 3.08Å; E243-V246 PolarHBondContact O-N 3.1Å; Y244-V246 VanDerWaalsContact C-N 3.3Å; Y244-V246 PolarHBondContact O-N 2.85Å; V246-K248 VanDerWaalsContact C-N 3.29Å; V246-K248 PolarHBondContact O-N 2.95Å; V246-Q249 WeakPolarHBondContact O-CB 3.45Å; V246-Q249 PolarHBondContact O-N 3.39Å
247M85.9Confident87.9Confident1 Ų158.5 Ų58.51%0.00528%0.278CS..Hα-helixtrans-59.1-40.1176.4-79.6-170.773.900111.6Y218 A221 I222 L225 E243 Y244 Q249 I250 I251Y218-M247 HydrophobicContact CD2-CE 3.8Å; Y218-M247 HydrophobicContact CE2-CE 3.49Å; Y218-M247 VanDerWaalsContact CE2-CE 3.49Å; Y218-M247 PolarHBondContact OH-O 2.78Å; A221-M247 HydrophobicContact CB-CE 3.52Å; I222-M247 HydrophobicContact CD1-CB 3.94Å; I222-M247 HydrophobicContact CD1-CE 3.52Å; I222-M247 HydrophobicContact CD1-SD 4.19Å; I222-M247 HydrophobicContact CG1-CE 3.81Å; L225-M247 HydrophobicContact CD2-CG 4.4Å; L225-M247 HydrophobicContact CD2-SD 3.51Å; L225-M247 VanDerWaalsContact CD2-SD 3.51Å; E243-M247 WeakPolarHBondContact O-CB 3.26Å; E243-M247 WeakPolarHBondContact O-CG 3.48Å; E243-M247 PolarHBondContact O-N 3.35Å; Y244-M247 PolarHBondContact O-N 3.33Å; M247-Q249 PolarHBondContact O-N 2.89Å; M247-I250 WeakPolarHBondContact O-CA 3.42Å; M247-I250 WeakPolarHBondContact O-CB 3.22Å; M247-I250 PolarHBondContact O-N 2.95Å; M247-I251 PolarHBondContact O-N 3.24Å
248K86.7Confident88.2Confident86 Ų8656.8 Ų56.837%0.37427%0.269SS..Hα-helixtrans-52.6-26.5173.2-84.6175.6169.9165.60114.4Y244 E245 V246 I251Y244-K248 HydrophobicContact CD1-CD 4.38Å; Y244-K248 HydrophobicContact CE1-CD 4.06Å; Y244-K248 HydrophobicContact CE1-CG 4.41Å; Y244-K248 WeakPolarHBondContact O-CG 3.41Å; Y244-K248 PolarHBondContact O-N 3.21Å; E245-K248 IonicContact OE1-NZ 3.44Å; E245-K248 PolarHBondContact OE1-NZ 3.29Å; E245-K248 WeakPolarHBondContact OE2-CD 3.32Å; E245-K248 IonicContact OE2-NZ 2.78Å; E245-K248 PolarHBondContact OE2-NZ 2.8Å; V246-K248 VanDerWaalsContact C-N 3.29Å; V246-K248 PolarHBondContact O-N 2.95Å; K248-I251 WeakPolarHBondContact O-CG2 3.42Å
249Q85.4Confident88.5Confident71 Ų7157.5 Ų57.533%0.33227%0.273SS..Hα-helixtrans-78.3-29.3176-59.3-176.75.700111.9V246 M247V246-Q249 WeakPolarHBondContact O-CB 3.45Å; V246-Q249 PolarHBondContact O-N 3.39Å; M247-Q249 PolarHBondContact O-N 2.89Å
250I87.7Confident88.7Confident3 Ų354 Ų542%0.01526%0.258CS..Hα-helixtrans-75.9-25.1178.3-50.4175000110.9R71 M136 Y218 M247 L252 I253 I254R71-I250 HydrophobicContact CG-CD1 4.37Å; M136-I250 HydrophobicContact CB-CG2 4.41Å; M136-I250 HydrophobicContact SD-CG2 4.46Å; Y218-I250 HydrophobicContact CE2-CB 4.04Å; Y218-I250 HydrophobicContact CE2-CG2 4.01Å; M247-I250 WeakPolarHBondContact O-CA 3.42Å; M247-I250 WeakPolarHBondContact O-CB 3.22Å; M247-I250 PolarHBondContact O-N 2.95Å; I250-L252 PolarHBondContact O-N 3.36Å; I250-I253 HydrophobicContact CG2-CG2 3.69Å; I250-I253 VanDerWaalsContact O-CG2 3.29Å; I250-I253 WeakPolarHBondContact O-CG2 3.35Å; I250-I253 PolarHBondContact O-N 3.41Å; I250-I254 HydrophobicContact CG2-CD1 3.58Å; I250-I254 HydrophobicContact CG2-CG1 4.11Å; I250-I254 PolarHBondContact O-N 2.86Å; I250-I254 VanDerWaalsContact O-N 3.13Å
251I90.9Very high89Confident97 Ų9753.8 Ų53.850%0.49726%0.257SS..Hα-helixtrans-54.9-31.6179-159.6167.3000112.3Y218 M247 K248 G255Y218-I251 HydrophobicContact CE1-CB 4.11Å; Y218-I251 HydrophobicContact CE1-CG1 3.98Å; Y218-I251 WeakPolarHBondContact OH-CA 3.43Å; Y218-I251 WeakPolarHBondContact OH-CB 3.35Å; Y218-I251 PolarHBondContact OH-N 3.48Å; Y218-I251 VanDerWaalsContact OH-N 3.13Å; M247-I251 PolarHBondContact O-N 3.24Å; K248-I251 WeakPolarHBondContact O-CG2 3.42Å; I251-G255 WeakPolarHBondContact O-CA 3.45Å; I251-G255 PolarHBondContact O-N 3.02Å
252L89.9Confident89.2Confident44 Ų4448.3 Ų48.323%0.2323%0.234CC..Hα-helixtrans-64.5-45.6176.7-175.667.7000111.3I250 N256 F298I250-L252 PolarHBondContact O-N 3.36Å; L252-N256 VanDerWaalsContact O-CB 3.23Å; L252-N256 WeakPolarHBondContact O-CB 3.35Å; L252-N256 PolarHBondContact O-N 3.46Å; L252-N256 PolarHBondContact O-OD1 3.07Å; L252-F298 HydrophobicContact CD2-CB 3.59Å; L252-F298 HydrophobicContact CD2-CD1 3.43Å; L252-F298 VanDerWaalsContact CD2-CD1 3.43Å; L252-F298 HydrophobicContact CD2-CD2 3.84Å; L252-F298 HydrophobicContact CD2-CE1 3.87Å; L252-F298 HydrophobicContact CD2-CE2 4.24Å; L252-F298 HydrophobicContact CD2-CG 3.36Å; L252-F298 HydrophobicContact CD2-CZ 4.2Å
253I91.2Very high89.5Confident3 Ų341.7 Ų41.72%0.01521%0.213CC..Hα-helixtrans-67.8-43-178.3-148.7176.9000111.3Y78 I133 M136 I250 S257 Y295Y78-I253 HydrophobicContact CD1-CD1 3.65Å; Y78-I253 HydrophobicContact CD2-CD1 3.4Å; Y78-I253 VanDerWaalsContact CD2-CD1 3.4Å; Y78-I253 HydrophobicContact CD2-CG1 4.14Å; Y78-I253 HydrophobicContact CE1-CD1 3.73Å; Y78-I253 HydrophobicContact CE1-CG1 4.35Å; Y78-I253 HydrophobicContact CE2-CD1 3.43Å; Y78-I253 VanDerWaalsContact CE2-CD1 3.43Å; Y78-I253 HydrophobicContact CE2-CG1 3.7Å; Y78-I253 HydrophobicContact CG-CD1 3.51Å; I133-I253 HydrophobicContact CG1-CD1 4.46Å; M136-I253 HydrophobicContact CE-CD1 3.69Å; M136-I253 HydrophobicContact CE-CG2 4.04Å; I250-I253 HydrophobicContact CG2-CG2 3.69Å; I250-I253 VanDerWaalsContact O-CG2 3.29Å; I250-I253 WeakPolarHBondContact O-CG2 3.35Å; I250-I253 PolarHBondContact O-N 3.41Å; I253-S257 VanDerWaalsContact O-CB 3.28Å; I253-S257 WeakPolarHBondContact O-CB 3.46Å; I253-S257 PolarHBondContact O-N 3.19Å; I253-Y295 HydrophobicContact CB-CD2 3.64Å; I253-Y295 HydrophobicContact CB-CE2 3.97Å; I253-Y295 HydrophobicContact CB-CG 3.99Å; I253-Y295 HydrophobicContact CD1-CD1 3.59Å; I253-Y295 HydrophobicContact CD1-CD2 4.13Å; I253-Y295 HydrophobicContact CD1-CE1 3.84Å; I253-Y295 HydrophobicContact CD1-CE2 4.33Å; I253-Y295 HydrophobicContact CD1-CG 3.74Å; I253-Y295 HydrophobicContact CG1-CD1 4.12Å; I253-Y295 HydrophobicContact CG1-CD2 3.94Å; I253-Y295 HydrophobicContact CG1-CE2 4.47Å; I253-Y295 HydrophobicContact CG1-CG 3.73Å
254I92Very high89.7Confident5 Ų539.3 Ų39.33%0.02620%0.203CC..Hα-helixtrans-74.2-43.6-177.1-69.9168.2000110.6I133 S137 T215 Y218 I250 N256 S257 F258I133-I254 HydrophobicContact CG2-CG1 3.73Å; S137-I254 WeakPolarHBondContact OG-CD1 3.26Å; T215-I254 HydrophobicContact CG2-CG2 4.49Å; Y218-I254 HydrophobicContact CD1-CB 4.45Å; Y218-I254 HydrophobicContact CD1-CD1 3.85Å; Y218-I254 HydrophobicContact CD1-CG2 4.13Å; Y218-I254 HydrophobicContact CD2-CD1 3.11Å; Y218-I254 HydrophobicContact CE1-CD1 4.32Å; Y218-I254 HydrophobicContact CE2-CD1 3.64Å; Y218-I254 HydrophobicContact CG-CD1 3.21Å; Y218-I254 HydrophobicContact CG-CG1 4.42Å; Y218-I254 HydrophobicContact CG-CG2 4.26Å; I250-I254 HydrophobicContact CG2-CD1 3.58Å; I250-I254 HydrophobicContact CG2-CG1 4.11Å; I250-I254 PolarHBondContact O-N 2.86Å; I250-I254 VanDerWaalsContact O-N 3.13Å; I254-N256 VanDerWaalsContact C-N 3.33Å; I254-N256 PolarHBondContact O-N 3.3Å; I254-S257 PolarHBondContact O-N 2.87Å; I254-F258 VanDerWaalsContact O-CB 3.29Å; I254-F258 WeakPolarHBondContact O-CB 3.47Å; I254-F258 PolarHBondContact O-N 3.18Å
255G92.4Very high89.8Confident26 Ų2636.6 Ų36.627%0.26819%0.192SC..Hα-helixtrans-60.1-44.5175.400000111.5I251 F258 L259I251-G255 WeakPolarHBondContact O-CA 3.45Å; I251-G255 PolarHBondContact O-N 3.02Å; G255-F258 PolarHBondContact O-N 3.36Å; G255-L259 WeakPolarHBondContact O-CB 3.43Å; G255-L259 VanDerWaalsContact O-CG 3.3Å; G255-L259 WeakPolarHBondContact O-CG 3.16Å; G255-L259 PolarHBondContact O-N 2.99Å
256N91.4Very high90Very high26 Ų2633.2 Ų33.214%0.13918%0.178CC..Hα-helixtrans-69.6-44.5177.5-69.22.1000112.9L252 I254 F258 L259 L260 N291 I294L252-N256 VanDerWaalsContact O-CB 3.23Å; L252-N256 WeakPolarHBondContact O-CB 3.35Å; L252-N256 PolarHBondContact O-N 3.46Å; L252-N256 PolarHBondContact O-OD1 3.07Å; I254-N256 VanDerWaalsContact C-N 3.33Å; I254-N256 PolarHBondContact O-N 3.3Å; N256-F258 PolarHBondContact O-N 2.94Å; N256-L259 PolarHBondContact O-N 2.95Å; N256-L260 HydrophobicContact CB-CD1 4.25Å; N256-L260 WeakPolarHBondContact O-CA 3.2Å; N256-L260 VanDerWaalsContact O-CB 3.22Å; N256-L260 WeakPolarHBondContact O-CB 3.49Å; N256-L260 PolarHBondContact O-N 3.48Å; N256-N291 WeakPolarHBondContact CB-OD1 3.35Å; N256-N291 PolarHBondContact ND2-OD1 3.19Å; N256-I294 WeakPolarHBondContact ND2-CG2 3.35Å
257S91.1Very high90.2Very high4 Ų434.4 Ų34.43%0.02818%0.182CC..Hα-helixtrans-61.9-34.8176.7178.70000111.4I133 I253 I254 E261 A262I133-S257 WeakPolarHBondContact CD1-OG 3.44Å; I253-S257 VanDerWaalsContact O-CB 3.28Å; I253-S257 WeakPolarHBondContact O-CB 3.46Å; I253-S257 PolarHBondContact O-N 3.19Å; I254-S257 PolarHBondContact O-N 2.87Å; S257-E261 CarbonylContact O-C 3.6Å; S257-E261 WeakPolarHBondContact O-CA 3.48Å; S257-E261 VanDerWaalsContact O-CB 3.26Å; S257-E261 WeakPolarHBondContact O-CB 3.46Å; S257-E261 PolarHBondContact O-N 3.4Å; S257-E261 PolarHBondContact OG-OE2 2.92Å; S257-A262 PolarHBondContact O-N 3.4Å
258F93Very high90.1Very high54 Ų5435.4 Ų35.424%0.23719%0.187CC..Iπ-helixtrans-65.3-55.4172.1-179.1-108.2000112.3Y212 T215 I254 G255 N256 A262 V263Y212-F258 AromaticContact CD1-CE2 3.89Å; Y212-F258 HydrophobicContact CD1-CE2 3.89Å; Y212-F258 AromaticContact CE1-CE2 3.63Å; Y212-F258 HydrophobicContact CE1-CE2 3.63Å; Y212-F258 HydrophobicContact CE1-CZ 4.23Å; Y212-F258 HydrophobicContact CG-CE2 4.46Å; Y212-F258 AromaticContact CZ-CE2 3.98Å; T215-F258 HydrophobicContact CG2-CB 4.36Å; T215-F258 HydrophobicContact CG2-CD2 4.06Å; T215-F258 HydrophobicContact CG2-CG 4.11Å; I254-F258 VanDerWaalsContact O-CB 3.29Å; I254-F258 WeakPolarHBondContact O-CB 3.47Å; I254-F258 PolarHBondContact O-N 3.18Å; G255-F258 PolarHBondContact O-N 3.36Å; N256-F258 PolarHBondContact O-N 2.94Å; F258-A262 HydrophobicContact CD2-CB 4.49Å; F258-V263 HydrophobicContact CD1-CG2 4.34Å; F258-V263 HydrophobicContact CD2-CG2 4.32Å; F258-V263 HydrophobicContact CE1-CG2 3.88Å; F258-V263 HydrophobicContact CE2-CG2 3.86Å; F258-V263 HydrophobicContact CZ-CG2 3.62Å; F258-V263 WeakPolarHBondContact O-CB 3.38Å; F258-V263 WeakPolarHBondContact O-CG2 3.43Å; F258-V263 PolarHBondContact O-N 3.32Å
259L92.1Very high90.1Very high107 Ų10731.5 Ų31.556%0.5617%0.17SC*.Iπ-helixtrans-76.5-32.1-170.8-67.6174.1000114.2G255 N256 P264G255-L259 WeakPolarHBondContact O-CB 3.43Å; G255-L259 VanDerWaalsContact O-CG 3.3Å; G255-L259 WeakPolarHBondContact O-CG 3.16Å; G255-L259 PolarHBondContact O-N 2.99Å; N256-L259 PolarHBondContact O-N 2.95Å; L259-P264 VanDerWaalsContact O-CD 3.3Å; L259-P264 WeakPolarHBondContact O-CD 3.3Å; L259-P264 WeakPolarHBondContact O-CG 3.29Å
260L90.7Very high90Very high41 Ų4130.9 Ų30.922%0.21517%0.174CC..Iπ-helixtrans-109.2-4.4-171.2-53.8-179.5000113.3N256 L287 Q288 N291 I294N256-L260 HydrophobicContact CB-CD1 4.25Å; N256-L260 WeakPolarHBondContact O-CA 3.2Å; N256-L260 VanDerWaalsContact O-CB 3.22Å; N256-L260 WeakPolarHBondContact O-CB 3.49Å; N256-L260 PolarHBondContact O-N 3.48Å; L260-L287 HydrophobicContact CB-CB 4.38Å; L260-L287 HydrophobicContact CD2-CB 4.39Å; L260-L287 HydrophobicContact CD2-CD2 4.47Å; L260-Q288 PolarHBondContact O-N 3.17Å; L260-N291 HydrophobicContact CB-CB 4.03Å; L260-N291 HydrophobicContact CD1-CB 3.86Å; L260-I294 HydrophobicContact CD1-CD1 4.28Å
261E90.4Very high89.6Confident8 Ų831.8 Ų31.84%0.03718%0.18CC..Iπ-helixtrans-134.6-64.7-179.7170.3-179.9-13900111.8S257 V263 P264 I265 Q288S257-E261 CarbonylContact O-C 3.6Å; S257-E261 WeakPolarHBondContact O-CA 3.48Å; S257-E261 VanDerWaalsContact O-CB 3.26Å; S257-E261 WeakPolarHBondContact O-CB 3.46Å; S257-E261 PolarHBondContact O-N 3.4Å; S257-E261 PolarHBondContact OG-OE2 2.92Å; E261-V263 PolarHBondContact O-N 3.22Å; E261-P264 WeakPolarHBondContact O-CD 3.48Å; E261-I265 HydrophobicContact CG-CD1 3.84Å; E261-I265 WeakPolarHBondContact O-CB 3.43Å; E261-I265 WeakPolarHBondContact O-CD1 3.48Å; E261-I265 WeakPolarHBondContact O-CG1 3.42Å; E261-I265 PolarHBondContact O-N 3.01Å; E261-Q288 HydrophobicContact CB-CG 4.27Å; E261-Q288 HydrophobicContact CG-CG 4.26Å; E261-Q288 PolarHBondContact OE1-NE2 3.46Å; E261-Q288 VanDerWaalsContact OE1-NE2 3.07Å
262A92.7Very high88.8Confident3 Ų329 Ų293%0.02517%0.169CC..Iπ-helixtrans-62.7-46.6-175.900000113Y212 S257 F258 S266Y212-A262 HydrophobicContact CD2-CB 4.26Å; Y212-A262 HydrophobicContact CE2-CB 4.22Å; S257-A262 PolarHBondContact O-N 3.4Å; F258-A262 HydrophobicContact CD2-CB 4.49Å; A262-S266 WeakPolarHBondContact O-CB 3.47Å; A262-S266 PolarHBondContact O-N 3.3Å; A262-S266 PolarHBondContact O-OG 3.39Å
263V91.3Very high88Confident39 Ų3933.2 Ų33.224%0.23619%0.186CC..Hα-helixtrans-65.6-51177.3167.50000111.3F258 E261 I265 S266 L267F258-V263 HydrophobicContact CD1-CG2 4.34Å; F258-V263 HydrophobicContact CD2-CG2 4.32Å; F258-V263 HydrophobicContact CE1-CG2 3.88Å; F258-V263 HydrophobicContact CE2-CG2 3.86Å; F258-V263 HydrophobicContact CZ-CG2 3.62Å; F258-V263 WeakPolarHBondContact O-CB 3.38Å; F258-V263 WeakPolarHBondContact O-CG2 3.43Å; F258-V263 PolarHBondContact O-N 3.32Å; E261-V263 PolarHBondContact O-N 3.22Å; V263-I265 PolarHBondContact O-N 2.95Å; V263-S266 WeakPolarHBondContact O-CB 3.37Å; V263-S266 PolarHBondContact O-N 3.01Å; V263-L267 HydrophobicContact CG1-CD1 4.09Å; V263-L267 HydrophobicContact CG1-CG 4.46Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.04Å
264P90Very high87.3Confident7 Ų739.6 Ų39.65%0.04522%0.217CC..Hα-helixtrans-59.3-43.2177.3-27.236.9000114.1L259 E261 S266 L267 E268 I284 L287L259-P264 VanDerWaalsContact O-CD 3.3Å; L259-P264 WeakPolarHBondContact O-CD 3.3Å; L259-P264 WeakPolarHBondContact O-CG 3.29Å; E261-P264 WeakPolarHBondContact O-CD 3.48Å; P264-S266 VanDerWaalsContact C-N 3.3Å; P264-S266 PolarHBondContact O-N 3.47Å; P264-L267 WeakPolarHBondContact O-CB 3.27Å; P264-L267 PolarHBondContact O-N 2.83Å; P264-L267 VanDerWaalsContact O-N 3.12Å; P264-E268 PolarHBondContact O-N 3.33Å; P264-I284 HydrophobicContact CB-CB 4.18Å; P264-I284 HydrophobicContact CB-CG1 4.15Å; P264-I284 HydrophobicContact CB-CG2 3.39Å; P264-L287 HydrophobicContact CG-CD1 4.22Å
265I89.8Confident86.1Confident3 Ų350.7 Ų50.72%0.01526%0.258CS..Hα-helixtrans-62.6-39.8175.8-65.3167.4000110.5Y204 L207 V208 E261 V263 L267 E268 L269 W285Y204-I265 HydrophobicContact CD1-CG2 4.07Å; L207-I265 HydrophobicContact CD1-CD1 4.4Å; V208-I265 HydrophobicContact CG2-CB 4.06Å; V208-I265 HydrophobicContact CG2-CG2 3.58Å; E261-I265 HydrophobicContact CG-CD1 3.84Å; E261-I265 WeakPolarHBondContact O-CB 3.43Å; E261-I265 WeakPolarHBondContact O-CD1 3.48Å; E261-I265 WeakPolarHBondContact O-CG1 3.42Å; E261-I265 PolarHBondContact O-N 3.01Å; V263-I265 PolarHBondContact O-N 2.95Å; I265-L267 VanDerWaalsContact C-N 3.3Å; I265-L267 PolarHBondContact O-N 3.11Å; I265-E268 PolarHBondContact O-N 2.98Å; I265-L269 HydrophobicContact CG2-CD1 4.19Å; I265-L269 HydrophobicContact CG2-CG 4.39Å; I265-L269 WeakPolarHBondContact O-CG 3.34Å; I265-L269 PolarHBondContact O-N 2.84Å; I265-W285 HydrophobicContact CD1-CZ3 4.5Å; I265-W285 HydrophobicContact CG1-CH2 4.21Å; I265-W285 HydrophobicContact CG1-CZ3 4.32Å
266S91.3Very high84.8Confident15 Ų1555.9 Ų55.911%0.10527%0.274CS..Hα-helixtrans-60.8-41.6174.7-56.30000111.8V208 Y212 A262 V263 P264 S270V208-S266 VanDerWaalsContact CG1-OG 3.32Å; V208-S266 WeakPolarHBondContact CG1-OG 3.41Å; Y212-S266 WeakPolarHBondContact CE2-OG 3.39Å; A262-S266 WeakPolarHBondContact O-CB 3.47Å; A262-S266 PolarHBondContact O-N 3.3Å; A262-S266 PolarHBondContact O-OG 3.39Å; V263-S266 WeakPolarHBondContact O-CB 3.37Å; V263-S266 PolarHBondContact O-N 3.01Å; P264-S266 VanDerWaalsContact C-N 3.3Å; P264-S266 PolarHBondContact O-N 3.47Å; S266-S270 VanDerWaalsContact O-CB 3.31Å; S266-S270 WeakPolarHBondContact O-CB 3.33Å; S266-S270 PolarHBondContact O-N 3.13Å; S266-S270 PolarHBondContact O-OG 3.21Å
267L87.8Confident83.4Confident79 Ų7959.8 Ų59.841%0.41430%0.295SS..Hα-helixtrans-65.6-42176.8-71.8172.1000111.2V263 P264 I265 S270 C271 I284V263-L267 HydrophobicContact CG1-CD1 4.09Å; V263-L267 HydrophobicContact CG1-CG 4.46Å; V263-L267 WeakPolarHBondContact O-CG 3.23Å; V263-L267 PolarHBondContact O-N 3.04Å; P264-L267 WeakPolarHBondContact O-CB 3.27Å; P264-L267 PolarHBondContact O-N 2.83Å; P264-L267 VanDerWaalsContact O-N 3.12Å; I265-L267 VanDerWaalsContact C-N 3.3Å; I265-L267 PolarHBondContact O-N 3.11Å; L267-S270 PolarHBondContact O-N 2.98Å; L267-C271 VanDerWaalsContact O-CB 3.24Å; L267-C271 WeakPolarHBondContact O-CB 3.33Å; L267-C271 PolarHBondContact O-N 3.42Å; L267-C271 PolarHBondContact O-SG 3.08Å; L267-I284 HydrophobicContact CB-CD1 4.11Å
268E83.7Confident82.1Confident23 Ų2364 Ų6411%0.10732%0.322CS..Hα-helixtrans-63.7-45.4176.7176.9-179.2-173.100112.5P264 I265 S270 C271 S272 A281 I284 W285P264-E268 PolarHBondContact O-N 3.33Å; I265-E268 PolarHBondContact O-N 2.98Å; E268-S270 VanDerWaalsContact C-N 3.32Å; E268-S270 PolarHBondContact O-N 3.36Å; E268-C271 PolarHBondContact O-N 2.97Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 3.29Å; E268-S272 PolarHBondContact O-OG 3.33Å; E268-S272 VanDerWaalsContact O-OG 3.07Å; E268-A281 HydrophobicContact CG-CB 4Å; E268-I284 HydrophobicContact CB-CD1 4.24Å; E268-I284 HydrophobicContact CB-CG2 4.44Å; E268-W285 VanDerWaalsContact CD-CZ2 3.48Å; E268-W285 WeakPolarHBondContact OE1-CZ2 3.17Å; E268-W285 PolarHBondContact OE1-NE1 3.21Å; E268-W285 WeakPolarHBondContact OE2-CZ2 3.23Å; E268-W285 PolarHBondContact OE2-NE1 3.3Å
269L86.5Confident80.7Confident3 Ų363.7 Ų63.72%0.01633%0.329CS..Hα-helixtrans-60.6-46.1175.6-70.5175.3000110.1F200 W205 V208 I265 C271 S272 F273F200-L269 HydrophobicContact CE1-CD2 4.05Å; W205-L269 HydrophobicContact CD2-CD1 3.92Å; W205-L269 HydrophobicContact CE3-CD1 4.31Å; W205-L269 HydrophobicContact CG-CD1 4.22Å; W205-L269 HydrophobicContact CZ2-CB 4.42Å; W205-L269 HydrophobicContact CZ2-CD1 4.34Å; V208-L269 HydrophobicContact CG2-CD1 4.12Å; I265-L269 HydrophobicContact CG2-CD1 4.19Å; I265-L269 HydrophobicContact CG2-CG 4.39Å; I265-L269 WeakPolarHBondContact O-CG 3.34Å; I265-L269 PolarHBondContact O-N 2.84Å; L269-C271 PolarHBondContact O-N 3.12Å; L269-S272 WeakPolarHBondContact O-CB 3.49Å; L269-S272 PolarHBondContact O-N 3.33Å; L269-F273 WeakPolarHBondContact O-CD2 3.46Å; L269-F273 PolarHBondContact O-N 3.33Å
270S83.9Confident79.5Confident59 Ų5963.9 Ų63.941%0.41333%0.326SS..Hα-helixtrans-62.6-43177-56.80000112.2S266 L267 E268 S272 F273 M274S266-S270 VanDerWaalsContact O-CB 3.31Å; S266-S270 WeakPolarHBondContact O-CB 3.33Å; S266-S270 PolarHBondContact O-N 3.13Å; S266-S270 PolarHBondContact O-OG 3.21Å; L267-S270 PolarHBondContact O-N 2.98Å; E268-S270 VanDerWaalsContact C-N 3.32Å; E268-S270 PolarHBondContact O-N 3.36Å; S270-S272 VanDerWaalsContact C-N 3.32Å; S270-S272 PolarHBondContact O-N 3.18Å; S270-F273 PolarHBondContact O-N 2.9Å; S270-M274 WeakPolarHBondContact O-CG 3.48Å; S270-M274 PolarHBondContact O-N 3.44Å; S270-M274 VanDerWaalsContact O-N 3.08Å
271C80Confident78.5Confident22 Ų2262.8 Ų62.815%0.14932%0.323CS..Hα-helixtrans-64.7-36.1177.3-74.70000112.3L267 E268 L269 F273 M274 R275 F276L267-C271 VanDerWaalsContact O-CB 3.24Å; L267-C271 WeakPolarHBondContact O-CB 3.33Å; L267-C271 PolarHBondContact O-N 3.42Å; L267-C271 PolarHBondContact O-SG 3.08Å; E268-C271 PolarHBondContact O-N 2.97Å; L269-C271 PolarHBondContact O-N 3.12Å; C271-F273 VanDerWaalsContact C-N 3.3Å; C271-F273 PolarHBondContact O-N 3.21Å; C271-M274 CarbonylContact O-C 3.51Å; C271-M274 PolarHBondContact O-N 3.45Å; C271-R275 PolarHBondContact O-N 2.98Å; C271-F276 HydrophobicContact CB-CB 3.99Å; C271-F276 HydrophobicContact CB-CD2 4.37Å; C271-F276 PolarHBondContact O-N 2.93Å; C271-F276 VanDerWaalsContact O-N 3.15Å
272S73.1Confident77.5Confident38 Ų3866.4 Ų66.427%0.26634%0.342SS..Hα-helixtrans-60.2-40.6173.8-710000111.9R192 E268 L269 S270R192-S272 PolarHBondContact NH1-OG 2.86Å; R192-S272 VanDerWaalsContact NH2-CB 3.3Å; R192-S272 PolarHBondContact NH2-OG 3.47Å; R192-S272 VanDerWaalsContact NH2-OG 3.07Å; E268-S272 WeakPolarHBondContact O-CB 3.44Å; E268-S272 PolarHBondContact O-N 3.29Å; E268-S272 PolarHBondContact O-OG 3.33Å; E268-S272 VanDerWaalsContact O-OG 3.07Å; L269-S272 WeakPolarHBondContact O-CB 3.49Å; L269-S272 PolarHBondContact O-N 3.33Å; S270-S272 VanDerWaalsContact C-N 3.32Å; S270-S272 PolarHBondContact O-N 3.18Å
273F74.5Confident76.7Confident133 Ų13369 Ų6958%0.58336%0.36SS*.Hα-helixtrans-69.5-34.3175.5-69.9-67.8000112.4L201 W205 L269 S270 C271L201-F273 HydrophobicContact CD2-CZ 4.37Å; W205-F273 HydrophobicContact CZ2-CE2 4.27Å; L269-F273 WeakPolarHBondContact O-CD2 3.46Å; L269-F273 PolarHBondContact O-N 3.33Å; S270-F273 PolarHBondContact O-N 2.9Å; C271-F273 VanDerWaalsContact C-N 3.3Å; C271-F273 PolarHBondContact O-N 3.21Å
274M74.8Confident76.1Confident136 Ų13667.6 Ų67.667%0.6735%0.351SS*.Hα-helixtrans-88.81-177.5-63-67.8-82.300114.3S270 C271 F276S270-M274 WeakPolarHBondContact O-CG 3.48Å; S270-M274 PolarHBondContact O-N 3.44Å; S270-M274 VanDerWaalsContact O-N 3.08Å; C271-M274 CarbonylContact O-C 3.51Å; C271-M274 PolarHBondContact O-N 3.45Å; M274-F276 VanDerWaalsContact C-N 3.32Å; M274-F276 HydrophobicContact CB-CD2 3.54Å; M274-F276 HydrophobicContact CB-CE2 3.61Å; M274-F276 HydrophobicContact CG-CE2 4.32Å; M274-F276 PolarHBondContact O-N 3.42Å
275R66.9Low75.8Confident238 Ų23869.2 Ų69.290%0.89836%0.356SS*.THydrogen-bonded Turntrans56.536.5-178-57.6-179.4176.8166.7-1.2114.5C271C271-R275 PolarHBondContact O-N 2.98Å
276F64.9Low75.7Confident136 Ų13670.7 Ų70.760%0.59636%0.364SS*.  trans-70.7164.6174.3-83-73.2000112.9C271 M274C271-F276 HydrophobicContact CB-CB 3.99Å; C271-F276 HydrophobicContact CB-CD2 4.37Å; C271-F276 PolarHBondContact O-N 2.93Å; C271-F276 VanDerWaalsContact O-N 3.15Å; M274-F276 VanDerWaalsContact C-N 3.32Å; M274-F276 HydrophobicContact CB-CD2 3.54Å; M274-F276 HydrophobicContact CB-CE2 3.61Å; M274-F276 HydrophobicContact CG-CE2 4.32Å; M274-F276 PolarHBondContact O-N 3.42Å
277N63.1Low75.5Confident108 Ų10873.6 Ų73.658%0.57838%0.378SS*.  trans-55.5125.3-176.6-174.7-25.5000112.1A279 F280N277-A279 PolarHBondContact O-N 3.27Å; N277-A279 VanDerWaalsContact O-N 3.16Å; N277-A279 VanDerWaalsContact OD1-CB 3.29Å; N277-A279 WeakPolarHBondContact OD1-CB 3.36Å; N277-A279 PolarHBondContact OD1-N 3.32Å; N277-F280 WeakPolarHBondContact O-CB 3.08Å; N277-F280 PolarHBondContact O-N 3.08Å; N277-F280 VanDerWaalsContact O-N 3.12Å
278P63.4Low75.5Confident92 Ų9270 Ų7060%0.59736%0.359SS*.Hα-helixtrans-60.7-23.8-179.424.9-35.5000114.1F280 A281 N282P278-F280 PolarHBondContact O-N 3.34Å; P278-A281 PolarHBondContact O-N 2.85Å; P278-N282 PolarHBondContact O-N 2.78Å; P278-N282 VanDerWaalsContact O-N 3.15Å
279A64.6Low75.9Confident47 Ų4768.9 Ų68.939%0.38835%0.354SS..Hα-helixtrans-61.6-31.4176.600000112.7N277 S283N277-A279 PolarHBondContact O-N 3.27Å; N277-A279 VanDerWaalsContact O-N 3.16Å; N277-A279 VanDerWaalsContact OD1-CB 3.29Å; N277-A279 WeakPolarHBondContact OD1-CB 3.36Å; N277-A279 PolarHBondContact OD1-N 3.32Å; A279-S283 PolarHBondContact O-N 3.07Å; A279-S283 PolarHBondContact O-OG 3.07Å; A279-S283 VanDerWaalsContact O-OG 3.12Å
280F67.1Low76.1Confident112 Ų11272.4 Ų72.449%0.49137%0.372SS..Hα-helixtrans-68.6-43.8176.7-175.1-104.5000111.4N277 P278 N282 S283 I284N277-F280 WeakPolarHBondContact O-CB 3.08Å; N277-F280 PolarHBondContact O-N 3.08Å; N277-F280 VanDerWaalsContact O-N 3.12Å; P278-F280 PolarHBondContact O-N 3.34Å; F280-N282 VanDerWaalsContact C-N 3.34Å; F280-N282 PolarHBondContact O-N 2.89Å; F280-S283 PolarHBondContact O-N 3.5Å; F280-I284 HydrophobicContact CD1-CD1 3.87Å; F280-I284 HydrophobicContact CE1-CD1 3.62Å; F280-I284 HydrophobicContact CE1-CG1 4.46Å; F280-I284 HydrophobicContact CZ-CD1 4.34Å; F280-I284 PolarHBondContact O-N 3.33Å
281A68.9Low76.5Confident18 Ų1869.8 Ų69.815%0.14935%0.353CS..Hα-helixtrans-60.6-41.117600000112.1E268 P278 S283 I284E268-A281 HydrophobicContact CG-CB 4Å; P278-A281 PolarHBondContact O-N 2.85Å; A281-S283 VanDerWaalsContact C-N 3.29Å; A281-S283 PolarHBondContact O-N 3.08Å; A281-I284 WeakPolarHBondContact O-CB 3.48Å; A281-I284 PolarHBondContact O-N 2.63Å
282N69.8Low77.2Confident84 Ų8468.8 Ų68.845%0.44935%0.347SS..Hα-helixtrans-68.6-26.2179.1-71.4-26.6000113.9P278 F280P278-N282 PolarHBondContact O-N 2.78Å; P278-N282 VanDerWaalsContact O-N 3.15Å; F280-N282 VanDerWaalsContact C-N 3.34Å; F280-N282 PolarHBondContact O-N 2.89Å
283S75.9Confident78.2Confident56 Ų5667.3 Ų67.339%0.39234%0.336SS..Hα-helixtrans-79.2-26176.3-59.80000112.2R40 A279 F280 A281 L286R40-S283 PolarHBondContact NH1-OG 3.37Å; A279-S283 PolarHBondContact O-N 3.07Å; A279-S283 PolarHBondContact O-OG 3.07Å; A279-S283 VanDerWaalsContact O-OG 3.12Å; F280-S283 PolarHBondContact O-N 3.5Å; A281-S283 VanDerWaalsContact C-N 3.29Å; A281-S283 PolarHBondContact O-N 3.08Å; S283-L286 VanDerWaalsContact O-CB 3.29Å; S283-L286 WeakPolarHBondContact O-CB 3.44Å; S283-L286 PolarHBondContact O-N 3.09Å
284I79Confident79.1Confident11 Ų1163.9 Ų63.96%0.05632%0.323CS..Hα-helixtrans-60.6-46.5174-83.3164.3000111.2P264 L267 E268 F280 A281 L286 L287P264-I284 HydrophobicContact CB-CB 4.18Å; P264-I284 HydrophobicContact CB-CG1 4.15Å; P264-I284 HydrophobicContact CB-CG2 3.39Å; L267-I284 HydrophobicContact CB-CD1 4.11Å; E268-I284 HydrophobicContact CB-CD1 4.24Å; E268-I284 HydrophobicContact CB-CG2 4.44Å; F280-I284 HydrophobicContact CD1-CD1 3.87Å; F280-I284 HydrophobicContact CE1-CD1 3.62Å; F280-I284 HydrophobicContact CE1-CG1 4.46Å; F280-I284 HydrophobicContact CZ-CD1 4.34Å; F280-I284 PolarHBondContact O-N 3.33Å; A281-I284 WeakPolarHBondContact O-CB 3.48Å; A281-I284 PolarHBondContact O-N 2.63Å; I284-L286 PolarHBondContact O-N 3.13Å; I284-L286 VanDerWaalsContact O-N 3.15Å; I284-L287 WeakPolarHBondContact O-CB 3.48Å; I284-L287 PolarHBondContact O-N 2.95Å; I284-L287 VanDerWaalsContact O-N 3.1Å
285W83Confident79.9Confident40 Ų4057.6 Ų57.615%0.15229%0.292CS..Hα-helixtrans-59.9-27.1179.9-69.3108.8000113.7F44 Y204 I265 E268 L287 Q288 A289F44-W285 HydrophobicContact CE1-CB 4.14Å; F44-W285 WeakPolarHBondContact CE1-O 3.42Å; F44-W285 HydrophobicContact CZ-CB 3.83Å; Y204-W285 HydrophobicContact CD1-CH2 4.06Å; Y204-W285 AromaticContact CE1-CH2 3.32Å; Y204-W285 HydrophobicContact CE1-CH2 3.32Å; Y204-W285 HydrophobicContact CE1-CZ2 4.07Å; Y204-W285 HydrophobicContact CE1-CZ3 4.21Å; Y204-W285 AromaticContact CZ-CH2 3.79Å; I265-W285 HydrophobicContact CD1-CZ3 4.5Å; I265-W285 HydrophobicContact CG1-CH2 4.21Å; I265-W285 HydrophobicContact CG1-CZ3 4.32Å; E268-W285 VanDerWaalsContact CD-CZ2 3.48Å; E268-W285 WeakPolarHBondContact OE1-CZ2 3.17Å; E268-W285 PolarHBondContact OE1-NE1 3.21Å; E268-W285 WeakPolarHBondContact OE2-CZ2 3.23Å; E268-W285 PolarHBondContact OE2-NE1 3.3Å; W285-L287 VanDerWaalsContact C-N 3.29Å; W285-L287 PolarHBondContact O-N 3.32Å; W285-Q288 PolarHBondContact O-N 2.97Å; W285-A289 PolarHBondContact O-N 3.22Å
286L86.8Confident81.2Confident35 Ų3546.2 Ų46.218%0.18325%0.249CC..Hα-helixtrans-63.3-37.5178.3-162.470.4000112I43 F44 S283 I284 Q288 A289 I290I43-L286 HydrophobicContact CB-CD1 3.86Å; I43-L286 HydrophobicContact CD1-CD2 4.39Å; I43-L286 HydrophobicContact CG2-CD1 3.43Å; I43-L286 VanDerWaalsContact CG2-CD1 3.43Å; I43-L286 HydrophobicContact CG2-CD2 4.3Å; I43-L286 HydrophobicContact CG2-CG 4.08Å; F44-L286 HydrophobicContact CD1-CD1 4.35Å; F44-L286 HydrophobicContact CD2-CD1 4.13Å; F44-L286 HydrophobicContact CE1-CD1 4.17Å; F44-L286 HydrophobicContact CE2-CD1 3.94Å; F44-L286 HydrophobicContact CG-CD1 4.33Å; F44-L286 HydrophobicContact CZ-CB 4.24Å; F44-L286 HydrophobicContact CZ-CD1 3.95Å; S283-L286 VanDerWaalsContact O-CB 3.29Å; S283-L286 WeakPolarHBondContact O-CB 3.44Å; S283-L286 PolarHBondContact O-N 3.09Å; I284-L286 PolarHBondContact O-N 3.13Å; I284-L286 VanDerWaalsContact O-N 3.15Å; L286-Q288 VanDerWaalsContact C-N 3.31Å; L286-Q288 PolarHBondContact O-N 3.35Å; L286-A289 PolarHBondContact O-N 2.77Å; L286-I290 HydrophobicContact CG-CD1 4.2Å; L286-I290 WeakPolarHBondContact O-CG1 3.29Å; L286-I290 PolarHBondContact O-N 3.18Å; L286-I290 VanDerWaalsContact O-N 3.11Å
287L87.2Confident82.6Confident75 Ų7543.2 Ų43.239%0.39324%0.238SC..Hα-helixtrans-63.4-40.6178.9-63.4176.5000111L260 P264 I284 W285 N291L260-L287 HydrophobicContact CB-CB 4.38Å; L260-L287 HydrophobicContact CD2-CB 4.39Å; L260-L287 HydrophobicContact CD2-CD2 4.47Å; P264-L287 HydrophobicContact CG-CD1 4.22Å; I284-L287 WeakPolarHBondContact O-CB 3.48Å; I284-L287 PolarHBondContact O-N 2.95Å; I284-L287 VanDerWaalsContact O-N 3.1Å; W285-L287 VanDerWaalsContact C-N 3.29Å; W285-L287 PolarHBondContact O-N 3.32Å; L287-N291 VanDerWaalsContact O-CB 3.3Å; L287-N291 WeakPolarHBondContact O-CB 3.16Å; L287-N291 PolarHBondContact O-N 3.43Å
288Q89.1Confident84Confident4 Ų441 Ų412%0.01922%0.224CC..Hα-helixtrans-64.2-47.2177.2-165.9-169.712.200110.7Y89 D126 L260 E261 W285 L286 I290 N291 L292Y89-Q288 PolarHBondContact OH-OE1 3.19Å; D126-Q288 PolarHBondContact OD1-NE2 3.45Å; L260-Q288 PolarHBondContact O-N 3.17Å; E261-Q288 HydrophobicContact CB-CG 4.27Å; E261-Q288 HydrophobicContact CG-CG 4.26Å; E261-Q288 PolarHBondContact OE1-NE2 3.46Å; E261-Q288 VanDerWaalsContact OE1-NE2 3.07Å; W285-Q288 PolarHBondContact O-N 2.97Å; L286-Q288 VanDerWaalsContact C-N 3.31Å; L286-Q288 PolarHBondContact O-N 3.35Å; Q288-I290 PolarHBondContact O-N 2.92Å; Q288-N291 WeakPolarHBondContact O-CB 3.3Å; Q288-N291 PolarHBondContact O-N 2.97Å; Q288-N291 VanDerWaalsContact O-N 3.09Å; Q288-L292 WeakPolarHBondContact O-CG 3.4Å; Q288-L292 PolarHBondContact O-N 2.96Å
289A92Very high85.3Confident0 Ų039 Ų390%021%0.205CC..Hα-helixtrans-59.2-44.3-179.500000112.5F44 Y89 W285 L286 N291F44-A289 HydrophobicContact CD1-CB 3.59Å; F44-A289 HydrophobicContact CE1-CB 3.79Å; Y89-A289 HydrophobicContact CD2-CB 4.18Å; Y89-A289 HydrophobicContact CE1-CB 4.15Å; Y89-A289 HydrophobicContact CE2-CB 3.77Å; W285-A289 PolarHBondContact O-N 3.22Å; L286-A289 PolarHBondContact O-N 2.77Å; A289-N291 VanDerWaalsContact C-N 3.32Å; A289-N291 PolarHBondContact O-N 2.81Å
290I90.2Very high86.5Confident76 Ų7638.2 Ų38.239%0.3919%0.193SC..Hα-helixtrans-64.8-40.1176.8-65.9167.8000110.5L286 Q288 L292 S293 I294L286-I290 HydrophobicContact CG-CD1 4.2Å; L286-I290 WeakPolarHBondContact O-CG1 3.29Å; L286-I290 PolarHBondContact O-N 3.18Å; L286-I290 VanDerWaalsContact O-N 3.11Å; Q288-I290 PolarHBondContact O-N 2.92Å; I290-L292 VanDerWaalsContact C-N 3.28Å; I290-L292 PolarHBondContact O-N 3.21Å; I290-S293 PolarHBondContact O-N 3.41Å; I290-I294 HydrophobicContact CG2-CD1 4.44Å
291N92.6Very high87.6Confident4 Ų436.9 Ų36.92%0.02119%0.191CC..Hα-helixtrans-59.3-35.3-177.3-177.232.7000113.6N256 L260 L287 Q288 A289 S293 I294N256-N291 WeakPolarHBondContact CB-OD1 3.35Å; N256-N291 PolarHBondContact ND2-OD1 3.19Å; L260-N291 HydrophobicContact CB-CB 4.03Å; L260-N291 HydrophobicContact CD1-CB 3.86Å; L287-N291 VanDerWaalsContact O-CB 3.3Å; L287-N291 WeakPolarHBondContact O-CB 3.16Å; L287-N291 PolarHBondContact O-N 3.43Å; Q288-N291 WeakPolarHBondContact O-CB 3.3Å; Q288-N291 PolarHBondContact O-N 2.97Å; Q288-N291 VanDerWaalsContact O-N 3.09Å; A289-N291 VanDerWaalsContact C-N 3.32Å; A289-N291 PolarHBondContact O-N 2.81Å; N291-S293 PolarHBondContact O-N 2.98Å; N291-I294 PolarHBondContact O-N 3.07Å
292L93.5Very high88.5Confident2 Ų240.7 Ų40.71%0.0120%0.204CC..Hα-helixtrans-53.9-28.2-175-63.9-175.2000114.6A51 N55 L85 Y89 Q288 I290A51-L292 HydrophobicContact CB-CB 3.78Å; A51-L292 HydrophobicContact CB-CD1 4.21Å; N55-L292 PolarHBondContact ND2-O 2.86Å; L85-L292 HydrophobicContact CB-CD1 3.53Å; L85-L292 HydrophobicContact CD1-CD1 4.04Å; L85-L292 HydrophobicContact CD1-CD2 3.67Å; L85-L292 HydrophobicContact CG-CD1 4.43Å; Y89-L292 HydrophobicContact CD2-CD1 4.11Å; Y89-L292 HydrophobicContact CE2-CD1 3.65Å; Q288-L292 WeakPolarHBondContact O-CG 3.4Å; Q288-L292 PolarHBondContact O-N 2.96Å; I290-L292 VanDerWaalsContact C-N 3.28Å; I290-L292 PolarHBondContact O-N 3.21Å
293S94.8Very high89.2Confident6 Ų639.4 Ų39.44%0.04220%0.195CC..Hα-helixtrans-94.3-24.6-177.6-590000113.8L50 A51 I290 N291 Y295 A296 I297L50-S293 WeakPolarHBondContact CB-OG 3.12Å; A51-S293 WeakPolarHBondContact CA-OG 3.27Å; A51-S293 PolarHBondContact N-OG 3.41Å; I290-S293 PolarHBondContact O-N 3.41Å; N291-S293 PolarHBondContact O-N 2.98Å; S293-Y295 PolarHBondContact O-N 2.94Å; S293-A296 PolarHBondContact O-N 3.11Å; S293-I297 WeakPolarHBondContact O-CB 3.21Å; S293-I297 VanDerWaalsContact O-CG1 3.28Å; S293-I297 WeakPolarHBondContact O-CG1 3.45Å; S293-I297 PolarHBondContact O-N 3.18Å
294I93.8Very high89.5Confident61 Ų6141.2 Ų41.231%0.31321%0.206SC..Hα-helixtrans-59.6-50.7-166.7-62.2177.4000110.9N256 L260 I290 N291 A296 F298N256-I294 WeakPolarHBondContact ND2-CG2 3.35Å; L260-I294 HydrophobicContact CD1-CD1 4.28Å; I290-I294 HydrophobicContact CG2-CD1 4.44Å; N291-I294 PolarHBondContact O-N 3.07Å; I294-A296 PolarHBondContact O-N 3.15Å; I294-F298 WeakPolarHBondContact O-CB 3.34Å; I294-F298 PolarHBondContact O-N 3.13Å
295Y92.1Very high89.6Confident4 Ų444.5 Ų44.52%0.01623%0.23CC..Hα-helixtrans-64.2-42.7-178.4175.6-100.9000112.2L58 I75 Y78 I253 S293 F298 R299L58-Y295 HydrophobicContact CD2-CD1 4.35Å; L58-Y295 HydrophobicContact CD2-CE1 4.17Å; I75-Y295 WeakPolarHBondContact CD1-OH 3.06Å; I75-Y295 HydrophobicContact CG2-CE1 3.75Å; Y78-Y295 HydrophobicContact CD1-CD1 4.16Å; Y78-Y295 AromaticContact CE1-CD1 3.9Å; Y78-Y295 HydrophobicContact CE1-CD1 3.9Å; I253-Y295 HydrophobicContact CB-CD2 3.64Å; I253-Y295 HydrophobicContact CB-CE2 3.97Å; I253-Y295 HydrophobicContact CB-CG 3.99Å; I253-Y295 HydrophobicContact CD1-CD1 3.59Å; I253-Y295 HydrophobicContact CD1-CD2 4.13Å; I253-Y295 HydrophobicContact CD1-CE1 3.84Å; I253-Y295 HydrophobicContact CD1-CE2 4.33Å; I253-Y295 HydrophobicContact CD1-CG 3.74Å; I253-Y295 HydrophobicContact CG1-CD1 4.12Å; I253-Y295 HydrophobicContact CG1-CD2 3.94Å; I253-Y295 HydrophobicContact CG1-CE2 4.47Å; I253-Y295 HydrophobicContact CG1-CG 3.73Å; S293-Y295 PolarHBondContact O-N 2.94Å; Y295-F298 PolarHBondContact O-N 2.95Å; Y295-R299 WeakPolarHBondContact O-CB 3.22Å; Y295-R299 PolarHBondContact O-N 3.27Å
296A94.2Very high89.4Confident0 Ų043.8 Ų43.80%023%0.23CC..Hα-helixtrans-63.2-47.6-179.900000111.7A54 N55 L58 S293 I294 F298 R299 I300A54-A296 HydrophobicContact CB-CB 3.88Å; N55-A296 WeakPolarHBondContact OD1-CB 3.38Å; L58-A296 HydrophobicContact CB-CB 4.23Å; L58-A296 HydrophobicContact CD2-CB 4.02Å; S293-A296 PolarHBondContact O-N 3.11Å; I294-A296 PolarHBondContact O-N 3.15Å; A296-F298 PolarHBondContact O-N 3.42Å; A296-R299 PolarHBondContact O-N 3.46Å; A296-I300 WeakPolarHBondContact O-CB 3.3Å; A296-I300 WeakPolarHBondContact O-CD1 3.24Å; A296-I300 WeakPolarHBondContact O-CG1 3.41Å; A296-I300 PolarHBondContact O-N 3.41Å
297I94.2Very high89.2Confident72 Ų7246.1 Ų46.137%0.36924%0.24SC..Hα-helixtrans-57.9-49.6175.7-67.1167.8000110.1A54 S293 R299 I300 L301A54-I297 HydrophobicContact CB-CG1 3.95Å; S293-I297 WeakPolarHBondContact O-CB 3.21Å; S293-I297 VanDerWaalsContact O-CG1 3.28Å; S293-I297 WeakPolarHBondContact O-CG1 3.45Å; S293-I297 PolarHBondContact O-N 3.18Å; I297-R299 VanDerWaalsContact C-N 3.33Å; I297-R299 PolarHBondContact O-N 3.45Å; I297-I300 PolarHBondContact O-N 2.98Å; I297-L301 HydrophobicContact CG2-CD1 3.78Å; I297-L301 HydrophobicContact CG2-CG 4.28Å; I297-L301 WeakPolarHBondContact O-CB 3.28Å; I297-L301 VanDerWaalsContact O-CG 3.26Å; I297-L301 WeakPolarHBondContact O-CG 3.43Å; I297-L301 PolarHBondContact O-N 3.17Å
298F92.2Very high88.9Confident62 Ų6245.5 Ų45.527%0.27225%0.246SC..Hα-helixtrans-57.3-44.3178.6173.4-100000112.8L252 I294 Y295 A296 L301 K302L252-F298 HydrophobicContact CD2-CB 3.59Å; L252-F298 HydrophobicContact CD2-CD1 3.43Å; L252-F298 VanDerWaalsContact CD2-CD1 3.43Å; L252-F298 HydrophobicContact CD2-CD2 3.84Å; L252-F298 HydrophobicContact CD2-CE1 3.87Å; L252-F298 HydrophobicContact CD2-CE2 4.24Å; L252-F298 HydrophobicContact CD2-CG 3.36Å; L252-F298 HydrophobicContact CD2-CZ 4.2Å; I294-F298 WeakPolarHBondContact O-CB 3.34Å; I294-F298 PolarHBondContact O-N 3.13Å; Y295-F298 PolarHBondContact O-N 2.95Å; A296-F298 PolarHBondContact O-N 3.42Å; F298-L301 PolarHBondContact O-N 3.37Å; F298-K302 HydrophobicContact CD1-CD 4.39Å; F298-K302 HydrophobicContact CE1-CD 3.79Å; F298-K302 HydrophobicContact CE2-CD 4.04Å; F298-K302 VanDerWaalsContact CE2-CE 3.42Å; F298-K302 HydrophobicContact CZ-CD 3.64Å; F298-K302 PolarHBondContact O-N 3.46Å
299R89.5Confident88.4Confident51 Ų5152.6 Ų52.619%0.19227%0.274CS..Hα-helixtrans-68.5-39.6-179.5-171.5162.4-174.7-135.47.2112L58 I62 N72 Y295 A296 I297 K302 H303L58-R299 HydrophobicContact CD1-CB 4.18Å; L58-R299 HydrophobicContact CD1-CG 3.87Å; I62-R299 VanDerWaalsContact CD1-NH1 3.28Å; I62-R299 VanDerWaalsContact CG1-NH1 3.33Å; N72-R299 PolarHBondContact OD1-NH2 2.67Å; Y295-R299 WeakPolarHBondContact O-CB 3.22Å; Y295-R299 PolarHBondContact O-N 3.27Å; A296-R299 PolarHBondContact O-N 3.46Å; I297-R299 VanDerWaalsContact C-N 3.33Å; I297-R299 PolarHBondContact O-N 3.45Å; R299-K302 PolarHBondContact O-N 2.93Å; R299-H303 PolarHBondContact O-N 3.26Å; R299-H303 VanDerWaalsContact O-N 3.11Å
300I90.7Very high87.8Confident30 Ų3057.2 Ų57.215%0.15429%0.294CS..Hα-helixtrans-61.3-47.9174.2-68.9163.1000110.3A54 A57 L58 L61 A296 I297 K302 H303 C306A54-I300 WeakPolarHBondContact O-CD1 3.49Å; A57-I300 HydrophobicContact CB-CD1 3.8Å; L58-I300 HydrophobicContact CB-CD1 4.48Å; L61-I300 HydrophobicContact CD1-CB 4.41Å; L61-I300 HydrophobicContact CD1-CG1 3.79Å; A296-I300 WeakPolarHBondContact O-CB 3.3Å; A296-I300 WeakPolarHBondContact O-CD1 3.24Å; A296-I300 WeakPolarHBondContact O-CG1 3.41Å; A296-I300 PolarHBondContact O-N 3.41Å; I297-I300 PolarHBondContact O-N 2.98Å; I300-K302 VanDerWaalsContact C-N 3.26Å; I300-K302 PolarHBondContact O-N 3.4Å; I300-H303 WeakPolarHBondContact O-CB 3.33Å; I300-H303 PolarHBondContact O-N 3.31Å; I300-C306 VanDerWaalsContact O-CB 3.23Å; I300-C306 WeakPolarHBondContact O-CB 3.44Å
301L90.3Very high87.4Confident84 Ų8460.3 Ų60.344%0.4431%0.305SS..Hα-helixtrans-64.1-29.4179.4-68.5175.3000113.1I297 F298 Q307 F310I297-L301 HydrophobicContact CG2-CD1 3.78Å; I297-L301 HydrophobicContact CG2-CG 4.28Å; I297-L301 WeakPolarHBondContact O-CB 3.28Å; I297-L301 VanDerWaalsContact O-CG 3.26Å; I297-L301 WeakPolarHBondContact O-CG 3.43Å; I297-L301 PolarHBondContact O-N 3.17Å; F298-L301 PolarHBondContact O-N 3.37Å; L301-Q307 WeakPolarHBondContact O-CG 3.21Å; L301-Q307 PolarHBondContact O-NE2 3.46Å; L301-F310 HydrophobicContact CD2-CD2 4.31Å; L301-F310 HydrophobicContact CD2-CE2 3.69Å; L301-F310 HydrophobicContact CD2-CZ 3.95Å
302K87Confident86.7Confident97 Ų9767 Ų6742%0.42233%0.334SS..Hα-helixtrans-81.7-13.1173.9-78.8-165.6171-173.80114.3F298 R299 I300F298-K302 HydrophobicContact CD1-CD 4.39Å; F298-K302 HydrophobicContact CE1-CD 3.79Å; F298-K302 HydrophobicContact CE2-CD 4.04Å; F298-K302 VanDerWaalsContact CE2-CE 3.42Å; F298-K302 HydrophobicContact CZ-CD 3.64Å; F298-K302 PolarHBondContact O-N 3.46Å; R299-K302 PolarHBondContact O-N 2.93Å; I300-K302 VanDerWaalsContact C-N 3.26Å; I300-K302 PolarHBondContact O-N 3.4Å
303H85.5Confident86Confident57 Ų5770.7 Ų70.726%0.26435%0.352SS..SBendtrans-69.5129.6-177.2-167.3-87.5000111L61 R299 I300 S305 C306 Q307L61-H303 HydrophobicContact CD1-CB 4.41Å; R299-H303 PolarHBondContact O-N 3.26Å; R299-H303 VanDerWaalsContact O-N 3.11Å; I300-H303 WeakPolarHBondContact O-CB 3.33Å; I300-H303 PolarHBondContact O-N 3.31Å; H303-S305 VanDerWaalsContact C-N 3.32Å; H303-S305 PolarHBondContact CE1-OG 2.93Å; H303-S305 VanDerWaalsContact CE1-OG 3.27Å; H303-S305 PolarHBondContact ND1-N 3.37Å; H303-S305 PolarHBondContact ND1-OG 3.07Å; H303-S305 PolarHBondContact O-N 3.18Å; H303-C306 HydrophobicContact CB-CB 4.31Å; H303-C306 PolarHBondContact O-N 3.02Å; H303-Q307 PolarHBondContact O-N 3.03Å
304P82.5Confident85.1Confident94 Ų9477.5 Ų77.561%0.6139%0.388SS*.Hα-helixtrans-54.6-42.1-174.5-28.334.7000114.3C306 Q307 A308P304-C306 VanDerWaalsContact C-N 3.31Å; P304-C306 PolarHBondContact O-N 2.81Å; P304-Q307 PolarHBondContact O-N 3.26Å; P304-A308 PolarHBondContact O-N 3.45Å
305S80.4Confident84.1Confident80 Ų8079.6 Ų79.656%0.55940%0.403SS*.Hα-helixtrans-63.3-37.6178.6-44.20000112.4H303 Y309H303-S305 VanDerWaalsContact C-N 3.32Å; H303-S305 PolarHBondContact CE1-OG 2.93Å; H303-S305 VanDerWaalsContact CE1-OG 3.27Å; H303-S305 PolarHBondContact ND1-N 3.37Å; H303-S305 PolarHBondContact ND1-OG 3.07Å; H303-S305 PolarHBondContact O-N 3.18Å; S305-Y309 PolarHBondContact O-N 3.3Å
306C78.2Confident82.3Confident25 Ų2586.9 Ų86.917%0.16944%0.435CS..Hα-helixtrans-72.9-41.1177.3-64.10000110.4I300 H303 P304 A308 Y309 F310I300-C306 VanDerWaalsContact O-CB 3.23Å; I300-C306 WeakPolarHBondContact O-CB 3.44Å; H303-C306 HydrophobicContact CB-CB 4.31Å; H303-C306 PolarHBondContact O-N 3.02Å; P304-C306 VanDerWaalsContact C-N 3.31Å; P304-C306 PolarHBondContact O-N 2.81Å; C306-A308 VanDerWaalsContact C-N 3.31Å; C306-A308 PolarHBondContact O-N 3.42Å; C306-Y309 PolarHBondContact O-N 3.5Å; C306-Y309 VanDerWaalsContact O-N 3.13Å; C306-F310 HydrophobicContact CB-CD2 4.45Å; C306-F310 VanDerWaalsContact O-CD2 3.23Å; C306-F310 WeakPolarHBondContact O-CD2 3.27Å; C306-F310 PolarHBondContact O-N 2.96Å
307Q83Confident80.2Confident84 Ų8492 Ų9239%0.39347%0.469SS..Hα-helixtrans-59.8-40.7174.7-70.2-171.1-10.600112.6L301 H303 P304 Y309 K311L301-Q307 WeakPolarHBondContact O-CG 3.21Å; L301-Q307 PolarHBondContact O-NE2 3.46Å; H303-Q307 PolarHBondContact O-N 3.03Å; P304-Q307 PolarHBondContact O-N 3.26Å; Q307-Y309 VanDerWaalsContact C-N 3.33Å; Q307-K311 WeakPolarHBondContact O-CB 3.42Å; Q307-K311 VanDerWaalsContact O-CG 3.27Å; Q307-K311 WeakPolarHBondContact O-CG 3.12Å; Q307-K311 PolarHBondContact O-N 3.45Å
308A81.4Confident78.2Confident62 Ų6298.3 Ų98.351%0.51249%0.493SS..Hα-helixtrans-62-42.7174.800000111.6P304 C306 K312P304-A308 PolarHBondContact O-N 3.45Å; C306-A308 VanDerWaalsContact C-N 3.31Å; C306-A308 PolarHBondContact O-N 3.42Å; A308-K312 WeakPolarHBondContact O-CB 3.44Å; A308-K312 PolarHBondContact O-N 2.91Å
309Y79Confident76.1Confident154 Ų154106.7 Ų106.760%0.60452%0.523SS*.Hα-helixtrans-66.5-46.3177.4-171.1-100.9000112.6S305 C306 Q307 K311 K312 I313S305-Y309 PolarHBondContact O-N 3.3Å; C306-Y309 PolarHBondContact O-N 3.5Å; C306-Y309 VanDerWaalsContact O-N 3.13Å; Q307-Y309 VanDerWaalsContact C-N 3.33Å; Y309-K311 PolarHBondContact O-N 2.86Å; Y309-K312 WeakPolarHBondContact O-CB 3.46Å; Y309-K312 PolarHBondContact O-N 3.31Å; Y309-K312 VanDerWaalsContact O-N 3.15Å; Y309-I313 HydrophobicContact CD1-CD1 3.74Å; Y309-I313 HydrophobicContact CD1-CG1 4.49Å; Y309-I313 HydrophobicContact CE1-CD1 3.3Å; Y309-I313 HydrophobicContact CE1-CG1 4.19Å; Y309-I313 PolarHBondContact O-N 2.95Å
310F78.7Confident74Confident97 Ų97113.6 Ų113.643%0.42556%0.555SS.*Hα-helixtrans-62-42.2176-84.7-70.1000112.3L301 C306 K312 I313 L314L301-F310 HydrophobicContact CD2-CD2 4.31Å; L301-F310 HydrophobicContact CD2-CE2 3.69Å; L301-F310 HydrophobicContact CD2-CZ 3.95Å; C306-F310 HydrophobicContact CB-CD2 4.45Å; C306-F310 VanDerWaalsContact O-CD2 3.23Å; C306-F310 WeakPolarHBondContact O-CD2 3.27Å; C306-F310 PolarHBondContact O-N 2.96Å; F310-K312 VanDerWaalsContact C-N 3.29Å; F310-K312 PolarHBondContact O-N 3.04Å; F310-I313 PolarHBondContact O-N 3.37Å; F310-L314 WeakPolarHBondContact O-CG 3.41Å; F310-L314 PolarHBondContact O-N 3.46Å
311K80.9Confident71.7Confident140 Ų140118.5 Ų118.561%0.60959%0.586SS**Hα-helixtrans-58.3-42.9173.4-78.2178.6-179.6-177.60111.2Q307 Y309 I313 L314 T315Q307-K311 WeakPolarHBondContact O-CB 3.42Å; Q307-K311 VanDerWaalsContact O-CG 3.27Å; Q307-K311 WeakPolarHBondContact O-CG 3.12Å; Q307-K311 PolarHBondContact O-N 3.45Å; Y309-K311 PolarHBondContact O-N 2.86Å; K311-I313 PolarHBondContact O-N 3.28Å; K311-L314 PolarHBondContact O-N 3.36Å; K311-T315 WeakPolarHBondContact O-CG2 3.24Å; K311-T315 PolarHBondContact O-N 3.05Å; K311-T315 PolarHBondContact O-OG1 3.21Å
312K79.7Confident69.4Low146 Ų146120 Ų12064%0.63560%0.598SS**Hα-helixtrans-64.1-36177.6-170178.7-179.6-179.40113.1A308 Y309 F310 T315A308-K312 WeakPolarHBondContact O-CB 3.44Å; A308-K312 PolarHBondContact O-N 2.91Å; Y309-K312 WeakPolarHBondContact O-CB 3.46Å; Y309-K312 PolarHBondContact O-N 3.31Å; Y309-K312 VanDerWaalsContact O-N 3.15Å; F310-K312 VanDerWaalsContact C-N 3.29Å; F310-K312 PolarHBondContact O-N 3.04Å; K312-T315 PolarHBondContact O-OG1 3.32Å
313I78.3Confident67.3Low78 Ų78124.5 Ų124.540%0.462%0.621SS.*Hα-helixtrans-67.3-46.9174.1-69.6172000110.6Y309 F310 K311 T315 F316Y309-I313 HydrophobicContact CD1-CD1 3.74Å; Y309-I313 HydrophobicContact CD1-CG1 4.49Å; Y309-I313 HydrophobicContact CE1-CD1 3.3Å; Y309-I313 HydrophobicContact CE1-CG1 4.19Å; Y309-I313 PolarHBondContact O-N 2.95Å; F310-I313 PolarHBondContact O-N 3.37Å; K311-I313 PolarHBondContact O-N 3.28Å; I313-T315 VanDerWaalsContact C-N 3.26Å; I313-T315 PolarHBondContact O-N 3.46Å; I313-F316 PolarHBondContact O-N 3.2Å
314L76.8Confident65.2Low149 Ų149126.8 Ų126.878%0.7864%0.639SS**Hα-helixtrans-66.8-27.7-179.6-69.8170.8000112.8F310 K311 F316F310-L314 WeakPolarHBondContact O-CG 3.41Å; F310-L314 PolarHBondContact O-N 3.46Å; K311-L314 PolarHBondContact O-N 3.36Å; L314-F316 VanDerWaalsContact C-N 3.33Å
315T72.5Confident63.2Low105 Ų105130.3 Ų130.364%0.64465%0.652SS**THydrogen-bonded Turntrans-9015.1175.558.60000114K311 K312 I313 P317K311-T315 WeakPolarHBondContact O-CG2 3.24Å; K311-T315 PolarHBondContact O-N 3.05Å; K311-T315 PolarHBondContact O-OG1 3.21Å; K312-T315 PolarHBondContact O-OG1 3.32Å; I313-T315 VanDerWaalsContact C-N 3.26Å; I313-T315 PolarHBondContact O-N 3.46Å; T315-P317 VanDerWaalsContact O-N 3.12Å
316F52.7Low61.1Low157 Ų157130.1 Ų130.169%0.68966%0.662SS**  trans-55.6122.8172.5-109-92.6000109.8I313 L314 K318I313-F316 PolarHBondContact O-N 3.2Å; L314-F316 VanDerWaalsContact C-N 3.33Å; F316-K318 PolarHBondContact O-N 2.96Å
317P51.8Low58.9Low108 Ų108132.6 Ų132.670%0.70169%0.692SS**  trans-66.8134.4-169.624.3-31.2000109.6T315 R319T315-P317 VanDerWaalsContact O-N 3.12Å; P317-R319 PolarHBondContact O-N 3.16Å
318K50.9Low56.8Low204 Ų204134.2 Ų134.289%0.88771%0.713SS**  trans-42121.7167.2-82.5-176.3176.4-179.60107.8F316 K320F316-K318 PolarHBondContact O-N 2.96Å; K318-K320 PolarHBondContact O-N 3.32Å; K318-K320 VanDerWaalsContact O-N 3.11Å
319R49Very low54.7Low238 Ų238139.1 Ų139.190%0.89873%0.729SS**  trans-36.6119.2176.2-141.9178.7-155.2170.84.7108.1P317 T321P317-R319 PolarHBondContact O-N 3.16Å; R319-T321 PolarHBondContact O-N 3.45Å
320K44.4Very low52.9Low197 Ų197135.7 Ų135.786%0.85773%0.733SS**  trans-54.2107.7169.2-81.7-176.6176.6-178.70105.9K318 V322K318-K320 PolarHBondContact O-N 3.32Å; K318-K320 VanDerWaalsContact O-N 3.11Å; K320-V322 PolarHBondContact O-N 3.22Å
321T42.5Very low51Low133 Ų133137.4 Ų137.482%0.81675%0.751SS**  trans-55110.1165.9-51.40000105.1R319 Q323R319-T321 PolarHBondContact O-N 3.45Å; T321-Q323 PolarHBondContact O-N 3.12Å
322V42.8Very low48.9Very low114 Ų114140.6 Ų140.669%0.69177%0.766SS**  trans-59.3110.6172.5-178.50000104.8K320 V324K320-V322 PolarHBondContact O-N 3.22Å; V322-V324 HydrophobicContact CB-CG2 4.06Å; V322-V324 HydrophobicContact CG1-CG2 3.45Å; V322-V324 VanDerWaalsContact CG1-CG2 3.45Å; V322-V324 PolarHBondContact O-N 2.89Å
323Q42.5Very low47.1Very low193 Ų193139.6 Ų139.690%0.90278%0.777SS**  trans-65.486166.2-88.5-171.7-29.200106.6T321T321-Q323 PolarHBondContact O-N 3.12Å
324V42.3Very low45.2Very low104 Ų104138.7 Ų138.763%0.6379%0.786SS**  trans-84.1108.6167.7179.20000106.5V322V322-V324 HydrophobicContact CB-CG2 4.06Å; V322-V324 HydrophobicContact CG1-CG2 3.45Å; V322-V324 VanDerWaalsContact CG1-CG2 3.45Å; V322-V324 PolarHBondContact O-N 2.89Å
325L39.4Very low43.5Very low169 Ų169140.7 Ų140.789%0.88579%0.789SS**  trans61.2138.1153.3-84.690.8000120.7
326G36.8Very low42.1Very low76 Ų76147.6 Ų147.678%0.78481%0.814SS**  trans124.487.6164.700000109.5
327G32.6Very low41.5Very low77 Ų77147.1 Ų147.179%0.79482%0.82SS**  cis91.3130.943.600000108.9
328S38.8Very low41Very low118 Ų118149.2 Ų149.283%0.82583%0.826SS**  trans86.194.6-179.7-144.10000114.1
329L36.7Very low40.4Very low164 Ų164146.1 Ų146.186%0.85982%0.823SS**  67.813458.4-142.1117.4000112.5
330A42Very low39.9Very low83 Ų83140.7 Ų140.769%0.68682%0.819SS**  trans84.4129.1175.300000115.2
331T37.3Very low39.7Very low132 Ų132137.2 Ų137.281%0.8182%0.816SS**  cis-164.1146.113.50.90000110.3
332K38Very low39.5Very low208 Ų208137.5 Ų137.590%0.90482%0.816SS**  trans-25.7131157.5-73.4168.3167.1176.70114.6
333S42.1Very low39.2Very low124 Ų124139.1 Ų139.187%0.86783%0.825SS**  trans-129.499.6146173.50000106.6
334G38Very low39Very low59 Ų59135 Ų13561%0.60882%0.819SS**  trans-87.8-177.5161.300000110.8
335K39.5Very low38.7Very low192 Ų192137.6 Ų137.684%0.83584%0.835SS**  trans93.8126.3-174.3-62.2-176.4171.2-166.90112.3
336E43.6Very low38.7Very low249 Ų249134.7 Ų134.7100%1.16483%0.83SS**  cis-161.40-3.9-127.6164.7-17300106

Retrieved 336 of 336 residues in 1499 ms (Link to these results)

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