A0A096NDC2_PAPAN Loading...

E3 ubiquitin-protein ligase RNF26

E3 ubiquitin-protein ligase that plays a key role in endosome organization by retaining vesicles in the perinuclear cloud. Acts as a platform for perinuclear positioning of the endosomal system by mediating ubiquitination of SQSTM1 through interaction with the ubiquitin conjugating enzyme UBE2J1. Ubiquitinated SQSTM1 attracts specific vesicle-associated adapters, forming a molecular bridge that restrains cognate vesicles in the perinuclear region and organizes the endosomal pathway for efficient cargo transport. Also acts as a regulator of type I interferon production in response to viral infection by mediating the formation of 'Lys-11'-linked polyubiquitin chains on TMEM173/STING, leading to stabilize TMEM173/STING. Also required to limit type I interferon response by promoting autophagic degradation of IRF3.

AlphaFold DB , UniProt , Accession A0A096NDC2, Species PAPAN (Papio anubis, Olive baboon), Gene RNF26, Length 433 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
1M62.5Low72.2Confident207 Ų207114.3 Ų114.3100%1.0263%0.628SS**  0-56.80-68.7-69.6-104.700110.7A3 V4 Y5M1-A3 PolarHBondContact O-N 3.31Å; M1-V4 PolarHBondContact O-N 3.47Å; M1-Y5 PolarHBondContact O-N 3.16Å; M1-Y5 VanDerWaalsContact O-N 3.1Å
2E70.2Confident72.6Confident171 Ų171106.9 Ų106.980%0.79960%0.598SS**Hα-helixtrans-61.8-41.8-179.3-64.2-162.3158.700114.9V4 Y5 L6E2-V4 VanDerWaalsContact C-N 3.27Å; E2-V4 PolarHBondContact O-N 3.42Å; E2-Y5 PolarHBondContact O-N 3.15Å; E2-L6 PolarHBondContact O-N 3.19Å
3A65.7Low72.7Confident73 Ų73107.2 Ų107.260%0.60360%0.597SS**Hα-helixtrans-61.7-34.7176.400000113M1 V7M1-A3 PolarHBondContact O-N 3.31Å; A3-V7 VanDerWaalsContact O-CG2 3.22Å; A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 2.88Å; A3-V7 VanDerWaalsContact O-N 3.09Å
4V72.2Confident72.7Confident97 Ų97106.4 Ų106.459%0.58860%0.596SS**Hα-helixtrans-71.5-40.2177179.30000110.2M1 E2 V7 V8M1-V4 PolarHBondContact O-N 3.47Å; E2-V4 VanDerWaalsContact C-N 3.27Å; E2-V4 PolarHBondContact O-N 3.42Å; V4-V7 PolarHBondContact O-N 3.43Å; V4-V8 HydrophobicContact CG1-CG2 4.34Å; V4-V8 WeakPolarHBondContact O-CB 3.45Å; V4-V8 VanDerWaalsContact O-CG2 3.25Å; V4-V8 WeakPolarHBondContact O-CG2 3.45Å; V4-V8 PolarHBondContact O-N 2.98Å
5Y76.9Confident72.7Confident170 Ų170105.5 Ų105.567%0.66759%0.589SS**Hα-helixtrans-63.7-41.9176.2-169.6-97000112M1 E2 V8 N9M1-Y5 PolarHBondContact O-N 3.16Å; M1-Y5 VanDerWaalsContact O-N 3.1Å; E2-Y5 PolarHBondContact O-N 3.15Å; Y5-V8 PolarHBondContact O-N 2.9Å; Y5-N9 VanDerWaalsContact O-CB 3.29Å; Y5-N9 WeakPolarHBondContact O-CB 3.38Å; Y5-N9 PolarHBondContact O-N 2.83Å
6L75.1Confident72.9Confident131 Ų131106.2 Ų106.269%0.68659%0.591SS**Hα-helixtrans-64.6-39.9176.5-127.8158.5000112E2 G10E2-L6 PolarHBondContact O-N 3.19Å; L6-G10 PolarHBondContact O-N 3.09Å
7V73.1Confident72.8Confident97 Ų97104.6 Ų104.659%0.58858%0.584SS**Hα-helixtrans-67.9-44.7175.1171.10000111.5A3 V4 N9 G10 V11A3-V7 VanDerWaalsContact O-CG2 3.22Å; A3-V7 WeakPolarHBondContact O-CG2 3.42Å; A3-V7 PolarHBondContact O-N 2.88Å; A3-V7 VanDerWaalsContact O-N 3.09Å; V4-V7 PolarHBondContact O-N 3.43Å; V7-N9 PolarHBondContact O-N 3.31Å; V7-G10 PolarHBondContact O-N 2.85Å; V7-V11 HydrophobicContact CG1-CG2 4.37Å; V7-V11 WeakPolarHBondContact O-CB 3.43Å; V7-V11 VanDerWaalsContact O-CG2 3.22Å; V7-V11 WeakPolarHBondContact O-CG2 3.21Å; V7-V11 PolarHBondContact O-N 3.38Å
8V74.9Confident72.9Confident95 Ų95102.4 Ų102.458%0.57657%0.571SS**Hα-helixtrans-63.9-42.2178.5170.30000111.2V4 Y5 V11 G12V4-V8 HydrophobicContact CG1-CG2 4.34Å; V4-V8 WeakPolarHBondContact O-CB 3.45Å; V4-V8 VanDerWaalsContact O-CG2 3.25Å; V4-V8 WeakPolarHBondContact O-CG2 3.45Å; V4-V8 PolarHBondContact O-N 2.98Å; Y5-V8 PolarHBondContact O-N 2.9Å; V8-V11 PolarHBondContact O-N 2.86Å; V8-G12 PolarHBondContact O-N 3.13Å
9N75.8Confident72.9Confident101 Ų101100.7 Ų100.754%0.5456%0.563SS.*Hα-helixtrans-70-37.3177.8-156.730000111.8Y5 V7 G12 L13Y5-N9 VanDerWaalsContact O-CB 3.29Å; Y5-N9 WeakPolarHBondContact O-CB 3.38Å; Y5-N9 PolarHBondContact O-N 2.83Å; V7-N9 PolarHBondContact O-N 3.31Å; N9-G12 PolarHBondContact O-N 3.15Å; N9-L13 PolarHBondContact O-N 3.44Å
10G73.9Confident72.9Confident35 Ų35101.9 Ų101.936%0.36157%0.568SS.*Hα-helixtrans-64.4-41.217300000112.8L6 V7 L13 V14L6-G10 PolarHBondContact O-N 3.09Å; V7-G10 PolarHBondContact O-N 2.85Å; G10-L13 PolarHBondContact O-N 3.01Å; G10-V14 VanDerWaalsContact O-CG2 3.29Å; G10-V14 WeakPolarHBondContact O-CG2 3.08Å; G10-V14 PolarHBondContact O-N 3.48Å
11V74.3Confident72.9Confident80 Ų80100.5 Ų100.549%0.48556%0.562SS.*Hα-helixtrans-64.8-40.7174.1168.70000111V7 V8 V14 L15V7-V11 HydrophobicContact CG1-CG2 4.37Å; V7-V11 WeakPolarHBondContact O-CB 3.43Å; V7-V11 VanDerWaalsContact O-CG2 3.22Å; V7-V11 WeakPolarHBondContact O-CG2 3.21Å; V7-V11 PolarHBondContact O-N 3.38Å; V8-V11 PolarHBondContact O-N 2.86Å; V11-V14 PolarHBondContact O-N 3.23Å; V11-L15 HydrophobicContact CG1-CD1 3.84Å; V11-L15 WeakPolarHBondContact O-CB 3.41Å; V11-L15 PolarHBondContact O-N 3.43Å
12G76.1Confident73.5Confident26 Ų2695.3 Ų95.327%0.26854%0.538SS..Hα-helixtrans-58.4-48.2173.400000112.5V8 N9 V14 L15 D16V8-G12 PolarHBondContact O-N 3.13Å; N9-G12 PolarHBondContact O-N 3.15Å; G12-V14 VanDerWaalsContact C-N 3.34Å; G12-V14 PolarHBondContact O-N 3.47Å; G12-L15 WeakPolarHBondContact O-CB 3.46Å; G12-L15 PolarHBondContact O-N 3.27Å; G12-L15 VanDerWaalsContact O-N 3.16Å; G12-D16 PolarHBondContact O-N 2.83Å
13L74.4Confident73.7Confident110 Ų11092.1 Ų92.158%0.57653%0.526SS*.Hα-helixtrans-64.6-38179.5-155153.4000112.1N9 G10 D16 V17N9-L13 PolarHBondContact O-N 3.44Å; G10-L13 PolarHBondContact O-N 3.01Å; L13-D16 PolarHBondContact O-N 3.19Å; L13-V17 HydrophobicContact CD2-CG2 4.09Å; L13-V17 VanDerWaalsContact O-CG2 3.28Å; L13-V17 WeakPolarHBondContact O-CG2 3.49Å; L13-V17 PolarHBondContact O-N 2.88Å
14V73Confident74Confident96 Ų9694.4 Ų94.458%0.58253%0.527SS*.Hα-helixtrans-66.2-39.7174.1171.40000111.6G10 V11 G12 L18G10-V14 VanDerWaalsContact O-CG2 3.29Å; G10-V14 WeakPolarHBondContact O-CG2 3.08Å; G10-V14 PolarHBondContact O-N 3.48Å; V11-V14 PolarHBondContact O-N 3.23Å; G12-V14 VanDerWaalsContact C-N 3.34Å; G12-V14 PolarHBondContact O-N 3.47Å; V14-L18 VanDerWaalsContact O-CB 3.25Å; V14-L18 WeakPolarHBondContact O-CB 3.36Å; V14-L18 PolarHBondContact O-N 3.17Å
15L72.9Confident74.1Confident94 Ų9491.2 Ų91.249%0.49251%0.507SS..Hα-helixtrans-64.6-43.7174.5-95.7146.4000111.7V11 G12 L18 T19V11-L15 HydrophobicContact CG1-CD1 3.84Å; V11-L15 WeakPolarHBondContact O-CB 3.41Å; V11-L15 PolarHBondContact O-N 3.43Å; G12-L15 WeakPolarHBondContact O-CB 3.46Å; G12-L15 PolarHBondContact O-N 3.27Å; G12-L15 VanDerWaalsContact O-N 3.16Å; L15-L18 PolarHBondContact O-N 3.04Å; L15-T19 WeakPolarHBondContact O-CB 3.4Å; L15-T19 PolarHBondContact O-N 2.99Å; L15-T19 PolarHBondContact O-OG1 3.38Å
16D75.1Confident74.3Confident116 Ų11690.2 Ų90.262%0.6251%0.507SS*.Hα-helixtrans-63.6-44178-70.5-22.1000111.6G12 L13 T19 L20G12-D16 PolarHBondContact O-N 2.83Å; L13-D16 PolarHBondContact O-N 3.19Å; D16-T19 PolarHBondContact O-N 3.36Å; D16-L20 WeakPolarHBondContact O-CB 3.44Å; D16-L20 PolarHBondContact O-N 2.97Å
17V71.7Confident74.4Confident79 Ų7989.5 Ų89.548%0.47950%0.503SS..Hα-helixtrans-63.7-41.4174.8171.80000111.2L13 T19 L20 V21L13-V17 HydrophobicContact CD2-CG2 4.09Å; L13-V17 VanDerWaalsContact O-CG2 3.28Å; L13-V17 WeakPolarHBondContact O-CG2 3.49Å; L13-V17 PolarHBondContact O-N 2.88Å; V17-T19 VanDerWaalsContact C-N 3.33Å; V17-T19 PolarHBondContact O-N 3.04Å; V17-L20 PolarHBondContact O-N 3.31Å; V17-V21 VanDerWaalsContact O-CG2 3.28Å; V17-V21 WeakPolarHBondContact O-CG2 3.11Å; V17-V21 PolarHBondContact O-N 3.12Å
18L73.6Confident74.6Confident65 Ų6588.3 Ų88.334%0.3449%0.492SS..Hα-helixtrans-63.5-40.4176.9-175.566.8000111.6V14 L15 V21 L22 L234V14-L18 VanDerWaalsContact O-CB 3.25Å; V14-L18 WeakPolarHBondContact O-CB 3.36Å; V14-L18 PolarHBondContact O-N 3.17Å; L15-L18 PolarHBondContact O-N 3.04Å; L18-V21 PolarHBondContact O-N 3.36Å; L18-L22 PolarHBondContact O-N 3.47Å; L18-L234 HydrophobicContact CD1-CD2 3.94Å; L18-L234 HydrophobicContact CD2-CD2 3.87Å
19T74.6Confident74.8Confident71 Ų7185.1 Ų85.144%0.43647%0.473SS..Hα-helixtrans-66.6-44.7178.6-45.70000110.6L15 D16 V17 V21 L22 D23L15-T19 WeakPolarHBondContact O-CB 3.4Å; L15-T19 PolarHBondContact O-N 2.99Å; L15-T19 PolarHBondContact O-OG1 3.38Å; D16-T19 PolarHBondContact O-N 3.36Å; V17-T19 VanDerWaalsContact C-N 3.33Å; V17-T19 PolarHBondContact O-N 3.04Å; T19-V21 VanDerWaalsContact C-N 3.35Å; T19-V21 PolarHBondContact O-N 2.92Å; T19-L22 WeakPolarHBondContact O-CB 3.17Å; T19-L22 PolarHBondContact O-N 3.22Å; T19-L22 VanDerWaalsContact O-N 3.13Å; T19-D23 PolarHBondContact O-N 2.91Å
20L72.2Confident75.1Confident124 Ų12482.6 Ų82.665%0.64946%0.463SS*.Hα-helixtrans-58.6-43.7174.3-172.699.8000112.2D16 V17 L22 D23 L24D16-L20 WeakPolarHBondContact O-CB 3.44Å; D16-L20 PolarHBondContact O-N 2.97Å; V17-L20 PolarHBondContact O-N 3.31Å; L20-L22 VanDerWaalsContact C-N 3.32Å; L20-D23 PolarHBondContact O-N 3.4Å; L20-L24 WeakPolarHBondContact O-CB 3.42Å; L20-L24 PolarHBondContact O-N 3.33Å
21V71.9Confident75.4Confident73 Ų7384 Ų8444%0.44247%0.468SS..Hα-helixtrans-64.9-38.1176.9170.60000111V17 L18 T19 N25V17-V21 VanDerWaalsContact O-CG2 3.28Å; V17-V21 WeakPolarHBondContact O-CG2 3.11Å; V17-V21 PolarHBondContact O-N 3.12Å; L18-V21 PolarHBondContact O-N 3.36Å; T19-V21 VanDerWaalsContact C-N 3.35Å; T19-V21 PolarHBondContact O-N 2.92Å; V21-N25 WeakPolarHBondContact O-CB 3.45Å; V21-N25 PolarHBondContact O-N 2.89Å
22L75.6Confident75.7Confident98 Ų9881.9 Ų81.951%0.51345%0.453SS..Hα-helixtrans-65.9-43.7176.1-127.789.8000112.1L18 T19 L20 N25 F26L18-L22 PolarHBondContact O-N 3.47Å; T19-L22 WeakPolarHBondContact O-CB 3.17Å; T19-L22 PolarHBondContact O-N 3.22Å; T19-L22 VanDerWaalsContact O-N 3.13Å; L20-L22 VanDerWaalsContact C-N 3.32Å; L22-N25 WeakPolarHBondContact O-CB 3.22Å; L22-N25 PolarHBondContact O-N 2.92Å; L22-F26 WeakPolarHBondContact O-CB 3.47Å; L22-F26 PolarHBondContact O-N 3.4Å
23D75Confident75.9Confident104 Ų10485.2 Ų85.256%0.55647%0.465SS*.Hα-helixtrans-66.4-42.3179.1-74.7-19.4000111.5T19 L20 N25 F26 L27T19-D23 PolarHBondContact O-N 2.91Å; L20-D23 PolarHBondContact O-N 3.4Å; D23-N25 VanDerWaalsContact C-N 3.32Å; D23-N25 PolarHBondContact O-N 3.42Å; D23-F26 PolarHBondContact O-N 2.93Å; D23-L27 WeakPolarHBondContact O-CB 3.48Å; D23-L27 PolarHBondContact O-N 2.88Å
24L71.5Confident76.4Confident121 Ų12182.3 Ų82.363%0.63446%0.456SS*.Hα-helixtrans-62.1-42174.7-163.794.5000111.2L20 L27 L28L20-L24 WeakPolarHBondContact O-CB 3.42Å; L20-L24 PolarHBondContact O-N 3.33Å; L24-L27 PolarHBondContact O-N 2.89Å; L24-L28 VanDerWaalsContact O-CB 3.27Å; L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 PolarHBondContact O-N 3.29Å
25N75.6Confident76.7Confident30 Ų3080.1 Ų80.116%0.1645%0.446CS..Hα-helixtrans-63.4-45.8176174.52.2000111.5V21 L22 D23 L27 L28 V29 F223 N227V21-N25 WeakPolarHBondContact O-CB 3.45Å; V21-N25 PolarHBondContact O-N 2.89Å; L22-N25 WeakPolarHBondContact O-CB 3.22Å; L22-N25 PolarHBondContact O-N 2.92Å; D23-N25 VanDerWaalsContact C-N 3.32Å; D23-N25 PolarHBondContact O-N 3.42Å; N25-L27 PolarHBondContact O-N 3.45Å; N25-L28 PolarHBondContact O-N 2.68Å; N25-V29 WeakPolarHBondContact O-CB 3.48Å; N25-V29 VanDerWaalsContact O-CG2 3.32Å; N25-V29 WeakPolarHBondContact O-CG2 3.44Å; N25-V29 PolarHBondContact O-N 3.11Å; N25-V29 WeakPolarHBondContact OD1-CG2 3.47Å; N25-F223 HydrophobicContact CB-CE1 3.96Å; N25-F223 HydrophobicContact CB-CZ 3.73Å; N25-F223 VanDerWaalsContact CG-CE1 3.41Å; N25-F223 WeakPolarHBondContact OD1-CE1 3.39Å; N25-F223 WeakPolarHBondContact OD1-CZ 3.21Å; N25-N227 VanDerWaalsContact CG-ND2 3.32Å; N25-N227 PolarHBondContact ND2-ND2 3.37Å; N25-N227 PolarHBondContact OD1-ND2 3.12Å
26F80Confident77.1Confident149 Ų14977 Ų7765%0.65443%0.429SS*.Hα-helixtrans-61.5-43.3176179.9-99.6000112.3L22 D23 S30L22-F26 WeakPolarHBondContact O-CB 3.47Å; L22-F26 PolarHBondContact O-N 3.4Å; D23-F26 PolarHBondContact O-N 2.93Å; F26-S30 VanDerWaalsContact O-CB 3.24Å; F26-S30 WeakPolarHBondContact O-CB 3.06Å; F26-S30 PolarHBondContact O-N 3.05Å; F26-S30 PolarHBondContact O-OG 3.27Å
27L77.9Confident77.5Confident116 Ų11674.3 Ų74.361%0.60742%0.423SS*.Hα-helixtrans-65-40.9177.1-172.8140.4000111.8D23 L24 N25 S30 S31D23-L27 WeakPolarHBondContact O-CB 3.48Å; D23-L27 PolarHBondContact O-N 2.88Å; L24-L27 PolarHBondContact O-N 2.89Å; N25-L27 PolarHBondContact O-N 3.45Å; L27-S30 WeakPolarHBondContact CA-OG 3.24Å; L27-S30 PolarHBondContact O-OG 3.35Å; L27-S30 VanDerWaalsContact O-OG 3.09Å; L27-S31 VanDerWaalsContact O-CB 3.32Å; L27-S31 WeakPolarHBondContact O-CB 3.31Å; L27-S31 PolarHBondContact O-N 3.13Å; L27-S31 PolarHBondContact O-OG 3.42Å
28L76.6Confident78.3Confident71 Ų7180.3 Ų80.337%0.37244%0.437SS..Hα-helixtrans-68.3-44.5178.3-162.2134.3000111.3L24 N25 S31 L32 F223L24-L28 VanDerWaalsContact O-CB 3.27Å; L24-L28 WeakPolarHBondContact O-CB 3.4Å; L24-L28 PolarHBondContact O-N 3.29Å; N25-L28 PolarHBondContact O-N 2.68Å; L28-S31 PolarHBondContact O-OG 2.98Å; L28-L32 HydrophobicContact CD2-CD1 3.5Å; L28-L32 VanDerWaalsContact CD2-CD1 3.5Å; L28-L32 HydrophobicContact CG-CD1 4.12Å; L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.48Å; L28-L32 WeakPolarHBondContact O-CD1 3.4Å; L28-L32 PolarHBondContact O-N 3.42Å; L28-F223 HydrophobicContact CB-CE1 4.48Å; L28-F223 HydrophobicContact CD2-CD1 4.15Å; L28-F223 HydrophobicContact CD2-CE1 3.9Å; L28-F223 HydrophobicContact CD2-CZ 4.27Å
29V80Confident78.7Confident28 Ų2879 Ų7917%0.1743%0.43CS..Hα-helixtrans-65.6-44.3177.1169.50000111.7N25 L32 L33 L220 F223N25-V29 WeakPolarHBondContact O-CB 3.48Å; N25-V29 VanDerWaalsContact O-CG2 3.32Å; N25-V29 WeakPolarHBondContact O-CG2 3.44Å; N25-V29 PolarHBondContact O-N 3.11Å; N25-V29 WeakPolarHBondContact OD1-CG2 3.47Å; V29-L32 PolarHBondContact O-N 3.48Å; V29-L33 HydrophobicContact CG1-CD1 3.56Å; V29-L33 HydrophobicContact CG1-CG 4.43Å; V29-L33 WeakPolarHBondContact O-CB 3.28Å; V29-L33 WeakPolarHBondContact O-CD1 3.3Å; V29-L33 WeakPolarHBondContact O-CG 3.3Å; V29-L33 PolarHBondContact O-N 3.33Å; V29-L220 HydrophobicContact CB-CD2 4.42Å; V29-L220 HydrophobicContact CG1-CD2 4.32Å; V29-L220 HydrophobicContact CG2-CD2 4.16Å; V29-F223 HydrophobicContact CG2-CD1 3.65Å; V29-F223 HydrophobicContact CG2-CE1 3.7Å
30S82.1Confident79Confident48 Ų4880.7 Ų80.734%0.33644%0.436SS..Hα-helixtrans-66.7-41.9-179.757.60000112.6F26 L27 L33 A34F26-S30 VanDerWaalsContact O-CB 3.24Å; F26-S30 WeakPolarHBondContact O-CB 3.06Å; F26-S30 PolarHBondContact O-N 3.05Å; F26-S30 PolarHBondContact O-OG 3.27Å; L27-S30 WeakPolarHBondContact CA-OG 3.24Å; L27-S30 PolarHBondContact O-OG 3.35Å; L27-S30 VanDerWaalsContact O-OG 3.09Å; S30-L33 PolarHBondContact O-N 2.84Å; S30-A34 WeakPolarHBondContact O-CB 3.45Å; S30-A34 PolarHBondContact O-N 3.35Å
31S79.9Confident79.6Confident64 Ų6476.7 Ų76.745%0.44842%0.421SS..Hα-helixtrans-65.9-41.2175590000112.4L27 L28 A34 S35L27-S31 VanDerWaalsContact O-CB 3.32Å; L27-S31 WeakPolarHBondContact O-CB 3.31Å; L27-S31 PolarHBondContact O-N 3.13Å; L27-S31 PolarHBondContact O-OG 3.42Å; L28-S31 PolarHBondContact O-OG 2.98Å; S31-A34 PolarHBondContact O-N 3.03Å; S31-S35 WeakPolarHBondContact O-CB 3.39Å; S31-S35 PolarHBondContact O-N 2.84Å
32L79.1Confident80.2Confident36 Ų3678.8 Ų78.819%0.18842%0.424CS..Hα-helixtrans-63.7-46.7173.8-96.8144.3000112L28 V29 A34 S35 L36 A216 L220L28-L32 HydrophobicContact CD2-CD1 3.5Å; L28-L32 VanDerWaalsContact CD2-CD1 3.5Å; L28-L32 HydrophobicContact CG-CD1 4.12Å; L28-L32 VanDerWaalsContact O-CB 3.31Å; L28-L32 WeakPolarHBondContact O-CB 3.48Å; L28-L32 WeakPolarHBondContact O-CD1 3.4Å; L28-L32 PolarHBondContact O-N 3.42Å; V29-L32 PolarHBondContact O-N 3.48Å; L32-A34 VanDerWaalsContact C-N 3.34Å; L32-A34 PolarHBondContact O-N 3.47Å; L32-S35 PolarHBondContact O-N 3.48Å; L32-S35 PolarHBondContact O-OG 3.19Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.27Å; L32-A216 HydrophobicContact CD2-CB 3.95Å; L32-L220 HydrophobicContact CB-CD1 4.02Å; L32-L220 HydrophobicContact CB-CD2 3.75Å; L32-L220 HydrophobicContact CB-CG 3.99Å; L32-L220 HydrophobicContact CD1-CD2 4.15Å; L32-L220 HydrophobicContact CD1-CG 4.41Å; L32-L220 HydrophobicContact CD2-CD1 4.42Å; L32-L220 HydrophobicContact CD2-CG 4.19Å; L32-L220 HydrophobicContact CG-CD2 4.41Å; L32-L220 HydrophobicContact CG-CG 4.44Å
33L80.8Confident80.5Confident97 Ų9776.1 Ų76.151%0.50841%0.412SS..Hα-helixtrans-60.4-42.4176-83.5160000112.1V29 S30 L36 A37V29-L33 HydrophobicContact CG1-CD1 3.56Å; V29-L33 HydrophobicContact CG1-CG 4.43Å; V29-L33 WeakPolarHBondContact O-CB 3.28Å; V29-L33 WeakPolarHBondContact O-CD1 3.3Å; V29-L33 WeakPolarHBondContact O-CG 3.3Å; V29-L33 PolarHBondContact O-N 3.33Å; S30-L33 PolarHBondContact O-N 2.84Å; L33-L36 PolarHBondContact O-N 3.45Å; L33-A37 WeakPolarHBondContact O-CB 3.37Å; L33-A37 PolarHBondContact O-N 2.93Å
34A85.8Confident81Confident48 Ų4879.9 Ų79.940%0.39742%0.42SS..Hα-helixtrans-61.8-45.5174.800000111.1S30 S31 L32 L36 A37 W38S30-A34 WeakPolarHBondContact O-CB 3.45Å; S30-A34 PolarHBondContact O-N 3.35Å; S31-A34 PolarHBondContact O-N 3.03Å; L32-A34 VanDerWaalsContact C-N 3.34Å; L32-A34 PolarHBondContact O-N 3.47Å; A34-L36 PolarHBondContact O-N 2.91Å; A34-A37 PolarHBondContact O-N 3.45Å; A34-W38 VanDerWaalsContact O-CD1 3.24Å; A34-W38 PolarHBondContact O-N 3.19Å
35S79.1Confident81.7Confident51 Ų5178 Ų7836%0.35741%0.41SS..Hα-helixtrans-62.1-40.9177.575.80000112.5S31 L32 W38 L39S31-S35 WeakPolarHBondContact O-CB 3.39Å; S31-S35 PolarHBondContact O-N 2.84Å; L32-S35 PolarHBondContact O-N 3.48Å; L32-S35 PolarHBondContact O-OG 3.19Å; S35-W38 PolarHBondContact O-N 3.3Å; S35-L39 WeakPolarHBondContact O-CB 3.49Å; S35-L39 PolarHBondContact O-N 3.42Å
36L80.6Confident82.1Confident28 Ų2878 Ų7815%0.14741%0.41CS..Hα-helixtrans-63.7-43.1174.8-75.7-178.6000111.7L32 L33 A34 W38 L39 L40 L213 A216 L220L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.27Å; L33-L36 PolarHBondContact O-N 3.45Å; A34-L36 PolarHBondContact O-N 2.91Å; L36-W38 VanDerWaalsContact C-N 3.35Å; L36-L39 PolarHBondContact O-N 3.44Å; L36-L40 VanDerWaalsContact O-CB 3.31Å; L36-L40 WeakPolarHBondContact O-CB 3.36Å; L36-L40 PolarHBondContact O-N 3.46Å; L36-L213 HydrophobicContact CB-CD1 4.42Å; L36-L213 HydrophobicContact CD2-CD1 3.38Å; L36-L213 HydrophobicContact CD2-CG 3.95Å; L36-L213 HydrophobicContact CG-CD1 4.5Å; L36-A216 HydrophobicContact CD2-CB 3.71Å; L36-A216 HydrophobicContact CG-CB 4.41Å; L36-L220 HydrophobicContact CD1-CD1 3.36Å; L36-L220 HydrophobicContact CG-CD1 4.4Å
37A84.8Confident82.2Confident59 Ų5974.4 Ų74.449%0.48840%0.402SS..Hα-helixtrans-62.7-42.4178.100000111.5L33 A34 L40 A41L33-A37 WeakPolarHBondContact O-CB 3.37Å; L33-A37 PolarHBondContact O-N 2.93Å; A34-A37 PolarHBondContact O-N 3.45Å; A37-L40 PolarHBondContact O-N 3.27Å; A37-A41 VanDerWaalsContact O-CB 3.27Å; A37-A41 WeakPolarHBondContact O-CB 3.44Å; A37-A41 PolarHBondContact O-N 2.89Å
38W88.3Confident82.5Confident206 Ų20674.5 Ų74.578%0.7840%0.399SS*.Hα-helixtrans-64.5-43.6174.6-84.8105000112.6A34 S35 L36 A41 F42A34-W38 VanDerWaalsContact O-CD1 3.24Å; A34-W38 PolarHBondContact O-N 3.19Å; S35-W38 PolarHBondContact O-N 3.3Å; L36-W38 VanDerWaalsContact C-N 3.35Å; W38-A41 PolarHBondContact O-N 3.09Å; W38-F42 WeakPolarHBondContact O-CB 3.45Å; W38-F42 PolarHBondContact O-N 2.88Å
39L80.7Confident82.8Confident36 Ų3675 Ų7519%0.18841%0.405CS..Hα-helixtrans-61.5-45.1174.9-91.4151.2000112S35 L36 F42 V43 A209 L212 L213S35-L39 WeakPolarHBondContact O-CB 3.49Å; S35-L39 PolarHBondContact O-N 3.42Å; L36-L39 PolarHBondContact O-N 3.44Å; L39-F42 WeakPolarHBondContact O-CB 3.37Å; L39-F42 PolarHBondContact O-N 2.97Å; L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.3Å; L39-A209 HydrophobicContact CD2-CB 3.93Å; L39-L212 HydrophobicContact CD1-CD2 3.94Å; L39-L212 HydrophobicContact CD1-CG 4.44Å; L39-L212 HydrophobicContact CD2-CD2 4.44Å; L39-L213 HydrophobicContact CB-CD1 3.89Å
40L80.9Confident83Confident108 Ų10876.9 Ų76.957%0.56542%0.416SS*.Hα-helixtrans-64.5-44.6178.6-162.590000111.3L36 A37 F42 V43 Y44 L213L36-L40 VanDerWaalsContact O-CB 3.31Å; L36-L40 WeakPolarHBondContact O-CB 3.36Å; L36-L40 PolarHBondContact O-N 3.46Å; A37-L40 PolarHBondContact O-N 3.27Å; L40-F42 VanDerWaalsContact C-N 3.31Å; L40-F42 PolarHBondContact O-N 2.75Å; L40-V43 PolarHBondContact O-N 2.89Å; L40-Y44 WeakPolarHBondContact O-CB 3.35Å; L40-Y44 PolarHBondContact O-N 3.22Å; L40-L213 HydrophobicContact CD1-CD2 4.11Å
41A85.1Confident83Confident40 Ų4079.5 Ų79.533%0.33143%0.426SS..Hα-helixtrans-62.1-39.4175.500000111.5A37 W38 N45A37-A41 VanDerWaalsContact O-CB 3.27Å; A37-A41 WeakPolarHBondContact O-CB 3.44Å; A37-A41 PolarHBondContact O-N 2.89Å; W38-A41 PolarHBondContact O-N 3.09Å; A41-N45 WeakPolarHBondContact O-CB 3.36Å; A41-N45 PolarHBondContact O-N 2.85Å; A41-N45 PolarHBondContact O-ND2 3.32Å
42F84.2Confident83.2Confident117 Ų11778.9 Ų78.951%0.51342%0.419SS..Hα-helixtrans-62-50.8174.8175.2-99.9000111.6W38 L39 L40 Y44 N45 L46W38-F42 WeakPolarHBondContact O-CB 3.45Å; W38-F42 PolarHBondContact O-N 2.88Å; L39-F42 WeakPolarHBondContact O-CB 3.37Å; L39-F42 PolarHBondContact O-N 2.97Å; L40-F42 VanDerWaalsContact C-N 3.31Å; L40-F42 PolarHBondContact O-N 2.75Å; F42-Y44 VanDerWaalsContact C-N 3.31Å; F42-Y44 PolarHBondContact O-N 2.92Å; F42-N45 PolarHBondContact O-N 2.9Å; F42-L46 HydrophobicContact CD1-CD1 4.47Å; F42-L46 HydrophobicContact CE1-CD1 3.66Å; F42-L46 HydrophobicContact CE2-CD1 4.32Å; F42-L46 HydrophobicContact CZ-CD1 3.58Å; F42-L46 VanDerWaalsContact O-CB 3.25Å; F42-L46 WeakPolarHBondContact O-CB 3.22Å; F42-L46 PolarHBondContact O-N 3.04Å
43V82.6Confident83.1Confident42 Ų4281 Ų8126%0.25544%0.438SS..Hα-helixtrans-61.2-39.2179.2173.20000111.6L39 L40 P47 A209L39-V43 WeakPolarHBondContact O-CG2 3.47Å; L39-V43 PolarHBondContact O-N 3.3Å; L40-V43 PolarHBondContact O-N 2.89Å; V43-P47 WeakPolarHBondContact O-CD 3.31Å; V43-A209 HydrophobicContact CG2-CB 4.48Å
44Y84.7Confident83.1Confident183 Ų18380.8 Ų80.872%0.71844%0.436SS*.Hα-helixtrans-69.5-39.8178.6-177.7-96.8000113.1L40 F42 P47L40-Y44 WeakPolarHBondContact O-CB 3.35Å; L40-Y44 PolarHBondContact O-N 3.22Å; F42-Y44 VanDerWaalsContact C-N 3.31Å; F42-Y44 PolarHBondContact O-N 2.92Å; Y44-P47 WeakPolarHBondContact O-CD 2.96Å; Y44-P47 WeakPolarHBondContact O-CG 3.48Å
45N87Confident82.9Confident80 Ų8082.7 Ų82.743%0.42844%0.44SS..Hα-helixtrans-82.1-24.6-176.7-73.2-56.3000113.5A41 F42 H48 T49A41-N45 WeakPolarHBondContact O-CB 3.36Å; A41-N45 PolarHBondContact O-N 2.85Å; A41-N45 PolarHBondContact O-ND2 3.32Å; F42-N45 PolarHBondContact O-N 2.9Å; N45-H48 WeakPolarHBondContact O-CB 3.42Å; N45-H48 PolarHBondContact O-N 2.92Å; N45-H48 VanDerWaalsContact O-N 3.14Å; N45-T49 WeakPolarHBondContact O-CG2 3.48Å; N45-T49 PolarHBondContact O-N 3.01Å; N45-T49 PolarHBondContact O-OG1 3.2Å
46L84.1Confident83Confident30 Ų3086.4 Ų86.416%0.15745%0.451CS..Hα-helixtrans-55.7-46.8179.8-178.2144.5000114.8F42 H48 T49 V50 L202F42-L46 HydrophobicContact CD1-CD1 4.47Å; F42-L46 HydrophobicContact CE1-CD1 3.66Å; F42-L46 HydrophobicContact CE2-CD1 4.32Å; F42-L46 HydrophobicContact CZ-CD1 3.58Å; F42-L46 VanDerWaalsContact O-CB 3.25Å; F42-L46 WeakPolarHBondContact O-CB 3.22Å; F42-L46 PolarHBondContact O-N 3.04Å; L46-H48 VanDerWaalsContact C-N 3.3Å; L46-H48 PolarHBondContact O-N 2.79Å; L46-T49 PolarHBondContact O-N 3.38Å; L46-T49 PolarHBondContact O-OG1 2.9Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.14Å; L46-V50 PolarHBondContact O-N 3.5Å; L46-L202 HydrophobicContact CD1-CD1 4.1Å; L46-L202 HydrophobicContact CD1-CD2 4.32Å; L46-L202 HydrophobicContact CD1-CG 4.37Å; L46-L202 HydrophobicContact CD2-CD2 3.58Å; L46-L202 HydrophobicContact CD2-CG 4.19Å; L46-L202 HydrophobicContact CG-CD2 4.13Å
47P83.1Confident83Confident75 Ų7590 Ų9049%0.48747%0.47SS..Hα-helixtrans-65-34.617523.1-32.5000112.4V43 Y44 L51V43-P47 WeakPolarHBondContact O-CD 3.31Å; Y44-P47 WeakPolarHBondContact O-CD 2.96Å; Y44-P47 WeakPolarHBondContact O-CG 3.48Å; P47-L51 WeakPolarHBondContact O-CB 3.18Å; P47-L51 PolarHBondContact O-N 3.4Å
48H82.8Confident82.8Confident118 Ų11888.9 Ų88.955%0.54646%0.464SS..Hα-helixtrans-68.1-40.7178.2-176.3-90.1000112.1N45 L46 T52N45-H48 WeakPolarHBondContact O-CB 3.42Å; N45-H48 PolarHBondContact O-N 2.92Å; N45-H48 VanDerWaalsContact O-N 3.14Å; L46-H48 VanDerWaalsContact C-N 3.3Å; L46-H48 PolarHBondContact O-N 2.79Å; H48-T52 WeakPolarHBondContact O-CB 3.41Å; H48-T52 WeakPolarHBondContact O-CG2 3.32Å; H48-T52 PolarHBondContact O-N 3.48Å; H48-T52 PolarHBondContact O-OG1 2.79Å
49T83.9Confident82.6Confident80 Ų8086.7 Ų86.749%0.49146%0.456SS..Hα-helixtrans-69.7-39.9176.956.20000112.1N45 L46 T52 S53N45-T49 WeakPolarHBondContact O-CG2 3.48Å; N45-T49 PolarHBondContact O-N 3.01Å; N45-T49 PolarHBondContact O-OG1 3.2Å; L46-T49 PolarHBondContact O-N 3.38Å; L46-T49 PolarHBondContact O-OG1 2.9Å; T49-T52 WeakPolarHBondContact CA-OG1 3.1Å; T49-T52 PolarHBondContact O-OG1 3.2Å; T49-S53 WeakPolarHBondContact O-CB 3.48Å; T49-S53 PolarHBondContact O-N 2.98Å
50V83.7Confident82.5Confident69 Ų6986.9 Ų86.942%0.41847%0.467SS..Hα-helixtrans-63.2-46174.3172.80000110.6L46 S53 L54 L202L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.14Å; L46-V50 PolarHBondContact O-N 3.5Å; V50-S53 PolarHBondContact O-N 2.74Å; V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 3.38Å; V50-L202 HydrophobicContact CG2-CD2 4.13Å
51L82.9Confident82.6Confident103 Ų10382.9 Ų82.954%0.53945%0.446SS..Hα-helixtrans-64-44-179.8-175.563.9000112.2P47 L54 L55P47-L51 WeakPolarHBondContact O-CB 3.18Å; P47-L51 PolarHBondContact O-N 3.4Å; L51-L54 PolarHBondContact O-N 2.93Å; L51-L55 HydrophobicContact CG-CD1 4.12Å; L51-L55 WeakPolarHBondContact O-CB 3.28Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 3.4Å
52T82.7Confident82.5Confident50 Ų5086.6 Ų86.631%0.30746%0.46SS..Hα-helixtrans-64.9-42.9177.748.20000111.7H48 T49 L54 L55 H56H48-T52 WeakPolarHBondContact O-CB 3.41Å; H48-T52 WeakPolarHBondContact O-CG2 3.32Å; H48-T52 PolarHBondContact O-N 3.48Å; H48-T52 PolarHBondContact O-OG1 2.79Å; T49-T52 WeakPolarHBondContact CA-OG1 3.1Å; T49-T52 PolarHBondContact O-OG1 3.2Å; T52-L54 VanDerWaalsContact C-N 3.35Å; T52-L54 PolarHBondContact O-N 3.48Å; T52-L55 PolarHBondContact O-N 3.37Å; T52-H56 PolarHBondContact O-CD2 2.85Å; T52-H56 PolarHBondContact O-N 2.93Å
53S78.6Confident82.5Confident82 Ų8286.8 Ų86.857%0.57347%0.466SS*.Hα-helixtrans-58.5-45.8174.3-177.10000112T49 V50 L55 H56 L57T49-S53 WeakPolarHBondContact O-CB 3.48Å; T49-S53 PolarHBondContact O-N 2.98Å; V50-S53 PolarHBondContact O-N 2.74Å; S53-L55 PolarHBondContact O-N 3.26Å; S53-H56 PolarHBondContact O-N 2.94Å; S53-L57 PolarHBondContact O-N 3.27Å
54L80.4Confident82.5Confident91 Ų9188.1 Ų88.148%0.47648%0.477SS..Hα-helixtrans-67.9-35.9-179.7-153.6136.7000112V50 L51 T52 G58V50-L54 WeakPolarHBondContact O-CB 3.37Å; V50-L54 PolarHBondContact O-N 3.38Å; L51-L54 PolarHBondContact O-N 2.93Å; T52-L54 VanDerWaalsContact C-N 3.35Å; T52-L54 PolarHBondContact O-N 3.48Å; L54-G58 PolarHBondContact O-N 3.21Å
55L81.4Confident82.3Confident89 Ų8981.7 Ų81.747%0.46646%0.455SS..Hα-helixtrans-66.6-40.7172.7-75.6170.8000112.5L51 T52 S53 G58 R59L51-L55 HydrophobicContact CG-CD1 4.12Å; L51-L55 WeakPolarHBondContact O-CB 3.28Å; L51-L55 VanDerWaalsContact O-CG 3.26Å; L51-L55 WeakPolarHBondContact O-CG 3.34Å; L51-L55 PolarHBondContact O-N 3.4Å; T52-L55 PolarHBondContact O-N 3.37Å; S53-L55 PolarHBondContact O-N 3.26Å; L55-G58 PolarHBondContact O-N 3.45Å; L55-R59 WeakPolarHBondContact O-CB 3.49Å; L55-R59 VanDerWaalsContact O-CG 3.32Å; L55-R59 WeakPolarHBondContact O-CG 3.49Å; L55-R59 PolarHBondContact O-N 3.45Å
56H81.3Confident82.3Confident129 Ų12983 Ų8360%0.59746%0.461SS*.Hα-helixtrans-64.8-43.7175.9-80.3-67.4000111.7T52 S53 R59 G60T52-H56 PolarHBondContact O-CD2 2.85Å; T52-H56 PolarHBondContact O-N 2.93Å; S53-H56 PolarHBondContact O-N 2.94Å; H56-R59 PolarHBondContact O-N 2.88Å; H56-G60 PolarHBondContact O-N 3.2Å
57L80.1Confident82.2Confident103 Ų10384.2 Ų84.254%0.53948%0.476SS..Hα-helixtrans-61.6-46.6174.1-172.764.9000110.9S53 R59 G60 V61S53-L57 PolarHBondContact O-N 3.27Å; L57-R59 PolarHBondContact O-N 3.43Å; L57-G60 PolarHBondContact O-N 3.02Å; L57-V61 VanDerWaalsContact O-CG2 3.25Å; L57-V61 WeakPolarHBondContact O-CG2 3.39Å; L57-V61 PolarHBondContact O-N 2.9Å
58G81.2Confident82.2Confident36 Ų3683.8 Ų83.837%0.37147%0.469SS..Hα-helixtrans-59.9-41.4177.100000113.2L54 L55 V61 L62L54-G58 PolarHBondContact O-N 3.21Å; L55-G58 PolarHBondContact O-N 3.45Å; G58-V61 PolarHBondContact O-N 3.45Å; G58-L62 WeakPolarHBondContact O-CB 3.39Å; G58-L62 PolarHBondContact O-N 3.07Å
59R84.2Confident82.2Confident159 Ų15982.6 Ų82.660%0.647%0.466SS*.Hα-helixtrans-64-44.6175-77.7175.8175.4173.1-0.7112.2L55 H56 L57 V61 L62 L63L55-R59 WeakPolarHBondContact O-CB 3.49Å; L55-R59 VanDerWaalsContact O-CG 3.32Å; L55-R59 WeakPolarHBondContact O-CG 3.49Å; L55-R59 PolarHBondContact O-N 3.45Å; H56-R59 PolarHBondContact O-N 2.88Å; L57-R59 PolarHBondContact O-N 3.43Å; R59-V61 VanDerWaalsContact C-N 3.35Å; R59-V61 PolarHBondContact O-N 2.84Å; R59-L62 PolarHBondContact O-N 3.38Å; R59-L63 VanDerWaalsContact O-CG 3.31Å; R59-L63 WeakPolarHBondContact O-CG 3.33Å; R59-L63 PolarHBondContact O-N 3.38Å
60G78.9Confident82.3Confident41 Ų4183.2 Ų83.242%0.42346%0.463SS..Hα-helixtrans-61-44.4177.400000112.2H56 L57 L63 S64H56-G60 PolarHBondContact O-N 3.2Å; L57-G60 PolarHBondContact O-N 3.02Å; G60-L63 PolarHBondContact O-N 2.89Å; G60-S64 PolarHBondContact O-N 2.91Å
61V81.7Confident82.2Confident23 Ų2382.6 Ų82.614%0.13947%0.466CS..Hα-helixtrans-60.5-49.9174.6169.70000111L57 G58 R59 L63 S64 L65 F187L57-V61 VanDerWaalsContact O-CG2 3.25Å; L57-V61 WeakPolarHBondContact O-CG2 3.39Å; L57-V61 PolarHBondContact O-N 2.9Å; G58-V61 PolarHBondContact O-N 3.45Å; R59-V61 VanDerWaalsContact C-N 3.35Å; R59-V61 PolarHBondContact O-N 2.84Å; V61-L63 VanDerWaalsContact C-N 3.31Å; V61-L63 PolarHBondContact O-N 3.43Å; V61-S64 WeakPolarHBondContact CA-OG 3.47Å; V61-S64 PolarHBondContact O-N 3.34Å; V61-S64 VanDerWaalsContact O-N 3.11Å; V61-S64 PolarHBondContact O-OG 3.34Å; V61-L65 HydrophobicContact CG1-CD1 3.83Å; V61-L65 HydrophobicContact CG1-CG 4.34Å; V61-L65 WeakPolarHBondContact O-CG 3.43Å; V61-L65 PolarHBondContact O-N 3.3Å; V61-F187 HydrophobicContact CB-CE1 4.02Å; V61-F187 HydrophobicContact CB-CZ 4.38Å; V61-F187 HydrophobicContact CG1-CD1 4.06Å; V61-F187 HydrophobicContact CG1-CE1 3.37Å; V61-F187 HydrophobicContact CG1-CZ 4.16Å; V61-F187 HydrophobicContact CG2-CE1 3.39Å; V61-F187 HydrophobicContact CG2-CZ 3.31Å
62L83.8Confident82.1Confident118 Ų11879 Ų7962%0.61845%0.447SS*.Hα-helixtrans-59.2-43.3-178.6-176.468.1000111.5G58 R59 L65 L66G58-L62 WeakPolarHBondContact O-CB 3.39Å; G58-L62 PolarHBondContact O-N 3.07Å; R59-L62 PolarHBondContact O-N 3.38Å; L62-L65 PolarHBondContact O-N 2.88Å; L62-L66 WeakPolarHBondContact O-CB 3.25Å; L62-L66 PolarHBondContact O-N 3.01Å
63L84.6Confident82.1Confident121 Ų12180.9 Ų80.963%0.63446%0.455SS*.Hα-helixtrans-63-42175.7-71.4170.3000111.8R59 G60 V61 L66 A67R59-L63 VanDerWaalsContact O-CG 3.31Å; R59-L63 WeakPolarHBondContact O-CG 3.33Å; R59-L63 PolarHBondContact O-N 3.38Å; G60-L63 PolarHBondContact O-N 2.89Å; V61-L63 VanDerWaalsContact C-N 3.31Å; V61-L63 PolarHBondContact O-N 3.43Å; L63-L66 PolarHBondContact O-N 3.46Å; L63-A67 WeakPolarHBondContact O-CB 3.43Å; L63-A67 PolarHBondContact O-N 2.91Å
64S80.7Confident82.3Confident70 Ų7085 Ų8549%0.4946%0.458SS..Hα-helixtrans-65.1-40.5177.472.50000112.6G60 V61 A67 L68G60-S64 PolarHBondContact O-N 2.91Å; V61-S64 WeakPolarHBondContact CA-OG 3.47Å; V61-S64 PolarHBondContact O-N 3.34Å; V61-S64 VanDerWaalsContact O-N 3.11Å; V61-S64 PolarHBondContact O-OG 3.34Å; S64-A67 PolarHBondContact O-N 2.93Å; S64-L68 WeakPolarHBondContact O-CB 3.5Å; S64-L68 PolarHBondContact O-N 3.47Å
65L82.4Confident82.3Confident48 Ų4887.1 Ų87.125%0.25146%0.463SS..Hα-helixtrans-65.7-42.5175.2-75.4172.7000111.3V61 L62 L68 I69 V184V61-L65 HydrophobicContact CG1-CD1 3.83Å; V61-L65 HydrophobicContact CG1-CG 4.34Å; V61-L65 WeakPolarHBondContact O-CG 3.43Å; V61-L65 PolarHBondContact O-N 3.3Å; L62-L65 PolarHBondContact O-N 2.88Å; L65-L68 WeakPolarHBondContact O-CB 3.21Å; L65-L68 PolarHBondContact O-N 2.82Å; L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 3.39Å; L65-V184 HydrophobicContact CD2-CG2 3.42Å; L65-V184 VanDerWaalsContact CD2-CG2 3.42Å
66L85.2Confident82.1Confident107 Ų10784.7 Ų84.756%0.5645%0.452SS*.Hα-helixtrans-63.1-43.2177.7-17167.3000111.4L62 L63 L68 I69 E70L62-L66 WeakPolarHBondContact O-CB 3.25Å; L62-L66 PolarHBondContact O-N 3.01Å; L63-L66 PolarHBondContact O-N 3.46Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 2.94Å; L66-I69 PolarHBondContact O-N 3.08Å; L66-E70 WeakPolarHBondContact O-CB 3.45Å; L66-E70 PolarHBondContact O-N 3.18Å
67A83.7Confident82.1Confident57 Ų5781.9 Ų81.947%0.47145%0.447SS..Hα-helixtrans-62.4-38.4175.500000112.1L63 S64 E70 A71L63-A67 WeakPolarHBondContact O-CB 3.43Å; L63-A67 PolarHBondContact O-N 2.91Å; S64-A67 PolarHBondContact O-N 2.93Å; A67-E70 PolarHBondContact O-N 3.2Å; A67-A71 WeakPolarHBondContact O-CB 3.34Å; A67-A71 PolarHBondContact O-N 2.8Å
68L83.1Confident82Confident65 Ų6578.9 Ų78.934%0.3444%0.44SS..Hα-helixtrans-67-45.1176.4-169.665.6000111.8S64 L65 L66 E70 A71 V72 M180S64-L68 WeakPolarHBondContact O-CB 3.5Å; S64-L68 PolarHBondContact O-N 3.47Å; L65-L68 WeakPolarHBondContact O-CB 3.21Å; L65-L68 PolarHBondContact O-N 2.82Å; L66-L68 VanDerWaalsContact C-N 3.31Å; L66-L68 PolarHBondContact O-N 2.94Å; L68-E70 VanDerWaalsContact C-N 3.33Å; L68-E70 PolarHBondContact O-N 2.7Å; L68-A71 PolarHBondContact O-N 3.26Å; L68-V72 WeakPolarHBondContact O-CG2 3.23Å; L68-V72 PolarHBondContact O-N 3.25Å; L68-M180 HydrophobicContact CD1-CE 3.88Å; L68-M180 HydrophobicContact CD1-SD 4.32Å; L68-M180 HydrophobicContact CD2-CE 4.17Å; L68-M180 HydrophobicContact CD2-CG 4.06Å; L68-M180 HydrophobicContact CD2-SD 3.48Å; L68-M180 WeakPolarHBondContact CD2-SD 3.37Å; L68-M180 HydrophobicContact CG-CE 4.26Å; L68-M180 HydrophobicContact CG-CG 4.46Å; L68-M180 HydrophobicContact CG-SD 4.15Å
69I81.6Confident81.8Confident93 Ų9378.1 Ų78.148%0.47743%0.432SS..Hα-helixtrans-60.3-45.6174.9-69.9165.6000110L65 L66 A71 V72 I73L65-I69 VanDerWaalsContact O-CG1 3.27Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 3.39Å; L66-I69 PolarHBondContact O-N 3.08Å; I69-A71 VanDerWaalsContact C-N 3.33Å; I69-A71 PolarHBondContact O-N 3.26Å; I69-V72 PolarHBondContact O-N 2.97Å; I69-I73 HydrophobicContact CG2-CD1 3.66Å; I69-I73 HydrophobicContact CG2-CG1 4.27Å; I69-I73 VanDerWaalsContact O-CG1 3.29Å; I69-I73 WeakPolarHBondContact O-CG1 3.3Å; I69-I73 PolarHBondContact O-N 3.28Å
70E86.1Confident81.6Confident93 Ų9375.3 Ų75.344%0.43543%0.429SS..Hα-helixtrans-60.5-42.5177.5-175175.4-166.400111.8L66 A67 L68 V72 I73 R74L66-E70 WeakPolarHBondContact O-CB 3.45Å; L66-E70 PolarHBondContact O-N 3.18Å; A67-E70 PolarHBondContact O-N 3.2Å; L68-E70 VanDerWaalsContact C-N 3.33Å; L68-E70 PolarHBondContact O-N 2.7Å; E70-V72 PolarHBondContact O-N 3.31Å; E70-I73 PolarHBondContact O-N 3.5Å; E70-R74 WeakPolarHBondContact O-CG 3.48Å; E70-R74 PolarHBondContact O-N 3.05Å; E70-R74 IonicContact OE1-CZ 2.63Å; E70-R74 IonicContact OE1-NE 2.92Å; E70-R74 PolarHBondContact OE1-NE 3.45Å; E70-R74 IonicContact OE1-NH2 3.43Å; E70-R74 PolarHBondContact OE1-NH2 3.25Å
71A81.1Confident81.8Confident57 Ų5779.9 Ų79.947%0.47144%0.439SS..Hα-helixtrans-61.5-43.3175.500000112A67 L68 I69 R74 F75A67-A71 WeakPolarHBondContact O-CB 3.34Å; A67-A71 PolarHBondContact O-N 2.8Å; L68-A71 PolarHBondContact O-N 3.26Å; I69-A71 VanDerWaalsContact C-N 3.33Å; I69-A71 PolarHBondContact O-N 3.26Å; A71-R74 PolarHBondContact O-N 3.35Å; A71-F75 WeakPolarHBondContact O-CB 3.48Å; A71-F75 PolarHBondContact O-N 3.25Å
72V81.3Confident81.5Confident26 Ų2681.1 Ų81.116%0.15845%0.452CS..Hα-helixtrans-63.9-45.5175.6174.10000110.8L68 I69 E70 R74 F75 T76 L177L68-V72 WeakPolarHBondContact O-CG2 3.23Å; L68-V72 PolarHBondContact O-N 3.25Å; I69-V72 PolarHBondContact O-N 2.97Å; E70-V72 PolarHBondContact O-N 3.31Å; V72-R74 PolarHBondContact O-N 2.68Å; V72-F75 PolarHBondContact O-N 3.5Å; V72-T76 HydrophobicContact CG1-CG2 4.15Å; V72-T76 WeakPolarHBondContact O-CG2 3.48Å; V72-T76 PolarHBondContact O-N 3.05Å; V72-T76 PolarHBondContact O-OG1 2.94Å; V72-L177 HydrophobicContact CG1-CD2 3.89Å; V72-L177 HydrophobicContact CG1-CG 4.28Å
73I82.4Confident81.3Confident91 Ų9176.4 Ų76.447%0.46743%0.427SS..Hα-helixtrans-58.9-48.9177.6-69.4168.4000110.3I69 E70 F75 T76 C77I69-I73 HydrophobicContact CG2-CD1 3.66Å; I69-I73 HydrophobicContact CG2-CG1 4.27Å; I69-I73 VanDerWaalsContact O-CG1 3.29Å; I69-I73 WeakPolarHBondContact O-CG1 3.3Å; I69-I73 PolarHBondContact O-N 3.28Å; E70-I73 PolarHBondContact O-N 3.5Å; I73-F75 VanDerWaalsContact C-N 3.31Å; I73-F75 PolarHBondContact O-N 2.91Å; I73-T76 WeakPolarHBondContact CA-OG1 3.48Å; I73-T76 PolarHBondContact O-N 3.5Å; I73-T76 PolarHBondContact O-OG1 2.89Å; I73-C77 WeakPolarHBondContact O-CB 3.49Å; I73-C77 PolarHBondContact O-N 2.96Å
74R82.8Confident81Confident167 Ų16774.1 Ų74.163%0.6342%0.42SS*.Hα-helixtrans-60.4-40.9178.2-71.4-179.7-171.7178.31.6112.1E70 A71 V72 G78E70-R74 WeakPolarHBondContact O-CG 3.48Å; E70-R74 PolarHBondContact O-N 3.05Å; E70-R74 IonicContact OE1-CZ 2.63Å; E70-R74 IonicContact OE1-NE 2.92Å; E70-R74 PolarHBondContact OE1-NE 3.45Å; E70-R74 IonicContact OE1-NH2 3.43Å; E70-R74 PolarHBondContact OE1-NH2 3.25Å; A71-R74 PolarHBondContact O-N 3.35Å; V72-R74 PolarHBondContact O-N 2.68Å; R74-G78 PolarHBondContact O-N 3.27Å
75F80.1Confident81Confident136 Ų13674.8 Ų74.860%0.59642%0.422SS*.Hα-helixtrans-62.7-46.5175.8-177.4-99.2000111.8A71 V72 I73 G78 G79A71-F75 WeakPolarHBondContact O-CB 3.48Å; A71-F75 PolarHBondContact O-N 3.25Å; V72-F75 PolarHBondContact O-N 3.5Å; I73-F75 VanDerWaalsContact C-N 3.31Å; I73-F75 PolarHBondContact O-N 2.91Å; F75-G78 PolarHBondContact O-N 3.45Å; F75-G79 PolarHBondContact O-N 2.95Å
76T77.9Confident80.8Confident38 Ų3877.3 Ų77.323%0.23344%0.435CS..Hα-helixtrans-63.9-45.7178.961.40000112.3V72 I73 G78 G79 L80 V173V72-T76 HydrophobicContact CG1-CG2 4.15Å; V72-T76 WeakPolarHBondContact O-CG2 3.48Å; V72-T76 PolarHBondContact O-N 3.05Å; V72-T76 PolarHBondContact O-OG1 2.94Å; I73-T76 WeakPolarHBondContact CA-OG1 3.48Å; I73-T76 PolarHBondContact O-N 3.5Å; I73-T76 PolarHBondContact O-OG1 2.89Å; T76-G78 PolarHBondContact O-N 2.94Å; T76-G79 PolarHBondContact O-N 3.34Å; T76-L80 WeakPolarHBondContact O-CB 3.15Å; T76-L80 PolarHBondContact O-N 2.92Å; T76-V173 HydrophobicContact CG2-CB 4.23Å; T76-V173 HydrophobicContact CG2-CG1 3.57Å; T76-V173 HydrophobicContact CG2-CG2 3.7Å
77C80.5Confident80.5Confident71 Ų7175.2 Ų75.248%0.4842%0.424SS..Hα-helixtrans-63-41.9176.3-74.80000111.5I73 L80 Q81I73-C77 WeakPolarHBondContact O-CB 3.49Å; I73-C77 PolarHBondContact O-N 2.96Å; C77-L80 PolarHBondContact O-N 2.94Å; C77-Q81 VanDerWaalsContact O-CB 3.31Å; C77-Q81 WeakPolarHBondContact O-CB 3.3Å; C77-Q81 PolarHBondContact O-N 3.39Å
78G79.8Confident80.2Confident39 Ų3981.2 Ų81.240%0.40244%0.436SS..Hα-helixtrans-61.7-44.3175.400000112.5R74 F75 T76 Q81 A82R74-G78 PolarHBondContact O-N 3.27Å; F75-G78 PolarHBondContact O-N 3.45Å; T76-G78 PolarHBondContact O-N 2.94Å; G78-Q81 PolarHBondContact O-N 2.86Å; G78-A82 PolarHBondContact O-N 2.89Å
79G76.9Confident79.8Confident20 Ų2081.9 Ų81.921%0.20645%0.446CS..Hα-helixtrans-62.9-43.3174.900000112.9F75 T76 A82 L83F75-G79 PolarHBondContact O-N 2.95Å; T76-G79 PolarHBondContact O-N 3.34Å; G79-A82 PolarHBondContact O-N 3.49Å; G79-L83 PolarHBondContact O-N 3.48Å
80L79.4Confident79.4Confident100 Ų10079.9 Ų79.952%0.52444%0.439SS..Hα-helixtrans-65.8-40.2177.7-167.371.9000111.7T76 C77 L83 C84T76-L80 WeakPolarHBondContact O-CB 3.15Å; T76-L80 PolarHBondContact O-N 2.92Å; C77-L80 PolarHBondContact O-N 2.94Å; L80-L83 HydrophobicContact CD1-CD2 4.5Å; L80-L83 WeakPolarHBondContact O-CB 3.33Å; L80-L83 PolarHBondContact O-N 3.48Å; L80-C84 PolarHBondContact O-N 2.98Å
81Q82Confident78.9Confident138 Ų13878.9 Ų78.965%0.64544%0.442SS*.Hα-helixtrans-64-43176.2-173.7168.8-8.600111.3C77 G78 L83 C84 T85C77-Q81 VanDerWaalsContact O-CB 3.31Å; C77-Q81 WeakPolarHBondContact O-CB 3.3Å; C77-Q81 PolarHBondContact O-N 3.39Å; G78-Q81 PolarHBondContact O-N 2.86Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.92Å; Q81-C84 PolarHBondContact O-N 2.98Å; Q81-T85 WeakPolarHBondContact O-CG2 3.45Å; Q81-T85 PolarHBondContact O-N 3.36Å; Q81-T85 PolarHBondContact O-OG1 3.42Å
82A76.1Confident78.6Confident48 Ų4879 Ų7940%0.39744%0.439SS..Hα-helixtrans-59.7-43.4173.500000111.7G78 G79 C84 T85 L86G78-A82 PolarHBondContact O-N 2.89Å; G79-A82 PolarHBondContact O-N 3.49Å; A82-C84 PolarHBondContact O-N 2.69Å; A82-T85 WeakPolarHBondContact CA-OG1 3.29Å; A82-T85 PolarHBondContact O-N 3.46Å; A82-T85 PolarHBondContact O-OG1 3.39Å; A82-L86 PolarHBondContact O-N 2.9Å
83L79.7Confident78.2Confident20 Ų2079.2 Ų79.211%0.10545%0.447CS..Hα-helixtrans-60.5-45.6175.4-175.569.2000112G79 L80 Q81 T85 L86 L87 L165 V166 L169G79-L83 PolarHBondContact O-N 3.48Å; L80-L83 HydrophobicContact CD1-CD2 4.5Å; L80-L83 WeakPolarHBondContact O-CB 3.33Å; L80-L83 PolarHBondContact O-N 3.48Å; Q81-L83 VanDerWaalsContact C-N 3.33Å; Q81-L83 PolarHBondContact O-N 2.92Å; L83-T85 VanDerWaalsContact C-N 3.31Å; L83-T85 PolarHBondContact O-N 2.89Å; L83-L86 PolarHBondContact O-N 2.9Å; L83-L87 HydrophobicContact CG-CD1 4.25Å; L83-L87 WeakPolarHBondContact O-CB 3.49Å; L83-L87 PolarHBondContact O-N 2.79Å; L83-L165 HydrophobicContact CD1-CD2 3.41Å; L83-L165 VanDerWaalsContact CD1-CD2 3.41Å; L83-L165 HydrophobicContact CD1-CG 3.91Å; L83-V166 HydrophobicContact CD2-CG2 4.17Å; L83-L169 HydrophobicContact CD2-CD2 4.21Å
84C78.7Confident77.6Confident72 Ų7279.6 Ų79.649%0.48645%0.449SS..Hα-helixtrans-59.8-40.6175.8-78.30000112L80 Q81 A82 L87 Y88L80-C84 PolarHBondContact O-N 2.98Å; Q81-C84 PolarHBondContact O-N 2.98Å; A82-C84 PolarHBondContact O-N 2.69Å; C84-L87 PolarHBondContact O-N 3.4Å; C84-Y88 WeakPolarHBondContact O-CB 3.48Å; C84-Y88 PolarHBondContact O-N 3.15Å
85T80Confident77.2Confident85 Ų8578.2 Ų78.252%0.52145%0.45SS..Hα-helixtrans-67.2-37.7177.157.60000112.8Q81 A82 L83 Y88 S89Q81-T85 WeakPolarHBondContact O-CG2 3.45Å; Q81-T85 PolarHBondContact O-N 3.36Å; Q81-T85 PolarHBondContact O-OG1 3.42Å; A82-T85 WeakPolarHBondContact CA-OG1 3.29Å; A82-T85 PolarHBondContact O-N 3.46Å; A82-T85 PolarHBondContact O-OG1 3.39Å; L83-T85 VanDerWaalsContact C-N 3.31Å; L83-T85 PolarHBondContact O-N 2.89Å; T85-Y88 PolarHBondContact O-N 2.98Å; T85-S89 WeakPolarHBondContact O-CB 3.33Å; T85-S89 PolarHBondContact O-N 2.98Å
86L78.6Confident76.9Confident101 Ų10175.1 Ų75.153%0.52945%0.445SS..Hα-helixtrans-64.8-44.7174-83.2164.5000111.5A82 L83 S89 C90 L165A82-L86 PolarHBondContact O-N 2.9Å; L83-L86 PolarHBondContact O-N 2.9Å; L86-S89 PolarHBondContact O-N 3.34Å; L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 2.99Å; L86-L165 HydrophobicContact CD1-CD2 4Å
87L78.1Confident76.4Confident63 Ų6376 Ų7633%0.3345%0.448SS..Hα-helixtrans-59.1-47.3174.5-86.1165.5000111.5L83 C84 S89 C90 C91 L162L83-L87 HydrophobicContact CG-CD1 4.25Å; L83-L87 WeakPolarHBondContact O-CB 3.49Å; L83-L87 PolarHBondContact O-N 2.79Å; C84-L87 PolarHBondContact O-N 3.4Å; L87-S89 VanDerWaalsContact C-N 3.35Å; L87-S89 PolarHBondContact O-N 2.97Å; L87-C90 WeakPolarHBondContact O-CB 3.45Å; L87-C90 PolarHBondContact O-N 3.5Å; L87-C91 PolarHBondContact O-N 3.11Å; L87-C91 PolarHBondContact O-SG 3.28Å; L87-C91 VanDerWaalsContact O-SG 3.33Å; L87-L162 HydrophobicContact CD2-CD1 3.37Å; L87-L162 HydrophobicContact CD2-CD2 3.91Å; L87-L162 HydrophobicContact CD2-CG 4.25Å; L87-L162 HydrophobicContact CG-CD1 3.89Å
88Y78.6Confident76.1Confident183 Ų18379.6 Ų79.672%0.71846%0.455SS*.Hα-helixtrans-60.7-43.6177.3-174.8-95.8000112C84 T85 C90 C91 S92C84-Y88 WeakPolarHBondContact O-CB 3.48Å; C84-Y88 PolarHBondContact O-N 3.15Å; T85-Y88 PolarHBondContact O-N 2.98Å; Y88-C90 VanDerWaalsContact C-N 3.32Å; Y88-C90 PolarHBondContact O-N 2.9Å; Y88-C91 PolarHBondContact O-N 3.25Å; Y88-S92 PolarHBondContact O-N 3.26Å
89S74.9Confident76Confident79 Ų7983.4 Ų83.455%0.55247%0.466SS*.Hα-helixtrans-61.5-39.8174.8-179.20000112.1T85 L86 L87 S92 G93T85-S89 WeakPolarHBondContact O-CB 3.33Å; T85-S89 PolarHBondContact O-N 2.98Å; L86-S89 PolarHBondContact O-N 3.34Å; L87-S89 VanDerWaalsContact C-N 3.35Å; L87-S89 PolarHBondContact O-N 2.97Å; S89-S92 PolarHBondContact O-N 3.33Å; S89-G93 PolarHBondContact O-N 3.18Å
90C73.3Confident75.8Confident50 Ų5087.8 Ų87.834%0.33848%0.484SS..Hα-helixtrans-65.5-43.2175.6-164.70000112L86 L87 Y88 S92 G93 L94 S158L86-C90 WeakPolarHBondContact O-CB 3.49Å; L86-C90 PolarHBondContact O-N 2.99Å; L87-C90 WeakPolarHBondContact O-CB 3.45Å; L87-C90 PolarHBondContact O-N 3.5Å; Y88-C90 VanDerWaalsContact C-N 3.32Å; Y88-C90 PolarHBondContact O-N 2.9Å; C90-S92 PolarHBondContact O-N 3.15Å; C90-G93 WeakPolarHBondContact O-CA 3.28Å; C90-G93 PolarHBondContact O-N 3.38Å; C90-G93 VanDerWaalsContact O-N 3.15Å; C90-L94 PolarHBondContact O-N 3.38Å; C90-S158 PolarHBondContact SG-OG 3.45Å
91C74.4Confident75.5Confident72 Ų7285 Ų8549%0.48648%0.479SS..Hα-helixtrans-60.7-42.3174.5-70.10000112.1L87 Y88 G93 L94 E95L87-C91 PolarHBondContact O-N 3.11Å; L87-C91 PolarHBondContact O-SG 3.28Å; L87-C91 VanDerWaalsContact O-SG 3.33Å; Y88-C91 PolarHBondContact O-N 3.25Å; C91-G93 VanDerWaalsContact C-N 3.31Å; C91-G93 PolarHBondContact O-N 2.97Å; C91-L94 WeakPolarHBondContact O-CB 3.36Å; C91-L94 PolarHBondContact O-N 3.49Å; C91-L94 VanDerWaalsContact O-N 3.1Å; C91-E95 PolarHBondContact O-N 3.49Å
92S75.2Confident75.2Confident59 Ų5983.9 Ų83.941%0.41347%0.474SS..Hα-helixtrans-63.9-37.3174.5-172.70000111.9Y88 S89 C90 L94 E95 S96Y88-S92 PolarHBondContact O-N 3.26Å; S89-S92 PolarHBondContact O-N 3.33Å; C90-S92 PolarHBondContact O-N 3.15Å; S92-L94 VanDerWaalsContact C-N 3.33Å; S92-L94 PolarHBondContact O-N 3.37Å; S92-E95 WeakPolarHBondContact O-CB 3.4Å; S92-E95 PolarHBondContact O-N 2.97Å; S92-S96 PolarHBondContact O-N 2.71Å; S92-S96 VanDerWaalsContact O-N 3.09Å
93G72.9Confident75.2Confident31 Ų3187.5 Ų87.532%0.3249%0.486SS..Hα-helixtrans-57.3-42.8168.800000112.9S89 C90 C91 E95 S96 L97S89-G93 PolarHBondContact O-N 3.18Å; C90-G93 WeakPolarHBondContact O-CA 3.28Å; C90-G93 PolarHBondContact O-N 3.38Å; C90-G93 VanDerWaalsContact O-N 3.15Å; C91-G93 VanDerWaalsContact C-N 3.31Å; C91-G93 PolarHBondContact O-N 2.97Å; G93-E95 VanDerWaalsContact C-N 3.34Å; G93-E95 PolarHBondContact O-N 3.48Å; G93-S96 PolarHBondContact O-N 3.48Å; G93-S96 PolarHBondContact O-OG 2.95Å; G93-L97 PolarHBondContact O-N 3.42Å; G93-L97 VanDerWaalsContact O-N 3.13Å
94L69.9Low74.7Confident100 Ų10089.6 Ų89.652%0.52451%0.507SS..Hα-helixtrans-65.3-34.7175.7-70.2168.5000112.8C90 C91 S92 L97 K98C90-L94 PolarHBondContact O-N 3.38Å; C91-L94 WeakPolarHBondContact O-CB 3.36Å; C91-L94 PolarHBondContact O-N 3.49Å; C91-L94 VanDerWaalsContact O-N 3.1Å; S92-L94 VanDerWaalsContact C-N 3.33Å; S92-L94 PolarHBondContact O-N 3.37Å; L94-L97 HydrophobicContact CD2-CD1 4.4Å; L94-L97 VanDerWaalsContact O-CB 3.28Å; L94-L97 WeakPolarHBondContact O-CB 3.27Å; L94-L97 PolarHBondContact O-N 3.32Å; L94-K98 PolarHBondContact O-N 3.09Å
95E74.8Confident74.5Confident137 Ų13788.6 Ų88.664%0.6450%0.5SS*.Hα-helixtrans-64.6-40.4172.9-71.7-174.6156.300112C91 S92 G93 L97 K98 L99C91-E95 PolarHBondContact O-N 3.49Å; S92-E95 WeakPolarHBondContact O-CB 3.4Å; S92-E95 PolarHBondContact O-N 2.97Å; G93-E95 VanDerWaalsContact C-N 3.34Å; G93-E95 PolarHBondContact O-N 3.48Å; E95-L97 PolarHBondContact O-N 3.46Å; E95-K98 VanDerWaalsContact O-CB 3.3Å; E95-K98 WeakPolarHBondContact O-CB 3.4Å; E95-K98 PolarHBondContact O-N 3.05Å; E95-K98 VanDerWaalsContact O-N 3.09Å; E95-L99 PolarHBondContact O-N 3.24Å; E95-L99 VanDerWaalsContact O-N 3.17Å
96S72.5Confident74.1Confident71 Ų7191.1 Ų91.150%0.49751%0.506SS..Hα-helixtrans-63.3-32173.970.20000112.8S92 G93 L99 L100S92-S96 PolarHBondContact O-N 2.71Å; S92-S96 VanDerWaalsContact O-N 3.09Å; G93-S96 PolarHBondContact O-N 3.48Å; G93-S96 PolarHBondContact O-OG 2.95Å; S96-L99 WeakPolarHBondContact O-CB 3.22Å; S96-L99 PolarHBondContact O-N 2.91Å; S96-L100 PolarHBondContact O-N 3.24Å
97L68Low73.8Confident57 Ų5788.2 Ų88.230%0.29850%0.5SS..Hα-helixtrans-67.6-34.8172.3-104152.4000112.8G93 L94 E95 L99 L100 G101 L151G93-L97 PolarHBondContact O-N 3.42Å; G93-L97 VanDerWaalsContact O-N 3.13Å; L94-L97 HydrophobicContact CD2-CD1 4.4Å; L94-L97 VanDerWaalsContact O-CB 3.28Å; L94-L97 WeakPolarHBondContact O-CB 3.27Å; L94-L97 PolarHBondContact O-N 3.32Å; E95-L97 PolarHBondContact O-N 3.46Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L100 WeakPolarHBondContact O-CB 3.45Å; L97-L100 PolarHBondContact O-N 2.92Å; L97-G101 PolarHBondContact O-N 3.38Å; L97-L151 HydrophobicContact CD2-CD2 3.22Å
98K75.5Confident73.3Confident146 Ų14687.9 Ų87.964%0.63551%0.506SS*.Hα-helixtrans-64.1-40.1173.1-167.2177.2-179.2174.60111.6L94 E95 G101 H102L94-K98 PolarHBondContact O-N 3.09Å; E95-K98 VanDerWaalsContact O-CB 3.3Å; E95-K98 WeakPolarHBondContact O-CB 3.4Å; E95-K98 PolarHBondContact O-N 3.05Å; E95-K98 VanDerWaalsContact O-N 3.09Å; K98-G101 PolarHBondContact O-N 2.91Å; K98-H102 PolarHBondContact O-CD2 3.35Å; K98-H102 PolarHBondContact O-N 3.29Å
99L76.3Confident72.9Confident119 Ų11984.1 Ų84.162%0.62350%0.499SS*.Hα-helixtrans-62.1-43172.6-106.6151.5000112E95 S96 L97 G101 H102 L103E95-L99 PolarHBondContact O-N 3.24Å; E95-L99 VanDerWaalsContact O-N 3.17Å; S96-L99 WeakPolarHBondContact O-CB 3.22Å; S96-L99 PolarHBondContact O-N 2.91Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L99-G101 VanDerWaalsContact C-N 3.3Å; L99-G101 PolarHBondContact O-N 3.13Å; L99-H102 PolarHBondContact O-N 3.05Å; L99-L103 PolarHBondContact O-N 2.97Å
100L73.1Confident72.8Confident112 Ų11288.9 Ų88.959%0.58650%0.504SS*.Hα-helixtrans-61.8-38.6173.6-167.768.8000111.7S96 L97 L103 A104S96-L100 PolarHBondContact O-N 3.24Å; L97-L100 WeakPolarHBondContact O-CB 3.45Å; L97-L100 PolarHBondContact O-N 2.92Å; L100-L103 WeakPolarHBondContact O-CB 3.36Å; L100-L103 PolarHBondContact O-N 3.45Å; L100-A104 WeakPolarHBondContact O-CB 3.26Å; L100-A104 PolarHBondContact O-N 3.36Å
101G73.9Confident72.2Confident41 Ų4189.7 Ų89.742%0.42351%0.51SS..Hα-helixtrans-62.7-43.2173.600000113.1L97 K98 L99 A104 S105L97-G101 PolarHBondContact O-N 3.38Å; K98-G101 PolarHBondContact O-N 2.91Å; L99-G101 VanDerWaalsContact C-N 3.3Å; L99-G101 PolarHBondContact O-N 3.13Å; G101-A104 PolarHBondContact O-N 3.35Å; G101-S105 PolarHBondContact O-N 2.93Å
102H75.3Confident71.8Confident116 Ų11695.1 Ų95.154%0.53752%0.521SS..Hα-helixtrans-63-43.1173.9-81.4-60.3000112K98 L99 A104 S105 H106K98-H102 PolarHBondContact O-CD2 3.35Å; K98-H102 PolarHBondContact O-N 3.29Å; L99-H102 PolarHBondContact O-N 3.05Å; H102-A104 PolarHBondContact O-N 3.36Å; H102-S105 PolarHBondContact O-N 3.35Å; H102-S105 PolarHBondContact O-OG 2.89Å; H102-H106 PolarHBondContact O-N 3.36Å
103L74.8Confident71.4Confident123 Ų12398.4 Ų98.464%0.64453%0.53SS*.Hα-helixtrans-59.2-44.3173.8-105.6155.3000112.3L99 L100 H106 G107L99-L103 PolarHBondContact O-N 2.97Å; L100-L103 WeakPolarHBondContact O-CB 3.36Å; L100-L103 PolarHBondContact O-N 3.45Å; L103-H106 PolarHBondContact O-N 3.44Å; L103-G107 PolarHBondContact O-N 3.18Å
104A70.9Confident71Confident65 Ų65102.3 Ų102.354%0.53754%0.542SS..Hα-helixtrans-63.8-41176.100000112L100 G101 H102 G107 A108L100-A104 WeakPolarHBondContact O-CB 3.26Å; L100-A104 PolarHBondContact O-N 3.36Å; G101-A104 PolarHBondContact O-N 3.35Å; H102-A104 PolarHBondContact O-N 3.36Å; A104-G107 PolarHBondContact O-N 2.94Å; A104-A108 WeakPolarHBondContact O-CB 3.41Å; A104-A108 PolarHBondContact O-N 3.3Å
105S73.3Confident70.6Confident51 Ų51101.4 Ų101.436%0.35754%0.537SS..Hα-helixtrans-65-39.8177.274.90000112.5G101 H102 A108 L109G101-S105 PolarHBondContact O-N 2.93Å; H102-S105 PolarHBondContact O-N 3.35Å; H102-S105 PolarHBondContact O-OG 2.89Å; S105-A108 PolarHBondContact O-N 3.26Å; S105-L109 PolarHBondContact O-N 3.15Å
106H72.3Confident70Confident137 Ų137100.9 Ų100.963%0.63453%0.534SS*.Hα-helixtrans-66.8-39.8173.9-109.8-80.8000111.5H102 L103 A108 L109 R110H102-H106 PolarHBondContact O-N 3.36Å; L103-H106 PolarHBondContact O-N 3.44Å; H106-A108 VanDerWaalsContact C-N 3.34Å; H106-L109 PolarHBondContact O-N 3.34Å; H106-R110 WeakPolarHBondContact O-CB 3.41Å; H106-R110 PolarHBondContact O-N 2.83Å
107G72.1Confident69.6Low40 Ų40107.1 Ų107.141%0.41255%0.547SS..Hα-helixtrans-59.1-44.2172.600000112.1L103 A104 R110 S111L103-G107 PolarHBondContact O-N 3.18Å; A104-G107 PolarHBondContact O-N 2.94Å; G107-R110 PolarHBondContact O-N 3.07Å; G107-S111 WeakPolarHBondContact O-CB 3.23Å; G107-S111 PolarHBondContact O-N 3.33Å; G107-S111 PolarHBondContact O-OG 3.31Å
108A67.9Low69.4Low56 Ų56105.9 Ų105.946%0.46355%0.548SS..Hα-helixtrans-68.2-41.2179.200000113.2A104 S105 H106 S111 R112A104-A108 WeakPolarHBondContact O-CB 3.41Å; A104-A108 PolarHBondContact O-N 3.3Å; S105-A108 PolarHBondContact O-N 3.26Å; H106-A108 VanDerWaalsContact C-N 3.34Å; A108-S111 WeakPolarHBondContact CA-OG 3.43Å; A108-S111 PolarHBondContact O-OG 2.84Å; A108-R112 WeakPolarHBondContact O-CB 3.48Å; A108-R112 PolarHBondContact O-N 3.35Å
109L70.2Confident68.5Low105 Ų105102.4 Ų102.455%0.5554%0.539SS..Hα-helixtrans-65.3-42.8174.7-80.6160.4000111.2S105 H106 R112 E113S105-L109 PolarHBondContact O-N 3.15Å; H106-L109 PolarHBondContact O-N 3.34Å; L109-R112 WeakPolarHBondContact O-CB 3.26Å; L109-R112 PolarHBondContact O-N 3.46Å; L109-E113 PolarHBondContact O-N 2.89Å
110R72.3Confident67.6Low179 Ų179102.9 Ų102.968%0.67554%0.541SS*.Hα-helixtrans-68.5-38.7178.4-165.5174.7-174.9174.81.2112.3H106 G107 R112 E113 I114H106-R110 WeakPolarHBondContact O-CB 3.41Å; H106-R110 PolarHBondContact O-N 2.83Å; G107-R110 PolarHBondContact O-N 3.07Å; R110-R112 VanDerWaalsContact C-N 3.27Å; R110-R112 PolarHBondContact O-N 3.18Å; R110-E113 PolarHBondContact O-N 3.3Å; R110-I114 HydrophobicContact CG-CD1 4.35Å; R110-I114 WeakPolarHBondContact O-CD1 3.45Å; R110-I114 VanDerWaalsContact O-CG1 3.25Å; R110-I114 WeakPolarHBondContact O-CG1 3.27Å; R110-I114 PolarHBondContact O-N 3.47Å; R110-I114 VanDerWaalsContact O-N 3.07Å
111S60.3Low66.8Low66 Ų66101.8 Ų101.846%0.46254%0.543SS..Hα-helixtrans-64.8-34.6172.9640000111.5G107 A108 I114 L115G107-S111 WeakPolarHBondContact O-CB 3.23Å; G107-S111 PolarHBondContact O-N 3.33Å; G107-S111 PolarHBondContact O-OG 3.31Å; A108-S111 WeakPolarHBondContact CA-OG 3.43Å; A108-S111 PolarHBondContact O-OG 2.84Å; S111-I114 PolarHBondContact O-N 3.1Å; S111-L115 WeakPolarHBondContact O-CB 3.33Å; S111-L115 PolarHBondContact O-N 2.79Å
112R65.9Low65.8Low187 Ų187102.7 Ų102.771%0.70654%0.54SS*.Hα-helixtrans-68.5-38.1176.5-162.1178.3-177.6-1760.4112.4A108 L109 R110 L115 H116A108-R112 WeakPolarHBondContact O-CB 3.48Å; A108-R112 PolarHBondContact O-N 3.35Å; L109-R112 WeakPolarHBondContact O-CB 3.26Å; L109-R112 PolarHBondContact O-N 3.46Å; R110-R112 VanDerWaalsContact C-N 3.27Å; R110-R112 PolarHBondContact O-N 3.18Å; R112-L115 WeakPolarHBondContact O-CB 3.44Å; R112-L115 PolarHBondContact O-N 3.33Å; R112-H116 WeakPolarHBondContact O-CB 3.33Å; R112-H116 PolarHBondContact O-N 3.21Å
113E66.9Low64.8Low128 Ų128102.7 Ų102.760%0.59855%0.548SS*.Hα-helixtrans-67-39.9172.9-80.2-178.7160.100112.8L109 R110 L115 H116 R117L109-E113 PolarHBondContact O-N 2.89Å; R110-E113 PolarHBondContact O-N 3.3Å; E113-L115 VanDerWaalsContact C-N 3.31Å; E113-H116 PolarHBondContact O-N 3.04Å; E113-R117 WeakPolarHBondContact O-CB 3.41Å; E113-R117 PolarHBondContact O-N 3.45Å
114I64.9Low63.9Low112 Ų112101.7 Ų101.757%0.57455%0.552SS**Hα-helixtrans-64.4-40.5174.1-64.5162.7000109.8R110 S111 G118R110-I114 HydrophobicContact CG-CD1 4.35Å; R110-I114 WeakPolarHBondContact O-CD1 3.45Å; R110-I114 VanDerWaalsContact O-CG1 3.25Å; R110-I114 WeakPolarHBondContact O-CG1 3.27Å; R110-I114 PolarHBondContact O-N 3.47Å; R110-I114 VanDerWaalsContact O-N 3.07Å; S111-I114 PolarHBondContact O-N 3.1Å; I114-G118 PolarHBondContact O-N 3.15Å
115L61.9Low63.2Low81 Ų81104.9 Ų104.942%0.42456%0.56SS.*Hα-helixtrans-63.3-44.1173.7-135.482.2000111.2S111 R112 E113 R117 G118 V119S111-L115 WeakPolarHBondContact O-CB 3.33Å; S111-L115 PolarHBondContact O-N 2.79Å; R112-L115 WeakPolarHBondContact O-CB 3.44Å; R112-L115 PolarHBondContact O-N 3.33Å; E113-L115 VanDerWaalsContact C-N 3.31Å; L115-R117 PolarHBondContact O-N 3.1Å; L115-G118 CarbonylContact O-C 3.55Å; L115-G118 PolarHBondContact O-N 2.97Å; L115-V119 VanDerWaalsContact O-CB 3.3Å; L115-V119 WeakPolarHBondContact O-CB 3.46Å; L115-V119 WeakPolarHBondContact O-CG2 3.33Å; L115-V119 PolarHBondContact O-N 3.47Å
116H62.3Low62.3Low127 Ų127105.1 Ų105.159%0.58857%0.57SS**Hα-helixtrans-67.6-36.9-178.4-157.9-85.4000112.2R112 E113 L120R112-H116 WeakPolarHBondContact O-CB 3.33Å; R112-H116 PolarHBondContact O-N 3.21Å; E113-H116 PolarHBondContact O-N 3.04Å; H116-L120 PolarHBondContact O-N 3.09Å
117R63Low61.7Low201 Ų201107 Ų10776%0.75858%0.579SS**Hα-helixtrans-69.7-36.1171.5-77.6-177.6176161.11.4112.5E113 L115 S121E113-R117 WeakPolarHBondContact O-CB 3.41Å; E113-R117 PolarHBondContact O-N 3.45Å; L115-R117 PolarHBondContact O-N 3.1Å; R117-S121 PolarHBondContact O-N 3.46Å; R117-S121 PolarHBondContact O-OG 3.17Å
118G63.9Low61.2Low31 Ų31108.7 Ų108.732%0.3259%0.589SS.*Hα-helixtrans-73.8-29.917500000114I114 L115 S121 V122I114-G118 PolarHBondContact O-N 3.15Å; L115-G118 CarbonylContact O-C 3.55Å; L115-G118 PolarHBondContact O-N 2.97Å; G118-S121 PolarHBondContact O-OG 3.46Å; G118-S121 VanDerWaalsContact O-OG 3.09Å; G118-V122 VanDerWaalsContact O-CB 3.24Å; G118-V122 WeakPolarHBondContact O-CB 3.47Å; G118-V122 WeakPolarHBondContact O-CG2 3.44Å; G118-V122 PolarHBondContact O-N 3.47Å
119V56.7Low61Low74 Ų74109.8 Ų109.845%0.44859%0.587SS.*Hα-helixtrans-74.2-42.6177.2167.60000110.3L115 S121 V122 V123L115-V119 VanDerWaalsContact O-CB 3.3Å; L115-V119 WeakPolarHBondContact O-CB 3.46Å; L115-V119 WeakPolarHBondContact O-CG2 3.33Å; L115-V119 PolarHBondContact O-N 3.47Å; V119-S121 VanDerWaalsContact C-N 3.29Å; V119-S121 PolarHBondContact O-N 2.64Å; V119-V122 PolarHBondContact O-N 3.25Å; V119-V122 VanDerWaalsContact O-N 3.12Å; V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CG2 3.28Å; V119-V123 PolarHBondContact O-N 2.72Å
120L57.8Low60.8Low128 Ų128110.5 Ų110.567%0.6759%0.591SS**Hα-helixtrans-66.6-26.9177.6-79.3165.8000113.7H116H116-L120 PolarHBondContact O-N 3.09Å
121S56.5Low60.7Low89 Ų89111.3 Ų111.362%0.62259%0.593SS**THydrogen-bonded Turntrans-83.5-9.3173.960.40000114.1R117 G118 V119R117-S121 PolarHBondContact O-N 3.46Å; R117-S121 PolarHBondContact O-OG 3.17Å; G118-S121 PolarHBondContact O-OG 3.46Å; G118-S121 VanDerWaalsContact O-OG 3.09Å; V119-S121 VanDerWaalsContact C-N 3.29Å; V119-S121 PolarHBondContact O-N 2.64Å
122V52.5Low61.4Low61 Ų61113.9 Ų113.937%0.3760%0.598SS.*THydrogen-bonded Turntrans-119.3-15.1-170.7172.60000113.3G118 V119 S124 N125 L129G118-V122 VanDerWaalsContact O-CB 3.24Å; G118-V122 WeakPolarHBondContact O-CB 3.47Å; G118-V122 WeakPolarHBondContact O-CG2 3.44Å; G118-V122 PolarHBondContact O-N 3.47Å; V119-V122 PolarHBondContact O-N 3.25Å; V119-V122 VanDerWaalsContact O-N 3.12Å; V122-S124 PolarHBondContact O-N 3.08Å; V122-N125 PolarHBondContact O-N 2.97Å; V122-N125 VanDerWaalsContact O-N 3.09Å; V122-L129 HydrophobicContact CG1-CD1 3.4Å; V122-L129 HydrophobicContact CG1-CD2 3.95Å; V122-L129 HydrophobicContact CG1-CG 4.19Å
123V54.5Low61.8Low115 Ų115106.7 Ų106.770%0.69758%0.579SS**THydrogen-bonded Turntrans-58.1-5.1177157.80000114.6V119V119-V123 HydrophobicContact CG1-CG2 3.88Å; V119-V123 WeakPolarHBondContact O-CG2 3.28Å; V119-V123 PolarHBondContact O-N 2.72Å
124S55.6Low62.1Low103 Ų103104.3 Ų104.372%0.7258%0.575SS**THydrogen-bonded Turntrans-82-3.7170.478.10000115.5V122V122-S124 PolarHBondContact O-N 3.08Å
125N56.6Low62.7Low132 Ų132103.3 Ų103.371%0.70657%0.571SS**SBendtrans-153.7124.6174.6-89.8-34.1000114.4V122 L129V122-N125 PolarHBondContact O-N 2.97Å; V122-N125 VanDerWaalsContact O-N 3.09Å; N125-L129 WeakPolarHBondContact O-CD1 3.37Å
126G55Low63.5Low56 Ų56103.6 Ų103.658%0.57757%0.572SS**  trans106.6116.8141.900000120.9A128 L129G126-A128 PolarHBondContact O-N 3.23Å; G126-A128 VanDerWaalsContact O-N 3.15Å; G126-L129 PolarHBondContact O-N 2.94Å; G126-L129 VanDerWaalsContact O-N 3.16Å
127H58.7Low64.1Low175 Ų175100.8 Ų100.881%0.8157%0.566SS**Hα-helixtrans-60.5-16.7170.7-152.2-63.8000114.6
128A62.1Low64.7Low76 Ų7694 Ų9463%0.62855%0.553SS**Hα-helixtrans-72.7-29.3175.400000112.8G126 R131 Q132G126-A128 PolarHBondContact O-N 3.23Å; G126-A128 VanDerWaalsContact O-N 3.15Å; A128-R131 PolarHBondContact O-N 3.26Å; A128-Q132 PolarHBondContact O-N 3.25Å
129L62.7Low65.5Low79 Ų7997.9 Ų97.941%0.41457%0.565SS.*Hα-helixtrans-76-30.3-178.1-81.5147.5000113V122 N125 G126 R131 Q132 A133V122-L129 HydrophobicContact CG1-CD1 3.4Å; V122-L129 HydrophobicContact CG1-CD2 3.95Å; V122-L129 HydrophobicContact CG1-CG 4.19Å; N125-L129 WeakPolarHBondContact O-CD1 3.37Å; G126-L129 PolarHBondContact O-N 2.94Å; G126-L129 VanDerWaalsContact O-N 3.16Å; L129-R131 VanDerWaalsContact C-N 3.28Å; L129-R131 PolarHBondContact O-N 3.42Å; L129-Q132 PolarHBondContact O-N 3.35Å; L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 2.7Å
130L66.1Low66.5Low121 Ų12196.6 Ų96.663%0.63456%0.563SS**Hα-helixtrans-66-34.9174-165.872.6000111.4C134L130-C134 PolarHBondContact O-N 2.84Å; L130-C134 PolarHBondContact O-SG 2.9Å
131R70.3Confident67.4Low195 Ų19596.9 Ų96.974%0.73656%0.562SS**Hα-helixtrans-70.1-42.9175.8-161.1154.9-167.9125.30.7111.2A128 L129 A133 C134 D135A128-R131 PolarHBondContact O-N 3.26Å; L129-R131 VanDerWaalsContact C-N 3.28Å; L129-R131 PolarHBondContact O-N 3.42Å; R131-A133 VanDerWaalsContact C-N 3.34Å; R131-A133 PolarHBondContact O-N 3.02Å; R131-C134 WeakPolarHBondContact O-CB 3.38Å; R131-C134 PolarHBondContact O-N 2.86Å; R131-C134 VanDerWaalsContact O-N 3.15Å; R131-D135 VanDerWaalsContact O-CG 3.32Å; R131-D135 PolarHBondContact O-N 2.97Å
132Q76.4Confident68.4Low120 Ų12096 Ų9656%0.56156%0.556SS**Hα-helixtrans-65.4-35.4175.1-163.1159.1-2100112.6A128 L129 D135 I136A128-Q132 PolarHBondContact O-N 3.25Å; L129-Q132 PolarHBondContact O-N 3.35Å; Q132-D135 PolarHBondContact O-N 3.07Å; Q132-I136 HydrophobicContact CG-CD1 4.45Å; Q132-I136 WeakPolarHBondContact O-CD1 3.48Å; Q132-I136 WeakPolarHBondContact O-CG1 3.49Å; Q132-I136 PolarHBondContact O-N 3.49Å
133A73.9Confident69.8Low37 Ų3798.5 Ų98.531%0.30657%0.567SS.*Hα-helixtrans-66.4-40.2171.300000112.1L129 R131 I136 C137L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 2.7Å; R131-A133 VanDerWaalsContact C-N 3.34Å; R131-A133 PolarHBondContact O-N 3.02Å; A133-I136 PolarHBondContact O-N 3.24Å; A133-C137 WeakPolarHBondContact O-CB 3.39Å; A133-C137 PolarHBondContact O-N 3.44Å; A133-C137 PolarHBondContact O-SG 2.94Å; A133-C137 VanDerWaalsContact O-SG 3.36Å
134C73.6Confident70.9Confident77 Ų7796.6 Ų96.652%0.5256%0.556SS.*Hα-helixtrans-62.8-41.3173.4-74.90000112.1L130 R131 C137 A138L130-C134 PolarHBondContact O-N 2.84Å; L130-C134 PolarHBondContact O-SG 2.9Å; R131-C134 WeakPolarHBondContact O-CB 3.38Å; R131-C134 PolarHBondContact O-N 2.86Å; R131-C134 VanDerWaalsContact O-N 3.15Å; C134-C137 PolarHBondContact O-N 3.33Å; C134-A138 WeakPolarHBondContact O-CB 3.3Å; C134-A138 PolarHBondContact O-N 3.32Å
135D77Confident71.9Confident91 Ų9194.4 Ų94.449%0.48754%0.544SS..Hα-helixtrans-64.8-42.2177.5-66.8-26.7000111.2R131 Q132 A138 I139R131-D135 VanDerWaalsContact O-CG 3.32Å; R131-D135 PolarHBondContact O-N 2.97Å; Q132-D135 PolarHBondContact O-N 3.07Å; D135-A138 PolarHBondContact O-N 3.39Å; D135-I139 WeakPolarHBondContact O-CD1 3.37Å; D135-I139 WeakPolarHBondContact O-CG1 3.37Å; D135-I139 PolarHBondContact O-N 3.31Å
136I78.8Confident73.1Confident87 Ų8795.7 Ų95.745%0.44654%0.54SS..Hα-helixtrans-63.6-42.2174.8-67.2164.8000111.1Q132 A133 I139 A140Q132-I136 HydrophobicContact CG-CD1 4.45Å; Q132-I136 WeakPolarHBondContact O-CD1 3.48Å; Q132-I136 WeakPolarHBondContact O-CG1 3.49Å; Q132-I136 PolarHBondContact O-N 3.49Å; A133-I136 PolarHBondContact O-N 3.24Å; I136-I139 PolarHBondContact O-N 2.85Å; I136-A140 WeakPolarHBondContact O-CB 3.3Å; I136-A140 PolarHBondContact O-N 3.45Å
137C74.9Confident74.3Confident68 Ų6896.5 Ų96.546%0.45953%0.533SS..Hα-helixtrans-64.5-40.3175.1-750000112A133 C134 A140 M141A133-C137 WeakPolarHBondContact O-CB 3.39Å; A133-C137 PolarHBondContact O-N 3.44Å; A133-C137 PolarHBondContact O-SG 2.94Å; A133-C137 VanDerWaalsContact O-SG 3.36Å; C134-C137 PolarHBondContact O-N 3.33Å; C137-A140 PolarHBondContact O-N 3.38Å; C137-M141 WeakPolarHBondContact O-CB 3.5Å; C137-M141 VanDerWaalsContact O-CG 3.28Å; C137-M141 WeakPolarHBondContact O-CG 3.4Å; C137-M141 PolarHBondContact O-N 2.89Å
138A75.4Confident75.2Confident59 Ų5992.8 Ų92.849%0.48852%0.518SS..Hα-helixtrans-63-43.2175.800000111.4C134 D135 M141 S142C134-A138 WeakPolarHBondContact O-CB 3.3Å; C134-A138 PolarHBondContact O-N 3.32Å; D135-A138 PolarHBondContact O-N 3.39Å; A138-M141 PolarHBondContact O-N 3.45Å; A138-S142 WeakPolarHBondContact O-CB 3.44Å; A138-S142 PolarHBondContact O-N 2.91Å
139I80.1Confident75.9Confident112 Ų11294.4 Ų94.457%0.57452%0.517SS*.Hα-helixtrans-62-45.9174.5-66.5162000110.5D135 I136 M141 S142 L143D135-I139 WeakPolarHBondContact O-CD1 3.37Å; D135-I139 WeakPolarHBondContact O-CG1 3.37Å; D135-I139 PolarHBondContact O-N 3.31Å; I136-I139 PolarHBondContact O-N 2.85Å; I139-M141 PolarHBondContact O-N 3.32Å; I139-S142 WeakPolarHBondContact CA-OG 3.38Å; I139-S142 PolarHBondContact O-N 3.27Å; I139-S142 PolarHBondContact O-OG 3.46Å; I139-L143 PolarHBondContact O-N 2.97Å
140A79.1Confident76.8Confident48 Ų4892.9 Ų92.940%0.39751%0.513SS..Hα-helixtrans-61.4-44.117800000112.3I136 C137 S142 L143 V144I136-A140 WeakPolarHBondContact O-CB 3.3Å; I136-A140 PolarHBondContact O-N 3.45Å; C137-A140 PolarHBondContact O-N 3.38Å; A140-S142 VanDerWaalsContact C-N 3.32Å; A140-S142 PolarHBondContact O-N 3.49Å; A140-L143 PolarHBondContact O-N 2.72Å; A140-V144 WeakPolarHBondContact O-CG2 3.44Å; A140-V144 PolarHBondContact O-N 3.48Å
141M74.9Confident77.4Confident133 Ų13390.6 Ų90.666%0.65550%0.501SS*.Hα-helixtrans-64.8-37.1176.3-70-57.5-65.700112C137 A138 I139 V144 A145C137-M141 WeakPolarHBondContact O-CB 3.5Å; C137-M141 VanDerWaalsContact O-CG 3.28Å; C137-M141 WeakPolarHBondContact O-CG 3.4Å; C137-M141 PolarHBondContact O-N 2.89Å; A138-M141 PolarHBondContact O-N 3.45Å; I139-M141 PolarHBondContact O-N 3.32Å; M141-V144 PolarHBondContact O-N 3.29Å; M141-A145 WeakPolarHBondContact O-CB 3.36Å; M141-A145 PolarHBondContact O-N 3.31Å
142S78.1Confident77.8Confident71 Ų7185 Ų8550%0.49749%0.488SS..Hα-helixtrans-66.1-37.8175770000112.5A138 I139 A140 A145 Y146A138-S142 WeakPolarHBondContact O-CB 3.44Å; A138-S142 PolarHBondContact O-N 2.91Å; I139-S142 WeakPolarHBondContact CA-OG 3.38Å; I139-S142 PolarHBondContact O-N 3.27Å; I139-S142 PolarHBondContact O-OG 3.46Å; A140-S142 VanDerWaalsContact C-N 3.32Å; A140-S142 PolarHBondContact O-N 3.49Å; S142-A145 PolarHBondContact O-N 3.37Å; S142-Y146 WeakPolarHBondContact O-CB 3.41Å; S142-Y146 PolarHBondContact O-N 3.27Å
143L81.6Confident78.1Confident113 Ų11383.6 Ų83.659%0.59248%0.484SS*.Hα-helixtrans-67.1-42.3175.6-167.781.1000111.2I139 A140 Y146 V147I139-L143 PolarHBondContact O-N 2.97Å; A140-L143 PolarHBondContact O-N 2.72Å; L143-Y146 WeakPolarHBondContact O-CB 3.44Å; L143-Y146 PolarHBondContact O-N 2.89Å; L143-V147 WeakPolarHBondContact O-CG2 3.31Å; L143-V147 PolarHBondContact O-N 2.96Å
144V78.4Confident78.4Confident76 Ų7686 Ų8646%0.46149%0.491SS..Hα-helixtrans-63-45.7175.5171.50000110.6A140 M141 Y146 V147 I148A140-V144 WeakPolarHBondContact O-CG2 3.44Å; A140-V144 PolarHBondContact O-N 3.48Å; M141-V144 PolarHBondContact O-N 3.29Å; V144-Y146 VanDerWaalsContact C-N 3.31Å; V144-Y146 PolarHBondContact O-N 3.22Å; V144-V147 PolarHBondContact O-N 3.23Å; V144-I148 HydrophobicContact CG1-CD1 3.82Å; V144-I148 HydrophobicContact CG1-CG1 4.47Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 3.25Å
145A76.4Confident78.6Confident57 Ų5785.6 Ų85.647%0.47149%0.488SS..Hα-helixtrans-60.7-40.7175.600000111.9M141 S142 I148 N149M141-A145 WeakPolarHBondContact O-CB 3.36Å; M141-A145 PolarHBondContact O-N 3.31Å; S142-A145 PolarHBondContact O-N 3.37Å; A145-I148 PolarHBondContact O-N 2.97Å; A145-N149 VanDerWaalsContact O-CB 3.3Å; A145-N149 WeakPolarHBondContact O-CB 3.22Å; A145-N149 PolarHBondContact O-N 3.49Å
146Y81.6Confident78.6Confident158 Ų15886 Ų8662%0.6249%0.49SS*.Hα-helixtrans-62-44.6175.1177.3-98.6000112.4S142 L143 V144 N149 S150S142-Y146 WeakPolarHBondContact O-CB 3.41Å; S142-Y146 PolarHBondContact O-N 3.27Å; L143-Y146 WeakPolarHBondContact O-CB 3.44Å; L143-Y146 PolarHBondContact O-N 2.89Å; V144-Y146 VanDerWaalsContact C-N 3.31Å; V144-Y146 PolarHBondContact O-N 3.22Å; Y146-N149 PolarHBondContact O-N 2.7Å; Y146-S150 WeakPolarHBondContact O-CB 3.47Å; Y146-S150 PolarHBondContact O-N 2.9Å
147V80.6Confident78.8Confident73 Ų7385.8 Ų85.844%0.44249%0.489SS..Hα-helixtrans-63-47.7176.8170.70000110.7L143 V144 N149 S150 L151L143-V147 WeakPolarHBondContact O-CG2 3.31Å; L143-V147 PolarHBondContact O-N 2.96Å; V144-V147 PolarHBondContact O-N 3.23Å; V147-N149 VanDerWaalsContact C-N 3.31Å; V147-N149 PolarHBondContact O-N 3Å; V147-S150 WeakPolarHBondContact O-CB 3.33Å; V147-S150 PolarHBondContact O-N 3.24Å; V147-L151 HydrophobicContact CG1-CD1 4.14Å; V147-L151 HydrophobicContact CG1-CG 4.38Å; V147-L151 VanDerWaalsContact O-CG 3.3Å; V147-L151 WeakPolarHBondContact O-CG 3.37Å; V147-L151 PolarHBondContact O-N 3.42Å
148I76.8Confident79Confident97 Ų9784.8 Ų84.850%0.49748%0.482SS..Hα-helixtrans-59-45.2177.5-66.6167.6000110.4V144 A145 S150 L151 V152V144-I148 HydrophobicContact CG1-CD1 3.82Å; V144-I148 HydrophobicContact CG1-CG1 4.47Å; V144-I148 WeakPolarHBondContact O-CG1 3.32Å; V144-I148 PolarHBondContact O-N 3.25Å; A145-I148 PolarHBondContact O-N 2.97Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 3.41Å; I148-L151 PolarHBondContact O-N 3.46Å; I148-V152 HydrophobicContact CG2-CG2 4.4Å; I148-V152 WeakPolarHBondContact O-CG2 3.46Å; I148-V152 PolarHBondContact O-N 3.28Å
149N77.8Confident79.1Confident111 Ų11185 Ų8559%0.59448%0.478SS*.Hα-helixtrans-62.6-41178.1-167.844.7000112A145 Y146 V147 V152 N153A145-N149 VanDerWaalsContact O-CB 3.3Å; A145-N149 WeakPolarHBondContact O-CB 3.22Å; A145-N149 PolarHBondContact O-N 3.49Å; Y146-N149 PolarHBondContact O-N 2.7Å; V147-N149 VanDerWaalsContact C-N 3.31Å; V147-N149 PolarHBondContact O-N 3Å; N149-V152 PolarHBondContact O-N 2.93Å; N149-N153 VanDerWaalsContact O-CB 3.29Å; N149-N153 WeakPolarHBondContact O-CB 3.45Å; N149-N153 PolarHBondContact O-N 2.78Å
150S81.9Confident79.2Confident47 Ų4786.1 Ų86.133%0.32948%0.481SS..Hα-helixtrans-62.9-42.6175.4-169.50000111.9Y146 V147 I148 N153 I154Y146-S150 WeakPolarHBondContact O-CB 3.47Å; Y146-S150 PolarHBondContact O-N 2.9Å; V147-S150 WeakPolarHBondContact O-CB 3.33Å; V147-S150 PolarHBondContact O-N 3.24Å; I148-S150 VanDerWaalsContact C-N 3.34Å; I148-S150 PolarHBondContact O-N 3.41Å; S150-N153 PolarHBondContact O-N 2.95Å; S150-I154 WeakPolarHBondContact O-CB 3.33Å; S150-I154 WeakPolarHBondContact O-CD1 3.48Å; S150-I154 VanDerWaalsContact O-CG1 3.23Å; S150-I154 WeakPolarHBondContact O-CG1 3.29Å; S150-I154 PolarHBondContact O-N 3.34Å
151L77.7Confident79.3Confident73 Ų7388.9 Ų88.938%0.38249%0.489SS..Hα-helixtrans-64.7-45.1176.6-68.8178.5000112.7L97 V147 I148 N153 I154 C155L97-L151 HydrophobicContact CD2-CD2 3.22Å; V147-L151 HydrophobicContact CG1-CD1 4.14Å; V147-L151 HydrophobicContact CG1-CG 4.38Å; V147-L151 VanDerWaalsContact O-CG 3.3Å; V147-L151 WeakPolarHBondContact O-CG 3.37Å; V147-L151 PolarHBondContact O-N 3.42Å; I148-L151 PolarHBondContact O-N 3.46Å; L151-N153 VanDerWaalsContact C-N 3.29Å; L151-N153 PolarHBondContact O-N 2.93Å; L151-I154 PolarHBondContact O-N 2.88Å; L151-C155 WeakPolarHBondContact O-CB 3.45Å; L151-C155 PolarHBondContact O-N 3.46Å
152V79.2Confident79.6Confident77 Ų7785.4 Ų85.447%0.46747%0.472SS..Hα-helixtrans-61-42.9175.81710000110.1I148 N149 C155 L156I148-V152 HydrophobicContact CG2-CG2 4.4Å; I148-V152 WeakPolarHBondContact O-CG2 3.46Å; I148-V152 PolarHBondContact O-N 3.28Å; N149-V152 PolarHBondContact O-N 2.93Å; V152-C155 PolarHBondContact O-N 2.98Å; V152-L156 HydrophobicContact CG1-CD1 3.91Å; V152-L156 WeakPolarHBondContact O-CB 3.02Å; V152-L156 WeakPolarHBondContact O-CG 3.11Å; V152-L156 PolarHBondContact O-N 2.93Å
153N81.5Confident79.6Confident90 Ų9088.9 Ų88.948%0.48148%0.479SS..Hα-helixtrans-65-44.1178.4-161.133.3000111.9N149 S150 L151 C155 L156 I157N149-N153 VanDerWaalsContact O-CB 3.29Å; N149-N153 WeakPolarHBondContact O-CB 3.45Å; N149-N153 PolarHBondContact O-N 2.78Å; S150-N153 PolarHBondContact O-N 2.95Å; L151-N153 VanDerWaalsContact C-N 3.29Å; L151-N153 PolarHBondContact O-N 2.93Å; N153-C155 VanDerWaalsContact C-N 3.32Å; N153-C155 PolarHBondContact O-N 2.9Å; N153-L156 PolarHBondContact O-N 3.47Å; N153-I157 WeakPolarHBondContact O-CB 3.41Å; N153-I157 WeakPolarHBondContact O-CD1 3.48Å; N153-I157 WeakPolarHBondContact O-CG1 3.24Å; N153-I157 PolarHBondContact O-N 3.4Å
154I80.1Confident79.6Confident88 Ų8886.6 Ų86.645%0.45147%0.473SS..Hα-helixtrans-60.4-41.9174.5-70.2163.4000111S150 L151 I157 S158S150-I154 WeakPolarHBondContact O-CB 3.33Å; S150-I154 WeakPolarHBondContact O-CD1 3.48Å; S150-I154 VanDerWaalsContact O-CG1 3.23Å; S150-I154 WeakPolarHBondContact O-CG1 3.29Å; S150-I154 PolarHBondContact O-N 3.34Å; L151-I154 PolarHBondContact O-N 2.88Å; I154-I157 PolarHBondContact O-N 3.45Å; I154-S158 VanDerWaalsContact O-CB 3.26Å; I154-S158 WeakPolarHBondContact O-CB 3.22Å; I154-S158 PolarHBondContact O-N 2.87Å
155C78.2Confident79.8Confident69 Ų6986.5 Ų86.547%0.46647%0.469SS..Hα-helixtrans-66.9-42.3178.7-165.50000112L151 V152 N153 S158 T159L151-C155 WeakPolarHBondContact O-CB 3.45Å; L151-C155 PolarHBondContact O-N 3.46Å; V152-C155 PolarHBondContact O-N 2.98Å; N153-C155 VanDerWaalsContact C-N 3.32Å; N153-C155 PolarHBondContact O-N 2.9Å; C155-S158 PolarHBondContact O-N 3.3Å; C155-T159 WeakPolarHBondContact O-CB 3.41Å; C155-T159 WeakPolarHBondContact O-CG2 3.41Å; C155-T159 PolarHBondContact O-N 3.22Å; C155-T159 PolarHBondContact O-OG1 2.89Å
156L77.4Confident80Confident99 Ų9986.8 Ų86.852%0.51847%0.465SS..Hα-helixtrans-62.4-45.9174.5-82166.1000111.9V152 N153 S158 T159 Q160V152-L156 HydrophobicContact CG1-CD1 3.91Å; V152-L156 WeakPolarHBondContact O-CB 3.02Å; V152-L156 WeakPolarHBondContact O-CG 3.11Å; V152-L156 PolarHBondContact O-N 2.93Å; N153-L156 PolarHBondContact O-N 3.47Å; L156-S158 VanDerWaalsContact C-N 3.34Å; L156-S158 PolarHBondContact O-N 3.41Å; L156-T159 WeakPolarHBondContact CA-OG1 3.33Å; L156-T159 PolarHBondContact O-N 3.31Å; L156-T159 PolarHBondContact O-OG1 2.74Å; L156-Q160 VanDerWaalsContact O-CB 3.27Å; L156-Q160 WeakPolarHBondContact O-CB 3.5Å; L156-Q160 PolarHBondContact O-N 3.22Å
157I83.9Confident79.9Confident83 Ų8384.6 Ų84.643%0.42646%0.463SS..Hα-helixtrans-63.4-42.3177.5-68.1160.2000110.8N153 I154 Q160 N161N153-I157 WeakPolarHBondContact O-CB 3.41Å; N153-I157 WeakPolarHBondContact O-CD1 3.48Å; N153-I157 WeakPolarHBondContact O-CG1 3.24Å; N153-I157 PolarHBondContact O-N 3.4Å; I154-I157 PolarHBondContact O-N 3.45Å; I157-Q160 PolarHBondContact O-N 3.37Å; I157-N161 WeakPolarHBondContact O-CB 3.46Å; I157-N161 PolarHBondContact O-N 2.93Å
158S79Confident79.8Confident46 Ų4683.6 Ų83.632%0.32246%0.463SS..Hα-helixtrans-63.8-46.9177.9-173.40000112.1C90 I154 C155 L156 Q160 N161 L162C90-S158 PolarHBondContact SG-OG 3.45Å; I154-S158 VanDerWaalsContact O-CB 3.26Å; I154-S158 WeakPolarHBondContact O-CB 3.22Å; I154-S158 PolarHBondContact O-N 2.87Å; C155-S158 PolarHBondContact O-N 3.3Å; L156-S158 VanDerWaalsContact C-N 3.34Å; L156-S158 PolarHBondContact O-N 3.41Å; S158-Q160 PolarHBondContact O-N 2.88Å; S158-N161 PolarHBondContact O-N 2.85Å; S158-L162 WeakPolarHBondContact O-CB 3.46Å; S158-L162 PolarHBondContact O-N 3.32Å
159T76.1Confident80Confident65 Ų6581.1 Ų81.140%0.39945%0.45SS..Hα-helixtrans-65.3-38.617849.90000112.3C155 L156 L162 F163C155-T159 WeakPolarHBondContact O-CB 3.41Å; C155-T159 WeakPolarHBondContact O-CG2 3.41Å; C155-T159 PolarHBondContact O-N 3.22Å; C155-T159 PolarHBondContact O-OG1 2.89Å; L156-T159 WeakPolarHBondContact CA-OG1 3.33Å; L156-T159 PolarHBondContact O-N 3.31Å; L156-T159 PolarHBondContact O-OG1 2.74Å; T159-L162 WeakPolarHBondContact O-CB 3.03Å; T159-L162 PolarHBondContact O-N 2.86Å; T159-F163 PolarHBondContact O-N 3.01Å
160Q83.3Confident80.1Confident135 Ų13584.3 Ų84.363%0.63145%0.454SS*.Hα-helixtrans-67.2-40.3176.6-169170.3-2.500112.3L156 I157 S158 L162 F163 S164L156-Q160 VanDerWaalsContact O-CB 3.27Å; L156-Q160 WeakPolarHBondContact O-CB 3.5Å; L156-Q160 PolarHBondContact O-N 3.22Å; I157-Q160 PolarHBondContact O-N 3.37Å; S158-Q160 PolarHBondContact O-N 2.88Å; Q160-L162 VanDerWaalsContact C-N 3.34Å; Q160-F163 PolarHBondContact O-N 3.45Å; Q160-S164 WeakPolarHBondContact O-CB 3.44Å; Q160-S164 PolarHBondContact O-N 3.5Å; Q160-S164 PolarHBondContact O-OG 2.88Å
161N81.4Confident80.1Confident105 Ų10587.5 Ų87.556%0.56147%0.468SS*.Hα-helixtrans-66-37.6173.2-81-16.1000111.9I157 S158 S164 L165I157-N161 WeakPolarHBondContact O-CB 3.46Å; I157-N161 PolarHBondContact O-N 2.93Å; S158-N161 PolarHBondContact O-N 2.85Å; N161-S164 PolarHBondContact O-N 2.92Å; N161-L165 WeakPolarHBondContact O-CB 3.4Å; N161-L165 PolarHBondContact O-N 2.92Å
162L80.5Confident80.1Confident60 Ų6087.2 Ų87.231%0.31447%0.469SS..Hα-helixtrans-62.6-48.5175.7-164.388.1000111.5L87 S158 T159 Q160 S164 L165 V166L87-L162 HydrophobicContact CD2-CD1 3.37Å; L87-L162 HydrophobicContact CD2-CD2 3.91Å; L87-L162 HydrophobicContact CD2-CG 4.25Å; L87-L162 HydrophobicContact CG-CD1 3.89Å; S158-L162 WeakPolarHBondContact O-CB 3.46Å; S158-L162 PolarHBondContact O-N 3.32Å; T159-L162 WeakPolarHBondContact O-CB 3.03Å; T159-L162 PolarHBondContact O-N 2.86Å; Q160-L162 VanDerWaalsContact C-N 3.34Å; L162-S164 VanDerWaalsContact C-N 3.3Å; L162-S164 PolarHBondContact O-N 3.36Å; L162-L165 PolarHBondContact O-N 2.87Å; L162-V166 WeakPolarHBondContact O-CG2 3.2Å; L162-V166 PolarHBondContact O-N 3.33Å
163F78.7Confident80Confident144 Ų14485.1 Ų85.163%0.63246%0.456SS*.Hα-helixtrans-60.2-41.7176.2-98-79000111.8T159 Q160 L165 V166 L167T159-F163 PolarHBondContact O-N 3.01Å; Q160-F163 PolarHBondContact O-N 3.45Å; F163-L165 PolarHBondContact O-N 3.43Å; F163-V166 PolarHBondContact O-N 3.13Å; F163-L167 WeakPolarHBondContact O-CB 3.31Å; F163-L167 WeakPolarHBondContact O-CG 3.42Å; F163-L167 PolarHBondContact O-N 3.42Å
164S81.9Confident79.8Confident66 Ų6682.1 Ų82.146%0.46244%0.441SS..Hα-helixtrans-63.7-40.5177.2-57.20000111.9Q160 N161 L162 L167 A168Q160-S164 WeakPolarHBondContact O-CB 3.44Å; Q160-S164 PolarHBondContact O-N 3.5Å; Q160-S164 PolarHBondContact O-OG 2.88Å; N161-S164 PolarHBondContact O-N 2.92Å; L162-S164 VanDerWaalsContact C-N 3.3Å; L162-S164 PolarHBondContact O-N 3.36Å; S164-L167 PolarHBondContact O-N 3.5Å; S164-A168 WeakPolarHBondContact O-CB 3.3Å; S164-A168 PolarHBondContact O-N 2.95Å
165L82.2Confident80Confident73 Ų7379 Ų7938%0.38243%0.431SS..Hα-helixtrans-67.2-41.7176.3-176.465.4000112.1L83 L86 N161 L162 F163 A168 L169L83-L165 HydrophobicContact CD1-CD2 3.41Å; L83-L165 VanDerWaalsContact CD1-CD2 3.41Å; L83-L165 HydrophobicContact CD1-CG 3.91Å; L86-L165 HydrophobicContact CD1-CD2 4Å; N161-L165 WeakPolarHBondContact O-CB 3.4Å; N161-L165 PolarHBondContact O-N 2.92Å; L162-L165 PolarHBondContact O-N 2.87Å; F163-L165 PolarHBondContact O-N 3.43Å; L165-A168 PolarHBondContact O-N 2.91Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 PolarHBondContact O-N 3.49Å
166V79.7Confident80Confident64 Ų6478 Ų7839%0.38842%0.424SS..Hα-helixtrans-63-43.7176.1169.70000110.9L83 L162 F163 L169 W170L83-V166 HydrophobicContact CD2-CG2 4.17Å; L162-V166 WeakPolarHBondContact O-CG2 3.2Å; L162-V166 PolarHBondContact O-N 3.33Å; F163-V166 PolarHBondContact O-N 3.13Å; V166-L169 PolarHBondContact O-N 2.98Å; V166-W170 VanDerWaalsContact O-CB 3.3Å; V166-W170 WeakPolarHBondContact O-CB 3.39Å; V166-W170 PolarHBondContact O-N 3.04Å
167L80.8Confident79.9Confident112 Ų11277.1 Ų77.159%0.58642%0.419SS*.Hα-helixtrans-64.7-41.5176.2-73.4171000111.9F163 S164 W170 D171F163-L167 WeakPolarHBondContact O-CB 3.31Å; F163-L167 WeakPolarHBondContact O-CG 3.42Å; F163-L167 PolarHBondContact O-N 3.42Å; S164-L167 PolarHBondContact O-N 3.5Å; L167-W170 PolarHBondContact O-N 3.49Å; L167-D171 WeakPolarHBondContact O-CB 3.33Å; L167-D171 PolarHBondContact O-N 3.48Å
168A78.8Confident79.8Confident52 Ų5281.6 Ų81.643%0.4343%0.431SS..Hα-helixtrans-61.9-44.8174.600000111.3S164 L165 W170 D171 T172S164-A168 WeakPolarHBondContact O-CB 3.3Å; S164-A168 PolarHBondContact O-N 2.95Å; L165-A168 PolarHBondContact O-N 2.91Å; A168-W170 PolarHBondContact O-N 3.22Å; A168-D171 PolarHBondContact O-N 2.88Å; A168-T172 VanDerWaalsContact O-CG2 3.22Å; A168-T172 WeakPolarHBondContact O-CG2 3.47Å; A168-T172 PolarHBondContact O-N 3.23Å; A168-T172 PolarHBondContact O-OG1 3.41Å
169L79.7Confident79.9Confident45 Ų4588.2 Ų88.224%0.23645%0.448CS..Hα-helixtrans-62.6-44.8176.7-15579.7000110.8L83 L165 V166 D171 T172 V173L83-L169 HydrophobicContact CD2-CD2 4.21Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 PolarHBondContact O-N 3.49Å; V166-L169 PolarHBondContact O-N 2.98Å; L169-D171 VanDerWaalsContact C-N 3.35Å; L169-D171 PolarHBondContact O-N 3.29Å; L169-T172 WeakPolarHBondContact CA-OG1 3.19Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 PolarHBondContact O-OG1 2.84Å; L169-V173 VanDerWaalsContact O-CG2 3.31Å; L169-V173 WeakPolarHBondContact O-CG2 3.36Å; L169-V173 PolarHBondContact O-N 3.34Å
170W81Confident80Confident177 Ų17788 Ų8867%0.6744%0.444SS*.Hα-helixtrans-57.3-46.2176.4-179.2-91.9000112.1V166 L167 A168 V173 T174V166-W170 VanDerWaalsContact O-CB 3.3Å; V166-W170 WeakPolarHBondContact O-CB 3.39Å; V166-W170 PolarHBondContact O-N 3.04Å; L167-W170 PolarHBondContact O-N 3.49Å; A168-W170 PolarHBondContact O-N 3.22Å; W170-V173 PolarHBondContact O-N 3.43Å; W170-T174 HydrophobicContact CD2-CG2 3.91Å; W170-T174 VanDerWaalsContact CE2-CG2 3.49Å; W170-T174 HydrophobicContact CG-CG2 4.26Å; W170-T174 HydrophobicContact CH2-CG2 4.4Å; W170-T174 HydrophobicContact CZ2-CG2 3.78Å; W170-T174 WeakPolarHBondContact O-CB 3.45Å; W170-T174 WeakPolarHBondContact O-CG2 3.27Å; W170-T174 PolarHBondContact O-N 3.37Å; W170-T174 PolarHBondContact O-OG1 2.83Å
171D81.8Confident79.7Confident115 Ų11585.1 Ų85.162%0.61544%0.435SS*.Hα-helixtrans-66-40.6178-164.740.3000111.5L167 A168 L169 V173 G175L167-D171 WeakPolarHBondContact O-CB 3.33Å; L167-D171 PolarHBondContact O-N 3.48Å; A168-D171 PolarHBondContact O-N 2.88Å; L169-D171 VanDerWaalsContact C-N 3.35Å; L169-D171 PolarHBondContact O-N 3.29Å; D171-V173 PolarHBondContact O-N 2.95Å; D171-G175 PolarHBondContact O-N 3.43Å
172T76.3Confident79.9Confident66 Ų6685.1 Ų85.141%0.40544%0.435SS..Hα-helixtrans-65.4-22.8175.662.70000114.1A168 L169 P176A168-T172 VanDerWaalsContact O-CG2 3.22Å; A168-T172 WeakPolarHBondContact O-CG2 3.47Å; A168-T172 PolarHBondContact O-N 3.23Å; A168-T172 PolarHBondContact O-OG1 3.41Å; L169-T172 WeakPolarHBondContact CA-OG1 3.19Å; L169-T172 PolarHBondContact O-N 3.47Å; L169-T172 PolarHBondContact O-OG1 2.84Å; T172-P176 WeakPolarHBondContact O-CD 3.44Å; T172-P176 WeakPolarHBondContact O-CG 3.32Å
173V78.1Confident79.9Confident33 Ų3386.8 Ų86.820%0.245%0.448CS..Hα-helixtrans-93.9-48.2179170.40000111.1T76 L169 W170 D171 L177T76-V173 HydrophobicContact CG2-CB 4.23Å; T76-V173 HydrophobicContact CG2-CG1 3.57Å; T76-V173 HydrophobicContact CG2-CG2 3.7Å; L169-V173 VanDerWaalsContact O-CG2 3.31Å; L169-V173 WeakPolarHBondContact O-CG2 3.36Å; L169-V173 PolarHBondContact O-N 3.34Å; W170-V173 PolarHBondContact O-N 3.43Å; D171-V173 PolarHBondContact O-N 2.95Å; V173-L177 HydrophobicContact CG1-CD1 3.86Å; V173-L177 WeakPolarHBondContact O-CD1 3.43Å; V173-L177 VanDerWaalsContact O-CG 3.29Å; V173-L177 WeakPolarHBondContact O-CG 3.45Å; V173-L177 PolarHBondContact O-N 3.48Å
174T77.8Confident80Confident27 Ų2782 Ų8217%0.16643%0.43CS..Hα-helixtrans-70.9-38.9-176.755.60000112.1W170 L177 W178W170-T174 HydrophobicContact CD2-CG2 3.91Å; W170-T174 VanDerWaalsContact CE2-CG2 3.49Å; W170-T174 HydrophobicContact CG-CG2 4.26Å; W170-T174 HydrophobicContact CH2-CG2 4.4Å; W170-T174 HydrophobicContact CZ2-CG2 3.78Å; W170-T174 WeakPolarHBondContact O-CB 3.45Å; W170-T174 WeakPolarHBondContact O-CG2 3.27Å; W170-T174 PolarHBondContact O-N 3.37Å; W170-T174 PolarHBondContact O-OG1 2.83Å; T174-L177 PolarHBondContact O-N 2.84Å; T174-W178 PolarHBondContact O-N 2.79Å
175G82.9Confident80Confident23 Ų2381.4 Ų81.424%0.23743%0.43CS..Hα-helixtrans-56.2-54.5178.600000113.3D171 L177 W178 R179D171-G175 PolarHBondContact O-N 3.43Å; G175-L177 PolarHBondContact O-N 3.28Å; G175-W178 PolarHBondContact O-N 2.96Å; G175-R179 PolarHBondContact O-N 3.5Å; G175-R179 VanDerWaalsContact O-N 3.08Å
176P78.1Confident80Confident49 Ų4980.9 Ų80.932%0.31844%0.436SS..Hα-helixtrans-60.8-40.8174.8-26.836.8000113T172 W178 R179 M180T172-P176 WeakPolarHBondContact O-CD 3.44Å; T172-P176 WeakPolarHBondContact O-CG 3.32Å; P176-W178 PolarHBondContact O-N 3.35Å; P176-R179 PolarHBondContact O-N 2.87Å; P176-M180 WeakPolarHBondContact O-CB 3.29Å; P176-M180 WeakPolarHBondContact O-CG 3.46Å; P176-M180 PolarHBondContact O-N 3.03Å
177L77Confident80.1Confident80 Ų8081.5 Ų81.542%0.41943%0.433SS..Hα-helixtrans-59.2-48178.7-77.1170.2000112V72 V173 T174 G175 R179 M180 T181V72-L177 HydrophobicContact CG1-CD2 3.89Å; V72-L177 HydrophobicContact CG1-CG 4.28Å; V173-L177 HydrophobicContact CG1-CD1 3.86Å; V173-L177 WeakPolarHBondContact O-CD1 3.43Å; V173-L177 VanDerWaalsContact O-CG 3.29Å; V173-L177 WeakPolarHBondContact O-CG 3.45Å; V173-L177 PolarHBondContact O-N 3.48Å; T174-L177 PolarHBondContact O-N 2.84Å; G175-L177 PolarHBondContact O-N 3.28Å; L177-R179 PolarHBondContact O-N 3.46Å; L177-M180 PolarHBondContact O-N 2.95Å; L177-T181 WeakPolarHBondContact O-CG2 3.33Å; L177-T181 PolarHBondContact O-N 2.98Å; L177-T181 PolarHBondContact O-OG1 3.25Å
178W80Confident80.1Confident177 Ų17781 Ų8167%0.6743%0.431SS*.Hα-helixtrans-62.1-42.1176.3-78.6108.9000112.3T174 G175 P176 M180 T181 D182T174-W178 PolarHBondContact O-N 2.79Å; G175-W178 PolarHBondContact O-N 2.96Å; P176-W178 PolarHBondContact O-N 3.35Å; W178-M180 VanDerWaalsContact C-N 3.34Å; W178-M180 PolarHBondContact O-N 2.87Å; W178-T181 WeakPolarHBondContact CA-OG1 3.31Å; W178-T181 PolarHBondContact O-N 3.29Å; W178-T181 PolarHBondContact O-OG1 3.44Å; W178-D182 PolarHBondContact O-N 2.96Å
179R82.7Confident80.3Confident184 Ų18481.1 Ų81.169%0.69443%0.432SS*.Hα-helixtrans-64.4-38.5174.6-73.2-170.8-179.6139.43.4112.4G175 P176 L177 D182 V183G175-R179 PolarHBondContact O-N 3.5Å; G175-R179 VanDerWaalsContact O-N 3.08Å; P176-R179 PolarHBondContact O-N 2.87Å; L177-R179 PolarHBondContact O-N 3.46Å; R179-D182 PolarHBondContact O-N 3.48Å; R179-V183 WeakPolarHBondContact O-CB 3.28Å; R179-V183 VanDerWaalsContact O-CG2 3.24Å; R179-V183 WeakPolarHBondContact O-CG2 3.44Å; R179-V183 PolarHBondContact O-N 2.86Å
180M77.4Confident80.5Confident62 Ų6285.2 Ų85.231%0.30545%0.449SS..Hα-helixtrans-64.9-42.5175.6-68.8-40.8169.600110.8L68 P176 L177 W178 D182 V183 V184L68-M180 HydrophobicContact CD1-CE 3.88Å; L68-M180 HydrophobicContact CD1-SD 4.32Å; L68-M180 HydrophobicContact CD2-CE 4.17Å; L68-M180 HydrophobicContact CD2-CG 4.06Å; L68-M180 HydrophobicContact CD2-SD 3.48Å; L68-M180 WeakPolarHBondContact CD2-SD 3.37Å; L68-M180 HydrophobicContact CG-CE 4.26Å; L68-M180 HydrophobicContact CG-CG 4.46Å; L68-M180 HydrophobicContact CG-SD 4.15Å; P176-M180 WeakPolarHBondContact O-CB 3.29Å; P176-M180 WeakPolarHBondContact O-CG 3.46Å; P176-M180 PolarHBondContact O-N 3.03Å; L177-M180 PolarHBondContact O-N 2.95Å; W178-M180 VanDerWaalsContact C-N 3.34Å; W178-M180 PolarHBondContact O-N 2.87Å; M180-D182 VanDerWaalsContact C-N 3.33Å; M180-D182 PolarHBondContact O-N 3.5Å; M180-V183 PolarHBondContact O-N 2.88Å; M180-V184 WeakPolarHBondContact O-CB 3.47Å; M180-V184 WeakPolarHBondContact O-CG2 3.49Å; M180-V184 PolarHBondContact O-N 3.35Å
181T76.8Confident80.5Confident74 Ų7478.8 Ų78.845%0.45443%0.428SS..Hα-helixtrans-62.5-39.517651.40000112.3L177 W178 V184 A185L177-T181 WeakPolarHBondContact O-CG2 3.33Å; L177-T181 PolarHBondContact O-N 2.98Å; L177-T181 PolarHBondContact O-OG1 3.25Å; W178-T181 WeakPolarHBondContact CA-OG1 3.31Å; W178-T181 PolarHBondContact O-N 3.29Å; W178-T181 PolarHBondContact O-OG1 3.44Å; T181-V184 PolarHBondContact O-N 3.5Å; T181-A185 WeakPolarHBondContact O-CB 3.43Å; T181-A185 PolarHBondContact O-N 3.35Å
182D85.6Confident80.5Confident105 Ų10576.5 Ų76.556%0.56142%0.421SS*.Hα-helixtrans-66.3-42.5176.1-75-17.3000111.9W178 R179 M180 A185 A186W178-D182 PolarHBondContact O-N 2.96Å; R179-D182 PolarHBondContact O-N 3.48Å; M180-D182 VanDerWaalsContact C-N 3.33Å; M180-D182 PolarHBondContact O-N 3.5Å; D182-A185 PolarHBondContact O-N 3.46Å; D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 2.91Å
183V81.3Confident80.9Confident95 Ų9577 Ų7758%0.57643%0.427SS*.Hα-helixtrans-63.5-43.2175.8171.10000110.8R179 M180 A186 F187R179-V183 WeakPolarHBondContact O-CB 3.28Å; R179-V183 VanDerWaalsContact O-CG2 3.24Å; R179-V183 WeakPolarHBondContact O-CG2 3.44Å; R179-V183 PolarHBondContact O-N 2.86Å; M180-V183 PolarHBondContact O-N 2.88Å; V183-A186 PolarHBondContact O-N 3.41Å; V183-F187 WeakPolarHBondContact O-CB 3.27Å; V183-F187 PolarHBondContact O-N 3.48Å
184V80.1Confident81.1Confident42 Ų4277.8 Ų77.826%0.25543%0.434SS..Hα-helixtrans-61-46.2175176.60000110.5L65 M180 T181 F187 L188L65-V184 HydrophobicContact CD2-CG2 3.42Å; L65-V184 VanDerWaalsContact CD2-CG2 3.42Å; M180-V184 WeakPolarHBondContact O-CB 3.47Å; M180-V184 WeakPolarHBondContact O-CG2 3.49Å; M180-V184 PolarHBondContact O-N 3.35Å; T181-V184 PolarHBondContact O-N 3.5Å; V184-F187 PolarHBondContact O-N 2.93Å; V184-L188 HydrophobicContact CG1-CD1 4.01Å; V184-L188 HydrophobicContact CG1-CG 4.39Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 2.91Å
185A81.6Confident81.4Confident55 Ų5578.4 Ų78.446%0.45544%0.442SS..Hα-helixtrans-63.1-45.4179.500000111.9T181 D182 F187 L188 A189T181-A185 WeakPolarHBondContact O-CB 3.43Å; T181-A185 PolarHBondContact O-N 3.35Å; D182-A185 PolarHBondContact O-N 3.46Å; A185-F187 VanDerWaalsContact C-N 3.31Å; A185-F187 PolarHBondContact O-N 2.94Å; A185-L188 PolarHBondContact O-N 3.43Å; A185-A189 WeakPolarHBondContact O-CB 3.33Å; A185-A189 PolarHBondContact O-N 2.9Å
186A83.6Confident81.3Confident62 Ų6281.5 Ų81.551%0.51246%0.456SS..Hα-helixtrans-62.3-39.5175.600000111.8D182 V183 A189 H190D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 2.91Å; V183-A186 PolarHBondContact O-N 3.41Å; A186-A189 PolarHBondContact O-N 3.34Å; A186-H190 PolarHBondContact O-N 2.98Å
187F80.9Confident81.6Confident76 Ų7681.3 Ų81.333%0.33346%0.459SS..Hα-helixtrans-66-44.3176.4-177.7-98.3000112.2V61 V183 V184 A185 A189 H190 I191V61-F187 HydrophobicContact CB-CE1 4.02Å; V61-F187 HydrophobicContact CB-CZ 4.38Å; V61-F187 HydrophobicContact CG1-CD1 4.06Å; V61-F187 HydrophobicContact CG1-CE1 3.37Å; V61-F187 HydrophobicContact CG1-CZ 4.16Å; V61-F187 HydrophobicContact CG2-CE1 3.39Å; V61-F187 HydrophobicContact CG2-CZ 3.31Å; V183-F187 WeakPolarHBondContact O-CB 3.27Å; V183-F187 PolarHBondContact O-N 3.48Å; V184-F187 PolarHBondContact O-N 2.93Å; A185-F187 VanDerWaalsContact C-N 3.31Å; A185-F187 PolarHBondContact O-N 2.94Å; F187-A189 VanDerWaalsContact C-N 3.33Å; F187-A189 PolarHBondContact O-N 3.49Å; F187-H190 WeakPolarHBondContact O-CB 3.34Å; F187-H190 PolarHBondContact O-N 3.5Å; F187-H190 VanDerWaalsContact O-N 3.13Å; F187-I191 HydrophobicContact CD1-CD1 3.86Å; F187-I191 HydrophobicContact CD1-CG1 4.34Å; F187-I191 HydrophobicContact CE1-CD1 3.09Å; F187-I191 HydrophobicContact CE1-CG1 3.84Å; F187-I191 HydrophobicContact CZ-CD1 3.49Å; F187-I191 VanDerWaalsContact CZ-CD1 3.49Å; F187-I191 HydrophobicContact CZ-CG1 3.96Å; F187-I191 PolarHBondContact O-N 3.26Å
188L80Confident81.8Confident102 Ų10283.1 Ų83.153%0.53447%0.466SS..Hα-helixtrans-63-38.7174.2-72.2173.2000112.1V184 A185 H190 I191 S192V184-L188 HydrophobicContact CG1-CD1 4.01Å; V184-L188 HydrophobicContact CG1-CG 4.39Å; V184-L188 WeakPolarHBondContact O-CB 3.44Å; V184-L188 WeakPolarHBondContact O-CG 3.34Å; V184-L188 PolarHBondContact O-N 2.91Å; A185-L188 PolarHBondContact O-N 3.43Å; L188-H190 VanDerWaalsContact C-N 3.31Å; L188-H190 PolarHBondContact O-N 3.5Å; L188-I191 PolarHBondContact O-N 2.92Å; L188-S192 WeakPolarHBondContact O-CB 3.47Å; L188-S192 PolarHBondContact O-N 3.42Å; L188-S192 PolarHBondContact O-OG 3.11Å
189A83.1Confident81.9Confident55 Ų5577.7 Ų77.746%0.45546%0.459SS..Hα-helixtrans-62.2-40172.500000111.4A185 A186 F187 S192 S193A185-A189 WeakPolarHBondContact O-CB 3.33Å; A185-A189 PolarHBondContact O-N 2.9Å; A186-A189 PolarHBondContact O-N 3.34Å; F187-A189 VanDerWaalsContact C-N 3.33Å; F187-A189 PolarHBondContact O-N 3.49Å; A189-S192 WeakPolarHBondContact CA-OG 3.35Å; A189-S192 PolarHBondContact O-OG 3Å; A189-S193 VanDerWaalsContact O-CB 3.3Å; A189-S193 WeakPolarHBondContact O-CB 3.17Å; A189-S193 PolarHBondContact O-N 3.37Å
190H84.1Confident81.9Confident130 Ų13074.4 Ų74.460%0.60245%0.454SS*.Hα-helixtrans-68.1-42.1176-16968.4000112.7A186 F187 L188 S193 S194A186-H190 PolarHBondContact O-N 2.98Å; F187-H190 WeakPolarHBondContact O-CB 3.34Å; F187-H190 PolarHBondContact O-N 3.5Å; F187-H190 VanDerWaalsContact O-N 3.13Å; L188-H190 VanDerWaalsContact C-N 3.31Å; L188-H190 PolarHBondContact O-N 3.5Å; H190-S193 PolarHBondContact O-N 3.45Å; H190-S194 VanDerWaalsContact O-CB 3.31Å; H190-S194 WeakPolarHBondContact O-CB 3.25Å; H190-S194 PolarHBondContact O-N 2.89Å; H190-S194 PolarHBondContact O-OG 3.37Å
191I80.6Confident82.2Confident43 Ų4377 Ų7722%0.22147%0.469CS..Hα-helixtrans-61.4-48174.7-72.3-174.9000110.8F187 L188 S193 S194 A195F187-I191 HydrophobicContact CD1-CD1 3.86Å; F187-I191 HydrophobicContact CD1-CG1 4.34Å; F187-I191 HydrophobicContact CE1-CD1 3.09Å; F187-I191 HydrophobicContact CE1-CG1 3.84Å; F187-I191 HydrophobicContact CZ-CD1 3.49Å; F187-I191 VanDerWaalsContact CZ-CD1 3.49Å; F187-I191 HydrophobicContact CZ-CG1 3.96Å; F187-I191 PolarHBondContact O-N 3.26Å; L188-I191 PolarHBondContact O-N 2.92Å; I191-S193 PolarHBondContact O-N 2.98Å; I191-S194 WeakPolarHBondContact CA-OG 3.38Å; I191-S194 PolarHBondContact O-N 2.95Å; I191-S194 PolarHBondContact O-OG 2.63Å; I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.09Å; I191-A195 PolarHBondContact O-N 3.43Å
192S81.6Confident82.6Confident66 Ų6676.2 Ų76.246%0.46246%0.461SS..Hα-helixtrans-63.9-42.9-179.854.80000111.7L188 A189 S194 A195 V196L188-S192 WeakPolarHBondContact O-CB 3.47Å; L188-S192 PolarHBondContact O-N 3.42Å; L188-S192 PolarHBondContact O-OG 3.11Å; A189-S192 WeakPolarHBondContact CA-OG 3.35Å; A189-S192 PolarHBondContact O-OG 3Å; S192-S194 PolarHBondContact O-N 3.41Å; S192-A195 PolarHBondContact O-N 2.88Å; S192-V196 WeakPolarHBondContact O-CG2 3.44Å; S192-V196 PolarHBondContact O-N 2.68Å
193S86.3Confident82.6Confident78 Ų7879.4 Ų79.455%0.54547%0.466SS..Hα-helixtrans-63.9-41.2175.8-175.20000112.6A189 H190 I191 V196 A197A189-S193 VanDerWaalsContact O-CB 3.3Å; A189-S193 WeakPolarHBondContact O-CB 3.17Å; A189-S193 PolarHBondContact O-N 3.37Å; H190-S193 PolarHBondContact O-N 3.45Å; I191-S193 PolarHBondContact O-N 2.98Å; S193-V196 PolarHBondContact O-N 3.01Å; S193-A197 WeakPolarHBondContact O-CB 3.33Å; S193-A197 PolarHBondContact O-N 3.47Å
194S82.6Confident82.7Confident48 Ų4879.1 Ų79.134%0.33647%0.465SS..Hα-helixtrans-71.2-36.6178.555.50000112H190 I191 S192 V196 A197 M198H190-S194 VanDerWaalsContact O-CB 3.31Å; H190-S194 WeakPolarHBondContact O-CB 3.25Å; H190-S194 PolarHBondContact O-N 2.89Å; H190-S194 PolarHBondContact O-OG 3.37Å; I191-S194 WeakPolarHBondContact CA-OG 3.38Å; I191-S194 PolarHBondContact O-N 2.95Å; I191-S194 PolarHBondContact O-OG 2.63Å; S192-S194 PolarHBondContact O-N 3.41Å; S194-V196 PolarHBondContact O-N 3.46Å; S194-A197 PolarHBondContact O-N 2.82Å; S194-M198 WeakPolarHBondContact O-CB 3.48Å; S194-M198 VanDerWaalsContact O-CG 3.28Å; S194-M198 WeakPolarHBondContact O-CG 3.45Å; S194-M198 PolarHBondContact O-N 3.48Å
195A82.2Confident82.8Confident40 Ų4080 Ų8033%0.33147%0.471SS..Hα-helixtrans-61.1-43.8172.600000111.5I191 S192 M198 A199I191-A195 VanDerWaalsContact O-CB 3.27Å; I191-A195 WeakPolarHBondContact O-CB 3.09Å; I191-A195 PolarHBondContact O-N 3.43Å; S192-A195 PolarHBondContact O-N 2.88Å; A195-M198 PolarHBondContact O-N 3.3Å; A195-A199 WeakPolarHBondContact O-CB 3.3Å; A195-A199 PolarHBondContact O-N 3.14Å
196V82.2Confident82.8Confident89 Ų8979 Ų7954%0.53946%0.46SS..Hα-helixtrans-63.6-44.2174.4172.70000111.1S192 S193 S194 M198 A199 I200S192-V196 WeakPolarHBondContact O-CG2 3.44Å; S192-V196 PolarHBondContact O-N 2.68Å; S193-V196 PolarHBondContact O-N 3.01Å; S194-V196 PolarHBondContact O-N 3.46Å; V196-M198 PolarHBondContact O-N 3.21Å; V196-A199 WeakPolarHBondContact O-CB 3.28Å; V196-A199 PolarHBondContact O-N 3.42Å; V196-I200 HydrophobicContact CG1-CD1 3.85Å; V196-I200 HydrophobicContact CG1-CG1 4.49Å; V196-I200 VanDerWaalsContact O-CG1 3.32Å; V196-I200 WeakPolarHBondContact O-CG1 3.35Å; V196-I200 PolarHBondContact O-N 2.91Å
197A83.1Confident83Confident45 Ų4580 Ų8037%0.37246%0.455SS..Hα-helixtrans-61.4-43.4177.200000112.2S193 S194 I200 L201S193-A197 WeakPolarHBondContact O-CB 3.33Å; S193-A197 PolarHBondContact O-N 3.47Å; S194-A197 PolarHBondContact O-N 2.82Å; A197-I200 PolarHBondContact O-N 2.99Å; A197-L201 WeakPolarHBondContact O-CB 3.46Å; A197-L201 WeakPolarHBondContact O-CG 3.17Å; A197-L201 PolarHBondContact O-N 3.31Å
198M82.1Confident83.3Confident117 Ų11782.1 Ų82.158%0.57647%0.468SS*.Hα-helixtrans-64.1-39.4175.2-71.5-57.6-63.700111.8S194 A195 V196 I200 L201 L202S194-M198 WeakPolarHBondContact O-CB 3.48Å; S194-M198 VanDerWaalsContact O-CG 3.28Å; S194-M198 WeakPolarHBondContact O-CG 3.45Å; S194-M198 PolarHBondContact O-N 3.48Å; A195-M198 PolarHBondContact O-N 3.3Å; V196-M198 PolarHBondContact O-N 3.21Å; M198-I200 VanDerWaalsContact C-N 3.35Å; M198-I200 PolarHBondContact O-N 2.96Å; M198-L201 PolarHBondContact O-N 3.45Å; M198-L201 HydrophobicContact SD-CD1 4.37Å; M198-L202 WeakPolarHBondContact O-CB 3.3Å; M198-L202 PolarHBondContact O-N 3.41Å
199A81.9Confident83.4Confident64 Ų6477.9 Ų77.953%0.52945%0.448SS..Hα-helixtrans-62.2-42174.600000111.9A195 V196 L202 W203A195-A199 WeakPolarHBondContact O-CB 3.3Å; A195-A199 PolarHBondContact O-N 3.14Å; V196-A199 WeakPolarHBondContact O-CB 3.28Å; V196-A199 PolarHBondContact O-N 3.42Å; A199-L202 PolarHBondContact O-N 3.41Å; A199-W203 WeakPolarHBondContact O-CB 3.31Å; A199-W203 PolarHBondContact O-N 2.86Å
200I83.9Confident83.4Confident114 Ų11479.4 Ų79.459%0.58545%0.448SS*.Hα-helixtrans-66.9-45.2176.9-66.1165.2000111.1V196 A197 M198 L202 W203V196-I200 HydrophobicContact CG1-CD1 3.85Å; V196-I200 HydrophobicContact CG1-CG1 4.49Å; V196-I200 VanDerWaalsContact O-CG1 3.32Å; V196-I200 WeakPolarHBondContact O-CG1 3.35Å; V196-I200 PolarHBondContact O-N 2.91Å; A197-I200 PolarHBondContact O-N 2.99Å; M198-I200 VanDerWaalsContact C-N 3.35Å; M198-I200 PolarHBondContact O-N 2.96Å; I200-L202 VanDerWaalsContact C-N 3.28Å; I200-L202 PolarHBondContact O-N 3.37Å; I200-W203 WeakPolarHBondContact O-CB 3.4Å; I200-W203 PolarHBondContact O-N 2.97Å
201L83.6Confident83.7Confident118 Ų11878.1 Ų78.162%0.61844%0.443SS*.Hα-helixtrans-63.8-34.7178.3-74.7171.6000112.3A197 M198 P205A197-L201 WeakPolarHBondContact O-CB 3.46Å; A197-L201 WeakPolarHBondContact O-CG 3.17Å; A197-L201 PolarHBondContact O-N 3.31Å; M198-L201 PolarHBondContact O-N 3.45Å; M198-L201 HydrophobicContact SD-CD1 4.37Å; L201-P205 WeakPolarHBondContact O-CD 3.41Å
202L83.3Confident83.9Confident56 Ų5680.6 Ų80.629%0.29346%0.455SS..Hα-helixtrans-85.5-19.1-178.9-157.960000112.8L46 V50 M198 A199 I200 P205 C206L46-L202 HydrophobicContact CD1-CD1 4.1Å; L46-L202 HydrophobicContact CD1-CD2 4.32Å; L46-L202 HydrophobicContact CD1-CG 4.37Å; L46-L202 HydrophobicContact CD2-CD2 3.58Å; L46-L202 HydrophobicContact CD2-CG 4.19Å; L46-L202 HydrophobicContact CG-CD2 4.13Å; V50-L202 HydrophobicContact CG2-CD2 4.13Å; M198-L202 WeakPolarHBondContact O-CB 3.3Å; M198-L202 PolarHBondContact O-N 3.41Å; A199-L202 PolarHBondContact O-N 3.41Å; I200-L202 VanDerWaalsContact C-N 3.28Å; I200-L202 PolarHBondContact O-N 3.37Å; L202-P205 HydrophobicContact CD1-CG 4.25Å; L202-P205 VanDerWaalsContact O-CD 3.3Å; L202-P205 WeakPolarHBondContact O-CD 3.42Å; L202-P205 VanDerWaalsContact O-CG 3.3Å; L202-P205 WeakPolarHBondContact O-CG 3.32Å; L202-C206 WeakPolarHBondContact O-CB 3.21Å; L202-C206 PolarHBondContact O-N 2.93Å; L202-C206 VanDerWaalsContact O-N 3.14Å
203W85.6Confident84Confident172 Ų17279.3 Ų79.365%0.65244%0.443SS*.Hα-helixtrans-60.1-50178.3176.8-94.5000112.2A199 I200 C206 Q207A199-W203 WeakPolarHBondContact O-CB 3.31Å; A199-W203 PolarHBondContact O-N 2.86Å; I200-W203 WeakPolarHBondContact O-CB 3.4Å; I200-W203 PolarHBondContact O-N 2.97Å; W203-C206 PolarHBondContact O-N 2.87Å; W203-Q207 VanDerWaalsContact NE1-OE1 3.14Å; W203-Q207 WeakPolarHBondContact O-CB 3.26Å; W203-Q207 PolarHBondContact O-N 2.9Å
204T84.2Confident83.9Confident90 Ų9077.7 Ų77.755%0.55244%0.435SS*.Hα-helixtrans-62.9-47-177.347.60000114.1C206 Q207 L208T204-C206 VanDerWaalsContact C-N 3.33Å; T204-C206 PolarHBondContact O-N 3.28Å; T204-Q207 PolarHBondContact O-N 3.03Å; T204-L208 WeakPolarHBondContact O-CB 3.35Å; T204-L208 PolarHBondContact O-N 3.36Å
205P82.4Confident84.1Confident61 Ų6177.4 Ų77.440%0.39643%0.433SS..Hα-helixtrans-67.9-33.1175.226.9-35.3000112.3L201 L202 L208 A209L201-P205 WeakPolarHBondContact O-CD 3.41Å; L202-P205 HydrophobicContact CD1-CG 4.25Å; L202-P205 VanDerWaalsContact O-CD 3.3Å; L202-P205 WeakPolarHBondContact O-CD 3.42Å; L202-P205 VanDerWaalsContact O-CG 3.3Å; L202-P205 WeakPolarHBondContact O-CG 3.32Å; P205-L208 PolarHBondContact O-N 2.9Å; P205-A209 WeakPolarHBondContact O-CB 3.43Å; P205-A209 PolarHBondContact O-N 2.88Å
206C82.4Confident84Confident33 Ų3376 Ų7622%0.22342%0.421CS..Hα-helixtrans-68.6-42.5177.2-160.70000111.4L202 W203 T204 A209 L210L202-C206 WeakPolarHBondContact O-CB 3.21Å; L202-C206 PolarHBondContact O-N 2.93Å; L202-C206 VanDerWaalsContact O-N 3.14Å; W203-C206 PolarHBondContact O-N 2.87Å; T204-C206 VanDerWaalsContact C-N 3.33Å; T204-C206 PolarHBondContact O-N 3.28Å; C206-A209 PolarHBondContact O-N 3.48Å; C206-L210 WeakPolarHBondContact O-CG 3.35Å; C206-L210 PolarHBondContact O-N 3.32Å
207Q87.2Confident83.9Confident84 Ų8474 Ų7439%0.39341%0.414SS..Hα-helixtrans-59.2-48.2172.9-178.5-179.5-14.200111W203 T204 A209 L210 E211W203-Q207 VanDerWaalsContact NE1-OE1 3.14Å; W203-Q207 WeakPolarHBondContact O-CB 3.26Å; W203-Q207 PolarHBondContact O-N 2.9Å; T204-Q207 PolarHBondContact O-N 3.03Å; Q207-A209 VanDerWaalsContact C-N 3.33Å; Q207-A209 PolarHBondContact O-N 3.39Å; Q207-L210 PolarHBondContact O-N 3.07Å; Q207-E211 PolarHBondContact NE2-OE1 2.92Å; Q207-E211 WeakPolarHBondContact O-CG 3.34Å; Q207-E211 PolarHBondContact O-N 2.97Å
208L87.1Confident84.1Confident119 Ų11980 Ų8062%0.62343%0.427SS*.Hα-helixtrans-60.5-42.5177.7-173.871.1000111.8T204 P205 L210 E211 L212T204-L208 WeakPolarHBondContact O-CB 3.35Å; T204-L208 PolarHBondContact O-N 3.36Å; P205-L208 PolarHBondContact O-N 2.9Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-L210 PolarHBondContact O-N 3.31Å; L208-E211 PolarHBondContact O-N 3.48Å; L208-L212 VanDerWaalsContact O-CB 3.29Å; L208-L212 WeakPolarHBondContact O-CB 3.37Å; L208-L212 PolarHBondContact O-N 3.36Å
209A82.9Confident84.2Confident13 Ų1379.5 Ų79.511%0.10743%0.426CS..Hα-helixtrans-62-40.317700000112L39 V43 P205 C206 Q207 L212 L213L39-A209 HydrophobicContact CD2-CB 3.93Å; V43-A209 HydrophobicContact CG2-CB 4.48Å; P205-A209 WeakPolarHBondContact O-CB 3.43Å; P205-A209 PolarHBondContact O-N 2.88Å; C206-A209 PolarHBondContact O-N 3.48Å; Q207-A209 VanDerWaalsContact C-N 3.33Å; Q207-A209 PolarHBondContact O-N 3.39Å; A209-L212 PolarHBondContact O-N 2.9Å; A209-L213 WeakPolarHBondContact O-CB 3.49Å; A209-L213 PolarHBondContact O-N 3.46Å
210L82.8Confident84Confident87 Ų8777.3 Ų77.346%0.45541%0.405SS..Hα-helixtrans-68.7-41176.2-70.8170.7000112.3C206 Q207 L208 L212 L213 A214C206-L210 WeakPolarHBondContact O-CG 3.35Å; C206-L210 PolarHBondContact O-N 3.32Å; Q207-L210 PolarHBondContact O-N 3.07Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-L210 PolarHBondContact O-N 3.31Å; L210-L212 VanDerWaalsContact C-N 3.34Å; L210-L213 WeakPolarHBondContact O-CB 3.29Å; L210-L213 PolarHBondContact O-N 2.91Å; L210-A214 WeakPolarHBondContact O-CB 3.08Å; L210-A214 PolarHBondContact O-N 2.85Å
211E89.9Confident83.8Confident104 Ų10474.8 Ų74.849%0.48640%0.402SS..Hα-helixtrans-65.4-38174.9-73.1179.1-166.800111.8Q207 L208 A214 S215Q207-E211 PolarHBondContact NE2-OE1 2.92Å; Q207-E211 WeakPolarHBondContact O-CG 3.34Å; Q207-E211 PolarHBondContact O-N 2.97Å; L208-E211 PolarHBondContact O-N 3.48Å; E211-A214 PolarHBondContact O-N 3.46Å; E211-S215 WeakPolarHBondContact O-CB 3.38Å; E211-S215 PolarHBondContact O-N 3.05Å; E211-S215 PolarHBondContact O-OG 3.41Å
212L84.8Confident83.8Confident94 Ų9472 Ų7249%0.49239%0.392SS..Hα-helixtrans-64.9-43.7172.7-173.867.3000111.1L39 L208 A209 L210 A214 S215 A216L39-L212 HydrophobicContact CD1-CD2 3.94Å; L39-L212 HydrophobicContact CD1-CG 4.44Å; L39-L212 HydrophobicContact CD2-CD2 4.44Å; L208-L212 VanDerWaalsContact O-CB 3.29Å; L208-L212 WeakPolarHBondContact O-CB 3.37Å; L208-L212 PolarHBondContact O-N 3.36Å; A209-L212 PolarHBondContact O-N 2.9Å; L210-L212 VanDerWaalsContact C-N 3.34Å; L212-A214 VanDerWaalsContact C-N 3.35Å; L212-A214 PolarHBondContact O-N 2.99Å; L212-S215 WeakPolarHBondContact CA-OG 3.41Å; L212-S215 PolarHBondContact O-N 3.43Å; L212-S215 PolarHBondContact O-OG 3.14Å; L212-A216 WeakPolarHBondContact O-CB 3.34Å; L212-A216 PolarHBondContact O-N 2.91Å
213L82.8Confident83.7Confident39 Ų3972 Ų7220%0.20439%0.39CS..Hα-helixtrans-60.6-45.4176.2-164.384.7000110.9L36 L39 L40 A209 L210 A217L36-L213 HydrophobicContact CB-CD1 4.42Å; L36-L213 HydrophobicContact CD2-CD1 3.38Å; L36-L213 HydrophobicContact CD2-CG 3.95Å; L36-L213 HydrophobicContact CG-CD1 4.5Å; L39-L213 HydrophobicContact CB-CD1 3.89Å; L40-L213 HydrophobicContact CD1-CD2 4.11Å; A209-L213 WeakPolarHBondContact O-CB 3.49Å; A209-L213 PolarHBondContact O-N 3.46Å; L210-L213 WeakPolarHBondContact O-CB 3.29Å; L210-L213 PolarHBondContact O-N 2.91Å; L213-A217 VanDerWaalsContact O-CB 3.24Å; L213-A217 WeakPolarHBondContact O-CB 3.32Å; L213-A217 PolarHBondContact O-N 2.95Å
214A84.1Confident83.3Confident44 Ų4466.9 Ų66.936%0.36438%0.378SS..Hα-helixtrans-68-36.9179.300000112.9L210 E211 L212 R218L210-A214 WeakPolarHBondContact O-CB 3.08Å; L210-A214 PolarHBondContact O-N 2.85Å; E211-A214 PolarHBondContact O-N 3.46Å; L212-A214 VanDerWaalsContact C-N 3.35Å; L212-A214 PolarHBondContact O-N 2.99Å; A214-R218 WeakPolarHBondContact O-CB 3.47Å; A214-R218 WeakPolarHBondContact O-CG 3.4Å; A214-R218 PolarHBondContact O-N 3.01Å; A214-R218 PolarHBondContact O-NE 2.98Å
215S87.4Confident83.1Confident42 Ų4268.1 Ų68.129%0.29438%0.38SS..Hα-helixtrans-71.5-44.7175540000111.9E211 L212 A217 R218 L219E211-S215 WeakPolarHBondContact O-CB 3.38Å; E211-S215 PolarHBondContact O-N 3.05Å; E211-S215 PolarHBondContact O-OG 3.41Å; L212-S215 WeakPolarHBondContact CA-OG 3.41Å; L212-S215 PolarHBondContact O-N 3.43Å; L212-S215 PolarHBondContact O-OG 3.14Å; S215-A217 PolarHBondContact O-N 2.94Å; S215-R218 PolarHBondContact O-N 3Å; S215-L219 WeakPolarHBondContact O-CG 3.25Å; S215-L219 PolarHBondContact O-N 3.06Å
216A81.3Confident83.2Confident10 Ų1069.6 Ų69.68%0.08339%0.388CS..Hα-helixtrans-61.4-41.4175.500000112.5L32 L36 L212 L219 L220L32-A216 HydrophobicContact CD2-CB 3.95Å; L36-A216 HydrophobicContact CD2-CB 3.71Å; L36-A216 HydrophobicContact CG-CB 4.41Å; L212-A216 WeakPolarHBondContact O-CB 3.34Å; L212-A216 PolarHBondContact O-N 2.91Å; A216-L219 PolarHBondContact O-N 3.46Å; A216-L220 PolarHBondContact O-N 3.36Å
217A80.2Confident83Confident48 Ų4870.1 Ų70.140%0.39739%0.388SS..Hα-helixtrans-62.9-41.6174.100000112.5L213 S215 L220 A221L213-A217 VanDerWaalsContact O-CB 3.24Å; L213-A217 WeakPolarHBondContact O-CB 3.32Å; L213-A217 PolarHBondContact O-N 2.95Å; S215-A217 PolarHBondContact O-N 2.94Å; A217-L220 PolarHBondContact O-N 3.21Å; A217-A221 WeakPolarHBondContact O-CB 3.35Å; A217-A221 PolarHBondContact O-N 3.17Å
218R86Confident82.5Confident170 Ų17070.9 Ų70.964%0.64240%0.395SS*.Hα-helixtrans-64.2-42.7174.9-79.8179.8-73.8-1621.5112.1A214 S215 A221 S222A214-R218 WeakPolarHBondContact O-CB 3.47Å; A214-R218 WeakPolarHBondContact O-CG 3.4Å; A214-R218 PolarHBondContact O-N 3.01Å; A214-R218 PolarHBondContact O-NE 2.98Å; S215-R218 PolarHBondContact O-N 3Å; R218-A221 PolarHBondContact O-N 2.84Å; R218-S222 WeakPolarHBondContact O-CB 3.34Å; R218-S222 PolarHBondContact O-N 3.46Å; R218-S222 PolarHBondContact O-OG 3.46Å
219L83.5Confident82.1Confident108 Ų10869.1 Ų69.157%0.56539%0.389SS*.Hα-helixtrans-60.9-48.2176.2-74.2170.5000110.9S215 A216 A221 S222 F223S215-L219 WeakPolarHBondContact O-CG 3.25Å; S215-L219 PolarHBondContact O-N 3.06Å; A216-L219 PolarHBondContact O-N 3.46Å; L219-A221 PolarHBondContact O-N 2.9Å; L219-S222 PolarHBondContact O-N 2.9Å; L219-S222 PolarHBondContact O-OG 2.92Å; L219-F223 VanDerWaalsContact O-CB 3.31Å; L219-F223 WeakPolarHBondContact O-CB 3.49Å; L219-F223 PolarHBondContact O-N 3.47Å
220L78.3Confident82.2Confident17 Ų1770.4 Ų70.49%0.08940%0.403CS..Hα-helixtrans-58-47174.6-82.5169.5000112.4V29 L32 L36 A216 A217 S222 F223 V224V29-L220 HydrophobicContact CB-CD2 4.42Å; V29-L220 HydrophobicContact CG1-CD2 4.32Å; V29-L220 HydrophobicContact CG2-CD2 4.16Å; L32-L220 HydrophobicContact CB-CD1 4.02Å; L32-L220 HydrophobicContact CB-CD2 3.75Å; L32-L220 HydrophobicContact CB-CG 3.99Å; L32-L220 HydrophobicContact CD1-CD2 4.15Å; L32-L220 HydrophobicContact CD1-CG 4.41Å; L32-L220 HydrophobicContact CD2-CD1 4.42Å; L32-L220 HydrophobicContact CD2-CG 4.19Å; L32-L220 HydrophobicContact CG-CD2 4.41Å; L32-L220 HydrophobicContact CG-CG 4.44Å; L36-L220 HydrophobicContact CD1-CD1 3.36Å; L36-L220 HydrophobicContact CG-CD1 4.4Å; A216-L220 PolarHBondContact O-N 3.36Å; A217-L220 PolarHBondContact O-N 3.21Å; L220-S222 VanDerWaalsContact C-N 3.32Å; L220-S222 PolarHBondContact O-N 3.46Å; L220-F223 PolarHBondContact O-N 2.85Å; L220-V224 WeakPolarHBondContact O-CB 3.36Å; L220-V224 VanDerWaalsContact O-CG2 3.26Å; L220-V224 WeakPolarHBondContact O-CG2 3.48Å; L220-V224 PolarHBondContact O-N 3.31Å
221A79.9Confident81.8Confident62 Ų6270.9 Ų70.951%0.51241%0.406SS..Hα-helixtrans-59.9-44.1178.100000111.6A217 R218 L219 L225A217-A221 WeakPolarHBondContact O-CB 3.35Å; A217-A221 PolarHBondContact O-N 3.17Å; R218-A221 PolarHBondContact O-N 2.84Å; L219-A221 PolarHBondContact O-N 2.9Å; A221-L225 VanDerWaalsContact O-CB 3.31Å; A221-L225 WeakPolarHBondContact O-CB 3.31Å; A221-L225 PolarHBondContact O-N 2.85Å
222S84.1Confident81.2Confident59 Ų5970.2 Ų70.241%0.41341%0.408SS..Hα-helixtrans-64.9-41.3177.172.10000112.3R218 L219 L220 L225 V226R218-S222 WeakPolarHBondContact O-CB 3.34Å; R218-S222 PolarHBondContact O-N 3.46Å; R218-S222 PolarHBondContact O-OG 3.46Å; L219-S222 PolarHBondContact O-N 2.9Å; L219-S222 PolarHBondContact O-OG 2.92Å; L220-S222 VanDerWaalsContact C-N 3.32Å; L220-S222 PolarHBondContact O-N 3.46Å; S222-L225 PolarHBondContact O-N 3.35Å; S222-V226 VanDerWaalsContact O-CG2 3.3Å; S222-V226 WeakPolarHBondContact O-CG2 3.34Å; S222-V226 PolarHBondContact O-N 2.95Å
223F80.6Confident81.1Confident56 Ų5671.5 Ų71.525%0.24642%0.415CS..Hα-helixtrans-67.9-44.8-179.8-173.7-121000111.5N25 L28 V29 L219 L220 L225 V226 N227N25-F223 HydrophobicContact CB-CE1 3.96Å; N25-F223 HydrophobicContact CB-CZ 3.73Å; N25-F223 VanDerWaalsContact CG-CE1 3.41Å; N25-F223 WeakPolarHBondContact OD1-CE1 3.39Å; N25-F223 WeakPolarHBondContact OD1-CZ 3.21Å; L28-F223 HydrophobicContact CB-CE1 4.48Å; L28-F223 HydrophobicContact CD2-CD1 4.15Å; L28-F223 HydrophobicContact CD2-CE1 3.9Å; L28-F223 HydrophobicContact CD2-CZ 4.27Å; V29-F223 HydrophobicContact CG2-CD1 3.65Å; V29-F223 HydrophobicContact CG2-CE1 3.7Å; L219-F223 VanDerWaalsContact O-CB 3.31Å; L219-F223 WeakPolarHBondContact O-CB 3.49Å; L219-F223 PolarHBondContact O-N 3.47Å; L220-F223 PolarHBondContact O-N 2.85Å; F223-L225 VanDerWaalsContact C-N 3.32Å; F223-L225 PolarHBondContact O-N 3.37Å; F223-V226 PolarHBondContact O-N 2.8Å; F223-N227 WeakPolarHBondContact CD1-ND2 3.43Å; F223-N227 WeakPolarHBondContact CD2-ND2 3.36Å; F223-N227 VanDerWaalsContact CE1-ND2 3.31Å; F223-N227 WeakPolarHBondContact CE1-ND2 3.31Å; F223-N227 WeakPolarHBondContact CE2-ND2 3.33Å; F223-N227 WeakPolarHBondContact CG-ND2 3.48Å; F223-N227 WeakPolarHBondContact CZ-ND2 3.49Å; F223-N227 WeakPolarHBondContact O-CB 3.24Å; F223-N227 VanDerWaalsContact O-CG 3.3Å; F223-N227 PolarHBondContact O-N 3.02Å; F223-N227 PolarHBondContact O-ND2 3.29Å
224V77.8Confident81Confident65 Ų6572.7 Ų72.739%0.39442%0.422SS..Hα-helixtrans-60.7-42.8174.1170.90000110.6L220 L228L220-V224 WeakPolarHBondContact O-CB 3.36Å; L220-V224 VanDerWaalsContact O-CG2 3.26Å; L220-V224 WeakPolarHBondContact O-CG2 3.48Å; L220-V224 PolarHBondContact O-N 3.31Å; V224-L228 HydrophobicContact CG1-CD1 3.68Å; V224-L228 HydrophobicContact CG1-CG 4.29Å; V224-L228 VanDerWaalsContact O-CB 3.28Å; V224-L228 WeakPolarHBondContact O-CB 3.43Å; V224-L228 VanDerWaalsContact O-CG 3.24Å; V224-L228 WeakPolarHBondContact O-CG 3.41Å; V224-L228 PolarHBondContact O-N 3Å
225L80.3Confident80.6Confident115 Ų11573.3 Ų73.360%0.60243%0.427SS*.Hα-helixtrans-62.3-49.6177.4-169.779.2000111.7A221 S222 F223 N227 L228 T229A221-L225 VanDerWaalsContact O-CB 3.31Å; A221-L225 WeakPolarHBondContact O-CB 3.31Å; A221-L225 PolarHBondContact O-N 2.85Å; S222-L225 PolarHBondContact O-N 3.35Å; F223-L225 VanDerWaalsContact C-N 3.32Å; F223-L225 PolarHBondContact O-N 3.37Å; L225-N227 PolarHBondContact O-N 2.79Å; L225-L228 PolarHBondContact O-N 3.37Å; L225-T229 WeakPolarHBondContact O-CB 3.31Å; L225-T229 VanDerWaalsContact O-CG2 3.28Å; L225-T229 WeakPolarHBondContact O-CG2 3.42Å; L225-T229 PolarHBondContact O-N 2.89Å; L225-T229 PolarHBondContact O-OG1 2.93Å; L225-T229 VanDerWaalsContact O-OG1 3.06Å
226V84.4Confident80.2Confident92 Ų9274.7 Ų74.756%0.55844%0.435SS*.Hα-helixtrans-61.1-46.5179.3171.50000110.6S222 F223 L228 T229 G230S222-V226 VanDerWaalsContact O-CG2 3.3Å; S222-V226 WeakPolarHBondContact O-CG2 3.34Å; S222-V226 PolarHBondContact O-N 2.95Å; F223-V226 PolarHBondContact O-N 2.8Å; V226-L228 PolarHBondContact O-N 3.36Å; V226-T229 WeakPolarHBondContact CA-OG1 3.3Å; V226-T229 PolarHBondContact O-N 2.97Å; V226-T229 PolarHBondContact O-OG1 3.37Å; V226-G230 PolarHBondContact O-N 3.02Å
227N78.7Confident80.3Confident45 Ų4577.9 Ų77.924%0.24145%0.454CS..Hα-helixtrans-66.1-39.9179.3-70.6-44.6000112.8N25 F223 L225 G230 L231N25-N227 VanDerWaalsContact CG-ND2 3.32Å; N25-N227 PolarHBondContact ND2-ND2 3.37Å; N25-N227 PolarHBondContact OD1-ND2 3.12Å; F223-N227 WeakPolarHBondContact CD1-ND2 3.43Å; F223-N227 WeakPolarHBondContact CD2-ND2 3.36Å; F223-N227 VanDerWaalsContact CE1-ND2 3.31Å; F223-N227 WeakPolarHBondContact CE1-ND2 3.31Å; F223-N227 WeakPolarHBondContact CE2-ND2 3.33Å; F223-N227 WeakPolarHBondContact CG-ND2 3.48Å; F223-N227 WeakPolarHBondContact CZ-ND2 3.49Å; F223-N227 WeakPolarHBondContact O-CB 3.24Å; F223-N227 VanDerWaalsContact O-CG 3.3Å; F223-N227 PolarHBondContact O-N 3.02Å; F223-N227 PolarHBondContact O-ND2 3.29Å; L225-N227 PolarHBondContact O-N 2.79Å; N227-G230 PolarHBondContact O-N 2.92Å; N227-L231 WeakPolarHBondContact O-CB 3.45Å; N227-L231 PolarHBondContact O-N 3.27Å
228L76.4Confident80.2Confident100 Ų10080.2 Ų80.252%0.52446%0.459SS..Hα-helixtrans-63.2-45.2174.2-77.9170.3000111.6V224 L225 V226 L231 V232V224-L228 HydrophobicContact CG1-CD1 3.68Å; V224-L228 HydrophobicContact CG1-CG 4.29Å; V224-L228 VanDerWaalsContact O-CB 3.28Å; V224-L228 WeakPolarHBondContact O-CB 3.43Å; V224-L228 VanDerWaalsContact O-CG 3.24Å; V224-L228 WeakPolarHBondContact O-CG 3.41Å; V224-L228 PolarHBondContact O-N 3Å; L225-L228 PolarHBondContact O-N 3.37Å; V226-L228 PolarHBondContact O-N 3.36Å; L228-L231 PolarHBondContact O-N 3.26Å; L228-V232 VanDerWaalsContact O-CG2 3.27Å; L228-V232 WeakPolarHBondContact O-CG2 3.47Å; L228-V232 PolarHBondContact O-N 3.43Å
229T79.1Confident79.7Confident82 Ų8274.7 Ų74.750%0.50345%0.45SS..Hα-helixtrans-64.8-39.9177.5570000112L225 V226 V232 L233L225-T229 WeakPolarHBondContact O-CB 3.31Å; L225-T229 VanDerWaalsContact O-CG2 3.28Å; L225-T229 WeakPolarHBondContact O-CG2 3.42Å; L225-T229 PolarHBondContact O-N 2.89Å; L225-T229 PolarHBondContact O-OG1 2.93Å; L225-T229 VanDerWaalsContact O-OG1 3.06Å; V226-T229 WeakPolarHBondContact CA-OG1 3.3Å; V226-T229 PolarHBondContact O-N 2.97Å; V226-T229 PolarHBondContact O-OG1 3.37Å; T229-V232 PolarHBondContact O-N 3.3Å; T229-L233 WeakPolarHBondContact O-CB 3.42Å; T229-L233 PolarHBondContact O-N 3.03Å
230G83.4Confident79.7Confident39 Ų3973.8 Ų73.840%0.40245%0.448SS..Hα-helixtrans-63-43.4174.400000112.5V226 N227 L233 L234V226-G230 PolarHBondContact O-N 3.02Å; N227-G230 PolarHBondContact O-N 2.92Å; G230-L233 PolarHBondContact O-N 2.98Å; G230-L234 WeakPolarHBondContact O-CB 3.31Å; G230-L234 PolarHBondContact O-N 2.84Å
231L75.1Confident79.7Confident98 Ų9876.4 Ų76.451%0.51347%0.465SS..Hα-helixtrans-63.2-43.9175.8-173.471.5000111.8N227 L228 L234 A235N227-L231 WeakPolarHBondContact O-CB 3.45Å; N227-L231 PolarHBondContact O-N 3.27Å; L228-L231 PolarHBondContact O-N 3.26Å; L231-L234 PolarHBondContact O-N 3.35Å; L231-A235 WeakPolarHBondContact O-CB 3.45Å; L231-A235 PolarHBondContact O-N 3.26Å
232V77.6Confident79.6Confident89 Ų8976.4 Ų76.454%0.53946%0.459SS..Hα-helixtrans-63.1-45.5176.3170.20000110.9L228 T229 A235 C236L228-V232 VanDerWaalsContact O-CG2 3.27Å; L228-V232 WeakPolarHBondContact O-CG2 3.47Å; L228-V232 PolarHBondContact O-N 3.43Å; T229-V232 PolarHBondContact O-N 3.3Å; V232-A235 PolarHBondContact O-N 2.73Å; V232-C236 WeakPolarHBondContact O-CB 3.31Å; V232-C236 PolarHBondContact O-N 2.9Å; V232-C236 PolarHBondContact O-SG 2.93Å
233L81.5Confident79.2Confident121 Ų12176.8 Ų76.863%0.63446%0.459SS*.Hα-helixtrans-62.2-45.3178.4-170.576.2000111.3T229 G230 A235 C236 V237T229-L233 WeakPolarHBondContact O-CB 3.42Å; T229-L233 PolarHBondContact O-N 3.03Å; G230-L233 PolarHBondContact O-N 2.98Å; L233-A235 PolarHBondContact O-N 3.37Å; L233-C236 WeakPolarHBondContact O-CB 3.42Å; L233-C236 PolarHBondContact O-N 3.42Å; L233-V237 WeakPolarHBondContact O-CG2 3.45Å; L233-V237 PolarHBondContact O-N 3.47Å
234L81.4Confident79.2Confident65 Ų6579.6 Ų79.634%0.3448%0.48SS..Hα-helixtrans-61.1-44.7176.7-176.668.1000111.2L18 G230 L231 C236 V237 L238L18-L234 HydrophobicContact CD1-CD2 3.94Å; L18-L234 HydrophobicContact CD2-CD2 3.87Å; G230-L234 WeakPolarHBondContact O-CB 3.31Å; G230-L234 PolarHBondContact O-N 2.84Å; L231-L234 PolarHBondContact O-N 3.35Å; L234-C236 VanDerWaalsContact C-N 3.33Å; L234-C236 PolarHBondContact O-N 3.45Å; L234-V237 PolarHBondContact O-N 2.94Å; L234-L238 HydrophobicContact CD1-CD1 4.49Å; L234-L238 HydrophobicContact CG-CD1 4.07Å; L234-L238 WeakPolarHBondContact O-CB 3.31Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.91Å
235A75.1Confident79.2Confident57 Ų5782.7 Ų82.747%0.47149%0.494SS..Hα-helixtrans-61.4-40.3175.300000112L231 V232 L233 A239L231-A235 WeakPolarHBondContact O-CB 3.45Å; L231-A235 PolarHBondContact O-N 3.26Å; V232-A235 PolarHBondContact O-N 2.73Å; L233-A235 PolarHBondContact O-N 3.37Å; A235-A239 VanDerWaalsContact O-CB 3.26Å; A235-A239 WeakPolarHBondContact O-CB 3.46Å; A235-A239 PolarHBondContact O-N 2.91Å
236C79.4Confident79Confident70 Ų7082 Ų8247%0.47349%0.487SS..Hα-helixtrans-63.9-45.9174.6-72.90000112.1V232 L233 L234 A239 V240V232-C236 WeakPolarHBondContact O-CB 3.31Å; V232-C236 PolarHBondContact O-N 2.9Å; V232-C236 PolarHBondContact O-SG 2.93Å; L233-C236 WeakPolarHBondContact O-CB 3.42Å; L233-C236 PolarHBondContact O-N 3.42Å; L234-C236 VanDerWaalsContact C-N 3.33Å; L234-C236 PolarHBondContact O-N 3.45Å; C236-A239 PolarHBondContact O-N 3.34Å; C236-V240 VanDerWaalsContact O-CG2 3.3Å; C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 2.89Å
237V82.9Confident78.7Confident78 Ų7881.4 Ų81.447%0.47349%0.485SS..Hα-helixtrans-62.4-46.3177.5172.20000110.5L233 L234 A239 V240 T241L233-V237 WeakPolarHBondContact O-CG2 3.45Å; L233-V237 PolarHBondContact O-N 3.47Å; L234-V237 PolarHBondContact O-N 2.94Å; V237-A239 VanDerWaalsContact C-N 3.34Å; V237-A239 PolarHBondContact O-N 3.45Å; V237-V240 PolarHBondContact O-N 3.21Å; V237-T241 HydrophobicContact CG1-CG2 4.3Å; V237-T241 WeakPolarHBondContact O-CG2 3.39Å; V237-T241 PolarHBondContact O-N 2.92Å; V237-T241 PolarHBondContact O-OG1 3.39Å
238L78.6Confident78.6Confident96 Ų9684.7 Ų84.750%0.50350%0.503SS..Hα-helixtrans-61.1-41.2175.5-73.8170.1000112.1L234 T241 V242L234-L238 HydrophobicContact CD1-CD1 4.49Å; L234-L238 HydrophobicContact CG-CD1 4.07Å; L234-L238 WeakPolarHBondContact O-CB 3.31Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.91Å; L238-T241 WeakPolarHBondContact CA-OG1 3.27Å; L238-T241 PolarHBondContact O-N 3.45Å; L238-T241 PolarHBondContact O-OG1 3.41Å; L238-V242 WeakPolarHBondContact O-CB 3.27Å; L238-V242 WeakPolarHBondContact O-CG2 3.36Å; L238-V242 PolarHBondContact O-N 3.35Å
239A76.1Confident78.6Confident55 Ų5584.5 Ų84.546%0.45550%0.502SS..Hα-helixtrans-61.8-46.4175.200000111A235 C236 V237 V242 T243A235-A239 VanDerWaalsContact O-CB 3.26Å; A235-A239 WeakPolarHBondContact O-CB 3.46Å; A235-A239 PolarHBondContact O-N 2.91Å; C236-A239 PolarHBondContact O-N 3.34Å; V237-A239 VanDerWaalsContact C-N 3.34Å; V237-A239 PolarHBondContact O-N 3.45Å; A239-V242 PolarHBondContact O-N 2.7Å; A239-T243 VanDerWaalsContact O-CG2 3.24Å; A239-T243 WeakPolarHBondContact O-CG2 3.28Å; A239-T243 PolarHBondContact O-N 3.45Å; A239-T243 PolarHBondContact O-OG1 2.99Å
240V82.1Confident78.4Confident88 Ų8882.2 Ų82.253%0.53349%0.488SS..Hα-helixtrans-62.4-47.8177.6172.30000110.9C236 V237 V242 T243 V244C236-V240 VanDerWaalsContact O-CG2 3.3Å; C236-V240 WeakPolarHBondContact O-CG2 3.38Å; C236-V240 PolarHBondContact O-N 2.89Å; V237-V240 PolarHBondContact O-N 3.21Å; V240-V242 VanDerWaalsContact C-N 3.34Å; V240-V242 PolarHBondContact O-N 3.45Å; V240-T243 WeakPolarHBondContact CA-OG1 3.49Å; V240-T243 PolarHBondContact O-N 3.02Å; V240-T243 PolarHBondContact O-OG1 3.19Å; V240-V244 HydrophobicContact CG1-CG2 4.4Å; V240-V244 WeakPolarHBondContact O-CG2 3.49Å; V240-V244 PolarHBondContact O-N 3.25Å
241T79.4Confident78Confident73 Ų7385.8 Ų85.845%0.44850%0.497SS..Hα-helixtrans-62.7-41179.455.90000111.8V237 L238 V244 L245V237-T241 HydrophobicContact CG1-CG2 4.3Å; V237-T241 WeakPolarHBondContact O-CG2 3.39Å; V237-T241 PolarHBondContact O-N 2.92Å; V237-T241 PolarHBondContact O-OG1 3.39Å; L238-T241 WeakPolarHBondContact CA-OG1 3.27Å; L238-T241 PolarHBondContact O-N 3.45Å; L238-T241 PolarHBondContact O-OG1 3.41Å; T241-V244 PolarHBondContact O-N 3.2Å; T241-L245 WeakPolarHBondContact O-CB 3.44Å; T241-L245 PolarHBondContact O-N 3.09Å
242V77.6Confident78.1Confident62 Ų6289.1 Ų89.138%0.37650%0.503SS..Hα-helixtrans-66.4-38.4175.5175.30000111.5L238 A239 V240 H246 T250L238-V242 WeakPolarHBondContact O-CB 3.27Å; L238-V242 WeakPolarHBondContact O-CG2 3.36Å; L238-V242 PolarHBondContact O-N 3.35Å; A239-V242 PolarHBondContact O-N 2.7Å; V240-V242 VanDerWaalsContact C-N 3.34Å; V240-V242 PolarHBondContact O-N 3.45Å; V242-H246 CarbonylContact O-C 3.59Å; V242-H246 WeakPolarHBondContact O-CA 3.48Å; V242-H246 PolarHBondContact O-N 2.92Å; V242-T250 HydrophobicContact CG1-CG2 3.72Å
243T75.8Confident78Confident66 Ų6689.4 Ų89.441%0.40550%0.501SS..Hα-helixtrans-64.2-38.7174.957.60000112.9A239 V240 T250A239-T243 VanDerWaalsContact O-CG2 3.24Å; A239-T243 WeakPolarHBondContact O-CG2 3.28Å; A239-T243 PolarHBondContact O-N 3.45Å; A239-T243 PolarHBondContact O-OG1 2.99Å; V240-T243 WeakPolarHBondContact CA-OG1 3.49Å; V240-T243 PolarHBondContact O-N 3.02Å; V240-T243 PolarHBondContact O-OG1 3.19Å; T243-T250 HydrophobicContact CG2-CG2 3.68Å
244V80.4Confident77.6Confident116 Ų11686.3 Ų86.370%0.70349%0.493SS*.Hα-helixtrans-74.3-39.9179.1173.60000111.1V240 T241V240-V244 HydrophobicContact CG1-CG2 4.4Å; V240-V244 WeakPolarHBondContact O-CG2 3.49Å; V240-V244 PolarHBondContact O-N 3.25Å; T241-V244 PolarHBondContact O-N 3.2Å
245L78.3Confident77.3Confident130 Ų13087 Ų8768%0.68150%0.5SS*.Hα-helixtrans-82.5-30.9-175.6-153.871000112.9T241T241-L245 WeakPolarHBondContact O-CB 3.44Å; T241-L245 PolarHBondContact O-N 3.09Å
246H76.6Confident77.5Confident99 Ų9989.7 Ų89.746%0.45850%0.503SS..  trans-13972.8-176.5-67.2-58.3000112.5V242 D248 L249 T250V242-H246 CarbonylContact O-C 3.59Å; V242-H246 WeakPolarHBondContact O-CA 3.48Å; V242-H246 PolarHBondContact O-N 2.92Å; H246-D248 VanDerWaalsContact C-N 3.34Å; H246-D248 PolarHBondContact O-N 3.37Å; H246-L249 HydrophobicContact CB-CB 3.89Å; H246-L249 PolarHBondContact O-N 3.25Å; H246-T250 PolarHBondContact O-N 2.89Å; H246-T250 VanDerWaalsContact O-N 3.17Å; H246-T250 PolarHBondContact O-OG1 3.48Å
247P77.8Confident77.2Confident80 Ų8088.5 Ų88.552%0.51950%0.498SS..Hα-helixtrans-62-37.2-177.824.5-34.2000113.1L249 T250 L251P247-L249 VanDerWaalsContact C-N 3.31Å; P247-L249 PolarHBondContact O-N 3.02Å; P247-T250 PolarHBondContact O-N 3.26Å; P247-T250 PolarHBondContact O-OG1 2.82Å; P247-L251 WeakPolarHBondContact O-CB 3.36Å; P247-L251 PolarHBondContact O-N 2.97Å; P247-L251 VanDerWaalsContact O-N 3.07Å
248D77.1Confident76.8Confident115 Ų11590.1 Ų90.162%0.61550%0.504SS*.Hα-helixtrans-66.7-32.2178.6-75.5-33000113.2H246 R252H246-D248 VanDerWaalsContact C-N 3.34Å; H246-D248 PolarHBondContact O-N 3.37Å; D248-R252 VanDerWaalsContact O-CG 3.28Å; D248-R252 WeakPolarHBondContact O-CG 3.49Å; D248-R252 PolarHBondContact O-N 3.5Å
249L75.9Confident76.4Confident96 Ų9688.9 Ų88.950%0.50350%0.503SS..Hα-helixtrans-78.8-38.5-177.4-138156.5000110.2H246 P247 R252 L253H246-L249 HydrophobicContact CB-CB 3.89Å; H246-L249 PolarHBondContact O-N 3.25Å; P247-L249 VanDerWaalsContact C-N 3.31Å; P247-L249 PolarHBondContact O-N 3.02Å; L249-R252 PolarHBondContact O-N 2.87Å; L249-L253 HydrophobicContact CD2-CD1 3.9Å; L249-L253 HydrophobicContact CD2-CG 4.38Å; L249-L253 WeakPolarHBondContact O-CG 3.4Å; L249-L253 PolarHBondContact O-N 3.03Å
250T73.4Confident76.2Confident33 Ų3392.8 Ų92.820%0.20251%0.512CS..Hα-helixtrans-69.5-36.5175.256.60000113.1V242 T243 H246 P247 R252 L253 A254V242-T250 HydrophobicContact CG1-CG2 3.72Å; T243-T250 HydrophobicContact CG2-CG2 3.68Å; H246-T250 PolarHBondContact O-N 2.89Å; H246-T250 VanDerWaalsContact O-N 3.17Å; H246-T250 PolarHBondContact O-OG1 3.48Å; P247-T250 PolarHBondContact O-N 3.26Å; P247-T250 PolarHBondContact O-OG1 2.82Å; T250-R252 PolarHBondContact O-N 3.38Å; T250-L253 PolarHBondContact O-N 3.06Å; T250-A254 VanDerWaalsContact O-CB 3.23Å; T250-A254 WeakPolarHBondContact O-CB 3.17Å; T250-A254 PolarHBondContact O-N 3.39Å
251L76.1Confident75.4Confident115 Ų11592.7 Ų92.760%0.60251%0.508SS*.Hα-helixtrans-64.8-39174.3-170.266.8000112.1P247 T255P247-L251 WeakPolarHBondContact O-CB 3.36Å; P247-L251 PolarHBondContact O-N 2.97Å; P247-L251 VanDerWaalsContact O-N 3.07Å; L251-T255 WeakPolarHBondContact O-CB 3.26Å; L251-T255 VanDerWaalsContact O-CG2 3.27Å; L251-T255 WeakPolarHBondContact O-CG2 3.19Å; L251-T255 PolarHBondContact O-N 2.92Å; L251-T255 PolarHBondContact O-OG1 2.9Å
252R77.4Confident74.8Confident168 Ų16895.1 Ų95.163%0.63451%0.514SS*.Hα-helixtrans-67.4-43.3175.2-71.1176.2-158.8-165.75.8112.5D248 L249 T250 T255 Q256D248-R252 VanDerWaalsContact O-CG 3.28Å; D248-R252 WeakPolarHBondContact O-CG 3.49Å; D248-R252 PolarHBondContact O-N 3.5Å; L249-R252 PolarHBondContact O-N 2.87Å; T250-R252 PolarHBondContact O-N 3.38Å; R252-T255 WeakPolarHBondContact CA-OG1 3.31Å; R252-T255 PolarHBondContact O-OG1 2.86Å; R252-Q256 WeakPolarHBondContact O-CB 3.41Å; R252-Q256 WeakPolarHBondContact O-CG 3.45Å; R252-Q256 PolarHBondContact O-N 2.93Å
253L75.3Confident74.3Confident95 Ų9596 Ų9650%0.49753%0.527SS..Hα-helixtrans-66.6-40.1175.9-73.9170.4000112.1L249 T250 Q256 A257L249-L253 HydrophobicContact CD2-CD1 3.9Å; L249-L253 HydrophobicContact CD2-CG 4.38Å; L249-L253 WeakPolarHBondContact O-CG 3.4Å; L249-L253 PolarHBondContact O-N 3.03Å; T250-L253 PolarHBondContact O-N 3.06Å; L253-Q256 PolarHBondContact O-N 2.86Å; L253-A257 VanDerWaalsContact O-CB 3.29Å; L253-A257 WeakPolarHBondContact O-CB 3.4Å; L253-A257 PolarHBondContact O-N 3.35Å
254A73.4Confident73.7Confident56 Ų56100.6 Ų100.646%0.46354%0.537SS..Hα-helixtrans-64.6-42.6177.100000111.7T250 A257 L258T250-A254 VanDerWaalsContact O-CB 3.23Å; T250-A254 WeakPolarHBondContact O-CB 3.17Å; T250-A254 PolarHBondContact O-N 3.39Å; A254-A257 PolarHBondContact O-N 3Å; A254-L258 WeakPolarHBondContact O-CB 3.37Å; A254-L258 PolarHBondContact O-N 2.85Å
255T75.8Confident72.9Confident80 Ų8099.2 Ų99.249%0.49153%0.53SS..Hα-helixtrans-68.3-36.9177.249.10000112.6L251 R252 S259L251-T255 WeakPolarHBondContact O-CB 3.26Å; L251-T255 VanDerWaalsContact O-CG2 3.27Å; L251-T255 WeakPolarHBondContact O-CG2 3.19Å; L251-T255 PolarHBondContact O-N 2.92Å; L251-T255 PolarHBondContact O-OG1 2.9Å; R252-T255 WeakPolarHBondContact CA-OG1 3.31Å; R252-T255 PolarHBondContact O-OG1 2.86Å; T255-S259 WeakPolarHBondContact O-CB 2.78Å; T255-S259 PolarHBondContact O-N 3.48Å; T255-S259 PolarHBondContact O-OG 3.45Å
256Q78.4Confident72.2Confident112 Ų11296.5 Ų96.552%0.52352%0.522SS..Hα-helixtrans-67.6-44171.9-75.6176.8-24.500112.9R252 L253 S259 Q260R252-Q256 WeakPolarHBondContact O-CB 3.41Å; R252-Q256 WeakPolarHBondContact O-CG 3.45Å; R252-Q256 PolarHBondContact O-N 2.93Å; L253-Q256 PolarHBondContact O-N 2.86Å; Q256-S259 WeakPolarHBondContact CA-OG 3.35Å; Q256-S259 PolarHBondContact O-N 3.31Å; Q256-S259 PolarHBondContact O-OG 2.86Å; Q256-Q260 WeakPolarHBondContact O-CB 3.49Å; Q256-Q260 VanDerWaalsContact O-CG 3.29Å; Q256-Q260 WeakPolarHBondContact O-CG 3.38Å; Q256-Q260 PolarHBondContact O-N 2.91Å
257A72.8Confident71.6Confident46 Ų4697 Ų9738%0.3852%0.521SS..Hα-helixtrans-65.7-40.7176.800000111.7L253 A254 Q260 L261L253-A257 VanDerWaalsContact O-CB 3.29Å; L253-A257 WeakPolarHBondContact O-CB 3.4Å; L253-A257 PolarHBondContact O-N 3.35Å; A254-A257 PolarHBondContact O-N 3Å; A257-Q260 PolarHBondContact O-N 2.87Å; A257-L261 WeakPolarHBondContact O-CB 3.32Å; A257-L261 WeakPolarHBondContact O-CG 3.32Å; A257-L261 PolarHBondContact O-N 3.46Å
258L74.2Confident71.1Confident112 Ų11298.1 Ų98.159%0.58652%0.519SS*.Hα-helixtrans-67.5-38178.6-157.981.1000111.8A254 H262A254-L258 WeakPolarHBondContact O-CB 3.37Å; A254-L258 PolarHBondContact O-N 2.85Å; L258-H262 WeakPolarHBondContact O-CB 3.27Å; L258-H262 PolarHBondContact O-N 3Å
259S71.6Confident70.8Confident69 Ų69100.2 Ų100.248%0.48352%0.518SS..Hα-helixtrans-69.5-38.6174.654.80000112.4T255 Q256 H262 A263T255-S259 WeakPolarHBondContact O-CB 2.78Å; T255-S259 PolarHBondContact O-N 3.48Å; T255-S259 PolarHBondContact O-OG 3.45Å; Q256-S259 WeakPolarHBondContact CA-OG 3.35Å; Q256-S259 PolarHBondContact O-N 3.31Å; Q256-S259 PolarHBondContact O-OG 2.86Å; S259-H262 PolarHBondContact O-N 3.09Å; S259-A263 WeakPolarHBondContact O-CB 3.32Å; S259-A263 PolarHBondContact O-N 3.48Å
260Q71.9Confident70.6Confident137 Ų137101.1 Ų101.164%0.6452%0.523SS*.Hα-helixtrans-67.5-37.1173.4-73.9180-2.500112.8Q256 A257 A263 R264Q256-Q260 WeakPolarHBondContact O-CB 3.49Å; Q256-Q260 VanDerWaalsContact O-CG 3.29Å; Q256-Q260 WeakPolarHBondContact O-CG 3.38Å; Q256-Q260 PolarHBondContact O-N 2.91Å; A257-Q260 PolarHBondContact O-N 2.87Å; Q260-A263 PolarHBondContact O-N 3.44Å; Q260-R264 PolarHBondContact O-N 3.02Å
261L64.7Low70.7Confident86 Ų86106 Ų10645%0.4554%0.538SS..Hα-helixtrans-66.4-40.9173.1-81.8163.7000111.4A257 A263 R264A257-L261 WeakPolarHBondContact O-CB 3.32Å; A257-L261 WeakPolarHBondContact O-CG 3.32Å; A257-L261 PolarHBondContact O-N 3.46Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.92Å; L261-R264 PolarHBondContact O-N 3.15Å
262H66.4Low70.8Confident125 Ų125103.9 Ų103.958%0.57953%0.525SS*.Hα-helixtrans-65-32.5173.1-107.5125000113L258 S259 R264L258-H262 WeakPolarHBondContact O-CB 3.27Å; L258-H262 PolarHBondContact O-N 3Å; S259-H262 PolarHBondContact O-N 3.09Å; H262-R264 VanDerWaalsContact C-N 3.31Å; H262-R264 PolarHBondContact O-N 2.81Å
263A66.6Low70.8Confident79 Ų7999.5 Ų99.565%0.65351%0.514SS*.Hα-helixtrans-76.1-13178.400000113.9S259 Q260 L261 P265S259-A263 WeakPolarHBondContact O-CB 3.32Å; S259-A263 PolarHBondContact O-N 3.48Å; Q260-A263 PolarHBondContact O-N 3.44Å; L261-A263 VanDerWaalsContact C-N 3.3Å; L261-A263 PolarHBondContact O-N 2.92Å; A263-P265 WeakPolarHBondContact O-CD 3.39Å
264R63Low70.8Confident163 Ų16399.1 Ų99.162%0.61552%0.515SS*.  trans-79.4120.7179.1-81.8-171.5177.8-178.31111.6Q260 L261 H262 S266 Y267Q260-R264 PolarHBondContact O-N 3.02Å; L261-R264 PolarHBondContact O-N 3.15Å; H262-R264 VanDerWaalsContact C-N 3.31Å; H262-R264 PolarHBondContact O-N 2.81Å; R264-S266 PolarHBondContact O-N 3.3Å; R264-S266 VanDerWaalsContact O-N 3.1Å; R264-Y267 PolarHBondContact O-N 3.2Å
265P63.9Low70.9Confident87 Ų87100.5 Ų100.557%0.56551%0.513SS*.Hα-helixtrans-68.1-12.2-179.327.5-34.9000113.9A263 R269A263-P265 WeakPolarHBondContact O-CD 3.39Å; P265-R269 PolarHBondContact O-NE 3.22Å
266S64.8Low71Confident73 Ų73103.1 Ų103.151%0.5151%0.514SS..Hα-helixtrans-76.3-32.1172.355.20000112.7R264 L270R264-S266 PolarHBondContact O-N 3.3Å; R264-S266 VanDerWaalsContact O-N 3.1Å; S266-L270 WeakPolarHBondContact O-CB 3.32Å; S266-L270 PolarHBondContact O-N 3.07Å
267Y63.2Low70.8Confident111 Ų111103.3 Ų103.344%0.43552%0.518SS..Hα-helixtrans-70.5-41.3179.3-178.3-102.8000111.4R264 L270 R271R264-Y267 PolarHBondContact O-N 3.2Å; Y267-L270 PolarHBondContact O-N 3.21Å; Y267-R271 VanDerWaalsContact O-CB 3.22Å; Y267-R271 WeakPolarHBondContact O-CB 3.39Å; Y267-R271 PolarHBondContact O-N 3.34Å
268H68.3Low70.4Confident102 Ų102103.2 Ų103.247%0.47252%0.515SS..Hα-helixtrans-63.8-43.6176.5-155.7-81.3000111.7R271 E272H268-R271 PolarHBondContact O-N 2.93Å; H268-E272 IonicContact CE1-OE1 2.93Å; H268-E272 PolarHBondContact CE1-OE1 2.89Å; H268-E272 IonicContact ND1-OE1 2.77Å; H268-E272 PolarHBondContact ND1-OE1 3.44Å; H268-E272 WeakPolarHBondContact O-CB 3.43Å; H268-E272 WeakPolarHBondContact O-CG 3.04Å; H268-E272 PolarHBondContact O-N 2.9Å
269R70.8Confident70.4Confident160 Ų160105.6 Ų105.660%0.60452%0.516SS*.Hα-helixtrans-62.5-48.2175-84.5-172.8-89.8-148.3-1.8112.4P265 R271 E272 D273P265-R269 PolarHBondContact O-NE 3.22Å; R269-R271 VanDerWaalsContact C-N 3.34Å; R269-R271 PolarHBondContact O-N 3.36Å; R269-E272 PolarHBondContact O-N 3.39Å; R269-D273 WeakPolarHBondContact O-CB 3.36Å; R269-D273 VanDerWaalsContact O-CG 3.26Å; R269-D273 PolarHBondContact O-N 3.4Å
270L71.4Confident70.4Confident114 Ų114108 Ų10860%0.59752%0.523SS*.Hα-helixtrans-63.7-39.8179.3-154.387.3000112S266 Y267 D273 V274S266-L270 WeakPolarHBondContact O-CB 3.32Å; S266-L270 PolarHBondContact O-N 3.07Å; Y267-L270 PolarHBondContact O-N 3.21Å; L270-D273 PolarHBondContact O-N 2.9Å; L270-V274 WeakPolarHBondContact O-CB 3.27Å; L270-V274 WeakPolarHBondContact O-CG2 3.28Å; L270-V274 PolarHBondContact O-N 2.99Å
271R75Confident70Confident135 Ų135103.4 Ų103.451%0.50951%0.508SS..Hα-helixtrans-64.8-42.6176.1-178.7177.9175.4-124.92.2111.5Y267 H268 R269 M275Y267-R271 VanDerWaalsContact O-CB 3.22Å; Y267-R271 WeakPolarHBondContact O-CB 3.39Å; Y267-R271 PolarHBondContact O-N 3.34Å; H268-R271 PolarHBondContact O-N 2.93Å; R269-R271 VanDerWaalsContact C-N 3.34Å; R269-R271 PolarHBondContact O-N 3.36Å; R271-M275 VanDerWaalsContact O-CB 3.23Å; R271-M275 WeakPolarHBondContact O-CB 3.24Å; R271-M275 WeakPolarHBondContact O-CG 3.35Å; R271-M275 PolarHBondContact O-N 3.41Å
272E77.1Confident69.9Low72 Ų72105 Ų10534%0.33652%0.517SS..Hα-helixtrans-63.5-42.9174.4-79.1-177.4-149.600112.1H268 R269 M275 R276H268-E272 IonicContact CE1-OE1 2.93Å; H268-E272 PolarHBondContact CE1-OE1 2.89Å; H268-E272 IonicContact ND1-OE1 2.77Å; H268-E272 PolarHBondContact ND1-OE1 3.44Å; H268-E272 WeakPolarHBondContact O-CB 3.43Å; H268-E272 WeakPolarHBondContact O-CG 3.04Å; H268-E272 PolarHBondContact O-N 2.9Å; R269-E272 PolarHBondContact O-N 3.39Å; E272-M275 CarbonylContact O-C 3.53Å; E272-M275 PolarHBondContact O-N 3.41Å; E272-R276 WeakPolarHBondContact O-CB 3.33Å; E272-R276 VanDerWaalsContact O-CG 3.31Å; E272-R276 WeakPolarHBondContact O-CG 3.34Å; E272-R276 PolarHBondContact O-N 3.01Å; E272-R276 IonicContact OE2-NH2 3.31Å; E272-R276 PolarHBondContact OE2-NH2 2.96Å
273D77.3Confident69.7Low75 Ų75101.3 Ų101.340%0.40151%0.512SS..Hα-helixtrans-67.6-42.3179.7-70.2-24.9000111.6R269 L270 M275 R276 L277R269-D273 WeakPolarHBondContact O-CB 3.36Å; R269-D273 VanDerWaalsContact O-CG 3.26Å; R269-D273 PolarHBondContact O-N 3.4Å; L270-D273 PolarHBondContact O-N 2.9Å; D273-M275 VanDerWaalsContact C-N 3.34Å; D273-M275 PolarHBondContact O-N 3.49Å; D273-R276 PolarHBondContact O-N 3.47Å; D273-L277 WeakPolarHBondContact O-CB 3.45Å; D273-L277 VanDerWaalsContact O-CG 3.28Å; D273-L277 WeakPolarHBondContact O-CG 3.17Å; D273-L277 PolarHBondContact O-N 2.89Å
274V76.3Confident69.6Low87 Ų8799.7 Ų99.753%0.52750%0.496SS..Hα-helixtrans-64.3-39.2173.21710000111L270 S278L270-V274 WeakPolarHBondContact O-CB 3.27Å; L270-V274 WeakPolarHBondContact O-CG2 3.28Å; L270-V274 PolarHBondContact O-N 2.99Å; V274-S278 WeakPolarHBondContact O-CB 3.28Å; V274-S278 PolarHBondContact O-N 2.85Å; V274-S278 PolarHBondContact O-OG 2.97Å; V274-S278 VanDerWaalsContact O-OG 3.06Å
275M76.3Confident69.6Low85 Ų8598.7 Ų98.742%0.41950%0.499SS..Hα-helixtrans-70.7-28.2175.2-87.1-93.2-81.100113.6R271 E272 D273 S278 R279R271-M275 VanDerWaalsContact O-CB 3.23Å; R271-M275 WeakPolarHBondContact O-CB 3.24Å; R271-M275 WeakPolarHBondContact O-CG 3.35Å; R271-M275 PolarHBondContact O-N 3.41Å; E272-M275 CarbonylContact O-C 3.53Å; E272-M275 PolarHBondContact O-N 3.41Å; D273-M275 VanDerWaalsContact C-N 3.34Å; D273-M275 PolarHBondContact O-N 3.49Å; M275-S278 WeakPolarHBondContact CA-OG 3.45Å; M275-S278 PolarHBondContact O-OG 3.44Å; M275-R279 WeakPolarHBondContact O-CB 3.24Å; M275-R279 WeakPolarHBondContact O-CG 3.46Å; M275-R279 PolarHBondContact O-N 2.91Å; M275-R279 PolarHBondContact O-NE 3.33Å
276R77.8Confident69.5Low136 Ų13697.2 Ų97.251%0.51349%0.494SS..Hα-helixtrans-74.6-47.5172.1-77.2177.9-143.7-169.16.8110.2E272 D273 R279 L280E272-R276 WeakPolarHBondContact O-CB 3.33Å; E272-R276 VanDerWaalsContact O-CG 3.31Å; E272-R276 WeakPolarHBondContact O-CG 3.34Å; E272-R276 PolarHBondContact O-N 3.01Å; E272-R276 IonicContact OE2-NH2 3.31Å; E272-R276 PolarHBondContact OE2-NH2 2.96Å; D273-R276 PolarHBondContact O-N 3.47Å; R276-R279 PolarHBondContact O-N 2.76Å; R276-L280 WeakPolarHBondContact O-CB 3.34Å; R276-L280 VanDerWaalsContact O-CG 3.25Å; R276-L280 WeakPolarHBondContact O-CG 3.21Å; R276-L280 PolarHBondContact O-N 3.33Å
277L72.9Confident69.2Low115 Ų115100.2 Ų100.260%0.60249%0.494SS*.Hα-helixtrans-65-39.2178.3-72.1170.6000112.1D273 L280 A281D273-L277 WeakPolarHBondContact O-CB 3.45Å; D273-L277 VanDerWaalsContact O-CG 3.28Å; D273-L277 WeakPolarHBondContact O-CG 3.17Å; D273-L277 PolarHBondContact O-N 2.89Å; L277-L280 PolarHBondContact O-N 3.41Å; L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.38Å; L277-A281 PolarHBondContact O-N 3.49Å
278S66Low69.2Low44 Ų44102 Ų10231%0.30850%0.5SS..Hα-helixtrans-67.5-38.6175.469.60000111.9V274 M275 A281 L282V274-S278 WeakPolarHBondContact O-CB 3.28Å; V274-S278 PolarHBondContact O-N 2.85Å; V274-S278 PolarHBondContact O-OG 2.97Å; V274-S278 VanDerWaalsContact O-OG 3.06Å; M275-S278 WeakPolarHBondContact CA-OG 3.45Å; M275-S278 PolarHBondContact O-OG 3.44Å; S278-A281 PolarHBondContact O-N 3.13Å; S278-L282 WeakPolarHBondContact O-CB 3.29Å; S278-L282 WeakPolarHBondContact O-CD1 3.44Å; S278-L282 PolarHBondContact O-N 2.86Å
279R73.8Confident69.2Low162 Ų162104.2 Ų104.261%0.61150%0.504SS*.Hα-helixtrans-67.8-35.8172.5-86.1-176.9-80.8-166.2-3.2113M275 R276 G283M275-R279 WeakPolarHBondContact O-CB 3.24Å; M275-R279 WeakPolarHBondContact O-CG 3.46Å; M275-R279 PolarHBondContact O-N 2.91Å; M275-R279 PolarHBondContact O-NE 3.33Å; R276-R279 PolarHBondContact O-N 2.76Å; R279-G283 WeakPolarHBondContact O-CA 3.47Å; R279-G283 PolarHBondContact O-N 3.07Å
280L72Confident69.2Low120 Ų120100.6 Ų100.663%0.62850%0.5SS*.Hα-helixtrans-68.5-40.7173.8-72.6166.3000111.4R276 L277 G283 S284R276-L280 WeakPolarHBondContact O-CB 3.34Å; R276-L280 VanDerWaalsContact O-CG 3.25Å; R276-L280 WeakPolarHBondContact O-CG 3.21Å; R276-L280 PolarHBondContact O-N 3.33Å; L277-L280 PolarHBondContact O-N 3.41Å; L280-G283 PolarHBondContact O-N 2.78Å; L280-S284 PolarHBondContact O-N 3.42Å
281A62.6Low68.9Low41 Ų41102.5 Ų102.534%0.33950%0.499SS..Hα-helixtrans-65.6-45.4175.200000112.1L277 S278 W287L277-A281 VanDerWaalsContact O-CB 3.29Å; L277-A281 WeakPolarHBondContact O-CB 3.38Å; L277-A281 PolarHBondContact O-N 3.49Å; S278-A281 PolarHBondContact O-N 3.13Å; A281-W287 WeakPolarHBondContact O-CB 3.39Å; A281-W287 VanDerWaalsContact O-CD1 3.23Å
282L63Low68.5Low120 Ų12098.7 Ų98.763%0.62849%0.493SS*.Hα-helixtrans-74.6-21.2175.2-90.1104000114S278 R288S278-L282 WeakPolarHBondContact O-CB 3.29Å; S278-L282 WeakPolarHBondContact O-CD1 3.44Å; S278-L282 PolarHBondContact O-N 2.86Å; L282-R288 PolarHBondContact O-NH1 3.22Å; L282-R288 PolarHBondContact O-NH2 3.32Å
283G62.8Low67.8Low47 Ų47103.2 Ų103.249%0.48551%0.507SS..Hα-helixtrans-83.4-25.9178.700000113.2R279 L280 E285R279-G283 WeakPolarHBondContact O-CA 3.47Å; R279-G283 PolarHBondContact O-N 3.07Å; L280-G283 PolarHBondContact O-N 2.78Å; G283-E285 PolarHBondContact O-N 3.43Å
284S63.1Low66.8Low45 Ų45102.3 Ų102.332%0.31551%0.507SS..  trans-71.8120.4-179.687.30000111.8L280 A286 W287 R288L280-S284 PolarHBondContact O-N 3.42Å; S284-A286 PolarHBondContact O-N 2.86Å; S284-W287 PolarHBondContact O-N 3.35Å; S284-W287 WeakPolarHBondContact OG-CB 3.5Å; S284-W287 PolarHBondContact OG-N 3.29Å; S284-R288 PolarHBondContact O-N 3.46Å
285E62.7Low66Low142 Ų142102.6 Ų102.666%0.66450%0.504SS*.Hα-helixtrans-62.5-21.1172.5-65.4175.5167.200112.2G283 R289G283-E285 PolarHBondContact O-N 3.43Å; E285-R289 WeakPolarHBondContact O-CB 3.34Å; E285-R289 WeakPolarHBondContact O-CG 3.33Å; E285-R289 PolarHBondContact O-N 2.83Å; E285-R289 VanDerWaalsContact O-N 3.15Å; E285-R289 PolarHBondContact O-NE 3.5Å
286A62.4Low65.2Low56 Ų56104.8 Ų104.846%0.46351%0.514SS..Hα-helixtrans-69.7-46.6173.600000111.9S284 R288 R289 V290S284-A286 PolarHBondContact O-N 2.86Å; A286-R288 VanDerWaalsContact C-N 3.35Å; A286-R289 PolarHBondContact O-N 2.88Å; A286-V290 WeakPolarHBondContact O-CG2 3.29Å; A286-V290 PolarHBondContact O-N 2.92Å
287W58.2Low64.2Low136 Ų136104.3 Ų104.352%0.51552%0.521SS..Hα-helixtrans-65-39.5175.8-174.5-112.7000111.7A281 S284 R289 V290 W291A281-W287 WeakPolarHBondContact O-CB 3.39Å; A281-W287 VanDerWaalsContact O-CD1 3.23Å; S284-W287 PolarHBondContact O-N 3.35Å; S284-W287 WeakPolarHBondContact OG-CB 3.5Å; S284-W287 PolarHBondContact OG-N 3.29Å; W287-R289 VanDerWaalsContact C-N 3.29Å; W287-R289 PolarHBondContact O-N 3.31Å; W287-V290 PolarHBondContact O-N 2.88Å; W287-W291 VanDerWaalsContact O-CB 3.27Å; W287-W291 WeakPolarHBondContact O-CB 3.4Å; W287-W291 PolarHBondContact O-N 2.88Å
288R63.5Low63.1Low149 Ų149102.9 Ų102.956%0.56253%0.526SS*.Hα-helixtrans-60.4-37.9174.9-132.3-172.7-61.7-90.3-6.3112.2L282 S284 A286 S292L282-R288 PolarHBondContact O-NH1 3.22Å; L282-R288 PolarHBondContact O-NH2 3.32Å; S284-R288 PolarHBondContact O-N 3.46Å; A286-R288 VanDerWaalsContact C-N 3.35Å; R288-S292 WeakPolarHBondContact O-CB 3.25Å; R288-S292 PolarHBondContact O-N 3.47Å; R288-S292 PolarHBondContact O-OG 2.92Å
289R68.9Low62.4Low147 Ų147104.8 Ų104.856%0.55554%0.539SS*.Hα-helixtrans-73-36175.6-81.2-177-78.7163.3-11.1113.7E285 A286 W287 S292 R293E285-R289 WeakPolarHBondContact O-CB 3.34Å; E285-R289 WeakPolarHBondContact O-CG 3.33Å; E285-R289 PolarHBondContact O-N 2.83Å; E285-R289 VanDerWaalsContact O-N 3.15Å; E285-R289 PolarHBondContact O-NE 3.5Å; A286-R289 PolarHBondContact O-N 2.88Å; W287-R289 VanDerWaalsContact C-N 3.29Å; W287-R289 PolarHBondContact O-N 3.31Å; R289-S292 WeakPolarHBondContact CA-OG 3.45Å; R289-S292 PolarHBondContact O-OG 2.86Å; R289-S292 VanDerWaalsContact O-OG 3.09Å; R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 WeakPolarHBondContact O-CG 3.46Å; R289-R293 PolarHBondContact O-N 3.32Å; R289-R293 VanDerWaalsContact O-N 3.12Å
290V69.6Low60.7Low85 Ų85107.1 Ų107.152%0.51555%0.548SS..Hα-helixtrans-71.3-42.6176.3171.10000110.7A286 W287 R293 S294A286-V290 WeakPolarHBondContact O-CG2 3.29Å; A286-V290 PolarHBondContact O-N 2.92Å; W287-V290 PolarHBondContact O-N 2.88Å; V290-R293 PolarHBondContact O-N 3.27Å; V290-S294 PolarHBondContact O-N 3.01Å
291W65.1Low59.4Low153 Ų153106.8 Ų106.858%0.5855%0.553SS**Hα-helixtrans-65.3-41175.9-172.5-100.1000112.3W287 S294 L295W287-W291 VanDerWaalsContact O-CB 3.27Å; W287-W291 WeakPolarHBondContact O-CB 3.4Å; W287-W291 PolarHBondContact O-N 2.88Å; W291-S294 PolarHBondContact O-N 3.41Å; W291-S294 PolarHBondContact O-OG 3.39Å; W291-L295 VanDerWaalsContact CD1-CD1 3.43Å; W291-L295 HydrophobicContact CD2-CD1 4.2Å; W291-L295 HydrophobicContact CG-CD1 4.11Å; W291-L295 HydrophobicContact CZ2-CD1 4.2Å; W291-L295 WeakPolarHBondContact O-CD1 3.36Å; W291-L295 PolarHBondContact O-N 3.03Å
292S66.3Low58.6Low55 Ų55112.7 Ų112.739%0.38558%0.579SS.*Hα-helixtrans-66.5-37.7175.466.20000112.5R288 R289 Q296R288-S292 WeakPolarHBondContact O-CB 3.25Å; R288-S292 PolarHBondContact O-N 3.47Å; R288-S292 PolarHBondContact O-OG 2.92Å; R289-S292 WeakPolarHBondContact CA-OG 3.45Å; R289-S292 PolarHBondContact O-OG 2.86Å; R289-S292 VanDerWaalsContact O-OG 3.09Å; S292-Q296 VanDerWaalsContact O-CG 3.31Å; S292-Q296 WeakPolarHBondContact O-CG 3.25Å; S292-Q296 PolarHBondContact O-N 3.46Å
293R64.1Low57.3Low168 Ų168119 Ų11963%0.63459%0.594SS**Hα-helixtrans-66.8-38173.4-78.3178.8-175.6175.60.6113R289 V290 Q296 L297R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 WeakPolarHBondContact O-CG 3.46Å; R289-R293 PolarHBondContact O-N 3.32Å; R289-R293 VanDerWaalsContact O-N 3.12Å; V290-R293 PolarHBondContact O-N 3.27Å; R293-Q296 PolarHBondContact O-N 2.94Å; R293-L297 WeakPolarHBondContact O-CG 3.28Å; R293-L297 PolarHBondContact O-N 2.65Å
294S56.2Low56.1Low56 Ų56120.5 Ų120.539%0.39261%0.61SS.*Hα-helixtrans-70.2-36177.573.40000112.2V290 W291 L297 A298V290-S294 PolarHBondContact O-N 3.01Å; W291-S294 PolarHBondContact O-N 3.41Å; W291-S294 PolarHBondContact O-OG 3.39Å; S294-L297 PolarHBondContact O-N 3.31Å; S294-A298 WeakPolarHBondContact O-CB 3.45Å; S294-A298 PolarHBondContact O-N 3.07Å
295L58.5Low54.7Low92 Ų92122.1 Ų122.148%0.48263%0.633SS.*Hα-helixtrans-67.9-32.6171.6-95133.8000113.1W291 A298 S299W291-L295 VanDerWaalsContact CD1-CD1 3.43Å; W291-L295 HydrophobicContact CD2-CD1 4.2Å; W291-L295 HydrophobicContact CG-CD1 4.11Å; W291-L295 HydrophobicContact CZ2-CD1 4.2Å; W291-L295 WeakPolarHBondContact O-CD1 3.36Å; W291-L295 PolarHBondContact O-N 3.03Å; L295-A298 PolarHBondContact O-N 3.28Å; L295-S299 WeakPolarHBondContact O-CB 3.41Å; L295-S299 PolarHBondContact O-N 2.86Å; L295-S299 PolarHBondContact O-OG 3.06Å
296Q60.1Low53.6Low132 Ų132120.1 Ų120.162%0.61764%0.642SS**Hα-helixtrans-68.6-35.9171.5-77173.3-18.100112.2S292 R293 S299S292-Q296 VanDerWaalsContact O-CG 3.31Å; S292-Q296 WeakPolarHBondContact O-CG 3.25Å; S292-Q296 PolarHBondContact O-N 3.46Å; R293-Q296 PolarHBondContact O-N 2.94Å; Q296-S299 PolarHBondContact O-OG 3.27Å
297L56.7Low52.5Low126 Ų126124 Ų12466%0.6666%0.662SS**Hα-helixtrans-73.2-26.5174-74.8164000113.1R293 S294R293-L297 WeakPolarHBondContact O-CG 3.28Å; R293-L297 PolarHBondContact O-N 2.65Å; S294-L297 PolarHBondContact O-N 3.31Å
298A49Very low51.5Low85 Ų85121.6 Ų121.670%0.70268%0.679SS**Hα-helixtrans-85.4-10.3178.500000114.3S294 L295S294-A298 WeakPolarHBondContact O-CB 3.45Å; S294-A298 PolarHBondContact O-N 3.07Å; L295-A298 PolarHBondContact O-N 3.28Å
299S51.3Low50.1Low83 Ų83119 Ų11958%0.5869%0.69SS**  trans-108.620.5-175.652.90000114.8L295 Q296 P301L295-S299 WeakPolarHBondContact O-CB 3.41Å; L295-S299 PolarHBondContact O-N 2.86Å; L295-S299 PolarHBondContact O-OG 3.06Å; Q296-S299 PolarHBondContact O-OG 3.27Å; S299-P301 VanDerWaalsContact O-CD 3.31Å; S299-P301 WeakPolarHBondContact O-CD 3.19Å
300W39.1Very low48.6Very low211 Ų211118.5 Ų118.580%0.79971%0.705SS**  trans-71.2120.7172-128.3-44.1000110.8
301P44.3Very low46.8Very low114 Ų114124 Ų12474%0.7473%0.726SS**  trans-76.9136.4178.7-1026.8000111.3S299S299-P301 VanDerWaalsContact O-CD 3.31Å; S299-P301 WeakPolarHBondContact O-CD 3.19Å
302N45.5Very low45.1Very low165 Ų165120.2 Ų120.288%0.88273%0.733SS**  trans-90102.6173.8-166.114.9000110.5
303R35.1Very low43.3Very low251 Ų251125 Ų12595%0.94776%0.755SS**  trans172.1130.8160.6-108-176.5-167-1542.1107.3
304G37.5Very low41.5Very low80 Ų80122.1 Ų122.183%0.82576%0.76SS**  cis143110.88.800000108.9
305G34.2Very low40.1Very low78 Ų78128.5 Ų128.580%0.80479%0.786SS**  trans86.7107164.800000117.7
306A40.8Very low38.5Very low101 Ų101133.9 Ų133.984%0.83580%0.8SS**  82128.97500000114.6
307P38.8Very low37Very low138 Ų138134.4 Ų134.490%0.89681%0.812SS**  -149.914399.734.9-16.3000115.7
308G37.6Very low35.4Very low84 Ų84137.2 Ų137.287%0.86682%0.819SS**  trans127.256.4159.300000116.7
309A32.6Very low34.5Very low95 Ų95138.1 Ų138.179%0.78582%0.821SS**  trans-148.6137.1152.800000109.6
310P37.7Very low33.3Very low136 Ų136140 Ų14088%0.88383%0.828SS**  trans-78.1147.2-1620.716000113
311Q31.8Very low32.6Very low202 Ų202139 Ų13994%0.94482%0.824SS**  trans-61144.8175.1-82.7164.7-11.600113.6
312G29.1Very low31.8Very low72 Ų72140.6 Ų140.674%0.74283%0.832SS**  trans-166.675166.300000111.9
313D28.6Very low30.7Very low156 Ų156141.8 Ų141.883%0.83482%0.824SS**  trans5596.8148.3-67.2-20.3000122.2
314S27.8Very low30.2Very low107 Ų107138.6 Ų138.675%0.74881%0.812SS**  32.889.9117.7-158.10000118.5R316S314-R316 PolarHBondContact O-N 2.8Å; S314-R316 VanDerWaalsContact O-N 3.07Å
315M25.5Very low29.5Very low190 Ų190143.7 Ų143.794%0.93682%0.815SS**  trans-75.295.5161.2-167.5146.2-80.900110.3
316R25.9Very low29.1Very low206 Ų206144.2 Ų144.278%0.77780%0.799SS**  trans-64.1132.5156-103.6-177.4-94.4-176.8-6.5108.4S314 F318S314-R316 PolarHBondContact O-N 2.8Å; S314-R316 VanDerWaalsContact O-N 3.07Å; R316-F318 PolarHBondContact O-N 2.83Å
317V29.2Very low28.3Very low143 Ų143146.1 Ų146.187%0.86780%0.8SS**  trans-48.5120.3161172.70000108.7
318F22.5Very low27.5Very low184 Ų184148.1 Ų148.181%0.80780%0.795SS**  trans-134.4121.8163.7-121.5-87.2000110.3R316R316-F318 PolarHBondContact O-N 2.83Å
319S30.2Very low27.5Very low105 Ų105148.8 Ų148.873%0.73478%0.784SS**  trans-72.4130.3166.5179.30000109.8
320V25.6Very low27.1Very low122 Ų122152.4 Ų152.474%0.73979%0.785SS**  trans-144102.1162.9178.20000105.1
321R23.8Very low26.4Very low189 Ų189150.7 Ų150.771%0.71378%0.783SS**  66.393.771.1-159.2-179.4-159.5153.35.4112.3
322T27.3Very low26.1Very low148 Ų148144.6 Ų144.691%0.90877%0.773SS**  trans-105.599.6151.6-13.20000107.8
323R24.1Very low25.8Very low190 Ų190152.5 Ų152.572%0.71778%0.781SS**  trans-72.4120.6166.8159.4178.3-102.3179.7-7.9106.5
324R23.9Very low25.6Very low185 Ų185156 Ų15670%0.69878%0.783SS**  58.8116.774.2-161.6-175.4-169.7170.47.2114.2D326R324-D326 IonicContact CZ-OD1 3.36Å; R324-D326 VanDerWaalsContact CZ-OD1 3.31Å; R324-D326 IonicContact NE-OD1 3.87Å; R324-D326 PolarHBondContact NE-OD1 3.26Å; R324-D326 IonicContact NE-OD2 2.69Å; R324-D326 IonicContact NH2-OD1 3.33Å; R324-D326 PolarHBondContact NH2-OD1 2.81Å
325Q23.3Very low25.4Very low187 Ų187155.1 Ų155.187%0.87478%0.777SS**  trans-152.695137.5-132.5160.67.200105.6
326D25.4Very low25.4Very low88 Ų88154.6 Ų154.647%0.47177%0.772SS.*  65115.591.1-66.9-38.3000111R324R324-D326 IonicContact CZ-OD1 3.36Å; R324-D326 VanDerWaalsContact CZ-OD1 3.31Å; R324-D326 IonicContact NE-OD1 3.87Å; R324-D326 PolarHBondContact NE-OD1 3.26Å; R324-D326 IonicContact NE-OD2 2.69Å; R324-D326 IonicContact NH2-OD1 3.33Å; R324-D326 PolarHBondContact NH2-OD1 2.81Å
327T23Very low25.3Very low141 Ų141148.5 Ų148.587%0.86577%0.765SS**  -157.9129.478.6-170000112
328F23.2Very low25Very low181 Ų181149.9 Ų149.979%0.79476%0.762SS**  trans-90.1-178.3155.8-90.9-84.9000108.2
329P37.2Very low25.1Very low98 Ų98149.1 Ų149.164%0.63676%0.761SS**  cis-135.2-168.813.539-16000112
330E24.6Very low24.8Very low170 Ų170152.2 Ų152.279%0.79476%0.764SS**  cis-168.4161.922.6-150.7133.117600110.7
331A22.8Very low24.8Very low101 Ų101155.1 Ų155.184%0.83577%0.77SS**  trans3148.7157.300000120.9
332G24.4Very low24.9Very low73 Ų73150.3 Ų150.375%0.75377%0.77SS**  cis147157.31500000109.7
333R24.1Very low24.8Very low239 Ų239154.2 Ų154.290%0.90277%0.768SS**  trans84.2110.6167-84.2-178.4-150.6-175.57.2121.7
334R24.2Very low25Very low229 Ų229152.2 Ų152.286%0.86478%0.777SS**  60.5126.2113-79.9-170.2176.6-162.8-2.1121.8
335S23.9Very low25.2Very low89 Ų89150.4 Ų150.462%0.62278%0.78SS**  trans88.9116.5135.4-73.20000120
336E24.7Very low25.4Very low179 Ų179152.4 Ų152.484%0.83678%0.78SS**  73.4130.6127.2-66.417017700121.2
337A23.3Very low25.4Very low78 Ų78153.2 Ų153.265%0.64580%0.798SS**  trans87.1135.2141.600000120.4
338E24.6Very low25.7Very low172 Ų172151.9 Ų151.980%0.80479%0.791SS**  trans75.4105.2147.9-70.6162.1-163.400116.6
339E24.3Very low26.1Very low167 Ų167148.8 Ų148.878%0.7879%0.789SS**  99.6125.679.1-102.1-17817400110.6
340E23.8Very low25.7Very low171 Ų171149.1 Ų149.180%0.79980%0.799SS**  trans70.5110.3147.7-147142.1-16500119.1
341E24.1Very low26Very low183 Ų183152.5 Ų152.586%0.85581%0.805SS**  171.7153.795-159.1169.4179.500111.7
342A26.1Very low26.3Very low87 Ų87150.5 Ų150.572%0.71979%0.794SS**  trans96.667.9160.600000119.9
343R26.1Very low26.5Very low230 Ų230158.3 Ų158.387%0.86880%0.801SS**  4988.5124.3-67.7-178.7178.6173.61.7118.5
344T27.1Very low26.8Very low148 Ų148155.6 Ų155.691%0.90880%0.798SS**  trans-87.9104.5148.341.90000110.1
345I28.8Very low27.2Very low148 Ų148155.9 Ų155.976%0.75980%0.799SS**  trans-66.9126.7173.4-69.6171.6000109.7A347I345-A347 PolarHBondContact O-N 3.49Å
346R27.5Very low27.9Very low228 Ų228159.8 Ų159.886%0.8681%0.812SS**  trans-36.1115.9157.6-92.3171.7163.1164-4.8111.4T348R346-T348 VanDerWaalsContact C-N 3.33Å; R346-T348 PolarHBondContact O-N 3.31Å; R346-T348 VanDerWaalsContact O-N 3.15Å
347A26.4Very low28.4Very low105 Ų105158.1 Ų158.187%0.86881%0.809SS**  trans-82.584.1161.800000109.3I345I345-A347 PolarHBondContact O-N 3.49Å
348T27.8Very low28.9Very low114 Ų114161.3 Ų161.370%0.69982%0.815SS**  trans-63141.7155.8-210000108.3R346 A350R346-T348 VanDerWaalsContact C-N 3.33Å; R346-T348 PolarHBondContact O-N 3.31Å; R346-T348 VanDerWaalsContact O-N 3.15Å; T348-A350 PolarHBondContact O-N 2.86Å
349P31.9Very low29.6Very low116 Ų116162.9 Ų162.975%0.75382%0.823SS**  trans-65.8129168.827.4-31.5000108.6R351P349-R351 VanDerWaalsContact C-N 3.3Å; P349-R351 PolarHBondContact O-N 2.92Å
350A28.9Very low30.3Very low104 Ų104163.4 Ų163.486%0.8683%0.825SS**  trans-64.891174.400000109.4T348 G352T348-A350 PolarHBondContact O-N 2.86Å; A350-G352 VanDerWaalsContact C-N 3.29Å; A350-G352 PolarHBondContact O-N 3.25Å
351R32Very low31.1Very low242 Ų242160.7 Ų160.791%0.91382%0.822SS**  trans-69.392.9158.8-156176.6-170.7-1722.2106.2P349 R353P349-R351 VanDerWaalsContact C-N 3.3Å; P349-R351 PolarHBondContact O-N 2.92Å; R351-R353 PolarHBondContact O-N 2.9Å
352G27.7Very low32.3Very low59 Ų59158.7 Ų158.761%0.60883%0.825SS**  trans-58.9122.8168.600000108.8A350 E354A350-G352 VanDerWaalsContact C-N 3.29Å; A350-G352 PolarHBondContact O-N 3.25Å; G352-E354 PolarHBondContact O-N 3.3Å; G352-E354 VanDerWaalsContact O-N 3.1Å
353R29.3Very low33Very low237 Ų237157.6 Ų157.689%0.89482%0.822SS**  trans-69.195.7-175.7-167.7174.4-174.4171.20.2108.9R351 R355R351-R353 PolarHBondContact O-N 2.9Å; R353-R355 PolarHBondContact O-N 3.48Å
354E31.4Very low34.3Very low181 Ų181150.4 Ų150.485%0.84682%0.82SS**  trans-58.3116.1161.6-117.1136.8124.200107.6G352 L356G352-E354 PolarHBondContact O-N 3.3Å; G352-E354 VanDerWaalsContact O-N 3.1Å; E354-L356 PolarHBondContact O-N 2.84Å
355R31.2Very low35.8Very low236 Ų236150.6 Ų150.689%0.89181%0.81SS**  trans-68.1120.1166.8-70.5-173.7-160.8-115.84.4106.3R353 N357R353-R355 PolarHBondContact O-N 3.48Å; R355-N357 PolarHBondContact O-N 2.96Å; R355-N357 VanDerWaalsContact O-N 3.15Å
356L38.9Very low37.6Very low170 Ų170147.7 Ų147.789%0.8980%0.797SS**  trans-45.4112.6156.4-73.6143.2000108.9E354E354-L356 PolarHBondContact O-N 2.84Å
357N35.7Very low40Very low144 Ų144141 Ų14177%0.7778%0.782SS**  trans-161.5137.5138.2-107.211.2000110R355R355-N357 PolarHBondContact O-N 2.96Å; R355-N357 VanDerWaalsContact O-N 3.15Å
358D33.1Very low42.2Very low145 Ų145145.6 Ų145.678%0.77578%0.778SS**  trans7582.1169.2-51.5-45.4000116.6E360D358-E360 PolarHBondContact O-N 3.2Å
359E39.5Very low44.7Very low205 Ų205146.6 Ų146.696%0.95877%0.772SS**  trans-70.5109.8155-67.1-145.4121.600109.7
360E39.6Very low47.1Very low179 Ų179144.9 Ų144.984%0.83676%0.756SS**  trans-116.7149.3157.2-80.9-149.9138.300109.1D358D358-E360 PolarHBondContact O-N 3.2Å
361P40.5Very low49.6Very low113 Ų113145.3 Ų145.373%0.73474%0.743SS**  trans-68.4160.1-161.429-34.8000112.9G363P361-G363 VanDerWaalsContact C-N 3.31Å; P361-G363 PolarHBondContact O-N 3.41Å
362P48.6Very low52.1Low142 Ų142140.1 Ų140.192%0.92273%0.727SS**  trans-77.281.1-170.832.9-33.5000110.8
363G41.8Very low54.9Low63 Ų63141.4 Ų141.465%0.64972%0.718SS**  trans-84.613416500000110.2P361 Q365P361-G363 VanDerWaalsContact C-N 3.31Å; P361-G363 PolarHBondContact O-N 3.41Å; G363-Q365 PolarHBondContact O-N 2.99Å
364G52.9Low57.6Low80 Ų80135 Ų13583%0.82570%0.698SS**  trans-41.4121-169.300000115.6D366G364-D366 PolarHBondContact O-N 3.16Å
365Q58Low60.4Low151 Ų151131.3 Ų131.371%0.70668%0.681SS**  trans-66.9113.3164.5-78.41701300108.3G363 P367G363-Q365 PolarHBondContact O-N 2.99Å; Q365-P367 WeakPolarHBondContact O-CD 3.28Å; Q365-P367 VanDerWaalsContact O-N 3.17Å
366D68.1Low63.1Low88 Ų88125 Ų12547%0.47166%0.661SS.*  trans-48.3119.4172.9-98.9-49.2000110.2G364 W368 K369G364-D366 PolarHBondContact O-N 3.16Å; D366-W368 PolarHBondContact O-N 2.85Å; D366-K369 HydrophobicContact CB-CD 4.21Å; D366-K369 HydrophobicContact CB-CG 4.07Å; D366-K369 PolarHBondContact O-N 2.92Å
367P76.4Confident65.5Low86 Ų86124.6 Ų124.656%0.55865%0.648SS**Hα-helixtrans-52.5-29.2178.9-28.435000113.2Q365 L370 L371Q365-P367 WeakPolarHBondContact O-CD 3.28Å; Q365-P367 VanDerWaalsContact O-N 3.17Å; P367-L370 PolarHBondContact O-N 3.46Å; P367-L371 WeakPolarHBondContact O-CG 3.33Å; P367-L371 PolarHBondContact O-N 2.94Å; P367-L371 VanDerWaalsContact O-N 3.15Å
368W73.8Confident68.1Low203 Ų203123.2 Ų123.277%0.76964%0.635SS**Hα-helixtrans-66.2-32.7177.3-67.796.3000114D366 K372D366-W368 PolarHBondContact O-N 2.85Å; W368-K372 WeakPolarHBondContact O-CB 3.21Å; W368-K372 PolarHBondContact O-N 2.9Å; W368-K372 VanDerWaalsContact O-N 3.11Å
369K79.9Confident71Confident135 Ų135119.6 Ų119.659%0.58761%0.612SS**Hα-helixtrans-70-42176.7-69.3-179.2-178173.30110.8D366 K372 E373D366-K369 HydrophobicContact CB-CD 4.21Å; D366-K369 HydrophobicContact CB-CG 4.07Å; D366-K369 PolarHBondContact O-N 2.92Å; K369-K372 PolarHBondContact O-N 3.43Å; K369-E373 WeakPolarHBondContact O-CG 3.35Å; K369-E373 PolarHBondContact O-N 3.35Å
370L82Confident73.7Confident79 Ų79109.9 Ų109.941%0.41457%0.567SS.*Hα-helixtrans-64.3-41.9177.2-64.2178.1000112.2P367 K372 E373 Q374P367-L370 PolarHBondContact O-N 3.46Å; L370-K372 VanDerWaalsContact C-N 3.34Å; L370-K372 PolarHBondContact O-N 3.16Å; L370-E373 PolarHBondContact O-N 2.98Å; L370-Q374 VanDerWaalsContact O-CG 3.26Å; L370-Q374 WeakPolarHBondContact O-CG 3.46Å; L370-Q374 PolarHBondContact O-N 3.36Å
371L81.6Confident76.4Confident113 Ų113104 Ų10459%0.59254%0.543SS*.Hα-helixtrans-63-41.8175.8-71.8172.2000111.8P367 Q374 E375P367-L371 WeakPolarHBondContact O-CG 3.33Å; P367-L371 PolarHBondContact O-N 2.94Å; P367-L371 VanDerWaalsContact O-N 3.15Å; L371-Q374 PolarHBondContact O-N 2.88Å; L371-E375 WeakPolarHBondContact O-CB 3.3Å; L371-E375 PolarHBondContact O-N 2.93Å
372K83.6Confident78.9Confident134 Ų134102.9 Ų102.958%0.58353%0.53SS*.Hα-helixtrans-63.4-43.2177.3-169.8176.9179.4-176.20111.9W368 K369 L370 Q374 E375 E376W368-K372 WeakPolarHBondContact O-CB 3.21Å; W368-K372 PolarHBondContact O-N 2.9Å; W368-K372 VanDerWaalsContact O-N 3.11Å; K369-K372 PolarHBondContact O-N 3.43Å; L370-K372 VanDerWaalsContact C-N 3.34Å; L370-K372 PolarHBondContact O-N 3.16Å; K372-Q374 PolarHBondContact O-N 2.85Å; K372-E375 PolarHBondContact O-N 3.4Å; K372-E376 VanDerWaalsContact CE-OE1 3.28Å; K372-E376 WeakPolarHBondContact CE-OE1 3.26Å; K372-E376 WeakPolarHBondContact O-CG 3.36Å; K372-E376 PolarHBondContact O-N 2.88Å
373E87Confident81.1Confident86 Ų8698.7 Ų98.740%0.40250%0.504SS..Hα-helixtrans-64.1-39.3175.9-74176.3-163.200112.8K369 L370 E375 R377K369-E373 WeakPolarHBondContact O-CG 3.35Å; K369-E373 PolarHBondContact O-N 3.35Å; L370-E373 PolarHBondContact O-N 2.98Å; E373-E375 VanDerWaalsContact C-N 3.33Å; E373-R377 WeakPolarHBondContact O-CB 3.35Å; E373-R377 VanDerWaalsContact O-CG 3.23Å; E373-R377 WeakPolarHBondContact O-CG 3.37Å; E373-R377 PolarHBondContact O-N 2.92Å
374Q86.8Confident83.6Confident103 Ų103102.6 Ų102.648%0.48151%0.505SS..Hα-helixtrans-65.8-37.9175.6-70-65.3-36.500111.7L370 L371 K372 R377 K378L370-Q374 VanDerWaalsContact O-CG 3.26Å; L370-Q374 WeakPolarHBondContact O-CG 3.46Å; L370-Q374 PolarHBondContact O-N 3.36Å; L371-Q374 PolarHBondContact O-N 2.88Å; K372-Q374 PolarHBondContact O-N 2.85Å; Q374-R377 PolarHBondContact O-N 2.96Å; Q374-K378 WeakPolarHBondContact O-CG 3.34Å; Q374-K378 PolarHBondContact O-N 3.25Å
375E88.5Confident85.5Confident103 Ų103104 Ų10448%0.48149%0.493SS..Hα-helixtrans-68.8-44.5177.4-164.158.4-148.800111.5L371 K372 E373 R377 K378 K379L371-E375 WeakPolarHBondContact O-CB 3.3Å; L371-E375 PolarHBondContact O-N 2.93Å; K372-E375 PolarHBondContact O-N 3.4Å; E373-E375 VanDerWaalsContact C-N 3.33Å; E375-R377 VanDerWaalsContact C-N 3.29Å; E375-R377 PolarHBondContact O-N 3.38Å; E375-K378 WeakPolarHBondContact O-CB 3.16Å; E375-K378 PolarHBondContact O-N 3.48Å; E375-K378 IonicContact OE2-NZ 3.78Å; E375-K379 WeakPolarHBondContact O-CG 3.4Å
376E89.2Confident87.2Confident104 Ų104102 Ų10249%0.48648%0.484SS..Hα-helixtrans-60.7-37.1175.6-73.4173.2-176.300112.2K372 K378 K379K372-E376 VanDerWaalsContact CE-OE1 3.28Å; K372-E376 WeakPolarHBondContact CE-OE1 3.26Å; K372-E376 WeakPolarHBondContact O-CG 3.36Å; K372-E376 PolarHBondContact O-N 2.88Å; E376-K378 PolarHBondContact O-N 2.89Å; E376-K379 PolarHBondContact O-N 3.41Å
377R88.2Confident88.5Confident160 Ų160100.6 Ų100.660%0.60448%0.481SS*.Hα-helixtrans-66.2-19.5175.4-74.8174.8-170.7-161.56.7113.8E373 Q374 E375 K388E373-R377 WeakPolarHBondContact O-CB 3.35Å; E373-R377 VanDerWaalsContact O-CG 3.23Å; E373-R377 WeakPolarHBondContact O-CG 3.37Å; E373-R377 PolarHBondContact O-N 2.92Å; Q374-R377 PolarHBondContact O-N 2.96Å; E375-R377 VanDerWaalsContact C-N 3.29Å; E375-R377 PolarHBondContact O-N 3.38Å; R377-K388 VanDerWaalsContact O-CE 3.28Å; R377-K388 WeakPolarHBondContact O-CE 3.22Å; R377-K388 PolarHBondContact O-NZ 2.85Å
378K91.1Very high89.4Confident115 Ų11598.7 Ų98.750%0.546%0.464SS..Hα-helixtrans-86-11.3176.8-67.9172.6-171.5171.20113.1Q374 E375 E376 S387 K388Q374-K378 WeakPolarHBondContact O-CG 3.34Å; Q374-K378 PolarHBondContact O-N 3.25Å; E375-K378 WeakPolarHBondContact O-CB 3.16Å; E375-K378 PolarHBondContact O-N 3.48Å; E375-K378 IonicContact OE2-NZ 3.78Å; E376-K378 PolarHBondContact O-N 2.89Å; K378-S387 WeakPolarHBondContact O-CA 3.4Å; K378-K388 WeakPolarHBondContact O-CG 3.46Å; K378-K388 PolarHBondContact O-N 3.36Å
379K94.6Very high90.4Very high69 Ų6990.6 Ų90.630%0.344%0.437SS..BIsolated β-bridgetrans-80.2148.3-177.5-55.6-171-174.4-176.60112.6E375 E376 V381 Q384 Q386 K388E375-K379 WeakPolarHBondContact O-CG 3.4Å; E376-K379 PolarHBondContact O-N 3.41Å; K379-V381 PolarHBondContact O-N 3.44Å; K379-Q384 WeakPolarHBondContact CD-O 3.29Å; K379-Q386 CarbonylContact C-O 3.58Å; K379-Q386 WeakPolarHBondContact CA-O 3.31Å; K379-K388 WeakPolarHBondContact O-CE 3.22Å
380C95.7Very high91.2Very high1 Ų184.2 Ų84.21%0.00741%0.409CS..  trans-54.5134176.8173.90000110.6I382 C383 Q384 Q386 C401 C404C380-I382 PolarHBondContact O-N 3.26Å; C380-I382 PolarHBondContact SG-N 2.68Å; C380-C383 VanDerWaalsContact CB-SG 3.57Å; C380-Q384 WeakPolarHBondContact O-CA 3.45Å; C380-Q384 PolarHBondContact O-N 3.42Å; C380-Q386 VanDerWaalsContact CB-O 3.31Å; C380-Q386 WeakPolarHBondContact CB-O 3.44Å; C380-Q386 PolarHBondContact N-O 2.94Å; C380-C401 HydrophobicContact CB-CB 3.98Å; C380-C401 PolarHBondContact SG-N 2.93Å; C380-C401 VanDerWaalsContact SG-N 3.38Å; C380-C404 VanDerWaalsContact SG-SG 3.7Å
381V95.8Very high91.8Very high56 Ų5682.2 Ų82.234%0.33940%0.399SS..THydrogen-bonded Turntrans-69.8-16.2-176.6-56.60000113.6K379 C399 L400 P419 L420K379-V381 PolarHBondContact O-N 3.44Å; V381-C399 HydrophobicContact CG1-CB 4.17Å; V381-C399 HydrophobicContact CG2-CB 4.19Å; V381-C399 WeakPolarHBondContact CG2-O 3.44Å; V381-C399 PolarHBondContact N-O 2.91Å; V381-L400 HydrophobicContact CG2-CD2 4.04Å; V381-P419 HydrophobicContact CG2-CB 3.88Å; V381-P419 HydrophobicContact CG2-CG 4.21Å; V381-L420 HydrophobicContact CG1-CD2 4.44Å
382I94.2Very high92.5Very high90 Ų9076.9 Ų76.946%0.46237%0.371SS..THydrogen-bonded Turntrans-89.1-60.4178.4-64.6-178.4000110.9C380 L400 C404 P419C380-I382 PolarHBondContact O-N 3.26Å; C380-I382 PolarHBondContact SG-N 2.68Å; I382-L400 HydrophobicContact CB-CD2 4.23Å; I382-L400 HydrophobicContact CD1-CD1 4.4Å; I382-L400 HydrophobicContact CD1-CD2 3.38Å; I382-L400 HydrophobicContact CG1-CD2 3.51Å; I382-C404 HydrophobicContact CB-CB 4.21Å; I382-C404 HydrophobicContact CD1-CB 4.32Å; I382-C404 HydrophobicContact CG2-CB 4.4Å; I382-P419 HydrophobicContact CD1-CG 4.41Å
383C95.1Very high93Very high54 Ų5472.6 Ų72.637%0.36536%0.355SS..THydrogen-bonded Turntrans-86.6-18.2-176.466.80000114.4C380 D385C380-C383 VanDerWaalsContact CB-SG 3.57Å; C383-D385 HydrophobicContact CB-CB 4.46Å; C383-D385 PolarHBondContact O-N 2.88Å
384Q93.8Very high93.1Very high145 Ų14571.7 Ų71.768%0.67836%0.356SS*.SBendtrans52.823-176.1-56.4-174.618.800114.8K379 C380K379-Q384 WeakPolarHBondContact CD-O 3.29Å; C380-Q384 WeakPolarHBondContact O-CA 3.45Å; C380-Q384 PolarHBondContact O-N 3.42Å
385D93.3Very high93.5Very high108 Ų10867.8 Ų67.858%0.57834%0.34SS*.SBendtrans-120.7-66-174.6-177.132.6000110C383C383-D385 HydrophobicContact CB-CB 4.46Å; C383-D385 PolarHBondContact O-N 2.88Å
386Q93.7Very high93.9Very high110 Ų11072 Ų7251%0.51435%0.351SS..SBendtrans-77.7152.2-178.3-62.7-66.73.500113.2K379 C380 C401K379-Q386 CarbonylContact C-O 3.58Å; K379-Q386 WeakPolarHBondContact CA-O 3.31Å; C380-Q386 VanDerWaalsContact CB-O 3.31Å; C380-Q386 WeakPolarHBondContact CB-O 3.44Å; C380-Q386 PolarHBondContact N-O 2.94Å; Q386-C401 HydrophobicContact CB-CB 3.74Å
387S94Very high94.2Very high59 Ų5970 Ų7041%0.41334%0.342SS..BIsolated β-bridgetrans-66.8154.4176.761.50000112.8K378 T389 C401K378-S387 WeakPolarHBondContact O-CA 3.4Å; S387-T389 PolarHBondContact O-N 2.88Å; S387-C401 VanDerWaalsContact O-CB 3.22Å; S387-C401 WeakPolarHBondContact O-CB 3.25Å
388K95.8Very high94.6Very high46 Ų4665.3 Ų65.320%0.233%0.328CS..PPolyproline II helixtrans-73118.3177.1-63.3161.2-179.6-178.90110.1R377 K378 K379 L398 L400 L433R377-K388 VanDerWaalsContact O-CE 3.28Å; R377-K388 WeakPolarHBondContact O-CE 3.22Å; R377-K388 PolarHBondContact O-NZ 2.85Å; K378-K388 WeakPolarHBondContact O-CG 3.46Å; K378-K388 PolarHBondContact O-N 3.36Å; K379-K388 WeakPolarHBondContact O-CE 3.22Å; K388-L398 HydrophobicContact CB-CD1 4.06Å; K388-L398 HydrophobicContact CB-CG 3.95Å; K388-L400 CarbonylContact C-O 3.6Å; K388-L400 WeakPolarHBondContact CA-O 3.22Å; K388-L433 WeakPolarHBondContact O-CD1 3.23Å
389T95.6Very high94.7Very high33 Ų3359.8 Ų59.820%0.20231%0.305CS..  trans-129.72-176.1570000113.9S387 L400 Q402 N430 V431S387-T389 PolarHBondContact O-N 2.88Å; T389-L400 PolarHBondContact N-O 3.4Å; T389-Q402 PolarHBondContact OG1-N 2.77Å; T389-N430 WeakPolarHBondContact O-CA 3.29Å; T389-V431 VanDerWaalsContact O-CG2 3.3Å; T389-V431 WeakPolarHBondContact O-CG2 3.28Å; T389-V431 PolarHBondContact O-N 3.21Å
390V94.8Very high94.8Very high0 Ų056.5 Ų56.50%029%0.29CS..EExtended strand (participates in β ladder)trans-127.3127.6-177.6-170.80000112.7L392 L398 L400 Q402 T405 T428 L429 N430V390-L392 HydrophobicContact CG1-CD2 4.27Å; V390-L398 WeakPolarHBondContact O-CD1 3.22Å; V390-L400 PolarHBondContact N-O 3.44Å; V390-Q402 HydrophobicContact CG2-CB 4.37Å; V390-T405 HydrophobicContact CG1-CG2 4.01Å; V390-T405 WeakPolarHBondContact CG2-OG1 3.45Å; V390-T428 HydrophobicContact CG1-CG2 4.4Å; V390-L429 WeakPolarHBondContact CA-O 3.37Å; V390-N430 WeakPolarHBondContact CG2-OD1 3.44Å
391L95.9Very high94.8Very high38 Ų3856.7 Ų56.720%0.19929%0.292CS..EExtended strand (participates in β ladder)trans-93.9127.1173.3-162.580.5000110.6R396 L398 L429L391-R396 VanDerWaalsContact CD1-O 3.27Å; L391-R396 WeakPolarHBondContact CD1-O 3.34Å; L391-R396 HydrophobicContact CD2-CB 4.47Å; L391-L398 HydrophobicContact CD1-CB 3.96Å; L391-L429 HydrophobicContact CB-CB 4.32Å; L391-L429 HydrophobicContact CD2-CD2 4.44Å; L391-L429 PolarHBondContact N-O 3.33Å; L391-L429 PolarHBondContact O-N 3.35Å
392L95.9Very high94.8Very high0 Ų058.6 Ų58.60%030%0.297CS..EExtended strand (participates in β ladder)trans-97125.4-177.5-55.2179.9000111.9V390 C395 R396 H397 L400 C418 I425 T428V390-L392 HydrophobicContact CG1-CD2 4.27Å; L392-C395 CarbonylContact O-C 3.53Å; L392-C395 PolarHBondContact O-N 3.36Å; L392-C395 PolarHBondContact O-SG 3.09Å; L392-R396 VanDerWaalsContact O-CA 3.29Å; L392-R396 WeakPolarHBondContact O-CA 3.32Å; L392-R396 PolarHBondContact O-N 3.1Å; L392-H397 PolarHBondContact N-O 3.49Å; L392-H397 VanDerWaalsContact N-O 3.08Å; L392-L400 HydrophobicContact CD1-CD1 4.12Å; L392-L400 HydrophobicContact CD2-CD1 4.4Å; L392-C418 HydrophobicContact CD1-CB 4.04Å; L392-I425 HydrophobicContact CB-CG1 4.47Å; L392-I425 HydrophobicContact CD1-CD1 3.9Å; L392-I425 HydrophobicContact CD1-CG1 4.28Å; L392-I425 HydrophobicContact CD2-CD1 4.15Å; L392-I425 HydrophobicContact CD2-CG2 4.24Å; L392-T428 HydrophobicContact CD2-CG2 3.82Å
393L93.8Very high94.9Very high45 Ų4557.1 Ų57.124%0.23630%0.298CS..EExtended strand (participates in β ladder)trans-103.6141.9-179.9-64.2173.1000112.1R396 L426 Q427L393-R396 HydrophobicContact CD2-CG 3.92Å; L393-L426 PolarHBondContact O-N 2.87Å; L393-Q427 HydrophobicContact CB-CB 4.1Å; L393-Q427 WeakPolarHBondContact CB-O 3.41Å; L393-Q427 HydrophobicContact CD1-CB 4.04Å; L393-Q427 PolarHBondContact N-O 2.88Å
394P90.6Very high94.9Very high66 Ų6655.1 Ų55.143%0.42928%0.284SS..THydrogen-bonded Turncis-89.1-3.51034.3-35.8000115.1R396P394-R396 VanDerWaalsContact C-N 3.28Å; P394-R396 PolarHBondContact O-N 3.19Å
395C95.2Very high95Very high22 Ų2248.5 Ų48.515%0.14925%0.254CS..THydrogen-bonded Turntrans-72-13.7-171.862.60000115.8L392 H397 C421 R423L392-C395 CarbonylContact O-C 3.53Å; L392-C395 PolarHBondContact O-N 3.36Å; L392-C395 PolarHBondContact O-SG 3.09Å; C395-H397 PolarHBondContact O-N 2.89Å; C395-C421 WeakPolarHBondContact CB-SG 3.32Å; C395-R423 HydrophobicContact CB-CB 4.44Å
396R95Very high95.1Very high191 Ų19147.8 Ų47.872%0.72125%0.247SC*.THydrogen-bonded Turntrans55.330.4-178.9-58.3178.6-178.8179.4-0.4114.8L391 L392 L393 P394L391-R396 VanDerWaalsContact CD1-O 3.27Å; L391-R396 WeakPolarHBondContact CD1-O 3.34Å; L391-R396 HydrophobicContact CD2-CB 4.47Å; L392-R396 VanDerWaalsContact O-CA 3.29Å; L392-R396 WeakPolarHBondContact O-CA 3.32Å; L392-R396 PolarHBondContact O-N 3.1Å; L393-R396 HydrophobicContact CD2-CG 3.92Å; P394-R396 VanDerWaalsContact C-N 3.28Å; P394-R396 PolarHBondContact O-N 3.19Å
397H96.6Very high95.1Very high63 Ų6347.2 Ų47.229%0.29225%0.246SC..EExtended strand (participates in β ladder)trans-85.1125.5175.4-74.1115.6000111.4L392 C395 L420 C421L392-H397 PolarHBondContact N-O 3.49Å; L392-H397 VanDerWaalsContact N-O 3.08Å; C395-H397 PolarHBondContact O-N 2.89Å; H397-L420 HydrophobicContact CB-CD1 4.11Å; H397-C421 VanDerWaalsContact CE1-CB 3.48Å; H397-C421 WeakPolarHBondContact CE1-CB 3.24Å; H397-C421 VanDerWaalsContact CE1-SG 3.55Å; H397-C421 PolarHBondContact ND1-SG 2.82Å
398L95.3Very high95.1Very high60 Ų6045.6 Ų45.631%0.31423%0.233SC..EExtended strand (participates in β ladder)trans-93.996.4169.9-179.758.9000108.5K388 V390 L391 V431K388-L398 HydrophobicContact CB-CD1 4.06Å; K388-L398 HydrophobicContact CB-CG 3.95Å; V390-L398 WeakPolarHBondContact O-CD1 3.22Å; L391-L398 HydrophobicContact CD1-CB 3.96Å; L398-V431 HydrophobicContact CD1-CG2 3.59Å; L398-V431 HydrophobicContact CD2-CG2 4.41Å
399C94.7Very high94.9Very high0 Ų045.8 Ų45.80%024%0.235CC..EExtended strand (participates in β ladder)trans-139.8-9.2-173.260.20000115.2V381 L420V381-C399 HydrophobicContact CG1-CB 4.17Å; V381-C399 HydrophobicContact CG2-CB 4.19Å; V381-C399 WeakPolarHBondContact CG2-O 3.44Å; V381-C399 PolarHBondContact N-O 2.91Å; C399-L420 HydrophobicContact CB-CD1 3.67Å; C399-L420 HydrophobicContact CB-CG 3.85Å
400L96Very high94.7Very high0 Ų053.8 Ų53.80%026%0.262CS..EExtended strand (participates in β ladder)trans-122151.4-175.5-62.6-179.2000111.9V381 I382 K388 T389 V390 L392 C404 T405 L408 P419V381-L400 HydrophobicContact CG2-CD2 4.04Å; I382-L400 HydrophobicContact CB-CD2 4.23Å; I382-L400 HydrophobicContact CD1-CD1 4.4Å; I382-L400 HydrophobicContact CD1-CD2 3.38Å; I382-L400 HydrophobicContact CG1-CD2 3.51Å; K388-L400 CarbonylContact C-O 3.6Å; K388-L400 WeakPolarHBondContact CA-O 3.22Å; T389-L400 PolarHBondContact N-O 3.4Å; V390-L400 PolarHBondContact N-O 3.44Å; L392-L400 HydrophobicContact CD1-CD1 4.12Å; L392-L400 HydrophobicContact CD2-CD1 4.4Å; L400-C404 HydrophobicContact CD2-CB 4.43Å; L400-T405 WeakPolarHBondContact CB-OG1 3.19Å; L400-L408 HydrophobicContact CD1-CD2 3.76Å; L400-P419 HydrophobicContact CD1-CG 4.41Å; L400-P419 HydrophobicContact CD2-CG 4.09Å; L400-P419 HydrophobicContact CG-CG 4.48Å
401C96.4Very high94.4Very high5 Ų558.2 Ų58.23%0.03428%0.282CS..  trans-82.6166.5161.470.30000110.3C380 Q386 S387 A403 C404 T405C380-C401 HydrophobicContact CB-CB 3.98Å; C380-C401 PolarHBondContact SG-N 2.93Å; C380-C401 VanDerWaalsContact SG-N 3.38Å; Q386-C401 HydrophobicContact CB-CB 3.74Å; S387-C401 VanDerWaalsContact O-CB 3.22Å; S387-C401 WeakPolarHBondContact O-CB 3.25Å; C401-A403 PolarHBondContact O-N 3.39Å; C401-C404 PolarHBondContact O-N 3.07Å; C401-C404 PolarHBondContact SG-N 3.1Å; C401-C404 PolarHBondContact SG-SG 2.93Å; C401-T405 PolarHBondContact O-N 3.37Å; C401-T405 PolarHBondContact O-OG1 3.3Å
402Q95.3Very high94Very high96 Ų9658.9 Ų58.945%0.44929%0.289SS..Hα-helixtrans-57.5-49.4179.6-175.5175.5-5.400112.4T389 V390 C404 T405 E406T389-Q402 PolarHBondContact OG1-N 2.77Å; V390-Q402 HydrophobicContact CG2-CB 4.37Å; Q402-C404 PolarHBondContact O-N 2.93Å; Q402-T405 WeakPolarHBondContact O-CB 3.46Å; Q402-T405 PolarHBondContact O-N 2.87Å; Q402-T405 VanDerWaalsContact O-N 3.11Å; Q402-E406 PolarHBondContact NE2-OE1 3.47Å; Q402-E406 PolarHBondContact O-N 3.47Å
403A96.3Very high93.4Very high58 Ų5864 Ų6448%0.47932%0.32SS..Hα-helixtrans-59.3-43.1-178.500000112.8C401 T405 E406 I407C401-A403 PolarHBondContact O-N 3.39Å; A403-T405 VanDerWaalsContact C-N 3.35Å; A403-E406 PolarHBondContact O-N 3.34Å; A403-I407 WeakPolarHBondContact O-CG1 3.36Å; A403-I407 PolarHBondContact O-N 2.84Å
404C96.1Very high92.9Very high12 Ų1270 Ų708%0.08134%0.341CS..Hα-helixtrans-69.3-33.9177.6-71.80000112.4C380 I382 L400 C401 Q402 L408C380-C404 VanDerWaalsContact SG-SG 3.7Å; I382-C404 HydrophobicContact CB-CB 4.21Å; I382-C404 HydrophobicContact CD1-CB 4.32Å; I382-C404 HydrophobicContact CG2-CB 4.4Å; L400-C404 HydrophobicContact CD2-CB 4.43Å; C401-C404 PolarHBondContact O-N 3.07Å; C401-C404 PolarHBondContact SG-N 3.1Å; C401-C404 PolarHBondContact SG-SG 2.93Å; Q402-C404 PolarHBondContact O-N 2.93Å; C404-L408 WeakPolarHBondContact O-CB 3.34Å; C404-L408 PolarHBondContact O-N 3.43Å
405T95.4Very high92.7Very high7 Ų772.3 Ų72.34%0.04335%0.345CS..Hα-helixtrans-65.1-43.8174.9-56.60000111.1V390 L400 C401 Q402 A403 I407 L408 M409 T428V390-T405 HydrophobicContact CG1-CG2 4.01Å; V390-T405 WeakPolarHBondContact CG2-OG1 3.45Å; L400-T405 WeakPolarHBondContact CB-OG1 3.19Å; C401-T405 PolarHBondContact O-N 3.37Å; C401-T405 PolarHBondContact O-OG1 3.3Å; Q402-T405 WeakPolarHBondContact O-CB 3.46Å; Q402-T405 PolarHBondContact O-N 2.87Å; Q402-T405 VanDerWaalsContact O-N 3.11Å; A403-T405 VanDerWaalsContact C-N 3.35Å; T405-I407 VanDerWaalsContact C-N 3.3Å; T405-I407 PolarHBondContact O-N 2.85Å; T405-L408 WeakPolarHBondContact O-CB 3.39Å; T405-L408 PolarHBondContact O-N 3.33Å; T405-L408 VanDerWaalsContact O-N 3.13Å; T405-M409 HydrophobicContact CG2-CG 4.12Å; T405-M409 VanDerWaalsContact O-CG 3.31Å; T405-M409 WeakPolarHBondContact O-CG 3.23Å; T405-M409 PolarHBondContact O-N 2.98Å; T405-T428 HydrophobicContact CG2-CG2 3.81Å
406E94.8Very high92.6Very high93 Ų9374.2 Ų74.244%0.43535%0.349SS..Hα-helixtrans-59.9-41.3178.6-74.6175.1-162.800111.8Q402 A403 M409 R410Q402-E406 PolarHBondContact NE2-OE1 3.47Å; Q402-E406 PolarHBondContact O-N 3.47Å; A403-E406 PolarHBondContact O-N 3.34Å; E406-M409 PolarHBondContact O-N 2.88Å; E406-R410 WeakPolarHBondContact O-CG 3.42Å; E406-R410 PolarHBondContact O-N 3.49Å
407I94.3Very high92.6Very high97 Ų9768.4 Ų68.450%0.49733%0.332SS..Hα-helixtrans-62.8-46.6174.1-62.6165.3000110.4A403 T405 M409 R410A403-I407 WeakPolarHBondContact O-CG1 3.36Å; A403-I407 PolarHBondContact O-N 2.84Å; T405-I407 VanDerWaalsContact C-N 3.3Å; T405-I407 PolarHBondContact O-N 2.85Å; I407-M409 VanDerWaalsContact C-N 3.3Å; I407-M409 PolarHBondContact O-N 3.36Å; I407-R410 WeakPolarHBondContact O-CB 3.29Å; I407-R410 PolarHBondContact O-N 3.5Å; I407-R410 VanDerWaalsContact O-N 3.17Å
408L92.9Very high92.5Very high26 Ų2665.4 Ų65.414%0.13632%0.319CS..Hα-helixtrans-60.7-38.6179.6-171.867.1000112.2L400 C404 T405 R410 H411 I425L400-L408 HydrophobicContact CD1-CD2 3.76Å; C404-L408 WeakPolarHBondContact O-CB 3.34Å; C404-L408 PolarHBondContact O-N 3.43Å; T405-L408 WeakPolarHBondContact O-CB 3.39Å; T405-L408 PolarHBondContact O-N 3.33Å; T405-L408 VanDerWaalsContact O-N 3.13Å; L408-R410 VanDerWaalsContact C-N 3.32Å; L408-R410 PolarHBondContact O-N 3.43Å; L408-H411 WeakPolarHBondContact O-CB 3.41Å; L408-H411 PolarHBondContact O-N 3.17Å; L408-I425 HydrophobicContact CD2-CD1 3.45Å; L408-I425 VanDerWaalsContact CD2-CD1 3.45Å; L408-I425 HydrophobicContact CG-CD1 4.4Å
409M91.1Very high92.5Very high49 Ų4965.2 Ų65.224%0.24132%0.321CS..Hα-helixtrans-75.8-16.5-179.7-66-63.1-85.800113.3T405 E406 I407 H411 R416 I425 T428T405-M409 HydrophobicContact CG2-CG 4.12Å; T405-M409 VanDerWaalsContact O-CG 3.31Å; T405-M409 WeakPolarHBondContact O-CG 3.23Å; T405-M409 PolarHBondContact O-N 2.98Å; E406-M409 PolarHBondContact O-N 2.88Å; I407-M409 VanDerWaalsContact C-N 3.3Å; I407-M409 PolarHBondContact O-N 3.36Å; M409-H411 VanDerWaalsContact C-N 3.26Å; M409-H411 PolarHBondContact O-N 3.4Å; M409-R416 PolarHBondContact O-NE 3.07Å; M409-R416 PolarHBondContact O-NH2 3.4Å; M409-R416 HydrophobicContact SD-CG 4.48Å; M409-I425 HydrophobicContact SD-CG2 4.23Å; M409-T428 HydrophobicContact CE-CG2 4.22Å; M409-T428 HydrophobicContact SD-CG2 4.24Å
410R92.5Very high92.5Very high201 Ų20170 Ų7076%0.75835%0.346SS*.Hα-helixtrans-70.1-22.9170.7-72.1174.3-170.7178.84112.7E406 I407 L408E406-R410 WeakPolarHBondContact O-CG 3.42Å; E406-R410 PolarHBondContact O-N 3.49Å; I407-R410 WeakPolarHBondContact O-CB 3.29Å; I407-R410 PolarHBondContact O-N 3.5Å; I407-R410 VanDerWaalsContact O-N 3.17Å; L408-R410 VanDerWaalsContact C-N 3.32Å; L408-R410 PolarHBondContact O-N 3.43Å
411H88.8Confident92.4Very high93 Ų9372.4 Ų72.443%0.43136%0.363SS..SBendtrans-67.8157175.7-71.9-73000111.9L408 M409 H415 R416L408-H411 WeakPolarHBondContact O-CB 3.41Å; L408-H411 PolarHBondContact O-N 3.17Å; M409-H411 VanDerWaalsContact C-N 3.26Å; M409-H411 PolarHBondContact O-N 3.4Å; H411-H415 HydrophobicContact CB-CB 4.17Å; H411-R416 PolarHBondContact O-NE 2.97Å; H411-R416 PolarHBondContact O-NH2 2.92Å; H411-R416 VanDerWaalsContact O-NH2 3.13Å
412P87.9Confident92.3Very high53 Ų5382 Ų8234%0.34440%0.398SS..  trans-56.1150.3173.9-21.932.1000111.8Y414 H415P412-Y414 HydrophobicContact CB-CD1 3.77Å; P412-Y414 HydrophobicContact CB-CD2 4.41Å; P412-Y414 HydrophobicContact CB-CE1 3.18Å; P412-Y414 HydrophobicContact CB-CE2 3.94Å; P412-Y414 HydrophobicContact CB-CG 4.33Å; P412-Y414 WeakPolarHBondContact CB-OH 3.36Å; P412-Y414 HydrophobicContact CG-CE1 4.14Å; P412-Y414 HydrophobicContact CG-CE2 4.34Å; P412-Y414 WeakPolarHBondContact CG-OH 3.36Å; P412-Y414 PolarHBondContact O-N 3.43Å; P412-H415 PolarHBondContact O-N 3.03Å
413V82.9Confident92.2Very high107 Ų10785 Ų8565%0.64841%0.405SS*.G310 helixtrans-53.2-35.4-171.5-178.50000113.1H415 R416V413-H415 VanDerWaalsContact C-N 3.27Å; V413-H415 PolarHBondContact O-N 3.32Å; V413-R416 PolarHBondContact O-N 3.2Å
414Y83.5Confident92Very high172 Ų17284 Ų8468%0.67540%0.4SS*.G310 helixtrans-70.9-15.3179.549.3-89.3000114.7P412P412-Y414 HydrophobicContact CB-CD1 3.77Å; P412-Y414 HydrophobicContact CB-CD2 4.41Å; P412-Y414 HydrophobicContact CB-CE1 3.18Å; P412-Y414 HydrophobicContact CB-CE2 3.94Å; P412-Y414 HydrophobicContact CB-CG 4.33Å; P412-Y414 WeakPolarHBondContact CB-OH 3.36Å; P412-Y414 HydrophobicContact CG-CE1 4.14Å; P412-Y414 HydrophobicContact CG-CE2 4.34Å; P412-Y414 WeakPolarHBondContact CG-OH 3.36Å; P412-Y414 PolarHBondContact O-N 3.43Å
415H86.8Confident92Very high113 Ų11383.9 Ų83.952%0.52340%0.398SS..G310 helixtrans-100.8-1.4175.2-73.8-74.7000113.6H411 P412 V413 N417H411-H415 HydrophobicContact CB-CB 4.17Å; P412-H415 PolarHBondContact O-N 3.03Å; V413-H415 VanDerWaalsContact C-N 3.27Å; V413-H415 PolarHBondContact O-N 3.32Å; H415-N417 VanDerWaalsContact C-N 3.32Å; H415-N417 PolarHBondContact O-N 3.47Å
416R92.9Very high91.8Very high63 Ų6390 Ų9024%0.23843%0.431CS..  trans-82.876.3-179.2-61.3179.1-171.2175.30.5110.5M409 H411 V413 G424 I425M409-R416 PolarHBondContact O-NE 3.07Å; M409-R416 PolarHBondContact O-NH2 3.4Å; M409-R416 HydrophobicContact SD-CG 4.48Å; H411-R416 PolarHBondContact O-NE 2.97Å; H411-R416 PolarHBondContact O-NH2 2.92Å; H411-R416 VanDerWaalsContact O-NH2 3.13Å; V413-R416 PolarHBondContact O-N 3.2Å; R416-G424 CarbonylContact O-C 3.56Å; R416-G424 WeakPolarHBondContact O-CA 3.46Å; R416-I425 HydrophobicContact CB-CB 4.42Å; R416-I425 PolarHBondContact O-N 3.01Å
417N94.3Very high91.5Very high68 Ų6891.8 Ų91.836%0.36444%0.439SS..BIsolated β-bridgetrans-111.5144.3-179.4-64.7-38000111.5H415 R423 G424H415-N417 VanDerWaalsContact C-N 3.32Å; H415-N417 PolarHBondContact O-N 3.47Å; N417-R423 WeakPolarHBondContact CA-O 3.42Å; N417-G424 WeakPolarHBondContact OD1-CA 3.27Å
418C95.3Very high91.6Very high1 Ų189.7 Ų89.71%0.00743%0.431CS..  trans-62.9128.9174173.30000110.6L392 L420 R422 R423L392-C418 HydrophobicContact CD1-CB 4.04Å; C418-L420 PolarHBondContact O-N 3.45Å; C418-R422 WeakPolarHBondContact O-CA 3.45Å; C418-R422 PolarHBondContact O-N 3.01Å; C418-R423 PolarHBondContact N-O 3.02Å
419P94.3Very high91.6Very high56 Ų5692.9 Ų92.936%0.36445%0.447SS..THydrogen-bonded Turntrans-61.5-27.5-180-25.533.9000114.8V381 I382 L400V381-P419 HydrophobicContact CG2-CB 3.88Å; V381-P419 HydrophobicContact CG2-CG 4.21Å; I382-P419 HydrophobicContact CD1-CG 4.41Å; L400-P419 HydrophobicContact CD1-CG 4.41Å; L400-P419 HydrophobicContact CD2-CG 4.09Å; L400-P419 HydrophobicContact CG-CG 4.48Å
420L94Very high91.7Very high99 Ų9994.1 Ų94.152%0.51846%0.455SS..THydrogen-bonded Turntrans-84-48.1-178-63.4-173.9000112.7V381 H397 C399 C418V381-L420 HydrophobicContact CG1-CD2 4.44Å; H397-L420 HydrophobicContact CB-CD1 4.11Å; C399-L420 HydrophobicContact CB-CD1 3.67Å; C399-L420 HydrophobicContact CB-CG 3.85Å; C418-L420 PolarHBondContact O-N 3.45Å
421C94.9Very high91.6Very high52 Ų5286.7 Ų86.735%0.35143%0.432SS..THydrogen-bonded Turntrans-115.90-170.870.50000114.5C395 H397 R423C395-C421 WeakPolarHBondContact CB-SG 3.32Å; H397-C421 VanDerWaalsContact CE1-CB 3.48Å; H397-C421 WeakPolarHBondContact CE1-CB 3.24Å; H397-C421 VanDerWaalsContact CE1-SG 3.55Å; H397-C421 PolarHBondContact ND1-SG 2.82Å; C421-R423 PolarHBondContact O-N 2.92Å
422R93.5Very high91.2Very high207 Ų20792.5 Ų92.578%0.78145%0.451SS*.  trans59.39.7178.3-54.8177.9-176.6-105.3-0.5115.5C418C418-R422 WeakPolarHBondContact O-CA 3.45Å; C418-R422 PolarHBondContact O-N 3.01Å
423R93.5Very high90Very high159 Ų15998.8 Ų98.860%0.648%0.481SS*.  trans-73.6142.1175.4-156.9170.1-146.9157.87.1110.7C395 N417 C418 C421C395-R423 HydrophobicContact CB-CB 4.44Å; N417-R423 WeakPolarHBondContact CA-O 3.42Å; C418-R423 PolarHBondContact N-O 3.02Å; C421-R423 PolarHBondContact O-N 2.92Å
424G93Very high90.4Very high35 Ų3598.4 Ų98.436%0.36147%0.473SS..BIsolated β-bridgetrans-58.6137.1175.900000112.5R416 N417R416-G424 CarbonylContact O-C 3.56Å; R416-G424 WeakPolarHBondContact O-CA 3.46Å; N417-G424 WeakPolarHBondContact OD1-CA 3.27Å
425I95.1Very high90.7Very high10 Ų1094.5 Ų94.55%0.05146%0.462CS..  trans-91.2115.7-179.2-56.7165.4000108L392 L408 M409 R416 T428L392-I425 HydrophobicContact CB-CG1 4.47Å; L392-I425 HydrophobicContact CD1-CD1 3.9Å; L392-I425 HydrophobicContact CD1-CG1 4.28Å; L392-I425 HydrophobicContact CD2-CD1 4.15Å; L392-I425 HydrophobicContact CD2-CG2 4.24Å; L408-I425 HydrophobicContact CD2-CD1 3.45Å; L408-I425 VanDerWaalsContact CD2-CD1 3.45Å; L408-I425 HydrophobicContact CG-CD1 4.4Å; M409-I425 HydrophobicContact SD-CG2 4.23Å; R416-I425 HydrophobicContact CB-CB 4.42Å; R416-I425 PolarHBondContact O-N 3.01Å; I425-T428 HydrophobicContact CG2-CG2 3.77Å
426L90.6Very high90.9Very high137 Ų13793.5 Ų93.572%0.71746%0.459SS*.  trans-93-40.3177.1-60.7179.8000111.4L393L393-L426 PolarHBondContact O-N 2.87Å
427Q90.4Very high90.8Very high129 Ų12995.3 Ų95.360%0.60347%0.472SS*.EExtended strand (participates in β ladder)trans-145.3154.4-176.7-67.1176.6-12.300110L393L393-Q427 HydrophobicContact CB-CB 4.1Å; L393-Q427 WeakPolarHBondContact CB-O 3.41Å; L393-Q427 HydrophobicContact CD1-CB 4.04Å; L393-Q427 PolarHBondContact N-O 2.88Å
428T94.6Very high90.6Very high54 Ų5497 Ų9733%0.33148%0.478SS..EExtended strand (participates in β ladder)trans-127.2136.3177.855.50000109.4V390 L392 T405 M409 I425V390-T428 HydrophobicContact CG1-CG2 4.4Å; L392-T428 HydrophobicContact CD2-CG2 3.82Å; T405-T428 HydrophobicContact CG2-CG2 3.81Å; M409-T428 HydrophobicContact CE-CG2 4.22Å; M409-T428 HydrophobicContact SD-CG2 4.24Å; I425-T428 HydrophobicContact CG2-CG2 3.77Å
429L94.6Very high90.3Very high93 Ų93103.4 Ų103.449%0.48751%0.51SS..EExtended strand (participates in β ladder)trans-120.3125.7177.9-175.791000109.2V390 L391 V431V390-L429 WeakPolarHBondContact CA-O 3.37Å; L391-L429 HydrophobicContact CB-CB 4.32Å; L391-L429 HydrophobicContact CD2-CD2 4.44Å; L391-L429 PolarHBondContact N-O 3.33Å; L391-L429 PolarHBondContact O-N 3.35Å; L429-V431 HydrophobicContact CD2-CG1 4.36Å
430N93.1Very high90Very high74 Ų74106.8 Ų106.840%0.39652%0.52SS..EExtended strand (participates in β ladder)trans-78133173-66.2-22.3000109.8T389 V390T389-N430 WeakPolarHBondContact O-CA 3.29Å; V390-N430 WeakPolarHBondContact CG2-OD1 3.44Å
431V89.9Confident89.7Confident45 Ų45107.4 Ų107.427%0.27352%0.521SS..  trans-119.1129175.3-88.20000108.9T389 L398 L429T389-V431 VanDerWaalsContact O-CG2 3.3Å; T389-V431 WeakPolarHBondContact O-CG2 3.28Å; T389-V431 PolarHBondContact O-N 3.21Å; L398-V431 HydrophobicContact CD1-CG2 3.59Å; L398-V431 HydrophobicContact CD2-CG2 4.41Å; L429-V431 HydrophobicContact CD2-CG1 4.36Å
432Y79.7Confident89.3Confident216 Ų216112 Ų11285%0.84754%0.535SS*.  trans-91.8121.2173.6-58.6-83.2000107.3
433L63.2Low88.9Confident185 Ų185103.4 Ų103.497%0.96951%0.512SS*.  trans-98.50-179.3-74174.8000111.4K388K388-L433 WeakPolarHBondContact O-CD1 3.23Å

Retrieved 433 of 433 residues in 122.1 ms (Link to these results)