A0A089VLV6_HUMAN Loading...

Rh blood group

AlphaFold DB , UniProt , Accession A0A089VLV6, Species HUMAN (Homo sapiens, Human), Gene RHCE, Length 417 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
1M34.9Very low42.9Very low245 Ų245149.9 Ų149.9100%1.20771%0.706SS**  0111.20-82.5171.7155.600108.9S3M1-S3 PolarHBondContact O-N 3.27Å
2S27.4Very low44.5Very low118 Ų118144.8 Ų144.883%0.82570%0.697SS**  trans-57.6124.1175.6172.50000109.5K4S2-K4 PolarHBondContact O-N 3.07Å; S2-K4 VanDerWaalsContact O-N 3.07Å
3S34.7Very low46.3Very low72 Ų72136.8 Ų136.850%0.50366%0.66SS.*  trans-60.5114.7178.2-178.70000109.6M1 Y5M1-S3 PolarHBondContact O-N 3.27Å; S3-Y5 PolarHBondContact O-N 2.67Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.5Å; S3-Y5 WeakPolarHBondContact OG-CE2 3.3Å
4K36.2Very low47.9Very low203 Ų203131.5 Ų131.588%0.88364%0.642SS**  trans-71.657.3169.6-67.6-178.6179.3178.50109.7S2 P6S2-K4 PolarHBondContact O-N 3.07Å; S2-K4 VanDerWaalsContact O-N 3.07Å; K4-P6 WeakPolarHBondContact O-CD 3.38Å
5Y44.6Very low49.9Very low103 Ų103130.6 Ų130.640%0.40464%0.64SS.*  trans-69.8120.1162.1-78.7-71.6000107S3 R7 Q405S3-Y5 PolarHBondContact O-N 2.67Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.5Å; S3-Y5 WeakPolarHBondContact OG-CE2 3.3Å; Y5-R7 PolarHBondContact O-N 2.81Å; Y5-R7 VanDerWaalsContact O-N 3.16Å; Y5-Q405 PolarHBondContact OH-OE1 3.16Å
6P43.8Very low51.7Low96 Ų96126.8 Ų126.862%0.62363%0.629SS**  trans-55.7127.8163.623-29000106.8K4 S8K4-P6 WeakPolarHBondContact O-CD 3.38Å; P6-S8 WeakPolarHBondContact O-CB 3.39Å; P6-S8 PolarHBondContact O-N 3.36Å
7R46.1Very low53.6Low257 Ų257120.8 Ų120.897%0.9760%0.604SS**  trans-65.168.5172.9-76179.1175167.2-2108.5Y5Y5-R7 PolarHBondContact O-N 2.81Å; Y5-R7 VanDerWaalsContact O-N 3.16Å
8S50.9Low55.5Low49 Ų49121.1 Ų121.134%0.34361%0.607SS.*  trans-94.8131.5-166.2-160.60000107.9P6 R10P6-S8 WeakPolarHBondContact O-CB 3.39Å; P6-S8 PolarHBondContact O-N 3.36Å; S8-R10 PolarHBondContact O-N 3.26Å
9V51.6Low57.2Low43 Ų43118.8 Ų118.826%0.26160%0.601SS.*SBendtrans85.3-21.2159.5-157.50000118.5R11 C12 L13V9-R11 VanDerWaalsContact C-N 3.28Å; V9-R11 PolarHBondContact O-N 3.03Å; V9-C12 PolarHBondContact O-N 3.4Å; V9-L13 HydrophobicContact CG1-CB 3.19Å; V9-L13 HydrophobicContact CG1-CD1 3.69Å; V9-L13 HydrophobicContact CG1-CD2 3.93Å; V9-L13 HydrophobicContact CG1-CG 3.81Å; V9-L13 PolarHBondContact O-N 3.29Å
10R50.5Low58.9Low239 Ų239114.9 Ų114.990%0.90258%0.581SS**THydrogen-bonded Turntrans-53.8-26.7-170.2-143.1-177.1-153.9-160.44.6117.7S8 P14S8-R10 PolarHBondContact O-N 3.26Å; R10-P14 WeakPolarHBondContact O-CG 2.89Å
11R51.3Low60.6Low224 Ų224112.8 Ų112.885%0.84557%0.569SS**THydrogen-bonded Turntrans-106-28.5178.4-92.1-172-178.2173.40.4115V9 L15V9-R11 VanDerWaalsContact C-N 3.28Å; V9-R11 PolarHBondContact O-N 3.03Å; R11-L15 WeakPolarHBondContact O-CB 2.77Å
12C61.3Low63.4Low88 Ų88103.5 Ų103.560%0.59553%0.532SS*.Hα-helixtrans-86.6-45.7-170.1-162.20000111.8V9 L15 C16V9-C12 PolarHBondContact O-N 3.4Å; C12-L15 PolarHBondContact O-N 3.32Å; C12-C16 WeakPolarHBondContact O-CB 3.31Å; C12-C16 PolarHBondContact O-N 3.22Å; C12-C16 PolarHBondContact O-SG 3.33Å
13L67.9Low66.5Low41 Ų41100 Ų10022%0.21551%0.51CS..Hα-helixtrans-68.7-47.2-175-167.5106.1000115.1V9 L15 C16 A17 L136 A137V9-L13 HydrophobicContact CG1-CB 3.19Å; V9-L13 HydrophobicContact CG1-CD1 3.69Å; V9-L13 HydrophobicContact CG1-CD2 3.93Å; V9-L13 HydrophobicContact CG1-CG 3.81Å; V9-L13 PolarHBondContact O-N 3.29Å; L13-L15 PolarHBondContact O-N 3.44Å; L13-C16 PolarHBondContact O-N 3.44Å; L13-A17 WeakPolarHBondContact O-CB 3.49Å; L13-A17 PolarHBondContact O-N 3.39Å; L13-L136 HydrophobicContact CD1-CB 3.9Å; L13-L136 HydrophobicContact CD2-CB 4.12Å; L13-L136 HydrophobicContact CD2-CD2 3.77Å; L13-L136 HydrophobicContact CD2-CG 4.42Å; L13-L136 HydrophobicContact CG-CB 4.5Å; L13-L136 HydrophobicContact CG-CD2 4.43Å; L13-A137 HydrophobicContact CD1-CB 3.74Å
14P69.8Low69.3Low63 Ų6396.8 Ų96.841%0.40949%0.487SS..Hα-helixtrans-64.3-34.5176.223.8-32.3000111.2R10 L18R10-P14 WeakPolarHBondContact O-CG 2.89Å; P14-L18 WeakPolarHBondContact O-CB 3.44Å; P14-L18 WeakPolarHBondContact O-CG 3.41Å; P14-L18 PolarHBondContact O-N 3.45Å
15L77.1Confident72Confident118 Ų11892 Ų9262%0.61847%0.47SS*.Hα-helixtrans-70.5-46179.6-144.5131.9000110.8R11 C12 L13 A17 L18 T19R11-L15 WeakPolarHBondContact O-CB 2.77Å; C12-L15 PolarHBondContact O-N 3.32Å; L13-L15 PolarHBondContact O-N 3.44Å; L15-A17 PolarHBondContact O-N 3.31Å; L15-L18 PolarHBondContact O-N 2.86Å; L15-T19 HydrophobicContact CD2-CG2 4.37Å; L15-T19 VanDerWaalsContact O-CG2 3.27Å; L15-T19 WeakPolarHBondContact O-CG2 3.48Å; L15-T19 PolarHBondContact O-N 3.24Å; L15-T19 PolarHBondContact O-OG1 2.77Å; L15-T19 VanDerWaalsContact O-OG1 3.12Å
16C79.4Confident74.4Confident69 Ų6992 Ų9247%0.46648%0.476SS..Hα-helixtrans-59.9-42.5173.9-71.60000112.8C12 L13 T19 L20C12-C16 WeakPolarHBondContact O-CB 3.31Å; C12-C16 PolarHBondContact O-N 3.22Å; C12-C16 PolarHBondContact O-SG 3.33Å; L13-C16 PolarHBondContact O-N 3.44Å; C16-T19 VanDerWaalsContact CA-OG1 3.3Å; C16-T19 WeakPolarHBondContact CA-OG1 3.32Å; C16-T19 PolarHBondContact O-N 2.94Å; C16-T19 PolarHBondContact O-OG1 3.38Å; C16-L20 WeakPolarHBondContact O-CB 3.36Å; C16-L20 PolarHBondContact O-N 2.8Å
17A83.5Confident76.6Confident25 Ų2590 Ų9021%0.20746%0.46CS..Hα-helixtrans-64.5-45.8177.800000111.4L13 L15 L20 E21 F82L13-A17 WeakPolarHBondContact O-CB 3.49Å; L13-A17 PolarHBondContact O-N 3.39Å; L15-A17 PolarHBondContact O-N 3.31Å; A17-L20 PolarHBondContact O-N 3.41Å; A17-E21 PolarHBondContact O-N 2.78Å; A17-F82 HydrophobicContact CB-CZ 4.4Å
18L87.8Confident78.8Confident126 Ų12679.9 Ų79.966%0.6642%0.424SS*.Hα-helixtrans-66.1-37.5177.1-70.4172.5000112.5P14 L15 L20 E21 A22P14-L18 WeakPolarHBondContact O-CB 3.44Å; P14-L18 WeakPolarHBondContact O-CG 3.41Å; P14-L18 PolarHBondContact O-N 3.45Å; L15-L18 PolarHBondContact O-N 2.86Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L18-E21 PolarHBondContact O-N 3.2Å; L18-A22 WeakPolarHBondContact O-CB 3.34Å; L18-A22 PolarHBondContact O-N 3.4Å
19T88.8Confident80.7Confident79 Ų7986.1 Ų86.149%0.48544%0.441SS..Hα-helixtrans-66.3-37.7174.754.40000112.1L15 C16 A23L15-T19 HydrophobicContact CD2-CG2 4.37Å; L15-T19 VanDerWaalsContact O-CG2 3.27Å; L15-T19 WeakPolarHBondContact O-CG2 3.48Å; L15-T19 PolarHBondContact O-N 3.24Å; L15-T19 PolarHBondContact O-OG1 2.77Å; L15-T19 VanDerWaalsContact O-OG1 3.12Å; C16-T19 VanDerWaalsContact CA-OG1 3.3Å; C16-T19 WeakPolarHBondContact CA-OG1 3.32Å; C16-T19 PolarHBondContact O-N 2.94Å; C16-T19 PolarHBondContact O-OG1 3.38Å; T19-A23 WeakPolarHBondContact O-CB 3.27Å; T19-A23 PolarHBondContact O-N 3.28Å
20L90.3Very high82.4Confident40 Ų4090.1 Ų90.121%0.20946%0.455CS..Hα-helixtrans-66.9-44.4176.3-177.762.8000110.7C16 A17 L18 A22 A23 L24 L86 V140 L144C16-L20 WeakPolarHBondContact O-CB 3.36Å; C16-L20 PolarHBondContact O-N 2.8Å; A17-L20 PolarHBondContact O-N 3.41Å; L18-L20 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 2.79Å; L20-A23 WeakPolarHBondContact O-CB 3.26Å; L20-A23 PolarHBondContact O-N 3.42Å; L20-L24 HydrophobicContact CG-CD1 4.31Å; L20-L24 WeakPolarHBondContact O-CG 3.39Å; L20-L24 PolarHBondContact O-N 3.01Å; L20-L86 HydrophobicContact CD2-CD1 3.61Å; L20-L86 HydrophobicContact CD2-CD2 4.02Å; L20-L86 HydrophobicContact CD2-CG 4.48Å; L20-L86 HydrophobicContact CG-CD1 4.16Å; L20-V140 HydrophobicContact CD2-CG1 3.61Å; L20-L144 HydrophobicContact CD1-CD1 4.5Å; L20-L144 HydrophobicContact CD2-CD1 4.49Å
21E93.7Very high84.1Confident70 Ų7082.4 Ų82.433%0.32743%0.428SS..Hα-helixtrans-61.4-45176.1-167.265.7-157.200111.4A17 L18 A23 L24 I25 Q89A17-E21 PolarHBondContact O-N 2.78Å; L18-E21 PolarHBondContact O-N 3.2Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.48Å; E21-L24 PolarHBondContact O-N 3.08Å; E21-I25 HydrophobicContact CG-CD1 4.12Å; E21-I25 VanDerWaalsContact O-CG1 3.3Å; E21-I25 WeakPolarHBondContact O-CG1 3.37Å; E21-I25 PolarHBondContact O-N 2.97Å; E21-Q89 PolarHBondContact OE1-NE2 3.49Å; E21-Q89 PolarHBondContact OE1-OE1 3.48Å; E21-Q89 PolarHBondContact OE2-OE1 2.94Å
22A93.8Very high85.8Confident50 Ų5073 Ų7341%0.41340%0.395SS..Hα-helixtrans-60.2-40.617600000111.9L18 L20 I25 L26L18-A22 WeakPolarHBondContact O-CB 3.34Å; L18-A22 PolarHBondContact O-N 3.4Å; L20-A22 PolarHBondContact O-N 2.79Å; A22-I25 PolarHBondContact O-N 3.3Å; A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.35Å
23A93.3Very high87Confident45 Ų4572.6 Ų72.637%0.37239%0.385SS..Hα-helixtrans-64.4-4317500000111.8T19 L20 E21 L26 L27T19-A23 WeakPolarHBondContact O-CB 3.27Å; T19-A23 PolarHBondContact O-N 3.28Å; L20-A23 WeakPolarHBondContact O-CB 3.26Å; L20-A23 PolarHBondContact O-N 3.42Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 3.48Å; A23-L26 PolarHBondContact O-N 3.42Å; A23-L27 VanDerWaalsContact O-CG 3.32Å; A23-L27 WeakPolarHBondContact O-CG 3.27Å; A23-L27 PolarHBondContact O-N 3.44Å
24L93.4Very high87.8Confident5 Ų579.5 Ų79.53%0.02641%0.409CS..Hα-helixtrans-62.3-46175.8-69.6170.5000111L20 E21 L26 L27 F28 L86 Q89 W90 L93L20-L24 HydrophobicContact CG-CD1 4.31Å; L20-L24 WeakPolarHBondContact O-CG 3.39Å; L20-L24 PolarHBondContact O-N 3.01Å; E21-L24 PolarHBondContact O-N 3.08Å; L24-L26 VanDerWaalsContact C-N 3.3Å; L24-L26 PolarHBondContact O-N 2.94Å; L24-L27 PolarHBondContact O-N 3.48Å; L24-L27 VanDerWaalsContact O-N 3.1Å; L24-F28 VanDerWaalsContact O-CD2 3.31Å; L24-F28 WeakPolarHBondContact O-CD2 3.49Å; L24-F28 PolarHBondContact O-N 2.88Å; L24-L86 HydrophobicContact CD1-CD1 3.63Å; L24-Q89 HydrophobicContact CD1-CB 4.3Å; L24-W90 HydrophobicContact CD2-CE3 4.05Å; L24-L93 HydrophobicContact CD2-CD1 3.58Å
25I94.1Very high88.1Confident103 Ų10379.9 Ų79.953%0.52841%0.408SS..Hα-helixtrans-56.1-45.4176.4-69.1165.8000111.1E21 A22 F28 Y29E21-I25 HydrophobicContact CG-CD1 4.12Å; E21-I25 VanDerWaalsContact O-CG1 3.3Å; E21-I25 WeakPolarHBondContact O-CG1 3.37Å; E21-I25 PolarHBondContact O-N 2.97Å; A22-I25 PolarHBondContact O-N 3.3Å; I25-F28 PolarHBondContact O-N 3.01Å; I25-Y29 WeakPolarHBondContact O-CB 3.39Å; I25-Y29 PolarHBondContact O-N 3.44Å
26L93.8Very high87.7Confident101 Ų10179.1 Ų79.153%0.52942%0.419SS..Hα-helixtrans-62.6-44.1176.8-71.4171000111.6A22 A23 L24 F28 Y29 F30A22-L26 WeakPolarHBondContact O-CG 3.48Å; A22-L26 PolarHBondContact O-N 3.35Å; A23-L26 PolarHBondContact O-N 3.42Å; L24-L26 VanDerWaalsContact C-N 3.3Å; L24-L26 PolarHBondContact O-N 2.94Å; L26-F28 PolarHBondContact O-N 3.11Å; L26-Y29 PolarHBondContact O-N 3.3Å; L26-F30 HydrophobicContact CD2-CE2 4.39Å; L26-F30 WeakPolarHBondContact O-CD2 3.21Å; L26-F30 PolarHBondContact O-N 2.81Å
27L91.3Very high87.2Confident55 Ų5579.1 Ų79.129%0.28842%0.419SS..Hα-helixtrans-61.9-43.2176.5-69.7172.6000111.7A23 L24 Y29 F30 F31 L93A23-L27 VanDerWaalsContact O-CG 3.32Å; A23-L27 WeakPolarHBondContact O-CG 3.27Å; A23-L27 PolarHBondContact O-N 3.44Å; L24-L27 PolarHBondContact O-N 3.48Å; L24-L27 VanDerWaalsContact O-N 3.1Å; L27-Y29 VanDerWaalsContact C-N 3.35Å; L27-Y29 PolarHBondContact O-N 3.47Å; L27-F30 PolarHBondContact O-N 3.22Å; L27-F31 HydrophobicContact CB-CD2 4.48Å; L27-F31 HydrophobicContact CD2-CD2 3.92Å; L27-F31 HydrophobicContact CD2-CE2 3.76Å; L27-F31 WeakPolarHBondContact O-CB 3.48Å; L27-F31 WeakPolarHBondContact O-CD2 3.48Å; L27-F31 PolarHBondContact O-N 3.36Å; L27-L93 HydrophobicContact CB-CD1 3.83Å; L27-L93 HydrophobicContact CB-CD2 4.22Å; L27-L93 HydrophobicContact CD1-CD1 4.03Å
28F91Very high85.9Confident45 Ų4586.5 Ų86.520%0.19745%0.454CS..Hα-helixtrans-61.1-44.4174.8-90.2-97000111.4L24 I25 L26 F30 T32 Q89 I92 L93 I108L24-F28 VanDerWaalsContact O-CD2 3.31Å; L24-F28 WeakPolarHBondContact O-CD2 3.49Å; L24-F28 PolarHBondContact O-N 2.88Å; I25-F28 PolarHBondContact O-N 3.01Å; L26-F28 PolarHBondContact O-N 3.11Å; F28-F30 PolarHBondContact O-N 3.38Å; F28-T32 HydrophobicContact CB-CG2 4.46Å; F28-T32 HydrophobicContact CD1-CG2 3.71Å; F28-T32 WeakPolarHBondContact CD1-OG1 3.3Å; F28-T32 HydrophobicContact CE1-CG2 4.15Å; F28-T32 HydrophobicContact CG-CG2 4.14Å; F28-T32 WeakPolarHBondContact O-CB 3.45Å; F28-T32 PolarHBondContact O-N 3.3Å; F28-T32 PolarHBondContact O-OG1 2.8Å; F28-Q89 HydrophobicContact CE2-CB 4.08Å; F28-Q89 WeakPolarHBondContact CE2-O 3.24Å; F28-Q89 HydrophobicContact CZ-CB 4.37Å; F28-I92 HydrophobicContact CE1-CG2 4.05Å; F28-I92 HydrophobicContact CZ-CB 4.11Å; F28-I92 HydrophobicContact CZ-CG2 4.06Å; F28-L93 HydrophobicContact CD2-CD1 3.8Å; F28-L93 HydrophobicContact CD2-CD2 3.82Å; F28-L93 HydrophobicContact CD2-CG 3.9Å; F28-L93 HydrophobicContact CE2-CD1 3.6Å; F28-L93 HydrophobicContact CE2-CD2 3.85Å; F28-L93 HydrophobicContact CE2-CG 3.48Å; F28-L93 VanDerWaalsContact CE2-CG 3.48Å; F28-L93 HydrophobicContact CG-CD2 4.26Å; F28-L93 HydrophobicContact CZ-CD2 4.3Å; F28-L93 HydrophobicContact CZ-CG 4.03Å; F28-I108 HydrophobicContact CD1-CD1 4.12Å; F28-I108 HydrophobicContact CE1-CD1 3.95Å
29Y90.3Very high84.7Confident180 Ų18084.3 Ų84.371%0.70644%0.44SS*.Hα-helixtrans-58.8-43.6178.3175.9-100.3000112.8I25 L26 L27I25-Y29 WeakPolarHBondContact O-CB 3.39Å; I25-Y29 PolarHBondContact O-N 3.44Å; L26-Y29 PolarHBondContact O-N 3.3Å; L27-Y29 VanDerWaalsContact C-N 3.35Å; L27-Y29 PolarHBondContact O-N 3.47Å
30F88.1Confident83.9Confident127 Ų12785.9 Ų85.956%0.55745%0.446SS*.Hα-helixtrans-82.7-36.6-176.8-73.3-65.4000113.9L26 L27 F28L26-F30 HydrophobicContact CD2-CE2 4.39Å; L26-F30 WeakPolarHBondContact O-CD2 3.21Å; L26-F30 PolarHBondContact O-N 2.81Å; L27-F30 PolarHBondContact O-N 3.22Å; F28-F30 PolarHBondContact O-N 3.38Å
31F86.2Confident83Confident76 Ų7691.4 Ų91.433%0.33347%0.471SS..Hα-helixtrans-109.7-8.6-166.6-64-75.3000114.6L27 F97 K105 V106L27-F31 HydrophobicContact CB-CD2 4.48Å; L27-F31 HydrophobicContact CD2-CD2 3.92Å; L27-F31 HydrophobicContact CD2-CE2 3.76Å; L27-F31 WeakPolarHBondContact O-CB 3.48Å; L27-F31 WeakPolarHBondContact O-CD2 3.48Å; L27-F31 PolarHBondContact O-N 3.36Å; F31-F97 HydrophobicContact CB-CE1 4.03Å; F31-F97 HydrophobicContact CB-CZ 4.22Å; F31-F97 AromaticContact CD1-CE1 3.9Å; F31-F97 HydrophobicContact CD1-CE1 3.9Å; F31-F97 HydrophobicContact CD1-CZ 4.49Å; F31-F97 HydrophobicContact CD2-CE1 4.21Å; F31-F97 AromaticContact CD2-CZ 3.98Å; F31-F97 HydrophobicContact CD2-CZ 3.98Å; F31-F97 HydrophobicContact CE1-CE1 4.42Å; F31-F97 AromaticContact CG-CE1 3.78Å; F31-F97 HydrophobicContact CG-CE1 3.78Å; F31-F97 AromaticContact CG-CZ 3.98Å; F31-F97 HydrophobicContact CG-CZ 3.98Å; F31-K105 CarbonylContact O-C 3.59Å; F31-K105 WeakPolarHBondContact O-CA 3.14Å; F31-V106 WeakPolarHBondContact O-CB 3.41Å; F31-V106 PolarHBondContact O-N 3.18Å
32T86.9Confident82.1Confident27 Ų2796 Ų9617%0.16649%0.49CS..EExtended strand (participates in β ladder)trans-117.6149.6-175.573.70000113.1F28 L93 V106 I108F28-T32 HydrophobicContact CB-CG2 4.46Å; F28-T32 HydrophobicContact CD1-CG2 3.71Å; F28-T32 WeakPolarHBondContact CD1-OG1 3.3Å; F28-T32 HydrophobicContact CE1-CG2 4.15Å; F28-T32 HydrophobicContact CG-CG2 4.14Å; F28-T32 WeakPolarHBondContact O-CB 3.45Å; F28-T32 PolarHBondContact O-N 3.3Å; F28-T32 PolarHBondContact O-OG1 2.8Å; T32-L93 HydrophobicContact CG2-CD2 3.83Å; T32-V106 WeakPolarHBondContact CA-O 3.44Å; T32-V106 HydrophobicContact CG2-CB 4.19Å; T32-I108 HydrophobicContact CG2-CD1 4.22Å
33H86.6Confident81.1Confident79 Ų7995.2 Ų95.237%0.36649%0.486SS..EExtended strand (participates in β ladder)trans-146.7155.716865.4-64.1000110.2V106 V107 I108H33-V106 PolarHBondContact N-O 3.41Å; H33-V106 PolarHBondContact ND1-O 2.72Å; H33-V107 VanDerWaalsContact CE1-CG2 3.44Å; H33-V107 WeakPolarHBondContact CE1-CG2 3.27Å; H33-I108 PolarHBondContact O-N 2.91Å
34Y83.8Confident80.4Confident187 Ų18796.9 Ų96.973%0.73349%0.488SS*.EExtended strand (participates in β ladder)trans-77.8144.4175.3-65.9-66.2000110.8A36 I108Y34-A36 PolarHBondContact O-N 3.04Å; Y34-I108 HydrophobicContact CD1-CB 4.16Å; Y34-I108 HydrophobicContact CD1-CG2 4.3Å; Y34-I108 HydrophobicContact CE1-CB 4.44Å; Y34-I108 HydrophobicContact CE1-CD1 4.42Å; Y34-I108 HydrophobicContact CE1-CG2 4.26Å
35D77.4Confident79.8Confident71 Ų71100 Ų10038%0.3851%0.507SS..  trans-62.1130.7167-168.94.5000109.7S37 V107 I108 T109D35-S37 VanDerWaalsContact C-N 3.31Å; D35-S37 VanDerWaalsContact CG-OG 3.24Å; D35-S37 WeakPolarHBondContact OD1-CB 3.19Å; D35-S37 PolarHBondContact OD1-N 3.19Å; D35-S37 PolarHBondContact OD1-OG 2.84Å; D35-S37 PolarHBondContact OD2-OG 3.15Å; D35-V107 HydrophobicContact CB-CG1 3.73Å; D35-I108 PolarHBondContact N-O 3.13Å; D35-T109 HydrophobicContact CB-CG2 4.23Å
36A68.9Low79.1Confident102 Ų10296.8 Ų96.884%0.84350%0.496SS*.  trans-88.6-1.2178.100000112.2Y34Y34-A36 PolarHBondContact O-N 3.04Å
37S67.3Low78.4Confident68 Ų6893.2 Ų93.248%0.47648%0.48SS..  trans-67.2131.2-17977.70000111.9D35 E39D35-S37 VanDerWaalsContact C-N 3.31Å; D35-S37 VanDerWaalsContact CG-OG 3.24Å; D35-S37 WeakPolarHBondContact OD1-CB 3.19Å; D35-S37 PolarHBondContact OD1-N 3.19Å; D35-S37 PolarHBondContact OD1-OG 2.84Å; D35-S37 PolarHBondContact OD2-OG 3.15Å; S37-E39 PolarHBondContact O-N 2.74Å; S37-E39 VanDerWaalsContact O-N 3.07Å
38L57.6Low78.1Confident180 Ų18097.4 Ų97.494%0.94249%0.493SS*.  trans-74.991.2171-90.7153.6000108.3
39E62.1Low78Confident80 Ų80100.3 Ų100.337%0.37451%0.507SS..  trans-62.6140.5170.3-77-169.4169.500110.7S37 Q41 L44S37-E39 PolarHBondContact O-N 2.74Å; S37-E39 VanDerWaalsContact O-N 3.07Å; E39-Q41 PolarHBondContact O-N 2.96Å; E39-L44 HydrophobicContact CB-CD1 4.43Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.35Å
40D70.9Confident77.8Confident113 Ų11392.4 Ų92.460%0.60448%0.477SS*.  trans-54131.1169.9174.432.9000110K42 G43 L44D40-K42 PolarHBondContact O-N 3.28Å; D40-K42 VanDerWaalsContact O-N 3.09Å; D40-G43 WeakPolarHBondContact O-CA 3.39Å; D40-G43 PolarHBondContact O-N 3.12Å; D40-L44 PolarHBondContact O-N 2.86Å
41Q73.2Confident77.7Confident155 Ų15587 Ų8772%0.72446%0.457SS*.Hα-helixtrans-56-34.7-173-170.6179.7-3.100112.2E39 V45E39-Q41 PolarHBondContact O-N 2.96Å; Q41-V45 VanDerWaalsContact O-CG2 3.32Å; Q41-V45 WeakPolarHBondContact O-CG2 3.45Å; Q41-V45 PolarHBondContact O-N 3.46Å; Q41-V45 VanDerWaalsContact O-N 3.14Å
42K73.2Confident77.9Confident168 Ų16888 Ų8873%0.7346%0.463SS*.Hα-helixtrans-69.8-40.7176-69.1178.9179.9174.30112.2D40 A46D40-K42 PolarHBondContact O-N 3.28Å; D40-K42 VanDerWaalsContact O-N 3.09Å; K42-A46 WeakPolarHBondContact O-CB 3.36Å; K42-A46 PolarHBondContact O-N 2.83Å; K42-A46 VanDerWaalsContact O-N 3.14Å
43G74.3Confident78.2Confident32 Ų3288.3 Ų88.333%0.3346%0.463SS..Hα-helixtrans-61.9-44.9174.900000111.8D40 S47D40-G43 WeakPolarHBondContact O-CA 3.39Å; D40-G43 PolarHBondContact O-N 3.12Å; G43-S47 WeakPolarHBondContact O-CB 3.34Å; G43-S47 PolarHBondContact O-N 3.01Å; G43-S47 PolarHBondContact O-OG 3.47Å; G43-S47 VanDerWaalsContact O-OG 3.08Å
44L77.1Confident78.4Confident80 Ų8084.5 Ų84.542%0.41945%0.446SS..Hα-helixtrans-60.7-48.6178.1-171.878.6000112.1E39 D40 S47 Y48 L110E39-L44 HydrophobicContact CB-CD1 4.43Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.35Å; D40-L44 PolarHBondContact O-N 2.86Å; L44-S47 WeakPolarHBondContact O-CB 3.46Å; L44-S47 PolarHBondContact O-N 2.91Å; L44-Y48 WeakPolarHBondContact O-CB 3.12Å; L44-Y48 PolarHBondContact O-N 3.46Å; L44-L110 HydrophobicContact CD1-CD1 3.48Å; L44-L110 VanDerWaalsContact CD1-CD1 3.48Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.28Å
45V82.5Confident78.8Confident71 Ų7178.8 Ų78.843%0.4343%0.43SS..Hα-helixtrans-63.1-47.6-180171.30000111.4Q41 S47 Y48 Q49Q41-V45 VanDerWaalsContact O-CG2 3.32Å; Q41-V45 WeakPolarHBondContact O-CG2 3.45Å; Q41-V45 PolarHBondContact O-N 3.46Å; Q41-V45 VanDerWaalsContact O-N 3.14Å; V45-S47 PolarHBondContact O-N 2.98Å; V45-Y48 PolarHBondContact O-N 3.38Å; V45-Q49 WeakPolarHBondContact O-CG 3.41Å; V45-Q49 PolarHBondContact O-N 3.35Å
46A79.5Confident79.6Confident35 Ų3576.9 Ų76.929%0.28942%0.421SS..Hα-helixtrans-61.5-39177.500000111.3K42 V50K42-A46 WeakPolarHBondContact O-CB 3.36Å; K42-A46 PolarHBondContact O-N 2.83Å; K42-A46 VanDerWaalsContact O-N 3.14Å; A46-V50 WeakPolarHBondContact O-CG2 3.31Å; A46-V50 PolarHBondContact O-N 2.94Å
47S78.3Confident80.7Confident26 Ų2672.2 Ų72.218%0.18238%0.382CS..Hα-helixtrans-64.9-41.7177.6-87.70000113.5G43 L44 V45 G51 R114G43-S47 WeakPolarHBondContact O-CB 3.34Å; G43-S47 PolarHBondContact O-N 3.01Å; G43-S47 PolarHBondContact O-OG 3.47Å; G43-S47 VanDerWaalsContact O-OG 3.08Å; L44-S47 WeakPolarHBondContact O-CB 3.46Å; L44-S47 PolarHBondContact O-N 2.91Å; V45-S47 PolarHBondContact O-N 2.98Å; S47-G51 PolarHBondContact O-N 3.07Å; S47-R114 PolarHBondContact O-NE 3.4Å; S47-R114 PolarHBondContact O-NH2 3.08Å; S47-R114 PolarHBondContact OG-NH2 2.84Å
48Y84.1Confident81.8Confident143 Ų14369 Ų6956%0.56136%0.359SS*.Hα-helixtrans-67.1-43.7177.1177.1-98.4000111.8L44 V45 V50 G51 Q52L44-Y48 WeakPolarHBondContact O-CB 3.12Å; L44-Y48 PolarHBondContact O-N 3.46Å; V45-Y48 PolarHBondContact O-N 3.38Å; Y48-V50 PolarHBondContact O-N 3.2Å; Y48-G51 WeakPolarHBondContact O-CA 3.39Å; Y48-G51 PolarHBondContact O-N 3.32Å; Y48-Q52 PolarHBondContact O-N 2.92Å
49Q88.8Confident83.5Confident107 Ų10761.3 Ų61.350%0.532%0.322SS..Hα-helixtrans-56.1-47.3178-75.4172.7-13.600112.2V45 G51 Q52 D53V45-Q49 WeakPolarHBondContact O-CG 3.41Å; V45-Q49 PolarHBondContact O-N 3.35Å; Q49-G51 VanDerWaalsContact C-N 3.3Å; Q49-G51 PolarHBondContact O-N 3.33Å; Q49-Q52 WeakPolarHBondContact O-CB 3.47Å; Q49-Q52 PolarHBondContact O-N 3.47Å; Q49-Q52 VanDerWaalsContact O-N 3.16Å; Q49-D53 VanDerWaalsContact O-CG 3.32Å; Q49-D53 PolarHBondContact O-N 3.42Å
50V86.3Confident84.9Confident13 Ų1360.2 Ų60.28%0.07932%0.318CS..Hα-helixtrans-62.4-38.71771780000111.3A46 Y48 D53 L54 A226A46-V50 WeakPolarHBondContact O-CG2 3.31Å; A46-V50 PolarHBondContact O-N 2.94Å; Y48-V50 PolarHBondContact O-N 3.2Å; V50-D53 PolarHBondContact O-N 3.39Å; V50-L54 WeakPolarHBondContact O-CG 3.29Å; V50-L54 PolarHBondContact O-N 3.35Å; V50-L54 VanDerWaalsContact O-N 3.14Å; V50-A226 HydrophobicContact CG1-CB 3.61Å
51G86.3Confident85.8Confident13 Ų1354.8 Ų54.813%0.13429%0.289CS..Hα-helixtrans-64.7-38.4175.400000113.1S47 Y48 Q49 T55S47-G51 PolarHBondContact O-N 3.07Å; Y48-G51 WeakPolarHBondContact O-CA 3.39Å; Y48-G51 PolarHBondContact O-N 3.32Å; Q49-G51 VanDerWaalsContact C-N 3.3Å; Q49-G51 PolarHBondContact O-N 3.33Å; G51-T55 WeakPolarHBondContact O-CB 3.43Å; G51-T55 PolarHBondContact O-N 2.98Å; G51-T55 PolarHBondContact O-OG1 2.95Å
52Q91.1Very high86.5Confident99 Ų9948 Ų4846%0.46326%0.257SS..Hα-helixtrans-63.4-46.4174.7-177.6178.9-29.200111.2Y48 Q49 L54 T55 V56Y48-Q52 PolarHBondContact O-N 2.92Å; Q49-Q52 WeakPolarHBondContact O-CB 3.47Å; Q49-Q52 PolarHBondContact O-N 3.47Å; Q49-Q52 VanDerWaalsContact O-N 3.16Å; Q52-L54 VanDerWaalsContact C-N 3.34Å; Q52-L54 PolarHBondContact O-N 3.29Å; Q52-T55 PolarHBondContact O-N 3.45Å; Q52-T55 VanDerWaalsContact O-N 3.16Å; Q52-V56 HydrophobicContact CG-CG2 4.32Å; Q52-V56 WeakPolarHBondContact O-CB 3.5Å; Q52-V56 WeakPolarHBondContact O-CG2 3.49Å; Q52-V56 PolarHBondContact O-N 3.17Å
53D92.7Very high87.1Confident32 Ų3240 Ų4017%0.17122%0.223CC..Hα-helixtrans-56.8-47.1177.8-67.2-9.1000111.5Q49 V50 T55 V56 M57 F219 S222Q49-D53 VanDerWaalsContact O-CG 3.32Å; Q49-D53 PolarHBondContact O-N 3.42Å; V50-D53 PolarHBondContact O-N 3.39Å; D53-T55 VanDerWaalsContact C-N 3.34Å; D53-T55 PolarHBondContact O-N 3.27Å; D53-V56 PolarHBondContact O-N 3.26Å; D53-M57 VanDerWaalsContact O-CB 3.3Å; D53-M57 WeakPolarHBondContact O-CB 3.27Å; D53-M57 PolarHBondContact O-N 2.83Å; D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.64Å; D53-F219 HydrophobicContact CB-CE1 4.28Å; D53-F219 HydrophobicContact CB-CG 4.37Å; D53-F219 VanDerWaalsContact CG-CD1 3.48Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.5Å; D53-F219 VanDerWaalsContact OD1-CE1 3.24Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.32Å; D53-S222 WeakPolarHBondContact OD2-CB 3.44Å; D53-S222 PolarHBondContact OD2-OG 3.42Å
54L91.5Very high87.7Confident0 Ų041.2 Ų41.20%022%0.219CC..Hα-helixtrans-60.1-43.7176.7-68.4178.5000111.8V50 Q52 M57 A58 R114 T117 M118 M121 V223 A226V50-L54 WeakPolarHBondContact O-CG 3.29Å; V50-L54 PolarHBondContact O-N 3.35Å; V50-L54 VanDerWaalsContact O-N 3.14Å; Q52-L54 VanDerWaalsContact C-N 3.34Å; Q52-L54 PolarHBondContact O-N 3.29Å; L54-M57 PolarHBondContact O-N 3.26Å; L54-A58 VanDerWaalsContact O-CB 3.3Å; L54-A58 WeakPolarHBondContact O-CB 3.33Å; L54-A58 PolarHBondContact O-N 3.19Å; L54-R114 HydrophobicContact CD1-CB 3.93Å; L54-R114 HydrophobicContact CD1-CG 4.09Å; L54-T117 HydrophobicContact CB-CG2 3.83Å; L54-M118 HydrophobicContact CD1-CG 4.11Å; L54-M118 HydrophobicContact CD1-SD 4.34Å; L54-M118 HydrophobicContact CD2-CG 4.44Å; L54-M118 HydrophobicContact CD2-SD 3.6Å; L54-M121 HydrophobicContact CD2-SD 4.28Å; L54-V223 HydrophobicContact CD2-CB 4.25Å; L54-V223 HydrophobicContact CD2-CG2 3.86Å; L54-A226 HydrophobicContact CD1-CB 3.96Å; L54-A226 HydrophobicContact CD2-CB 4.24Å; L54-A226 HydrophobicContact CG-CB 4.41Å
55T92.1Very high87.9Confident66 Ų6637.9 Ų37.941%0.40520%0.202SC..Hα-helixtrans-68.1-43.6-178.3-55.20000111.6G51 Q52 D53 M57 A58 A59G51-T55 WeakPolarHBondContact O-CB 3.43Å; G51-T55 PolarHBondContact O-N 2.98Å; G51-T55 PolarHBondContact O-OG1 2.95Å; Q52-T55 PolarHBondContact O-N 3.45Å; Q52-T55 VanDerWaalsContact O-N 3.16Å; D53-T55 VanDerWaalsContact C-N 3.34Å; D53-T55 PolarHBondContact O-N 3.27Å; T55-M57 VanDerWaalsContact C-N 3.3Å; T55-M57 PolarHBondContact O-N 3.45Å; T55-A58 PolarHBondContact O-N 2.92Å; T55-A59 VanDerWaalsContact O-CB 3.31Å; T55-A59 WeakPolarHBondContact O-CB 3.38Å; T55-A59 PolarHBondContact O-N 3.02Å
56V93.8Very high87.5Confident31 Ų3135.7 Ų35.719%0.18819%0.189CC..Hα-helixtrans-60-44.7175.1167.40000110.1Q52 D53 I60 G61 F215 F219Q52-V56 HydrophobicContact CG-CG2 4.32Å; Q52-V56 WeakPolarHBondContact O-CB 3.5Å; Q52-V56 WeakPolarHBondContact O-CG2 3.49Å; Q52-V56 PolarHBondContact O-N 3.17Å; D53-V56 PolarHBondContact O-N 3.26Å; V56-I60 HydrophobicContact CG1-CD1 4.36Å; V56-I60 WeakPolarHBondContact O-CA 3.39Å; V56-I60 WeakPolarHBondContact O-CB 3.3Å; V56-I60 PolarHBondContact O-N 3.28Å; V56-G61 PolarHBondContact O-N 3.25Å; V56-F215 HydrophobicContact CG1-CD1 3.56Å; V56-F215 HydrophobicContact CG1-CE1 3.91Å; V56-F219 HydrophobicContact CG1-CD2 3.93Å; V56-F219 HydrophobicContact CG1-CE2 3.71Å; V56-F219 HydrophobicContact CG1-CZ 4.37Å
57M91.6Very high87.1Confident4 Ų434.1 Ų34.12%0.0218%0.175CC..Iπ-helixtrans-67.4-39.3-179.8-160.3-164.967.500112.6D53 L54 T55 G61 L62 M121 L216 F219 V223D53-M57 VanDerWaalsContact O-CB 3.3Å; D53-M57 WeakPolarHBondContact O-CB 3.27Å; D53-M57 PolarHBondContact O-N 2.83Å; L54-M57 PolarHBondContact O-N 3.26Å; T55-M57 VanDerWaalsContact C-N 3.3Å; T55-M57 PolarHBondContact O-N 3.45Å; M57-G61 CarbonylContact O-C 3.41Å; M57-G61 WeakPolarHBondContact O-CA 3.36Å; M57-G61 PolarHBondContact O-N 2.99Å; M57-G61 VanDerWaalsContact O-N 3.1Å; M57-L62 PolarHBondContact O-N 3.07Å; M57-M121 HydrophobicContact CE-CE 3.05Å; M57-M121 HydrophobicContact CE-SD 3.84Å; M57-L216 HydrophobicContact CE-CD2 4.2Å; M57-L216 HydrophobicContact CG-CD2 3.48Å; M57-L216 VanDerWaalsContact CG-CD2 3.48Å; M57-L216 HydrophobicContact CG-CG 4.25Å; M57-L216 HydrophobicContact SD-CD2 3.72Å; M57-F219 HydrophobicContact CB-CB 4.13Å; M57-F219 HydrophobicContact CG-CB 4.31Å; M57-V223 HydrophobicContact CE-CB 4.37Å; M57-V223 HydrophobicContact CE-CG1 4.38Å; M57-V223 HydrophobicContact CE-CG2 3.13Å; M57-V223 HydrophobicContact SD-CG2 3.19Å; M57-V223 WeakPolarHBondContact SD-CG2 3.42Å
58A91.8Very high86.3Confident0 Ų034.2 Ų34.20%018%0.176CC..Iπ-helixtrans-66.8-53.7176.300000111.6L54 T55 N80 L84 M121 L124L54-A58 VanDerWaalsContact O-CB 3.3Å; L54-A58 WeakPolarHBondContact O-CB 3.33Å; L54-A58 PolarHBondContact O-N 3.19Å; T55-A58 PolarHBondContact O-N 2.92Å; A58-N80 PolarHBondContact O-OD1 3.42Å; A58-L84 HydrophobicContact CB-CD1 3.71Å; A58-L84 HydrophobicContact CB-CD2 3.62Å; A58-L84 HydrophobicContact CB-CG 4.29Å; A58-M121 HydrophobicContact CB-CG 3.58Å; A58-M121 HydrophobicContact CB-SD 4.17Å; A58-L124 HydrophobicContact CB-CD1 3.83Å
59A91.9Very high85.4Confident19 Ų1930.7 Ų30.716%0.15716%0.164CC..Iπ-helixtrans-74-49.9-173.400000112.9T55 L81 L84T55-A59 VanDerWaalsContact O-CB 3.31Å; T55-A59 WeakPolarHBondContact O-CB 3.38Å; T55-A59 PolarHBondContact O-N 3.02Å; A59-L81 HydrophobicContact CB-CD1 4.15Å; A59-L84 HydrophobicContact CB-CD2 3.84Å
60I91.2Very high84.1Confident57 Ų5730.6 Ų30.629%0.29216%0.159SC..Iπ-helixtrans-89.6-52-176.2-55.7-178.8000109.5V56 F64 F215V56-I60 HydrophobicContact CG1-CD1 4.36Å; V56-I60 WeakPolarHBondContact O-CA 3.39Å; V56-I60 WeakPolarHBondContact O-CB 3.3Å; V56-I60 PolarHBondContact O-N 3.28Å; I60-F64 HydrophobicContact CG2-CD2 3.79Å; I60-F64 HydrophobicContact CG2-CE2 4.21Å; I60-F64 VanDerWaalsContact O-CB 3.26Å; I60-F64 WeakPolarHBondContact O-CB 3.35Å; I60-F64 WeakPolarHBondContact O-CD2 3.39Å; I60-F64 PolarHBondContact O-N 3.15Å; I60-F215 HydrophobicContact CB-CG 4.47Å; I60-F215 HydrophobicContact CG2-CB 4.49Å; I60-F215 HydrophobicContact CG2-CD1 4.37Å; I60-F215 HydrophobicContact CG2-CD2 3.55Å; I60-F215 HydrophobicContact CG2-CE2 3.78Å; I60-F215 HydrophobicContact CG2-CG 3.88Å; I60-F215 HydrophobicContact CG2-CZ 4.31Å
61G89.8Confident83.2Confident0 Ų034 Ų340%017%0.17CC..Iπ-helixtrans-56.1-67.9-17700000112.7V56 M57 G63 L65 G212V56-G61 PolarHBondContact O-N 3.25Å; M57-G61 CarbonylContact O-C 3.41Å; M57-G61 WeakPolarHBondContact O-CA 3.36Å; M57-G61 PolarHBondContact O-N 2.99Å; M57-G61 VanDerWaalsContact O-N 3.1Å; G61-G63 PolarHBondContact O-N 2.81Å; G61-L65 WeakPolarHBondContact O-CB 3.45Å; G61-L65 PolarHBondContact O-N 2.94Å; G61-G212 VanDerWaalsContact O-CA 3.32Å; G61-G212 WeakPolarHBondContact O-CA 3.33Å
62L88.2Confident82.5Confident11 Ų1133.5 Ų33.56%0.05816%0.164CC..Iπ-helixtrans-68.1-33.3-178.7-63.3175.4000112.9M57 L65 T66 N80 L124 M125 L216M57-L62 PolarHBondContact O-N 3.07Å; L62-L65 HydrophobicContact CD2-CD2 4.26Å; L62-T66 PolarHBondContact O-N 2.89Å; L62-T66 PolarHBondContact O-OG1 3.42Å; L62-N80 VanDerWaalsContact C-ND2 3.28Å; L62-N80 PolarHBondContact O-ND2 3.12Å; L62-L124 HydrophobicContact CB-CB 4.38Å; L62-L124 HydrophobicContact CD1-CB 3.59Å; L62-L124 HydrophobicContact CD1-CD1 4.01Å; L62-L124 HydrophobicContact CD1-CG 4.47Å; L62-M125 HydrophobicContact CD1-CG 4.09Å; L62-M125 HydrophobicContact CD2-CG 4.36Å; L62-L216 HydrophobicContact CD2-CD1 4.2Å; L62-L216 HydrophobicContact CD2-CD2 3.8Å; L62-L216 HydrophobicContact CG-CD2 4.08Å
63G86.1Confident81.8Confident0 Ų030.3 Ų30.30%015%0.153CC..Hα-helixtrans-63.4-47.2179.100000112.8G61 T66 S76 N80G61-G63 PolarHBondContact O-N 2.81Å; G63-T66 PolarHBondContact O-OG1 3.02Å; G63-S76 PolarHBondContact O-OG 3.03Å; G63-N80 VanDerWaalsContact CA-ND2 3.34Å; G63-N80 WeakPolarHBondContact CA-ND2 3.36Å; G63-N80 PolarHBondContact N-ND2 3.16Å; G63-N80 VanDerWaalsContact N-ND2 3.18Å
64F86.8Confident81.3Confident58 Ų5836.5 Ų36.525%0.25417%0.174SC..Hα-helixtrans-78.9-31.9177.9-83.5-83.7000112.8I60 T66 S67 V77 S208 A209I60-F64 HydrophobicContact CG2-CD2 3.79Å; I60-F64 HydrophobicContact CG2-CE2 4.21Å; I60-F64 VanDerWaalsContact O-CB 3.26Å; I60-F64 WeakPolarHBondContact O-CB 3.35Å; I60-F64 WeakPolarHBondContact O-CD2 3.39Å; I60-F64 PolarHBondContact O-N 3.15Å; F64-T66 VanDerWaalsContact C-N 3.25Å; F64-T66 PolarHBondContact O-N 2.72Å; F64-S67 VanDerWaalsContact O-CB 3.24Å; F64-S67 WeakPolarHBondContact O-CB 3.21Å; F64-S67 PolarHBondContact O-N 2.88Å; F64-S67 PolarHBondContact O-OG 2.75Å; F64-V77 HydrophobicContact CD1-CG2 4.19Å; F64-V77 HydrophobicContact CD2-CG2 4.31Å; F64-V77 HydrophobicContact CE1-CG2 4.18Å; F64-V77 HydrophobicContact CE2-CG1 4.26Å; F64-V77 HydrophobicContact CE2-CG2 4.3Å; F64-V77 HydrophobicContact CG-CG2 4.27Å; F64-V77 HydrophobicContact CZ-CG2 4.23Å; F64-S208 WeakPolarHBondContact CB-O 3.47Å; F64-A209 WeakPolarHBondContact O-CA 3.29Å
65L81.3Confident80.9Confident11 Ų1136.5 Ų36.56%0.05817%0.174CC..Hα-helixtrans-58.9-39.2178.3-176.572.6000112.6G61 L62 S67 A213 L216 L275 M328G61-L65 WeakPolarHBondContact O-CB 3.45Å; G61-L65 PolarHBondContact O-N 2.94Å; L62-L65 HydrophobicContact CD2-CD2 4.26Å; L65-S67 PolarHBondContact O-N 3.42Å; L65-A213 HydrophobicContact CD1-CB 4.02Å; L65-L216 HydrophobicContact CB-CD1 3.89Å; L65-L216 HydrophobicContact CD1-CD1 4.01Å; L65-L216 HydrophobicContact CD2-CD1 3.31Å; L65-L216 HydrophobicContact CG-CD1 3.93Å; L65-L275 HydrophobicContact CD1-CD1 4.23Å; L65-L275 HydrophobicContact CD2-CD1 4.46Å; L65-M328 HydrophobicContact CD1-CE 3.68Å; L65-M328 HydrophobicContact CD1-SD 4.15Å; L65-M328 HydrophobicContact CD2-CE 3.1Å; L65-M328 HydrophobicContact CD2-SD 3.78Å; L65-M328 HydrophobicContact CG-CE 3.61Å; L65-M328 HydrophobicContact CG-SD 3.84Å
66T73.6Confident80.4Confident25 Ų2533.4 Ų33.415%0.15316%0.155CC..G310 helixtrans-78-8.1177.847.10000113.3L62 G63 F64 S68 S76L62-T66 PolarHBondContact O-N 2.89Å; L62-T66 PolarHBondContact O-OG1 3.42Å; G63-T66 PolarHBondContact O-OG1 3.02Å; F64-T66 VanDerWaalsContact C-N 3.25Å; F64-T66 PolarHBondContact O-N 2.72Å; T66-S68 PolarHBondContact O-N 2.93Å; T66-S68 VanDerWaalsContact O-N 3.12Å; T66-S76 VanDerWaalsContact CB-OG 3.29Å; T66-S76 WeakPolarHBondContact CB-OG 3.46Å; T66-S76 PolarHBondContact O-OG 3.39Å; T66-S76 PolarHBondContact OG1-OG 3.43Å
67S71.4Confident80.2Confident1 Ų133.9 Ų33.91%0.00716%0.158CC..G310 helixtrans-80.418.4-179.280.20000114.7F64 L65 F69 S73 S76 S206 S208F64-S67 VanDerWaalsContact O-CB 3.24Å; F64-S67 WeakPolarHBondContact O-CB 3.21Å; F64-S67 PolarHBondContact O-N 2.88Å; F64-S67 PolarHBondContact O-OG 2.75Å; L65-S67 PolarHBondContact O-N 3.42Å; S67-F69 PolarHBondContact O-N 3.42Å; S67-S73 PolarHBondContact O-OG 2.86Å; S67-S73 VanDerWaalsContact O-OG 3.11Å; S67-S76 PolarHBondContact N-OG 3.27Å; S67-S76 VanDerWaalsContact N-OG 3.15Å; S67-S206 PolarHBondContact O-OG 2.71Å; S67-S208 WeakPolarHBondContact OG-CB 3.24Å; S67-S208 PolarHBondContact OG-OG 3.3Å
68S62.9Low80.1Confident28 Ų2835.3 Ų35.320%0.19617%0.17CC..G310 helixtrans-67.6-15.4-178.157.70000114.1T66 T203T66-S68 PolarHBondContact O-N 2.93Å; T66-S68 VanDerWaalsContact O-N 3.12Å; S68-T203 WeakPolarHBondContact O-CG2 3.42Å
69F64.3Low80Confident70 Ų7036 Ų3631%0.30717%0.174SC..SBendtrans-86.8122.6178.2-61.9-70.9000111.9S67 R71 H72 S73 F402S67-F69 PolarHBondContact O-N 3.42Å; F69-R71 PolarHBondContact O-N 3.12Å; F69-R71 VanDerWaalsContact O-N 3.08Å; F69-H72 HydrophobicContact CB-CB 3.91Å; F69-H72 PolarHBondContact O-N 3.45Å; F69-S73 PolarHBondContact O-N 2.95Å; F69-S73 PolarHBondContact O-OG 3.43Å; F69-S73 VanDerWaalsContact O-OG 3.12Å; F69-F402 HydrophobicContact CD1-CD1 4.15Å; F69-F402 AromaticContact CD2-CD1 3.82Å; F69-F402 HydrophobicContact CD2-CD1 3.82Å; F69-F402 HydrophobicContact CD2-CE1 4.18Å; F69-F402 HydrophobicContact CE1-CD1 4.2Å; F69-F402 HydrophobicContact CE1-CE1 4.22Å; F69-F402 AromaticContact CE2-CD1 3.86Å; F69-F402 HydrophobicContact CE2-CD1 3.86Å; F69-F402 AromaticContact CE2-CE1 3.73Å; F69-F402 HydrophobicContact CE2-CE1 3.73Å; F69-F402 AromaticContact CG-CD1 3.97Å; F69-F402 HydrophobicContact CG-CD1 3.97Å; F69-F402 HydrophobicContact CZ-CD1 4.05Å; F69-F402 AromaticContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CZ 4.45Å
70R61.7Low80Confident104 Ų10435.3 Ų35.339%0.39217%0.167SC..THydrogen-bonded Turntrans-52-34.6-174.6-169.5179.7-178.1-162.5-1.8114.8F417R70-F417 PolarHBondContact NH1-O 3.14Å; R70-F417 PolarHBondContact NH1-OXT 2.93Å; R70-F417 PolarHBondContact NH2-O 3.37Å; R70-F417 PolarHBondContact NH2-OXT 3.03Å
71R67.1Low80.1Confident85 Ų8537.2 Ų37.232%0.32118%0.177SC..THydrogen-bonded Turntrans-109.19.5-178.2-66.8-171.6179.7178.93.6114F69 F402 D403 D404F69-R71 PolarHBondContact O-N 3.12Å; F69-R71 VanDerWaalsContact O-N 3.08Å; R71-F402 CarbonylContact C-O 3.58Å; R71-D403 CarbonylContact O-C 3.48Å; R71-D404 WeakPolarHBondContact O-CA 3.4Å; R71-D404 WeakPolarHBondContact O-CB 3.41Å; R71-D404 PolarHBondContact O-N 3.36Å
72H72.3Confident80.3Confident2 Ų240.3 Ų40.31%0.00919%0.191CC..THydrogen-bonded Turntrans-126.210.4-179-168.1-94.2000113.6F69 W74 S75 S76 G132 F402 D404F69-H72 HydrophobicContact CB-CB 3.91Å; F69-H72 PolarHBondContact O-N 3.45Å; H72-W74 VanDerWaalsContact C-N 3.33Å; H72-W74 PolarHBondContact O-N 2.97Å; H72-S75 WeakPolarHBondContact NE2-CB 3.49Å; H72-S76 VanDerWaalsContact O-CB 3.27Å; H72-S76 WeakPolarHBondContact O-CB 3.4Å; H72-S76 PolarHBondContact O-N 3.11Å; H72-G132 PolarHBondContact CE1-N 3.4Å; H72-G132 WeakPolarHBondContact NE2-CA 3.21Å; H72-G132 PolarHBondContact NE2-N 3.4Å; H72-F402 HydrophobicContact CB-CB 4.36Å; H72-D404 VanDerWaalsContact CA-CG 3.42Å; H72-D404 WeakPolarHBondContact CA-OD1 3.37Å; H72-D404 VanDerWaalsContact CA-OD2 3.23Å; H72-D404 WeakPolarHBondContact CA-OD2 3.39Å; H72-D404 IonicContact CD2-OD1 2.62Å
73S76.4Confident80.6Confident33 Ų3339.8 Ų39.823%0.23119%0.188CC..Hα-helixtrans-65.2-32.6-174.1-53.70000113.3S67 F69 S76 V77 D404S67-S73 PolarHBondContact O-OG 2.86Å; S67-S73 VanDerWaalsContact O-OG 3.11Å; F69-S73 PolarHBondContact O-N 2.95Å; F69-S73 PolarHBondContact O-OG 3.43Å; F69-S73 VanDerWaalsContact O-OG 3.12Å; S73-S76 WeakPolarHBondContact O-CB 3.3Å; S73-V77 PolarHBondContact O-N 2.96Å; S73-D404 PolarHBondContact N-OD2 3.33Å; S73-D404 VanDerWaalsContact N-OD2 3.13Å
74W80.9Confident81Confident162 Ų16240.2 Ų40.261%0.61419%0.191SC*.Hα-helixtrans-72.1-49.4-179.3-7271.2000111.5H72 S76 V77 A78 D404 W408H72-W74 VanDerWaalsContact C-N 3.33Å; H72-W74 PolarHBondContact O-N 2.97Å; W74-S76 PolarHBondContact O-N 3Å; W74-V77 PolarHBondContact O-N 2.72Å; W74-A78 VanDerWaalsContact O-CB 3.29Å; W74-A78 WeakPolarHBondContact O-CB 3.3Å; W74-A78 PolarHBondContact O-N 3.18Å; W74-D404 WeakPolarHBondContact CB-OD2 3.32Å; W74-D404 PolarHBondContact N-OD2 3.01Å; W74-W408 HydrophobicContact CB-CD2 4.1Å; W74-W408 HydrophobicContact CB-CG 4.2Å; W74-W408 HydrophobicContact CE3-CE3 4.13Å; W74-W408 HydrophobicContact CE3-CZ3 4.33Å
75S83.7Confident81.5Confident0 Ų040.1 Ų40.10%020%0.2CC..Hα-helixtrans-61.4-36.1175.2-60.10000111.1H72 F79 D404 W408H72-S75 WeakPolarHBondContact NE2-CB 3.49Å; S75-F79 WeakPolarHBondContact O-CB 3.48Å; S75-F79 WeakPolarHBondContact O-CD2 3.13Å; S75-F79 WeakPolarHBondContact O-CG 3.39Å; S75-F79 PolarHBondContact O-N 2.7Å; S75-D404 WeakPolarHBondContact CB-OD1 3.17Å; S75-D404 PolarHBondContact N-OD1 3.07Å; S75-D404 PolarHBondContact OG-OD1 3.14Å; S75-W408 PolarHBondContact OG-NE1 3.42Å
76S82.7Confident82.1Confident0 Ų039.9 Ų39.90%020%0.199CC..Hα-helixtrans-56.9-54.3178.1-164.20000112.7G63 T66 S67 H72 S73 W74 N80 L131G63-S76 PolarHBondContact O-OG 3.03Å; T66-S76 VanDerWaalsContact CB-OG 3.29Å; T66-S76 WeakPolarHBondContact CB-OG 3.46Å; T66-S76 PolarHBondContact O-OG 3.39Å; T66-S76 PolarHBondContact OG1-OG 3.43Å; S67-S76 PolarHBondContact N-OG 3.27Å; S67-S76 VanDerWaalsContact N-OG 3.15Å; H72-S76 VanDerWaalsContact O-CB 3.27Å; H72-S76 WeakPolarHBondContact O-CB 3.4Å; H72-S76 PolarHBondContact O-N 3.11Å; S73-S76 WeakPolarHBondContact O-CB 3.3Å; W74-S76 PolarHBondContact O-N 3Å; S76-N80 WeakPolarHBondContact O-CB 3.39Å; S76-N80 PolarHBondContact O-N 3.41Å; S76-L131 WeakPolarHBondContact OG-CD2 3.39Å
77V87.7Confident83.2Confident42 Ų4238.7 Ų38.726%0.25519%0.192SC..Hα-helixtrans-72.5-46.5-176.5178.30000110.9F64 S73 W74 N80 L81F64-V77 HydrophobicContact CD1-CG2 4.19Å; F64-V77 HydrophobicContact CD2-CG2 4.31Å; F64-V77 HydrophobicContact CE1-CG2 4.18Å; F64-V77 HydrophobicContact CE2-CG1 4.26Å; F64-V77 HydrophobicContact CE2-CG2 4.3Å; F64-V77 HydrophobicContact CG-CG2 4.27Å; F64-V77 HydrophobicContact CZ-CG2 4.23Å; S73-V77 PolarHBondContact O-N 2.96Å; W74-V77 PolarHBondContact O-N 2.72Å; V77-N80 PolarHBondContact O-N 3.43Å; V77-L81 PolarHBondContact O-N 3.22Å
78A89.9Confident84.4Confident33 Ų3340 Ų4027%0.27320%0.199SC..Hα-helixtrans-69.9-42.7-175.200000113W74 N80 L81 F82 W408W74-A78 VanDerWaalsContact O-CB 3.29Å; W74-A78 WeakPolarHBondContact O-CB 3.3Å; W74-A78 PolarHBondContact O-N 3.18Å; A78-N80 VanDerWaalsContact C-N 3.31Å; A78-L81 PolarHBondContact O-N 2.93Å; A78-F82 WeakPolarHBondContact O-CB 3.34Å; A78-F82 PolarHBondContact O-N 2.82Å; A78-W408 HydrophobicContact CB-CH2 3.52Å; A78-W408 HydrophobicContact CB-CZ2 3.41Å; A78-W408 VanDerWaalsContact CB-CZ2 3.41Å
79F90.4Very high85.9Confident16 Ų1641.1 Ų41.17%0.0720%0.202CC..Hα-helixtrans-69.8-33.2177.2-61.1-11.5000111.1S75 F82 M83 L136 L139 F407 W408S75-F79 WeakPolarHBondContact O-CB 3.48Å; S75-F79 WeakPolarHBondContact O-CD2 3.13Å; S75-F79 WeakPolarHBondContact O-CG 3.39Å; S75-F79 PolarHBondContact O-N 2.7Å; F79-F82 PolarHBondContact O-N 3.34Å; F79-M83 WeakPolarHBondContact O-CB 3.34Å; F79-M83 WeakPolarHBondContact O-CE 3.37Å; F79-M83 VanDerWaalsContact O-CG 3.27Å; F79-M83 WeakPolarHBondContact O-CG 3.32Å; F79-M83 PolarHBondContact O-N 3.22Å; F79-L136 HydrophobicContact CB-CD1 4.2Å; F79-L136 HydrophobicContact CD1-CD1 3.69Å; F79-L136 HydrophobicContact CD1-CG 4.49Å; F79-L136 HydrophobicContact CE1-CB 4.22Å; F79-L136 HydrophobicContact CE1-CD1 4.2Å; F79-L136 HydrophobicContact CE1-CD2 4.49Å; F79-L136 HydrophobicContact CG-CD1 3.94Å; F79-L136 HydrophobicContact CZ-CB 4.33Å; F79-L139 HydrophobicContact CB-CD1 3.74Å; F79-L139 HydrophobicContact CD2-CD1 3.74Å; F79-L139 HydrophobicContact CG-CD1 4.04Å; F79-F407 HydrophobicContact CE2-CD2 4.12Å; F79-F407 HydrophobicContact CE2-CE2 4.22Å; F79-F407 HydrophobicContact CZ-CB 4.22Å; F79-F407 HydrophobicContact CZ-CD1 4.36Å; F79-F407 AromaticContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CE2 4.43Å; F79-F407 AromaticContact CZ-CG 3.92Å; F79-F407 HydrophobicContact CZ-CG 3.92Å; F79-W408 HydrophobicContact CE1-CZ2 4.44Å
80N91.7Very high87.4Confident3 Ų340.1 Ų40.12%0.01620%0.196CC..Hα-helixtrans-61-51173.1-173.4-52.7000111.4A58 L62 G63 S76 V77 A78 F82 M83 L84 L124A58-N80 PolarHBondContact O-OD1 3.42Å; L62-N80 VanDerWaalsContact C-ND2 3.28Å; L62-N80 PolarHBondContact O-ND2 3.12Å; G63-N80 VanDerWaalsContact CA-ND2 3.34Å; G63-N80 WeakPolarHBondContact CA-ND2 3.36Å; G63-N80 PolarHBondContact N-ND2 3.16Å; G63-N80 VanDerWaalsContact N-ND2 3.18Å; S76-N80 WeakPolarHBondContact O-CB 3.39Å; S76-N80 PolarHBondContact O-N 3.41Å; V77-N80 PolarHBondContact O-N 3.43Å; A78-N80 VanDerWaalsContact C-N 3.31Å; N80-F82 VanDerWaalsContact C-N 3.28Å; N80-F82 PolarHBondContact O-N 3.46Å; N80-M83 PolarHBondContact O-N 3.23Å; N80-L84 WeakPolarHBondContact O-CB 3.15Å; N80-L84 PolarHBondContact O-N 3.1Å; N80-L124 HydrophobicContact CB-CD2 4.45Å; N80-L124 WeakPolarHBondContact O-CD2 3.41Å; N80-L124 VanDerWaalsContact OD1-CD1 3.31Å; N80-L124 WeakPolarHBondContact OD1-CD1 3.13Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.41Å
81L93.5Very high88.9Confident98 Ų9835.1 Ų35.151%0.51318%0.177SC..Hα-helixtrans-58.9-41176.5-17862.6000112.2A59 V77 A78 L84 A85A59-L81 HydrophobicContact CB-CD1 4.15Å; V77-L81 PolarHBondContact O-N 3.22Å; A78-L81 PolarHBondContact O-N 2.93Å; L81-L84 PolarHBondContact O-N 2.96Å; L81-A85 PolarHBondContact O-N 3.26Å
82F93.8Very high90.1Very high65 Ų6531.8 Ų31.829%0.28517%0.165SC..Hα-helixtrans-62.6-47.3176.6-180-85.2000112.2A17 A78 F79 N80 L84 A85 L86 L136 V140A17-F82 HydrophobicContact CB-CZ 4.4Å; A78-F82 WeakPolarHBondContact O-CB 3.34Å; A78-F82 PolarHBondContact O-N 2.82Å; F79-F82 PolarHBondContact O-N 3.34Å; N80-F82 VanDerWaalsContact C-N 3.28Å; N80-F82 PolarHBondContact O-N 3.46Å; F82-L84 VanDerWaalsContact C-N 3.3Å; F82-L84 PolarHBondContact O-N 3.05Å; F82-A85 PolarHBondContact O-N 3.49Å; F82-L86 HydrophobicContact CE1-CD2 4.16Å; F82-L86 WeakPolarHBondContact O-CB 3.36Å; F82-L86 PolarHBondContact O-N 3.07Å; F82-L136 HydrophobicContact CB-CD1 4.35Å; F82-L136 HydrophobicContact CD1-CD1 3.55Å; F82-L136 HydrophobicContact CD1-CD2 4.49Å; F82-L136 HydrophobicContact CD1-CG 4.26Å; F82-L136 HydrophobicContact CE1-CD1 4.04Å; F82-L136 HydrophobicContact CE1-CG 4.3Å; F82-L136 HydrophobicContact CG-CD1 3.96Å; F82-L136 HydrophobicContact CG-CD2 4.48Å; F82-V140 HydrophobicContact CE1-CG2 3.51Å; F82-V140 HydrophobicContact CZ-CG2 3.97Å
83M94.3Very high91Very high0 Ų031.7 Ų31.70%017%0.165CC..Hα-helixtrans-62.1-38.2176.7-73.4-175.4-66.700112F79 N80 G87 L124 A127 L131 L139 V143F79-M83 WeakPolarHBondContact O-CB 3.34Å; F79-M83 WeakPolarHBondContact O-CE 3.37Å; F79-M83 VanDerWaalsContact O-CG 3.27Å; F79-M83 WeakPolarHBondContact O-CG 3.32Å; F79-M83 PolarHBondContact O-N 3.22Å; N80-M83 PolarHBondContact O-N 3.23Å; M83-G87 WeakPolarHBondContact O-CA 3.38Å; M83-G87 PolarHBondContact O-N 3.47Å; M83-L124 HydrophobicContact CB-CD2 3.71Å; M83-L124 HydrophobicContact CE-CD2 3.97Å; M83-A127 HydrophobicContact CE-CB 3.68Å; M83-A127 HydrophobicContact SD-CB 3.78Å; M83-L131 HydrophobicContact CE-CD1 4.1Å; M83-L139 HydrophobicContact CE-CD1 4.3Å; M83-L139 HydrophobicContact CG-CB 4.13Å; M83-L139 HydrophobicContact SD-CB 3.88Å; M83-L139 HydrophobicContact SD-CD1 4.03Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.07Å; M83-V143 HydrophobicContact CB-CG2 3.75Å; M83-V143 HydrophobicContact CG-CG2 3.64Å; M83-V143 HydrophobicContact SD-CG2 4.3Å
84L95.8Very high91.6Very high9 Ų930.7 Ų30.75%0.04716%0.157CC..Hα-helixtrans-61.9-51.1175.7179.258.4000111.3A58 A59 N80 L81 F82 L86 G87 V88 T117 A120 L124A58-L84 HydrophobicContact CB-CD1 3.71Å; A58-L84 HydrophobicContact CB-CD2 3.62Å; A58-L84 HydrophobicContact CB-CG 4.29Å; A59-L84 HydrophobicContact CB-CD2 3.84Å; N80-L84 WeakPolarHBondContact O-CB 3.15Å; N80-L84 PolarHBondContact O-N 3.1Å; L81-L84 PolarHBondContact O-N 2.96Å; F82-L84 VanDerWaalsContact C-N 3.3Å; F82-L84 PolarHBondContact O-N 3.05Å; L84-L86 PolarHBondContact O-N 3.33Å; L84-G87 PolarHBondContact O-N 2.85Å; L84-V88 HydrophobicContact CD1-CG2 4Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.12Å; L84-V88 PolarHBondContact O-N 2.9Å; L84-T117 HydrophobicContact CD1-CG2 4.43Å; L84-A120 HydrophobicContact CD1-CB 3.88Å; L84-L124 HydrophobicContact CB-CD1 4.21Å; L84-L124 HydrophobicContact CD1-CD1 4.22Å
85A95.4Very high91.8Very high55 Ų5523.5 Ų23.546%0.45513%0.131SC..Hα-helixtrans-59.3-49.7-179.300000111.5L81 F82 Q89L81-A85 PolarHBondContact O-N 3.26Å; F82-A85 PolarHBondContact O-N 3.49Å; A85-Q89 WeakPolarHBondContact O-CG 3.23Å; A85-Q89 PolarHBondContact O-N 3.22Å
86L95.6Very high91.8Very high7 Ų723.7 Ų23.74%0.03713%0.132CC..Hα-helixtrans-63.8-44.7178178.964.9000111.9L20 L24 F82 L84 V88 Q89 W90 V140 V143L20-L86 HydrophobicContact CD2-CD1 3.61Å; L20-L86 HydrophobicContact CD2-CD2 4.02Å; L20-L86 HydrophobicContact CD2-CG 4.48Å; L20-L86 HydrophobicContact CG-CD1 4.16Å; L24-L86 HydrophobicContact CD1-CD1 3.63Å; F82-L86 HydrophobicContact CE1-CD2 4.16Å; F82-L86 WeakPolarHBondContact O-CB 3.36Å; F82-L86 PolarHBondContact O-N 3.07Å; L84-L86 PolarHBondContact O-N 3.33Å; L86-V88 PolarHBondContact O-N 3.33Å; L86-Q89 PolarHBondContact O-N 3.38Å; L86-W90 WeakPolarHBondContact O-CB 3.39Å; L86-W90 PolarHBondContact O-N 3.38Å; L86-V140 HydrophobicContact CD2-CB 4.28Å; L86-V140 HydrophobicContact CD2-CG1 3.95Å; L86-V140 HydrophobicContact CD2-CG2 4.25Å; L86-V143 HydrophobicContact CB-CG1 4.43Å; L86-V143 HydrophobicContact CD2-CB 4.18Å; L86-V143 HydrophobicContact CD2-CG1 4.05Å; L86-V143 HydrophobicContact CG-CG1 4.02Å
87G96.2Very high91.8Very high0 Ų025.9 Ų25.90%014%0.142CC..Hα-helixtrans-63.5-39.8-177.400000112.5M83 L84 A91M83-G87 WeakPolarHBondContact O-CA 3.38Å; M83-G87 PolarHBondContact O-N 3.47Å; L84-G87 PolarHBondContact O-N 2.85Å; G87-A91 WeakPolarHBondContact O-CB 3.43Å; G87-A91 PolarHBondContact O-N 2.59Å
88V95.5Very high91.5Very high28 Ų2826 Ų2617%0.1714%0.141CC..Hα-helixtrans-64.5-49.4176.9170.20000110.9L84 L86 W90 A91 I92 A116 A120L84-V88 HydrophobicContact CD1-CG2 4Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.12Å; L84-V88 PolarHBondContact O-N 2.9Å; L86-V88 PolarHBondContact O-N 3.33Å; V88-W90 VanDerWaalsContact C-N 3.33Å; V88-W90 PolarHBondContact O-N 2.91Å; V88-A91 PolarHBondContact O-N 3.18Å; V88-I92 HydrophobicContact CG1-CD1 4.09Å; V88-I92 WeakPolarHBondContact O-CG1 3.42Å; V88-I92 PolarHBondContact O-N 3.28Å; V88-A116 HydrophobicContact CG1-CB 4.21Å; V88-A120 HydrophobicContact CG2-CB 3.93Å
89Q95.5Very high90.6Very high51 Ų5126.5 Ų26.524%0.23814%0.142CC..Hα-helixtrans-58.9-46.5178.9-70177-10.200111.3E21 L24 F28 A85 L86 L93E21-Q89 PolarHBondContact OE1-NE2 3.49Å; E21-Q89 PolarHBondContact OE1-OE1 3.48Å; E21-Q89 PolarHBondContact OE2-OE1 2.94Å; L24-Q89 HydrophobicContact CD1-CB 4.3Å; F28-Q89 HydrophobicContact CE2-CB 4.08Å; F28-Q89 WeakPolarHBondContact CE2-O 3.24Å; F28-Q89 HydrophobicContact CZ-CB 4.37Å; A85-Q89 WeakPolarHBondContact O-CG 3.23Å; A85-Q89 PolarHBondContact O-N 3.22Å; L86-Q89 PolarHBondContact O-N 3.38Å; Q89-L93 PolarHBondContact O-N 3.14Å
90W95.6Very high89.4Confident49 Ų4928.4 Ų28.419%0.18615%0.151CC..Hα-helixtrans-67.2-39.9180-175.9-128.4000112.6L24 L86 V88 L93 L94 L144 T148L24-W90 HydrophobicContact CD2-CE3 4.05Å; L86-W90 WeakPolarHBondContact O-CB 3.39Å; L86-W90 PolarHBondContact O-N 3.38Å; V88-W90 VanDerWaalsContact C-N 3.33Å; V88-W90 PolarHBondContact O-N 2.91Å; W90-L93 HydrophobicContact CE3-CD1 4.48Å; W90-L93 PolarHBondContact O-N 3.29Å; W90-L94 HydrophobicContact CD2-CD1 4.02Å; W90-L94 HydrophobicContact CD2-CG 4.02Å; W90-L94 VanDerWaalsContact CE2-CD1 3.42Å; W90-L94 HydrophobicContact CG-CD1 4.09Å; W90-L94 HydrophobicContact CG-CG 4.48Å; W90-L94 HydrophobicContact CH2-CD2 4.11Å; W90-L94 HydrophobicContact CH2-CG 4.27Å; W90-L94 HydrophobicContact CZ2-CD1 3.9Å; W90-L94 HydrophobicContact CZ2-CD2 3.67Å; W90-L94 HydrophobicContact CZ2-CG 3.75Å; W90-L94 WeakPolarHBondContact O-CB 3.26Å; W90-L94 WeakPolarHBondContact O-CG 3.45Å; W90-L94 PolarHBondContact O-N 3.44Å; W90-L144 HydrophobicContact CB-CD2 4.42Å; W90-L144 HydrophobicContact CD2-CD2 3.85Å; W90-L144 HydrophobicContact CG-CD2 3.77Å; W90-L144 PolarHBondContact NE1-O 3.07Å; W90-L144 VanDerWaalsContact NE1-O 3.14Å; W90-T148 PolarHBondContact NE1-OG1 2.67Å
91A93.4Very high87.6Confident0 Ų035.2 Ų35.20%018%0.181CC..Hα-helixtrans-64.9-39.1178.300000112.7G87 V88 L94 D95 A116 V147G87-A91 WeakPolarHBondContact O-CB 3.43Å; G87-A91 PolarHBondContact O-N 2.59Å; V88-A91 PolarHBondContact O-N 3.18Å; A91-L94 PolarHBondContact O-N 3.09Å; A91-D95 WeakPolarHBondContact O-CB 3.24Å; A91-D95 PolarHBondContact O-N 2.75Å; A91-A116 HydrophobicContact CB-CB 3.75Å; A91-V147 HydrophobicContact CB-CG1 3.61Å
92I92.1Very high85.9Confident15 Ų1537 Ų378%0.07720%0.198CC..Hα-helixtrans-60.6-48175.9-68.7171.2000110.6F28 V88 G96 I108 I113 A116F28-I92 HydrophobicContact CE1-CG2 4.05Å; F28-I92 HydrophobicContact CZ-CB 4.11Å; F28-I92 HydrophobicContact CZ-CG2 4.06Å; V88-I92 HydrophobicContact CG1-CD1 4.09Å; V88-I92 WeakPolarHBondContact O-CG1 3.42Å; V88-I92 PolarHBondContact O-N 3.28Å; I92-G96 PolarHBondContact O-N 2.84Å; I92-I108 HydrophobicContact CG2-CG1 4.32Å; I92-I113 HydrophobicContact CD1-CG1 4.38Å; I92-A116 HydrophobicContact CD1-CB 4.29Å; I92-A116 HydrophobicContact CG1-CB 3.46Å; I92-A116 VanDerWaalsContact CG1-CB 3.46Å
93L91.1Very high84.1Confident0 Ų037.6 Ų37.60%021%0.211CC..Hα-helixtrans-63.8-47.6179.4-69.6174.6000111.4L24 L27 F28 T32 Q89 W90 D95 G96 F97L24-L93 HydrophobicContact CD2-CD1 3.58Å; L27-L93 HydrophobicContact CB-CD1 3.83Å; L27-L93 HydrophobicContact CB-CD2 4.22Å; L27-L93 HydrophobicContact CD1-CD1 4.03Å; F28-L93 HydrophobicContact CD2-CD1 3.8Å; F28-L93 HydrophobicContact CD2-CD2 3.82Å; F28-L93 HydrophobicContact CD2-CG 3.9Å; F28-L93 HydrophobicContact CE2-CD1 3.6Å; F28-L93 HydrophobicContact CE2-CD2 3.85Å; F28-L93 HydrophobicContact CE2-CG 3.48Å; F28-L93 VanDerWaalsContact CE2-CG 3.48Å; F28-L93 HydrophobicContact CG-CD2 4.26Å; F28-L93 HydrophobicContact CZ-CD2 4.3Å; F28-L93 HydrophobicContact CZ-CG 4.03Å; T32-L93 HydrophobicContact CG2-CD2 3.83Å; Q89-L93 PolarHBondContact O-N 3.14Å; W90-L93 HydrophobicContact CE3-CD1 4.48Å; W90-L93 PolarHBondContact O-N 3.29Å; L93-D95 PolarHBondContact O-N 3.27Å; L93-G96 PolarHBondContact O-N 3.19Å; L93-F97 HydrophobicContact CB-CD2 4.41Å; L93-F97 HydrophobicContact CB-CE2 4Å; L93-F97 WeakPolarHBondContact O-CD2 3.48Å; L93-F97 VanDerWaalsContact O-CG 3.29Å; L93-F97 WeakPolarHBondContact O-CG 3.27Å; L93-F97 PolarHBondContact O-N 3.47Å
94L89.6Confident82.5Confident12 Ų1240 Ų406%0.06324%0.236CC..Hα-helixtrans-60.6-46178.3-82.7174.9000112.4W90 A91 G96 F97 L98 V147 T148W90-L94 HydrophobicContact CD2-CD1 4.02Å; W90-L94 HydrophobicContact CD2-CG 4.02Å; W90-L94 VanDerWaalsContact CE2-CD1 3.42Å; W90-L94 HydrophobicContact CG-CD1 4.09Å; W90-L94 HydrophobicContact CG-CG 4.48Å; W90-L94 HydrophobicContact CH2-CD2 4.11Å; W90-L94 HydrophobicContact CH2-CG 4.27Å; W90-L94 HydrophobicContact CZ2-CD1 3.9Å; W90-L94 HydrophobicContact CZ2-CD2 3.67Å; W90-L94 HydrophobicContact CZ2-CG 3.75Å; W90-L94 WeakPolarHBondContact O-CB 3.26Å; W90-L94 WeakPolarHBondContact O-CG 3.45Å; W90-L94 PolarHBondContact O-N 3.44Å; A91-L94 PolarHBondContact O-N 3.09Å; L94-G96 VanDerWaalsContact C-N 3.27Å; L94-G96 PolarHBondContact O-N 3.4Å; L94-F97 PolarHBondContact O-N 3.25Å; L94-F97 VanDerWaalsContact O-N 3.14Å; L94-L98 WeakPolarHBondContact O-CB 3.36Å; L94-L98 VanDerWaalsContact O-CG 3.24Å; L94-L98 WeakPolarHBondContact O-CG 3.45Å; L94-L98 PolarHBondContact O-N 3.43Å; L94-V147 HydrophobicContact CD1-CB 4.32Å; L94-V147 HydrophobicContact CD1-CG1 3.73Å; L94-T148 HydrophobicContact CD2-CG2 4.32Å
95D85Confident81.3Confident11 Ų1145.2 Ų45.26%0.05926%0.258CS..Hα-helixtrans-61.4-41.6177.9-86.4-21.7000111.1A91 L93 F97 S99 L115 R154 Y165A91-D95 WeakPolarHBondContact O-CB 3.24Å; A91-D95 PolarHBondContact O-N 2.75Å; L93-D95 PolarHBondContact O-N 3.27Å; D95-F97 PolarHBondContact O-N 2.85Å; D95-S99 VanDerWaalsContact O-CB 3.32Å; D95-S99 WeakPolarHBondContact O-CB 3.39Å; D95-S99 PolarHBondContact O-N 3.32Å; D95-S99 PolarHBondContact O-OG 3.31Å; D95-L115 VanDerWaalsContact OD2-CD2 3.3Å; D95-L115 WeakPolarHBondContact OD2-CD2 3.23Å; D95-R154 VanDerWaalsContact CG-NH2 3.26Å; D95-R154 IonicContact OD1-CZ 3.74Å; D95-R154 IonicContact OD1-NH1 3.92Å; D95-R154 PolarHBondContact OD1-NH1 2.88Å; D95-R154 IonicContact OD1-NH2 3.12Å; D95-R154 PolarHBondContact OD1-NH2 3.39Å; D95-R154 IonicContact OD2-CZ 3.98Å; D95-R154 IonicContact OD2-NH1 3.54Å; D95-R154 PolarHBondContact OD2-NH1 3.33Å; D95-R154 IonicContact OD2-NH2 3.89Å; D95-R154 PolarHBondContact OD2-NH2 2.89Å; D95-R154 VanDerWaalsContact OD2-NH2 3.12Å; D95-Y165 PolarHBondContact OD1-OH 3.42Å
96G82.1Confident80.5Confident3 Ų343 Ų433%0.03124%0.239CC..Hα-helixtrans-58-45.8172.100000113.3I92 L93 L94 Q100 V106I92-G96 PolarHBondContact O-N 2.84Å; L93-G96 PolarHBondContact O-N 3.19Å; L94-G96 VanDerWaalsContact C-N 3.27Å; L94-G96 PolarHBondContact O-N 3.4Å; G96-Q100 WeakPolarHBondContact O-CA 3.42Å; G96-Q100 WeakPolarHBondContact O-CB 3.2Å; G96-Q100 PolarHBondContact O-N 2.87Å; G96-V106 VanDerWaalsContact CA-CG2 3.43Å
97F84.1Confident79.9Confident47 Ų4744.6 Ų44.621%0.20625%0.249CC..Hα-helixtrans-71.5-38.8-179.3-63.8-41.7000113.4F31 L93 L94 D95 F101F31-F97 HydrophobicContact CB-CE1 4.03Å; F31-F97 HydrophobicContact CB-CZ 4.22Å; F31-F97 AromaticContact CD1-CE1 3.9Å; F31-F97 HydrophobicContact CD1-CE1 3.9Å; F31-F97 HydrophobicContact CD1-CZ 4.49Å; F31-F97 HydrophobicContact CD2-CE1 4.21Å; F31-F97 AromaticContact CD2-CZ 3.98Å; F31-F97 HydrophobicContact CD2-CZ 3.98Å; F31-F97 HydrophobicContact CE1-CE1 4.42Å; F31-F97 AromaticContact CG-CE1 3.78Å; F31-F97 HydrophobicContact CG-CE1 3.78Å; F31-F97 AromaticContact CG-CZ 3.98Å; F31-F97 HydrophobicContact CG-CZ 3.98Å; L93-F97 HydrophobicContact CB-CD2 4.41Å; L93-F97 HydrophobicContact CB-CE2 4Å; L93-F97 WeakPolarHBondContact O-CD2 3.48Å; L93-F97 VanDerWaalsContact O-CG 3.29Å; L93-F97 WeakPolarHBondContact O-CG 3.27Å; L93-F97 PolarHBondContact O-N 3.47Å; L94-F97 PolarHBondContact O-N 3.25Å; L94-F97 VanDerWaalsContact O-N 3.14Å; D95-F97 PolarHBondContact O-N 2.85Å; F97-F101 HydrophobicContact CB-CD2 4.07Å; F97-F101 HydrophobicContact CB-CE2 4.07Å; F97-F101 HydrophobicContact CD1-CD2 4.1Å; F97-F101 AromaticContact CD1-CE2 3.69Å; F97-F101 HydrophobicContact CD1-CE2 3.69Å; F97-F101 HydrophobicContact CG-CE2 4.19Å; F97-F101 WeakPolarHBondContact O-CD2 3.49Å
98L81.4Confident79.3Confident44 Ų4445.4 Ų45.423%0.2325%0.253CS..Hα-helixtrans-81.3-27.4-175.9-61.9177.2000112.7L94 T152 M155L94-L98 WeakPolarHBondContact O-CB 3.36Å; L94-L98 VanDerWaalsContact O-CG 3.24Å; L94-L98 WeakPolarHBondContact O-CG 3.45Å; L94-L98 PolarHBondContact O-N 3.43Å; L98-T152 HydrophobicContact CD1-CG2 4.45Å; L98-M155 HydrophobicContact CB-CE 3.6Å; L98-M155 HydrophobicContact CD2-CE 3.29Å; L98-M155 HydrophobicContact CG-CE 3.91Å
99S71.2Confident78.8Confident43 Ų4346 Ų4630%0.30126%0.256SS..Hα-helixtrans-108.1-27-17670.30000115.4D95D95-S99 VanDerWaalsContact O-CB 3.32Å; D95-S99 WeakPolarHBondContact O-CB 3.39Å; D95-S99 PolarHBondContact O-N 3.32Å; D95-S99 PolarHBondContact O-OG 3.31Å
100Q63.6Low78.2Confident57 Ų5745.6 Ų45.627%0.26626%0.256SS..Hα-helixtrans-122.414.2-169.8-64.5179.42.400114.2G96 P102 S103G96-Q100 WeakPolarHBondContact O-CA 3.42Å; G96-Q100 WeakPolarHBondContact O-CB 3.2Å; G96-Q100 PolarHBondContact O-N 2.87Å; Q100-P102 WeakPolarHBondContact O-CD 3.09Å; Q100-S103 PolarHBondContact O-N 2.91Å; Q100-S103 PolarHBondContact O-OG 3.35Å
101F55.3Low77.7Confident146 Ų14645.5 Ų45.564%0.6426%0.257SS*.G310 helixtrans-50.8-30.1-176.1-135-98.7000116.4F97 S103 G104F97-F101 HydrophobicContact CB-CD2 4.07Å; F97-F101 HydrophobicContact CB-CE2 4.07Å; F97-F101 HydrophobicContact CD1-CD2 4.1Å; F97-F101 AromaticContact CD1-CE2 3.69Å; F97-F101 HydrophobicContact CD1-CE2 3.69Å; F97-F101 HydrophobicContact CG-CE2 4.19Å; F97-F101 WeakPolarHBondContact O-CD2 3.49Å; F101-S103 VanDerWaalsContact C-N 3.27Å; F101-S103 PolarHBondContact O-N 2.89Å; F101-G104 PolarHBondContact O-N 2.87Å
102P56.6Low77.3Confident134 Ų13446.7 Ų46.787%0.8727%0.265SS*.G310 helixtrans-64.5-22.1177-21.232.6000115.3Q100Q100-P102 WeakPolarHBondContact O-CD 3.09Å
103S57.8Low77.2Confident79 Ų7948.9 Ų48.955%0.55228%0.276SS*.G310 helixtrans-90.1-10.5-177.266.30000114.2Q100 F101 K105Q100-S103 PolarHBondContact O-N 2.91Å; Q100-S103 PolarHBondContact O-OG 3.35Å; F101-S103 VanDerWaalsContact C-N 3.27Å; F101-S103 PolarHBondContact O-N 2.89Å; S103-K105 PolarHBondContact O-N 2.53Å; S103-K105 PolarHBondContact OG-O 3Å; S103-K105 VanDerWaalsContact OG-O 3.1Å
104G60.8Low77.1Confident51 Ų5149.7 Ų49.753%0.52628%0.279SS..SBendtrans70.3-9.518000000116F101F101-G104 PolarHBondContact O-N 2.87Å
105K69.1Low77Confident117 Ų11749.2 Ų49.251%0.50928%0.277SS..SBendtrans-143137176.9-67-172.3177.4-177.90112.2F31 S103F31-K105 CarbonylContact O-C 3.59Å; F31-K105 WeakPolarHBondContact O-CA 3.14Å; S103-K105 PolarHBondContact O-N 2.53Å; S103-K105 PolarHBondContact OG-O 3Å; S103-K105 VanDerWaalsContact OG-O 3.1Å
106V79.4Confident77.4Confident9 Ų948.7 Ų48.76%0.05527%0.274CS..EExtended strand (participates in β ladder)trans-83.5123.6177.8-174.20000109.7F31 T32 H33 G96F31-V106 WeakPolarHBondContact O-CB 3.41Å; F31-V106 PolarHBondContact O-N 3.18Å; T32-V106 WeakPolarHBondContact CA-O 3.44Å; T32-V106 HydrophobicContact CG2-CB 4.19Å; H33-V106 PolarHBondContact N-O 3.41Å; H33-V106 PolarHBondContact ND1-O 2.72Å; G96-V106 VanDerWaalsContact CA-CG2 3.43Å
107V82.7Confident77.9Confident40 Ų4048.7 Ų48.724%0.24227%0.274CS..EExtended strand (participates in β ladder)trans-86.4120.8174.7-174.80000109.6H33 D35 T109 S112H33-V107 VanDerWaalsContact CE1-CG2 3.44Å; H33-V107 WeakPolarHBondContact CE1-CG2 3.27Å; D35-V107 HydrophobicContact CB-CG1 3.73Å; V107-T109 HydrophobicContact CG1-CG2 4.07Å; V107-S112 PolarHBondContact O-OG 2.9Å
108I84.3Confident78.2Confident18 Ų1846.6 Ų46.69%0.09226%0.264CS..EExtended strand (participates in β ladder)trans-87.5113.7175.3-58.8178.4000109.2F28 T32 H33 Y34 D35 I92 I113F28-I108 HydrophobicContact CD1-CD1 4.12Å; F28-I108 HydrophobicContact CE1-CD1 3.95Å; T32-I108 HydrophobicContact CG2-CD1 4.22Å; H33-I108 PolarHBondContact O-N 2.91Å; Y34-I108 HydrophobicContact CD1-CB 4.16Å; Y34-I108 HydrophobicContact CD1-CG2 4.3Å; Y34-I108 HydrophobicContact CE1-CB 4.44Å; Y34-I108 HydrophobicContact CE1-CD1 4.42Å; Y34-I108 HydrophobicContact CE1-CG2 4.26Å; D35-I108 PolarHBondContact N-O 3.13Å; I92-I108 HydrophobicContact CG2-CG1 4.32Å; I108-I113 HydrophobicContact CG2-CG1 4.5Å
109T84.4Confident78.7Confident39 Ų3944.5 Ų44.524%0.23925%0.253CS..  trans-115.9164.8172.268.20000110.5D35 V107 F111 S112 I113D35-T109 HydrophobicContact CB-CG2 4.23Å; V107-T109 HydrophobicContact CG1-CG2 4.07Å; T109-F111 PolarHBondContact O-N 2.98Å; T109-F111 PolarHBondContact OG1-N 3.49Å; T109-S112 PolarHBondContact N-OG 3.17Å; T109-S112 WeakPolarHBondContact O-CB 3.4Å; T109-S112 PolarHBondContact O-N 3.22Å; T109-S112 VanDerWaalsContact O-N 3.1Å; T109-S112 PolarHBondContact OG1-N 2.59Å; T109-S112 PolarHBondContact OG1-OG 2.84Å; T109-I113 PolarHBondContact O-N 3.22Å
110L83.8Confident79.9Confident43 Ų4342.5 Ų42.523%0.22524%0.24CC..Hα-helixtrans-59.2-32.1171.4-74.6-179.3000112.4L44 I113 R114L44-L110 HydrophobicContact CD1-CD1 3.48Å; L44-L110 VanDerWaalsContact CD1-CD1 3.48Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.28Å; L110-I113 PolarHBondContact O-N 3.35Å; L110-R114 PolarHBondContact O-N 3.5Å
111F83.9Confident81.2Confident48 Ų4839.9 Ų39.921%0.21123%0.227CC..Hα-helixtrans-67.1-41.3175-177.1-92.7000111.7T109 I113 R114 L115 H166 L227T109-F111 PolarHBondContact O-N 2.98Å; T109-F111 PolarHBondContact OG1-N 3.49Å; F111-I113 VanDerWaalsContact C-N 3.26Å; F111-I113 PolarHBondContact O-N 3.13Å; F111-R114 PolarHBondContact O-N 2.61Å; F111-L115 HydrophobicContact CE1-CD2 4.35Å; F111-L115 WeakPolarHBondContact O-CB 3.42Å; F111-L115 PolarHBondContact O-N 3.01Å; F111-H166 HydrophobicContact CE1-CB 3.61Å; F111-H166 AromaticContact CE1-CG 3.68Å; F111-H166 AromaticContact CE1-ND1 3.81Å; F111-H166 HydrophobicContact CZ-CB 3.8Å; F111-L227 HydrophobicContact CE2-CD2 4.22Å; F111-L227 HydrophobicContact CZ-CD2 4.25Å
112S86.1Confident83Confident24 Ų2433 Ų3317%0.16820%0.197CC..Hα-helixtrans-57.2-40.7174.8-50.40000111.4V107 T109 L115 A116V107-S112 PolarHBondContact O-OG 2.9Å; T109-S112 PolarHBondContact N-OG 3.17Å; T109-S112 WeakPolarHBondContact O-CB 3.4Å; T109-S112 PolarHBondContact O-N 3.22Å; T109-S112 VanDerWaalsContact O-N 3.1Å; T109-S112 PolarHBondContact OG1-N 2.59Å; T109-S112 PolarHBondContact OG1-OG 2.84Å; S112-L115 PolarHBondContact O-N 3.12Å; S112-A116 VanDerWaalsContact O-CB 3.3Å; S112-A116 WeakPolarHBondContact O-CB 3.17Å; S112-A116 PolarHBondContact O-N 3.28Å
113I88.4Confident84.8Confident62 Ų6226.6 Ų26.632%0.31816%0.156SC..Hα-helixtrans-64.1-48176.4-63.3173.8000110.8I92 I108 T109 L110 F111 L115 A116 T117I92-I113 HydrophobicContact CD1-CG1 4.38Å; I108-I113 HydrophobicContact CG2-CG1 4.5Å; T109-I113 PolarHBondContact O-N 3.22Å; L110-I113 PolarHBondContact O-N 3.35Å; F111-I113 VanDerWaalsContact C-N 3.26Å; F111-I113 PolarHBondContact O-N 3.13Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.45Å; I113-A116 PolarHBondContact O-N 2.93Å; I113-T117 PolarHBondContact O-N 2.95Å; I113-T117 PolarHBondContact O-OG1 3.42Å
114R88.9Confident86.5Confident17 Ų1723 Ų236%0.06413%0.13CC..Hα-helixtrans-58.6-43.7178-67.4-171.8-158.7127.445.7112.3S47 L54 L110 F111 A116 T117 M118S47-R114 PolarHBondContact O-NE 3.4Å; S47-R114 PolarHBondContact O-NH2 3.08Å; S47-R114 PolarHBondContact OG-NH2 2.84Å; L54-R114 HydrophobicContact CD1-CB 3.93Å; L54-R114 HydrophobicContact CD1-CG 4.09Å; L110-R114 PolarHBondContact O-N 3.5Å; F111-R114 PolarHBondContact O-N 2.61Å; R114-A116 VanDerWaalsContact C-N 3.34Å; R114-T117 PolarHBondContact O-N 2.89Å; R114-M118 VanDerWaalsContact O-CG 3.32Å; R114-M118 WeakPolarHBondContact O-CG 3.03Å; R114-M118 PolarHBondContact O-N 2.76Å
115L88.9Confident87.8Confident2 Ų221.5 Ų21.51%0.0111%0.11CC..Hα-helixtrans-63.2-42.3179.2-172.666.9000111.6D95 F111 S112 I113 M118 S119 H166 L169 L227D95-L115 VanDerWaalsContact OD2-CD2 3.3Å; D95-L115 WeakPolarHBondContact OD2-CD2 3.23Å; F111-L115 HydrophobicContact CE1-CD2 4.35Å; F111-L115 WeakPolarHBondContact O-CB 3.42Å; F111-L115 PolarHBondContact O-N 3.01Å; S112-L115 PolarHBondContact O-N 3.12Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.45Å; L115-M118 PolarHBondContact O-N 3.04Å; L115-S119 PolarHBondContact O-N 3.08Å; L115-S119 PolarHBondContact O-OG 3.12Å; L115-S119 VanDerWaalsContact O-OG 3.04Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.39Å; L115-L169 HydrophobicContact CD1-CD1 3.43Å; L115-L169 VanDerWaalsContact CD1-CD1 3.43Å; L115-L227 HydrophobicContact CD1-CD1 4.24Å; L115-L227 HydrophobicContact CD1-CD2 3.98Å
116A92Very high88.9Confident0 Ų016 Ų160%09%0.086CC..Hα-helixtrans-65.4-42.9175.200000112.5V88 A91 I92 S112 I113 R114 M118 S119 A120V88-A116 HydrophobicContact CG1-CB 4.21Å; A91-A116 HydrophobicContact CB-CB 3.75Å; I92-A116 HydrophobicContact CD1-CB 4.29Å; I92-A116 HydrophobicContact CG1-CB 3.46Å; I92-A116 VanDerWaalsContact CG1-CB 3.46Å; S112-A116 VanDerWaalsContact O-CB 3.3Å; S112-A116 WeakPolarHBondContact O-CB 3.17Å; S112-A116 PolarHBondContact O-N 3.28Å; I113-A116 PolarHBondContact O-N 2.93Å; R114-A116 VanDerWaalsContact C-N 3.34Å; A116-M118 VanDerWaalsContact C-N 3.34Å; A116-M118 PolarHBondContact O-N 3.49Å; A116-S119 PolarHBondContact O-N 2.9Å; A116-A120 PolarHBondContact O-N 3.24Å
117T93Very high89.4Confident3 Ų315.5 Ų15.52%0.0188%0.083CC..Hα-helixtrans-60.3-42.7174.8-54.80000111.6L54 L84 I113 R114 S119 A120 M121L54-T117 HydrophobicContact CB-CG2 3.83Å; L84-T117 HydrophobicContact CD1-CG2 4.43Å; I113-T117 PolarHBondContact O-N 2.95Å; I113-T117 PolarHBondContact O-OG1 3.42Å; R114-T117 PolarHBondContact O-N 2.89Å; T117-S119 VanDerWaalsContact C-N 3.33Å; T117-S119 PolarHBondContact O-N 3.01Å; T117-A120 PolarHBondContact O-N 3.41Å; T117-M121 HydrophobicContact CG2-SD 4.33Å; T117-M121 WeakPolarHBondContact O-CB 3.31Å; T117-M121 VanDerWaalsContact O-CG 3.29Å; T117-M121 WeakPolarHBondContact O-CG 3.41Å; T117-M121 PolarHBondContact O-N 3.43Å
118M91.1Very high89.5Confident3 Ų314.3 Ų14.32%0.0158%0.078CC..Hα-helixtrans-63.9-38.3175.7-71.3-70.5-70.700112.4L54 R114 L115 A116 M121 S122 L169 F172 V223 L227L54-M118 HydrophobicContact CD1-CG 4.11Å; L54-M118 HydrophobicContact CD1-SD 4.34Å; L54-M118 HydrophobicContact CD2-CG 4.44Å; L54-M118 HydrophobicContact CD2-SD 3.6Å; R114-M118 VanDerWaalsContact O-CG 3.32Å; R114-M118 WeakPolarHBondContact O-CG 3.03Å; R114-M118 PolarHBondContact O-N 2.76Å; L115-M118 PolarHBondContact O-N 3.04Å; A116-M118 VanDerWaalsContact C-N 3.34Å; A116-M118 PolarHBondContact O-N 3.49Å; M118-M121 WeakPolarHBondContact O-CB 3.11Å; M118-M121 PolarHBondContact O-N 3.29Å; M118-M121 HydrophobicContact SD-CE 3.88Å; M118-M121 HydrophobicContact SD-SD 4.11Å; M118-S122 PolarHBondContact O-N 3.35Å; M118-L169 HydrophobicContact CB-CD2 3.64Å; M118-L169 HydrophobicContact CE-CD2 4.27Å; M118-F172 HydrophobicContact CE-CD1 4.39Å; M118-F172 HydrophobicContact CE-CE1 3.75Å; M118-F172 HydrophobicContact CE-CE2 4.39Å; M118-F172 HydrophobicContact CE-CZ 3.74Å; M118-V223 HydrophobicContact CE-CG1 3.73Å; M118-V223 HydrophobicContact SD-CG1 3.85Å; M118-L227 HydrophobicContact CE-CD1 4.48Å; M118-L227 HydrophobicContact CG-CD1 4.43Å
119S92.8Very high89.5Confident0 Ų013.7 Ų13.70%08%0.076CC..Hα-helixtrans-66.1-41.8175.1-59.20000111.8L115 A116 T117 M121 S122 R154L115-S119 PolarHBondContact O-N 3.08Å; L115-S119 PolarHBondContact O-OG 3.12Å; L115-S119 VanDerWaalsContact O-OG 3.04Å; A116-S119 PolarHBondContact O-N 2.9Å; T117-S119 VanDerWaalsContact C-N 3.33Å; T117-S119 PolarHBondContact O-N 3.01Å; S119-M121 VanDerWaalsContact C-N 3.34Å; S119-S122 VanDerWaalsContact O-CB 3.29Å; S119-S122 WeakPolarHBondContact O-CB 3.42Å; S119-S122 PolarHBondContact O-N 3.5Å; S119-R154 PolarHBondContact OG-NH2 2.86Å
120A94.7Very high89.5Confident1 Ų111.8 Ų11.81%0.0086%0.064CC..Hα-helixtrans-65.1-37.6174.100000112L84 V88 A116 T117 S122 V123 L124L84-A120 HydrophobicContact CD1-CB 3.88Å; V88-A120 HydrophobicContact CG2-CB 3.93Å; A116-A120 PolarHBondContact O-N 3.24Å; T117-A120 PolarHBondContact O-N 3.41Å; A120-S122 VanDerWaalsContact C-N 3.29Å; A120-S122 PolarHBondContact O-N 2.88Å; A120-V123 WeakPolarHBondContact O-CB 3.32Å; A120-V123 PolarHBondContact O-N 2.98Å; A120-L124 WeakPolarHBondContact O-CG 3.17Å; A120-L124 PolarHBondContact O-N 2.79Å; A120-L124 VanDerWaalsContact O-N 3.11Å
121M92.2Very high89.3Confident2 Ų210.3 Ų10.31%0.016%0.057CC..Hα-helixtrans-60.3-35.9174.8-79.5171.841.300112.9L54 M57 A58 T117 M118 S119 V123 L124 M125 V223L54-M121 HydrophobicContact CD2-SD 4.28Å; M57-M121 HydrophobicContact CE-CE 3.05Å; M57-M121 HydrophobicContact CE-SD 3.84Å; A58-M121 HydrophobicContact CB-CG 3.58Å; A58-M121 HydrophobicContact CB-SD 4.17Å; T117-M121 HydrophobicContact CG2-SD 4.33Å; T117-M121 WeakPolarHBondContact O-CB 3.31Å; T117-M121 VanDerWaalsContact O-CG 3.29Å; T117-M121 WeakPolarHBondContact O-CG 3.41Å; T117-M121 PolarHBondContact O-N 3.43Å; M118-M121 WeakPolarHBondContact O-CB 3.11Å; M118-M121 PolarHBondContact O-N 3.29Å; M118-M121 HydrophobicContact SD-CE 3.88Å; M118-M121 HydrophobicContact SD-SD 4.11Å; S119-M121 VanDerWaalsContact C-N 3.34Å; M121-V123 PolarHBondContact O-N 2.8Å; M121-L124 WeakPolarHBondContact O-CB 3.39Å; M121-L124 PolarHBondContact O-N 3.45Å; M121-L124 VanDerWaalsContact O-N 3.15Å; M121-M125 WeakPolarHBondContact O-CG 3.17Å; M121-M125 PolarHBondContact O-N 2.98Å; M121-V223 HydrophobicContact CE-CG1 3.91Å; M121-V223 HydrophobicContact CE-CG2 4.19Å
122S92.7Very high88.9Confident1 Ų18.3 Ų8.31%0.0075%0.049CC..Hα-helixtrans-52.1-48.1170.7179.40000110.7M118 S119 A120 L124 M125 S126 E146 A176M118-S122 PolarHBondContact O-N 3.35Å; S119-S122 VanDerWaalsContact O-CB 3.29Å; S119-S122 WeakPolarHBondContact O-CB 3.42Å; S119-S122 PolarHBondContact O-N 3.5Å; A120-S122 VanDerWaalsContact C-N 3.29Å; A120-S122 PolarHBondContact O-N 2.88Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.34Å; S122-M125 WeakPolarHBondContact O-CB 3.18Å; S122-M125 PolarHBondContact O-N 3.02Å; S122-M125 VanDerWaalsContact O-N 3.16Å; S122-S126 PolarHBondContact O-N 2.95Å; S122-S126 PolarHBondContact O-OG 2.93Å; S122-E146 VanDerWaalsContact C-OE1 3.23Å; S122-E146 PolarHBondContact OG-OE1 3.46Å; S122-A176 WeakPolarHBondContact O-CB 3.48Å; S122-A176 WeakPolarHBondContact OG-CB 3.4Å
123V94Very high88.5Confident0 Ų07.8 Ų7.80%04%0.044CC..Hα-helixtrans-62.9-41.7179.2-170.80000111.9A120 M121 M125 S126 A127 V143 E146 V147A120-V123 WeakPolarHBondContact O-CB 3.32Å; A120-V123 PolarHBondContact O-N 2.98Å; M121-V123 PolarHBondContact O-N 2.8Å; V123-M125 VanDerWaalsContact C-N 3.27Å; V123-M125 PolarHBondContact O-N 3.04Å; V123-S126 PolarHBondContact O-N 3.29Å; V123-A127 WeakPolarHBondContact O-CB 3.31Å; V123-A127 PolarHBondContact O-N 3.37Å; V123-V143 HydrophobicContact CG1-CB 4.3Å; V123-V143 HydrophobicContact CG1-CG2 3.7Å; V123-E146 WeakPolarHBondContact CA-OE1 3.05Å; V123-E146 WeakPolarHBondContact CA-OE2 3.22Å; V123-E146 HydrophobicContact CG2-CB 4.03Å; V123-E146 HydrophobicContact CG2-CG 4.12Å; V123-E146 PolarHBondContact N-OE1 2.75Å; V123-V147 HydrophobicContact CG2-CG2 3.54Å
124L92.6Very high88.3Confident3 Ų34.9 Ų4.92%0.0163%0.03CC..Hα-helixtrans-61.9-38.4177.5-60.3-178.1000111.8A58 L62 N80 M83 L84 A120 M121 S122 G128A58-L124 HydrophobicContact CB-CD1 3.83Å; L62-L124 HydrophobicContact CB-CB 4.38Å; L62-L124 HydrophobicContact CD1-CB 3.59Å; L62-L124 HydrophobicContact CD1-CD1 4.01Å; L62-L124 HydrophobicContact CD1-CG 4.47Å; N80-L124 HydrophobicContact CB-CD2 4.45Å; N80-L124 WeakPolarHBondContact O-CD2 3.41Å; N80-L124 VanDerWaalsContact OD1-CD1 3.31Å; N80-L124 WeakPolarHBondContact OD1-CD1 3.13Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.41Å; M83-L124 HydrophobicContact CB-CD2 3.71Å; M83-L124 HydrophobicContact CE-CD2 3.97Å; L84-L124 HydrophobicContact CB-CD1 4.21Å; L84-L124 HydrophobicContact CD1-CD1 4.22Å; A120-L124 WeakPolarHBondContact O-CG 3.17Å; A120-L124 PolarHBondContact O-N 2.79Å; A120-L124 VanDerWaalsContact O-N 3.11Å; M121-L124 WeakPolarHBondContact O-CB 3.39Å; M121-L124 PolarHBondContact O-N 3.45Å; M121-L124 VanDerWaalsContact O-N 3.15Å; S122-L124 VanDerWaalsContact C-N 3.34Å; S122-L124 PolarHBondContact O-N 3.34Å; L124-G128 PolarHBondContact O-N 2.84Å
125M89.8Confident88.2Confident20 Ų204.2 Ų4.210%0.0993%0.027CC..Hα-helixtrans-65.5-50.2174.5-66.7-17865.200111L62 M121 S122 V123 A127 G128 F172 Y173 A176 H329 F332L62-M125 HydrophobicContact CD1-CG 4.09Å; L62-M125 HydrophobicContact CD2-CG 4.36Å; M121-M125 WeakPolarHBondContact O-CG 3.17Å; M121-M125 PolarHBondContact O-N 2.98Å; S122-M125 WeakPolarHBondContact O-CB 3.18Å; S122-M125 PolarHBondContact O-N 3.02Å; S122-M125 VanDerWaalsContact O-N 3.16Å; V123-M125 VanDerWaalsContact C-N 3.27Å; V123-M125 PolarHBondContact O-N 3.04Å; M125-A127 VanDerWaalsContact C-N 3.33Å; M125-A127 PolarHBondContact O-N 3.41Å; M125-G128 PolarHBondContact O-N 3.13Å; M125-G128 VanDerWaalsContact O-N 3.13Å; M125-F172 HydrophobicContact SD-CE2 4.01Å; M125-Y173 HydrophobicContact CE-CD1 3.6Å; M125-Y173 HydrophobicContact CE-CE1 4.03Å; M125-Y173 HydrophobicContact SD-CD1 4.09Å; M125-Y173 HydrophobicContact SD-CE1 4.2Å; M125-A176 HydrophobicContact CB-CB 4.06Å; M125-H329 PolarHBondContact O-CE1 3.45Å; M125-H329 VanDerWaalsContact O-CE1 3.26Å; M125-H329 PolarHBondContact O-ND1 2.98Å; M125-F332 HydrophobicContact CE-CD1 3.57Å; M125-F332 HydrophobicContact CE-CE1 4.03Å
126S91.9Very high88.1Confident0 Ų05.1 Ų5.10%03%0.032CC..Hα-helixtrans-57.5-42.5175.7-640000113S122 V123 G128 A129 M142 E146 A176S122-S126 PolarHBondContact O-N 2.95Å; S122-S126 PolarHBondContact O-OG 2.93Å; V123-S126 PolarHBondContact O-N 3.29Å; S126-G128 PolarHBondContact O-N 3.43Å; S126-A129 WeakPolarHBondContact O-CB 3.47Å; S126-A129 PolarHBondContact O-N 2.77Å; S126-A129 VanDerWaalsContact O-N 3.08Å; S126-M142 VanDerWaalsContact C-CE 3.5Å; S126-M142 VanDerWaalsContact CB-CE 3.41Å; S126-E146 WeakPolarHBondContact CB-OE1 3.43Å; S126-E146 WeakPolarHBondContact CB-OE2 3.24Å; S126-E146 PolarHBondContact OG-OE1 2.82Å; S126-E146 PolarHBondContact OG-OE2 3.49Å; S126-A176 VanDerWaalsContact OG-CA 3.22Å; S126-A176 WeakPolarHBondContact OG-CA 3.27Å; S126-A176 PolarHBondContact OG-O 3.19Å
127A89.8Confident87.9Confident0 Ų06.2 Ų6.20%04%0.041CC..Hα-helixtrans-62.6-25.9-18000000111.9M83 V123 M125 A129 V130 L131 L139 M142M83-A127 HydrophobicContact CE-CB 3.68Å; M83-A127 HydrophobicContact SD-CB 3.78Å; V123-A127 WeakPolarHBondContact O-CB 3.31Å; V123-A127 PolarHBondContact O-N 3.37Å; M125-A127 VanDerWaalsContact C-N 3.33Å; M125-A127 PolarHBondContact O-N 3.41Å; A127-A129 PolarHBondContact O-N 2.93Å; A127-A129 VanDerWaalsContact O-N 3.12Å; A127-V130 WeakPolarHBondContact O-CG2 3.24Å; A127-V130 PolarHBondContact O-N 3.33Å; A127-L131 HydrophobicContact CB-CD1 3.93Å; A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 WeakPolarHBondContact O-CD1 3.44Å; A127-L131 PolarHBondContact O-N 2.9Å; A127-L139 HydrophobicContact CB-CD2 4.45Å; A127-M142 HydrophobicContact CB-CE 4.33Å
128G84.4Confident87.7Confident14 Ų146.2 Ų6.214%0.1444%0.041CC..THydrogen-bonded Turntrans-56.8-23.4173.100000114.3L124 M125 S126 S326L124-G128 PolarHBondContact O-N 2.84Å; M125-G128 PolarHBondContact O-N 3.13Å; M125-G128 VanDerWaalsContact O-N 3.13Å; S126-G128 PolarHBondContact O-N 3.43Å; G128-S326 WeakPolarHBondContact O-CB 3.26Å
129A83.6Confident87.8Confident5 Ų56.1 Ų6.14%0.0414%0.04CC..THydrogen-bonded Turntrans-79.7-25.6175.600000114S126 A127 G180 A184 H329S126-A129 WeakPolarHBondContact O-CB 3.47Å; S126-A129 PolarHBondContact O-N 2.77Å; S126-A129 VanDerWaalsContact O-N 3.08Å; A127-A129 PolarHBondContact O-N 2.93Å; A127-A129 VanDerWaalsContact O-N 3.12Å; A129-G180 WeakPolarHBondContact CB-O 3.5Å; A129-A184 HydrophobicContact CB-CB 4Å; A129-H329 HydrophobicContact CB-CB 4.3Å
130V84Confident87.8Confident0 Ų07.2 Ų7.20%05%0.047CC..THydrogen-bonded Turntrans-114.9-15.2-170.9-60.90000113.8A127 G132 K133 V134 L139 M142 V183 A184 L187A127-V130 WeakPolarHBondContact O-CG2 3.24Å; A127-V130 PolarHBondContact O-N 3.33Å; V130-G132 PolarHBondContact O-N 3.02Å; V130-K133 WeakPolarHBondContact O-CB 3.29Å; V130-K133 PolarHBondContact O-N 3.49Å; V130-V134 HydrophobicContact CB-CG1 4.14Å; V130-V134 HydrophobicContact CB-CG2 4.23Å; V130-V134 HydrophobicContact CG2-CG2 3.96Å; V130-L139 HydrophobicContact CG2-CD2 4.41Å; V130-M142 HydrophobicContact CG2-CE 4.25Å; V130-M142 HydrophobicContact CG2-SD 3.77Å; V130-V183 HydrophobicContact CG1-CB 4.23Å; V130-V183 HydrophobicContact CG1-CG1 3.82Å; V130-A184 HydrophobicContact CG1-CB 3.91Å; V130-L187 HydrophobicContact CB-CD1 4.02Å; V130-L187 HydrophobicContact CG1-CD1 3.77Å
131L79.6Confident87.7Confident11 Ų118.2 Ų8.26%0.0585%0.053CC..THydrogen-bonded Turntrans-51.1135.5178.8-124.684.6000111S76 M83 A127 K133 F402S76-L131 WeakPolarHBondContact OG-CD2 3.39Å; M83-L131 HydrophobicContact CE-CD1 4.1Å; A127-L131 HydrophobicContact CB-CD1 3.93Å; A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 WeakPolarHBondContact O-CD1 3.44Å; A127-L131 PolarHBondContact O-N 2.9Å; L131-K133 VanDerWaalsContact C-N 3.31Å; L131-F402 WeakPolarHBondContact O-CE1 3.23Å
132G75.9Confident87.8Confident6 Ų68.1 Ų8.16%0.0625%0.052CC..THydrogen-bonded Turntrans87.4-12.5-175.700000115.4H72 V130 Y401 F402H72-G132 PolarHBondContact CE1-N 3.4Å; H72-G132 WeakPolarHBondContact NE2-CA 3.21Å; H72-G132 PolarHBondContact NE2-N 3.4Å; V130-G132 PolarHBondContact O-N 3.02Å; G132-Y401 CarbonylContact O-C 3.6Å; G132-Y401 WeakPolarHBondContact O-CA 3.35Å; G132-F402 PolarHBondContact O-N 2.9Å
133K79Confident88Confident13 Ų138 Ų86%0.0575%0.052CC..THydrogen-bonded Turntrans-109.1-18.7174.6-54.8178.6-171158.50113.5V130 L131 L187 H324 P396 Y401 F402V130-K133 WeakPolarHBondContact O-CB 3.29Å; V130-K133 PolarHBondContact O-N 3.49Å; L131-K133 VanDerWaalsContact C-N 3.31Å; K133-L187 HydrophobicContact CB-CD1 4.44Å; K133-H324 PolarHBondContact NZ-O 2.9Å; K133-P396 VanDerWaalsContact O-CG 3.27Å; K133-P396 WeakPolarHBondContact O-CG 3.28Å; K133-Y401 HydrophobicContact CB-CD1 4.5Å; K133-Y401 HydrophobicContact CB-CD2 4.31Å; K133-Y401 HydrophobicContact CB-CE1 4.28Å; K133-Y401 HydrophobicContact CB-CE2 4.1Å; K133-Y401 HydrophobicContact CD-CD2 4.44Å; K133-Y401 HydrophobicContact CD-CE2 4.21Å; K133-Y401 HydrophobicContact CG-CD2 3.8Å; K133-Y401 HydrophobicContact CG-CE2 3.88Å; K133-Y401 HydrophobicContact CG-CG 4.23Å; K133-F402 HydrophobicContact CG-CZ 4.23Å
134V84.6Confident88Confident2 Ų210.1 Ų10.11%0.0126%0.063CC..SBendtrans-114.8152.2-175.4-62.30000111.2V130 Q138 L139 L187V130-V134 HydrophobicContact CB-CG1 4.14Å; V130-V134 HydrophobicContact CB-CG2 4.23Å; V130-V134 HydrophobicContact CG2-CG2 3.96Å; V134-Q138 VanDerWaalsContact CA-OE1 3.23Å; V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.46Å; V134-L139 HydrophobicContact CG2-CD1 4.42Å; V134-L139 HydrophobicContact CG2-CD2 3.44Å; V134-L139 VanDerWaalsContact CG2-CD2 3.44Å; V134-L139 HydrophobicContact CG2-CG 3.79Å; V134-L187 HydrophobicContact CG1-CD1 3.61Å; V134-L187 HydrophobicContact CG1-CD2 4.28Å
135N85.9Confident88.2Confident3 Ų312 Ų122%0.0168%0.075CC..  trans-92.9173173.667.728.9000112A137 Q138 L139 W393 K394 F407N135-A137 VanDerWaalsContact C-N 3.3Å; N135-A137 PolarHBondContact O-N 3.45Å; N135-A137 PolarHBondContact OD1-N 3.27Å; N135-Q138 WeakPolarHBondContact O-CB 3.43Å; N135-Q138 PolarHBondContact O-N 2.88Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.12Å; N135-Q138 PolarHBondContact OD1-N 2.83Å; N135-Q138 PolarHBondContact OD1-OE1 3.5Å; N135-L139 PolarHBondContact O-N 2.97Å; N135-W393 PolarHBondContact ND2-O 3.4Å; N135-K394 PolarHBondContact ND2-O 2.62Å; N135-F407 HydrophobicContact CB-CE1 3.74Å; N135-F407 HydrophobicContact CB-CZ 3.81Å
136L86.3Confident88.5Confident21 Ų2111.1 Ų11.111%0.117%0.07CC..Hα-helixtrans-61.4-33.4-177.7-17164.9000113.5L13 F79 F82 L139 V140L13-L136 HydrophobicContact CD1-CB 3.9Å; L13-L136 HydrophobicContact CD2-CB 4.12Å; L13-L136 HydrophobicContact CD2-CD2 3.77Å; L13-L136 HydrophobicContact CD2-CG 4.42Å; L13-L136 HydrophobicContact CG-CB 4.5Å; L13-L136 HydrophobicContact CG-CD2 4.43Å; F79-L136 HydrophobicContact CB-CD1 4.2Å; F79-L136 HydrophobicContact CD1-CD1 3.69Å; F79-L136 HydrophobicContact CD1-CG 4.49Å; F79-L136 HydrophobicContact CE1-CB 4.22Å; F79-L136 HydrophobicContact CE1-CD1 4.2Å; F79-L136 HydrophobicContact CE1-CD2 4.49Å; F79-L136 HydrophobicContact CG-CD1 3.94Å; F79-L136 HydrophobicContact CZ-CB 4.33Å; F82-L136 HydrophobicContact CB-CD1 4.35Å; F82-L136 HydrophobicContact CD1-CD1 3.55Å; F82-L136 HydrophobicContact CD1-CD2 4.49Å; F82-L136 HydrophobicContact CD1-CG 4.26Å; F82-L136 HydrophobicContact CE1-CD1 4.04Å; F82-L136 HydrophobicContact CE1-CG 4.3Å; F82-L136 HydrophobicContact CG-CD1 3.96Å; F82-L136 HydrophobicContact CG-CD2 4.48Å; L136-L139 PolarHBondContact O-N 3.35Å; L136-V140 VanDerWaalsContact O-CG2 3.31Å; L136-V140 WeakPolarHBondContact O-CG2 3.44Å; L136-V140 PolarHBondContact O-N 2.8Å
137A87.4Confident88.7Confident23 Ų2311.1 Ų11.119%0.197%0.07CC..Hα-helixtrans-66.8-41177.300000111.6L13 N135 L139 V140 V141 W393L13-A137 HydrophobicContact CD1-CB 3.74Å; N135-A137 VanDerWaalsContact C-N 3.3Å; N135-A137 PolarHBondContact O-N 3.45Å; N135-A137 PolarHBondContact OD1-N 3.27Å; A137-L139 VanDerWaalsContact C-N 3.29Å; A137-L139 PolarHBondContact O-N 2.76Å; A137-V140 WeakPolarHBondContact O-CB 3.42Å; A137-V140 PolarHBondContact O-N 3.47Å; A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 3Å; A137-W393 HydrophobicContact CB-CE3 4.06Å; A137-W393 HydrophobicContact CB-CZ3 4.47Å
138Q90.2Very high88.9Confident2 Ų213.3 Ų13.31%0.0098%0.083CC..Hα-helixtrans-62.9-38.8174-71.8170.5-49.800111.2V134 N135 V141 M142 L388 W393V134-Q138 VanDerWaalsContact CA-OE1 3.23Å; V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.46Å; N135-Q138 WeakPolarHBondContact O-CB 3.43Å; N135-Q138 PolarHBondContact O-N 2.88Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.12Å; N135-Q138 PolarHBondContact OD1-N 2.83Å; N135-Q138 PolarHBondContact OD1-OE1 3.5Å; Q138-V141 PolarHBondContact O-N 3.4Å; Q138-M142 WeakPolarHBondContact O-CB 3.43Å; Q138-M142 PolarHBondContact O-N 2.58Å; Q138-L388 HydrophobicContact CB-CD1 4.38Å; Q138-L388 HydrophobicContact CB-CD2 3.82Å; Q138-L388 HydrophobicContact CG-CD2 4.13Å; Q138-L388 PolarHBondContact NE2-O 3.11Å; Q138-L388 VanDerWaalsContact O-CD2 3.27Å; Q138-L388 WeakPolarHBondContact O-CD2 3.43Å; Q138-W393 HydrophobicContact CG-CB 3.75Å; Q138-W393 HydrophobicContact CG-CG 3.96Å
139L91.8Very high89.4Confident1 Ų113 Ų131%0.0058%0.08CC..Hα-helixtrans-66.1-39.5175.3-67.5176.7000112.8F79 M83 A127 V130 V134 N135 L136 A137 V141 M142 V143F79-L139 HydrophobicContact CB-CD1 3.74Å; F79-L139 HydrophobicContact CD2-CD1 3.74Å; F79-L139 HydrophobicContact CG-CD1 4.04Å; M83-L139 HydrophobicContact CE-CD1 4.3Å; M83-L139 HydrophobicContact CG-CB 4.13Å; M83-L139 HydrophobicContact SD-CB 3.88Å; M83-L139 HydrophobicContact SD-CD1 4.03Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.07Å; A127-L139 HydrophobicContact CB-CD2 4.45Å; V130-L139 HydrophobicContact CG2-CD2 4.41Å; V134-L139 HydrophobicContact CG2-CD1 4.42Å; V134-L139 HydrophobicContact CG2-CD2 3.44Å; V134-L139 VanDerWaalsContact CG2-CD2 3.44Å; V134-L139 HydrophobicContact CG2-CG 3.79Å; N135-L139 PolarHBondContact O-N 2.97Å; L136-L139 PolarHBondContact O-N 3.35Å; A137-L139 VanDerWaalsContact C-N 3.29Å; A137-L139 PolarHBondContact O-N 2.76Å; L139-V141 VanDerWaalsContact C-N 3.29Å; L139-V141 PolarHBondContact O-N 3.26Å; L139-M142 HydrophobicContact CD2-SD 4.42Å; L139-M142 WeakPolarHBondContact O-CB 3.34Å; L139-M142 PolarHBondContact O-N 3.5Å; L139-V143 VanDerWaalsContact O-CG2 3.26Å; L139-V143 WeakPolarHBondContact O-CG2 3.49Å; L139-V143 PolarHBondContact O-N 2.92Å
140V92.6Very high89.9Confident23 Ų2312.9 Ų12.914%0.1398%0.079CC..Hα-helixtrans-54.6-48.6172.6169.30000110.3L20 F82 L86 L136 A137 V143 L144L20-V140 HydrophobicContact CD2-CG1 3.61Å; F82-V140 HydrophobicContact CE1-CG2 3.51Å; F82-V140 HydrophobicContact CZ-CG2 3.97Å; L86-V140 HydrophobicContact CD2-CB 4.28Å; L86-V140 HydrophobicContact CD2-CG1 3.95Å; L86-V140 HydrophobicContact CD2-CG2 4.25Å; L136-V140 VanDerWaalsContact O-CG2 3.31Å; L136-V140 WeakPolarHBondContact O-CG2 3.44Å; L136-V140 PolarHBondContact O-N 2.8Å; A137-V140 WeakPolarHBondContact O-CB 3.42Å; A137-V140 PolarHBondContact O-N 3.47Å; V140-V143 PolarHBondContact O-N 3.14Å; V140-L144 HydrophobicContact CG1-CD1 4.25Å; V140-L144 WeakPolarHBondContact O-CG 3.31Å; V140-L144 PolarHBondContact O-N 2.88Å
141V92.9Very high90.2Very high22 Ų2212.9 Ų12.913%0.1338%0.079CC..Hα-helixtrans-67.8-40.1-178.4-179.50000111.6A137 Q138 L139 V143 L144 V145 L387 L388 W393A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 3Å; Q138-V141 PolarHBondContact O-N 3.4Å; L139-V141 VanDerWaalsContact C-N 3.29Å; L139-V141 PolarHBondContact O-N 3.26Å; V141-V143 VanDerWaalsContact C-N 3.33Å; V141-V143 PolarHBondContact O-N 3.05Å; V141-L144 PolarHBondContact O-N 3.35Å; V141-V145 HydrophobicContact CG1-CG2 4.2Å; V141-V145 WeakPolarHBondContact O-CG2 3.42Å; V141-V145 PolarHBondContact O-N 3.42Å; V141-L387 HydrophobicContact CB-CD2 4.37Å; V141-L387 HydrophobicContact CG1-CD2 3.24Å; V141-L388 HydrophobicContact CB-CD2 4.1Å; V141-L388 HydrophobicContact CG1-CD2 4.33Å; V141-W393 HydrophobicContact CG2-CH2 3.57Å; V141-W393 HydrophobicContact CG2-CZ2 3.93Å; V141-W393 HydrophobicContact CG2-CZ3 4.03Å
142M94.8Very high90.7Very high0 Ų014.7 Ų14.70%09%0.09CC..Hα-helixtrans-57.5-45.5174-175175.9171.200111.6S126 A127 V130 Q138 L139 V145 E146 F179 T384 L388S126-M142 VanDerWaalsContact C-CE 3.5Å; S126-M142 VanDerWaalsContact CB-CE 3.41Å; A127-M142 HydrophobicContact CB-CE 4.33Å; V130-M142 HydrophobicContact CG2-CE 4.25Å; V130-M142 HydrophobicContact CG2-SD 3.77Å; Q138-M142 WeakPolarHBondContact O-CB 3.43Å; Q138-M142 PolarHBondContact O-N 2.58Å; L139-M142 HydrophobicContact CD2-SD 4.42Å; L139-M142 WeakPolarHBondContact O-CB 3.34Å; L139-M142 PolarHBondContact O-N 3.5Å; M142-V145 PolarHBondContact O-N 3.41Å; M142-E146 WeakPolarHBondContact O-CB 3.45Å; M142-E146 PolarHBondContact O-N 3.32Å; M142-F179 HydrophobicContact CE-CD1 4.2Å; M142-F179 HydrophobicContact CE-CE1 3.89Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; M142-T384 HydrophobicContact CB-CG2 4.38Å; M142-T384 HydrophobicContact CG-CG2 4.34Å; M142-L388 HydrophobicContact CB-CD1 4.4Å
143V96.2Very high91.4Very high0 Ų014.4 Ų14.40%09%0.087CC..Hα-helixtrans-57.8-50.5175.3172.80000111.1M83 L86 V123 L139 V140 V141 V145 V147M83-V143 HydrophobicContact CB-CG2 3.75Å; M83-V143 HydrophobicContact CG-CG2 3.64Å; M83-V143 HydrophobicContact SD-CG2 4.3Å; L86-V143 HydrophobicContact CB-CG1 4.43Å; L86-V143 HydrophobicContact CD2-CB 4.18Å; L86-V143 HydrophobicContact CD2-CG1 4.05Å; L86-V143 HydrophobicContact CG-CG1 4.02Å; V123-V143 HydrophobicContact CG1-CB 4.3Å; V123-V143 HydrophobicContact CG1-CG2 3.7Å; L139-V143 VanDerWaalsContact O-CG2 3.26Å; L139-V143 WeakPolarHBondContact O-CG2 3.49Å; L139-V143 PolarHBondContact O-N 2.92Å; V140-V143 PolarHBondContact O-N 3.14Å; V141-V143 VanDerWaalsContact C-N 3.33Å; V141-V143 PolarHBondContact O-N 3.05Å; V143-V145 PolarHBondContact O-N 3.47Å; V143-V147 HydrophobicContact CG1-CG2 4.29Å; V143-V147 WeakPolarHBondContact O-CB 3.3Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.5Å; V143-V147 PolarHBondContact O-N 3.38Å; V143-V147 VanDerWaalsContact O-N 3.09Å
144L95.4Very high91.8Very high44 Ų4413.9 Ų13.923%0.239%0.085CC..Hα-helixtrans-61.4-45.2-177.6-67175.3000111.7L20 W90 V140 V141 T148L20-L144 HydrophobicContact CD1-CD1 4.5Å; L20-L144 HydrophobicContact CD2-CD1 4.49Å; W90-L144 HydrophobicContact CB-CD2 4.42Å; W90-L144 HydrophobicContact CD2-CD2 3.85Å; W90-L144 HydrophobicContact CG-CD2 3.77Å; W90-L144 PolarHBondContact NE1-O 3.07Å; W90-L144 VanDerWaalsContact NE1-O 3.14Å; V140-L144 HydrophobicContact CG1-CD1 4.25Å; V140-L144 WeakPolarHBondContact O-CG 3.31Å; V140-L144 PolarHBondContact O-N 2.88Å; V141-L144 PolarHBondContact O-N 3.35Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 2.99Å; L144-T148 PolarHBondContact O-OG1 2.85Å
145V96.3Very high91.9Very high43 Ų4316.1 Ų16.126%0.26110%0.096SC..Hα-helixtrans-71.8-46.5-178.2179.60000111.7V141 M142 V143 T148 A149 T384V141-V145 HydrophobicContact CG1-CG2 4.2Å; V141-V145 WeakPolarHBondContact O-CG2 3.42Å; V141-V145 PolarHBondContact O-N 3.42Å; M142-V145 PolarHBondContact O-N 3.41Å; V143-V145 PolarHBondContact O-N 3.47Å; V145-T148 PolarHBondContact O-N 3.03Å; V145-A149 WeakPolarHBondContact O-CB 3.39Å; V145-A149 PolarHBondContact O-N 2.96Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.29Å
146E96Very high92Very high0 Ų018.1 Ų18.10%011%0.108CC..Hα-helixtrans-66.6-44.7-175.3-171177.9158.500112.2S122 V123 S126 M142 T148 A149 L150 F175 F179S122-E146 VanDerWaalsContact C-OE1 3.23Å; S122-E146 PolarHBondContact OG-OE1 3.46Å; V123-E146 WeakPolarHBondContact CA-OE1 3.05Å; V123-E146 WeakPolarHBondContact CA-OE2 3.22Å; V123-E146 HydrophobicContact CG2-CB 4.03Å; V123-E146 HydrophobicContact CG2-CG 4.12Å; V123-E146 PolarHBondContact N-OE1 2.75Å; S126-E146 WeakPolarHBondContact CB-OE1 3.43Å; S126-E146 WeakPolarHBondContact CB-OE2 3.24Å; S126-E146 PolarHBondContact OG-OE1 2.82Å; S126-E146 PolarHBondContact OG-OE2 3.49Å; M142-E146 WeakPolarHBondContact O-CB 3.45Å; M142-E146 PolarHBondContact O-N 3.32Å; E146-T148 VanDerWaalsContact C-N 3.3Å; E146-T148 PolarHBondContact O-N 2.67Å; E146-A149 PolarHBondContact O-N 3.35Å; E146-L150 WeakPolarHBondContact O-CB 3.32Å; E146-L150 PolarHBondContact O-N 2.99Å; E146-F175 HydrophobicContact CG-CE1 3.91Å; E146-F179 HydrophobicContact CB-CD1 4.23Å; E146-F179 HydrophobicContact CB-CE1 3.62Å; E146-F179 HydrophobicContact CB-CE2 4.18Å; E146-F179 HydrophobicContact CB-CZ 3.59Å; E146-F179 HydrophobicContact CG-CD1 3.73Å; E146-F179 HydrophobicContact CG-CD2 4.31Å; E146-F179 HydrophobicContact CG-CE1 3.66Å; E146-F179 HydrophobicContact CG-CE2 4.24Å; E146-F179 HydrophobicContact CG-CG 4.07Å; E146-F179 HydrophobicContact CG-CZ 3.93Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.27Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.37Å
147V95.7Very high92Very high1 Ų117.1 Ų17.11%0.00610%0.103CC..Hα-helixtrans-63.9-38.6176.9178.30000110.6A91 L94 V123 V143 L150 G151A91-V147 HydrophobicContact CB-CG1 3.61Å; L94-V147 HydrophobicContact CD1-CB 4.32Å; L94-V147 HydrophobicContact CD1-CG1 3.73Å; V123-V147 HydrophobicContact CG2-CG2 3.54Å; V143-V147 HydrophobicContact CG1-CG2 4.29Å; V143-V147 WeakPolarHBondContact O-CB 3.3Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.5Å; V143-V147 PolarHBondContact O-N 3.38Å; V143-V147 VanDerWaalsContact O-N 3.09Å; V147-L150 PolarHBondContact O-N 3.43Å; V147-G151 PolarHBondContact O-N 2.89Å
148T95.1Very high91.8Very high45 Ų4517 Ų1728%0.27610%0.1SC..Hα-helixtrans-62.5-48.9174.3-51.90000110.5W90 L94 L144 V145 E146 L150 G151 T152W90-T148 PolarHBondContact NE1-OG1 2.67Å; L94-T148 HydrophobicContact CD2-CG2 4.32Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 2.99Å; L144-T148 PolarHBondContact O-OG1 2.85Å; V145-T148 PolarHBondContact O-N 3.03Å; E146-T148 VanDerWaalsContact C-N 3.3Å; E146-T148 PolarHBondContact O-N 2.67Å; T148-L150 VanDerWaalsContact C-N 3.33Å; T148-L150 PolarHBondContact O-N 2.86Å; T148-G151 PolarHBondContact O-N 3.12Å; T148-T152 HydrophobicContact CG2-CG2 4.43Å; T148-T152 WeakPolarHBondContact O-CG2 3.35Å; T148-T152 PolarHBondContact O-N 3.41Å; T148-T152 PolarHBondContact O-OG1 3.2Å
149A95.2Very high91.5Very high9 Ų922.2 Ų22.27%0.07413%0.128CC..Hα-helixtrans-59.5-43.8179.200000111.5V145 E146 T152 L153 F175 I376V145-A149 WeakPolarHBondContact O-CB 3.39Å; V145-A149 PolarHBondContact O-N 2.96Å; E146-A149 PolarHBondContact O-N 3.35Å; A149-T152 WeakPolarHBondContact CA-OG1 3.13Å; A149-T152 PolarHBondContact O-N 2.81Å; A149-T152 PolarHBondContact O-OG1 2.88Å; A149-L153 WeakPolarHBondContact O-CB 3.46Å; A149-L153 PolarHBondContact O-N 3.36Å; A149-F175 HydrophobicContact CB-CZ 3.85Å; A149-I376 HydrophobicContact CB-CG2 4.41Å
150L92.4Very high91.1Very high2 Ų227.3 Ų27.31%0.0115%0.154CC..Hα-helixtrans-66.2-38.9176.2-17559.7000112.5E146 V147 T148 L153 R154 F175E146-L150 WeakPolarHBondContact O-CB 3.32Å; E146-L150 PolarHBondContact O-N 2.99Å; V147-L150 PolarHBondContact O-N 3.43Å; T148-L150 VanDerWaalsContact C-N 3.33Å; T148-L150 PolarHBondContact O-N 2.86Å; L150-L153 HydrophobicContact CD1-CD2 4.28Å; L150-L153 PolarHBondContact O-N 3.32Å; L150-R154 WeakPolarHBondContact O-CG 3.47Å; L150-R154 PolarHBondContact O-N 3Å; L150-R154 VanDerWaalsContact O-N 3.11Å; L150-F175 HydrophobicContact CB-CD1 4.4Å; L150-F175 HydrophobicContact CB-CE1 3.88Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.89Å; L150-F175 HydrophobicContact CD1-CE1 4.21Å; L150-F175 HydrophobicContact CD1-CG 4.12Å
151G90.8Very high90.4Very high0 Ų028.3 Ų28.30%016%0.157CC..Hα-helixtrans-60.8-46.7171.800000112.2V147 T148 L153 R154 M155V147-G151 PolarHBondContact O-N 2.89Å; T148-G151 PolarHBondContact O-N 3.12Å; G151-L153 PolarHBondContact O-N 3.39Å; G151-R154 PolarHBondContact O-N 3.02Å; G151-M155 PolarHBondContact O-N 3.38Å
152T89.7Confident89.4Confident48 Ų4834.4 Ų34.429%0.29419%0.189SC..Hα-helixtrans-64.8-39.8177.459.80000112.4L98 T148 A149 R154 M155 V156L98-T152 HydrophobicContact CD1-CG2 4.45Å; T148-T152 HydrophobicContact CG2-CG2 4.43Å; T148-T152 WeakPolarHBondContact O-CG2 3.35Å; T148-T152 PolarHBondContact O-N 3.41Å; T148-T152 PolarHBondContact O-OG1 3.2Å; A149-T152 WeakPolarHBondContact CA-OG1 3.13Å; A149-T152 PolarHBondContact O-N 2.81Å; A149-T152 PolarHBondContact O-OG1 2.88Å; T152-R154 VanDerWaalsContact C-N 3.32Å; T152-R154 PolarHBondContact O-N 3.38Å; T152-M155 PolarHBondContact O-N 3.23Å; T152-V156 WeakPolarHBondContact O-CB 3.29Å; T152-V156 VanDerWaalsContact O-CG2 3.24Å; T152-V156 WeakPolarHBondContact O-CG2 3.29Å; T152-V156 PolarHBondContact O-N 2.99Å
153L90.6Very high88.1Confident1 Ų136.5 Ų36.51%0.00520%0.202CC..Hα-helixtrans-57.1-47.2173.6173.565.4000110.8A149 L150 G151 M155 V156 I157 F175 L372 A373 I376A149-L153 WeakPolarHBondContact O-CB 3.46Å; A149-L153 PolarHBondContact O-N 3.36Å; L150-L153 HydrophobicContact CD1-CD2 4.28Å; L150-L153 PolarHBondContact O-N 3.32Å; G151-L153 PolarHBondContact O-N 3.39Å; L153-M155 PolarHBondContact O-N 3.47Å; L153-V156 PolarHBondContact O-N 3.19Å; L153-I157 HydrophobicContact CD1-CD1 3.64Å; L153-I157 HydrophobicContact CD1-CG1 4.07Å; L153-I157 HydrophobicContact CG-CD1 3.9Å; L153-I157 WeakPolarHBondContact O-CB 3.42Å; L153-I157 VanDerWaalsContact O-CG1 3.31Å; L153-I157 WeakPolarHBondContact O-CG1 3.44Å; L153-I157 PolarHBondContact O-N 2.96Å; L153-F175 HydrophobicContact CD2-CD2 3.69Å; L153-F175 HydrophobicContact CD2-CE2 4.21Å; L153-F175 HydrophobicContact CD2-CG 4.33Å; L153-L372 HydrophobicContact CD1-CD2 4.25Å; L153-L372 HydrophobicContact CD1-CG 4.06Å; L153-A373 HydrophobicContact CD1-CB 4.13Å; L153-A373 HydrophobicContact CD2-CB 3.82Å; L153-I376 HydrophobicContact CB-CD1 4.18Å; L153-I376 HydrophobicContact CD1-CD1 3.8Å; L153-I376 HydrophobicContact CD1-CG1 4.49Å
154R88.4Confident86.5Confident1 Ų140.5 Ų40.50%0.00422%0.223CC..Hα-helixtrans-62.5-42.1178.3-72.6-175.9-69.7151.6-2.6112.5D95 S119 L150 G151 T152 S158 Y165 N168D95-R154 VanDerWaalsContact CG-NH2 3.26Å; D95-R154 IonicContact OD1-CZ 3.74Å; D95-R154 IonicContact OD1-NH1 3.92Å; D95-R154 PolarHBondContact OD1-NH1 2.88Å; D95-R154 IonicContact OD1-NH2 3.12Å; D95-R154 PolarHBondContact OD1-NH2 3.39Å; D95-R154 IonicContact OD2-CZ 3.98Å; D95-R154 IonicContact OD2-NH1 3.54Å; D95-R154 PolarHBondContact OD2-NH1 3.33Å; D95-R154 IonicContact OD2-NH2 3.89Å; D95-R154 PolarHBondContact OD2-NH2 2.89Å; D95-R154 VanDerWaalsContact OD2-NH2 3.12Å; S119-R154 PolarHBondContact OG-NH2 2.86Å; L150-R154 WeakPolarHBondContact O-CG 3.47Å; L150-R154 PolarHBondContact O-N 3Å; L150-R154 VanDerWaalsContact O-N 3.11Å; G151-R154 PolarHBondContact O-N 3.02Å; T152-R154 VanDerWaalsContact C-N 3.32Å; T152-R154 PolarHBondContact O-N 3.38Å; R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.41Å; R154-S158 PolarHBondContact O-N 3.45Å; R154-Y165 HydrophobicContact CB-CE2 4.17Å; R154-N168 HydrophobicContact CB-CB 4.12Å; R154-N168 HydrophobicContact CG-CB 3.89Å; R154-N168 PolarHBondContact O-ND2 3.4Å
155M87Confident84.7Confident49 Ų4939.4 Ų39.424%0.24122%0.216CC..Hα-helixtrans-62.5-49.7175.9-172.1-142.6-78.800111.4L98 G151 T152 L153 I157 S158 N159 Y165L98-M155 HydrophobicContact CB-CE 3.6Å; L98-M155 HydrophobicContact CD2-CE 3.29Å; L98-M155 HydrophobicContact CG-CE 3.91Å; G151-M155 PolarHBondContact O-N 3.38Å; T152-M155 PolarHBondContact O-N 3.23Å; L153-M155 PolarHBondContact O-N 3.47Å; M155-I157 PolarHBondContact O-N 3.27Å; M155-S158 PolarHBondContact O-N 3.48Å; M155-N159 WeakPolarHBondContact O-CB 3.31Å; M155-N159 VanDerWaalsContact O-CG 3.27Å; M155-N159 PolarHBondContact O-N 3.11Å; M155-Y165 HydrophobicContact CB-CE2 3.91Å
156V87.9Confident82.6Confident46 Ų4639.5 Ų39.528%0.27921%0.213SC..Hα-helixtrans-62.7-44.3-178.7173.80000110.7T152 L153 S158 N159 I160 L372T152-V156 WeakPolarHBondContact O-CB 3.29Å; T152-V156 VanDerWaalsContact O-CG2 3.24Å; T152-V156 WeakPolarHBondContact O-CG2 3.29Å; T152-V156 PolarHBondContact O-N 2.99Å; L153-V156 PolarHBondContact O-N 3.19Å; V156-S158 PolarHBondContact O-N 3.43Å; V156-N159 PolarHBondContact O-N 3.49Å; V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.24Å; V156-I160 WeakPolarHBondContact O-CB 3.4Å; V156-I160 VanDerWaalsContact O-CG1 3.29Å; V156-I160 WeakPolarHBondContact O-CG1 3.36Å; V156-I160 PolarHBondContact O-N 2.88Å; V156-L372 HydrophobicContact CG1-CD2 3.76Å
157I85.1Confident80.7Confident0 Ų042.3 Ų42.30%023%0.227CC..Hα-helixtrans-60.6-46.9175.7-70.1173.6000110.3L153 M155 N159 I160 F161 N168 E369 L372L153-I157 HydrophobicContact CD1-CD1 3.64Å; L153-I157 HydrophobicContact CD1-CG1 4.07Å; L153-I157 HydrophobicContact CG-CD1 3.9Å; L153-I157 WeakPolarHBondContact O-CB 3.42Å; L153-I157 VanDerWaalsContact O-CG1 3.31Å; L153-I157 WeakPolarHBondContact O-CG1 3.44Å; L153-I157 PolarHBondContact O-N 2.96Å; M155-I157 PolarHBondContact O-N 3.27Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.49Å; I157-I160 PolarHBondContact O-N 3.37Å; I157-F161 HydrophobicContact CB-CD2 4.45Å; I157-F161 HydrophobicContact CG2-CD2 4.07Å; I157-F161 WeakPolarHBondContact O-CB 3.41Å; I157-F161 WeakPolarHBondContact O-CD2 3.46Å; I157-F161 PolarHBondContact O-N 3.36Å; I157-N168 HydrophobicContact CG2-CB 4.35Å; I157-E369 HydrophobicContact CD1-CB 4.47Å; I157-E369 HydrophobicContact CG2-CG 4.14Å; I157-L372 HydrophobicContact CG1-CD2 3.99Å
158S83.8Confident79Confident20 Ų2042.8 Ų42.814%0.1423%0.23CC..Hα-helixtrans-60.1-44.2179.9-169.20000112R154 M155 V156 N162 T163 Y165 N168R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.41Å; R154-S158 PolarHBondContact O-N 3.45Å; M155-S158 PolarHBondContact O-N 3.48Å; V156-S158 PolarHBondContact O-N 3.43Å; S158-N162 WeakPolarHBondContact O-CA 3.29Å; S158-N162 PolarHBondContact O-N 3.25Å; S158-T163 WeakPolarHBondContact CB-O 3.38Å; S158-T163 PolarHBondContact OG-O 3.3Å; S158-Y165 PolarHBondContact OG-N 3.19Å; S158-N168 PolarHBondContact N-ND2 3.22Å
159N83.6Confident77.6Confident111 Ų11140.9 Ų40.959%0.59422%0.218SC*.Hα-helixtrans-71.4-36.8-178.3-70.5-12000113.3M155 V156 I157M155-N159 WeakPolarHBondContact O-CB 3.31Å; M155-N159 VanDerWaalsContact O-CG 3.27Å; M155-N159 PolarHBondContact O-N 3.11Å; V156-N159 PolarHBondContact O-N 3.49Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.49Å
160I83Confident76.6Confident108 Ų10842.3 Ų42.355%0.55422%0.221SC*.Hα-helixtrans-80.1-43.8-178.4-66.7176.4000111.1V156 I157V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.24Å; V156-I160 WeakPolarHBondContact O-CB 3.4Å; V156-I160 VanDerWaalsContact O-CG1 3.29Å; V156-I160 WeakPolarHBondContact O-CG1 3.36Å; V156-I160 PolarHBondContact O-N 2.88Å; I157-I160 PolarHBondContact O-N 3.37Å
161F77.6Confident76.1Confident45 Ų4542.3 Ų42.320%0.19722%0.221CC..Hα-helixtrans-100.30.1-170.6-61.4-85.9000113.3I157 T163 L365 E369I157-F161 HydrophobicContact CB-CD2 4.45Å; I157-F161 HydrophobicContact CG2-CD2 4.07Å; I157-F161 WeakPolarHBondContact O-CB 3.41Å; I157-F161 WeakPolarHBondContact O-CD2 3.46Å; I157-F161 PolarHBondContact O-N 3.36Å; F161-T163 HydrophobicContact CB-CG2 3.9Å; F161-T163 PolarHBondContact O-N 3.05Å; F161-L365 HydrophobicContact CD1-CB 4.03Å; F161-L365 HydrophobicContact CD1-CD1 4.34Å; F161-L365 HydrophobicContact CD1-CD2 3.68Å; F161-L365 HydrophobicContact CD1-CG 4.2Å; F161-L365 HydrophobicContact CE1-CB 3.97Å; F161-L365 HydrophobicContact CE1-CD2 3.54Å; F161-L365 HydrophobicContact CE1-CG 4.26Å; F161-E369 HydrophobicContact CD1-CG 4.15Å; F161-E369 HydrophobicContact CD2-CG 3.69Å; F161-E369 HydrophobicContact CE1-CG 4.03Å; F161-E369 HydrophobicContact CE2-CG 3.55Å; F161-E369 HydrophobicContact CG-CG 4Å; F161-E369 HydrophobicContact CZ-CG 3.74Å
162N72.6Confident75.9Confident149 Ų14942.8 Ų42.880%0.79722%0.224SC*.  trans51.735.3-175.5-69.4-42.2000112.9S158S158-N162 WeakPolarHBondContact O-CA 3.29Å; S158-N162 PolarHBondContact O-N 3.25Å
163T68.8Low75.8Confident45 Ų4540.7 Ų40.728%0.27621%0.21SC..  trans-92.8155.5178.257.10000111.1S158 F161 Y165 N168S158-T163 WeakPolarHBondContact CB-O 3.38Å; S158-T163 PolarHBondContact OG-O 3.3Å; F161-T163 HydrophobicContact CB-CG2 3.9Å; F161-T163 PolarHBondContact O-N 3.05Å; T163-Y165 PolarHBondContact O-N 3.18Å; T163-N168 PolarHBondContact OG1-ND2 3.03Å; T163-N168 PolarHBondContact OG1-OD1 3.43Å
164D62.7Low75.8Confident84 Ų8440.7 Ų40.745%0.44921%0.21SC..  trans-54.2112.7174.3-93.2-46.5000110.7H166 M167 N168 R229D164-H166 PolarHBondContact O-N 3.11Å; D164-M167 HydrophobicContact CB-CB 3.84Å; D164-M167 HydrophobicContact CB-CG 3.55Å; D164-M167 WeakPolarHBondContact O-CB 3.43Å; D164-M167 PolarHBondContact O-N 3.15Å; D164-N168 PolarHBondContact O-OD1 3.41Å; D164-R229 VanDerWaalsContact CG-NH1 3.32Å; D164-R229 IonicContact OD1-CZ 3.47Å; D164-R229 IonicContact OD1-NH1 3.04Å; D164-R229 PolarHBondContact OD1-NH1 3.38Å; D164-R229 VanDerWaalsContact OD1-NH1 3.11Å; D164-R229 IonicContact OD1-NH2 2.88Å; D164-R229 IonicContact OD2-NH1 3.66Å; D164-R229 PolarHBondContact OD2-NH1 3.35Å
165Y55.8Low76Confident21 Ų2140.7 Ų40.78%0.08221%0.21CC..G310 helixtrans-47.2-40.3178.4176.5-92.6000113.1D95 R154 M155 S158 T163 M167D95-Y165 PolarHBondContact OD1-OH 3.42Å; R154-Y165 HydrophobicContact CB-CE2 4.17Å; M155-Y165 HydrophobicContact CB-CE2 3.91Å; S158-Y165 PolarHBondContact OG-N 3.19Å; T163-Y165 PolarHBondContact O-N 3.18Å; Y165-M167 VanDerWaalsContact C-N 3.32Å; Y165-M167 PolarHBondContact O-N 3.46Å
166H53.2Low76.2Confident44 Ų4438.3 Ų38.320%0.20420%0.199CC..G310 helixtrans-77.5-12.8-177.8-63.5-61.8000114.7F111 L115 D164F111-H166 HydrophobicContact CE1-CB 3.61Å; F111-H166 AromaticContact CE1-CG 3.68Å; F111-H166 AromaticContact CE1-ND1 3.81Å; F111-H166 HydrophobicContact CZ-CB 3.8Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.39Å; D164-H166 PolarHBondContact O-N 3.11Å
167M56.6Low76.3Confident59 Ų5936.2 Ų36.229%0.29119%0.186SC..G310 helixtrans-95-7.8178.3-66.6-65.5-149.800112.9D164 Y165 L169 R229D164-M167 HydrophobicContact CB-CB 3.84Å; D164-M167 HydrophobicContact CB-CG 3.55Å; D164-M167 WeakPolarHBondContact O-CB 3.43Å; D164-M167 PolarHBondContact O-N 3.15Å; Y165-M167 VanDerWaalsContact C-N 3.32Å; Y165-M167 PolarHBondContact O-N 3.46Å; M167-L169 PolarHBondContact O-N 3.29Å; M167-R229 HydrophobicContact CE-CB 3.96Å; M167-R229 HydrophobicContact CE-CG 3.64Å
168N59.2Low76.5Confident11 Ų1138.6 Ų38.66%0.05920%0.196CC..THydrogen-bonded Turntrans-78.719-171.2-68.7-21.3000115R154 I157 S158 T163 D164 R170R154-N168 HydrophobicContact CB-CB 4.12Å; R154-N168 HydrophobicContact CG-CB 3.89Å; R154-N168 PolarHBondContact O-ND2 3.4Å; I157-N168 HydrophobicContact CG2-CB 4.35Å; S158-N168 PolarHBondContact N-ND2 3.22Å; T163-N168 PolarHBondContact OG1-ND2 3.03Å; T163-N168 PolarHBondContact OG1-OD1 3.43Å; D164-N168 PolarHBondContact O-OD1 3.41Å; N168-R170 PolarHBondContact O-N 2.95Å
169L65.4Low77Confident6 Ų637.7 Ų37.73%0.03119%0.189CC..THydrogen-bonded Turntrans-81.93.1169.3-101.8107.6000113.4L115 M118 M167 H171 F172 L227L115-L169 HydrophobicContact CD1-CD1 3.43Å; L115-L169 VanDerWaalsContact CD1-CD1 3.43Å; M118-L169 HydrophobicContact CB-CD2 3.64Å; M118-L169 HydrophobicContact CE-CD2 4.27Å; M167-L169 PolarHBondContact O-N 3.29Å; L169-H171 PolarHBondContact O-N 3.37Å; L169-F172 HydrophobicContact CB-CB 4.45Å; L169-F172 HydrophobicContact CD2-CB 3.77Å; L169-F172 HydrophobicContact CD2-CD1 4.25Å; L169-F172 HydrophobicContact CD2-CG 3.97Å; L169-F172 HydrophobicContact CG-CB 4.23Å; L169-F172 VanDerWaalsContact O-CB 3.31Å; L169-F172 WeakPolarHBondContact O-CB 3.49Å; L169-F172 WeakPolarHBondContact O-CD1 3.31Å; L169-F172 PolarHBondContact O-N 2.98Å; L169-L227 HydrophobicContact CB-CD1 3.71Å; L169-L227 HydrophobicContact CD1-CD1 3.92Å; L169-L227 HydrophobicContact CD2-CD1 4.35Å; L169-L227 HydrophobicContact CG-CD1 4.23Å
170R74.1Confident77.3Confident38 Ų3832.4 Ų32.414%0.14316%0.161CC..THydrogen-bonded Turntrans-43.5-43.7177.4-177.9168.761.5107.5-10.4112.7N168 F172 T283 E340 E369N168-R170 PolarHBondContact O-N 2.95Å; R170-F172 VanDerWaalsContact C-N 3.35Å; R170-F172 PolarHBondContact O-N 2.91Å; R170-T283 HydrophobicContact CG-CG2 4.31Å; R170-T283 WeakPolarHBondContact O-CG2 3.5Å; R170-E340 IonicContact NH1-OE2 3.07Å; R170-E340 PolarHBondContact NH1-OE2 3.43Å; R170-E369 IonicContact CZ-OE2 2.71Å; R170-E369 IonicContact NE-OE2 3.41Å; R170-E369 VanDerWaalsContact NH2-CD 3.3Å; R170-E369 IonicContact NH2-OE1 3.31Å; R170-E369 IonicContact NH2-OE2 3.67Å; R170-E369 PolarHBondContact NH2-OE2 3.5Å
171H82.5Confident77.6Confident2 Ų229.3 Ų29.31%0.00915%0.145CC..THydrogen-bonded Turntrans-86.67.3-175.4-57.5-54.4000115.7L169 Y173 V174 F175 E340 E369 A373L169-H171 PolarHBondContact O-N 3.37Å; H171-Y173 PolarHBondContact O-N 2.91Å; H171-V174 PolarHBondContact O-N 3.39Å; H171-F175 WeakPolarHBondContact O-CB 3.08Å; H171-F175 PolarHBondContact O-N 2.82Å; H171-E340 WeakPolarHBondContact CA-OE1 3.43Å; H171-E340 IonicContact CE1-OE1 3.11Å; H171-E340 IonicContact CE1-OE2 2.67Å; H171-E340 PolarHBondContact CE1-OE2 2.89Å; H171-E340 IonicContact CG-OE1 4Å; H171-E340 IonicContact ND1-OE1 3.97Å; H171-E340 PolarHBondContact ND1-OE1 3.41Å; H171-E340 IonicContact ND1-OE2 3.12Å; H171-E340 PolarHBondContact ND1-OE2 3.44Å; H171-E369 VanDerWaalsContact NE2-CB 3.34Å; H171-E369 WeakPolarHBondContact NE2-CB 3.41Å; H171-E369 IonicContact NE2-OE2 3.44Å; H171-A373 HydrophobicContact CB-CB 3.64Å
172F85.7Confident78.2Confident10 Ų1027.7 Ų27.74%0.04414%0.139CC..Hα-helixtrans-64.2-37.3-167.788.7-87.7000113.4M118 M125 L169 R170 F175 A176 V223M118-F172 HydrophobicContact CE-CD1 4.39Å; M118-F172 HydrophobicContact CE-CE1 3.75Å; M118-F172 HydrophobicContact CE-CE2 4.39Å; M118-F172 HydrophobicContact CE-CZ 3.74Å; M125-F172 HydrophobicContact SD-CE2 4.01Å; L169-F172 HydrophobicContact CB-CB 4.45Å; L169-F172 HydrophobicContact CD2-CB 3.77Å; L169-F172 HydrophobicContact CD2-CD1 4.25Å; L169-F172 HydrophobicContact CD2-CG 3.97Å; L169-F172 HydrophobicContact CG-CB 4.23Å; L169-F172 VanDerWaalsContact O-CB 3.31Å; L169-F172 WeakPolarHBondContact O-CB 3.49Å; L169-F172 WeakPolarHBondContact O-CD1 3.31Å; L169-F172 PolarHBondContact O-N 2.98Å; R170-F172 VanDerWaalsContact C-N 3.35Å; R170-F172 PolarHBondContact O-N 2.91Å; F172-F175 PolarHBondContact O-N 3.16Å; F172-A176 VanDerWaalsContact O-CB 3.27Å; F172-A176 WeakPolarHBondContact O-CB 3.44Å; F172-A176 PolarHBondContact O-N 3.3Å; F172-V223 HydrophobicContact CZ-CG1 4.17Å
173Y88.6Confident79.1Confident5 Ų520.6 Ų20.62%0.0210%0.101CC..Hα-helixtrans-61.5-46.2177.1-71.2-67.8000111.9M125 H171 A177 W220 N224 V279M125-Y173 HydrophobicContact CE-CD1 3.6Å; M125-Y173 HydrophobicContact CE-CE1 4.03Å; M125-Y173 HydrophobicContact SD-CD1 4.09Å; M125-Y173 HydrophobicContact SD-CE1 4.2Å; H171-Y173 PolarHBondContact O-N 2.91Å; Y173-A177 VanDerWaalsContact O-CB 3.24Å; Y173-A177 WeakPolarHBondContact O-CB 3.29Å; Y173-A177 PolarHBondContact O-N 3.27Å; Y173-W220 HydrophobicContact CE1-CZ2 4.01Å; Y173-W220 AromaticContact CZ-NE1 3.94Å; Y173-W220 PolarHBondContact OH-NE1 3.22Å; Y173-N224 PolarHBondContact OH-OD1 3.19Å; Y173-V279 HydrophobicContact CD1-CG1 3.98Å; Y173-V279 HydrophobicContact CE1-CG1 4.4Å; Y173-V279 HydrophobicContact CG-CG1 4.2Å
174V90.1Very high79.9Confident1 Ų118.8 Ų18.81%0.0069%0.09CC..Hα-helixtrans-66.6-48.7178172.20000109.7H171 A176 A177 Y178 G336 L337 E340 L370 I374H171-V174 PolarHBondContact O-N 3.39Å; V174-A176 PolarHBondContact O-N 2.97Å; V174-A177 PolarHBondContact O-N 2.85Å; V174-Y178 HydrophobicContact CG1-CD2 3.58Å; V174-Y178 HydrophobicContact CG1-CE2 3.76Å; V174-Y178 VanDerWaalsContact O-CD2 3.24Å; V174-Y178 WeakPolarHBondContact O-CD2 3.34Å; V174-Y178 PolarHBondContact O-N 3.42Å; V174-G336 VanDerWaalsContact CG2-C 3.46Å; V174-L337 HydrophobicContact CG1-CD2 4.32Å; V174-L337 HydrophobicContact CG2-CD2 4.3Å; V174-E340 HydrophobicContact CG2-CG 3.81Å; V174-L370 HydrophobicContact CG1-CD1 4.04Å; V174-L370 HydrophobicContact CG2-CD1 4.44Å; V174-I374 HydrophobicContact CG1-CD1 4.28Å; V174-I374 HydrophobicContact CG1-CG1 3.73Å
175F92.2Very high81Confident0 Ų022.3 Ų22.30%010%0.098CC..Hα-helixtrans-54.2-54.1178.5179.2-89.9000111.8E146 A149 L150 L153 H171 F172 A177 Y178 F179 I376 A377E146-F175 HydrophobicContact CG-CE1 3.91Å; A149-F175 HydrophobicContact CB-CZ 3.85Å; L150-F175 HydrophobicContact CB-CD1 4.4Å; L150-F175 HydrophobicContact CB-CE1 3.88Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.89Å; L150-F175 HydrophobicContact CD1-CE1 4.21Å; L150-F175 HydrophobicContact CD1-CG 4.12Å; L153-F175 HydrophobicContact CD2-CD2 3.69Å; L153-F175 HydrophobicContact CD2-CE2 4.21Å; L153-F175 HydrophobicContact CD2-CG 4.33Å; H171-F175 WeakPolarHBondContact O-CB 3.08Å; H171-F175 PolarHBondContact O-N 2.82Å; F172-F175 PolarHBondContact O-N 3.16Å; F175-A177 VanDerWaalsContact C-N 3.34Å; F175-A177 PolarHBondContact O-N 3.19Å; F175-Y178 PolarHBondContact O-N 3.15Å; F175-F179 HydrophobicContact CZ-CD2 4.48Å; F175-F179 WeakPolarHBondContact O-CB 3.33Å; F175-F179 PolarHBondContact O-N 3.23Å; F175-I376 HydrophobicContact CE2-CB 4.48Å; F175-I376 HydrophobicContact CE2-CG2 4.03Å; F175-A377 HydrophobicContact CD2-CB 3.63Å; F175-A377 HydrophobicContact CE2-CB 3.95Å; F175-A377 HydrophobicContact CG-CB 4.21Å; F175-A377 WeakPolarHBondContact O-CB 3.44Å
176A91.8Very high82.4Confident0 Ų022.4 Ų22.40%010%0.101CC..Hα-helixtrans-59.7-44.6179.400000112S122 M125 S126 F172 V174 G180S122-A176 WeakPolarHBondContact O-CB 3.48Å; S122-A176 WeakPolarHBondContact OG-CB 3.4Å; M125-A176 HydrophobicContact CB-CB 4.06Å; S126-A176 VanDerWaalsContact OG-CA 3.22Å; S126-A176 WeakPolarHBondContact OG-CA 3.27Å; S126-A176 PolarHBondContact OG-O 3.19Å; F172-A176 VanDerWaalsContact O-CB 3.27Å; F172-A176 WeakPolarHBondContact O-CB 3.44Å; F172-A176 PolarHBondContact O-N 3.3Å; V174-A176 PolarHBondContact O-N 2.97Å; A176-G180 PolarHBondContact O-N 3.12Å
177A89.6Confident83.8Confident2 Ų221 Ų212%0.01710%0.095CC..Hα-helixtrans-61.5-50.4-178.800000111.8Y173 V174 F175 L181 H329 S333Y173-A177 VanDerWaalsContact O-CB 3.24Å; Y173-A177 WeakPolarHBondContact O-CB 3.29Å; Y173-A177 PolarHBondContact O-N 3.27Å; V174-A177 PolarHBondContact O-N 2.85Å; F175-A177 VanDerWaalsContact C-N 3.34Å; F175-A177 PolarHBondContact O-N 3.19Å; A177-L181 VanDerWaalsContact O-CB 3.23Å; A177-L181 WeakPolarHBondContact O-CB 3.39Å; A177-L181 PolarHBondContact O-N 3.29Å; A177-H329 WeakPolarHBondContact CA-NE2 3.38Å; A177-H329 PolarHBondContact O-NE2 2.97Å; A177-S333 VanDerWaalsContact CB-CA 3.48Å
178Y90.8Very high84.7Confident50 Ų5020.8 Ų20.820%0.19610%0.098CC..Hα-helixtrans-70.7-37.1-179.6-79.3-76.7000113.1V174 F175 T182 S333 L337 I374 L378V174-Y178 HydrophobicContact CG1-CD2 3.58Å; V174-Y178 HydrophobicContact CG1-CE2 3.76Å; V174-Y178 VanDerWaalsContact O-CD2 3.24Å; V174-Y178 WeakPolarHBondContact O-CD2 3.34Å; V174-Y178 PolarHBondContact O-N 3.42Å; F175-Y178 PolarHBondContact O-N 3.15Å; Y178-T182 WeakPolarHBondContact O-CB 3.42Å; Y178-T182 PolarHBondContact O-N 3.23Å; Y178-T182 PolarHBondContact O-OG1 3.18Å; Y178-S333 WeakPolarHBondContact CE2-OG 3.31Å; Y178-L337 HydrophobicContact CE2-CD1 4.42Å; Y178-L337 HydrophobicContact CE2-CD2 4.22Å; Y178-L337 HydrophobicContact CE2-CG 4.22Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.45Å; Y178-I374 HydrophobicContact CD2-CG1 4.41Å; Y178-L378 HydrophobicContact CD1-CD2 4.12Å
179F93.5Very high85.2Confident0 Ų026.5 Ų26.50%012%0.123CC..Hα-helixtrans-60.2-56.9174.5-178.7-88.7000110.6M142 E146 F175 L181 T182 V183 A377 S380 G381 T384M142-F179 HydrophobicContact CE-CD1 4.2Å; M142-F179 HydrophobicContact CE-CE1 3.89Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; E146-F179 HydrophobicContact CB-CD1 4.23Å; E146-F179 HydrophobicContact CB-CE1 3.62Å; E146-F179 HydrophobicContact CB-CE2 4.18Å; E146-F179 HydrophobicContact CB-CZ 3.59Å; E146-F179 HydrophobicContact CG-CD1 3.73Å; E146-F179 HydrophobicContact CG-CD2 4.31Å; E146-F179 HydrophobicContact CG-CE1 3.66Å; E146-F179 HydrophobicContact CG-CE2 4.24Å; E146-F179 HydrophobicContact CG-CG 4.07Å; E146-F179 HydrophobicContact CG-CZ 3.93Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.27Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.37Å; F175-F179 HydrophobicContact CZ-CD2 4.48Å; F175-F179 WeakPolarHBondContact O-CB 3.33Å; F175-F179 PolarHBondContact O-N 3.23Å; F179-L181 VanDerWaalsContact C-N 3.29Å; F179-L181 PolarHBondContact O-N 3.34Å; F179-T182 PolarHBondContact O-N 3.36Å; F179-T182 VanDerWaalsContact O-N 3.11Å; F179-V183 HydrophobicContact CD1-CG2 4.06Å; F179-V183 HydrophobicContact CE1-CG2 3.74Å; F179-V183 HydrophobicContact CZ-CG2 4.07Å; F179-V183 WeakPolarHBondContact O-CG2 3.24Å; F179-V183 PolarHBondContact O-N 3.41Å; F179-A377 HydrophobicContact CB-CB 4.35Å; F179-S380 VanDerWaalsContact CD2-OG 3.31Å; F179-S380 WeakPolarHBondContact CD2-OG 3.46Å; F179-S380 VanDerWaalsContact CE2-C 3.48Å; F179-S380 WeakPolarHBondContact CE2-OG 3.33Å; F179-G381 VanDerWaalsContact CD2-CA 3.5Å; F179-T384 HydrophobicContact CZ-CG2 3.96Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.43Å
180G90.8Very high85Confident0 Ų027.8 Ų27.80%013%0.131CC..Hα-helixtrans-59.4-38.1-18000000113.3A129 A176 A184A129-G180 WeakPolarHBondContact CB-O 3.5Å; A176-G180 PolarHBondContact O-N 3.12Å; G180-A184 VanDerWaalsContact O-CB 3.3Å; G180-A184 WeakPolarHBondContact O-CB 3.39Å; G180-A184 PolarHBondContact O-N 3.48Å
181L87.8Confident84.1Confident43 Ų4331.7 Ų31.723%0.22515%0.154CC..Hα-helixtrans-63.9-43176.5-178.264000111.8A177 F179 A184 W185 I325A177-L181 VanDerWaalsContact O-CB 3.23Å; A177-L181 WeakPolarHBondContact O-CB 3.39Å; A177-L181 PolarHBondContact O-N 3.29Å; F179-L181 VanDerWaalsContact C-N 3.29Å; F179-L181 PolarHBondContact O-N 3.34Å; L181-A184 PolarHBondContact O-N 3.11Å; L181-W185 PolarHBondContact O-N 3.38Å; L181-I325 HydrophobicContact CD1-CB 4.42Å; L181-I325 HydrophobicContact CD1-CD1 3.3Å; L181-I325 HydrophobicContact CD1-CG1 3.7Å; L181-I325 HydrophobicContact CD1-CG2 3.85Å
182T90.6Very high82.7Confident12 Ų1237.7 Ų37.77%0.07419%0.194CC..Hα-helixtrans-68.1-43.6180-51.80000111.1Y178 F179 A184 W185 C186 L378 L382Y178-T182 WeakPolarHBondContact O-CB 3.42Å; Y178-T182 PolarHBondContact O-N 3.23Å; Y178-T182 PolarHBondContact O-OG1 3.18Å; F179-T182 PolarHBondContact O-N 3.36Å; F179-T182 VanDerWaalsContact O-N 3.11Å; T182-A184 VanDerWaalsContact C-N 3.32Å; T182-A184 PolarHBondContact O-N 2.92Å; T182-W185 WeakPolarHBondContact O-CB 3.35Å; T182-W185 PolarHBondContact O-N 3.49Å; T182-W185 VanDerWaalsContact O-N 3.14Å; T182-C186 PolarHBondContact O-N 2.87Å; T182-C186 PolarHBondContact O-SG 3.28Å; T182-C186 VanDerWaalsContact O-SG 3.38Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.29Å; T182-L382 HydrophobicContact CG2-CB 3.94Å
183V91.1Very high80.8Confident0 Ų042.3 Ų42.30%021%0.213CC..Hα-helixtrans-58.7-46.6174.1179.50000110.3V130 F179 W185 C186 G381 T384 L388V130-V183 HydrophobicContact CG1-CB 4.23Å; V130-V183 HydrophobicContact CG1-CG1 3.82Å; F179-V183 HydrophobicContact CD1-CG2 4.06Å; F179-V183 HydrophobicContact CE1-CG2 3.74Å; F179-V183 HydrophobicContact CZ-CG2 4.07Å; F179-V183 WeakPolarHBondContact O-CG2 3.24Å; F179-V183 PolarHBondContact O-N 3.41Å; V183-W185 PolarHBondContact O-N 2.92Å; V183-C186 PolarHBondContact O-N 3.34Å; V183-G381 WeakPolarHBondContact CG2-O 3.32Å; V183-T384 HydrophobicContact CG1-CG2 4.5Å; V183-T384 HydrophobicContact CG2-CG2 3.98Å; V183-L388 HydrophobicContact CG1-CD1 3.78Å
184A86.8Confident78.3Confident6 Ų645 Ų455%0.0524%0.243CC..Hα-helixtrans-62-29.6179.200000113.1A129 V130 G180 L181 T182A129-A184 HydrophobicContact CB-CB 4Å; V130-A184 HydrophobicContact CG1-CB 3.91Å; G180-A184 VanDerWaalsContact O-CB 3.3Å; G180-A184 WeakPolarHBondContact O-CB 3.39Å; G180-A184 PolarHBondContact O-N 3.48Å; L181-A184 PolarHBondContact O-N 3.11Å; T182-A184 VanDerWaalsContact C-N 3.32Å; T182-A184 PolarHBondContact O-N 2.92Å
185W84.5Confident75.8Confident159 Ų15951.9 Ų51.960%0.60229%0.285SS*.Hα-helixtrans-71.5-32.4177.7-170.321.8000112.9L181 T182 V183 L187 I322L181-W185 PolarHBondContact O-N 3.38Å; T182-W185 WeakPolarHBondContact O-CB 3.35Å; T182-W185 PolarHBondContact O-N 3.49Å; T182-W185 VanDerWaalsContact O-N 3.14Å; V183-W185 PolarHBondContact O-N 2.92Å; W185-L187 VanDerWaalsContact C-N 3.34Å; W185-I322 HydrophobicContact CG-CD1 4.18Å
186C86.6Confident73Confident23 Ų2359.6 Ų59.616%0.15532%0.321CS..Hα-helixtrans-76.1-18.6178.4-59.80000114.1T182 V183 G385 N389T182-C186 PolarHBondContact O-N 2.87Å; T182-C186 PolarHBondContact O-SG 3.28Å; T182-C186 VanDerWaalsContact O-SG 3.38Å; V183-C186 PolarHBondContact O-N 3.34Å; C186-G385 VanDerWaalsContact CB-C 3.47Å; C186-N389 PolarHBondContact O-ND2 2.86Å
187L82.4Confident70.4Confident13 Ų1363.5 Ų63.57%0.06834%0.342CS..SBendtrans-76.8151.1-175.5-69.2175.2000112.6V130 K133 V134 W185 K189 L388V130-L187 HydrophobicContact CB-CD1 4.02Å; V130-L187 HydrophobicContact CG1-CD1 3.77Å; K133-L187 HydrophobicContact CB-CD1 4.44Å; V134-L187 HydrophobicContact CG1-CD1 3.61Å; V134-L187 HydrophobicContact CG1-CD2 4.28Å; W185-L187 VanDerWaalsContact C-N 3.34Å; L187-K189 PolarHBondContact O-N 2.85Å; L187-L388 HydrophobicContact CD2-CB 4.28Å
188P74.6Confident67.9Low56 Ų5670.2 Ų70.236%0.36438%0.378SS..PPolyproline II helixtrans-57.4132.2179.4-2433.4000112.6N389 V398 Y401P188-N389 WeakPolarHBondContact CD-OD1 3.04Å; P188-N389 WeakPolarHBondContact CG-OD1 3.44Å; P188-V398 HydrophobicContact CB-CG2 4.42Å; P188-Y401 PolarHBondContact O-OH 3.41Å
189K68.9Low65.3Low131 Ų13173 Ų7357%0.5740%0.396SS*.PPolyproline II helixtrans-67.6140.6177.5-61.4-174.3-174.3-171.30110.4L187 G321L187-K189 PolarHBondContact O-N 2.85Å; K189-G321 WeakPolarHBondContact CE-O 3.46Å; K189-G321 PolarHBondContact NZ-O 3.31Å
190P61.3Low62.7Low33 Ų3377.3 Ų77.321%0.21442%0.416CS..PPolyproline II helixtrans-65.2147.9173.724.7-30000112.3H324 V398 Y401P190-H324 WeakPolarHBondContact CG-CD2 3.39Å; P190-V398 HydrophobicContact CB-CG1 4.09Å; P190-Y401 HydrophobicContact CB-CD2 4.23Å; P190-Y401 HydrophobicContact CB-CE2 4.48Å
191L57.1Low60.3Low119 Ų11984.3 Ų84.362%0.62344%0.443SS*.PPolyproline II helixtrans-59.8135.4176.1-98.579.8000109.8K193 V398L191-K193 PolarHBondContact O-N 3.26Å; L191-V398 HydrophobicContact CD1-CB 4.32Å; L191-V398 HydrophobicContact CD1-CG1 3.89Å
192P52.8Low58.1Low129 Ų12984.2 Ų84.284%0.83845%0.448SS*.  trans-64109.2167.325.6-29.4000107.8
193K45.1Very low56.2Low106 Ų10687.2 Ų87.246%0.46147%0.467SS..  trans-80.9127.6174.1-88.8-170.6173.9-173.40109.1L191 Q200L191-K193 PolarHBondContact O-N 3.26Å; K193-Q200 VanDerWaalsContact NZ-OE1 3.14Å
194G36.5Very low54.2Low63 Ų6391.4 Ų91.465%0.64949%0.488SS*.  trans-61.5161.3154.400000110.9E196G194-E196 PolarHBondContact O-N 3.44Å
195T36.3Very low52.6Low144 Ų14494.9 Ų94.988%0.88351%0.51SS*.SBendtrans-3921.7-169.535.40000122.1
196E34.5Very low51.6Low163 Ų16388.6 Ų88.676%0.76249%0.49SS*.SBendtrans-124.7119.8179.8-64.8-177.1176.500111.4G194G194-E196 PolarHBondContact O-N 3.44Å
197D37.8Very low51.1Low82 Ų8295 Ų9544%0.43952%0.522SS..  trans92.664.4-174.4-71.2-22.7000117.5D199 Q200D197-D199 PolarHBondContact O-N 3.24Å; D197-Q200 HydrophobicContact CB-CB 4.24Å; D197-Q200 HydrophobicContact CB-CG 3.95Å; D197-Q200 PolarHBondContact OD2-NE2 3.31Å
198N35.8Very low51Low143 Ų14395.9 Ų95.977%0.76553%0.529SS*.SBendtrans-65.6-18.2155.8-74.3-31.6000112.4A202N198-A202 PolarHBondContact O-N 3.26Å
199D36.8Very low51.3Low109 Ų10993.2 Ų93.258%0.58351%0.512SS*.SBendtrans-81.8-25.9-176.5-73.6-21.5000114.9D197 R201D197-D199 PolarHBondContact O-N 3.24Å; D199-R201 PolarHBondContact O-N 3.07Å
200Q39.3Very low52.1Low90 Ų9089.4 Ų89.442%0.42150%0.497SS..SBendtrans-71.3-22.9174.9-72.5-175.93.100112.5K193 D197K193-Q200 VanDerWaalsContact NZ-OE1 3.14Å; D197-Q200 HydrophobicContact CB-CB 4.24Å; D197-Q200 HydrophobicContact CB-CG 3.95Å; D197-Q200 PolarHBondContact OD2-NE2 3.31Å
201R40.6Very low53.4Low147 Ų14791.4 Ų91.456%0.55551%0.505SS*.SBendtrans-111.6-5.1-171.7-142.6179.2-76.1-173.3-6112.7D199 T203D199-R201 PolarHBondContact O-N 3.07Å; R201-T203 PolarHBondContact O-N 2.7Å
202A40Very low54.9Low41 Ų4185.7 Ų85.734%0.33948%0.476SS..  trans-64.698.9174.300000109.4N198 I204N198-A202 PolarHBondContact O-N 3.26Å; A202-I204 PolarHBondContact O-N 3.21Å
203T50.8Low56.6Low75 Ų7579.6 Ų79.646%0.4644%0.436SS..  trans-63.284.6164.9-42.40000107.3S68 R201 P205S68-T203 WeakPolarHBondContact O-CG2 3.42Å; R201-T203 PolarHBondContact O-N 2.7Å; T203-P205 WeakPolarHBondContact O-CD 3.24Å
204I48.7Very low58.8Low87 Ų8778.9 Ų78.945%0.44644%0.437SS..  trans-58.9128.7161.2-59.8177.3000104.8A202 S206A202-I204 PolarHBondContact O-N 3.21Å; I204-S206 VanDerWaalsContact C-N 3.28Å; I204-S206 PolarHBondContact O-N 2.86Å
205P54.2Low61.5Low80 Ų8078.6 Ų78.652%0.51942%0.418SS..  trans-54.397.9169.2-22.633.2000108.3T203 L207 M267T203-P205 WeakPolarHBondContact O-CD 3.24Å; P205-L207 PolarHBondContact O-N 2.86Å; P205-M267 HydrophobicContact CB-CB 3.76Å; P205-M267 HydrophobicContact CB-CG 3.9Å; P205-M267 HydrophobicContact CG-CB 3.97Å
206S64.3Low64.1Low26 Ų2671.8 Ų71.818%0.18238%0.376CS..  trans-76.5124.1179.762.20000106.7S67 I204 S208 A209 M210S67-S206 PolarHBondContact O-OG 2.71Å; I204-S206 VanDerWaalsContact C-N 3.28Å; I204-S206 PolarHBondContact O-N 2.86Å; S206-S208 WeakPolarHBondContact CB-OG 3.14Å; S206-S208 PolarHBondContact O-N 3.12Å; S206-S208 PolarHBondContact OG-OG 3.42Å; S206-A209 PolarHBondContact O-N 3.06Å; S206-A209 WeakPolarHBondContact OG-CB 3.5Å; S206-A209 PolarHBondContact OG-N 3.28Å; S206-M210 PolarHBondContact O-N 3.44Å
207L76.1Confident67Low159 Ų15966.9 Ų66.983%0.83235%0.351SS*.Hα-helixtrans-47.4-28.6166-77.9156.7000111P205 M210 L211P205-L207 PolarHBondContact O-N 2.86Å; L207-M210 PolarHBondContact O-N 3.2Å; L207-L211 WeakPolarHBondContact O-CB 3.48Å; L207-L211 PolarHBondContact O-N 3.44Å
208S79.6Confident69.7Low30 Ų3068.7 Ų68.721%0.2136%0.358CS..Hα-helixtrans-60.1-48173.277.90000112.8F64 S67 S206 M210 L211 G212F64-S208 WeakPolarHBondContact CB-O 3.47Å; S67-S208 WeakPolarHBondContact OG-CB 3.24Å; S67-S208 PolarHBondContact OG-OG 3.3Å; S206-S208 WeakPolarHBondContact CB-OG 3.14Å; S206-S208 PolarHBondContact O-N 3.12Å; S206-S208 PolarHBondContact OG-OG 3.42Å; S208-M210 VanDerWaalsContact C-N 3.33Å; S208-M210 PolarHBondContact O-N 3.31Å; S208-L211 WeakPolarHBondContact O-CB 3.32Å; S208-L211 PolarHBondContact O-N 3.47Å; S208-G212 PolarHBondContact O-N 3.14Å; S208-G212 VanDerWaalsContact O-N 3.1Å
209A81.8Confident72.5Confident1 Ų163.7 Ų63.71%0.00833%0.329CS..Hα-helixtrans-65.8-35.9177.600000112.6F64 S206 G212 A213F64-A209 WeakPolarHBondContact O-CA 3.29Å; S206-A209 PolarHBondContact O-N 3.06Å; S206-A209 WeakPolarHBondContact OG-CB 3.5Å; S206-A209 PolarHBondContact OG-N 3.28Å; A209-G212 PolarHBondContact O-N 3.35Å; A209-A213 PolarHBondContact O-N 2.94Å
210M85.1Confident75.1Confident51 Ų5158.7 Ų58.725%0.25130%0.302SS..Hα-helixtrans-67.6-38174.5-171.754.5161.200111.9S206 L207 S208 G212 A213 L214 M267 V270 H271S206-M210 PolarHBondContact O-N 3.44Å; L207-M210 PolarHBondContact O-N 3.2Å; S208-M210 VanDerWaalsContact C-N 3.33Å; S208-M210 PolarHBondContact O-N 3.31Å; M210-G212 VanDerWaalsContact C-N 3.3Å; M210-G212 PolarHBondContact O-N 2.77Å; M210-A213 PolarHBondContact O-N 2.86Å; M210-A213 VanDerWaalsContact O-N 3.17Å; M210-A213 HydrophobicContact SD-CB 4.27Å; M210-L214 HydrophobicContact CG-CD1 4.44Å; M210-L214 WeakPolarHBondContact O-CG 3.41Å; M210-L214 PolarHBondContact O-N 3.32Å; M210-M267 HydrophobicContact CB-CE 3.62Å; M210-M267 HydrophobicContact CE-CE 3.75Å; M210-M267 HydrophobicContact CG-CE 3.45Å; M210-M267 VanDerWaalsContact CG-CE 3.45Å; M210-M267 HydrophobicContact SD-CE 3.25Å; M210-M267 WeakPolarHBondContact SD-CE 3.1Å; M210-V270 HydrophobicContact CE-CG1 4.43Å; M210-H271 PolarHBondContact N-NE2 3.13Å
211L87.9Confident77.7Confident74 Ų7455.1 Ų55.139%0.38729%0.287SS..Hα-helixtrans-57-47.4173-172.166.6000110.4L207 S208 A213 L214 F215L207-L211 WeakPolarHBondContact O-CB 3.48Å; L207-L211 PolarHBondContact O-N 3.44Å; S208-L211 WeakPolarHBondContact O-CB 3.32Å; S208-L211 PolarHBondContact O-N 3.47Å; L211-A213 PolarHBondContact O-N 3.45Å; L211-L214 PolarHBondContact O-N 2.86Å; L211-F215 HydrophobicContact CD1-CD2 4.16Å; L211-F215 HydrophobicContact CD1-CE2 3.76Å; L211-F215 HydrophobicContact CG-CD2 4.09Å; L211-F215 HydrophobicContact CG-CE2 3.97Å; L211-F215 WeakPolarHBondContact O-CD2 3.42Å; L211-F215 PolarHBondContact O-N 3.04Å; L211-F215 VanDerWaalsContact O-N 3.1Å
212G88.6Confident80.1Confident0 Ų048.9 Ų48.90%027%0.266CS..Hα-helixtrans-56.8-46.1173.900000112.9G61 S208 A209 M210 L214 F215 L216G61-G212 VanDerWaalsContact O-CA 3.32Å; G61-G212 WeakPolarHBondContact O-CA 3.33Å; S208-G212 PolarHBondContact O-N 3.14Å; S208-G212 VanDerWaalsContact O-N 3.1Å; A209-G212 PolarHBondContact O-N 3.35Å; M210-G212 VanDerWaalsContact C-N 3.3Å; M210-G212 PolarHBondContact O-N 2.77Å; G212-L214 VanDerWaalsContact C-N 3.34Å; G212-L214 PolarHBondContact O-N 3.48Å; G212-F215 PolarHBondContact O-N 3.46Å; G212-L216 WeakPolarHBondContact O-CB 3.31Å; G212-L216 WeakPolarHBondContact O-CD1 3.42Å; G212-L216 VanDerWaalsContact O-CG 3.31Å; G212-L216 WeakPolarHBondContact O-CG 3.39Å; G212-L216 PolarHBondContact O-N 3.03Å
213A89.2Confident82.4Confident1 Ų147.1 Ų47.11%0.00825%0.251CS..Hα-helixtrans-62.1-36.8177.100000113.2L65 A209 M210 L211 L216 W217 L275L65-A213 HydrophobicContact CD1-CB 4.02Å; A209-A213 PolarHBondContact O-N 2.94Å; M210-A213 PolarHBondContact O-N 2.86Å; M210-A213 VanDerWaalsContact O-N 3.17Å; M210-A213 HydrophobicContact SD-CB 4.27Å; L211-A213 PolarHBondContact O-N 3.45Å; A213-L216 PolarHBondContact O-N 3.01Å; A213-W217 WeakPolarHBondContact O-CB 3.46Å; A213-W217 PolarHBondContact O-N 3.28Å; A213-L275 HydrophobicContact CB-CD1 4.38Å
214L91.4Very high84.4Confident91 Ų9144.3 Ų44.348%0.47623%0.233SC..Hα-helixtrans-67.6-45177.3-72170.6000112.3M210 L211 G212 L216 W217 M218M210-L214 HydrophobicContact CG-CD1 4.44Å; M210-L214 WeakPolarHBondContact O-CG 3.41Å; M210-L214 PolarHBondContact O-N 3.32Å; L211-L214 PolarHBondContact O-N 2.86Å; G212-L214 VanDerWaalsContact C-N 3.34Å; G212-L214 PolarHBondContact O-N 3.48Å; L214-L216 VanDerWaalsContact C-N 3.32Å; L214-L216 PolarHBondContact O-N 2.96Å; L214-W217 PolarHBondContact O-N 3.17Å; L214-M218 WeakPolarHBondContact O-CB 3.34Å; L214-M218 PolarHBondContact O-N 3.18Å
215F92.4Very high86.3Confident57 Ų5740.2 Ų40.225%0.2521%0.212CC..Hα-helixtrans-62.1-42.5175.2-85.9-80.1000111.4V56 I60 L211 G212 M218 F219V56-F215 HydrophobicContact CG1-CD1 3.56Å; V56-F215 HydrophobicContact CG1-CE1 3.91Å; I60-F215 HydrophobicContact CB-CG 4.47Å; I60-F215 HydrophobicContact CG2-CB 4.49Å; I60-F215 HydrophobicContact CG2-CD1 4.37Å; I60-F215 HydrophobicContact CG2-CD2 3.55Å; I60-F215 HydrophobicContact CG2-CE2 3.78Å; I60-F215 HydrophobicContact CG2-CG 3.88Å; I60-F215 HydrophobicContact CG2-CZ 4.31Å; L211-F215 HydrophobicContact CD1-CD2 4.16Å; L211-F215 HydrophobicContact CD1-CE2 3.76Å; L211-F215 HydrophobicContact CG-CD2 4.09Å; L211-F215 HydrophobicContact CG-CE2 3.97Å; L211-F215 WeakPolarHBondContact O-CD2 3.42Å; L211-F215 PolarHBondContact O-N 3.04Å; L211-F215 VanDerWaalsContact O-N 3.1Å; G212-F215 PolarHBondContact O-N 3.46Å; F215-M218 PolarHBondContact O-N 3.24Å; F215-F219 HydrophobicContact CD1-CD2 4.13Å; F215-F219 AromaticContact CD1-CE2 3.76Å; F215-F219 HydrophobicContact CD1-CE2 3.76Å; F215-F219 HydrophobicContact CE1-CE2 4.23Å; F215-F219 VanDerWaalsContact O-CD2 3.29Å; F215-F219 WeakPolarHBondContact O-CD2 3.48Å; F215-F219 PolarHBondContact O-N 3.07Å; F215-F219 VanDerWaalsContact O-N 3.13Å
216L92Very high87.8Confident1 Ų136.7 Ų36.71%0.00519%0.189CC..Hα-helixtrans-58.1-50.6173.3-77.8163.5000111.6M57 L62 L65 G212 A213 L214 M218 F219 W220 L275M57-L216 HydrophobicContact CE-CD2 4.2Å; M57-L216 HydrophobicContact CG-CD2 3.48Å; M57-L216 VanDerWaalsContact CG-CD2 3.48Å; M57-L216 HydrophobicContact CG-CG 4.25Å; M57-L216 HydrophobicContact SD-CD2 3.72Å; L62-L216 HydrophobicContact CD2-CD1 4.2Å; L62-L216 HydrophobicContact CD2-CD2 3.8Å; L62-L216 HydrophobicContact CG-CD2 4.08Å; L65-L216 HydrophobicContact CB-CD1 3.89Å; L65-L216 HydrophobicContact CD1-CD1 4.01Å; L65-L216 HydrophobicContact CD2-CD1 3.31Å; L65-L216 HydrophobicContact CG-CD1 3.93Å; G212-L216 WeakPolarHBondContact O-CB 3.31Å; G212-L216 WeakPolarHBondContact O-CD1 3.42Å; G212-L216 VanDerWaalsContact O-CG 3.31Å; G212-L216 WeakPolarHBondContact O-CG 3.39Å; G212-L216 PolarHBondContact O-N 3.03Å; A213-L216 PolarHBondContact O-N 3.01Å; L214-L216 VanDerWaalsContact C-N 3.32Å; L214-L216 PolarHBondContact O-N 2.96Å; L216-M218 VanDerWaalsContact C-N 3.33Å; L216-M218 PolarHBondContact O-N 3.1Å; L216-F219 PolarHBondContact O-N 3.34Å; L216-W220 HydrophobicContact CB-CE3 3.86Å; L216-W220 HydrophobicContact CB-CZ3 3.75Å; L216-W220 HydrophobicContact CD1-CZ3 4.49Å; L216-W220 HydrophobicContact CD2-CE3 4.25Å; L216-W220 HydrophobicContact CD2-CH2 4.48Å; L216-W220 HydrophobicContact CD2-CZ3 3.79Å; L216-W220 HydrophobicContact CG-CZ3 4.21Å; L216-W220 WeakPolarHBondContact O-CB 3.47Å; L216-W220 PolarHBondContact O-N 2.96Å; L216-L275 HydrophobicContact CB-CD1 4Å; L216-L275 HydrophobicContact CB-CD2 3.74Å; L216-L275 HydrophobicContact CD1-CD1 3.75Å; L216-L275 HydrophobicContact CG-CD1 4.49Å
217W94.2Very high88.7Confident60 Ų6036.4 Ų36.423%0.22719%0.186CC..Hα-helixtrans-59.5-42.5-179.4-172.295.8000112.3A213 L214 Y242 L245 V274 L275A213-W217 WeakPolarHBondContact O-CB 3.46Å; A213-W217 PolarHBondContact O-N 3.28Å; L214-W217 PolarHBondContact O-N 3.17Å; W217-Y242 HydrophobicContact CH2-CD2 4.45Å; W217-Y242 AromaticContact CH2-CE2 3.73Å; W217-Y242 HydrophobicContact CH2-CE2 3.73Å; W217-Y242 HydrophobicContact CZ3-CE2 4.24Å; W217-L245 HydrophobicContact CZ2-CB 4.47Å; W217-L245 PolarHBondContact NE1-O 2.91Å; W217-L245 WeakPolarHBondContact O-CD1 3.47Å; W217-V274 HydrophobicContact CG-CG1 4.44Å; W217-L275 HydrophobicContact CB-CD2 3.93Å
218M94.4Very high89.1Confident119 Ų11930.1 Ų30.159%0.58615%0.153SC*.Hα-helixtrans-66.6-42.3-178.4-172.5-179.7-60.400112.8L214 F215 L216L214-M218 WeakPolarHBondContact O-CB 3.34Å; L214-M218 PolarHBondContact O-N 3.18Å; F215-M218 PolarHBondContact O-N 3.24Å; L216-M218 VanDerWaalsContact C-N 3.33Å; L216-M218 PolarHBondContact O-N 3.1Å
219F94.2Very high89.2Confident38 Ų3835.3 Ų35.317%0.16717%0.168CC..Hα-helixtrans-100.2-5-171.8-67-70.1000114.3D53 V56 M57 F215 L216 P221 S222 V223D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.64Å; D53-F219 HydrophobicContact CB-CE1 4.28Å; D53-F219 HydrophobicContact CB-CG 4.37Å; D53-F219 VanDerWaalsContact CG-CD1 3.48Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.5Å; D53-F219 VanDerWaalsContact OD1-CE1 3.24Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.32Å; V56-F219 HydrophobicContact CG1-CD2 3.93Å; V56-F219 HydrophobicContact CG1-CE2 3.71Å; V56-F219 HydrophobicContact CG1-CZ 4.37Å; M57-F219 HydrophobicContact CB-CB 4.13Å; M57-F219 HydrophobicContact CG-CB 4.31Å; F215-F219 HydrophobicContact CD1-CD2 4.13Å; F215-F219 AromaticContact CD1-CE2 3.76Å; F215-F219 HydrophobicContact CD1-CE2 3.76Å; F215-F219 HydrophobicContact CE1-CE2 4.23Å; F215-F219 VanDerWaalsContact O-CD2 3.29Å; F215-F219 WeakPolarHBondContact O-CD2 3.48Å; F215-F219 PolarHBondContact O-N 3.07Å; F215-F219 VanDerWaalsContact O-N 3.13Å; L216-F219 PolarHBondContact O-N 3.34Å; F219-P221 VanDerWaalsContact C-CD 3.42Å; F219-P221 VanDerWaalsContact C-N 3.34Å; F219-S222 WeakPolarHBondContact O-CB 3.44Å; F219-S222 PolarHBondContact O-N 3.04Å; F219-V223 PolarHBondContact O-N 2.88Å
220W93Very high89.3Confident5 Ų537 Ų372%0.01918%0.18CC..Hα-helixtrans-54.2-39.3177.1-139.7-67000114.8Y173 L216 S222 V223 N224 T241 L245 L275 G278 V279 F332Y173-W220 HydrophobicContact CE1-CZ2 4.01Å; Y173-W220 AromaticContact CZ-NE1 3.94Å; Y173-W220 PolarHBondContact OH-NE1 3.22Å; L216-W220 HydrophobicContact CB-CE3 3.86Å; L216-W220 HydrophobicContact CB-CZ3 3.75Å; L216-W220 HydrophobicContact CD1-CZ3 4.49Å; L216-W220 HydrophobicContact CD2-CE3 4.25Å; L216-W220 HydrophobicContact CD2-CH2 4.48Å; L216-W220 HydrophobicContact CD2-CZ3 3.79Å; L216-W220 HydrophobicContact CG-CZ3 4.21Å; L216-W220 WeakPolarHBondContact O-CB 3.47Å; L216-W220 PolarHBondContact O-N 2.96Å; W220-S222 PolarHBondContact O-N 3.05Å; W220-V223 WeakPolarHBondContact O-CB 3.49Å; W220-V223 PolarHBondContact O-N 3.36Å; W220-V223 VanDerWaalsContact O-N 3.1Å; W220-N224 PolarHBondContact O-N 2.89Å; W220-N224 VanDerWaalsContact O-N 3.13Å; W220-T241 HydrophobicContact CB-CG2 4.23Å; W220-T241 HydrophobicContact CG-CG2 4.45Å; W220-L245 HydrophobicContact CB-CD1 3.55Å; W220-L245 HydrophobicContact CG-CD1 4.2Å; W220-L275 HydrophobicContact CE3-CB 4.45Å; W220-L275 HydrophobicContact CE3-CD2 3.81Å; W220-L275 HydrophobicContact CH2-CB 4.27Å; W220-L275 HydrophobicContact CZ3-CB 3.85Å; W220-L275 HydrophobicContact CZ3-CD1 3.9Å; W220-L275 HydrophobicContact CZ3-CD2 3.72Å; W220-L275 HydrophobicContact CZ3-CG 4.01Å; W220-G278 PolarHBondContact NE1-O 3.18Å; W220-G278 VanDerWaalsContact NE1-O 3.15Å; W220-V279 HydrophobicContact CH2-CG2 3.75Å; W220-V279 HydrophobicContact CZ2-CB 4.39Å; W220-V279 HydrophobicContact CZ2-CG2 3.35Å; W220-F332 AromaticContact CH2-CE1 3.82Å; W220-F332 HydrophobicContact CH2-CE1 3.82Å; W220-F332 HydrophobicContact CH2-CZ 4.14Å; W220-F332 HydrophobicContact CZ2-CE1 4.48Å
221P93.4Very high89.3Confident15 Ų1539 Ų3910%0.09720%0.196CC..Hα-helixtrans-57.3-34.6175.2-2736.8000113.1F219 S225 M238 T241F219-P221 VanDerWaalsContact C-CD 3.42Å; F219-P221 VanDerWaalsContact C-N 3.34Å; P221-S225 VanDerWaalsContact O-CB 3.3Å; P221-S225 WeakPolarHBondContact O-CB 3.33Å; P221-S225 PolarHBondContact O-N 3.45Å; P221-S225 PolarHBondContact O-OG 3.28Å; P221-M238 HydrophobicContact CB-CB 4.43Å; P221-T241 HydrophobicContact CB-CG2 4.39Å; P221-T241 HydrophobicContact CG-CG2 4.13Å
222S91.3Very high89.3Confident16 Ų1640.6 Ų40.611%0.11220%0.204CC..Hα-helixtrans-68.5-39.7175.5-60.90000111.2D53 F219 W220 S225 A226D53-S222 WeakPolarHBondContact OD2-CB 3.44Å; D53-S222 PolarHBondContact OD2-OG 3.42Å; F219-S222 WeakPolarHBondContact O-CB 3.44Å; F219-S222 PolarHBondContact O-N 3.04Å; W220-S222 PolarHBondContact O-N 3.05Å; S222-S225 PolarHBondContact O-N 2.97Å; S222-S225 PolarHBondContact O-OG 3.23Å; S222-A226 WeakPolarHBondContact O-CA 3.3Å; S222-A226 WeakPolarHBondContact O-CB 3.3Å; S222-A226 PolarHBondContact O-N 3.05Å
223V88.4Confident89.3Confident4 Ų444.2 Ų44.22%0.02422%0.221CC..Hα-helixtrans-58.6-53.3176.2-179.50000112.4L54 M57 M118 M121 F172 F219 W220 S225 A226L54-V223 HydrophobicContact CD2-CB 4.25Å; L54-V223 HydrophobicContact CD2-CG2 3.86Å; M57-V223 HydrophobicContact CE-CB 4.37Å; M57-V223 HydrophobicContact CE-CG1 4.38Å; M57-V223 HydrophobicContact CE-CG2 3.13Å; M57-V223 HydrophobicContact SD-CG2 3.19Å; M57-V223 WeakPolarHBondContact SD-CG2 3.42Å; M118-V223 HydrophobicContact CE-CG1 3.73Å; M118-V223 HydrophobicContact SD-CG1 3.85Å; M121-V223 HydrophobicContact CE-CG1 3.91Å; M121-V223 HydrophobicContact CE-CG2 4.19Å; F172-V223 HydrophobicContact CZ-CG1 4.17Å; F219-V223 PolarHBondContact O-N 2.88Å; W220-V223 WeakPolarHBondContact O-CB 3.49Å; W220-V223 PolarHBondContact O-N 3.36Å; W220-V223 VanDerWaalsContact O-N 3.1Å; V223-S225 PolarHBondContact O-N 2.84Å; V223-A226 PolarHBondContact O-N 3.41Å
224N91.1Very high89.3Confident16 Ų1648.5 Ų48.59%0.08624%0.237CC..Hα-helixtrans-69.4-15.3-175.1-73.4-9.3000112.3Y173 W220 T241 G278Y173-N224 PolarHBondContact OH-OD1 3.19Å; W220-N224 PolarHBondContact O-N 2.89Å; W220-N224 VanDerWaalsContact O-N 3.13Å; N224-T241 HydrophobicContact CB-CG2 4.44Å; N224-T241 WeakPolarHBondContact CB-OG1 3.31Å; N224-T241 VanDerWaalsContact ND2-CG2 3.27Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.17Å; N224-T241 PolarHBondContact ND2-OG1 2.62Å; N224-T241 VanDerWaalsContact ND2-OG1 3.07Å; N224-G278 PolarHBondContact ND2-O 3.39Å
225S89.4Confident89.3Confident0 Ų048.7 Ų48.70%023%0.234CC..Hα-helixtrans-112.6-11.3-177.370.20000114.2P221 S222 V223 L227 L228 M238P221-S225 VanDerWaalsContact O-CB 3.3Å; P221-S225 WeakPolarHBondContact O-CB 3.33Å; P221-S225 PolarHBondContact O-N 3.45Å; P221-S225 PolarHBondContact O-OG 3.28Å; S222-S225 PolarHBondContact O-N 2.97Å; S222-S225 PolarHBondContact O-OG 3.23Å; V223-S225 PolarHBondContact O-N 2.84Å; S225-L227 VanDerWaalsContact C-N 3.27Å; S225-L227 PolarHBondContact O-N 2.72Å; S225-L228 PolarHBondContact O-N 3.49Å; S225-L228 VanDerWaalsContact O-N 3.11Å; S225-M238 VanDerWaalsContact OG-CE 3.26Å; S225-M238 WeakPolarHBondContact OG-CE 3.22Å; S225-M238 WeakPolarHBondContact OG-CG 3.36Å
226A85.9Confident89.3Confident6 Ų648.1 Ų48.15%0.0523%0.234CC..THydrogen-bonded Turntrans-60-32.9-17000000114.5V50 L54 S222 V223V50-A226 HydrophobicContact CG1-CB 3.61Å; L54-A226 HydrophobicContact CD1-CB 3.96Å; L54-A226 HydrophobicContact CD2-CB 4.24Å; L54-A226 HydrophobicContact CG-CB 4.41Å; S222-A226 WeakPolarHBondContact O-CA 3.3Å; S222-A226 WeakPolarHBondContact O-CB 3.3Å; S222-A226 PolarHBondContact O-N 3.05Å; V223-A226 PolarHBondContact O-N 3.41Å
227L83.9Confident89.3Confident20 Ų2048 Ų4811%0.10523%0.233CC..THydrogen-bonded Turntrans-95.5-6.9-176.8-58178.9000112.9F111 L115 M118 L169 S225 R229F111-L227 HydrophobicContact CE2-CD2 4.22Å; F111-L227 HydrophobicContact CZ-CD2 4.25Å; L115-L227 HydrophobicContact CD1-CD1 4.24Å; L115-L227 HydrophobicContact CD1-CD2 3.98Å; M118-L227 HydrophobicContact CE-CD1 4.48Å; M118-L227 HydrophobicContact CG-CD1 4.43Å; L169-L227 HydrophobicContact CB-CD1 3.71Å; L169-L227 HydrophobicContact CD1-CD1 3.92Å; L169-L227 HydrophobicContact CD2-CD1 4.35Å; L169-L227 HydrophobicContact CG-CD1 4.23Å; S225-L227 VanDerWaalsContact C-N 3.27Å; S225-L227 PolarHBondContact O-N 2.72Å; L227-R229 PolarHBondContact O-N 3.45Å
228L84.8Confident89.3Confident27 Ų2747.9 Ų47.914%0.14124%0.236CC..  trans-77.1121.8-179.2-63.4173.6000111.1S225 Q233 R234 A237 H286S225-L228 PolarHBondContact O-N 3.49Å; S225-L228 VanDerWaalsContact O-N 3.11Å; L228-Q233 HydrophobicContact CD1-CB 4.39Å; L228-R234 HydrophobicContact CB-CB 4.24Å; L228-A237 HydrophobicContact CD1-CB 3.42Å; L228-A237 VanDerWaalsContact CD1-CB 3.42Å; L228-H286 HydrophobicContact CD1-CB 3.75Å; L228-H286 HydrophobicContact CD2-CB 4.24Å
229R79.9Confident89.4Confident139 Ų13947.3 Ų47.353%0.52523%0.23SC..  trans-77.2-39.2179.1-69.2179.1179.2164-4.7112.8D164 M167 L227D164-R229 VanDerWaalsContact CG-NH1 3.32Å; D164-R229 IonicContact OD1-CZ 3.47Å; D164-R229 IonicContact OD1-NH1 3.04Å; D164-R229 PolarHBondContact OD1-NH1 3.38Å; D164-R229 VanDerWaalsContact OD1-NH1 3.11Å; D164-R229 IonicContact OD1-NH2 2.88Å; D164-R229 IonicContact OD2-NH1 3.66Å; D164-R229 PolarHBondContact OD2-NH1 3.35Å; M167-R229 HydrophobicContact CE-CB 3.96Å; M167-R229 HydrophobicContact CE-CG 3.64Å; L227-R229 PolarHBondContact O-N 3.45Å
230S84.4Confident89.5Confident38 Ų3845.8 Ų45.827%0.26622%0.224SC..SBendtrans-72.8126.3-178.2169.70000110.6I232 Q233 R234S230-I232 PolarHBondContact O-N 2.84Å; S230-Q233 PolarHBondContact O-N 2.88Å; S230-R234 WeakPolarHBondContact O-CB 3.48Å; S230-R234 PolarHBondContact O-N 3.3Å
231P85.4Confident89.6Confident91 Ų9145.5 Ų45.559%0.59122%0.223SC*.Hα-helixtrans-63.3-33.2-178.124.9-33.6000112.1K235P231-K235 WeakPolarHBondContact O-CB 3.46Å; P231-K235 PolarHBondContact O-N 2.92Å
232I88.4Confident89.8Confident109 Ų10950.5 Ų50.556%0.55924%0.24SC*.Hα-helixtrans-70-46.6178.3-63.6163.5000110.2S230 R234 K235 N236S230-I232 PolarHBondContact O-N 2.84Å; I232-R234 VanDerWaalsContact C-N 3.32Å; I232-R234 PolarHBondContact O-N 2.91Å; I232-K235 PolarHBondContact O-N 3.38Å; I232-N236 WeakPolarHBondContact O-CB 3.31Å; I232-N236 PolarHBondContact O-N 3.46Å; I232-N236 PolarHBondContact O-OD1 3.18Å
233Q89Confident90.1Very high76 Ų7654.2 Ų54.236%0.35525%0.253SS..Hα-helixtrans-62.5-41.8176.5-70.6177-2.700111.1L228 S230 N236 A237 H286L228-Q233 HydrophobicContact CD1-CB 4.39Å; S230-Q233 PolarHBondContact O-N 2.88Å; Q233-N236 PolarHBondContact O-N 2.87Å; Q233-A237 VanDerWaalsContact O-CB 3.28Å; Q233-A237 WeakPolarHBondContact O-CB 3.2Å; Q233-A237 PolarHBondContact O-N 3.21Å; Q233-H286 HydrophobicContact CB-CB 4.15Å
234R88.5Confident90.5Very high90 Ų9054 Ų5434%0.3425%0.252SS..Hα-helixtrans-59.5-48.7176.1-165.2177.270.7179.41.7111.6L228 S230 I232 N236 A237 M238L228-R234 HydrophobicContact CB-CB 4.24Å; S230-R234 WeakPolarHBondContact O-CB 3.48Å; S230-R234 PolarHBondContact O-N 3.3Å; I232-R234 VanDerWaalsContact C-N 3.32Å; I232-R234 PolarHBondContact O-N 2.91Å; R234-N236 PolarHBondContact O-N 3.01Å; R234-A237 PolarHBondContact O-N 3.49Å; R234-M238 HydrophobicContact CG-CE 4.05Å; R234-M238 WeakPolarHBondContact O-CG 3.5Å; R234-M238 PolarHBondContact O-N 3Å
235K91.4Very high90.8Very high96 Ų9653.3 Ų53.342%0.41725%0.248SC..Hα-helixtrans-58.1-47.9175.4-179.9-176.36665.40111.7P231 I232 M238 F239P231-K235 WeakPolarHBondContact O-CB 3.46Å; P231-K235 PolarHBondContact O-N 2.92Å; I232-K235 PolarHBondContact O-N 3.38Å; K235-M238 PolarHBondContact O-N 3.23Å; K235-F239 HydrophobicContact CD-CE2 3.84Å; K235-F239 HydrophobicContact CD-CZ 4.25Å; K235-F239 HydrophobicContact CG-CD2 4.03Å; K235-F239 HydrophobicContact CG-CE2 3.53Å; K235-F239 HydrophobicContact CG-CZ 3.86Å; K235-F239 WeakPolarHBondContact O-CG 3.46Å; K235-F239 PolarHBondContact O-N 3.43Å; K235-F239 VanDerWaalsContact O-N 3.08Å
236N91.9Very high91.1Very high44 Ų4454.9 Ų54.924%0.23526%0.261CS..Hα-helixtrans-65.5-42.1-178.4-67.8-3.4000111.2I232 Q233 R234 M238 F239 N240I232-N236 WeakPolarHBondContact O-CB 3.31Å; I232-N236 PolarHBondContact O-N 3.46Å; I232-N236 PolarHBondContact O-OD1 3.18Å; Q233-N236 PolarHBondContact O-N 2.87Å; R234-N236 PolarHBondContact O-N 3.01Å; N236-M238 VanDerWaalsContact C-N 3.32Å; N236-M238 PolarHBondContact O-N 3Å; N236-F239 PolarHBondContact O-N 3.47Å; N236-N240 VanDerWaalsContact O-CB 3.28Å; N236-N240 WeakPolarHBondContact O-CB 3.29Å; N236-N240 VanDerWaalsContact O-CG 3.23Å; N236-N240 PolarHBondContact O-N 2.98Å; N236-N240 PolarHBondContact O-ND2 3.1Å; N236-N240 VanDerWaalsContact O-ND2 3.11Å
237A93Very high91.7Very high0 Ų055.9 Ų55.90%027%0.266CS..Hα-helixtrans-58.4-42.8174.800000112.4L228 Q233 R234 T241 C285 H286L228-A237 HydrophobicContact CD1-CB 3.42Å; L228-A237 VanDerWaalsContact CD1-CB 3.42Å; Q233-A237 VanDerWaalsContact O-CB 3.28Å; Q233-A237 WeakPolarHBondContact O-CB 3.2Å; Q233-A237 PolarHBondContact O-N 3.21Å; R234-A237 PolarHBondContact O-N 3.49Å; A237-T241 VanDerWaalsContact O-CB 3.22Å; A237-T241 WeakPolarHBondContact O-CB 3.38Å; A237-T241 PolarHBondContact O-N 2.96Å; A237-T241 PolarHBondContact O-OG1 3.38Å; A237-C285 HydrophobicContact CB-CB 4.11Å; A237-C285 VanDerWaalsContact CB-SG 3.51Å; A237-H286 HydrophobicContact CB-CB 4.33Å
238M93.9Very high92.3Very high57 Ų5755 Ų5528%0.28126%0.261SS..Hα-helixtrans-60.9-51.7175.8-71.6172.1172.400111.6P221 S225 R234 K235 N236 T241 Y242P221-M238 HydrophobicContact CB-CB 4.43Å; S225-M238 VanDerWaalsContact OG-CE 3.26Å; S225-M238 WeakPolarHBondContact OG-CE 3.22Å; S225-M238 WeakPolarHBondContact OG-CG 3.36Å; R234-M238 HydrophobicContact CG-CE 4.05Å; R234-M238 WeakPolarHBondContact O-CG 3.5Å; R234-M238 PolarHBondContact O-N 3Å; K235-M238 PolarHBondContact O-N 3.23Å; N236-M238 VanDerWaalsContact C-N 3.32Å; N236-M238 PolarHBondContact O-N 3Å; M238-T241 PolarHBondContact O-N 2.79Å; M238-Y242 WeakPolarHBondContact O-CB 3.3Å; M238-Y242 PolarHBondContact O-N 3.1Å
239F95.2Very high92.8Very high106 Ų10655.5 Ų55.547%0.46527%0.266SS..Hα-helixtrans-63-48.6-179.5-66.6-20.5000112.3K235 N236 T241 Y242 Y243K235-F239 HydrophobicContact CD-CE2 3.84Å; K235-F239 HydrophobicContact CD-CZ 4.25Å; K235-F239 HydrophobicContact CG-CD2 4.03Å; K235-F239 HydrophobicContact CG-CE2 3.53Å; K235-F239 HydrophobicContact CG-CZ 3.86Å; K235-F239 WeakPolarHBondContact O-CG 3.46Å; K235-F239 PolarHBondContact O-N 3.43Å; K235-F239 VanDerWaalsContact O-N 3.08Å; N236-F239 PolarHBondContact O-N 3.47Å; F239-T241 VanDerWaalsContact C-N 3.31Å; F239-T241 PolarHBondContact O-N 2.83Å; F239-Y242 PolarHBondContact O-N 2.71Å; F239-Y243 HydrophobicContact CB-CD2 4.38Å; F239-Y243 HydrophobicContact CB-CE2 4.17Å; F239-Y243 WeakPolarHBondContact O-CD2 3.37Å; F239-Y243 PolarHBondContact O-N 2.56Å
240N96.4Very high93.5Very high6 Ų653.6 Ų53.63%0.03227%0.269CS..Hα-helixtrans-62.3-40.3-179.8-69.9-32000111.4N236 A244 C285 I288 A294N236-N240 VanDerWaalsContact O-CB 3.28Å; N236-N240 WeakPolarHBondContact O-CB 3.29Å; N236-N240 VanDerWaalsContact O-CG 3.23Å; N236-N240 PolarHBondContact O-N 2.98Å; N236-N240 PolarHBondContact O-ND2 3.1Å; N236-N240 VanDerWaalsContact O-ND2 3.11Å; N240-A244 WeakPolarHBondContact O-CB 3.39Å; N240-A244 PolarHBondContact O-N 3.41Å; N240-C285 PolarHBondContact ND2-O 2.89Å; N240-I288 HydrophobicContact CB-CB 4.5Å; N240-I288 HydrophobicContact CB-CD1 4.48Å; N240-I288 WeakPolarHBondContact ND2-CB 3.39Å; N240-I288 PolarHBondContact ND2-O 2.95Å; N240-A294 HydrophobicContact CB-CB 3.85Å; N240-A294 WeakPolarHBondContact O-CB 3.3Å
241T96.1Very high94.1Very high0 Ų052 Ų520%026%0.258CS..Hα-helixtrans-63.4-45.2175.4-57.60000111.6W220 P221 N224 A237 M238 F239 A244 L245 V281W220-T241 HydrophobicContact CB-CG2 4.23Å; W220-T241 HydrophobicContact CG-CG2 4.45Å; P221-T241 HydrophobicContact CB-CG2 4.39Å; P221-T241 HydrophobicContact CG-CG2 4.13Å; N224-T241 HydrophobicContact CB-CG2 4.44Å; N224-T241 WeakPolarHBondContact CB-OG1 3.31Å; N224-T241 VanDerWaalsContact ND2-CG2 3.27Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.17Å; N224-T241 PolarHBondContact ND2-OG1 2.62Å; N224-T241 VanDerWaalsContact ND2-OG1 3.07Å; A237-T241 VanDerWaalsContact O-CB 3.22Å; A237-T241 WeakPolarHBondContact O-CB 3.38Å; A237-T241 PolarHBondContact O-N 2.96Å; A237-T241 PolarHBondContact O-OG1 3.38Å; M238-T241 PolarHBondContact O-N 2.79Å; F239-T241 VanDerWaalsContact C-N 3.31Å; F239-T241 PolarHBondContact O-N 2.83Å; T241-A244 PolarHBondContact O-N 3Å; T241-L245 HydrophobicContact CG2-CD1 4.12Å; T241-L245 WeakPolarHBondContact O-CB 3.18Å; T241-L245 WeakPolarHBondContact O-CG 3.39Å; T241-L245 PolarHBondContact O-N 3.01Å; T241-V281 HydrophobicContact CG2-CG2 4.18Å
242Y96.8Very high94.4Very high119 Ų11947.7 Ų47.747%0.46723%0.23SC..Hα-helixtrans-61.5-47.7179-176.9-94.5000112.3W217 M238 F239 A244 L245 A246W217-Y242 HydrophobicContact CH2-CD2 4.45Å; W217-Y242 AromaticContact CH2-CE2 3.73Å; W217-Y242 HydrophobicContact CH2-CE2 3.73Å; W217-Y242 HydrophobicContact CZ3-CE2 4.24Å; M238-Y242 WeakPolarHBondContact O-CB 3.3Å; M238-Y242 PolarHBondContact O-N 3.1Å; F239-Y242 PolarHBondContact O-N 2.71Å; Y242-A244 PolarHBondContact O-N 3.31Å; Y242-L245 PolarHBondContact O-N 3.23Å; Y242-A246 WeakPolarHBondContact O-CB 3.34Å; Y242-A246 PolarHBondContact O-N 2.96Å
243Y97.6Very high94.6Very high95 Ų9546.1 Ų46.137%0.37322%0.222SC..Hα-helixtrans-64.7-40.3179.4-71.6-57.8000112.7F239 A246 V247 P291F239-Y243 HydrophobicContact CB-CD2 4.38Å; F239-Y243 HydrophobicContact CB-CE2 4.17Å; F239-Y243 WeakPolarHBondContact O-CD2 3.37Å; F239-Y243 PolarHBondContact O-N 2.56Å; Y243-A246 PolarHBondContact O-N 3.19Å; Y243-V247 WeakPolarHBondContact O-CG2 3.13Å; Y243-V247 PolarHBondContact O-N 3.44Å; Y243-V247 VanDerWaalsContact O-N 3.11Å; Y243-P291 HydrophobicContact CD2-CB 3.77Å; Y243-P291 HydrophobicContact CD2-CG 4.44Å; Y243-P291 HydrophobicContact CE2-CB 3.87Å; Y243-P291 HydrophobicContact CE2-CG 4.16Å; Y243-P291 HydrophobicContact CG-CB 4.43Å
244A97.6Very high94.8Very high0 Ų045.7 Ų45.70%023%0.227CC..Hα-helixtrans-63.1-43.1175.900000111.9N240 T241 Y242 V247 S248 V281 A294 G298N240-A244 WeakPolarHBondContact O-CB 3.39Å; N240-A244 PolarHBondContact O-N 3.41Å; T241-A244 PolarHBondContact O-N 3Å; Y242-A244 PolarHBondContact O-N 3.31Å; A244-V247 PolarHBondContact O-N 3.46Å; A244-S248 WeakPolarHBondContact O-CB 3.33Å; A244-S248 PolarHBondContact O-N 3.41Å; A244-S248 PolarHBondContact O-OG 3.34Å; A244-V281 HydrophobicContact CB-CB 4.44Å; A244-V281 HydrophobicContact CB-CG1 3.43Å; A244-V281 VanDerWaalsContact CB-CG1 3.43Å; A244-V281 HydrophobicContact CB-CG2 4.18Å; A244-A294 WeakPolarHBondContact CA-O 3.32Å; A244-A294 WeakPolarHBondContact CB-O 3.34Å; A244-G298 WeakPolarHBondContact O-CA 3.26Å
245L96.5Very high94.9Very high1 Ų141.9 Ų41.91%0.00522%0.216CC..Hα-helixtrans-64.6-41.2176.1-83.9178.5000113.1W217 W220 T241 Y242 V247 S248 V249W217-L245 HydrophobicContact CZ2-CB 4.47Å; W217-L245 PolarHBondContact NE1-O 2.91Å; W217-L245 WeakPolarHBondContact O-CD1 3.47Å; W220-L245 HydrophobicContact CB-CD1 3.55Å; W220-L245 HydrophobicContact CG-CD1 4.2Å; T241-L245 HydrophobicContact CG2-CD1 4.12Å; T241-L245 WeakPolarHBondContact O-CB 3.18Å; T241-L245 WeakPolarHBondContact O-CG 3.39Å; T241-L245 PolarHBondContact O-N 3.01Å; Y242-L245 PolarHBondContact O-N 3.23Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.34Å; L245-S248 PolarHBondContact O-N 2.74Å; L245-V249 WeakPolarHBondContact O-CG2 3.45Å; L245-V249 PolarHBondContact O-N 3.44Å
246A97.1Very high94.7Very high33 Ų3337.3 Ų37.327%0.27320%0.196SC..Hα-helixtrans-60.3-45.5176.600000111.3Y242 Y243 V249 V250Y242-A246 WeakPolarHBondContact O-CB 3.34Å; Y242-A246 PolarHBondContact O-N 2.96Å; Y243-A246 PolarHBondContact O-N 3.19Å; A246-V249 PolarHBondContact O-N 2.93Å; A246-V250 PolarHBondContact O-N 3.02Å
247V97.4Very high94.7Very high27 Ų2737 Ų3716%0.16420%0.198CC..Hα-helixtrans-67.4-42.7177177.70000111.3Y243 A244 L245 V249 V250 T251 M295 L299Y243-V247 WeakPolarHBondContact O-CG2 3.13Å; Y243-V247 PolarHBondContact O-N 3.44Å; Y243-V247 VanDerWaalsContact O-N 3.11Å; A244-V247 PolarHBondContact O-N 3.46Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.34Å; V247-V249 VanDerWaalsContact C-N 3.25Å; V247-V249 PolarHBondContact O-N 3.23Å; V247-V250 PolarHBondContact O-N 3.11Å; V247-V250 VanDerWaalsContact O-N 3.1Å; V247-T251 PolarHBondContact O-N 3.22Å; V247-T251 PolarHBondContact O-OG1 3.05Å; V247-M295 WeakPolarHBondContact CG1-O 3.45Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.76Å; V247-M295 HydrophobicContact CG2-CG 3.79Å; V247-L299 HydrophobicContact CG1-CB 3.71Å
248S95.9Very high94.4Very high0 Ų044 Ų440%023%0.234CC..Hα-helixtrans-56.9-36176.1-76.50000113.3A244 L245 T251 A252 G277 G298A244-S248 WeakPolarHBondContact O-CB 3.33Å; A244-S248 PolarHBondContact O-N 3.41Å; A244-S248 PolarHBondContact O-OG 3.34Å; L245-S248 PolarHBondContact O-N 2.74Å; S248-T251 PolarHBondContact O-N 3.48Å; S248-A252 WeakPolarHBondContact O-CB 3.41Å; S248-A252 PolarHBondContact O-N 2.88Å; S248-G277 WeakPolarHBondContact OG-CA 3.31Å; S248-G277 PolarHBondContact OG-N 2.91Å; S248-G298 PolarHBondContact OG-O 3.01Å
249V95.6Very high93.9Very high39 Ų3942.4 Ų42.424%0.23623%0.23CC..Hα-helixtrans-63.4-48174.1170.60000111.6L245 A246 V247 T251 A252 I253 V274L245-V249 WeakPolarHBondContact O-CG2 3.45Å; L245-V249 PolarHBondContact O-N 3.44Å; A246-V249 PolarHBondContact O-N 2.93Å; V247-V249 VanDerWaalsContact C-N 3.25Å; V247-V249 PolarHBondContact O-N 3.23Å; V249-T251 VanDerWaalsContact C-N 3.31Å; V249-T251 PolarHBondContact O-N 3.2Å; V249-A252 WeakPolarHBondContact O-CB 3.02Å; V249-A252 PolarHBondContact O-N 3Å; V249-I253 HydrophobicContact CG1-CD1 4.14Å; V249-I253 PolarHBondContact O-N 3.43Å; V249-V274 HydrophobicContact CG2-CB 4.35Å; V249-V274 HydrophobicContact CG2-CG1 3.8Å; V249-V274 HydrophobicContact CG2-CG2 4.19Å
250V96.2Very high93.3Very high98 Ų9839.7 Ų39.759%0.59422%0.219SC*.Hα-helixtrans-61.6-44.3178.8177.10000109.9A246 V247 I253 S254A246-V250 PolarHBondContact O-N 3.02Å; V247-V250 PolarHBondContact O-N 3.11Å; V247-V250 VanDerWaalsContact O-N 3.1Å; V250-I253 PolarHBondContact O-N 3.41Å; V250-S254 VanDerWaalsContact O-CB 3.31Å; V250-S254 WeakPolarHBondContact O-CB 3.48Å; V250-S254 PolarHBondContact O-N 3.42Å; V250-S254 PolarHBondContact O-OG 2.93Å
251T95Very high92.6Very high5 Ų545.4 Ų45.43%0.03126%0.256CS..Hα-helixtrans-62.7-40.4175-51.80000112.2V247 S248 V249 S254 G255 L299 L303 I306V247-T251 PolarHBondContact O-N 3.22Å; V247-T251 PolarHBondContact O-OG1 3.05Å; S248-T251 PolarHBondContact O-N 3.48Å; V249-T251 VanDerWaalsContact C-N 3.31Å; V249-T251 PolarHBondContact O-N 3.2Å; T251-S254 PolarHBondContact O-OG 3.49Å; T251-G255 VanDerWaalsContact O-CA 3.28Å; T251-G255 WeakPolarHBondContact O-CA 3.34Å; T251-G255 PolarHBondContact O-N 2.78Å; T251-L299 HydrophobicContact CG2-CD1 3.87Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.31Å; T251-L303 HydrophobicContact CG2-CD2 3.82Å; T251-L303 HydrophobicContact CG2-CG 3.81Å; T251-I306 HydrophobicContact CG2-CD1 4.48Å; T251-I306 WeakPolarHBondContact O-CD1 3.48Å
252A92.4Very high91.9Very high0 Ų051.4 Ų51.40%028%0.284CS..Hα-helixtrans-60.6-48.6178.900000111.5S248 V249 S256 A273 V274S248-A252 WeakPolarHBondContact O-CB 3.41Å; S248-A252 PolarHBondContact O-N 2.88Å; V249-A252 WeakPolarHBondContact O-CB 3.02Å; V249-A252 PolarHBondContact O-N 3Å; A252-S256 WeakPolarHBondContact O-CA 3.44Å; A252-S256 WeakPolarHBondContact O-CB 3.47Å; A252-S256 PolarHBondContact O-N 3.28Å; A252-A273 HydrophobicContact CB-CB 3.54Å; A252-V274 HydrophobicContact CB-CG2 3.79Å
253I92.6Very high91.3Very high77 Ų7755.2 Ų55.240%0.39530%0.298SS..Hα-helixtrans-70.6-51.2-178.3-64.8173000110.9V249 V250 S256 S257 I265V249-I253 HydrophobicContact CG1-CD1 4.14Å; V249-I253 PolarHBondContact O-N 3.43Å; V250-I253 PolarHBondContact O-N 3.41Å; I253-S256 PolarHBondContact O-N 3.41Å; I253-S257 PolarHBondContact O-N 3.46Å; I253-S257 VanDerWaalsContact O-N 3.08Å; I253-I265 HydrophobicContact CG2-CD1 3.83Å; I253-I265 HydrophobicContact CG2-CG1 4.37Å
254S94.1Very high90.7Very high67 Ų6756.6 Ų56.647%0.46931%0.305SS..Hα-helixtrans-65.8-48.2-178.257.80000112V250 T251 S257 L258V250-S254 VanDerWaalsContact O-CB 3.31Å; V250-S254 WeakPolarHBondContact O-CB 3.48Å; V250-S254 PolarHBondContact O-N 3.42Å; V250-S254 PolarHBondContact O-OG 2.93Å; T251-S254 PolarHBondContact O-OG 3.49Å; S254-S257 PolarHBondContact O-N 2.94Å; S254-L258 PolarHBondContact O-N 2.98Å
255G89.4Confident90.1Very high10 Ų1061.5 Ų61.510%0.10333%0.331CS..Hα-helixtrans-67.6-34.4178.200000112.5T251 L258 A259T251-G255 VanDerWaalsContact O-CA 3.28Å; T251-G255 WeakPolarHBondContact O-CA 3.34Å; T251-G255 PolarHBondContact O-N 2.78Å; G255-L258 PolarHBondContact O-N 3.21Å; G255-A259 WeakPolarHBondContact O-CB 3.34Å; G255-A259 PolarHBondContact O-N 3.36Å
256S88.4Confident89.5Confident0 Ų062.7 Ų62.70%034%0.339CS..Hα-helixtrans-62.3-44.3171.8174.10000111.5A252 I253 L258 A259 H260 S266A252-S256 WeakPolarHBondContact O-CA 3.44Å; A252-S256 WeakPolarHBondContact O-CB 3.47Å; A252-S256 PolarHBondContact O-N 3.28Å; I253-S256 PolarHBondContact O-N 3.41Å; S256-L258 VanDerWaalsContact C-N 3.33Å; S256-A259 PolarHBondContact O-N 2.84Å; S256-H260 WeakPolarHBondContact O-CB 3.41Å; S256-H260 PolarHBondContact O-N 3.31Å; S256-S266 PolarHBondContact OG-N 2.93Å
257S90.4Very high88.7Confident38 Ų3863.6 Ų63.627%0.26634%0.338SS..Hα-helixtrans-62.4-44.3177.9-177.80000110.5I253 S254 A259 R263I253-S257 PolarHBondContact O-N 3.46Å; I253-S257 VanDerWaalsContact O-N 3.08Å; S254-S257 PolarHBondContact O-N 2.94Å; S257-A259 PolarHBondContact O-N 2.97Å; S257-R263 VanDerWaalsContact O-CA 3.3Å; S257-R263 WeakPolarHBondContact O-CA 3.46Å; S257-R263 PolarHBondContact OG-O 3.31Å
258L88.7Confident87.7Confident145 Ų14566 Ų6676%0.75935%0.353SS*.Hα-helixtrans-67.1-37.5179.6-171.963.3000113.3S254 G255 S256S254-L258 PolarHBondContact O-N 2.98Å; G255-L258 PolarHBondContact O-N 3.21Å; S256-L258 VanDerWaalsContact C-N 3.33Å
259A83.4Confident87.1Confident24 Ų2467.7 Ų67.720%0.19836%0.36CS..Hα-helixtrans-78.7-20.6-176.400000113.8G255 S256 S257 Y269 I306G255-A259 WeakPolarHBondContact O-CB 3.34Å; G255-A259 PolarHBondContact O-N 3.36Å; S256-A259 PolarHBondContact O-N 2.84Å; S257-A259 PolarHBondContact O-N 2.97Å; A259-Y269 HydrophobicContact CB-CE2 4.49Å; A259-I306 HydrophobicContact CB-CG2 3.85Å
260H81.4Confident86.6Confident50 Ų5066.2 Ų66.223%0.23135%0.351CS..SBendtrans-82.1132.3-177.7-165.9-88.1000111.6S256 Q262 R263 K264S256-H260 WeakPolarHBondContact O-CB 3.41Å; S256-H260 PolarHBondContact O-N 3.31Å; H260-Q262 PolarHBondContact ND1-N 2.91Å; H260-Q262 PolarHBondContact O-N 3.46Å; H260-R263 PolarHBondContact O-N 3.34Å; H260-K264 WeakPolarHBondContact CB-O 3.25Å
261P81.1Confident85.9Confident125 Ų12562.6 Ų62.681%0.81233%0.328SS*.THydrogen-bonded Turntrans-55.1-33.5-176.9-26.934.2000114.5
262Q83.3Confident85.1Confident126 Ų12662.7 Ų62.759%0.58933%0.329SS*.THydrogen-bonded Turntrans-92.68.4179-59.4-177.4-4.700114.4H260 K264H260-Q262 PolarHBondContact ND1-N 2.91Å; H260-Q262 PolarHBondContact O-N 3.46Å; Q262-K264 HydrophobicContact CB-CD 4.29Å; Q262-K264 HydrophobicContact CB-CG 4.21Å; Q262-K264 PolarHBondContact O-N 3.39Å; Q262-K264 VanDerWaalsContact OE1-NZ 3.15Å
263R83.4Confident85Confident200 Ų20062.7 Ų62.776%0.75533%0.329SS*.SBendtrans52.835.4-172-58.6-166.9-178.31801.8115.1S257 H260S257-R263 VanDerWaalsContact O-CA 3.3Å; S257-R263 WeakPolarHBondContact O-CA 3.46Å; S257-R263 PolarHBondContact OG-O 3.31Å; H260-R263 PolarHBondContact O-N 3.34Å
264K85.4Confident85Confident123 Ų12359.6 Ų59.654%0.53531%0.313SS..  trans-105.6152.1177.1-68.8-179-178.3167.90110.1H260 Q262 S266H260-K264 WeakPolarHBondContact CB-O 3.25Å; Q262-K264 HydrophobicContact CB-CD 4.29Å; Q262-K264 HydrophobicContact CB-CG 4.21Å; Q262-K264 PolarHBondContact O-N 3.39Å; Q262-K264 VanDerWaalsContact OE1-NZ 3.15Å; K264-S266 PolarHBondContact O-N 3.17Å
265I85.4Confident84.9Confident103 Ų10356.4 Ų56.453%0.52829%0.291SS..  trans-75.9126.1176.1-58.8164.4000108.6I253 V270I253-I265 HydrophobicContact CG2-CD1 3.83Å; I253-I265 HydrophobicContact CG2-CG1 4.37Å; I265-V270 HydrophobicContact CG2-CG2 3.54Å
266S83.1Confident85.1Confident27 Ų2755.9 Ų55.919%0.18929%0.286CS..  trans-103.9125.1176.9177.20000109.6S256 K264 T268 Y269 V270S256-S266 PolarHBondContact OG-N 2.93Å; K264-S266 PolarHBondContact O-N 3.17Å; S266-T268 PolarHBondContact O-N 2.91Å; S266-Y269 PolarHBondContact O-N 2.9Å; S266-V270 WeakPolarHBondContact O-CG2 3.45Å; S266-V270 PolarHBondContact O-N 3.22Å; S266-V270 VanDerWaalsContact O-N 3.13Å
267M79.9Confident85.3Confident51 Ų5155.9 Ų55.925%0.25129%0.286SS..Hα-helixtrans-63.4-27.9-178.7-154.569.3176.800113P205 M210 Y269 V270 H271P205-M267 HydrophobicContact CB-CB 3.76Å; P205-M267 HydrophobicContact CB-CG 3.9Å; P205-M267 HydrophobicContact CG-CB 3.97Å; M210-M267 HydrophobicContact CB-CE 3.62Å; M210-M267 HydrophobicContact CE-CE 3.75Å; M210-M267 HydrophobicContact CG-CE 3.45Å; M210-M267 VanDerWaalsContact CG-CE 3.45Å; M210-M267 HydrophobicContact SD-CE 3.25Å; M210-M267 WeakPolarHBondContact SD-CE 3.1Å; M267-Y269 VanDerWaalsContact C-N 3.34Å; M267-Y269 PolarHBondContact O-N 3.13Å; M267-V270 PolarHBondContact O-N 3.47Å; M267-V270 HydrophobicContact SD-CB 4.33Å; M267-V270 HydrophobicContact SD-CG1 4.38Å; M267-H271 WeakPolarHBondContact CE-NE2 3.31Å; M267-H271 WeakPolarHBondContact CG-NE2 3.41Å; M267-H271 WeakPolarHBondContact O-CB 3.42Å; M267-H271 VanDerWaalsContact O-CG 3.31Å; M267-H271 PolarHBondContact O-N 3.07Å
268T76.6Confident85.5Confident78 Ų7854.1 Ų54.148%0.47927%0.273SS..Hα-helixtrans-62.2-42.5177-51.20000111.8S266 S272S266-T268 PolarHBondContact O-N 2.91Å; T268-S272 PolarHBondContact O-N 2.9Å; T268-S272 PolarHBondContact O-OG 2.9Å
269Y82.8Confident85.6Confident35 Ų3547.2 Ų47.214%0.13724%0.237CC..Hα-helixtrans-70.7-42175.9-60.3-35.5000111A259 S266 M267 S272 A273 A309A259-Y269 HydrophobicContact CB-CE2 4.49Å; S266-Y269 PolarHBondContact O-N 2.9Å; M267-Y269 VanDerWaalsContact C-N 3.34Å; M267-Y269 PolarHBondContact O-N 3.13Å; Y269-S272 PolarHBondContact O-N 3.41Å; Y269-A273 VanDerWaalsContact O-CB 3.23Å; Y269-A273 WeakPolarHBondContact O-CB 3.12Å; Y269-A273 PolarHBondContact O-N 3.33Å; Y269-A309 HydrophobicContact CD1-CB 3.59Å; Y269-A309 HydrophobicContact CE1-CB 3.82Å
270V85.7Confident86.1Confident8 Ų846.1 Ų46.15%0.04823%0.228CC..Hα-helixtrans-61.1-51.8178.6175.20000111.4M210 I265 S266 M267 S272 A273 V274M210-V270 HydrophobicContact CE-CG1 4.43Å; I265-V270 HydrophobicContact CG2-CG2 3.54Å; S266-V270 WeakPolarHBondContact O-CG2 3.45Å; S266-V270 PolarHBondContact O-N 3.22Å; S266-V270 VanDerWaalsContact O-N 3.13Å; M267-V270 PolarHBondContact O-N 3.47Å; M267-V270 HydrophobicContact SD-CB 4.33Å; M267-V270 HydrophobicContact SD-CG1 4.38Å; V270-S272 PolarHBondContact O-N 3.44Å; V270-A273 PolarHBondContact O-N 3.24Å; V270-V274 HydrophobicContact CG1-CG2 3.63Å; V270-V274 VanDerWaalsContact O-CB 3.29Å; V270-V274 WeakPolarHBondContact O-CB 3.48Å; V270-V274 WeakPolarHBondContact O-CG2 3.33Å; V270-V274 PolarHBondContact O-N 3.43Å
271H80.7Confident86.6Confident23 Ų2343.7 Ų43.711%0.10622%0.217CC..Hα-helixtrans-57.2-36.5179.4-73.9170.9000113.1M210 M267M210-H271 PolarHBondContact N-NE2 3.13Å; M267-H271 WeakPolarHBondContact CE-NE2 3.31Å; M267-H271 WeakPolarHBondContact CG-NE2 3.41Å; M267-H271 WeakPolarHBondContact O-CB 3.42Å; M267-H271 VanDerWaalsContact O-CG 3.31Å; M267-H271 PolarHBondContact O-N 3.07Å
272S79.1Confident87Confident7 Ų738.3 Ų38.35%0.04918%0.183CC..Hα-helixtrans-81-34.3-178.4-52.60000112.6T268 Y269 V270 S305T268-S272 PolarHBondContact O-N 2.9Å; T268-S272 PolarHBondContact O-OG 2.9Å; Y269-S272 PolarHBondContact O-N 3.41Å; V270-S272 PolarHBondContact O-N 3.44Å; S272-S305 PolarHBondContact O-OG 3.38Å
273A89.8Confident87.2Confident0 Ų032.7 Ų32.70%016%0.158CC..Hα-helixtrans-94.8-27.6-17100000113.9A252 Y269 V270 L275 A276 S305 I306A252-A273 HydrophobicContact CB-CB 3.54Å; Y269-A273 VanDerWaalsContact O-CB 3.23Å; Y269-A273 WeakPolarHBondContact O-CB 3.12Å; Y269-A273 PolarHBondContact O-N 3.33Å; V270-A273 PolarHBondContact O-N 3.24Å; A273-L275 PolarHBondContact O-N 3.2Å; A273-A276 VanDerWaalsContact O-CB 3.26Å; A273-A276 WeakPolarHBondContact O-CB 3.39Å; A273-A276 PolarHBondContact O-N 3.34Å; A273-A276 VanDerWaalsContact O-N 3.07Å; A273-S305 VanDerWaalsContact CA-OG 3.31Å; A273-S305 WeakPolarHBondContact CA-OG 3.24Å; A273-S305 PolarHBondContact N-OG 3.31Å; A273-I306 HydrophobicContact CB-CD1 4.4Å; A273-I306 HydrophobicContact CB-CG1 3.83Å
274V92.4Very high87.5Confident11 Ų1123.2 Ų23.27%0.06712%0.122CC..THydrogen-bonded Turntrans-58.1-33.6180159.50000112.6W217 V249 A252 V270W217-V274 HydrophobicContact CG-CG1 4.44Å; V249-V274 HydrophobicContact CG2-CB 4.35Å; V249-V274 HydrophobicContact CG2-CG1 3.8Å; V249-V274 HydrophobicContact CG2-CG2 4.19Å; A252-V274 HydrophobicContact CB-CG2 3.79Å; V270-V274 HydrophobicContact CG1-CG2 3.63Å; V270-V274 VanDerWaalsContact O-CB 3.29Å; V270-V274 WeakPolarHBondContact O-CB 3.48Å; V270-V274 WeakPolarHBondContact O-CG2 3.33Å; V270-V274 PolarHBondContact O-N 3.43Å
275L92.2Very high87.7Confident0 Ų017.4 Ų17.40%010%0.097CC..THydrogen-bonded Turntrans-95-3.2-178.1-59.1173.1000113.2L65 A213 L216 W217 W220 A273 G277 G278 V279 M328 F332L65-L275 HydrophobicContact CD1-CD1 4.23Å; L65-L275 HydrophobicContact CD2-CD1 4.46Å; A213-L275 HydrophobicContact CB-CD1 4.38Å; L216-L275 HydrophobicContact CB-CD1 4Å; L216-L275 HydrophobicContact CB-CD2 3.74Å; L216-L275 HydrophobicContact CD1-CD1 3.75Å; L216-L275 HydrophobicContact CG-CD1 4.49Å; W217-L275 HydrophobicContact CB-CD2 3.93Å; W220-L275 HydrophobicContact CE3-CB 4.45Å; W220-L275 HydrophobicContact CE3-CD2 3.81Å; W220-L275 HydrophobicContact CH2-CB 4.27Å; W220-L275 HydrophobicContact CZ3-CB 3.85Å; W220-L275 HydrophobicContact CZ3-CD1 3.9Å; W220-L275 HydrophobicContact CZ3-CD2 3.72Å; W220-L275 HydrophobicContact CZ3-CG 4.01Å; A273-L275 PolarHBondContact O-N 3.2Å; L275-G277 PolarHBondContact O-N 3.37Å; L275-G278 PolarHBondContact O-N 3.07Å; L275-V279 PolarHBondContact O-N 3.27Å; L275-M328 HydrophobicContact CD1-CE 4.22Å; L275-F332 HydrophobicContact CB-CZ 4.47Å; L275-F332 HydrophobicContact CD1-CZ 4.45Å
276A93.4Very high87.9Confident0 Ų014.4 Ų14.40%08%0.081CC..Hα-helixtrans-63.7-42.7-165.700000112.9A273 G278 V279 A280 A301 L335A273-A276 VanDerWaalsContact O-CB 3.26Å; A273-A276 WeakPolarHBondContact O-CB 3.39Å; A273-A276 PolarHBondContact O-N 3.34Å; A273-A276 VanDerWaalsContact O-N 3.07Å; A276-G278 VanDerWaalsContact C-N 3.32Å; A276-G278 PolarHBondContact O-N 3.1Å; A276-V279 PolarHBondContact O-N 3.46Å; A276-A280 WeakPolarHBondContact O-CB 3.23Å; A276-A280 PolarHBondContact O-N 2.97Å; A276-A301 HydrophobicContact CB-CB 4.03Å; A276-L335 HydrophobicContact CB-CD1 3.58Å; A276-L335 HydrophobicContact CB-CD2 4.04Å; A276-L335 HydrophobicContact CB-CG 4.47Å
277G94.3Very high88.1Confident0 Ų015.6 Ų15.60%09%0.085CC..Hα-helixtrans-63.4-35.3178.200000113.2S248 L275 A280 V281S248-G277 WeakPolarHBondContact OG-CA 3.31Å; S248-G277 PolarHBondContact OG-N 2.91Å; L275-G277 PolarHBondContact O-N 3.37Å; G277-A280 PolarHBondContact O-N 3.36Å; G277-V281 WeakPolarHBondContact O-CG2 3.45Å; G277-V281 PolarHBondContact O-N 3.18Å
278G92.7Very high88.7Confident0 Ų013.3 Ų13.30%07%0.074CC..Hα-helixtrans-65.6-40.5178.800000112.8W220 N224 L275 A276 G282W220-G278 PolarHBondContact NE1-O 3.18Å; W220-G278 VanDerWaalsContact NE1-O 3.15Å; N224-G278 PolarHBondContact ND2-O 3.39Å; L275-G278 PolarHBondContact O-N 3.07Å; A276-G278 VanDerWaalsContact C-N 3.32Å; A276-G278 PolarHBondContact O-N 3.1Å; G278-G282 PolarHBondContact O-N 2.97Å
279V92Very high89.3Confident1 Ų114.4 Ų14.41%0.0068%0.082CC..Hα-helixtrans-68.2-48172.9-176.90000110.3Y173 W220 L275 A276 V281 G282 F332 L335Y173-V279 HydrophobicContact CD1-CG1 3.98Å; Y173-V279 HydrophobicContact CE1-CG1 4.4Å; Y173-V279 HydrophobicContact CG-CG1 4.2Å; W220-V279 HydrophobicContact CH2-CG2 3.75Å; W220-V279 HydrophobicContact CZ2-CB 4.39Å; W220-V279 HydrophobicContact CZ2-CG2 3.35Å; L275-V279 PolarHBondContact O-N 3.27Å; A276-V279 PolarHBondContact O-N 3.46Å; V279-V281 PolarHBondContact O-N 2.97Å; V279-G282 PolarHBondContact O-N 2.82Å; V279-F332 HydrophobicContact CG2-CD1 3.78Å; V279-F332 HydrophobicContact CG2-CE1 3.64Å; V279-F332 HydrophobicContact CG2-CG 4.44Å; V279-F332 HydrophobicContact CG2-CZ 4.16Å; V279-L335 HydrophobicContact CB-CB 4.01Å; V279-L335 HydrophobicContact CB-CD1 4.39Å; V279-L335 HydrophobicContact CG1-CB 3.72Å
280A93.4Very high89.7Confident0 Ų014 Ų140%08%0.084CC..Hα-helixtrans-65.1-36.9-174.400000113.4A276 G277 G282 L297 A301 L335 L338 G339A276-A280 WeakPolarHBondContact O-CB 3.23Å; A276-A280 PolarHBondContact O-N 2.97Å; G277-A280 PolarHBondContact O-N 3.36Å; A280-G282 VanDerWaalsContact C-N 3.27Å; A280-L297 HydrophobicContact CB-CD1 4.42Å; A280-L297 HydrophobicContact CB-CG 4.32Å; A280-A301 HydrophobicContact CB-CB 3.61Å; A280-L335 HydrophobicContact CB-CD2 4.49Å; A280-L338 HydrophobicContact CB-CD2 4.07Å; A280-G339 WeakPolarHBondContact O-CA 3.5Å
281V93.1Very high90.1Very high0 Ų016.7 Ų16.70%010%0.102CC..THydrogen-bonded Turntrans-79.9-8.9173.5-62.90000113T241 A244 G277 V279 T283 S284 C285 I288 L297T241-V281 HydrophobicContact CG2-CG2 4.18Å; A244-V281 HydrophobicContact CB-CB 4.44Å; A244-V281 HydrophobicContact CB-CG1 3.43Å; A244-V281 VanDerWaalsContact CB-CG1 3.43Å; A244-V281 HydrophobicContact CB-CG2 4.18Å; G277-V281 WeakPolarHBondContact O-CG2 3.45Å; G277-V281 PolarHBondContact O-N 3.18Å; V279-V281 PolarHBondContact O-N 2.97Å; V281-T283 VanDerWaalsContact C-N 3.34Å; V281-T283 PolarHBondContact O-N 3.16Å; V281-T283 VanDerWaalsContact O-N 3.14Å; V281-S284 CarbonylContact O-C 3.58Å; V281-S284 PolarHBondContact O-N 3.11Å; V281-S284 VanDerWaalsContact O-N 3.07Å; V281-S284 PolarHBondContact O-OG 2.87Å; V281-C285 HydrophobicContact CB-CB 4.23Å; V281-C285 HydrophobicContact CG2-CB 4.39Å; V281-C285 WeakPolarHBondContact O-CA 3.49Å; V281-C285 WeakPolarHBondContact O-CB 3.12Å; V281-C285 PolarHBondContact O-N 3.05Å; V281-I288 HydrophobicContact CG1-CD1 4.21Å; V281-L297 HydrophobicContact CG1-CB 4.46Å; V281-L297 HydrophobicContact CG1-CD2 3.8Å; V281-L297 HydrophobicContact CG1-CG 4.16Å
282G89.1Confident90.8Very high11 Ų1123.1 Ų23.111%0.11313%0.125CC..THydrogen-bonded Turntrans-48.3-51.5-166.200000114.4G278 V279 A280 C285G278-G282 PolarHBondContact O-N 2.97Å; V279-G282 PolarHBondContact O-N 2.82Å; A280-G282 VanDerWaalsContact C-N 3.27Å; G282-C285 PolarHBondContact O-SG 3.06Å
283T87.4Confident91.6Very high9 Ų925.3 Ų25.36%0.05514%0.136CC..THydrogen-bonded Turntrans-80.9-29.3-176.563.60000113.1R170 V281 H286 G339 E340 Y343R170-T283 HydrophobicContact CG-CG2 4.31Å; R170-T283 WeakPolarHBondContact O-CG2 3.5Å; V281-T283 VanDerWaalsContact C-N 3.34Å; V281-T283 PolarHBondContact O-N 3.16Å; V281-T283 VanDerWaalsContact O-N 3.14Å; T283-H286 PolarHBondContact O-CE1 3.44Å; T283-G339 PolarHBondContact OG1-O 2.91Å; T283-E340 HydrophobicContact CG2-CG 4.42Å; T283-E340 PolarHBondContact OG1-N 3.37Å; T283-Y343 WeakPolarHBondContact O-CD2 3.29Å
284S89.9Confident91.9Very high0 Ų025.3 Ų25.30%014%0.136CC..THydrogen-bonded Turntrans-100.8-9.4-171.755.10000114.5V281 H286 L287 I288V281-S284 CarbonylContact O-C 3.58Å; V281-S284 PolarHBondContact O-N 3.11Å; V281-S284 VanDerWaalsContact O-N 3.07Å; V281-S284 PolarHBondContact O-OG 2.87Å; S284-H286 PolarHBondContact O-N 3.35Å; S284-H286 VanDerWaalsContact O-N 3.07Å; S284-L287 PolarHBondContact O-N 3.39Å; S284-I288 PolarHBondContact O-N 3.45Å
285C89.9Confident92.1Very high1 Ų128.7 Ų28.71%0.00715%0.152CC..THydrogen-bonded Turntrans-56.2-33-168.3580000114.4A237 N240 V281 G282A237-C285 HydrophobicContact CB-CB 4.11Å; A237-C285 VanDerWaalsContact CB-SG 3.51Å; N240-C285 PolarHBondContact ND2-O 2.89Å; V281-C285 HydrophobicContact CB-CB 4.23Å; V281-C285 HydrophobicContact CG2-CB 4.39Å; V281-C285 WeakPolarHBondContact O-CA 3.49Å; V281-C285 WeakPolarHBondContact O-CB 3.12Å; V281-C285 PolarHBondContact O-N 3.05Å; G282-C285 PolarHBondContact O-SG 3.06Å
286H88.3Confident92.4Very high41 Ų4132.1 Ų32.119%0.1917%0.173CC..THydrogen-bonded Turntrans-80.8-19.2-179.968.1-79.7000113.7L228 Q233 A237 T283 S284 Y343L228-H286 HydrophobicContact CD1-CB 3.75Å; L228-H286 HydrophobicContact CD2-CB 4.24Å; Q233-H286 HydrophobicContact CB-CB 4.15Å; A237-H286 HydrophobicContact CB-CB 4.33Å; T283-H286 PolarHBondContact O-CE1 3.44Å; S284-H286 PolarHBondContact O-N 3.35Å; S284-H286 VanDerWaalsContact O-N 3.07Å; H286-Y343 AromaticContact CE1-CE2 3.96Å
287L88.6Confident92.5Very high51 Ų5132.9 Ų32.927%0.26718%0.177SC..THydrogen-bonded Turntrans-93.7-16.7179.5-64.6-175.7000113.2S284 P289 Y343 L346S284-L287 PolarHBondContact O-N 3.39Å; L287-P289 WeakPolarHBondContact O-CD 3.47Å; L287-Y343 HydrophobicContact CD1-CD2 3.55Å; L287-Y343 HydrophobicContact CD1-CE2 3.33Å; L287-Y343 HydrophobicContact CD1-CG 4.48Å; L287-Y343 HydrophobicContact CG-CD2 4.47Å; L287-Y343 HydrophobicContact CG-CE2 4.26Å; L287-L346 HydrophobicContact CB-CB 4.31Å; L287-L346 HydrophobicContact CB-CD1 4.23Å
288I91.4Very high92.6Very high4 Ų432.9 Ų32.92%0.02118%0.177CC..  trans-67.8115.8-179.8-66.5167.1000109.2N240 V281 S284 S290 L293 A294 L297 L346N240-I288 HydrophobicContact CB-CB 4.5Å; N240-I288 HydrophobicContact CB-CD1 4.48Å; N240-I288 WeakPolarHBondContact ND2-CB 3.39Å; N240-I288 PolarHBondContact ND2-O 2.95Å; V281-I288 HydrophobicContact CG1-CD1 4.21Å; S284-I288 PolarHBondContact O-N 3.45Å; I288-S290 VanDerWaalsContact CG2-O 3.23Å; I288-S290 WeakPolarHBondContact CG2-O 3.38Å; I288-L293 HydrophobicContact CG2-CB 3.78Å; I288-A294 HydrophobicContact CD1-CB 4.18Å; I288-A294 HydrophobicContact CG2-CB 4.24Å; I288-L297 HydrophobicContact CD1-CD2 4.48Å; I288-L346 HydrophobicContact CG1-CD1 3.53Å
289P88.8Confident92.8Very high101 Ų10136.5 Ų36.566%0.65620%0.196SC*.  trans-79-26.7-172.730.8-35.5000113.1L287 L293L287-P289 WeakPolarHBondContact O-CD 3.47Å; P289-L293 HydrophobicContact CG-CD1 3.96Å
290S91.8Very high93Very high27 Ų2739.2 Ų39.219%0.18921%0.212CC..SBendtrans-131.8140.8-173.360.60000112.4I288 W292 L293I288-S290 VanDerWaalsContact CG2-O 3.23Å; I288-S290 WeakPolarHBondContact CG2-O 3.38Å; S290-W292 VanDerWaalsContact C-N 3.29Å; S290-W292 PolarHBondContact O-N 3.46Å; S290-W292 VanDerWaalsContact OG-CD1 3.26Å; S290-W292 PolarHBondContact OG-NE1 3.1Å; S290-L293 PolarHBondContact O-N 3.22Å; S290-L293 VanDerWaalsContact OG-CD1 3.29Å; S290-L293 WeakPolarHBondContact OG-CD1 3.35Å; S290-L293 WeakPolarHBondContact OG-CG 3.47Å
291P94.3Very high93.1Very high63 Ų6339.2 Ų39.241%0.40921%0.212SC..Hα-helixtrans-58.1-35.5-178-28.936.3000114.8Y243 L293 A294 M295Y243-P291 HydrophobicContact CD2-CB 3.77Å; Y243-P291 HydrophobicContact CD2-CG 4.44Å; Y243-P291 HydrophobicContact CE2-CB 3.87Å; Y243-P291 HydrophobicContact CE2-CG 4.16Å; Y243-P291 HydrophobicContact CG-CB 4.43Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 2.94Å; P291-A294 WeakPolarHBondContact O-CB 3.1Å; P291-A294 PolarHBondContact O-N 3.49Å; P291-A294 VanDerWaalsContact O-N 3.12Å; P291-M295 WeakPolarHBondContact O-CG 3.36Å; P291-M295 PolarHBondContact O-N 3.49Å
292W95.6Very high93.1Very high159 Ų15939.2 Ų39.260%0.60221%0.212SC*.Hα-helixtrans-64.3-30.7-177.175.4-98.3000112.4S290 M295 V296S290-W292 VanDerWaalsContact C-N 3.29Å; S290-W292 PolarHBondContact O-N 3.46Å; S290-W292 VanDerWaalsContact OG-CD1 3.26Å; S290-W292 PolarHBondContact OG-NE1 3.1Å; W292-M295 WeakPolarHBondContact O-CB 3.32Å; W292-M295 PolarHBondContact O-N 3.41Å; W292-V296 HydrophobicContact CE3-CG2 3.91Å; W292-V296 HydrophobicContact CZ3-CG2 4.14Å; W292-V296 WeakPolarHBondContact O-CG2 3.32Å; W292-V296 PolarHBondContact O-N 3.1Å
293L95.1Very high93.3Very high52 Ų5243.2 Ų43.227%0.27223%0.23SC..Hα-helixtrans-66.2-41.8174.9-72.6171.7000111I288 P289 S290 P291 M295 V296 L297I288-L293 HydrophobicContact CG2-CB 3.78Å; P289-L293 HydrophobicContact CG-CD1 3.96Å; S290-L293 PolarHBondContact O-N 3.22Å; S290-L293 VanDerWaalsContact OG-CD1 3.29Å; S290-L293 WeakPolarHBondContact OG-CD1 3.35Å; S290-L293 WeakPolarHBondContact OG-CG 3.47Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 2.94Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.46Å; L293-V296 PolarHBondContact O-N 3.17Å; L293-L297 WeakPolarHBondContact O-CB 3.5Å; L293-L297 PolarHBondContact O-N 2.98Å
294A96.3Very high93.6Very high0 Ų045.8 Ų45.80%024%0.243CC..Hα-helixtrans-64.4-38.7174.600000111.6N240 A244 I288 P291 L297 G298N240-A294 HydrophobicContact CB-CB 3.85Å; N240-A294 WeakPolarHBondContact O-CB 3.3Å; A244-A294 WeakPolarHBondContact CA-O 3.32Å; A244-A294 WeakPolarHBondContact CB-O 3.34Å; I288-A294 HydrophobicContact CD1-CB 4.18Å; I288-A294 HydrophobicContact CG2-CB 4.24Å; P291-A294 WeakPolarHBondContact O-CB 3.1Å; P291-A294 PolarHBondContact O-N 3.49Å; P291-A294 VanDerWaalsContact O-N 3.12Å; A294-L297 PolarHBondContact O-N 3.44Å; A294-G298 PolarHBondContact O-N 3.43Å
295M97.8Very high93.6Very high82 Ų8245.8 Ų45.840%0.40424%0.243SC..Hα-helixtrans-61.2-47.2174.1-70177.874.500112.1V247 P291 W292 L293 L297 G298 L299V247-M295 WeakPolarHBondContact CG1-O 3.45Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.76Å; V247-M295 HydrophobicContact CG2-CG 3.79Å; P291-M295 WeakPolarHBondContact O-CG 3.36Å; P291-M295 PolarHBondContact O-N 3.49Å; W292-M295 WeakPolarHBondContact O-CB 3.32Å; W292-M295 PolarHBondContact O-N 3.41Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.46Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.31Å; M295-G298 PolarHBondContact O-N 3.14Å; M295-L299 PolarHBondContact O-N 3.39Å
296V96.9Very high93.6Very high73 Ų7346.2 Ų46.244%0.44225%0.246SC..Hα-helixtrans-60.9-43.6176.4169.70000110.8W292 L293 G298 L299 V300W292-V296 HydrophobicContact CE3-CG2 3.91Å; W292-V296 HydrophobicContact CZ3-CG2 4.14Å; W292-V296 WeakPolarHBondContact O-CG2 3.32Å; W292-V296 PolarHBondContact O-N 3.1Å; L293-V296 PolarHBondContact O-N 3.17Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 3.25Å; V296-L299 WeakPolarHBondContact O-CB 3.19Å; V296-L299 PolarHBondContact O-N 3.42Å; V296-V300 HydrophobicContact CG1-CG2 4.43Å; V296-V300 WeakPolarHBondContact O-CG2 3.44Å; V296-V300 PolarHBondContact O-N 3.15Å
297L95.9Very high93.5Very high15 Ų1545.9 Ų45.98%0.07925%0.253CS..Hα-helixtrans-63.2-39.5177.2-174.352.4000111.9A280 V281 I288 L293 A294 M295 L299 V300 A301 L338 T342A280-L297 HydrophobicContact CB-CD1 4.42Å; A280-L297 HydrophobicContact CB-CG 4.32Å; V281-L297 HydrophobicContact CG1-CB 4.46Å; V281-L297 HydrophobicContact CG1-CD2 3.8Å; V281-L297 HydrophobicContact CG1-CG 4.16Å; I288-L297 HydrophobicContact CD1-CD2 4.48Å; L293-L297 WeakPolarHBondContact O-CB 3.5Å; L293-L297 PolarHBondContact O-N 2.98Å; A294-L297 PolarHBondContact O-N 3.44Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.31Å; L297-L299 PolarHBondContact O-N 3.21Å; L297-V300 PolarHBondContact O-N 3.43Å; L297-A301 WeakPolarHBondContact O-CB 3.42Å; L297-A301 PolarHBondContact O-N 2.98Å; L297-L338 HydrophobicContact CD1-CD1 4.46Å; L297-L338 HydrophobicContact CD1-CD2 3.93Å; L297-L338 HydrophobicContact CD1-CG 4Å; L297-T342 HydrophobicContact CD2-CG2 3.59Å
298G96.6Very high93.2Very high0 Ų043.9 Ų43.90%024%0.244CC..Hα-helixtrans-61.9-38.6172.800000113.8A244 S248 A294 M295 V296 G302A244-G298 WeakPolarHBondContact O-CA 3.26Å; S248-G298 PolarHBondContact OG-O 3.01Å; A294-G298 PolarHBondContact O-N 3.43Å; M295-G298 PolarHBondContact O-N 3.14Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 3.25Å; G298-G302 PolarHBondContact O-N 2.89Å
299L96.8Very high92.7Very high77 Ų7744.1 Ų44.140%0.40325%0.247SC..Hα-helixtrans-64.6-50.8174.5176.763.4000111.2V247 T251 M295 V296 L297 A301 G302 L303V247-L299 HydrophobicContact CG1-CB 3.71Å; T251-L299 HydrophobicContact CG2-CD1 3.87Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.31Å; M295-L299 PolarHBondContact O-N 3.39Å; V296-L299 WeakPolarHBondContact O-CB 3.19Å; V296-L299 PolarHBondContact O-N 3.42Å; L297-L299 PolarHBondContact O-N 3.21Å; L299-A301 PolarHBondContact O-N 2.82Å; L299-G302 PolarHBondContact O-N 2.89Å; L299-L303 HydrophobicContact CD1-CD1 4.4Å; L299-L303 HydrophobicContact CG-CD1 4.4Å; L299-L303 WeakPolarHBondContact O-CG 3.44Å; L299-L303 PolarHBondContact O-N 3.14Å
300V95.8Very high92.3Very high58 Ų5844.8 Ų44.835%0.35224%0.24SC..Hα-helixtrans-61.2-45.9179.7172.30000110.6V296 L297 G302 L303 I304 L338V296-V300 HydrophobicContact CG1-CG2 4.43Å; V296-V300 WeakPolarHBondContact O-CG2 3.44Å; V296-V300 PolarHBondContact O-N 3.15Å; L297-V300 PolarHBondContact O-N 3.43Å; V300-G302 PolarHBondContact O-N 3.17Å; V300-L303 PolarHBondContact O-N 3.31Å; V300-I304 HydrophobicContact CG1-CD1 3.64Å; V300-I304 HydrophobicContact CG1-CG1 4.39Å; V300-I304 WeakPolarHBondContact O-CB 3.41Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.34Å; V300-I304 PolarHBondContact O-N 3.02Å; V300-L338 HydrophobicContact CG1-CD2 4.39Å
301A95.3Very high91.6Very high0 Ų046.9 Ų46.90%025%0.253CS..Hα-helixtrans-58.7-44.7175.700000112.4A276 A280 L297 L299 I304 S305 L335 L338A276-A301 HydrophobicContact CB-CB 4.03Å; A280-A301 HydrophobicContact CB-CB 3.61Å; L297-A301 WeakPolarHBondContact O-CB 3.42Å; L297-A301 PolarHBondContact O-N 2.98Å; L299-A301 PolarHBondContact O-N 2.82Å; A301-I304 PolarHBondContact O-N 2.95Å; A301-S305 WeakPolarHBondContact O-CB 3.35Å; A301-S305 PolarHBondContact O-N 3.26Å; A301-L335 HydrophobicContact CB-CD2 3.74Å; A301-L338 HydrophobicContact CB-CD2 4.23Å
302G94.2Very high90.5Very high0 Ų045.7 Ų45.70%024%0.243CC..Hα-helixtrans-60.8-44.6176.500000112.6G298 L299 V300 S305 I306G298-G302 PolarHBondContact O-N 2.89Å; L299-G302 PolarHBondContact O-N 2.89Å; V300-G302 PolarHBondContact O-N 3.17Å; G302-S305 PolarHBondContact O-N 3.01Å; G302-I306 VanDerWaalsContact O-CG1 3.3Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 2.89Å
303L92.9Very high89.1Confident94 Ų9440.1 Ų40.149%0.49223%0.228SC..Hα-helixtrans-65.8-42.5177.2-68.6175000112.4T251 L299 V300 S305 I306 G307T251-L303 HydrophobicContact CG2-CD2 3.82Å; T251-L303 HydrophobicContact CG2-CG 3.81Å; L299-L303 HydrophobicContact CD1-CD1 4.4Å; L299-L303 HydrophobicContact CG-CD1 4.4Å; L299-L303 WeakPolarHBondContact O-CG 3.44Å; L299-L303 PolarHBondContact O-N 3.14Å; V300-L303 PolarHBondContact O-N 3.31Å; L303-S305 VanDerWaalsContact C-N 3.3Å; L303-S305 PolarHBondContact O-N 3.49Å; L303-I306 PolarHBondContact O-N 3.29Å; L303-G307 PolarHBondContact O-N 3.14Å
304I92.6Very high87.8Confident63 Ų6342.1 Ų42.132%0.32324%0.242SC..Hα-helixtrans-61-41.7175.2-71.1166.9000110.3V300 A301 G307 G308 L338V300-I304 HydrophobicContact CG1-CD1 3.64Å; V300-I304 HydrophobicContact CG1-CG1 4.39Å; V300-I304 WeakPolarHBondContact O-CB 3.41Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.34Å; V300-I304 PolarHBondContact O-N 3.02Å; A301-I304 PolarHBondContact O-N 2.95Å; I304-G307 PolarHBondContact O-N 2.9Å; I304-G308 WeakPolarHBondContact O-CA 3.32Å; I304-G308 PolarHBondContact O-N 3.41Å; I304-L338 HydrophobicContact CD1-CD1 4.49Å; I304-L338 HydrophobicContact CD1-CD2 3.82Å
305S91.1Very high86.1Confident0 Ų045.6 Ų45.60%027%0.266CS..Hα-helixtrans-63-44.2177.3179.80000112.4S272 A273 A301 G302 L303 G308 A309 I331S272-S305 PolarHBondContact O-OG 3.38Å; A273-S305 VanDerWaalsContact CA-OG 3.31Å; A273-S305 WeakPolarHBondContact CA-OG 3.24Å; A273-S305 PolarHBondContact N-OG 3.31Å; A301-S305 WeakPolarHBondContact O-CB 3.35Å; A301-S305 PolarHBondContact O-N 3.26Å; G302-S305 PolarHBondContact O-N 3.01Å; L303-S305 VanDerWaalsContact C-N 3.3Å; L303-S305 PolarHBondContact O-N 3.49Å; S305-G308 PolarHBondContact O-N 3.26Å; S305-A309 WeakPolarHBondContact O-CB 3.42Å; S305-A309 PolarHBondContact O-N 3.47Å; S305-I331 WeakPolarHBondContact O-CD1 3.28Å; S305-I331 WeakPolarHBondContact OG-CG2 3.37Å
306I89.1Confident84.2Confident11 Ų1142.6 Ų42.66%0.05625%0.253CS..Hα-helixtrans-65.7-46.2177-63.7165000111.3T251 A259 A273 G302 L303 G308 A309 K310T251-I306 HydrophobicContact CG2-CD1 4.48Å; T251-I306 WeakPolarHBondContact O-CD1 3.48Å; A259-I306 HydrophobicContact CB-CG2 3.85Å; A273-I306 HydrophobicContact CB-CD1 4.4Å; A273-I306 HydrophobicContact CB-CG1 3.83Å; G302-I306 VanDerWaalsContact O-CG1 3.3Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 2.89Å; L303-I306 PolarHBondContact O-N 3.29Å; I306-G308 VanDerWaalsContact C-N 3.32Å; I306-G308 PolarHBondContact O-N 2.86Å; I306-A309 PolarHBondContact O-N 2.93Å; I306-K310 PolarHBondContact O-N 3.24Å
307G86.6Confident82.5Confident34 Ų3442 Ų4235%0.35125%0.247SC..Hα-helixtrans-60.8-42.6175.800000111.8L303 I304 K310 C311L303-G307 PolarHBondContact O-N 3.14Å; I304-G307 PolarHBondContact O-N 2.9Å; G307-K310 PolarHBondContact O-N 3.43Å; G307-C311 WeakPolarHBondContact O-CB 3.44Å; G307-C311 PolarHBondContact O-N 2.86Å; G307-C311 PolarHBondContact O-SG 3.23Å
308G83.6Confident80.5Confident8 Ų851.9 Ų51.98%0.08228%0.283CS..Hα-helixtrans-60-49.1174.800000111.9I304 S305 I306 K310 C311 L312I304-G308 WeakPolarHBondContact O-CA 3.32Å; I304-G308 PolarHBondContact O-N 3.41Å; S305-G308 PolarHBondContact O-N 3.26Å; I306-G308 VanDerWaalsContact C-N 3.32Å; I306-G308 PolarHBondContact O-N 2.86Å; G308-K310 PolarHBondContact O-N 3.49Å; G308-K310 VanDerWaalsContact O-N 3.17Å; G308-C311 PolarHBondContact O-N 3.33Å; G308-L312 WeakPolarHBondContact O-CB 2.91Å; G308-L312 WeakPolarHBondContact O-CD1 3.18Å; G308-L312 WeakPolarHBondContact O-CG 3.38Å; G308-L312 PolarHBondContact O-N 3.43Å
309A79.8Confident78.4Confident10 Ų1057.7 Ų57.78%0.08332%0.318CS..Hα-helixtrans-60.1-29.3179.100000113.1Y269 S305 I306 P313 V327 I331Y269-A309 HydrophobicContact CD1-CB 3.59Å; Y269-A309 HydrophobicContact CE1-CB 3.82Å; S305-A309 WeakPolarHBondContact O-CB 3.42Å; S305-A309 PolarHBondContact O-N 3.47Å; I306-A309 PolarHBondContact O-N 2.93Å; A309-P313 WeakPolarHBondContact O-CD 3.29Å; A309-P313 WeakPolarHBondContact O-CG 3.16Å; A309-V327 HydrophobicContact CB-CG1 4.3Å; A309-I331 HydrophobicContact CB-CD1 3.85Å
310K79.9Confident76.1Confident115 Ų11558.7 Ų58.750%0.532%0.324SS..Hα-helixtrans-83.6-45.6176.7-172.1174.2179.8173.80112.9I306 G307 G308I306-K310 PolarHBondContact O-N 3.24Å; G307-K310 PolarHBondContact O-N 3.43Å; G308-K310 PolarHBondContact O-N 3.49Å; G308-K310 VanDerWaalsContact O-N 3.17Å
311C76.8Confident73.8Confident70 Ų7057 Ų5747%0.47332%0.318SS..Hα-helixtrans-93.1-38.2-169.5-63.40000113.6G307 G308 V314 C315G307-C311 WeakPolarHBondContact O-CB 3.44Å; G307-C311 PolarHBondContact O-N 2.86Å; G307-C311 PolarHBondContact O-SG 3.23Å; G308-C311 PolarHBondContact O-N 3.33Å; C311-V314 PolarHBondContact O-N 3.37Å; C311-V314 VanDerWaalsContact O-N 3.13Å; C311-C315 PolarHBondContact O-N 2.99Å; C311-C315 PolarHBondContact O-SG 3.07Å
312L72.1Confident71.7Confident38 Ų3858 Ų5820%0.19932%0.323CS..Hα-helixtrans-58.4-42.9-176.2-75.7156.7000113.3G308 V314 C315 C316 I331 L334G308-L312 WeakPolarHBondContact O-CB 2.91Å; G308-L312 WeakPolarHBondContact O-CD1 3.18Å; G308-L312 WeakPolarHBondContact O-CG 3.38Å; G308-L312 PolarHBondContact O-N 3.43Å; L312-V314 VanDerWaalsContact C-N 3.26Å; L312-V314 PolarHBondContact O-N 2.95Å; L312-C315 PolarHBondContact O-N 3.4Å; L312-C316 WeakPolarHBondContact O-CB 3.34Å; L312-C316 PolarHBondContact O-N 3.17Å; L312-C316 PolarHBondContact O-SG 2.85Å; L312-C316 VanDerWaalsContact O-SG 3.37Å; L312-I331 HydrophobicContact CD1-CG1 3.98Å; L312-L334 HydrophobicContact CD1-CD1 3.87Å
313P66.6Low69.5Low42 Ų4263 Ų6327%0.27335%0.346SS..Hα-helixtrans-60.2-38.3177.8-22.733.3000112.1A309 N317 V327A309-P313 WeakPolarHBondContact O-CD 3.29Å; A309-P313 WeakPolarHBondContact O-CG 3.16Å; P313-N317 WeakPolarHBondContact O-CB 3.34Å; P313-N317 PolarHBondContact O-N 3.07Å; P313-N317 PolarHBondContact O-ND2 3.2Å; P313-N317 PolarHBondContact O-OD1 2.95Å; P313-V327 HydrophobicContact CG-CG1 4.29Å; P313-V327 HydrophobicContact CG-CG2 3.83Å
314V66.4Low67.6Low95 Ų9561.6 Ų61.658%0.57634%0.337SS*.Hα-helixtrans-73.1-46.5-179.4-175.90000110.8C311 L312 R318C311-V314 PolarHBondContact O-N 3.37Å; C311-V314 VanDerWaalsContact O-N 3.13Å; L312-V314 VanDerWaalsContact C-N 3.26Å; L312-V314 PolarHBondContact O-N 2.95Å; V314-R318 WeakPolarHBondContact O-CB 3.25Å; V314-R318 PolarHBondContact O-N 3.25Å
315C61.7Low65.8Low73 Ų7359.5 Ų59.549%0.49333%0.326SS..Hα-helixtrans-69.8-46.8-179-66.60000112.6C311 L312 N317 R318 V319C311-C315 PolarHBondContact O-N 2.99Å; C311-C315 PolarHBondContact O-SG 3.07Å; L312-C315 PolarHBondContact O-N 3.4Å; C315-N317 VanDerWaalsContact C-N 3.34Å; C315-N317 PolarHBondContact O-N 3.39Å; C315-R318 PolarHBondContact O-N 3.43Å; C315-V319 WeakPolarHBondContact O-CB 3.35Å; C315-V319 WeakPolarHBondContact O-CG2 3.36Å; C315-V319 PolarHBondContact O-N 3.42Å
316C58.7Low64.5Low19 Ų1961.4 Ų61.413%0.12834%0.339CS..Iπ-helixtrans-66.4-35.7-180-69.20000112L312 L320 G321L312-C316 WeakPolarHBondContact O-CB 3.34Å; L312-C316 PolarHBondContact O-N 3.17Å; L312-C316 PolarHBondContact O-SG 2.85Å; L312-C316 VanDerWaalsContact O-SG 3.37Å; C316-L320 WeakPolarHBondContact O-CB 3.42Å; C316-L320 PolarHBondContact O-N 3.35Å; C316-L320 VanDerWaalsContact O-N 3.12Å; C316-G321 PolarHBondContact O-N 2.97Å; C316-G321 VanDerWaalsContact O-N 3.15Å
317N59.9Low63.1Low60 Ų6063 Ų6332%0.32135%0.35SS..Iπ-helixtrans-68-39.5176.7-74.3-2.5000112.1P313 C315 I322 H323P313-N317 WeakPolarHBondContact O-CB 3.34Å; P313-N317 PolarHBondContact O-N 3.07Å; P313-N317 PolarHBondContact O-ND2 3.2Å; P313-N317 PolarHBondContact O-OD1 2.95Å; C315-N317 VanDerWaalsContact C-N 3.34Å; C315-N317 PolarHBondContact O-N 3.39Å; N317-I322 PolarHBondContact OD1-O 2.92Å; N317-H323 VanDerWaalsContact OD1-CA 3.3Å; N317-H323 WeakPolarHBondContact OD1-CA 3.3Å
318R54.3Low62Low223 Ų22362.9 Ų62.984%0.84234%0.34SS*.Iπ-helixtrans-81.1-36.8-175.8-160.8179-131-174.82.7113.5V314 C315V314-R318 WeakPolarHBondContact O-CB 3.25Å; V314-R318 PolarHBondContact O-N 3.25Å; C315-R318 PolarHBondContact O-N 3.43Å
319V52Low61.4Low121 Ų12163 Ų6373%0.73334%0.339SS*.Iπ-helixtrans-101.5-44.2-171.4-177.60000112.5C315C315-V319 WeakPolarHBondContact O-CB 3.35Å; C315-V319 WeakPolarHBondContact O-CG2 3.36Å; C315-V319 PolarHBondContact O-N 3.42Å
320L48.4Very low60.9Low99 Ų9963.2 Ų63.252%0.51834%0.339SS..Iπ-helixtrans-95.3-12.5-175.2-66.5165.8000112.6C316 I322C316-L320 WeakPolarHBondContact O-CB 3.42Å; C316-L320 PolarHBondContact O-N 3.35Å; C316-L320 VanDerWaalsContact O-N 3.12Å; L320-I322 HydrophobicContact CB-CD1 3.86Å; L320-I322 HydrophobicContact CB-CG1 3.85Å; L320-I322 HydrophobicContact CD1-CD1 4.46Å; L320-I322 WeakPolarHBondContact O-CG1 3.15Å; L320-I322 PolarHBondContact O-N 2.98Å
321G47.6Very low60.7Low22 Ų2257.8 Ų57.823%0.22732%0.316CS..  trans61.823-177.600000113.1K189 C316K189-G321 WeakPolarHBondContact CE-O 3.46Å; K189-G321 PolarHBondContact NZ-O 3.31Å; C316-G321 PolarHBondContact O-N 2.97Å; C316-G321 VanDerWaalsContact O-N 3.15Å
322I52.2Low60.8Low21 Ų2155.1 Ų55.111%0.10830%0.296CS..  trans-100.689.9-178.8-47.5171.6000108.3W185 N317 L320 H324 I325W185-I322 HydrophobicContact CG-CD1 4.18Å; N317-I322 PolarHBondContact OD1-O 2.92Å; L320-I322 HydrophobicContact CB-CD1 3.86Å; L320-I322 HydrophobicContact CB-CG1 3.85Å; L320-I322 HydrophobicContact CD1-CD1 4.46Å; L320-I322 WeakPolarHBondContact O-CG1 3.15Å; L320-I322 PolarHBondContact O-N 2.98Å; I322-H324 PolarHBondContact O-N 2.95Å; I322-I325 HydrophobicContact CB-CD1 3.77Å; I322-I325 HydrophobicContact CB-CG1 4.39Å; I322-I325 HydrophobicContact CD1-CD1 3.73Å; I322-I325 HydrophobicContact CG1-CD1 4.34Å; I322-I325 HydrophobicContact CG2-CD1 3.34Å; I322-I325 HydrophobicContact CG2-CG1 3.45Å; I322-I325 VanDerWaalsContact CG2-CG1 3.45Å
323H47.8Very low61.3Low106 Ų10653.7 Ų53.749%0.49129%0.289SS..THydrogen-bonded Turntrans-68.1-16.3-169.4-9045000115.3N317N317-H323 VanDerWaalsContact OD1-CA 3.3Å; N317-H323 WeakPolarHBondContact OD1-CA 3.3Å
324H53.1Low62.2Low64 Ų6455.1 Ų55.130%0.29629%0.294SS..THydrogen-bonded Turntrans-154.156.9-169.5-61-71.9000113.2K133 P190 I322K133-H324 PolarHBondContact NZ-O 2.9Å; P190-H324 WeakPolarHBondContact CG-CD2 3.39Å; I322-H324 PolarHBondContact O-N 2.95Å
325I54.3Low63.3Low19 Ų1950.6 Ų50.610%0.09727%0.267CS..  trans-75.5142.2155.6-66.3146.5000106.9L181 I322 V327 H329 S330L181-I325 HydrophobicContact CD1-CB 4.42Å; L181-I325 HydrophobicContact CD1-CD1 3.3Å; L181-I325 HydrophobicContact CD1-CG1 3.7Å; L181-I325 HydrophobicContact CD1-CG2 3.85Å; I322-I325 HydrophobicContact CB-CD1 3.77Å; I322-I325 HydrophobicContact CB-CG1 4.39Å; I322-I325 HydrophobicContact CD1-CD1 3.73Å; I322-I325 HydrophobicContact CG1-CD1 4.34Å; I322-I325 HydrophobicContact CG2-CD1 3.34Å; I322-I325 HydrophobicContact CG2-CG1 3.45Å; I322-I325 VanDerWaalsContact CG2-CG1 3.45Å; I325-V327 PolarHBondContact O-N 3.05Å; I325-H329 HydrophobicContact CG2-CB 4.36Å; I325-S330 VanDerWaalsContact CG2-OG 3.29Å; I325-S330 WeakPolarHBondContact CG2-OG 3.42Å
326S63.3Low64.6Low39 Ų3947.2 Ų47.227%0.27324%0.244SC..  trans-56.1113.2168.8176.80000108G128 M328 H329 S330G128-S326 WeakPolarHBondContact O-CB 3.26Å; S326-M328 PolarHBondContact O-N 2.73Å; S326-H329 WeakPolarHBondContact O-CA 3.26Å; S326-H329 VanDerWaalsContact O-CB 3.28Å; S326-H329 WeakPolarHBondContact O-CB 3.44Å; S326-H329 PolarHBondContact O-N 2.86Å; S326-S330 PolarHBondContact O-N 3.48Å
327V60.1Low66.1Low46 Ų4648.2 Ų48.228%0.27925%0.248SC..Hα-helixtrans-50.9-35-179.3175.10000110.7A309 P313 I325 S330 I331A309-V327 HydrophobicContact CB-CG1 4.3Å; P313-V327 HydrophobicContact CG-CG1 4.29Å; P313-V327 HydrophobicContact CG-CG2 3.83Å; I325-V327 PolarHBondContact O-N 3.05Å; V327-S330 PolarHBondContact O-N 3.26Å; V327-I331 HydrophobicContact CG1-CD1 3.94Å; V327-I331 WeakPolarHBondContact O-CD1 2.95Å; V327-I331 VanDerWaalsContact O-CG1 3.31Å; V327-I331 WeakPolarHBondContact O-CG1 3.17Å; V327-I331 PolarHBondContact O-N 2.93Å; V327-I331 VanDerWaalsContact O-N 3.13Å
328M63.3Low67.7Low31 Ų3147 Ų4715%0.15324%0.241CC..Hα-helixtrans-59-46173.3-170.6171.4-172.800112.5L65 L275 S326 S330 I331 F332L65-M328 HydrophobicContact CD1-CE 3.68Å; L65-M328 HydrophobicContact CD1-SD 4.15Å; L65-M328 HydrophobicContact CD2-CE 3.1Å; L65-M328 HydrophobicContact CD2-SD 3.78Å; L65-M328 HydrophobicContact CG-CE 3.61Å; L65-M328 HydrophobicContact CG-SD 3.84Å; L275-M328 HydrophobicContact CD1-CE 4.22Å; S326-M328 PolarHBondContact O-N 2.73Å; M328-S330 PolarHBondContact O-N 3.4Å; M328-I331 PolarHBondContact O-N 3.5Å; M328-F332 HydrophobicContact CE-CD2 4.3Å; M328-F332 HydrophobicContact CE-CE2 3.25Å; M328-F332 HydrophobicContact CE-CZ 3.42Å; M328-F332 VanDerWaalsContact CE-CZ 3.42Å; M328-F332 HydrophobicContact CG-CD2 3.93Å; M328-F332 HydrophobicContact CG-CE2 3.68Å; M328-F332 WeakPolarHBondContact O-CD2 3.48Å; M328-F332 PolarHBondContact O-N 3Å; M328-F332 HydrophobicContact SD-CE2 4.42Å
329H71Confident69.5Low11 Ų1136.3 Ų36.35%0.05120%0.201CC..Hα-helixtrans-62.6-42.2179.8-161.775.5000112.6M125 A129 A177 I325 S326 I331 F332 S333M125-H329 PolarHBondContact O-CE1 3.45Å; M125-H329 VanDerWaalsContact O-CE1 3.26Å; M125-H329 PolarHBondContact O-ND1 2.98Å; A129-H329 HydrophobicContact CB-CB 4.3Å; A177-H329 WeakPolarHBondContact CA-NE2 3.38Å; A177-H329 PolarHBondContact O-NE2 2.97Å; I325-H329 HydrophobicContact CG2-CB 4.36Å; S326-H329 WeakPolarHBondContact O-CA 3.26Å; S326-H329 VanDerWaalsContact O-CB 3.28Å; S326-H329 WeakPolarHBondContact O-CB 3.44Å; S326-H329 PolarHBondContact O-N 2.86Å; H329-I331 VanDerWaalsContact C-N 3.31Å; H329-I331 PolarHBondContact O-N 2.88Å; H329-F332 PolarHBondContact O-N 2.78Å; H329-S333 PolarHBondContact O-N 3.25Å
330S68.5Low71.3Confident14 Ų1430.6 Ų30.610%0.09817%0.166CC..Hα-helixtrans-64.7-35.9176-60.40000112.5I325 S326 V327 M328 S333 L334I325-S330 VanDerWaalsContact CG2-OG 3.29Å; I325-S330 WeakPolarHBondContact CG2-OG 3.42Å; S326-S330 PolarHBondContact O-N 3.48Å; V327-S330 PolarHBondContact O-N 3.26Å; M328-S330 PolarHBondContact O-N 3.4Å; S330-S333 WeakPolarHBondContact O-CB 3.18Å; S330-S333 PolarHBondContact O-N 3.08Å; S330-L334 PolarHBondContact O-N 2.87Å
331I77.3Confident73.4Confident1 Ų130.6 Ų30.61%0.00517%0.166CC..Hα-helixtrans-67.1-43.6175-71165.8000110.5S305 A309 L312 V327 M328 H329 S333 L334 L335S305-I331 WeakPolarHBondContact O-CD1 3.28Å; S305-I331 WeakPolarHBondContact OG-CG2 3.37Å; A309-I331 HydrophobicContact CB-CD1 3.85Å; L312-I331 HydrophobicContact CD1-CG1 3.98Å; V327-I331 HydrophobicContact CG1-CD1 3.94Å; V327-I331 WeakPolarHBondContact O-CD1 2.95Å; V327-I331 VanDerWaalsContact O-CG1 3.31Å; V327-I331 WeakPolarHBondContact O-CG1 3.17Å; V327-I331 PolarHBondContact O-N 2.93Å; V327-I331 VanDerWaalsContact O-N 3.13Å; M328-I331 PolarHBondContact O-N 3.5Å; H329-I331 VanDerWaalsContact C-N 3.31Å; H329-I331 PolarHBondContact O-N 2.88Å; I331-S333 PolarHBondContact O-N 3.49Å; I331-L334 PolarHBondContact O-N 3.38Å; I331-L334 VanDerWaalsContact O-N 3.12Å; I331-L335 HydrophobicContact CG2-CD1 3.69Å; I331-L335 HydrophobicContact CG2-CG 4.18Å; I331-L335 VanDerWaalsContact O-CG 3.25Å; I331-L335 WeakPolarHBondContact O-CG 3.46Å; I331-L335 PolarHBondContact O-N 3.29Å
332F79.1Confident75.5Confident14 Ų1430.9 Ų30.96%0.06116%0.163CC..Hα-helixtrans-59.7-35.9176.7-86.4-120.5000112.1M125 W220 L275 V279 M328 H329 L335 G336M125-F332 HydrophobicContact CE-CD1 3.57Å; M125-F332 HydrophobicContact CE-CE1 4.03Å; W220-F332 AromaticContact CH2-CE1 3.82Å; W220-F332 HydrophobicContact CH2-CE1 3.82Å; W220-F332 HydrophobicContact CH2-CZ 4.14Å; W220-F332 HydrophobicContact CZ2-CE1 4.48Å; L275-F332 HydrophobicContact CB-CZ 4.47Å; L275-F332 HydrophobicContact CD1-CZ 4.45Å; V279-F332 HydrophobicContact CG2-CD1 3.78Å; V279-F332 HydrophobicContact CG2-CE1 3.64Å; V279-F332 HydrophobicContact CG2-CG 4.44Å; V279-F332 HydrophobicContact CG2-CZ 4.16Å; M328-F332 HydrophobicContact CE-CD2 4.3Å; M328-F332 HydrophobicContact CE-CE2 3.25Å; M328-F332 HydrophobicContact CE-CZ 3.42Å; M328-F332 VanDerWaalsContact CE-CZ 3.42Å; M328-F332 HydrophobicContact CG-CD2 3.93Å; M328-F332 HydrophobicContact CG-CE2 3.68Å; M328-F332 WeakPolarHBondContact O-CD2 3.48Å; M328-F332 PolarHBondContact O-N 3Å; M328-F332 HydrophobicContact SD-CE2 4.42Å; H329-F332 PolarHBondContact O-N 2.78Å; F332-L335 PolarHBondContact O-N 3.44Å; F332-G336 PolarHBondContact O-N 3.24Å
333S81.2Confident77.4Confident8 Ų831.6 Ų31.66%0.05617%0.165CC..Hα-helixtrans-60.1-47.3172.7-165.50000112.8A177 Y178 H329 S330 I331 L335 G336 L337A177-S333 VanDerWaalsContact CB-CA 3.48Å; Y178-S333 WeakPolarHBondContact CE2-OG 3.31Å; H329-S333 PolarHBondContact O-N 3.25Å; S330-S333 WeakPolarHBondContact O-CB 3.18Å; S330-S333 PolarHBondContact O-N 3.08Å; I331-S333 PolarHBondContact O-N 3.49Å; S333-L335 VanDerWaalsContact C-N 3.33Å; S333-G336 PolarHBondContact O-N 3.19Å; S333-L337 PolarHBondContact O-N 3.49Å; S333-L337 VanDerWaalsContact O-N 3.14Å
334L86.3Confident79.4Confident72 Ų7227.7 Ų27.738%0.37715%0.147SC..Hα-helixtrans-65.4-39179.4-69.5173.5000111.7L312 S330 I331 L337 L338L312-L334 HydrophobicContact CD1-CD1 3.87Å; S330-L334 PolarHBondContact O-N 2.87Å; I331-L334 PolarHBondContact O-N 3.38Å; I331-L334 VanDerWaalsContact O-N 3.12Å; L334-L337 PolarHBondContact O-N 2.68Å; L334-L338 WeakPolarHBondContact O-CB 3.48Å; L334-L338 PolarHBondContact O-N 3.45Å
335L90.4Very high81.2Confident0 Ų029 Ų290%016%0.159CC..Hα-helixtrans-70.9-38179.1-64.9172.3000112.4A276 V279 A280 A301 I331 F332 S333 L338 G339A276-L335 HydrophobicContact CB-CD1 3.58Å; A276-L335 HydrophobicContact CB-CD2 4.04Å; A276-L335 HydrophobicContact CB-CG 4.47Å; V279-L335 HydrophobicContact CB-CB 4.01Å; V279-L335 HydrophobicContact CB-CD1 4.39Å; V279-L335 HydrophobicContact CG1-CB 3.72Å; A280-L335 HydrophobicContact CB-CD2 4.49Å; A301-L335 HydrophobicContact CB-CD2 3.74Å; I331-L335 HydrophobicContact CG2-CD1 3.69Å; I331-L335 HydrophobicContact CG2-CG 4.18Å; I331-L335 VanDerWaalsContact O-CG 3.25Å; I331-L335 WeakPolarHBondContact O-CG 3.46Å; I331-L335 PolarHBondContact O-N 3.29Å; F332-L335 PolarHBondContact O-N 3.44Å; S333-L335 VanDerWaalsContact C-N 3.33Å; L335-L338 WeakPolarHBondContact O-CB 3.3Å; L335-L338 PolarHBondContact O-N 2.99Å; L335-G339 PolarHBondContact O-N 3.49Å
336G88.4Confident82.8Confident1 Ų129 Ų291%0.0116%0.159CC..Hα-helixtrans-59.8-46172.800000111.5V174 F332 S333 L338 G339 E340V174-G336 VanDerWaalsContact CG2-C 3.46Å; F332-G336 PolarHBondContact O-N 3.24Å; S333-G336 PolarHBondContact O-N 3.19Å; G336-L338 PolarHBondContact O-N 3.26Å; G336-G339 PolarHBondContact O-N 3.06Å; G336-E340 PolarHBondContact O-N 3.06Å; G336-E340 VanDerWaalsContact O-N 3.11Å
337L90.8Very high84Confident40 Ų4028.3 Ų28.321%0.20915%0.153CC..Hα-helixtrans-61.5-42.7174.1-76.3-178000112.6V174 Y178 S333 L334 G339 E340 I341 I374V174-L337 HydrophobicContact CG1-CD2 4.32Å; V174-L337 HydrophobicContact CG2-CD2 4.3Å; Y178-L337 HydrophobicContact CE2-CD1 4.42Å; Y178-L337 HydrophobicContact CE2-CD2 4.22Å; Y178-L337 HydrophobicContact CE2-CG 4.22Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.45Å; S333-L337 PolarHBondContact O-N 3.49Å; S333-L337 VanDerWaalsContact O-N 3.14Å; L334-L337 PolarHBondContact O-N 2.68Å; L337-G339 PolarHBondContact O-N 2.8Å; L337-E340 PolarHBondContact O-N 3.33Å; L337-I341 VanDerWaalsContact O-CG1 3.31Å; L337-I341 WeakPolarHBondContact O-CG1 3.39Å; L337-I341 PolarHBondContact O-N 2.87Å; L337-I374 HydrophobicContact CD2-CD1 4.41Å
338L93.1Very high85.3Confident34 Ų3428.4 Ų28.418%0.17815%0.153CC..Hα-helixtrans-57.6-39.8176.1-179.865.3000111.2A280 L297 V300 A301 I304 L334 L335 G336 T342A280-L338 HydrophobicContact CB-CD2 4.07Å; L297-L338 HydrophobicContact CD1-CD1 4.46Å; L297-L338 HydrophobicContact CD1-CD2 3.93Å; L297-L338 HydrophobicContact CD1-CG 4Å; V300-L338 HydrophobicContact CG1-CD2 4.39Å; A301-L338 HydrophobicContact CB-CD2 4.23Å; I304-L338 HydrophobicContact CD1-CD1 4.49Å; I304-L338 HydrophobicContact CD1-CD2 3.82Å; L334-L338 WeakPolarHBondContact O-CB 3.48Å; L334-L338 PolarHBondContact O-N 3.45Å; L335-L338 WeakPolarHBondContact O-CB 3.3Å; L335-L338 PolarHBondContact O-N 2.99Å; G336-L338 PolarHBondContact O-N 3.26Å; L338-T342 WeakPolarHBondContact O-CB 3.18Å; L338-T342 PolarHBondContact O-N 3.16Å; L338-T342 PolarHBondContact O-OG1 2.96Å
339G91.3Very high86.4Confident0 Ų032.1 Ų32.10%017%0.173CC..Hα-helixtrans-64.2-45.6175.700000113.3A280 T283 L335 G336 L337 I341 T342 Y343A280-G339 WeakPolarHBondContact O-CA 3.5Å; T283-G339 PolarHBondContact OG1-O 2.91Å; L335-G339 PolarHBondContact O-N 3.49Å; G336-G339 PolarHBondContact O-N 3.06Å; L337-G339 PolarHBondContact O-N 2.8Å; G339-I341 PolarHBondContact O-N 2.97Å; G339-T342 WeakPolarHBondContact O-CB 3.34Å; G339-T342 PolarHBondContact O-N 3.32Å; G339-Y343 PolarHBondContact O-N 3.04Å
340E90.8Very high87Confident0 Ų036.9 Ų36.90%020%0.195CC..Hα-helixtrans-61.6-42.9176.1-67.3-69.4178.200112.7R170 H171 V174 T283 G336 L337 T342 Y343 I344 L370R170-E340 IonicContact NH1-OE2 3.07Å; R170-E340 PolarHBondContact NH1-OE2 3.43Å; H171-E340 WeakPolarHBondContact CA-OE1 3.43Å; H171-E340 IonicContact CE1-OE1 3.11Å; H171-E340 IonicContact CE1-OE2 2.67Å; H171-E340 PolarHBondContact CE1-OE2 2.89Å; H171-E340 IonicContact CG-OE1 4Å; H171-E340 IonicContact ND1-OE1 3.97Å; H171-E340 PolarHBondContact ND1-OE1 3.41Å; H171-E340 IonicContact ND1-OE2 3.12Å; H171-E340 PolarHBondContact ND1-OE2 3.44Å; V174-E340 HydrophobicContact CG2-CG 3.81Å; T283-E340 HydrophobicContact CG2-CG 4.42Å; T283-E340 PolarHBondContact OG1-N 3.37Å; G336-E340 PolarHBondContact O-N 3.06Å; G336-E340 VanDerWaalsContact O-N 3.11Å; L337-E340 PolarHBondContact O-N 3.33Å; E340-T342 VanDerWaalsContact C-N 3.32Å; E340-T342 PolarHBondContact O-N 3.39Å; E340-Y343 WeakPolarHBondContact O-CB 3.37Å; E340-Y343 PolarHBondContact O-N 3.43Å; E340-I344 WeakPolarHBondContact O-CG1 3.24Å; E340-I344 PolarHBondContact O-N 3.14Å; E340-L370 HydrophobicContact CB-CD1 4.22Å; E340-L370 HydrophobicContact CB-CD2 4.06Å; E340-L370 HydrophobicContact CG-CD1 3.79Å
341I91.7Very high87.6Confident99 Ų9936.6 Ų36.651%0.50819%0.193SC..Hα-helixtrans-62-44.8175.6-66.5165.3000109.9L337 G339 Y343 I344 V345L337-I341 VanDerWaalsContact O-CG1 3.31Å; L337-I341 WeakPolarHBondContact O-CG1 3.39Å; L337-I341 PolarHBondContact O-N 2.87Å; G339-I341 PolarHBondContact O-N 2.97Å; I341-Y343 VanDerWaalsContact C-N 3.3Å; I341-Y343 PolarHBondContact O-N 3.11Å; I341-I344 PolarHBondContact O-N 3.42Å; I341-V345 HydrophobicContact CG2-CG2 4.49Å; I341-V345 WeakPolarHBondContact O-CG2 3.44Å; I341-V345 PolarHBondContact O-N 2.71Å
342T92Very high87.9Confident28 Ų2840.6 Ų40.617%0.17222%0.217CC..Hα-helixtrans-59.7-42.9176.4-55.40000111L297 L338 G339 E340 I344 V345 L346L297-T342 HydrophobicContact CD2-CG2 3.59Å; L338-T342 WeakPolarHBondContact O-CB 3.18Å; L338-T342 PolarHBondContact O-N 3.16Å; L338-T342 PolarHBondContact O-OG1 2.96Å; G339-T342 WeakPolarHBondContact O-CB 3.34Å; G339-T342 PolarHBondContact O-N 3.32Å; E340-T342 VanDerWaalsContact C-N 3.32Å; E340-T342 PolarHBondContact O-N 3.39Å; T342-I344 PolarHBondContact O-N 2.63Å; T342-V345 PolarHBondContact O-N 3.29Å; T342-L346 HydrophobicContact CG2-CD1 3.93Å; T342-L346 HydrophobicContact CG2-CG 4.34Å; T342-L346 WeakPolarHBondContact O-CB 3.29Å; T342-L346 WeakPolarHBondContact O-CG 3.36Å; T342-L346 PolarHBondContact O-N 2.89Å
343Y90.9Very high87.9Confident36 Ų3650.4 Ų50.414%0.14125%0.254CS..Hα-helixtrans-58.5-48.4176.7175.1-90.6000111.5T283 H286 L287 G339 E340 I341 V345 L346 L347T283-Y343 WeakPolarHBondContact O-CD2 3.29Å; H286-Y343 AromaticContact CE1-CE2 3.96Å; L287-Y343 HydrophobicContact CD1-CD2 3.55Å; L287-Y343 HydrophobicContact CD1-CE2 3.33Å; L287-Y343 HydrophobicContact CD1-CG 4.48Å; L287-Y343 HydrophobicContact CG-CD2 4.47Å; L287-Y343 HydrophobicContact CG-CE2 4.26Å; G339-Y343 PolarHBondContact O-N 3.04Å; E340-Y343 WeakPolarHBondContact O-CB 3.37Å; E340-Y343 PolarHBondContact O-N 3.43Å; I341-Y343 VanDerWaalsContact C-N 3.3Å; I341-Y343 PolarHBondContact O-N 3.11Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 3.18Å; Y343-L346 PolarHBondContact O-N 2.81Å; Y343-L347 HydrophobicContact CE1-CD2 4.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.3Å; Y343-L347 PolarHBondContact O-N 3.46Å
344I89.9Confident87.9Confident25 Ų2554.8 Ų54.813%0.12828%0.276CS..Hα-helixtrans-61-43.8178.3-65.6166.4000110.8E340 I341 T342 L347 V348 V363 I367E340-I344 WeakPolarHBondContact O-CG1 3.24Å; E340-I344 PolarHBondContact O-N 3.14Å; I341-I344 PolarHBondContact O-N 3.42Å; T342-I344 PolarHBondContact O-N 2.63Å; I344-L347 WeakPolarHBondContact O-CB 3.26Å; I344-L347 PolarHBondContact O-N 3.33Å; I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.35Å; I344-V363 HydrophobicContact CG2-CG1 4.21Å; I344-I367 HydrophobicContact CD1-CG1 3.9Å
345V90.9Very high87.4Confident90 Ų9054.6 Ų54.655%0.54529%0.292SS..Hα-helixtrans-62.4-44.9178.2171.50000111.6I341 T342 Y343 L347 V348 L349I341-V345 HydrophobicContact CG2-CG2 4.49Å; I341-V345 WeakPolarHBondContact O-CG2 3.44Å; I341-V345 PolarHBondContact O-N 2.71Å; T342-V345 PolarHBondContact O-N 3.29Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 3.18Å; V345-L347 VanDerWaalsContact C-N 3.35Å; V345-V348 PolarHBondContact O-N 3.27Å; V345-L349 PolarHBondContact O-N 2.94Å
346L89.4Confident86.6Confident20 Ų2058 Ų5811%0.10531%0.311CS..Hα-helixtrans-67.2-36.8177.8-71.3172.1000112.2L287 I288 T342 Y343 L349 H350L287-L346 HydrophobicContact CB-CB 4.31Å; L287-L346 HydrophobicContact CB-CD1 4.23Å; I288-L346 HydrophobicContact CG1-CD1 3.53Å; T342-L346 HydrophobicContact CG2-CD1 3.93Å; T342-L346 HydrophobicContact CG2-CG 4.34Å; T342-L346 WeakPolarHBondContact O-CB 3.29Å; T342-L346 WeakPolarHBondContact O-CG 3.36Å; T342-L346 PolarHBondContact O-N 2.89Å; Y343-L346 PolarHBondContact O-N 2.81Å; L346-L349 PolarHBondContact O-N 3.38Å; L346-H350 WeakPolarHBondContact O-CB 3.33Å; L346-H350 PolarHBondContact O-N 3.41Å
347L87.6Confident85.7Confident25 Ų2561.9 Ų61.913%0.13135%0.35CS..Hα-helixtrans-60.6-46.6173.9-176.570.1000110.8Y343 I344 V345 H350 T351 Q362 S366Y343-L347 HydrophobicContact CE1-CD2 4.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.3Å; Y343-L347 PolarHBondContact O-N 3.46Å; I344-L347 WeakPolarHBondContact O-CB 3.26Å; I344-L347 PolarHBondContact O-N 3.33Å; V345-L347 VanDerWaalsContact C-N 3.35Å; L347-H350 PolarHBondContact O-N 3.13Å; L347-T351 HydrophobicContact CD1-CG2 4.44Å; L347-T351 WeakPolarHBondContact O-CB 3.43Å; L347-T351 WeakPolarHBondContact O-CG2 3.12Å; L347-T351 PolarHBondContact O-N 3.1Å; L347-T351 PolarHBondContact O-OG1 3.34Å; L347-Q362 HydrophobicContact CD2-CB 4.28Å; L347-S366 VanDerWaalsContact CD2-OG 3.24Å; L347-S366 WeakPolarHBondContact CD2-OG 3.43Å
348V87.4Confident85Confident48 Ų4864.8 Ų64.829%0.29136%0.364SS..Hα-helixtrans-60.1-47.1175172.40000110.9I344 V345 H350 T351 V352 I359 V363I344-V348 WeakPolarHBondContact O-CG2 3.42Å; I344-V348 PolarHBondContact O-N 3.35Å; V345-V348 PolarHBondContact O-N 3.27Å; V348-H350 PolarHBondContact O-N 3Å; V348-T351 WeakPolarHBondContact CA-OG1 3.35Å; V348-T351 PolarHBondContact O-N 3.43Å; V348-T351 PolarHBondContact O-OG1 2.74Å; V348-V352 HydrophobicContact CG1-CG2 4.23Å; V348-V352 WeakPolarHBondContact O-CB 3.49Å; V348-V352 VanDerWaalsContact O-CG2 3.22Å; V348-V352 WeakPolarHBondContact O-CG2 3.27Å; V348-V352 PolarHBondContact O-N 3.07Å; V348-I359 HydrophobicContact CG1-CG2 4.16Å; V348-I359 HydrophobicContact CG2-CG2 4.24Å; V348-V363 HydrophobicContact CG2-CG2 3.28Å
349L86.2Confident84.4Confident108 Ų10865.4 Ų65.457%0.56537%0.367SS*.Hα-helixtrans-61.2-44.8-179.1-173.666.8000112V345 L346 T351 W353V345-L349 PolarHBondContact O-N 2.94Å; L346-L349 PolarHBondContact O-N 3.38Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 2.96Å; L349-W353 WeakPolarHBondContact O-CB 3.22Å; L349-W353 PolarHBondContact O-N 2.7Å
350H83.4Confident83.8Confident111 Ų11168 Ų6851%0.51439%0.394SS..Hα-helixtrans-66.5-36.3-179.9-173.2-89.4000112.3L346 L347 V348 N354L346-H350 WeakPolarHBondContact O-CB 3.33Å; L346-H350 PolarHBondContact O-N 3.41Å; L347-H350 PolarHBondContact O-N 3.13Å; V348-H350 PolarHBondContact O-N 3Å; H350-N354 PolarHBondContact CE1-ND2 3.02Å; H350-N354 PolarHBondContact ND1-ND2 2.79Å; H350-N354 VanDerWaalsContact O-CG 3.32Å; H350-N354 PolarHBondContact O-N 3.13Å; H350-N354 VanDerWaalsContact O-N 3.15Å
351T81.7Confident83.4Confident8 Ų873.2 Ų73.25%0.04942%0.416CS..Hα-helixtrans-75.5-37.9-17951.10000112.2L347 V348 L349 N354 G355 N356L347-T351 HydrophobicContact CD1-CG2 4.44Å; L347-T351 WeakPolarHBondContact O-CB 3.43Å; L347-T351 WeakPolarHBondContact O-CG2 3.12Å; L347-T351 PolarHBondContact O-N 3.1Å; L347-T351 PolarHBondContact O-OG1 3.34Å; V348-T351 WeakPolarHBondContact CA-OG1 3.35Å; V348-T351 PolarHBondContact O-N 3.43Å; V348-T351 PolarHBondContact O-OG1 2.74Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 2.96Å; T351-N354 PolarHBondContact O-N 3.28Å; T351-G355 PolarHBondContact O-N 2.94Å; T351-N356 PolarHBondContact O-N 3.07Å; T351-N356 VanDerWaalsContact O-N 3.17Å
352V82.9Confident82.9Confident85 Ų8571.1 Ų71.152%0.51541%0.405SS..Hα-helixtrans-61-47.3169.6171.50000110.8V348 N354 G355 I359V348-V352 HydrophobicContact CG1-CG2 4.23Å; V348-V352 WeakPolarHBondContact O-CB 3.49Å; V348-V352 VanDerWaalsContact O-CG2 3.22Å; V348-V352 WeakPolarHBondContact O-CG2 3.27Å; V348-V352 PolarHBondContact O-N 3.07Å; V352-N354 VanDerWaalsContact C-N 3.27Å; V352-N354 PolarHBondContact O-N 3.23Å; V352-G355 PolarHBondContact O-N 3.34Å; V352-I359 HydrophobicContact CB-CD1 4.43Å; V352-I359 HydrophobicContact CG2-CD1 3.5Å; V352-I359 HydrophobicContact CG2-CG1 4.37Å
353W80.5Confident82.7Confident221 Ų22171.3 Ų71.384%0.83741%0.406SS*.Hα-helixtrans-60.8-36.7-179.4-172.4-93.7000112.8L349 G355L349-W353 WeakPolarHBondContact O-CB 3.22Å; L349-W353 PolarHBondContact O-N 2.7Å; W353-G355 PolarHBondContact O-N 3.45Å
354N80.8Confident82.5Confident99 Ų9975.1 Ų75.153%0.52943%0.428SS..THydrogen-bonded Turntrans-823.5178.9-69-4.7000113.8H350 T351 V352 N356H350-N354 PolarHBondContact CE1-ND2 3.02Å; H350-N354 PolarHBondContact ND1-ND2 2.79Å; H350-N354 VanDerWaalsContact O-CG 3.32Å; H350-N354 PolarHBondContact O-N 3.13Å; H350-N354 VanDerWaalsContact O-N 3.15Å; T351-N354 PolarHBondContact O-N 3.28Å; V352-N354 VanDerWaalsContact C-N 3.27Å; V352-N354 PolarHBondContact O-N 3.23Å; N354-N356 PolarHBondContact O-N 3.44Å
355G75.1Confident82.2Confident69 Ų6976.3 Ų76.371%0.71143%0.434SS*.THydrogen-bonded Turntrans65.822.6178.700000114.4T351 V352 W353T351-G355 PolarHBondContact O-N 2.94Å; V352-G355 PolarHBondContact O-N 3.34Å; W353-G355 PolarHBondContact O-N 3.45Å
356N74.1Confident82Confident72 Ų7272.4 Ų72.439%0.38541%0.411SS..  trans-84.9124.5-176.5-167.312.3000111T351 N354 M358 I359T351-N356 PolarHBondContact O-N 3.07Å; T351-N356 VanDerWaalsContact O-N 3.17Å; N354-N356 PolarHBondContact O-N 3.44Å; N356-M358 PolarHBondContact O-N 3.29Å; N356-I359 WeakPolarHBondContact O-CG1 3.42Å
357G68.7Low82Confident81 Ų8175 Ų7584%0.83542%0.424SS*.THydrogen-bonded Turntrans-73.4-5.3-178.100000115.5I359G357-I359 VanDerWaalsContact C-N 3.34Å; G357-I359 PolarHBondContact O-N 3.04Å
358M76.7Confident82.1Confident101 Ų10175.2 Ų75.250%0.49843%0.432SS..THydrogen-bonded Turntrans-90.216.8-174-107.2166.467.100115.2N356 G360 F361 Q362N356-M358 PolarHBondContact O-N 3.29Å; M358-G360 VanDerWaalsContact C-N 3.33Å; M358-G360 PolarHBondContact O-N 3.49Å; M358-F361 HydrophobicContact CE-CD1 3.91Å; M358-F361 HydrophobicContact CE-CE1 4.41Å; M358-F361 HydrophobicContact CG-CB 4.43Å; M358-F361 PolarHBondContact O-N 3.27Å; M358-F361 VanDerWaalsContact O-N 3.14Å; M358-Q362 PolarHBondContact O-N 3.34Å; M358-Q362 VanDerWaalsContact O-N 3.14Å
359I81.1Confident82.1Confident47 Ų4773.8 Ų73.824%0.24142%0.422CS..Hα-helixtrans-52.8-49.4-176.4-59.3158000111.3V348 V352 N356 G357 F361 Q362 V363V348-I359 HydrophobicContact CG1-CG2 4.16Å; V348-I359 HydrophobicContact CG2-CG2 4.24Å; V352-I359 HydrophobicContact CB-CD1 4.43Å; V352-I359 HydrophobicContact CG2-CD1 3.5Å; V352-I359 HydrophobicContact CG2-CG1 4.37Å; N356-I359 WeakPolarHBondContact O-CG1 3.42Å; G357-I359 VanDerWaalsContact C-N 3.34Å; G357-I359 PolarHBondContact O-N 3.04Å; I359-F361 VanDerWaalsContact C-N 3.29Å; I359-F361 PolarHBondContact O-N 3Å; I359-Q362 PolarHBondContact O-N 3.44Å; I359-V363 HydrophobicContact CG2-CG2 4.29Å; I359-V363 WeakPolarHBondContact O-CG2 3.38Å; I359-V363 PolarHBondContact O-N 2.91Å
360G79Confident82.3Confident55 Ų5569.7 Ų69.757%0.56740%0.401SS*.Hα-helixtrans-59.9-39.2-177.300000112.8M358 L364M358-G360 VanDerWaalsContact C-N 3.33Å; M358-G360 PolarHBondContact O-N 3.49Å; G360-L364 WeakPolarHBondContact O-CB 3.49Å; G360-L364 PolarHBondContact O-N 2.88Å
361F82Confident82.7Confident109 Ų10967.1 Ų67.148%0.47840%0.395SS..Hα-helixtrans-67.9-46.3178.2-176.4-107.6000111.6M358 I359 V363 L364 L365M358-F361 HydrophobicContact CE-CD1 3.91Å; M358-F361 HydrophobicContact CE-CE1 4.41Å; M358-F361 HydrophobicContact CG-CB 4.43Å; M358-F361 PolarHBondContact O-N 3.27Å; M358-F361 VanDerWaalsContact O-N 3.14Å; I359-F361 VanDerWaalsContact C-N 3.29Å; I359-F361 PolarHBondContact O-N 3Å; F361-V363 PolarHBondContact O-N 3.33Å; F361-L364 WeakPolarHBondContact O-CB 3.07Å; F361-L364 PolarHBondContact O-N 3.46Å; F361-L365 HydrophobicContact CD1-CD1 4Å; F361-L365 HydrophobicContact CD1-CG 4.36Å; F361-L365 HydrophobicContact CE1-CD1 3.5Å; F361-L365 VanDerWaalsContact CE1-CD1 3.5Å; F361-L365 HydrophobicContact CE1-CD2 4.37Å; F361-L365 HydrophobicContact CE1-CG 4.09Å; F361-L365 HydrophobicContact CE2-CD2 4.13Å; F361-L365 HydrophobicContact CE2-CG 4.48Å; F361-L365 HydrophobicContact CZ-CD1 3.88Å; F361-L365 HydrophobicContact CZ-CD2 3.93Å; F361-L365 HydrophobicContact CZ-CG 4.14Å; F361-L365 WeakPolarHBondContact O-CG 3.34Å; F361-L365 PolarHBondContact O-N 3.17Å
362Q81.4Confident83.2Confident56 Ų5668.9 Ų68.926%0.26240%0.404SS..Hα-helixtrans-65.6-36.8-179.6-71.5179.1-43.700113.2L347 M358 I359 S366L347-Q362 HydrophobicContact CD2-CB 4.28Å; M358-Q362 PolarHBondContact O-N 3.34Å; M358-Q362 VanDerWaalsContact O-N 3.14Å; I359-Q362 PolarHBondContact O-N 3.44Å; Q362-S366 WeakPolarHBondContact O-CB 3.47Å; Q362-S366 PolarHBondContact O-N 3.41Å; Q362-S366 PolarHBondContact O-OG 3.21Å
363V85.9Confident83.6Confident31 Ų3164.8 Ų64.819%0.18838%0.38CS..Hα-helixtrans-64.6-45172.9172.90000110.5I344 V348 I359 F361 L365 S366 I367I344-V363 HydrophobicContact CG2-CG1 4.21Å; V348-V363 HydrophobicContact CG2-CG2 3.28Å; I359-V363 HydrophobicContact CG2-CG2 4.29Å; I359-V363 WeakPolarHBondContact O-CG2 3.38Å; I359-V363 PolarHBondContact O-N 2.91Å; F361-V363 PolarHBondContact O-N 3.33Å; V363-L365 VanDerWaalsContact C-N 3.35Å; V363-L365 PolarHBondContact O-N 3.41Å; V363-S366 PolarHBondContact O-N 3.44Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.32Å; V363-I367 WeakPolarHBondContact O-CG1 3.1Å; V363-I367 PolarHBondContact O-N 2.96Å
364L86.8Confident84.2Confident116 Ų11656.1 Ų56.161%0.60735%0.349SS*.Hα-helixtrans-60.3-43.6178.5-173.667.4000111.8G360 F361 G368G360-L364 WeakPolarHBondContact O-CB 3.49Å; G360-L364 PolarHBondContact O-N 2.88Å; F361-L364 WeakPolarHBondContact O-CB 3.07Å; F361-L364 PolarHBondContact O-N 3.46Å; L364-G368 PolarHBondContact O-N 2.92Å
365L85Confident84.9Confident50 Ų5055.2 Ų55.226%0.26235%0.347SS..Hα-helixtrans-62.4-46.1175.1-61.7-176.8000111.4F161 F361 V363 I367 G368 E369F161-L365 HydrophobicContact CD1-CB 4.03Å; F161-L365 HydrophobicContact CD1-CD1 4.34Å; F161-L365 HydrophobicContact CD1-CD2 3.68Å; F161-L365 HydrophobicContact CD1-CG 4.2Å; F161-L365 HydrophobicContact CE1-CB 3.97Å; F161-L365 HydrophobicContact CE1-CD2 3.54Å; F161-L365 HydrophobicContact CE1-CG 4.26Å; F361-L365 HydrophobicContact CD1-CD1 4Å; F361-L365 HydrophobicContact CD1-CG 4.36Å; F361-L365 HydrophobicContact CE1-CD1 3.5Å; F361-L365 VanDerWaalsContact CE1-CD1 3.5Å; F361-L365 HydrophobicContact CE1-CD2 4.37Å; F361-L365 HydrophobicContact CE1-CG 4.09Å; F361-L365 HydrophobicContact CE2-CD2 4.13Å; F361-L365 HydrophobicContact CE2-CG 4.48Å; F361-L365 HydrophobicContact CZ-CD1 3.88Å; F361-L365 HydrophobicContact CZ-CD2 3.93Å; F361-L365 HydrophobicContact CZ-CG 4.14Å; F361-L365 WeakPolarHBondContact O-CG 3.34Å; F361-L365 PolarHBondContact O-N 3.17Å; V363-L365 VanDerWaalsContact C-N 3.35Å; V363-L365 PolarHBondContact O-N 3.41Å; L365-I367 VanDerWaalsContact C-N 3.34Å; L365-I367 PolarHBondContact O-N 3.3Å; L365-G368 WeakPolarHBondContact O-CA 3.36Å; L365-G368 PolarHBondContact O-N 3.48Å; L365-G368 VanDerWaalsContact O-N 3.1Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 2.95Å
366S86.3Confident85.8Confident8 Ų853.4 Ų53.46%0.05632%0.321CS..Hα-helixtrans-61.5-41.4-179.2-62.10000112.7L347 Q362 V363 L370L347-S366 VanDerWaalsContact CD2-OG 3.24Å; L347-S366 WeakPolarHBondContact CD2-OG 3.43Å; Q362-S366 WeakPolarHBondContact O-CB 3.47Å; Q362-S366 PolarHBondContact O-N 3.41Å; Q362-S366 PolarHBondContact O-OG 3.21Å; V363-S366 PolarHBondContact O-N 3.44Å; S366-L370 PolarHBondContact O-N 2.97Å
367I88.9Confident86.8Confident75 Ų7550 Ų5039%0.38530%0.302SS..Hα-helixtrans-69.1-39.2174.8-66.8170.9000110.5I344 V363 L365 L370 S371I344-I367 HydrophobicContact CD1-CG1 3.9Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.32Å; V363-I367 WeakPolarHBondContact O-CG1 3.1Å; V363-I367 PolarHBondContact O-N 2.96Å; L365-I367 VanDerWaalsContact C-N 3.34Å; L365-I367 PolarHBondContact O-N 3.3Å; I367-L370 PolarHBondContact O-N 3.23Å; I367-S371 WeakPolarHBondContact O-CB 3.38Å; I367-S371 PolarHBondContact O-N 2.9Å; I367-S371 PolarHBondContact O-OG 3.42Å
368G89.2Confident88.1Confident29 Ų2949.5 Ų49.530%0.29928%0.28SS..Hα-helixtrans-59.3-46.9175.700000112.6L364 L365 S371 L372L364-G368 PolarHBondContact O-N 2.92Å; L365-G368 WeakPolarHBondContact O-CA 3.36Å; L365-G368 PolarHBondContact O-N 3.48Å; L365-G368 VanDerWaalsContact O-N 3.1Å; G368-S371 PolarHBondContact O-N 3.34Å; G368-L372 WeakPolarHBondContact O-CB 3.22Å; G368-L372 PolarHBondContact O-N 3.5Å
369E88.6Confident89Confident18 Ų1848.6 Ų48.68%0.08428%0.281CS..Hα-helixtrans-63-44.8176.5-69.5178.7-146.100112I157 F161 R170 H171 L365 S371 L372 A373I157-E369 HydrophobicContact CD1-CB 4.47Å; I157-E369 HydrophobicContact CG2-CG 4.14Å; F161-E369 HydrophobicContact CD1-CG 4.15Å; F161-E369 HydrophobicContact CD2-CG 3.69Å; F161-E369 HydrophobicContact CE1-CG 4.03Å; F161-E369 HydrophobicContact CE2-CG 3.55Å; F161-E369 HydrophobicContact CG-CG 4Å; F161-E369 HydrophobicContact CZ-CG 3.74Å; R170-E369 IonicContact CZ-OE2 2.71Å; R170-E369 IonicContact NE-OE2 3.41Å; R170-E369 VanDerWaalsContact NH2-CD 3.3Å; R170-E369 IonicContact NH2-OE1 3.31Å; R170-E369 IonicContact NH2-OE2 3.67Å; R170-E369 PolarHBondContact NH2-OE2 3.5Å; H171-E369 VanDerWaalsContact NE2-CB 3.34Å; H171-E369 WeakPolarHBondContact NE2-CB 3.41Å; H171-E369 IonicContact NE2-OE2 3.44Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 2.95Å; E369-S371 PolarHBondContact O-N 3.34Å; E369-L372 PolarHBondContact O-N 3.47Å; E369-A373 WeakPolarHBondContact O-CB 3.37Å; E369-A373 PolarHBondContact O-N 3.37Å
370L90.2Very high89.7Confident22 Ų2247 Ų4712%0.11527%0.273CS..Hα-helixtrans-60.5-45.1175177.161.2000111.8V174 E340 S366 I367 L372 A373 I374V174-L370 HydrophobicContact CG1-CD1 4.04Å; V174-L370 HydrophobicContact CG2-CD1 4.44Å; E340-L370 HydrophobicContact CB-CD1 4.22Å; E340-L370 HydrophobicContact CB-CD2 4.06Å; E340-L370 HydrophobicContact CG-CD1 3.79Å; S366-L370 PolarHBondContact O-N 2.97Å; I367-L370 PolarHBondContact O-N 3.23Å; L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.37Å; L370-A373 PolarHBondContact O-N 2.97Å; L370-I374 HydrophobicContact CD1-CD1 4.09Å; L370-I374 HydrophobicContact CD1-CG1 4.41Å; L370-I374 HydrophobicContact CG-CD1 4.09Å; L370-I374 WeakPolarHBondContact O-CG1 3.47Å; L370-I374 PolarHBondContact O-N 3.2Å
371S91.8Very high90.5Very high57 Ų5744.3 Ų44.340%0.39925%0.246SC..Hα-helixtrans-62.8-43.8179.6-56.20000110.8I367 G368 E369 A373 I374 V375I367-S371 WeakPolarHBondContact O-CB 3.38Å; I367-S371 PolarHBondContact O-N 2.9Å; I367-S371 PolarHBondContact O-OG 3.42Å; G368-S371 PolarHBondContact O-N 3.34Å; E369-S371 PolarHBondContact O-N 3.34Å; S371-A373 PolarHBondContact O-N 3.44Å; S371-I374 PolarHBondContact O-N 2.77Å; S371-V375 VanDerWaalsContact O-CG2 3.31Å; S371-V375 WeakPolarHBondContact O-CG2 3.48Å; S371-V375 PolarHBondContact O-N 3.45Å
372L92.1Very high91.1Very high45 Ų4543.1 Ų43.124%0.23625%0.245CC..Hα-helixtrans-60.9-44.9175.5-178.366.3000111.3L153 V156 I157 G368 E369 L370 I374 V375 I376L153-L372 HydrophobicContact CD1-CD2 4.25Å; L153-L372 HydrophobicContact CD1-CG 4.06Å; V156-L372 HydrophobicContact CG1-CD2 3.76Å; I157-L372 HydrophobicContact CG1-CD2 3.99Å; G368-L372 WeakPolarHBondContact O-CB 3.22Å; G368-L372 PolarHBondContact O-N 3.5Å; E369-L372 PolarHBondContact O-N 3.47Å; L370-L372 VanDerWaalsContact C-N 3.34Å; L370-L372 PolarHBondContact O-N 3.37Å; L372-I374 VanDerWaalsContact C-N 3.34Å; L372-I374 PolarHBondContact O-N 3.19Å; L372-V375 PolarHBondContact O-N 3.48Å; L372-I376 HydrophobicContact CD1-CD1 4.04Å; L372-I376 HydrophobicContact CD1-CG1 4.2Å; L372-I376 HydrophobicContact CG-CD1 4.14Å; L372-I376 HydrophobicContact CG-CG1 4.48Å; L372-I376 WeakPolarHBondContact O-CG1 3.39Å; L372-I376 PolarHBondContact O-N 3.37Å
373A92.3Very high91.8Very high0 Ų045.7 Ų45.70%026%0.259CS..Hα-helixtrans-59.1-44.3177.800000112.1L153 H171 E369 L370 S371 A377L153-A373 HydrophobicContact CD1-CB 4.13Å; L153-A373 HydrophobicContact CD2-CB 3.82Å; H171-A373 HydrophobicContact CB-CB 3.64Å; E369-A373 WeakPolarHBondContact O-CB 3.37Å; E369-A373 PolarHBondContact O-N 3.37Å; L370-A373 PolarHBondContact O-N 2.97Å; S371-A373 PolarHBondContact O-N 3.44Å; A373-A377 VanDerWaalsContact O-CB 3.24Å; A373-A377 WeakPolarHBondContact O-CB 3.45Å; A373-A377 PolarHBondContact O-N 3.49Å
374I93.1Very high92.2Very high38 Ų3844.2 Ų44.220%0.19525%0.251CS..Hα-helixtrans-64.5-45.4176.4-66.8167.6000110.7V174 Y178 L337 L370 S371 L372 I376 A377 L378V174-I374 HydrophobicContact CG1-CD1 4.28Å; V174-I374 HydrophobicContact CG1-CG1 3.73Å; Y178-I374 HydrophobicContact CD2-CG1 4.41Å; L337-I374 HydrophobicContact CD2-CD1 4.41Å; L370-I374 HydrophobicContact CD1-CD1 4.09Å; L370-I374 HydrophobicContact CD1-CG1 4.41Å; L370-I374 HydrophobicContact CG-CD1 4.09Å; L370-I374 WeakPolarHBondContact O-CG1 3.47Å; L370-I374 PolarHBondContact O-N 3.2Å; S371-I374 PolarHBondContact O-N 2.77Å; L372-I374 VanDerWaalsContact C-N 3.34Å; L372-I374 PolarHBondContact O-N 3.19Å; I374-I376 PolarHBondContact O-N 3.05Å; I374-A377 PolarHBondContact O-N 2.96Å; I374-L378 HydrophobicContact CG2-CD1 3.79Å; I374-L378 HydrophobicContact CG2-CG 4.17Å; I374-L378 WeakPolarHBondContact O-CB 3.15Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.35Å; I374-L378 PolarHBondContact O-N 2.77Å
375V95.3Very high92.4Very high81 Ų8138.7 Ų38.749%0.49122%0.222SC..Hα-helixtrans-61.3-46.5179.5169.60000111.3S371 L372 L378 T379S371-V375 VanDerWaalsContact O-CG2 3.31Å; S371-V375 WeakPolarHBondContact O-CG2 3.48Å; S371-V375 PolarHBondContact O-N 3.45Å; L372-V375 PolarHBondContact O-N 3.48Å; V375-L378 PolarHBondContact O-N 2.88Å; V375-T379 HydrophobicContact CG1-CG2 4.34Å; V375-T379 WeakPolarHBondContact O-CB 3.31Å; V375-T379 VanDerWaalsContact O-CG2 3.29Å; V375-T379 WeakPolarHBondContact O-CG2 3.37Å; V375-T379 PolarHBondContact O-N 3.1Å; V375-T379 PolarHBondContact O-OG1 2.99Å
376I94.3Very high92.8Very high30 Ų3041.1 Ų41.115%0.15423%0.234CC..Hα-helixtrans-65.1-41.6177.5-62.4-173.5000110.4A149 L153 F175 L372 I374 L378 T379 S380A149-I376 HydrophobicContact CB-CG2 4.41Å; L153-I376 HydrophobicContact CB-CD1 4.18Å; L153-I376 HydrophobicContact CD1-CD1 3.8Å; L153-I376 HydrophobicContact CD1-CG1 4.49Å; F175-I376 HydrophobicContact CE2-CB 4.48Å; F175-I376 HydrophobicContact CE2-CG2 4.03Å; L372-I376 HydrophobicContact CD1-CD1 4.04Å; L372-I376 HydrophobicContact CD1-CG1 4.2Å; L372-I376 HydrophobicContact CG-CD1 4.14Å; L372-I376 HydrophobicContact CG-CG1 4.48Å; L372-I376 WeakPolarHBondContact O-CG1 3.39Å; L372-I376 PolarHBondContact O-N 3.37Å; I374-I376 PolarHBondContact O-N 3.05Å; I376-L378 PolarHBondContact O-N 3.25Å; I376-T379 WeakPolarHBondContact CA-OG1 3.07Å; I376-T379 PolarHBondContact O-N 3.39Å; I376-T379 PolarHBondContact O-OG1 3.07Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.36Å; I376-S380 PolarHBondContact O-N 2.94Å; I376-S380 PolarHBondContact O-OG 2.96Å
377A94.4Very high93.1Very high0 Ų043.7 Ų43.70%025%0.247CC..Hα-helixtrans-60.3-45.9177.100000112.6F175 F179 A373 I374 G381F175-A377 HydrophobicContact CD2-CB 3.63Å; F175-A377 HydrophobicContact CE2-CB 3.95Å; F175-A377 HydrophobicContact CG-CB 4.21Å; F175-A377 WeakPolarHBondContact O-CB 3.44Å; F179-A377 HydrophobicContact CB-CB 4.35Å; A373-A377 VanDerWaalsContact O-CB 3.24Å; A373-A377 WeakPolarHBondContact O-CB 3.45Å; A373-A377 PolarHBondContact O-N 3.49Å; I374-A377 PolarHBondContact O-N 2.96Å; A377-G381 WeakPolarHBondContact O-CA 3.36Å; A377-G381 PolarHBondContact O-N 2.91Å
378L95Very high93.1Very high71 Ų7140.1 Ų40.137%0.37223%0.229SC..Hα-helixtrans-68-45.8179.2-67.9176.7000111.7Y178 T182 I374 V375 I376 L382Y178-L378 HydrophobicContact CD1-CD2 4.12Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.29Å; I374-L378 HydrophobicContact CG2-CD1 3.79Å; I374-L378 HydrophobicContact CG2-CG 4.17Å; I374-L378 WeakPolarHBondContact O-CB 3.15Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.35Å; I374-L378 PolarHBondContact O-N 2.77Å; V375-L378 PolarHBondContact O-N 2.88Å; I376-L378 PolarHBondContact O-N 3.25Å; L378-L382 VanDerWaalsContact O-CB 3.24Å; L378-L382 WeakPolarHBondContact O-CB 3.28Å; L378-L382 PolarHBondContact O-N 2.85Å
379T96.2Very high93Very high83 Ų8342.4 Ų42.451%0.50923%0.234SC..Hα-helixtrans-67.7-48.2-177.850.90000111.9V375 I376 L382 L383V375-T379 HydrophobicContact CG1-CG2 4.34Å; V375-T379 WeakPolarHBondContact O-CB 3.31Å; V375-T379 VanDerWaalsContact O-CG2 3.29Å; V375-T379 WeakPolarHBondContact O-CG2 3.37Å; V375-T379 PolarHBondContact O-N 3.1Å; V375-T379 PolarHBondContact O-OG1 2.99Å; I376-T379 WeakPolarHBondContact CA-OG1 3.07Å; I376-T379 PolarHBondContact O-N 3.39Å; I376-T379 PolarHBondContact O-OG1 3.07Å; T379-L382 PolarHBondContact O-N 2.64Å; T379-L383 WeakPolarHBondContact O-CB 3.28Å; T379-L383 PolarHBondContact O-N 3.28Å
380S96.4Very high92.8Very high12 Ų1245.5 Ų45.58%0.08425%0.251CS..Hα-helixtrans-68.3-35176.463.20000112.2F179 I376 L383 T384F179-S380 VanDerWaalsContact CD2-OG 3.31Å; F179-S380 WeakPolarHBondContact CD2-OG 3.46Å; F179-S380 VanDerWaalsContact CE2-C 3.48Å; F179-S380 WeakPolarHBondContact CE2-OG 3.33Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.36Å; I376-S380 PolarHBondContact O-N 2.94Å; I376-S380 PolarHBondContact O-OG 2.96Å; S380-L383 PolarHBondContact O-N 3.14Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.37Å; S380-T384 PolarHBondContact O-N 3.26Å; S380-T384 PolarHBondContact O-OG1 3.08Å
381G95.3Very high92.3Very high0 Ų054.1 Ų54.10%029%0.287CS..Hα-helixtrans-66.2-40174.500000112.5F179 V183 A377 T384 G385F179-G381 VanDerWaalsContact CD2-CA 3.5Å; V183-G381 WeakPolarHBondContact CG2-O 3.32Å; A377-G381 WeakPolarHBondContact O-CA 3.36Å; A377-G381 PolarHBondContact O-N 2.91Å; G381-T384 PolarHBondContact O-N 3.37Å; G381-G385 PolarHBondContact O-N 3.25Å
382L95.1Very high91.7Very high84 Ų8457.7 Ų57.744%0.4430%0.301SS..Hα-helixtrans-64.6-47.9174.5179.665.9000110.9T182 L378 T379 T384 G385 L386T182-L382 HydrophobicContact CG2-CB 3.94Å; L378-L382 VanDerWaalsContact O-CB 3.24Å; L378-L382 WeakPolarHBondContact O-CB 3.28Å; L378-L382 PolarHBondContact O-N 2.85Å; T379-L382 PolarHBondContact O-N 2.64Å; L382-T384 VanDerWaalsContact C-N 3.33Å; L382-T384 PolarHBondContact O-N 3Å; L382-G385 PolarHBondContact O-N 3.28Å; L382-L386 HydrophobicContact CD1-CD1 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.3Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.33Å; L382-L386 PolarHBondContact O-N 2.96Å
383L95.3Very high91Very high109 Ų10959 Ų5957%0.57130%0.302SS*.Hα-helixtrans-57.5-47.9176.5179.565.3000111T379 S380 L386 L387T379-L383 WeakPolarHBondContact O-CB 3.28Å; T379-L383 PolarHBondContact O-N 3.28Å; S380-L383 PolarHBondContact O-N 3.14Å; L383-L386 PolarHBondContact O-N 3.35Å; L383-L387 WeakPolarHBondContact O-CB 3.22Å; L383-L387 PolarHBondContact O-N 3.03Å
384T95.3Very high90.2Very high1 Ų166 Ų661%0.00633%0.333CS..Hα-helixtrans-61.4-48.9177.9-570000110.4M142 V145 F179 V183 S380 G381 L382 L386 L387 L388M142-T384 HydrophobicContact CB-CG2 4.38Å; M142-T384 HydrophobicContact CG-CG2 4.34Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.29Å; F179-T384 HydrophobicContact CZ-CG2 3.96Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.43Å; V183-T384 HydrophobicContact CG1-CG2 4.5Å; V183-T384 HydrophobicContact CG2-CG2 3.98Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.37Å; S380-T384 PolarHBondContact O-N 3.26Å; S380-T384 PolarHBondContact O-OG1 3.08Å; G381-T384 PolarHBondContact O-N 3.37Å; L382-T384 VanDerWaalsContact C-N 3.33Å; L382-T384 PolarHBondContact O-N 3Å; T384-L386 VanDerWaalsContact C-N 3.34Å; T384-L386 PolarHBondContact O-N 3.4Å; T384-L387 CarbonylContact O-C 3.57Å; T384-L387 PolarHBondContact O-N 3.47Å; T384-L387 VanDerWaalsContact O-N 3.08Å; T384-L388 HydrophobicContact CG2-CD1 4.11Å; T384-L388 HydrophobicContact CG2-CG 4.06Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.23Å; T384-L388 PolarHBondContact O-N 2.82Å
385G91.6Very high89.3Confident0 Ų066.6 Ų66.60%034%0.344CS..Hα-helixtrans-57-43.9178.700000113.2C186 G381 L382 N389C186-G385 VanDerWaalsContact CB-C 3.47Å; G381-G385 PolarHBondContact O-N 3.25Å; L382-G385 PolarHBondContact O-N 3.28Å; G385-N389 WeakPolarHBondContact O-CB 3.41Å; G385-N389 PolarHBondContact O-N 2.88Å; G385-N389 VanDerWaalsContact O-N 3.11Å
386L92.3Very high88.1Confident100 Ų10063.5 Ų63.552%0.52433%0.325SS..Hα-helixtrans-63.2-43.5174.3-69.7173.5000111.8L382 L383 T384 N389L382-L386 HydrophobicContact CD1-CD1 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.3Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.33Å; L382-L386 PolarHBondContact O-N 2.96Å; L383-L386 PolarHBondContact O-N 3.35Å; T384-L386 VanDerWaalsContact C-N 3.34Å; T384-L386 PolarHBondContact O-N 3.4Å; L386-N389 PolarHBondContact O-N 3.49Å
387L92.1Very high87.1Confident62 Ų6268.5 Ų68.533%0.32535%0.347SS..Hα-helixtrans-66.9-39.7-179.8-167.1125.7000112.1V141 L383 T384 N389 L390 W393V141-L387 HydrophobicContact CB-CD2 4.37Å; V141-L387 HydrophobicContact CG1-CD2 3.24Å; L383-L387 WeakPolarHBondContact O-CB 3.22Å; L383-L387 PolarHBondContact O-N 3.03Å; T384-L387 CarbonylContact O-C 3.57Å; T384-L387 PolarHBondContact O-N 3.47Å; T384-L387 VanDerWaalsContact O-N 3.08Å; L387-N389 VanDerWaalsContact C-N 3.26Å; L387-N389 PolarHBondContact O-N 2.84Å; L387-L390 HydrophobicContact CG-CD1 4.29Å; L387-L390 WeakPolarHBondContact O-CB 3.44Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.45Å; L387-L390 PolarHBondContact O-N 3.31Å; L387-W393 HydrophobicContact CD2-CZ2 4.11Å; L387-W393 PolarHBondContact O-NE1 3.31Å
388L89Confident85.9Confident1 Ų169.9 Ų69.91%0.00536%0.356CS..Hα-helixtrans-67.9-26.5175.1-63.5-167.6000112.3Q138 V141 M142 V183 L187 T384 L390Q138-L388 HydrophobicContact CB-CD1 4.38Å; Q138-L388 HydrophobicContact CB-CD2 3.82Å; Q138-L388 HydrophobicContact CG-CD2 4.13Å; Q138-L388 PolarHBondContact NE2-O 3.11Å; Q138-L388 VanDerWaalsContact O-CD2 3.27Å; Q138-L388 WeakPolarHBondContact O-CD2 3.43Å; V141-L388 HydrophobicContact CB-CD2 4.1Å; V141-L388 HydrophobicContact CG1-CD2 4.33Å; M142-L388 HydrophobicContact CB-CD1 4.4Å; V183-L388 HydrophobicContact CG1-CD1 3.78Å; L187-L388 HydrophobicContact CD2-CB 4.28Å; T384-L388 HydrophobicContact CG2-CD1 4.11Å; T384-L388 HydrophobicContact CG2-CG 4.06Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.23Å; T384-L388 PolarHBondContact O-N 2.82Å; L388-L390 PolarHBondContact O-N 3.41Å
389N86.9Confident84.4Confident77 Ų7769.8 Ų69.841%0.41237%0.365SS..THydrogen-bonded Turntrans-78.2-5.3178.1-159.818.8000113.5C186 P188 G385 L386 L387C186-N389 PolarHBondContact O-ND2 2.86Å; P188-N389 WeakPolarHBondContact CD-OD1 3.04Å; P188-N389 WeakPolarHBondContact CG-OD1 3.44Å; G385-N389 WeakPolarHBondContact O-CB 3.41Å; G385-N389 PolarHBondContact O-N 2.88Å; G385-N389 VanDerWaalsContact O-N 3.11Å; L386-N389 PolarHBondContact O-N 3.49Å; L387-N389 VanDerWaalsContact C-N 3.26Å; L387-N389 PolarHBondContact O-N 2.84Å
390L85.9Confident83Confident82 Ų8268.9 Ų68.943%0.42935%0.354SS..SBendtrans-64.5136.3175.8-62.6175.8000111.3L387 L388 I392 W393L387-L390 HydrophobicContact CG-CD1 4.29Å; L387-L390 WeakPolarHBondContact O-CB 3.44Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.45Å; L387-L390 PolarHBondContact O-N 3.31Å; L388-L390 PolarHBondContact O-N 3.41Å; L390-I392 HydrophobicContact CD1-CD1 4.49Å; L390-I392 PolarHBondContact O-N 2.98Å; L390-W393 PolarHBondContact O-N 3.43Å
391K78.6Confident82Confident204 Ų20469.6 Ų69.689%0.88736%0.355SS*.G310 helixtrans-63.4-14.4-178-67.7-176.2179.3177.50114.3W393 K394K391-W393 PolarHBondContact O-N 2.96Å; K391-K394 PolarHBondContact O-N 3.32Å
392I79.5Confident80.9Confident132 Ų13272.1 Ų72.168%0.67737%0.366SS*.G310 helixtrans-58.1-35.1-179.9-56.4168.9000110.9L390 K394L390-I392 HydrophobicContact CD1-CD1 4.49Å; L390-I392 PolarHBondContact O-N 2.98Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 3.22Å
393W77.4Confident80Confident71 Ų7169.6 Ų69.627%0.26935%0.353SS..G310 helixtrans-75.7-9.8-173.1-54.9115.5000114.6N135 A137 Q138 V141 L387 L390 K391 A395N135-W393 PolarHBondContact ND2-O 3.4Å; A137-W393 HydrophobicContact CB-CE3 4.06Å; A137-W393 HydrophobicContact CB-CZ3 4.47Å; Q138-W393 HydrophobicContact CG-CB 3.75Å; Q138-W393 HydrophobicContact CG-CG 3.96Å; V141-W393 HydrophobicContact CG2-CH2 3.57Å; V141-W393 HydrophobicContact CG2-CZ2 3.93Å; V141-W393 HydrophobicContact CG2-CZ3 4.03Å; L387-W393 HydrophobicContact CD2-CZ2 4.11Å; L387-W393 PolarHBondContact O-NE1 3.31Å; L390-W393 PolarHBondContact O-N 3.43Å; K391-W393 PolarHBondContact O-N 2.96Å; W393-A395 VanDerWaalsContact C-N 3.3Å; W393-A395 PolarHBondContact O-N 3.08Å
394K75.7Confident79.2Confident149 Ų14964.5 Ų64.565%0.64833%0.327SS*.  trans48.354-174.4-61.2179.1-179.6176.70111.2N135 K391 I392N135-K394 PolarHBondContact ND2-O 2.62Å; K391-K394 PolarHBondContact O-N 3.32Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 3.22Å
395A73.5Confident78.4Confident50 Ų5067.2 Ų67.241%0.41334%0.339SS..PPolyproline II helixtrans-51.6148.7177.100000111.1W393 H397W393-A395 VanDerWaalsContact C-N 3.3Å; W393-A395 PolarHBondContact O-N 3.08Å; A395-H397 PolarHBondContact O-N 3.29Å
396P70.6Confident77.5Confident15 Ų1569.6 Ų69.610%0.09735%0.354CS..PPolyproline II helixtrans-57140.7177.224.5-32.2000109.8K133 V398 Y401K133-P396 VanDerWaalsContact O-CG 3.27Å; K133-P396 WeakPolarHBondContact O-CG 3.28Å; P396-V398 PolarHBondContact O-N 2.93Å; P396-Y401 HydrophobicContact CG-CD1 4.28Å; P396-Y401 HydrophobicContact CG-CE1 4.17Å; P396-Y401 WeakPolarHBondContact O-CE1 3.38Å
397H72.6Confident76.7Confident135 Ų13568 Ų6863%0.62534%0.343SS*.PPolyproline II helixtrans-62.1139.3176.1-169.5-91.5000109.1A395 A399 K400A395-H397 PolarHBondContact O-N 3.29Å; H397-A399 WeakPolarHBondContact ND1-CB 3.29Å; H397-A399 PolarHBondContact ND1-N 3.15Å; H397-A399 PolarHBondContact O-N 3.12Å; H397-K400 WeakPolarHBondContact O-CA 3.38Å; H397-K400 PolarHBondContact O-N 3.49Å
398V69.9Low76.1Confident30 Ų3069.1 Ų69.118%0.18234%0.343CS..G310 helixtrans-50.5-34.8-175.7174.20000113.6P188 P190 L191 P396 K400 Y401P188-V398 HydrophobicContact CB-CG2 4.42Å; P190-V398 HydrophobicContact CB-CG1 4.09Å; L191-V398 HydrophobicContact CD1-CB 4.32Å; L191-V398 HydrophobicContact CD1-CG1 3.89Å; P396-V398 PolarHBondContact O-N 2.93Å; V398-K400 PolarHBondContact O-N 3.05Å; V398-Y401 HydrophobicContact CG1-CE2 4.31Å; V398-Y401 HydrophobicContact CG2-CE1 4.46Å; V398-Y401 HydrophobicContact CG2-CE2 4.42Å; V398-Y401 PolarHBondContact O-N 2.95Å
399A62.4Low75.5Confident68 Ų6878.7 Ų78.756%0.56238%0.384SS*.G310 helixtrans-67.1-13177.500000114.8H397H397-A399 WeakPolarHBondContact ND1-CB 3.29Å; H397-A399 PolarHBondContact ND1-N 3.15Å; H397-A399 PolarHBondContact O-N 3.12Å
400K68.1Low74.8Confident64 Ų6478.7 Ų78.728%0.27838%0.381SS..G310 helixtrans-11819.2-177.8-58.7-167177.2-168.90112.8H397 V398 D403 V406H397-K400 WeakPolarHBondContact O-CA 3.38Å; H397-K400 PolarHBondContact O-N 3.49Å; V398-K400 PolarHBondContact O-N 3.05Å; K400-D403 PolarHBondContact O-N 3.48Å; K400-V406 HydrophobicContact CB-CG2 3.77Å; K400-V406 HydrophobicContact CD-CG2 3.85Å; K400-V406 HydrophobicContact CG-CG2 4.46Å
401Y74.9Confident73.1Confident28 Ų2879.9 Ų79.911%0.1139%0.393CS..THydrogen-bonded Turntrans-60.7143.4171.7-73.3-4.7000110.4G132 K133 P188 P190 P396 V398 D403G132-Y401 CarbonylContact O-C 3.6Å; G132-Y401 WeakPolarHBondContact O-CA 3.35Å; K133-Y401 HydrophobicContact CB-CD1 4.5Å; K133-Y401 HydrophobicContact CB-CD2 4.31Å; K133-Y401 HydrophobicContact CB-CE1 4.28Å; K133-Y401 HydrophobicContact CB-CE2 4.1Å; K133-Y401 HydrophobicContact CD-CD2 4.44Å; K133-Y401 HydrophobicContact CD-CE2 4.21Å; K133-Y401 HydrophobicContact CG-CD2 3.8Å; K133-Y401 HydrophobicContact CG-CE2 3.88Å; K133-Y401 HydrophobicContact CG-CG 4.23Å; P188-Y401 PolarHBondContact O-OH 3.41Å; P190-Y401 HydrophobicContact CB-CD2 4.23Å; P190-Y401 HydrophobicContact CB-CE2 4.48Å; P396-Y401 HydrophobicContact CG-CD1 4.28Å; P396-Y401 HydrophobicContact CG-CE1 4.17Å; P396-Y401 WeakPolarHBondContact O-CE1 3.38Å; V398-Y401 HydrophobicContact CG1-CE2 4.31Å; V398-Y401 HydrophobicContact CG2-CE1 4.46Å; V398-Y401 HydrophobicContact CG2-CE2 4.42Å; V398-Y401 PolarHBondContact O-N 2.95Å; Y401-D403 VanDerWaalsContact C-N 3.29Å; Y401-D403 PolarHBondContact O-N 3.11Å
402F72.3Confident71.8Confident52 Ų5278.3 Ų78.323%0.22839%0.389CS..THydrogen-bonded Turntrans6229.2-178.4-47.7-83.2000114.7F69 R71 H72 L131 G132 K133F69-F402 HydrophobicContact CD1-CD1 4.15Å; F69-F402 AromaticContact CD2-CD1 3.82Å; F69-F402 HydrophobicContact CD2-CD1 3.82Å; F69-F402 HydrophobicContact CD2-CE1 4.18Å; F69-F402 HydrophobicContact CE1-CD1 4.2Å; F69-F402 HydrophobicContact CE1-CE1 4.22Å; F69-F402 AromaticContact CE2-CD1 3.86Å; F69-F402 HydrophobicContact CE2-CD1 3.86Å; F69-F402 AromaticContact CE2-CE1 3.73Å; F69-F402 HydrophobicContact CE2-CE1 3.73Å; F69-F402 AromaticContact CG-CD1 3.97Å; F69-F402 HydrophobicContact CG-CD1 3.97Å; F69-F402 HydrophobicContact CZ-CD1 4.05Å; F69-F402 AromaticContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CZ 4.45Å; R71-F402 CarbonylContact C-O 3.58Å; H72-F402 HydrophobicContact CB-CB 4.36Å; L131-F402 WeakPolarHBondContact O-CE1 3.23Å; G132-F402 PolarHBondContact O-N 2.9Å; K133-F402 HydrophobicContact CG-CZ 4.23Å
403D75.7Confident70.3Confident31 Ų3177.8 Ų77.817%0.16639%0.387CS..  trans-121.3110.1178.8-168.5-5.1000112.4R71 K400 Y401 Q405 V406R71-D403 CarbonylContact O-C 3.48Å; K400-D403 PolarHBondContact O-N 3.48Å; Y401-D403 VanDerWaalsContact C-N 3.29Å; Y401-D403 PolarHBondContact O-N 3.11Å; D403-Q405 PolarHBondContact O-N 3.12Å; D403-Q405 VanDerWaalsContact OD1-CB 3.29Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.46Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.46Å; D403-Q405 PolarHBondContact OD1-N 3.21Å; D403-V406 HydrophobicContact CB-CG2 4.49Å; D403-V406 WeakPolarHBondContact O-CB 3.37Å; D403-V406 WeakPolarHBondContact O-CG2 3.49Å; D403-V406 PolarHBondContact O-N 3.29Å
404D78.8Confident68.7Low3 Ų377.7 Ų77.72%0.01640%0.401CS..G310 helixtrans-62.5-23.2177.8-80.2-29.1000111.9R71 H72 S73 W74 S75 V406 F407 W408 F410R71-D404 WeakPolarHBondContact O-CA 3.4Å; R71-D404 WeakPolarHBondContact O-CB 3.41Å; R71-D404 PolarHBondContact O-N 3.36Å; H72-D404 VanDerWaalsContact CA-CG 3.42Å; H72-D404 WeakPolarHBondContact CA-OD1 3.37Å; H72-D404 VanDerWaalsContact CA-OD2 3.23Å; H72-D404 WeakPolarHBondContact CA-OD2 3.39Å; H72-D404 IonicContact CD2-OD1 2.62Å; S73-D404 PolarHBondContact N-OD2 3.33Å; S73-D404 VanDerWaalsContact N-OD2 3.13Å; W74-D404 WeakPolarHBondContact CB-OD2 3.32Å; W74-D404 PolarHBondContact N-OD2 3.01Å; S75-D404 WeakPolarHBondContact CB-OD1 3.17Å; S75-D404 PolarHBondContact N-OD1 3.07Å; S75-D404 PolarHBondContact OG-OD1 3.14Å; D404-V406 PolarHBondContact O-N 3.23Å; D404-F407 PolarHBondContact O-N 2.93Å; D404-W408 PolarHBondContact O-N 3.32Å; D404-F410 HydrophobicContact CB-CE2 3.74Å; D404-F410 HydrophobicContact CB-CZ 3.56Å
405Q77.8Confident67Low58 Ų5876.7 Ų76.727%0.27141%0.407SS..G310 helixtrans-61.9-15.9179.1-64.4-1743.400112.7Y5 D403 F407 F410Y5-Q405 PolarHBondContact OH-OE1 3.16Å; D403-Q405 PolarHBondContact O-N 3.12Å; D403-Q405 VanDerWaalsContact OD1-CB 3.29Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.46Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.46Å; D403-Q405 PolarHBondContact OD1-N 3.21Å; Q405-F407 VanDerWaalsContact C-N 3.32Å; Q405-F410 HydrophobicContact CG-CD2 3.86Å; Q405-F410 HydrophobicContact CG-CE2 4Å
406V72.8Confident65.4Low50 Ų5076.9 Ų76.930%0.30341%0.414SS..G310 helixtrans-68.6-32.8173.1-1790000111.7K400 D403 D404K400-V406 HydrophobicContact CB-CG2 3.77Å; K400-V406 HydrophobicContact CD-CG2 3.85Å; K400-V406 HydrophobicContact CG-CG2 4.46Å; D403-V406 HydrophobicContact CB-CG2 4.49Å; D403-V406 WeakPolarHBondContact O-CB 3.37Å; D403-V406 WeakPolarHBondContact O-CG2 3.49Å; D403-V406 PolarHBondContact O-N 3.29Å; D404-V406 PolarHBondContact O-N 3.23Å
407F75.5Confident63.6Low67 Ų6785.6 Ų85.629%0.29445%0.45SS..THydrogen-bonded Turntrans-116.8-30.2-170.6-54.7-65.9000113.7F79 N135 D404 Q405F79-F407 HydrophobicContact CE2-CD2 4.12Å; F79-F407 HydrophobicContact CE2-CE2 4.22Å; F79-F407 HydrophobicContact CZ-CB 4.22Å; F79-F407 HydrophobicContact CZ-CD1 4.36Å; F79-F407 AromaticContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CD2 3.96Å; F79-F407 HydrophobicContact CZ-CE2 4.43Å; F79-F407 AromaticContact CZ-CG 3.92Å; F79-F407 HydrophobicContact CZ-CG 3.92Å; N135-F407 HydrophobicContact CB-CE1 3.74Å; N135-F407 HydrophobicContact CB-CZ 3.81Å; D404-F407 PolarHBondContact O-N 2.93Å; Q405-F407 VanDerWaalsContact C-N 3.32Å
408W79.4Confident63.1Low85 Ų8583.1 Ų83.132%0.32244%0.442SS..SBendtrans-108.9145.3-170.8-61.490.2000112.2W74 S75 A78 F79 D404 F410W74-W408 HydrophobicContact CB-CD2 4.1Å; W74-W408 HydrophobicContact CB-CG 4.2Å; W74-W408 HydrophobicContact CE3-CE3 4.13Å; W74-W408 HydrophobicContact CE3-CZ3 4.33Å; S75-W408 PolarHBondContact OG-NE1 3.42Å; A78-W408 HydrophobicContact CB-CH2 3.52Å; A78-W408 HydrophobicContact CB-CZ2 3.41Å; A78-W408 VanDerWaalsContact CB-CZ2 3.41Å; F79-W408 HydrophobicContact CE1-CZ2 4.44Å; D404-W408 PolarHBondContact O-N 3.32Å; W408-F410 HydrophobicContact CB-CD2 4.35Å; W408-F410 HydrophobicContact CB-CE2 3.7Å; W408-F410 HydrophobicContact CB-CZ 4.03Å
409K77.4Confident62.8Low201 Ų20185.9 Ų85.987%0.87446%0.455SS*.  trans-86113.7171.7-174.2-175.6178.5-170.80108.6
410F71.8Confident62.8Low78 Ų7886.9 Ų86.934%0.34245%0.449SS..  trans-94.6129.6172.3-68.8-84.5000110.5D404 Q405 W408 H412D404-F410 HydrophobicContact CB-CE2 3.74Å; D404-F410 HydrophobicContact CB-CZ 3.56Å; Q405-F410 HydrophobicContact CG-CD2 3.86Å; Q405-F410 HydrophobicContact CG-CE2 4Å; W408-F410 HydrophobicContact CB-CD2 4.35Å; W408-F410 HydrophobicContact CB-CE2 3.7Å; W408-F410 HydrophobicContact CB-CZ 4.03Å; F410-H412 PolarHBondContact O-N 2.99Å
411P51.1Low62.5Low106 Ų10688.2 Ų88.269%0.68846%0.46SS*.SBendtrans-71.5112.5169.627.6-28.4000108.5
412H51.2Low61.7Low172 Ų17292 Ų9280%0.79648%0.481SS*.SBendtrans67.2122-178.5-44.1-71.4000114.2F410 A414F410-H412 PolarHBondContact O-N 2.99Å; H412-A414 PolarHBondContact O-N 2.9Å
413L48.7Very low61Low121 Ų12194.7 Ų94.763%0.63450%0.498SS*.  trans-59.2105.9170.7-72.1147.4000107.9V415L413-V415 HydrophobicContact CB-CG2 3.66Å; L413-V415 PolarHBondContact O-N 3.35Å
414A43.2Very low59.9Low68 Ų6899.2 Ų99.256%0.56252%0.522SS*.  trans-67.776.215300000107H412 G416H412-A414 PolarHBondContact O-N 2.9Å; A414-G416 VanDerWaalsContact C-N 3.33Å; A414-G416 PolarHBondContact O-N 3.09Å; A414-G416 VanDerWaalsContact O-N 3.12Å
415V39.8Very low58.5Low128 Ų128106.6 Ų106.678%0.77656%0.561SS**  trans-67100.4159.7-175.60000104.8L413L413-V415 HydrophobicContact CB-CG2 3.66Å; L413-V415 PolarHBondContact O-N 3.35Å
416G39.1Very low56.9Low55 Ų55110.7 Ų110.757%0.56759%0.585SS**  trans9788.2175.100000114A414A414-G416 VanDerWaalsContact C-N 3.33Å; A414-G416 PolarHBondContact O-N 3.09Å; A414-G416 VanDerWaalsContact O-N 3.12Å
417F32.8Very low55.4Low197 Ų197116.2 Ų116.286%0.86461%0.611SS**  trans-156.60142.6-82.7-66.8000109.2R70R70-F417 PolarHBondContact NH1-O 3.14Å; R70-F417 PolarHBondContact NH1-OXT 2.93Å; R70-F417 PolarHBondContact NH2-O 3.37Å; R70-F417 PolarHBondContact NH2-OXT 3.03Å

Retrieved 417 of 417 residues in 594.7 ms (Link to these results)

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