A0A096MDF4_POEFO Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A096MDF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 208 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
1V47.5Very low42Very low165 Ų165122.1 Ų122.1100%161%0.614SS**  0-57.10-1720000113.3K3 F4 N5V1-K3 PolarHBondContact O-N 3.26Å; V1-F4 WeakPolarHBondContact O-CB 3.3Å; V1-F4 PolarHBondContact O-N 3.45Å; V1-N5 PolarHBondContact O-N 2.91Å
2L34.4Very low43.2Very low153 Ų153121.2 Ų121.280%0.80160%0.603SS**Hα-helixtrans-61.2-41.5-178.5-80.8155000115.4F4 N5 K6L2-F4 VanDerWaalsContact C-N 3.31Å; L2-F4 PolarHBondContact O-N 2.97Å; L2-N5 PolarHBondContact O-N 3.46Å; L2-K6 WeakPolarHBondContact O-CB 3.5Å; L2-K6 PolarHBondContact O-N 2.94Å
3K31.4Very low44.4Very low182 Ų182121 Ų12179%0.79160%0.602SS**Hα-helixtrans-68.3-30.8177.9-152.3166.2-174.1176.80112.7V1 N7V1-K3 PolarHBondContact O-N 3.26Å; K3-N7 PolarHBondContact O-N 3.22Å
4F36.8Very low45.7Very low152 Ų152116.9 Ų116.967%0.66759%0.59SS**Hα-helixtrans-74-41.9175.3-149.1-98.1000111.2V1 L2 K6 N7 I8V1-F4 WeakPolarHBondContact O-CB 3.3Å; V1-F4 PolarHBondContact O-N 3.45Å; L2-F4 VanDerWaalsContact C-N 3.31Å; L2-F4 PolarHBondContact O-N 2.97Å; F4-K6 VanDerWaalsContact C-N 3.32Å; F4-K6 PolarHBondContact O-N 3.24Å; F4-N7 PolarHBondContact O-N 3.44Å; F4-I8 HydrophobicContact CD1-CD1 3.58Å; F4-I8 HydrophobicContact CD1-CG1 4.44Å; F4-I8 HydrophobicContact CE1-CD1 3.86Å; F4-I8 WeakPolarHBondContact O-CD1 3.35Å; F4-I8 VanDerWaalsContact O-CG1 3.28Å; F4-I8 WeakPolarHBondContact O-CG1 3.35Å; F4-I8 PolarHBondContact O-N 3.05Å
5N37.8Very low47.3Very low81 Ų81113.4 Ų113.443%0.43358%0.576SS.*Hα-helixtrans-65.3-34.2175.1-159.61.5000112.2V1 L2 I8 N9V1-N5 PolarHBondContact O-N 2.91Å; L2-N5 PolarHBondContact O-N 3.46Å; N5-I8 PolarHBondContact O-N 3.38Å; N5-N9 WeakPolarHBondContact O-CB 3.49Å; N5-N9 PolarHBondContact O-N 3.06Å; N5-N9 PolarHBondContact O-ND2 3.41Å; N5-N9 PolarHBondContact OD1-ND2 3.38Å
6K34.6Very low48.8Very low166 Ų166109 Ų10972%0.72256%0.559SS**Hα-helixtrans-68.8-41.5175.7-151.1173.9-173.4177.50112.6L2 F4 N9 F10L2-K6 WeakPolarHBondContact O-CB 3.5Å; L2-K6 PolarHBondContact O-N 2.94Å; F4-K6 VanDerWaalsContact C-N 3.32Å; F4-K6 PolarHBondContact O-N 3.24Å; K6-N9 PolarHBondContact O-N 3.02Å; K6-F10 PolarHBondContact O-N 3.23Å
7N40.6Very low50.5Low111 Ų111112.1 Ų112.159%0.59456%0.562SS**Hα-helixtrans-64.3-41.8173.2-90.5-14.9000112.2K3 F4 N9 F10 S11K3-N7 PolarHBondContact O-N 3.22Å; F4-N7 PolarHBondContact O-N 3.44Å; N7-N9 PolarHBondContact O-N 3.21Å; N7-F10 PolarHBondContact O-N 3.34Å; N7-S11 PolarHBondContact O-N 3.49Å; N7-S11 PolarHBondContact O-OG 3.46Å
8I50.3Low52.2Low49 Ų49109.4 Ų109.425%0.25155%0.545SS..Hα-helixtrans-64.1-40.7177.1-69.7165.5000111.6F4 N5 K12F4-I8 HydrophobicContact CD1-CD1 3.58Å; F4-I8 HydrophobicContact CD1-CG1 4.44Å; F4-I8 HydrophobicContact CE1-CD1 3.86Å; F4-I8 WeakPolarHBondContact O-CD1 3.35Å; F4-I8 VanDerWaalsContact O-CG1 3.28Å; F4-I8 WeakPolarHBondContact O-CG1 3.35Å; F4-I8 PolarHBondContact O-N 3.05Å; N5-I8 PolarHBondContact O-N 3.38Å; I8-K12 HydrophobicContact CG2-CD 4.05Å; I8-K12 VanDerWaalsContact CG2-CE 3.44Å; I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 VanDerWaalsContact O-CG 3.22Å; I8-K12 WeakPolarHBondContact O-CG 3.4Å; I8-K12 PolarHBondContact O-N 3.24Å; I8-K12 VanDerWaalsContact O-N 3.09Å
9N47Very low53.8Low71 Ų71104.3 Ų104.338%0.3852%0.519SS..Hα-helixtrans-69.7-34.6177.5-76.4-30.8000112.8N5 K6 N7 K12 M13N5-N9 WeakPolarHBondContact O-CB 3.49Å; N5-N9 PolarHBondContact O-N 3.06Å; N5-N9 PolarHBondContact O-ND2 3.41Å; N5-N9 PolarHBondContact OD1-ND2 3.38Å; K6-N9 PolarHBondContact O-N 3.02Å; N7-N9 PolarHBondContact O-N 3.21Å; N9-K12 PolarHBondContact O-N 3Å; N9-M13 WeakPolarHBondContact O-CG 3.08Å; N9-M13 PolarHBondContact O-N 3.04Å; N9-M13 VanDerWaalsContact O-N 3.08Å
10F47.4Very low55.3Low142 Ų142102.1 Ų102.162%0.62351%0.509SS*.Hα-helixtrans-65.5-48.3174.9-169.7-99.2000111.8K6 N7 K12 M13 C14K6-F10 PolarHBondContact O-N 3.23Å; N7-F10 PolarHBondContact O-N 3.34Å; F10-K12 VanDerWaalsContact C-N 3.31Å; F10-K12 PolarHBondContact O-N 3.44Å; F10-M13 PolarHBondContact O-N 2.99Å; F10-C14 PolarHBondContact O-N 3.44Å; F10-C14 PolarHBondContact O-SG 3.38Å; F10-C14 VanDerWaalsContact O-SG 3.4Å
11S54Low56.8Low71 Ų71104.7 Ų104.750%0.49751%0.514SS..Hα-helixtrans-60.2-38.5175.6-58.60000112.5N7 C14 V15N7-S11 PolarHBondContact O-N 3.49Å; N7-S11 PolarHBondContact O-OG 3.46Å; S11-C14 PolarHBondContact O-N 3.04Å; S11-V15 VanDerWaalsContact O-CG2 3.23Å; S11-V15 WeakPolarHBondContact O-CG2 3.32Å; S11-V15 PolarHBondContact O-N 3.5Å
12K56.7Low58.8Low111 Ų11197.1 Ų97.148%0.48347%0.469SS..Hα-helixtrans-63.7-40.8175.5-75.9170.2-179.2171.30113I8 N9 F10 V15 S16I8-K12 HydrophobicContact CG2-CD 4.05Å; I8-K12 VanDerWaalsContact CG2-CE 3.44Å; I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 VanDerWaalsContact O-CG 3.22Å; I8-K12 WeakPolarHBondContact O-CG 3.4Å; I8-K12 PolarHBondContact O-N 3.24Å; I8-K12 VanDerWaalsContact O-N 3.09Å; N9-K12 PolarHBondContact O-N 3Å; F10-K12 VanDerWaalsContact C-N 3.31Å; F10-K12 PolarHBondContact O-N 3.44Å; K12-V15 PolarHBondContact O-N 3.27Å; K12-S16 PolarHBondContact O-N 3.29Å; K12-S16 VanDerWaalsContact O-N 3.09Å
13M58.9Low61.3Low119 Ų11989.9 Ų89.959%0.58643%0.43SS*.Hα-helixtrans-68.5-37.3177.5-72.3176.373.700111.9N9 F10 R17N9-M13 WeakPolarHBondContact O-CG 3.08Å; N9-M13 PolarHBondContact O-N 3.04Å; N9-M13 VanDerWaalsContact O-N 3.08Å; F10-M13 PolarHBondContact O-N 2.99Å; M13-R17 WeakPolarHBondContact O-CG 3.39Å; M13-R17 PolarHBondContact O-N 2.98Å
14C62.8Low64Low64 Ų6485.7 Ų85.743%0.43242%0.415SS..Hα-helixtrans-65.2-43.6173.7-68.40000112.1F10 S11 R17 Y18F10-C14 PolarHBondContact O-N 3.44Å; F10-C14 PolarHBondContact O-SG 3.38Å; F10-C14 VanDerWaalsContact O-SG 3.4Å; S11-C14 PolarHBondContact O-N 3.04Å; C14-R17 PolarHBondContact O-N 3.13Å; C14-Y18 VanDerWaalsContact O-CB 3.27Å; C14-Y18 WeakPolarHBondContact O-CB 3.49Å; C14-Y18 PolarHBondContact O-N 3.4Å
15V69.3Low66.5Low64 Ų6480.6 Ų80.639%0.38840%0.401SS..Hα-helixtrans-67.7-40.4-1791730000112.3S11 K12 Y18 L19S11-V15 VanDerWaalsContact O-CG2 3.23Å; S11-V15 WeakPolarHBondContact O-CG2 3.32Å; S11-V15 PolarHBondContact O-N 3.5Å; K12-V15 PolarHBondContact O-N 3.27Å; V15-Y18 PolarHBondContact O-N 2.86Å; V15-L19 HydrophobicContact CG1-CD1 4.03Å; V15-L19 HydrophobicContact CG1-CG 4.37Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 WeakPolarHBondContact O-CG 3.46Å; V15-L19 PolarHBondContact O-N 2.91Å
16S70.7Confident69Low43 Ų4376.8 Ų76.830%0.30138%0.381SS..Hα-helixtrans-62.8-45.5176.6168.10000112K12 L19 L20 S83K12-S16 PolarHBondContact O-N 3.29Å; K12-S16 VanDerWaalsContact O-N 3.09Å; S16-L19 PolarHBondContact O-N 3.04Å; S16-L20 PolarHBondContact O-N 3.05Å; S16-S83 VanDerWaalsContact O-CB 3.25Å; S16-S83 WeakPolarHBondContact O-CB 3.38Å; S16-S83 PolarHBondContact OG-O 2.95Å
17R78Confident71.7Confident161 Ų16171.1 Ų71.161%0.60836%0.36SS*.Hα-helixtrans-64.3-44.2176.2-70.3-176.3-178.5-162.70.7111.5M13 C14 L19 L20 Y21M13-R17 WeakPolarHBondContact O-CG 3.39Å; M13-R17 PolarHBondContact O-N 2.98Å; C14-R17 PolarHBondContact O-N 3.13Å; R17-L19 PolarHBondContact O-N 3.42Å; R17-L20 WeakPolarHBondContact O-CB 3.21Å; R17-L20 PolarHBondContact O-N 2.94Å; R17-Y21 HydrophobicContact CB-CD2 4.5Å; R17-Y21 HydrophobicContact CB-CE2 4.4Å; R17-Y21 WeakPolarHBondContact O-CD2 3.23Å; R17-Y21 PolarHBondContact O-N 3.03Å
18Y81.9Confident74.2Confident64 Ų6468.9 Ų68.925%0.25135%0.351SS..Hα-helixtrans-57.3-48.8175.7167.9-97.6000111.9C14 V15 L20 Y21 V22 L191 N192 N195C14-Y18 VanDerWaalsContact O-CB 3.27Å; C14-Y18 WeakPolarHBondContact O-CB 3.49Å; C14-Y18 PolarHBondContact O-N 3.4Å; V15-Y18 PolarHBondContact O-N 2.86Å; Y18-L20 VanDerWaalsContact C-N 3.27Å; Y18-L20 PolarHBondContact O-N 3.1Å; Y18-Y21 PolarHBondContact O-N 3.35Å; Y18-V22 HydrophobicContact CD1-CG2 4.38Å; Y18-V22 HydrophobicContact CD2-CG2 3.98Å; Y18-V22 HydrophobicContact CE1-CG2 3.98Å; Y18-V22 HydrophobicContact CE2-CG2 3.53Å; Y18-V22 HydrophobicContact CG-CG2 4.37Å; Y18-V22 VanDerWaalsContact O-CG2 3.31Å; Y18-V22 WeakPolarHBondContact O-CG2 3.48Å; Y18-V22 PolarHBondContact O-N 3.11Å; Y18-L191 WeakPolarHBondContact OH-CB 3.45Å; Y18-N192 WeakPolarHBondContact CE1-OD1 3.23Å; Y18-N192 PolarHBondContact OH-OD1 3.39Å; Y18-N195 WeakPolarHBondContact CE1-ND2 3.37Å
19L81.9Confident76.2Confident12 Ų1269.4 Ų69.46%0.06335%0.353CS..Hα-helixtrans-60.9-34.7176.7-72.7171.9000112.7V15 S16 R17 G23 F79 R82 L98V15-L19 HydrophobicContact CG1-CD1 4.03Å; V15-L19 HydrophobicContact CG1-CG 4.37Å; V15-L19 WeakPolarHBondContact O-CB 3.28Å; V15-L19 WeakPolarHBondContact O-CG 3.46Å; V15-L19 PolarHBondContact O-N 2.91Å; S16-L19 PolarHBondContact O-N 3.04Å; R17-L19 PolarHBondContact O-N 3.42Å; L19-G23 PolarHBondContact O-N 3.02Å; L19-F79 HydrophobicContact CD2-CD1 4.09Å; L19-R82 HydrophobicContact CD1-CG 4.43Å; L19-L98 HydrophobicContact CD1-CD2 4.13Å; L19-L98 HydrophobicContact CD2-CD2 4.26Å
20L84.6Confident78.4Confident60 Ų6066.1 Ų66.131%0.31434%0.336SS..Hα-helixtrans-66.7-47.8174.3-177.561.8000111.6S16 R17 Y18 G23 M24 I80S16-L20 PolarHBondContact O-N 3.05Å; R17-L20 WeakPolarHBondContact O-CB 3.21Å; R17-L20 PolarHBondContact O-N 2.94Å; Y18-L20 VanDerWaalsContact C-N 3.27Å; Y18-L20 PolarHBondContact O-N 3.1Å; L20-G23 PolarHBondContact O-N 3.22Å; L20-M24 HydrophobicContact CD1-CG 4.35Å; L20-M24 HydrophobicContact CD1-SD 4.37Å; L20-M24 HydrophobicContact CG-CE 4.06Å; L20-M24 HydrophobicContact CG-SD 4.46Å; L20-M24 WeakPolarHBondContact O-CB 3.22Å; L20-M24 WeakPolarHBondContact O-CG 3.36Å; L20-M24 PolarHBondContact O-N 3.4Å; L20-I80 HydrophobicContact CD1-CG2 4.3Å
21Y86.7Confident80.5Confident157 Ų15763.9 Ų63.962%0.61633%0.329SS*.Hα-helixtrans-62.6-44.6177.5-78.3-68.6000112R17 Y18 M24 A25R17-Y21 HydrophobicContact CB-CD2 4.5Å; R17-Y21 HydrophobicContact CB-CE2 4.4Å; R17-Y21 WeakPolarHBondContact O-CD2 3.23Å; R17-Y21 PolarHBondContact O-N 3.03Å; Y18-Y21 PolarHBondContact O-N 3.35Å; Y21-M24 HydrophobicContact CD1-CE 4.16Å; Y21-M24 HydrophobicContact CE1-CE 4.47Å; Y21-M24 PolarHBondContact O-N 3.19Å; Y21-A25 VanDerWaalsContact O-CB 3.29Å; Y21-A25 WeakPolarHBondContact O-CB 3.46Å; Y21-A25 PolarHBondContact O-N 3.46Å
22V87.9Confident82.2Confident7 Ų764 Ų644%0.04232%0.324CS..Hα-helixtrans-63-45.9177.1174.40000110.8Y18 M24 A25 L26 L188 N192Y18-V22 HydrophobicContact CD1-CG2 4.38Å; Y18-V22 HydrophobicContact CD2-CG2 3.98Å; Y18-V22 HydrophobicContact CE1-CG2 3.98Å; Y18-V22 HydrophobicContact CE2-CG2 3.53Å; Y18-V22 HydrophobicContact CG-CG2 4.37Å; Y18-V22 VanDerWaalsContact O-CG2 3.31Å; Y18-V22 WeakPolarHBondContact O-CG2 3.48Å; Y18-V22 PolarHBondContact O-N 3.11Å; V22-M24 PolarHBondContact O-N 3.38Å; V22-A25 PolarHBondContact O-N 3.09Å; V22-L26 HydrophobicContact CG1-CD1 3.84Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.35Å; V22-L26 WeakPolarHBondContact O-CD1 3.41Å; V22-L26 VanDerWaalsContact O-CG 3.24Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 2.99Å; V22-L188 HydrophobicContact CG1-CB 4.06Å; V22-L188 HydrophobicContact CG2-CD2 4.36Å; V22-N192 WeakPolarHBondContact CG1-ND2 3.48Å
23G87.4Confident83.8Confident0 Ų058.7 Ų58.70%030%0.301CS..Hα-helixtrans-58.1-46.2175.300000112.6L19 L20 L26 V27L19-G23 PolarHBondContact O-N 3.02Å; L20-G23 PolarHBondContact O-N 3.22Å; G23-L26 PolarHBondContact O-N 3.4Å; G23-V27 WeakPolarHBondContact O-CG2 3.36Å; G23-V27 PolarHBondContact O-N 3.18Å
24M88Confident85.2Confident95 Ų9555.5 Ų55.547%0.46829%0.285SS..Hα-helixtrans-67.6-34.4177.7-71.1-169.1-54.600113.1L20 Y21 V22 P28L20-M24 HydrophobicContact CD1-CG 4.35Å; L20-M24 HydrophobicContact CD1-SD 4.37Å; L20-M24 HydrophobicContact CG-CE 4.06Å; L20-M24 HydrophobicContact CG-SD 4.46Å; L20-M24 WeakPolarHBondContact O-CB 3.22Å; L20-M24 WeakPolarHBondContact O-CG 3.36Å; L20-M24 PolarHBondContact O-N 3.4Å; Y21-M24 HydrophobicContact CD1-CE 4.16Å; Y21-M24 HydrophobicContact CE1-CE 4.47Å; Y21-M24 PolarHBondContact O-N 3.19Å; V22-M24 PolarHBondContact O-N 3.38Å; M24-P28 WeakPolarHBondContact O-CD 3.01Å
25A90.6Very high86.5Confident45 Ų4555.9 Ų55.937%0.37229%0.285SS..Hα-helixtrans-72.7-30176.700000112.8Y21 V22 P28 M29Y21-A25 VanDerWaalsContact O-CB 3.29Å; Y21-A25 WeakPolarHBondContact O-CB 3.46Å; Y21-A25 PolarHBondContact O-N 3.46Å; V22-A25 PolarHBondContact O-N 3.09Å; A25-P28 VanDerWaalsContact O-CD 3.29Å; A25-P28 WeakPolarHBondContact O-CD 3.34Å; A25-P28 WeakPolarHBondContact O-CG 3.49Å; A25-M29 WeakPolarHBondContact O-CG 3.27Å
26L90.1Very high87.4Confident1 Ų153.2 Ų53.21%0.00527%0.269CS..Hα-helixtrans-68.6-35.1176.8-75.1164.1000112.2V22 G23 M29 V30 V72 A76 F79 Q185 L188V22-L26 HydrophobicContact CG1-CD1 3.84Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.35Å; V22-L26 WeakPolarHBondContact O-CD1 3.41Å; V22-L26 VanDerWaalsContact O-CG 3.24Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 2.99Å; G23-L26 PolarHBondContact O-N 3.4Å; L26-M29 PolarHBondContact O-N 3.08Å; L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 3.14Å; L26-V72 HydrophobicContact CD2-CG1 3.96Å; L26-A76 HydrophobicContact CB-CB 3.94Å; L26-A76 HydrophobicContact CD1-CB 4.32Å; L26-F79 HydrophobicContact CD1-CD2 3.7Å; L26-F79 HydrophobicContact CD1-CE2 3.65Å; L26-Q185 HydrophobicContact CD2-CB 4.04Å; L26-Q185 HydrophobicContact CD2-CG 3.71Å; L26-L188 HydrophobicContact CD2-CD1 4.18Å; L26-L188 HydrophobicContact CG-CD1 4.38Å
27V91.3Very high88.3Confident47 Ų4751.3 Ų51.329%0.28526%0.256SS..Hα-helixtrans-55.7-55.1-179.1174.50000113.6G23 M29 V30 I31 A76G23-V27 WeakPolarHBondContact O-CG2 3.36Å; G23-V27 PolarHBondContact O-N 3.18Å; V27-M29 VanDerWaalsContact C-N 3.3Å; V27-M29 PolarHBondContact O-N 2.98Å; V27-V30 WeakPolarHBondContact O-CB 3.39Å; V27-V30 PolarHBondContact O-N 3.39Å; V27-I31 HydrophobicContact CG1-CD1 4.02Å; V27-I31 WeakPolarHBondContact O-CG1 3.36Å; V27-I31 PolarHBondContact O-N 3.1Å; V27-A76 HydrophobicContact CG2-CB 4.5Å
28P92.8Very high88.6Confident63 Ų6347.3 Ų47.341%0.40925%0.245SC..Hα-helixtrans-64.4-34.9178.925.7-34.4000112.1M24 A25 V30 I31 I32M24-P28 WeakPolarHBondContact O-CD 3.01Å; A25-P28 VanDerWaalsContact O-CD 3.29Å; A25-P28 WeakPolarHBondContact O-CD 3.34Å; A25-P28 WeakPolarHBondContact O-CG 3.49Å; P28-V30 PolarHBondContact O-N 2.75Å; P28-I31 PolarHBondContact O-N 2.89Å; P28-I32 VanDerWaalsContact O-CG1 3.3Å; P28-I32 WeakPolarHBondContact O-CG1 3.48Å; P28-I32 PolarHBondContact O-N 3.36Å
29M91.9Very high88.7Confident61 Ų6146.9 Ų46.930%0.325%0.247SC..Hα-helixtrans-63-42.6175.8-65.2-67.5-176.800111.5A25 L26 V27 I31 I32 C33 C181 Q185A25-M29 WeakPolarHBondContact O-CG 3.27Å; L26-M29 PolarHBondContact O-N 3.08Å; V27-M29 VanDerWaalsContact C-N 3.3Å; V27-M29 PolarHBondContact O-N 2.98Å; M29-I31 VanDerWaalsContact C-N 3.34Å; M29-I32 PolarHBondContact O-N 2.86Å; M29-C33 PolarHBondContact O-N 3.21Å; M29-C33 PolarHBondContact O-SG 3.32Å; M29-C33 VanDerWaalsContact O-SG 3.37Å; M29-C181 HydrophobicContact CB-CB 4.46Å; M29-C181 HydrophobicContact SD-CB 3.98Å; M29-C181 VanDerWaalsContact SD-SG 3.63Å; M29-Q185 HydrophobicContact CB-CG 4.11Å
30V92.6Very high88.5Confident2 Ų246.6 Ų46.61%0.01225%0.246CC..Hα-helixtrans-59.8-45.2174.1164.50000111L26 V27 P28 C33 M34 V72 L73L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 3.14Å; V27-V30 WeakPolarHBondContact O-CB 3.39Å; V27-V30 PolarHBondContact O-N 3.39Å; P28-V30 PolarHBondContact O-N 2.75Å; V30-C33 PolarHBondContact O-N 3.47Å; V30-M34 HydrophobicContact CG1-CE 4.26Å; V30-M34 HydrophobicContact CG1-CG 4.47Å; V30-M34 WeakPolarHBondContact O-CG 3.33Å; V30-M34 PolarHBondContact O-N 2.94Å; V30-V72 HydrophobicContact CG2-CB 3.9Å; V30-V72 HydrophobicContact CG2-CG1 3.67Å; V30-L73 HydrophobicContact CG1-CB 4.21Å; V30-L73 HydrophobicContact CG1-CD1 4.35Å
31I91.4Very high88.1Confident95 Ų9545.6 Ų45.649%0.48724%0.24SC..Hα-helixtrans-61.8-46.1179.5-66.5166.8000110.3V27 P28 M29 C33 M34 V35V27-I31 HydrophobicContact CG1-CD1 4.02Å; V27-I31 WeakPolarHBondContact O-CG1 3.36Å; V27-I31 PolarHBondContact O-N 3.1Å; P28-I31 PolarHBondContact O-N 2.89Å; M29-I31 VanDerWaalsContact C-N 3.34Å; I31-C33 VanDerWaalsContact C-N 3.33Å; I31-C33 PolarHBondContact O-N 3.23Å; I31-M34 PolarHBondContact O-N 3.39Å; I31-V35 HydrophobicContact CG2-CG2 4.2Å; I31-V35 WeakPolarHBondContact O-CB 3.48Å; I31-V35 VanDerWaalsContact O-CG2 3.3Å; I31-V35 WeakPolarHBondContact O-CG2 3.29Å; I31-V35 PolarHBondContact O-N 3.46Å
32I91.3Very high87.4Confident73 Ų7342 Ų4237%0.37423%0.228SC..Hα-helixtrans-59.8-44.3177-66.8164000110.6P28 M29 S36P28-I32 VanDerWaalsContact O-CG1 3.3Å; P28-I32 WeakPolarHBondContact O-CG1 3.48Å; P28-I32 PolarHBondContact O-N 3.36Å; M29-I32 PolarHBondContact O-N 2.86Å; I32-S36 VanDerWaalsContact O-CB 3.24Å; I32-S36 WeakPolarHBondContact O-CB 3.44Å; I32-S36 PolarHBondContact O-N 2.92Å; I32-S36 PolarHBondContact O-OG 3.47Å
33C89.3Confident86.4Confident0 Ų042.6 Ų42.60%023%0.233CC..Hα-helixtrans-62.3-44176.5-72.40000112.6M29 V30 I31 N37 C181M29-C33 PolarHBondContact O-N 3.21Å; M29-C33 PolarHBondContact O-SG 3.32Å; M29-C33 VanDerWaalsContact O-SG 3.37Å; V30-C33 PolarHBondContact O-N 3.47Å; I31-C33 VanDerWaalsContact C-N 3.33Å; I31-C33 PolarHBondContact O-N 3.23Å; C33-N37 WeakPolarHBondContact O-CB 3.36Å; C33-N37 PolarHBondContact O-N 3.04Å; C33-C181 WeakPolarHBondContact SG-CB 3.3Å
34M89.3Confident85.2Confident51 Ų5146.5 Ų46.525%0.25125%0.251SS..Hα-helixtrans-64.5-48.9178.3-76.3-165.5174.800111.6V30 I31 S36 N37 I38 L65 G69V30-M34 HydrophobicContact CG1-CE 4.26Å; V30-M34 HydrophobicContact CG1-CG 4.47Å; V30-M34 WeakPolarHBondContact O-CG 3.33Å; V30-M34 PolarHBondContact O-N 2.94Å; I31-M34 PolarHBondContact O-N 3.39Å; M34-S36 VanDerWaalsContact C-N 3.33Å; M34-S36 PolarHBondContact O-N 3.28Å; M34-N37 PolarHBondContact O-N 3.19Å; M34-I38 VanDerWaalsContact O-CG1 3.28Å; M34-I38 WeakPolarHBondContact O-CG1 3.32Å; M34-I38 PolarHBondContact O-N 3.32Å; M34-L65 HydrophobicContact CB-CD2 4.25Å; M34-L65 HydrophobicContact CG-CD2 4.16Å; M34-L65 HydrophobicContact SD-CD2 4.45Å; M34-G69 VanDerWaalsContact CE-C 3.47Å; M34-G69 VanDerWaalsContact CE-CA 3.48Å
35V90.1Very high83.7Confident72 Ų7249.6 Ų49.644%0.43627%0.266SS..Hα-helixtrans-61.3-44.8179.1172.30000110.2I31 N37 I38 L39I31-V35 HydrophobicContact CG2-CG2 4.2Å; I31-V35 WeakPolarHBondContact O-CB 3.48Å; I31-V35 VanDerWaalsContact O-CG2 3.3Å; I31-V35 WeakPolarHBondContact O-CG2 3.29Å; I31-V35 PolarHBondContact O-N 3.46Å; V35-N37 VanDerWaalsContact C-N 3.34Å; V35-N37 PolarHBondContact O-N 2.84Å; V35-I38 PolarHBondContact O-N 3.01Å; V35-L39 HydrophobicContact CG1-CD1 3.87Å; V35-L39 HydrophobicContact CG1-CG 4.27Å; V35-L39 WeakPolarHBondContact O-CB 3.38Å; V35-L39 VanDerWaalsContact O-CG 3.28Å; V35-L39 WeakPolarHBondContact O-CG 3.22Å; V35-L39 PolarHBondContact O-N 3.47Å
36S88.6Confident82.1Confident8 Ų849.9 Ų49.96%0.05626%0.263CS..Hα-helixtrans-63.4-39.8179.1-56.50000112.3I32 M34 L39 L40 M178I32-S36 VanDerWaalsContact O-CB 3.24Å; I32-S36 WeakPolarHBondContact O-CB 3.44Å; I32-S36 PolarHBondContact O-N 2.92Å; I32-S36 PolarHBondContact O-OG 3.47Å; M34-S36 VanDerWaalsContact C-N 3.33Å; M34-S36 PolarHBondContact O-N 3.28Å; S36-L39 PolarHBondContact O-N 3.38Å; S36-L40 WeakPolarHBondContact O-CB 3.44Å; S36-L40 WeakPolarHBondContact O-CG 3.32Å; S36-L40 PolarHBondContact O-N 2.95Å; S36-M178 VanDerWaalsContact CB-CG 3.42Å
37N87.8Confident80.6Confident3 Ų356.7 Ų56.72%0.01629%0.29CS..Hα-helixtrans-68.4-38.2176.5-169.7102.8000112.3C33 M34 V35 L41 G64 M178C33-N37 WeakPolarHBondContact O-CB 3.36Å; C33-N37 PolarHBondContact O-N 3.04Å; M34-N37 PolarHBondContact O-N 3.19Å; V35-N37 VanDerWaalsContact C-N 3.34Å; V35-N37 PolarHBondContact O-N 2.84Å; N37-L41 PolarHBondContact O-N 3.47Å; N37-L41 VanDerWaalsContact O-N 3.17Å; N37-G64 WeakPolarHBondContact OD1-CA 3.46Å; N37-G64 PolarHBondContact OD1-N 2.98Å; N37-G64 VanDerWaalsContact OD1-N 3.13Å; N37-M178 HydrophobicContact CB-CE 3.97Å; N37-M178 HydrophobicContact CB-SD 4.09Å
38I84.3Confident78.9Confident77 Ų7759.5 Ų59.540%0.39530%0.3SS..Hα-helixtrans-63.7-48.3174.2-69.3165.2000109.3M34 V35 L40 L41 F42 L65M34-I38 VanDerWaalsContact O-CG1 3.28Å; M34-I38 WeakPolarHBondContact O-CG1 3.32Å; M34-I38 PolarHBondContact O-N 3.32Å; V35-I38 PolarHBondContact O-N 3.01Å; I38-L40 PolarHBondContact O-N 2.95Å; I38-L41 WeakPolarHBondContact O-CA 3.35Å; I38-L41 VanDerWaalsContact O-CB 3.25Å; I38-L41 WeakPolarHBondContact O-CB 3.38Å; I38-L41 PolarHBondContact O-N 3.01Å; I38-F42 HydrophobicContact CG2-CD2 4.19Å; I38-F42 HydrophobicContact CG2-CE2 4.43Å; I38-F42 WeakPolarHBondContact O-CD2 3.45Å; I38-F42 PolarHBondContact O-N 3.22Å; I38-L65 HydrophobicContact CD1-CD2 4.11Å; I38-L65 HydrophobicContact CG1-CD1 4.3Å; I38-L65 HydrophobicContact CG1-CD2 4Å; I38-L65 HydrophobicContact CG1-CG 4.48Å
39L84.4Confident77Confident55 Ų5558.1 Ų58.129%0.28829%0.287SS..Hα-helixtrans-57.2-48.7177.3-74.4177.5000110.5V35 S36 L41 F42 W170 L174V35-L39 HydrophobicContact CG1-CD1 3.87Å; V35-L39 HydrophobicContact CG1-CG 4.27Å; V35-L39 WeakPolarHBondContact O-CB 3.38Å; V35-L39 VanDerWaalsContact O-CG 3.28Å; V35-L39 WeakPolarHBondContact O-CG 3.22Å; V35-L39 PolarHBondContact O-N 3.47Å; S36-L39 PolarHBondContact O-N 3.38Å; L39-L41 PolarHBondContact O-N 3.31Å; L39-L41 VanDerWaalsContact O-N 3.11Å; L39-F42 CarbonylContact O-C 3.11Å; L39-F42 WeakPolarHBondContact O-CA 3.35Å; L39-F42 PolarHBondContact O-N 3.48Å; L39-W170 HydrophobicContact CB-CH2 3.45Å; L39-W170 VanDerWaalsContact CB-CH2 3.45Å; L39-W170 HydrophobicContact CB-CZ2 4.01Å; L39-W170 HydrophobicContact CB-CZ3 4.1Å; L39-W170 HydrophobicContact CD2-CH2 3.95Å; L39-W170 HydrophobicContact CD2-CZ2 3.99Å; L39-W170 HydrophobicContact CG-CH2 4.21Å; L39-W170 HydrophobicContact CG-CZ2 4.39Å; L39-W170 WeakPolarHBondContact O-CH2 3.41Å; L39-W170 WeakPolarHBondContact O-CZ3 3.38Å; L39-L174 HydrophobicContact CB-CD1 3.64Å; L39-L174 HydrophobicContact CB-CD2 4.26Å; L39-L174 HydrophobicContact CD1-CD2 4.01Å
40L79Confident75.2Confident6 Ų658.6 Ų58.63%0.03129%0.29CS..Hα-helixtrans-56.2-28.6175.1-79.4168000114.2S36 I38 F42 N171 L174 F175 M178S36-L40 WeakPolarHBondContact O-CB 3.44Å; S36-L40 WeakPolarHBondContact O-CG 3.32Å; S36-L40 PolarHBondContact O-N 2.95Å; I38-L40 PolarHBondContact O-N 2.95Å; L40-F42 VanDerWaalsContact C-N 3.34Å; L40-N171 HydrophobicContact CD2-CB 4.39Å; L40-N171 VanDerWaalsContact CD2-OD1 3.32Å; L40-N171 WeakPolarHBondContact CD2-OD1 3.34Å; L40-L174 HydrophobicContact CD1-CB 4.11Å; L40-L174 HydrophobicContact CD2-CB 3.87Å; L40-L174 HydrophobicContact CD2-CD1 4.06Å; L40-L174 HydrophobicContact CG-CB 3.74Å; L40-L174 HydrophobicContact CG-CD1 3.88Å; L40-L174 HydrophobicContact CG-CG 4.49Å; L40-F175 HydrophobicContact CD1-CD1 3.65Å; L40-F175 HydrophobicContact CD1-CD2 4.24Å; L40-F175 HydrophobicContact CD1-CE1 3.56Å; L40-F175 HydrophobicContact CD1-CE2 4.14Å; L40-F175 HydrophobicContact CD1-CG 4Å; L40-F175 HydrophobicContact CD1-CZ 3.81Å; L40-F175 HydrophobicContact CD2-CD2 3.8Å; L40-F175 HydrophobicContact CD2-CE2 3.59Å; L40-F175 HydrophobicContact CD2-CG 4.35Å; L40-F175 HydrophobicContact CD2-CZ 3.98Å; L40-F175 HydrophobicContact CG-CZ 4.47Å; L40-M178 HydrophobicContact CD1-SD 3.54Å; L40-M178 VanDerWaalsContact CD1-SD 3.54Å
41L74.8Confident73.3Confident39 Ų3964.8 Ų64.820%0.20432%0.322CS..Hα-helixtrans-73-28.1174.7-137.781.7000112.3N37 I38 L39 P43 L50 A59N37-L41 PolarHBondContact O-N 3.47Å; N37-L41 VanDerWaalsContact O-N 3.17Å; I38-L41 WeakPolarHBondContact O-CA 3.35Å; I38-L41 VanDerWaalsContact O-CB 3.25Å; I38-L41 WeakPolarHBondContact O-CB 3.38Å; I38-L41 PolarHBondContact O-N 3.01Å; L39-L41 PolarHBondContact O-N 3.31Å; L39-L41 VanDerWaalsContact O-N 3.11Å; L41-P43 VanDerWaalsContact C-CD 3.47Å; L41-P43 WeakPolarHBondContact O-CD 3.43Å; L41-L50 WeakPolarHBondContact O-CD1 3.08Å; L41-A59 WeakPolarHBondContact CD1-O 3.18Å
42F72.7Confident71.6Confident81 Ų8165.5 Ų65.536%0.35533%0.327SS..SBendtrans-121.571-177.4-63.4-82.3000111.6I38 L39 L40 E44 M45 L50I38-F42 HydrophobicContact CG2-CD2 4.19Å; I38-F42 HydrophobicContact CG2-CE2 4.43Å; I38-F42 WeakPolarHBondContact O-CD2 3.45Å; I38-F42 PolarHBondContact O-N 3.22Å; L39-F42 CarbonylContact O-C 3.11Å; L39-F42 WeakPolarHBondContact O-CA 3.35Å; L39-F42 PolarHBondContact O-N 3.48Å; L40-F42 VanDerWaalsContact C-N 3.34Å; F42-E44 PolarHBondContact O-N 3.09Å; F42-M45 PolarHBondContact O-N 2.99Å; F42-L50 HydrophobicContact CD1-CD1 3.35Å; F42-L50 HydrophobicContact CE1-CD1 3.17Å; F42-L50 HydrophobicContact CE2-CD1 4.43Å; F42-L50 HydrophobicContact CG-CD1 4.07Å; F42-L50 HydrophobicContact CZ-CD1 3.76Å
43P66.1Low69.9Low21 Ų2165.1 Ų65.114%0.13634%0.341CS..G310 helixtrans-57.6131.9171.424.9-31.9000109.9L41 M45 T46L41-P43 VanDerWaalsContact C-CD 3.47Å; L41-P43 WeakPolarHBondContact O-CD 3.43Å; P43-M45 PolarHBondContact O-N 2.9Å; P43-M45 VanDerWaalsContact O-N 3.14Å; P43-T46 PolarHBondContact O-N 3.41Å; P43-T46 PolarHBondContact O-OG1 3.48Å
44E63.5Low68.3Low82 Ų8268.5 Ų68.538%0.38336%0.357SS..G310 helixtrans58.916.9-177.7-60.1-178.216900116.1F42 T46 P164 E165F42-E44 PolarHBondContact O-N 3.09Å; E44-T46 PolarHBondContact O-N 3.48Å; E44-P164 HydrophobicContact CG-CB 4.13Å; E44-P164 WeakPolarHBondContact OE1-CB 2.91Å; E44-E165 PolarHBondContact OE1-N 3.43Å
45M55.3Low66.9Low159 Ų15967.5 Ų67.578%0.78335%0.353SS*.G310 helixtrans54.422.5-176.4-67.4-105.5-71.500113.6F42 P43F42-M45 PolarHBondContact O-N 2.99Å; P43-M45 PolarHBondContact O-N 2.9Å; P43-M45 VanDerWaalsContact O-N 3.14Å
46T58.3Low65.3Low51 Ų5165.1 Ų65.131%0.31334%0.339SS..  trans-104.7122.8178.9410000110P43 E44 H48 Y49P43-T46 PolarHBondContact O-N 3.41Å; P43-T46 PolarHBondContact O-OG1 3.48Å; E44-T46 PolarHBondContact O-N 3.48Å; T46-H48 VanDerWaalsContact C-N 3.26Å; T46-H48 PolarHBondContact O-N 3.3Å; T46-Y49 WeakPolarHBondContact OG1-CD2 3.32Å; T46-Y49 VanDerWaalsContact OG1-CE2 3.26Å; T46-Y49 WeakPolarHBondContact OG1-CE2 3.31Å
47Y57.5Low63.9Low144 Ų14473.7 Ų73.757%0.56537%0.37SS*.THydrogen-bonded Turntrans-74.4-13.3-176.753.4-94.2000113.7Y49 L50 L51Y47-Y49 VanDerWaalsContact C-N 3.35Å; Y47-Y49 PolarHBondContact O-N 3.2Å; Y47-L50 PolarHBondContact O-N 2.88Å; Y47-L51 HydrophobicContact CD2-CD1 4.02Å; Y47-L51 PolarHBondContact O-N 2.93Å
48H55.4Low62.4Low107 Ų10775.2 Ų75.250%0.49538%0.377SS..Hα-helixtrans-61.7-38.2-175.9-86-80.8000113T46 L50 L51 D52T46-H48 VanDerWaalsContact C-N 3.26Å; T46-H48 PolarHBondContact O-N 3.3Å; H48-L50 VanDerWaalsContact C-N 3.32Å; H48-L50 PolarHBondContact O-N 3.08Å; H48-L51 PolarHBondContact O-N 2.84Å; H48-D52 PolarHBondContact O-N 3.44Å
49Y54.2Low61.2Low34 Ų3471.7 Ų71.713%0.13336%0.359CS..Hα-helixtrans-72.8-22.9-178.6-57.4-70.9000114T46 Y47 W136 K163 P164T46-Y49 WeakPolarHBondContact OG1-CD2 3.32Å; T46-Y49 VanDerWaalsContact OG1-CE2 3.26Å; T46-Y49 WeakPolarHBondContact OG1-CE2 3.31Å; Y47-Y49 VanDerWaalsContact C-N 3.35Å; Y47-Y49 PolarHBondContact O-N 3.2Å; Y49-W136 HydrophobicContact CD1-CH2 4.26Å; Y49-W136 HydrophobicContact CE1-CH2 4Å; Y49-K163 WeakPolarHBondContact OH-CE 3.37Å; Y49-P164 HydrophobicContact CE1-CG 4.46Å; Y49-P164 HydrophobicContact CE2-CG 4.29Å
50L53.5Low60.1Low70 Ų7072.8 Ų72.837%0.36637%0.368SS..Hα-helixtrans-76.7-33.6175.1-109.8155.5000112.1L41 F42 Y47 H48 V55L41-L50 WeakPolarHBondContact O-CD1 3.08Å; F42-L50 HydrophobicContact CD1-CD1 3.35Å; F42-L50 HydrophobicContact CE1-CD1 3.17Å; F42-L50 HydrophobicContact CE2-CD1 4.43Å; F42-L50 HydrophobicContact CG-CD1 4.07Å; F42-L50 HydrophobicContact CZ-CD1 3.76Å; Y47-L50 PolarHBondContact O-N 2.88Å; H48-L50 VanDerWaalsContact C-N 3.32Å; H48-L50 PolarHBondContact O-N 3.08Å; L50-V55 HydrophobicContact CG-CG2 4.32Å
51L53.2Low59.4Low133 Ų13381.5 Ų81.570%0.69640%0.401SS*.Hα-helixtrans-74-33177.4-89.9145000112.6Y47 H48 G53Y47-L51 HydrophobicContact CD2-CD1 4.02Å; Y47-L51 PolarHBondContact O-N 2.93Å; H48-L51 PolarHBondContact O-N 2.84Å; L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 2.91Å
52D55.4Low59.3Low109 Ų10980.9 Ų80.958%0.58340%0.402SS*.THydrogen-bonded Turntrans-850.3-178.9-70.3-30.9000113.8H48 H54H48-D52 PolarHBondContact O-N 3.44Å; D52-H54 VanDerWaalsContact C-N 3.27Å; D52-H54 PolarHBondContact O-CE1 3.41Å; D52-H54 PolarHBondContact O-N 3.48Å; D52-H54 PolarHBondContact O-ND1 2.91Å
53G55.4Low59.3Low65 Ų6577.9 Ų77.967%0.6739%0.39SS*.THydrogen-bonded Turntrans72.312175.800000115.6L51 V55L51-G53 VanDerWaalsContact C-N 3.32Å; L51-G53 PolarHBondContact O-N 2.91Å; G53-V55 VanDerWaalsContact C-N 3.3Å; G53-V55 PolarHBondContact O-N 3.44Å
54H55.7Low59.7Low72 Ų7276.9 Ų76.933%0.33338%0.384SS..  trans-91.347.5-176.7-69.786.3000112.3D52 L125 W136D52-H54 VanDerWaalsContact C-N 3.27Å; D52-H54 PolarHBondContact O-CE1 3.41Å; D52-H54 PolarHBondContact O-N 3.48Å; D52-H54 PolarHBondContact O-ND1 2.91Å; H54-L125 HydrophobicContact CB-CD2 3.85Å; H54-L125 WeakPolarHBondContact O-CD2 3.28Å; H54-W136 AromaticContact CD2-CD1 3.77Å; H54-W136 AromaticContact CD2-CD2 3.75Å; H54-W136 AromaticContact CD2-CG 3.46Å; H54-W136 VanDerWaalsContact CD2-CG 3.46Å; H54-W136 AromaticContact NE2-CD1 3.57Å; H54-W136 AromaticContact NE2-CG 3.73Å
55V60.1Low60.5Low29 Ų2975.7 Ų75.718%0.17638%0.379CS..SBendtrans-111.9144-178-176.20000111.2L50 G53 R57 T60L50-V55 HydrophobicContact CG-CG2 4.32Å; G53-V55 VanDerWaalsContact C-N 3.3Å; G53-V55 PolarHBondContact O-N 3.44Å; V55-R57 PolarHBondContact O-N 2.85Å; V55-T60 HydrophobicContact CB-CG2 4.22Å; V55-T60 HydrophobicContact CG1-CG2 4.01Å
56T57Low61.7Low22 Ų2276.9 Ų76.914%0.13538%0.375CS..  trans-55.9120176.6-34.80000110.5E58 A59 T60T56-E58 PolarHBondContact O-N 3.26Å; T56-E58 VanDerWaalsContact O-N 3.09Å; T56-A59 WeakPolarHBondContact O-CB 3.09Å; T56-A59 PolarHBondContact O-N 3.5Å; T56-T60 PolarHBondContact O-N 2.86Å
57R57.3Low62.8Low188 Ų18875.2 Ų75.271%0.70937%0.367SS*.Hα-helixtrans-56-31.9-175.1-157.117471.8171.95.5113.2V55 T60V55-R57 PolarHBondContact O-N 2.85Å; R57-T60 PolarHBondContact O-N 3.5Å; R57-T60 PolarHBondContact O-OG1 3.45Å
58E57.1Low64Low36 Ų3668.4 Ų68.417%0.16834%0.34CS..Hα-helixtrans-68.2-32.7177.1-54.3-55.2144.200113.1T56 V115T56-E58 PolarHBondContact O-N 3.26Å; T56-E58 VanDerWaalsContact O-N 3.09Å; E58-V115 HydrophobicContact CB-CG1 4.14Å
59A58.8Low65.4Low2 Ų263.3 Ų63.32%0.01732%0.316CS..Hα-helixtrans-76.5-32.3175.600000112L41 T56 W61 A62L41-A59 WeakPolarHBondContact CD1-O 3.18Å; T56-A59 WeakPolarHBondContact O-CB 3.09Å; T56-A59 PolarHBondContact O-N 3.5Å; A59-W61 PolarHBondContact O-N 2.89Å; A59-A62 PolarHBondContact O-N 3.36Å
60T62Low67Low78 Ų7866.2 Ų66.248%0.47933%0.33SS..Hα-helixtrans-64.3-23.5177.463.10000113.6V55 T56 R57 A62V55-T60 HydrophobicContact CB-CG2 4.22Å; V55-T60 HydrophobicContact CG1-CG2 4.01Å; T56-T60 PolarHBondContact O-N 2.86Å; R57-T60 PolarHBondContact O-N 3.5Å; R57-T60 PolarHBondContact O-OG1 3.45Å; T60-A62 PolarHBondContact O-N 3.01Å
61W64.1Low68.6Low189 Ų18965.1 Ų65.172%0.71632%0.324SS*.THydrogen-bonded Turntrans-71.6-9.6174.5-84.243.9000113.3A59 T63A59-W61 PolarHBondContact O-N 2.89Å; W61-T63 HydrophobicContact CB-CG2 3.87Å; W61-T63 PolarHBondContact O-N 3.24Å
62A72.2Confident70.2Confident27 Ų2758.9 Ų58.922%0.22329%0.291CS..  trans47.635.1173.600000113.4A59 T60 G64 L65 W66A59-A62 PolarHBondContact O-N 3.36Å; T60-A62 PolarHBondContact O-N 3.01Å; A62-G64 PolarHBondContact O-N 3.29Å; A62-L65 HydrophobicContact CB-CB 4.38Å; A62-L65 HydrophobicContact CB-CD1 4.15Å; A62-L65 WeakPolarHBondContact O-CB 3.48Å; A62-L65 PolarHBondContact O-N 2.71Å; A62-W66 PolarHBondContact O-N 2.75Å
63T72.8Confident71.8Confident18 Ų1856.3 Ų56.311%0.1128%0.278CS..Hα-helixtrans-63.6-27.4-17556.80000111.2W61 L65 A67 S68 V115W61-T63 HydrophobicContact CB-CG2 3.87Å; W61-T63 PolarHBondContact O-N 3.24Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-L65 PolarHBondContact O-N 3.14Å; T63-A67 WeakPolarHBondContact O-CA 3.34Å; T63-A67 WeakPolarHBondContact O-CB 3.42Å; T63-A67 PolarHBondContact O-N 2.89Å; T63-S68 PolarHBondContact O-N 3.49Å; T63-V115 HydrophobicContact CG2-CG1 4.42Å; T63-V115 HydrophobicContact CG2-CG2 4.22Å
64G74.7Confident73.3Confident0 Ų056.9 Ų56.90%027%0.265CS..Hα-helixtrans-65.1-32.2171.700000114.3N37 A62 S68 G69N37-G64 WeakPolarHBondContact OD1-CA 3.46Å; N37-G64 PolarHBondContact OD1-N 2.98Å; N37-G64 VanDerWaalsContact OD1-N 3.13Å; A62-G64 PolarHBondContact O-N 3.29Å; G64-S68 WeakPolarHBondContact CA-OG 3.31Å; G64-S68 PolarHBondContact O-OG 2.91Å; G64-G69 VanDerWaalsContact O-CA 3.28Å; G64-G69 WeakPolarHBondContact O-CA 3.36Å; G64-G69 PolarHBondContact O-N 3.34Å
65L81Confident74.7Confident56 Ų5653.6 Ų53.629%0.29325%0.25SS..Hα-helixtrans-81.5-48-179.8-79.5165000112.1M34 I38 A62 T63 G69 F70M34-L65 HydrophobicContact CB-CD2 4.25Å; M34-L65 HydrophobicContact CG-CD2 4.16Å; M34-L65 HydrophobicContact SD-CD2 4.45Å; I38-L65 HydrophobicContact CD1-CD2 4.11Å; I38-L65 HydrophobicContact CG1-CD1 4.3Å; I38-L65 HydrophobicContact CG1-CD2 4Å; I38-L65 HydrophobicContact CG1-CG 4.48Å; A62-L65 HydrophobicContact CB-CB 4.38Å; A62-L65 HydrophobicContact CB-CD1 4.15Å; A62-L65 WeakPolarHBondContact O-CB 3.48Å; A62-L65 PolarHBondContact O-N 2.71Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-L65 PolarHBondContact O-N 3.14Å; L65-G69 WeakPolarHBondContact O-CA 3.38Å; L65-F70 PolarHBondContact O-N 3.33Å
66W79.6Confident75.9Confident185 Ų18552.2 Ų52.270%0.70124%0.242SC*.Iπ-helixtrans-92.1-44.9-174.4-141.672.8000112.8A62 F70 L71A62-W66 PolarHBondContact O-N 2.75Å; W66-F70 WeakPolarHBondContact O-CB 3.31Å; W66-F70 PolarHBondContact O-N 2.96Å; W66-L71 HydrophobicContact CE3-CD1 4.03Å; W66-L71 HydrophobicContact CZ3-CD1 4.23Å; W66-L71 WeakPolarHBondContact O-CD1 3.38Å; W66-L71 PolarHBondContact O-N 3.42Å; W66-L71 VanDerWaalsContact O-N 3.12Å
67A81.8Confident77.3Confident16 Ų1655.3 Ų55.313%0.13226%0.258CS..Iπ-helixtrans-79-77.9-177.300000112.3T63 G69 L71 A108T63-A67 WeakPolarHBondContact O-CA 3.34Å; T63-A67 WeakPolarHBondContact O-CB 3.42Å; T63-A67 PolarHBondContact O-N 2.89Å; A67-G69 PolarHBondContact O-N 3.47Å; A67-G69 VanDerWaalsContact O-N 3.14Å; A67-L71 VanDerWaalsContact O-CB 3.27Å; A67-L71 WeakPolarHBondContact O-CB 3.25Å; A67-L71 PolarHBondContact O-N 2.89Å; A67-A108 HydrophobicContact CB-CB 4.09Å
68S82Confident78.6Confident0 Ų047.5 Ų47.50%023%0.233CC..Iπ-helixtrans-69.8-12.7179.461.20000113.3T63 G64 V72 C112T63-S68 PolarHBondContact O-N 3.49Å; G64-S68 WeakPolarHBondContact CA-OG 3.31Å; G64-S68 PolarHBondContact O-OG 2.91Å; S68-V72 WeakPolarHBondContact O-CB 3.3Å; S68-C112 PolarHBondContact OG-SG 2.91Å
69G86.5Confident79.8Confident0 Ų045.8 Ų45.80%023%0.225CC..Iπ-helixtrans-84.7-89.5177.600000111.5M34 G64 L65 A67 L73M34-G69 VanDerWaalsContact CE-C 3.47Å; M34-G69 VanDerWaalsContact CE-CA 3.48Å; G64-G69 VanDerWaalsContact O-CA 3.28Å; G64-G69 WeakPolarHBondContact O-CA 3.36Å; G64-G69 PolarHBondContact O-N 3.34Å; L65-G69 WeakPolarHBondContact O-CA 3.38Å; A67-G69 PolarHBondContact O-N 3.47Å; A67-G69 VanDerWaalsContact O-N 3.14Å; G69-L73 VanDerWaalsContact O-CB 3.28Å; G69-L73 WeakPolarHBondContact O-CB 3.42Å; G69-L73 PolarHBondContact O-N 2.94Å
70F86.3Confident81Confident96 Ų9648.2 Ų48.242%0.42124%0.237SC..Iπ-helixtrans-61.9-48.1-173.7-177.7-104.2000113.8L65 W66 V72 L73 L74L65-F70 PolarHBondContact O-N 3.33Å; W66-F70 WeakPolarHBondContact O-CB 3.31Å; W66-F70 PolarHBondContact O-N 2.96Å; F70-V72 PolarHBondContact O-N 2.87Å; F70-L73 PolarHBondContact O-N 3.3Å; F70-L74 HydrophobicContact CD1-CD1 4.01Å; F70-L74 HydrophobicContact CE1-CD1 3.53Å; F70-L74 HydrophobicContact CE1-CG 4.27Å; F70-L74 HydrophobicContact CZ-CD1 3.88Å; F70-L74 HydrophobicContact CZ-CD2 4.39Å; F70-L74 HydrophobicContact CZ-CG 4.28Å; F70-L74 WeakPolarHBondContact O-CG 3.49Å; F70-L74 PolarHBondContact O-N 3.18Å
71L86.7Confident81.9Confident46 Ų4652.1 Ų52.124%0.24125%0.248CC..Iπ-helixtrans-64-41.5-178.5-89.9133.8000112.7W66 A67 L74 G75 L104 A108W66-L71 HydrophobicContact CE3-CD1 4.03Å; W66-L71 HydrophobicContact CZ3-CD1 4.23Å; W66-L71 WeakPolarHBondContact O-CD1 3.38Å; W66-L71 PolarHBondContact O-N 3.42Å; W66-L71 VanDerWaalsContact O-N 3.12Å; A67-L71 VanDerWaalsContact O-CB 3.27Å; A67-L71 WeakPolarHBondContact O-CB 3.25Å; A67-L71 PolarHBondContact O-N 2.89Å; L71-L74 PolarHBondContact O-N 3.25Å; L71-G75 PolarHBondContact O-N 3.07Å; L71-L104 HydrophobicContact CD2-CB 4.33Å; L71-A108 HydrophobicContact CB-CB 3.98Å
72V87.2Confident82.4Confident2 Ų245.7 Ų45.71%0.01222%0.223CC..Hα-helixtrans-71.2-34.91771790000111.3L26 V30 S68 F70 L74 G75 A76 A108 Q185L26-V72 HydrophobicContact CD2-CG1 3.96Å; V30-V72 HydrophobicContact CG2-CB 3.9Å; V30-V72 HydrophobicContact CG2-CG1 3.67Å; S68-V72 WeakPolarHBondContact O-CB 3.3Å; F70-V72 PolarHBondContact O-N 2.87Å; V72-L74 PolarHBondContact O-N 3.19Å; V72-G75 WeakPolarHBondContact O-CA 3.19Å; V72-G75 PolarHBondContact O-N 3.49Å; V72-A76 PolarHBondContact O-N 3.45Å; V72-A108 HydrophobicContact CG2-CB 4.48Å; V72-Q185 HydrophobicContact CG1-CG 4.24Å
73L89.4Confident82.4Confident56 Ų5644.9 Ų44.929%0.29322%0.216SC..Hα-helixtrans-63.4-39.8174.9-170.164.7000112.3V30 G69 F70 G75 A76 N77V30-L73 HydrophobicContact CG1-CB 4.21Å; V30-L73 HydrophobicContact CG1-CD1 4.35Å; G69-L73 VanDerWaalsContact O-CB 3.28Å; G69-L73 WeakPolarHBondContact O-CB 3.42Å; G69-L73 PolarHBondContact O-N 2.94Å; F70-L73 PolarHBondContact O-N 3.3Å; L73-G75 VanDerWaalsContact C-N 3.31Å; L73-G75 PolarHBondContact O-N 3.43Å; L73-A76 PolarHBondContact O-N 3.37Å; L73-N77 PolarHBondContact O-N 2.91Å
74L87.2Confident82.3Confident76 Ų7654.5 Ų54.540%0.39825%0.25SS..Hα-helixtrans-59.9-43.4172.3-72.1176.4000111.3F70 L71 V72 N77 A78F70-L74 HydrophobicContact CD1-CD1 4.01Å; F70-L74 HydrophobicContact CE1-CD1 3.53Å; F70-L74 HydrophobicContact CE1-CG 4.27Å; F70-L74 HydrophobicContact CZ-CD1 3.88Å; F70-L74 HydrophobicContact CZ-CD2 4.39Å; F70-L74 HydrophobicContact CZ-CG 4.28Å; F70-L74 WeakPolarHBondContact O-CG 3.49Å; F70-L74 PolarHBondContact O-N 3.18Å; L71-L74 PolarHBondContact O-N 3.25Å; V72-L74 PolarHBondContact O-N 3.19Å; L74-N77 PolarHBondContact O-N 2.87Å; L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.36Å
75G84.7Confident81.9Confident3 Ų358.4 Ų58.43%0.03128%0.275CS..Hα-helixtrans-60.7-46.3173.500000112.9L71 V72 L73 N77 A78 F79L71-G75 PolarHBondContact O-N 3.07Å; V72-G75 WeakPolarHBondContact O-CA 3.19Å; V72-G75 PolarHBondContact O-N 3.49Å; L73-G75 VanDerWaalsContact C-N 3.31Å; L73-G75 PolarHBondContact O-N 3.43Å; G75-N77 PolarHBondContact O-N 2.84Å; G75-A78 WeakPolarHBondContact O-CB 3.21Å; G75-A78 PolarHBondContact O-N 3.19Å; G75-A78 VanDerWaalsContact O-N 3.16Å; G75-F79 WeakPolarHBondContact O-CD2 3.34Å; G75-F79 VanDerWaalsContact O-CG 3.23Å; G75-F79 WeakPolarHBondContact O-CG 3.48Å; G75-F79 PolarHBondContact O-N 3.29Å
76A86.4Confident80.3Confident0 Ų067.8 Ų67.80%031%0.306CS..Hα-helixtrans-59.7-44.6177.400000112.2L26 V27 V72 L73 A78 F79 I80L26-A76 HydrophobicContact CB-CB 3.94Å; L26-A76 HydrophobicContact CD1-CB 4.32Å; V27-A76 HydrophobicContact CG2-CB 4.5Å; V72-A76 PolarHBondContact O-N 3.45Å; L73-A76 PolarHBondContact O-N 3.37Å; A76-A78 VanDerWaalsContact C-N 3.34Å; A76-A78 PolarHBondContact O-N 2.88Å; A76-F79 WeakPolarHBondContact O-CB 3.23Å; A76-F79 PolarHBondContact O-N 3.3Å; A76-I80 WeakPolarHBondContact O-CG1 3.23Å; A76-I80 PolarHBondContact O-N 3.41Å
77N85.5Confident78.9Confident87 Ų8761.7 Ų61.747%0.46530%0.301SS..Hα-helixtrans-63.2-39.5174.9-82.4-29.5000112.2L73 L74 G75 F79 I80 K81L73-N77 PolarHBondContact O-N 2.91Å; L74-N77 PolarHBondContact O-N 2.87Å; G75-N77 PolarHBondContact O-N 2.84Å; N77-F79 VanDerWaalsContact C-N 3.33Å; N77-F79 PolarHBondContact O-N 3.49Å; N77-I80 PolarHBondContact O-N 2.93Å; N77-K81 VanDerWaalsContact O-CB 3.26Å; N77-K81 WeakPolarHBondContact O-CB 3.4Å; N77-K81 PolarHBondContact O-N 3.29Å
78A83.8Confident77.1Confident24 Ų2469.6 Ų69.620%0.19833%0.332CS..Hα-helixtrans-61.3-41.5173.500000111.3L74 G75 A76 R82 Y101L74-A78 WeakPolarHBondContact O-CB 3.49Å; L74-A78 PolarHBondContact O-N 3.36Å; G75-A78 WeakPolarHBondContact O-CB 3.21Å; G75-A78 PolarHBondContact O-N 3.19Å; G75-A78 VanDerWaalsContact O-N 3.16Å; A76-A78 VanDerWaalsContact C-N 3.34Å; A76-A78 PolarHBondContact O-N 2.88Å; A78-R82 WeakPolarHBondContact O-CB 3.49Å; A78-R82 PolarHBondContact O-N 3.48Å; A78-Y101 HydrophobicContact CB-CD2 4Å; A78-Y101 HydrophobicContact CB-CE2 4.43Å; A78-Y101 HydrophobicContact CB-CG 4.26Å
79F82.7Confident75.6Confident1 Ų175.9 Ų75.90%0.00437%0.365CS..Hα-helixtrans-63.9-46.5176.2-58.4-37.3000112.7L19 L26 G75 A76 N77 R82 S83 L98 S102 N192L19-F79 HydrophobicContact CD2-CD1 4.09Å; L26-F79 HydrophobicContact CD1-CD2 3.7Å; L26-F79 HydrophobicContact CD1-CE2 3.65Å; G75-F79 WeakPolarHBondContact O-CD2 3.34Å; G75-F79 VanDerWaalsContact O-CG 3.23Å; G75-F79 WeakPolarHBondContact O-CG 3.48Å; G75-F79 PolarHBondContact O-N 3.29Å; A76-F79 WeakPolarHBondContact O-CB 3.23Å; A76-F79 PolarHBondContact O-N 3.3Å; N77-F79 VanDerWaalsContact C-N 3.33Å; N77-F79 PolarHBondContact O-N 3.49Å; F79-R82 PolarHBondContact O-N 3.34Å; F79-S83 PolarHBondContact O-N 2.89Å; F79-L98 HydrophobicContact CD1-CD1 3.48Å; F79-L98 VanDerWaalsContact CD1-CD1 3.48Å; F79-L98 HydrophobicContact CD1-CG 4.22Å; F79-L98 HydrophobicContact CE1-CD1 3.72Å; F79-L98 HydrophobicContact CE1-CG 4.09Å; F79-S102 WeakPolarHBondContact CE1-OG 3.45Å; F79-S102 VanDerWaalsContact CZ-OG 3.31Å; F79-S102 WeakPolarHBondContact CZ-OG 3.33Å; F79-N192 WeakPolarHBondContact CE2-ND2 3.28Å; F79-N192 HydrophobicContact CZ-CB 4.38Å; F79-N192 VanDerWaalsContact CZ-ND2 3.32Å; F79-N192 WeakPolarHBondContact CZ-ND2 3.44Å
80I83.6Confident74Confident52 Ų5278 Ų7827%0.26738%0.382SS..Hα-helixtrans-66.3-45.8180-64.9167.6000111L20 A76 N77 R82 S83 R84L20-I80 HydrophobicContact CD1-CG2 4.3Å; A76-I80 WeakPolarHBondContact O-CG1 3.23Å; A76-I80 PolarHBondContact O-N 3.41Å; N77-I80 PolarHBondContact O-N 2.93Å; I80-R82 PolarHBondContact O-N 3.34Å; I80-S83 PolarHBondContact O-N 2.93Å; I80-S83 PolarHBondContact O-OG 3.23Å; I80-R84 PolarHBondContact O-N 2.97Å
81K81.6Confident72.8Confident161 Ų16175.7 Ų75.770%0.738%0.378SS*.Hα-helixtrans-60.5-37176.8-170.8174.5-177.6177.90110.9N77 T85N77-K81 VanDerWaalsContact O-CB 3.26Å; N77-K81 WeakPolarHBondContact O-CB 3.4Å; N77-K81 PolarHBondContact O-N 3.29Å; K81-T85 PolarHBondContact O-N 2.95Å; K81-T85 PolarHBondContact O-OG1 3.02Å
82R74.3Confident71.8Confident53 Ų5379.5 Ų79.520%0.239%0.389CS..Hα-helixtrans-68.4-41.5177.5-165.964.6176.2167.60.5112.6L19 A78 F79 I80 R84 T85 Q94 L98L19-R82 HydrophobicContact CD1-CG 4.43Å; A78-R82 WeakPolarHBondContact O-CB 3.49Å; A78-R82 PolarHBondContact O-N 3.48Å; F79-R82 PolarHBondContact O-N 3.34Å; I80-R82 PolarHBondContact O-N 3.34Å; R82-R84 VanDerWaalsContact C-N 3.25Å; R82-R84 PolarHBondContact O-N 3.4Å; R82-T85 PolarHBondContact O-N 3.26Å; R82-Q94 VanDerWaalsContact CZ-OE1 3.25Å; R82-L98 HydrophobicContact CB-CD1 4.44Å; R82-L98 HydrophobicContact CG-CD1 4.44Å
83S73.1Confident70.9Confident11 Ų1184.8 Ų84.88%0.07742%0.422CS..Hα-helixtrans-63.2-33.5179.477.10000112.5S16 F79 I80S16-S83 VanDerWaalsContact O-CB 3.25Å; S16-S83 WeakPolarHBondContact O-CB 3.38Å; S16-S83 PolarHBondContact OG-O 2.95Å; F79-S83 PolarHBondContact O-N 2.89Å; I80-S83 PolarHBondContact O-N 2.93Å; I80-S83 PolarHBondContact O-OG 3.23Å
84R70.2Confident70Confident219 Ų21986.2 Ų86.283%0.82643%0.427SS*.Hα-helixtrans-79.7-21.3-177.9-160.2169.7-173.7162.91.2114I80 R82 R86I80-R84 PolarHBondContact O-N 2.97Å; R82-R84 VanDerWaalsContact C-N 3.25Å; R82-R84 PolarHBondContact O-N 3.4Å; R84-R86 PolarHBondContact O-N 3.48Å; R84-R86 VanDerWaalsContact O-N 3.09Å
85T65.4Low69.4Low83 Ų8385.1 Ų85.151%0.50942%0.42SS..  trans-81.391.4-178.5-48.80000110K81 R82 G87K81-T85 PolarHBondContact O-N 2.95Å; K81-T85 PolarHBondContact O-OG1 3.02Å; R82-T85 PolarHBondContact O-N 3.26Å; T85-G87 PolarHBondContact O-N 2.87Å; T85-G87 VanDerWaalsContact O-N 3.14Å
86R48.5Very low69Low252 Ų25290.1 Ų90.195%0.95144%0.441SS*.  trans-77.224.3179.2-80.5-173.1-176.51673.6115R84R84-R86 PolarHBondContact O-N 3.48Å; R84-R86 VanDerWaalsContact O-N 3.09Å
87G49.3Very low68.8Low57 Ų5791.2 Ų91.259%0.58845%0.453SS*.  trans-88.6130.4-174.600000113.8T85T85-G87 PolarHBondContact O-N 2.87Å; T85-G87 VanDerWaalsContact O-N 3.14Å
88F45.3Very low68.6Low182 Ų18287.7 Ų87.780%0.79843%0.434SS*.SBendtrans-60.1134.3178.7-158.5-107.1000110.7
89I49.7Very low68.8Low133 Ų13387.1 Ų87.168%0.68243%0.429SS*.  trans77.188.6-174.6-48.6164.3000113S91I89-S91 VanDerWaalsContact C-N 3.31Å; I89-S91 PolarHBondContact O-N 3.47Å
90A53Low69Low44 Ų4492.5 Ų92.536%0.36446%0.457SS..  trans-60.710015300000107.4M95A90-M95 HydrophobicContact CB-CE 4.06Å; A90-M95 HydrophobicContact CB-CG 4.1Å; A90-M95 HydrophobicContact CB-SD 4.19Å
91S61.3Low69.3Low48 Ų4895.5 Ų95.534%0.33647%0.466SS..  trans-57.9143.9171.463.90000108.1I89 T93 Q94 M95I89-S91 VanDerWaalsContact C-N 3.31Å; I89-S91 PolarHBondContact O-N 3.47Å; S91-T93 PolarHBondContact O-N 3.45Å; S91-Q94 WeakPolarHBondContact O-CB 3.5Å; S91-Q94 PolarHBondContact O-N 2.93Å; S91-Q94 WeakPolarHBondContact OG-CG 3.22Å; S91-M95 PolarHBondContact O-N 3.49Å
92R65.3Low69.6Low126 Ų12687.8 Ų87.848%0.47543%0.433SS..Hα-helixtrans-49.4-39.7-177.8-70-163-176.6-169.81.2111.6Q94 M95 F96R92-Q94 PolarHBondContact O-N 2.91Å; R92-M95 PolarHBondContact O-N 3.3Å; R92-M95 VanDerWaalsContact O-N 3.1Å; R92-F96 HydrophobicContact CB-CD2 4.32Å; R92-F96 HydrophobicContact CB-CE2 4.41Å; R92-F96 VanDerWaalsContact O-CD2 3.23Å; R92-F96 WeakPolarHBondContact O-CD2 3.26Å; R92-F96 PolarHBondContact O-N 2.85Å
93T68.8Low70.5Confident113 Ų11387.8 Ų87.869%0.69344%0.44SS*.Hα-helixtrans-52.7-38.5176.4-340000113.1S91 G97S91-T93 PolarHBondContact O-N 3.45Å; T93-G97 PolarHBondContact O-N 2.91Å
94Q70.4Confident71.3Confident85 Ų8591.3 Ų91.340%0.39746%0.458SS..Hα-helixtrans-76.2-33-180-66.6172.3-16.200113R82 S91 R92 L98R82-Q94 VanDerWaalsContact CZ-OE1 3.25Å; S91-Q94 WeakPolarHBondContact O-CB 3.5Å; S91-Q94 PolarHBondContact O-N 2.93Å; S91-Q94 WeakPolarHBondContact OG-CG 3.22Å; R92-Q94 PolarHBondContact O-N 2.91Å; Q94-L98 PolarHBondContact O-N 3.16Å
95M73.7Confident72.3Confident53 Ų5381 Ų8126%0.26142%0.419SS..Hα-helixtrans-71.6-38.5172.8-66.6-59.9-140.100111.2A90 S91 R92 L98 A99 L200A90-M95 HydrophobicContact CB-CE 4.06Å; A90-M95 HydrophobicContact CB-CG 4.1Å; A90-M95 HydrophobicContact CB-SD 4.19Å; S91-M95 PolarHBondContact O-N 3.49Å; R92-M95 PolarHBondContact O-N 3.3Å; R92-M95 VanDerWaalsContact O-N 3.1Å; M95-L98 PolarHBondContact O-N 3.17Å; M95-A99 PolarHBondContact O-N 3.44Å; M95-L200 HydrophobicContact CB-CD2 3.82Å; M95-L200 HydrophobicContact CB-CG 4.26Å
96F77.6Confident73.6Confident109 Ų10979.7 Ų79.748%0.47841%0.409SS..Hα-helixtrans-60.9-44.9171.6-85.8-71.7000111.9R92 L98 A99 L100 L200R92-F96 HydrophobicContact CB-CD2 4.32Å; R92-F96 HydrophobicContact CB-CE2 4.41Å; R92-F96 VanDerWaalsContact O-CD2 3.23Å; R92-F96 WeakPolarHBondContact O-CD2 3.26Å; R92-F96 PolarHBondContact O-N 2.85Å; F96-L98 VanDerWaalsContact C-N 3.32Å; F96-L98 PolarHBondContact O-N 3.23Å; F96-A99 PolarHBondContact O-N 2.96Å; F96-L100 WeakPolarHBondContact O-CG 3.5Å; F96-L100 PolarHBondContact O-N 3.47Å; F96-L200 HydrophobicContact CD1-CD1 4.2Å; F96-L200 HydrophobicContact CD2-CD2 3.81Å; F96-L200 HydrophobicContact CE1-CD1 3.99Å; F96-L200 HydrophobicContact CE1-CD2 4.46Å; F96-L200 HydrophobicContact CE2-CD2 3.63Å; F96-L200 HydrophobicContact CG-CD2 4.28Å; F96-L200 HydrophobicContact CZ-CD1 4.2Å; F96-L200 HydrophobicContact CZ-CD2 3.99Å
97G81.4Confident75.7Confident23 Ų2373.5 Ų73.524%0.23739%0.394CS..Hα-helixtrans-57.3-43.9175.100000112.6T93 A99 L100 Y101T93-G97 PolarHBondContact O-N 2.91Å; G97-A99 PolarHBondContact O-N 3.49Å; G97-L100 PolarHBondContact O-N 2.98Å; G97-Y101 WeakPolarHBondContact O-CD2 3.37Å; G97-Y101 PolarHBondContact O-N 2.83Å
98L82.4Confident77.7Confident12 Ų1271.2 Ų71.26%0.06337%0.369CS..Hα-helixtrans-62.5-41.9177.5-160.669.7000112.6L19 F79 R82 Q94 M95 F96 S102L19-L98 HydrophobicContact CD1-CD2 4.13Å; L19-L98 HydrophobicContact CD2-CD2 4.26Å; F79-L98 HydrophobicContact CD1-CD1 3.48Å; F79-L98 VanDerWaalsContact CD1-CD1 3.48Å; F79-L98 HydrophobicContact CD1-CG 4.22Å; F79-L98 HydrophobicContact CE1-CD1 3.72Å; F79-L98 HydrophobicContact CE1-CG 4.09Å; R82-L98 HydrophobicContact CB-CD1 4.44Å; R82-L98 HydrophobicContact CG-CD1 4.44Å; Q94-L98 PolarHBondContact O-N 3.16Å; M95-L98 PolarHBondContact O-N 3.17Å; F96-L98 VanDerWaalsContact C-N 3.32Å; F96-L98 PolarHBondContact O-N 3.23Å; L98-S102 WeakPolarHBondContact O-CB 3.45Å; L98-S102 PolarHBondContact O-N 3.35Å; L98-S102 PolarHBondContact O-OG 3.38Å
99A86.2Confident79.9Confident13 Ų1362.5 Ų62.511%0.10733%0.331CS..Hα-helixtrans-63.3-44.1175.500000111.1M95 F96 G97 S102 C103M95-A99 PolarHBondContact O-N 3.44Å; F96-A99 PolarHBondContact O-N 2.96Å; G97-A99 PolarHBondContact O-N 3.49Å; A99-S102 PolarHBondContact O-N 3.17Å; A99-C103 PolarHBondContact O-N 3.01Å; A99-C103 PolarHBondContact O-SG 3.01Å; A99-C103 VanDerWaalsContact O-SG 3.36Å
100L88.5Confident81.9Confident114 Ų11458 Ų5860%0.59731%0.313SS*.Hα-helixtrans-61.2-48.4177.4-71.1173000112.1F96 G97 S102 C103 L104F96-L100 WeakPolarHBondContact O-CG 3.5Å; F96-L100 PolarHBondContact O-N 3.47Å; G97-L100 PolarHBondContact O-N 2.98Å; L100-S102 VanDerWaalsContact C-N 3.27Å; L100-S102 PolarHBondContact O-N 3.3Å; L100-C103 PolarHBondContact O-N 3.09Å; L100-L104 WeakPolarHBondContact O-CG 3.24Å; L100-L104 PolarHBondContact O-N 3.01Å
101Y88.7Confident83.7Confident114 Ų11457.6 Ų57.645%0.44731%0.31SS..Hα-helixtrans-61.8-35.6175.7-75.3-65.4000112.4A78 G97 G105A78-Y101 HydrophobicContact CB-CD2 4Å; A78-Y101 HydrophobicContact CB-CE2 4.43Å; A78-Y101 HydrophobicContact CB-CG 4.26Å; G97-Y101 WeakPolarHBondContact O-CD2 3.37Å; G97-Y101 PolarHBondContact O-N 2.83Å; Y101-G105 PolarHBondContact O-N 3.45Å
102S89.4Confident85Confident0 Ų055.3 Ų55.30%029%0.294CS..Hα-helixtrans-69.4-39.2176.5-54.10000112F79 L98 A99 L100 G105 L106F79-S102 WeakPolarHBondContact CE1-OG 3.45Å; F79-S102 VanDerWaalsContact CZ-OG 3.31Å; F79-S102 WeakPolarHBondContact CZ-OG 3.33Å; L98-S102 WeakPolarHBondContact O-CB 3.45Å; L98-S102 PolarHBondContact O-N 3.35Å; L98-S102 PolarHBondContact O-OG 3.38Å; A99-S102 PolarHBondContact O-N 3.17Å; L100-S102 VanDerWaalsContact C-N 3.27Å; L100-S102 PolarHBondContact O-N 3.3Å; S102-G105 PolarHBondContact O-N 3.4Å; S102-L106 WeakPolarHBondContact O-CB 3.46Å; S102-L106 PolarHBondContact O-N 2.79Å
103C91.3Very high86.2Confident52 Ų5251.2 Ų51.235%0.35128%0.284SS..Hα-helixtrans-65.1-44.6173.4-71.70000111.8A99 L100 G105 L106 L107A99-C103 PolarHBondContact O-N 3.01Å; A99-C103 PolarHBondContact O-SG 3.01Å; A99-C103 VanDerWaalsContact O-SG 3.36Å; L100-C103 PolarHBondContact O-N 3.09Å; C103-G105 VanDerWaalsContact C-N 3.34Å; C103-G105 PolarHBondContact O-N 3.47Å; C103-L106 PolarHBondContact O-N 3.49Å; C103-L107 WeakPolarHBondContact O-CG 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å
104L91.6Very high87.1Confident86 Ų8651.8 Ų51.845%0.4528%0.281SS..Hα-helixtrans-61.1-44.2175-71.6173.1000111.3L71 L100 L106 L107 A108L71-L104 HydrophobicContact CD2-CB 4.33Å; L100-L104 WeakPolarHBondContact O-CG 3.24Å; L100-L104 PolarHBondContact O-N 3.01Å; L104-L106 PolarHBondContact O-N 3.25Å; L104-L107 PolarHBondContact O-N 3.12Å; L104-A108 VanDerWaalsContact O-CB 3.23Å; L104-A108 WeakPolarHBondContact O-CB 3.37Å; L104-A108 PolarHBondContact O-N 3.35Å
105G90.6Very high87.9Confident1 Ų148.9 Ų48.91%0.0127%0.269CS..Hα-helixtrans-61.2-41.6174.600000112.6Y101 S102 C103 A108 A109Y101-G105 PolarHBondContact O-N 3.45Å; S102-G105 PolarHBondContact O-N 3.4Å; C103-G105 VanDerWaalsContact C-N 3.34Å; C103-G105 PolarHBondContact O-N 3.47Å; G105-A108 PolarHBondContact O-N 2.91Å; G105-A109 WeakPolarHBondContact O-CB 3.29Å; G105-A109 PolarHBondContact O-N 3.4Å
106L93.2Very high88.5Confident57 Ų5746.4 Ų46.430%0.29826%0.257SS..Hα-helixtrans-63-47.7176.1179.565.8000111.8S102 C103 L104 A109 A110 A186 C189 I193S102-L106 WeakPolarHBondContact O-CB 3.46Å; S102-L106 PolarHBondContact O-N 2.79Å; C103-L106 PolarHBondContact O-N 3.49Å; L104-L106 PolarHBondContact O-N 3.25Å; L106-A109 PolarHBondContact O-N 2.93Å; L106-A110 WeakPolarHBondContact O-CB 3.34Å; L106-A110 PolarHBondContact O-N 2.96Å; L106-A186 HydrophobicContact CD1-CB 3.78Å; L106-A186 VanDerWaalsContact CD1-O 3.29Å; L106-A186 WeakPolarHBondContact CD1-O 3.34Å; L106-C189 HydrophobicContact CB-CB 4.1Å; L106-I193 HydrophobicContact CB-CD1 4.26Å; L106-I193 HydrophobicContact CD2-CD1 3.72Å
107L92.9Very high88.9Confident122 Ų12243.4 Ų43.464%0.63925%0.252SS*.Hα-helixtrans-62.8-43.4178.1-70.9172.3000111.3C103 L104 A110 A111C103-L107 WeakPolarHBondContact O-CG 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å; L104-L107 PolarHBondContact O-N 3.12Å; L107-A110 PolarHBondContact O-N 2.85Å; L107-A111 VanDerWaalsContact O-CB 3.32Å; L107-A111 WeakPolarHBondContact O-CB 3.35Å; L107-A111 PolarHBondContact O-N 3.28Å
108A90.1Very high89Confident8 Ų844.8 Ų44.87%0.06626%0.256CS..Hα-helixtrans-64.8-44178.200000112.2A67 L71 V72 L104 G105 A111 C112A67-A108 HydrophobicContact CB-CB 4.09Å; L71-A108 HydrophobicContact CB-CB 3.98Å; V72-A108 HydrophobicContact CG2-CB 4.48Å; L104-A108 VanDerWaalsContact O-CB 3.23Å; L104-A108 WeakPolarHBondContact O-CB 3.37Å; L104-A108 PolarHBondContact O-N 3.35Å; G105-A108 PolarHBondContact O-N 2.91Å; A108-A111 PolarHBondContact O-N 2.8Å; A108-C112 PolarHBondContact O-N 3.24Å
109A91.9Very high88.9Confident0 Ų044.3 Ų44.30%025%0.253CS..Hα-helixtrans-66.7-42.1176.900000111.8G105 L106 C112 C113 Q185 A186G105-A109 WeakPolarHBondContact O-CB 3.29Å; G105-A109 PolarHBondContact O-N 3.4Å; L106-A109 PolarHBondContact O-N 2.93Å; A109-C112 PolarHBondContact O-N 3.04Å; A109-C113 WeakPolarHBondContact O-CB 3.47Å; A109-C113 PolarHBondContact O-N 3.46Å; A109-Q185 HydrophobicContact CB-CB 3.96Å; A109-A186 HydrophobicContact CB-CB 4.02Å
110A91.7Very high88.6Confident37 Ų3745.2 Ų45.231%0.30626%0.257SS..Hα-helixtrans-63.2-42.9175.600000111.9L106 L107 C113 M114L106-A110 WeakPolarHBondContact O-CB 3.34Å; L106-A110 PolarHBondContact O-N 2.96Å; L107-A110 PolarHBondContact O-N 2.85Å; A110-C113 PolarHBondContact O-N 3.26Å; A110-M114 WeakPolarHBondContact O-CG 3.27Å; A110-M114 PolarHBondContact O-N 2.74Å
111A90.1Very high88.1Confident37 Ų3743.5 Ų43.531%0.30625%0.251SS..Hα-helixtrans-60.7-45.317500000111.7L107 A108 C113 M114 V115L107-A111 VanDerWaalsContact O-CB 3.32Å; L107-A111 WeakPolarHBondContact O-CB 3.35Å; L107-A111 PolarHBondContact O-N 3.28Å; A108-A111 PolarHBondContact O-N 2.8Å; A111-C113 PolarHBondContact O-N 2.95Å; A111-M114 PolarHBondContact O-N 2.83Å; A111-V115 WeakPolarHBondContact O-CG2 3.29Å; A111-V115 PolarHBondContact O-N 3.27Å
112C88.4Confident87.5Confident0 Ų041.2 Ų41.20%024%0.244CC..Hα-helixtrans-62.6-41.7175.9-175.10000112.1S68 A108 A109 V115 S116S68-C112 PolarHBondContact OG-SG 2.91Å; A108-C112 PolarHBondContact O-N 3.24Å; A109-C112 PolarHBondContact O-N 3.04Å; C112-V115 PolarHBondContact O-N 3.45Å; C112-S116 VanDerWaalsContact O-CB 3.28Å; C112-S116 WeakPolarHBondContact O-CB 3.28Å; C112-S116 PolarHBondContact O-N 3.39Å; C112-S116 PolarHBondContact O-OG 2.95Å
113C90.2Very high86.7Confident39 Ų3941.2 Ų41.226%0.26424%0.244SC..Hα-helixtrans-62-45.5176.8-174.30000111.5A109 A110 A111 S116 A117 S182A109-C113 WeakPolarHBondContact O-CB 3.47Å; A109-C113 PolarHBondContact O-N 3.46Å; A110-C113 PolarHBondContact O-N 3.26Å; A111-C113 PolarHBondContact O-N 2.95Å; C113-S116 PolarHBondContact O-N 2.91Å; C113-A117 VanDerWaalsContact O-CB 3.31Å; C113-A117 WeakPolarHBondContact O-CB 3.24Å; C113-A117 PolarHBondContact O-N 3.5Å; C113-S182 WeakPolarHBondContact CA-OG 3.34Å; C113-S182 WeakPolarHBondContact CB-OG 3.24Å; C113-S182 PolarHBondContact N-OG 3.37Å
114M88.8Confident86Confident125 Ų12538.9 Ų38.962%0.61623%0.228SC*.Hα-helixtrans-61-48.3176-72.9-171.8-63.300111.7A110 A111 S116 A117 T118A110-M114 WeakPolarHBondContact O-CG 3.27Å; A110-M114 PolarHBondContact O-N 2.74Å; A111-M114 PolarHBondContact O-N 2.83Å; M114-S116 VanDerWaalsContact C-N 3.32Å; M114-S116 PolarHBondContact O-N 2.69Å; M114-A117 PolarHBondContact O-N 2.89Å; M114-T118 WeakPolarHBondContact O-CG2 3.26Å; M114-T118 PolarHBondContact O-N 2.9Å; M114-T118 PolarHBondContact O-OG1 2.89Å
115V86.8Confident85.1Confident25 Ų2536.8 Ų36.815%0.15222%0.218CC..Hα-helixtrans-64.5-37.3179173.50000111.8E58 T63 A111 C112 T118 G119E58-V115 HydrophobicContact CB-CG1 4.14Å; T63-V115 HydrophobicContact CG2-CG1 4.42Å; T63-V115 HydrophobicContact CG2-CG2 4.22Å; A111-V115 WeakPolarHBondContact O-CG2 3.29Å; A111-V115 PolarHBondContact O-N 3.27Å; C112-V115 PolarHBondContact O-N 3.45Å; V115-T118 VanDerWaalsContact CA-OG1 3.31Å; V115-T118 WeakPolarHBondContact CA-OG1 3.5Å; V115-T118 PolarHBondContact O-N 3.46Å; V115-T118 PolarHBondContact O-OG1 3.17Å; V115-G119 PolarHBondContact O-N 3.34Å
116S87Confident84.5Confident1 Ų136.8 Ų36.81%0.00722%0.217CC..Hα-helixtrans-67.5-42.1176.4-570000111.2C112 C113 M114 G119 L120C112-S116 VanDerWaalsContact O-CB 3.28Å; C112-S116 WeakPolarHBondContact O-CB 3.28Å; C112-S116 PolarHBondContact O-N 3.39Å; C112-S116 PolarHBondContact O-OG 2.95Å; C113-S116 PolarHBondContact O-N 2.91Å; M114-S116 VanDerWaalsContact C-N 3.32Å; M114-S116 PolarHBondContact O-N 2.69Å; S116-G119 PolarHBondContact O-N 3.14Å; S116-L120 WeakPolarHBondContact O-CB 3.49Å; S116-L120 PolarHBondContact O-N 3.01Å
117A86.1Confident83.7Confident45 Ų4535.5 Ų35.537%0.37221%0.21SC..Hα-helixtrans-66.4-40.7176.100000112C113 M114 L120 V121C113-A117 VanDerWaalsContact O-CB 3.31Å; C113-A117 WeakPolarHBondContact O-CB 3.24Å; C113-A117 PolarHBondContact O-N 3.5Å; M114-A117 PolarHBondContact O-N 2.89Å; A117-L120 WeakPolarHBondContact O-CB 3.38Å; A117-L120 PolarHBondContact O-N 3.19Å; A117-V121 VanDerWaalsContact O-CG2 3.3Å; A117-V121 WeakPolarHBondContact O-CG2 3.38Å; A117-V121 PolarHBondContact O-N 3.01Å
118T83Confident82.9Confident53 Ų5332.7 Ų32.733%0.32519%0.192SC..Hα-helixtrans-65.7-39.3174.554.80000111.3M114 V115 L120 V121 Q122M114-T118 WeakPolarHBondContact O-CG2 3.26Å; M114-T118 PolarHBondContact O-N 2.9Å; M114-T118 PolarHBondContact O-OG1 2.89Å; V115-T118 VanDerWaalsContact CA-OG1 3.31Å; V115-T118 WeakPolarHBondContact CA-OG1 3.5Å; V115-T118 PolarHBondContact O-N 3.46Å; V115-T118 PolarHBondContact O-OG1 3.17Å; T118-L120 VanDerWaalsContact C-N 3.31Å; T118-L120 PolarHBondContact O-N 2.88Å; T118-V121 PolarHBondContact O-N 3.3Å; T118-Q122 VanDerWaalsContact O-CB 3.27Å; T118-Q122 WeakPolarHBondContact O-CB 3.24Å; T118-Q122 VanDerWaalsContact O-CG 3.26Å; T118-Q122 WeakPolarHBondContact O-CG 3.35Å; T118-Q122 PolarHBondContact O-N 3.49Å
119G79.5Confident82.4Confident1 Ų137.9 Ų37.91%0.0122%0.218CC..Hα-helixtrans-59.1-41.6171.900000112.5V115 S116 G123V115-G119 PolarHBondContact O-N 3.34Å; S116-G119 PolarHBondContact O-N 3.14Å; G119-G123 PolarHBondContact O-N 3.49Å
120L80.9Confident81.6Confident33 Ų3339.6 Ų39.617%0.17323%0.231CC..Hα-helixtrans-67.4-33.9176.2-141.977.2000113.2S116 A117 T118 Y150 L151 V172 F175S116-L120 WeakPolarHBondContact O-CB 3.49Å; S116-L120 PolarHBondContact O-N 3.01Å; A117-L120 WeakPolarHBondContact O-CB 3.38Å; A117-L120 PolarHBondContact O-N 3.19Å; T118-L120 VanDerWaalsContact C-N 3.31Å; T118-L120 PolarHBondContact O-N 2.88Å; L120-Y150 WeakPolarHBondContact O-CE1 3.31Å; L120-Y150 PolarHBondContact O-OH 3.47Å; L120-L151 HydrophobicContact CD1-CD2 4.43Å; L120-L151 HydrophobicContact CD2-CD1 4.02Å; L120-L151 HydrophobicContact CD2-CD2 4.09Å; L120-L151 HydrophobicContact CG-CD1 4.05Å; L120-L151 HydrophobicContact CG-CD2 3.75Å; L120-V172 HydrophobicContact CD1-CG1 4.48Å; L120-V172 WeakPolarHBondContact CD1-O 3.44Å; L120-F175 HydrophobicContact CD1-CB 3.41Å; L120-F175 VanDerWaalsContact CD1-CB 3.41Å
121V78.5Confident80.8Confident78 Ų7843.7 Ų43.747%0.47326%0.257SS..Hα-helixtrans-82.4-40.4179.9170.40000111.3A117 T118 P142A117-V121 VanDerWaalsContact O-CG2 3.3Å; A117-V121 WeakPolarHBondContact O-CG2 3.38Å; A117-V121 PolarHBondContact O-N 3.01Å; T118-V121 PolarHBondContact O-N 3.3Å; V121-P142 HydrophobicContact CG1-CG 3.83Å; V121-P142 VanDerWaalsContact O-CD 3.24Å; V121-P142 WeakPolarHBondContact O-CD 3.2Å
122Q74.8Confident80.1Confident65 Ų6551.5 Ų51.530%0.30428%0.284SS..Hα-helixtrans-72.7-35.8-179.1-69.7178.49.200111.3T118 V138T118-Q122 VanDerWaalsContact O-CB 3.27Å; T118-Q122 WeakPolarHBondContact O-CB 3.24Å; T118-Q122 VanDerWaalsContact O-CG 3.26Å; T118-Q122 WeakPolarHBondContact O-CG 3.35Å; T118-Q122 PolarHBondContact O-N 3.49Å; Q122-V138 WeakPolarHBondContact O-CG1 3.27Å
123G73.1Confident79.6Confident1 Ų153 Ų531%0.0130%0.299CS..  trans82164.1-178.700000113.9G119 Y150G119-G123 PolarHBondContact O-N 3.49Å; G123-Y150 VanDerWaalsContact CA-OH 3.25Å; G123-Y150 WeakPolarHBondContact CA-OH 3.46Å
124P77Confident79.1Confident2 Ų256.6 Ų56.61%0.01332%0.315CS..  trans-73.3154-176.230.6-35.2000112.1L140 V167 V168 N171P124-L140 HydrophobicContact CG-CD1 4.42Å; P124-V167 HydrophobicContact CB-CG2 4.38Å; P124-V168 HydrophobicContact CG-CG2 4.14Å; P124-N171 HydrophobicContact CB-CB 4.14Å; P124-N171 HydrophobicContact CG-CB 4.36Å
125L73.5Confident78.6Confident43 Ų4353 Ų5323%0.22530%0.301CS..  trans-72.4126.6166.2-158.385.8000108.6H54 G137 V138H54-L125 HydrophobicContact CB-CD2 3.85Å; H54-L125 WeakPolarHBondContact O-CD2 3.28Å; L125-G137 WeakPolarHBondContact CA-O 3.42Å; L125-V138 HydrophobicContact CD1-CG2 3.66Å
126C76.6Confident78Confident0 Ų056.3 Ų56.30%031%0.31CS..EExtended strand (participates in β ladder)trans-144.4160.3175.775.70000112G137 C161 V167C126-G137 PolarHBondContact N-O 3.01Å; C126-G137 PolarHBondContact O-N 3.12Å; C126-G137 VanDerWaalsContact O-N 3.11Å; C126-G137 VanDerWaalsContact O-O 3.11Å; C126-C161 HydrophobicContact CB-CB 3.54Å; C126-C161 WeakPolarHBondContact CB-SG 2.96Å; C126-C161 VanDerWaalsContact SG-CA 3.6Å; C126-C161 WeakPolarHBondContact SG-CB 3.17Å; C126-C161 CovalentContact SG-SG 2.04Å; C126-C161 PolarHBondContact SG-SG 2.99Å; C126-V167 HydrophobicContact CB-CG1 4.08Å
127L76.8Confident77.3Confident30 Ų3056.9 Ų56.916%0.15732%0.316CS..EExtended strand (participates in β ladder)trans-80.3122173.3-170.574.9000109.1L134 W136 L162 K163L127-L134 HydrophobicContact CD1-CB 4.22Å; L127-L134 HydrophobicContact CD2-CD2 3.98Å; L127-L134 HydrophobicContact CG-CD2 4.2Å; L127-W136 HydrophobicContact CB-CD2 4.04Å; L127-W136 HydrophobicContact CB-CE3 4.06Å; L127-W136 HydrophobicContact CB-CH2 4.06Å; L127-W136 HydrophobicContact CB-CZ2 4.04Å; L127-W136 HydrophobicContact CB-CZ3 4.08Å; L127-W136 HydrophobicContact CD1-CD2 3.89Å; L127-W136 HydrophobicContact CD1-CG 3.85Å; L127-W136 HydrophobicContact CD1-CZ2 4.35Å; L127-L162 PolarHBondContact O-N 3.37Å; L127-K163 PolarHBondContact N-O 2.98Å; L127-K163 VanDerWaalsContact N-O 3.15Å
128Y76.6Confident76.6Confident64 Ų6457.2 Ų57.225%0.25131%0.314SS..EExtended strand (participates in β ladder)trans-129.3154.7176.972.1-80.4000111S130 T135 P139 I160Y128-S130 PolarHBondContact O-N 2.94Å; Y128-T135 WeakPolarHBondContact CD1-O 3.49Å; Y128-T135 PolarHBondContact N-O 2.96Å; Y128-T135 VanDerWaalsContact N-O 3.08Å; Y128-T135 PolarHBondContact O-N 3.38Å; Y128-T135 VanDerWaalsContact O-N 3.08Å; Y128-P139 HydrophobicContact CD1-CB 4.04Å; Y128-P139 HydrophobicContact CD1-CG 3.94Å; Y128-P139 HydrophobicContact CD2-CB 4.3Å; Y128-P139 HydrophobicContact CE1-CB 4.33Å; Y128-P139 HydrophobicContact CG-CB 4.03Å; Y128-P139 HydrophobicContact CG-CG 4.11Å; Y128-I160 VanDerWaalsContact CB-O 3.23Å; Y128-I160 WeakPolarHBondContact CB-O 3.34Å
129N80.1Confident75.6Confident116 Ų11656.9 Ų56.962%0.6231%0.313SS*.EExtended strand (participates in β ladder)trans-84110.7178.2-167.27.4000109.7L162N129-L162 HydrophobicContact CB-CD1 3.99Å
130S75.3Confident75Confident37 Ų3757.7 Ų57.726%0.25932%0.316SS..EExtended strand (participates in β ladder)trans-97.9163.4173.6-167.70000109.9Y128 F132 G133Y128-S130 PolarHBondContact O-N 2.94Å; S130-F132 PolarHBondContact O-N 3.46Å; S130-G133 PolarHBondContact N-O 3.48Å; S130-G133 PolarHBondContact O-N 2.95Å
131S74.9Confident74.1Confident123 Ų12362.1 Ų62.186%0.8633%0.334SS*.THydrogen-bonded Turntrans-58-15.5179.2-52.10000114.1
132F73.4Confident73Confident201 Ų20162.3 Ų62.388%0.88234%0.338SS*.THydrogen-bonded Turntrans-105.95.5178.3-60.6-82.8000113.9S130S130-F132 PolarHBondContact O-N 3.46Å
133G79.7Confident72.2Confident30 Ų3063.9 Ų63.931%0.30935%0.351SS..EExtended strand (participates in β ladder)trans120.4-168.3-179.400000114.2S130 T135S130-G133 PolarHBondContact N-O 3.48Å; S130-G133 PolarHBondContact O-N 2.95Å; G133-T135 PolarHBondContact O-N 2.93Å
134L78.5Confident71.1Confident115 Ų11569.7 Ų69.760%0.60239%0.389SS*.EExtended strand (participates in β ladder)trans-74.3118180-71.3157.7000110.1L127 L162L127-L134 HydrophobicContact CD1-CB 4.22Å; L127-L134 HydrophobicContact CD2-CD2 3.98Å; L127-L134 HydrophobicContact CG-CD2 4.2Å; L134-L162 HydrophobicContact CD2-CD1 3.63Å
135T78.2Confident69.7Low51 Ų5176.3 Ų76.331%0.31342%0.424SS..EExtended strand (participates in β ladder)trans-131.4141-179.8590000111.3Y128 G133Y128-T135 WeakPolarHBondContact CD1-O 3.49Å; Y128-T135 PolarHBondContact N-O 2.96Å; Y128-T135 VanDerWaalsContact N-O 3.08Å; Y128-T135 PolarHBondContact O-N 3.38Å; Y128-T135 VanDerWaalsContact O-N 3.08Å; G133-T135 PolarHBondContact O-N 2.93Å
136W73.8Confident68.8Low93 Ų9383.9 Ų83.935%0.35245%0.45SS..EExtended strand (participates in β ladder)trans-83129.9172.2-72.197.6000109.8Y49 H54 L127Y49-W136 HydrophobicContact CD1-CH2 4.26Å; Y49-W136 HydrophobicContact CE1-CH2 4Å; H54-W136 AromaticContact CD2-CD1 3.77Å; H54-W136 AromaticContact CD2-CD2 3.75Å; H54-W136 AromaticContact CD2-CG 3.46Å; H54-W136 VanDerWaalsContact CD2-CG 3.46Å; H54-W136 AromaticContact NE2-CD1 3.57Å; H54-W136 AromaticContact NE2-CG 3.73Å; L127-W136 HydrophobicContact CB-CD2 4.04Å; L127-W136 HydrophobicContact CB-CE3 4.06Å; L127-W136 HydrophobicContact CB-CH2 4.06Å; L127-W136 HydrophobicContact CB-CZ2 4.04Å; L127-W136 HydrophobicContact CB-CZ3 4.08Å; L127-W136 HydrophobicContact CD1-CD2 3.89Å; L127-W136 HydrophobicContact CD1-CG 3.85Å; L127-W136 HydrophobicContact CD1-CZ2 4.35Å
137G72.2Confident67.4Low13 Ų1392.9 Ų92.913%0.13449%0.491CS..EExtended strand (participates in β ladder)trans-173.8-166.6175.900000112.5L125 C126 P139L125-G137 WeakPolarHBondContact CA-O 3.42Å; C126-G137 PolarHBondContact N-O 3.01Å; C126-G137 PolarHBondContact O-N 3.12Å; C126-G137 VanDerWaalsContact O-N 3.11Å; C126-G137 VanDerWaalsContact O-O 3.11Å; G137-P139 VanDerWaalsContact C-CD 3.45Å; G137-P139 WeakPolarHBondContact O-CD 3.25Å
138V71.6Confident66.3Low52 Ų5293.9 Ų93.932%0.31550%0.504SS..  trans-11478.6-179.5-166.80000108.2Q122 L125 L140 K141Q122-V138 WeakPolarHBondContact O-CG1 3.27Å; L125-V138 HydrophobicContact CD1-CG2 3.66Å; V138-L140 PolarHBondContact O-N 2.63Å; V138-L140 VanDerWaalsContact O-N 3.13Å; V138-K141 HydrophobicContact CB-CB 4.4Å; V138-K141 HydrophobicContact CG1-CB 4.08Å; V138-K141 PolarHBondContact O-N 3.16Å
139P63.5Low65.7Low47 Ų4793 Ų9331%0.30551%0.514SS..THydrogen-bonded Turntrans-66.9-14.6-175.428.1-35.2000112.8Y128 G137 I160Y128-P139 HydrophobicContact CD1-CB 4.04Å; Y128-P139 HydrophobicContact CD1-CG 3.94Å; Y128-P139 HydrophobicContact CD2-CB 4.3Å; Y128-P139 HydrophobicContact CE1-CB 4.33Å; Y128-P139 HydrophobicContact CG-CB 4.03Å; Y128-P139 HydrophobicContact CG-CG 4.11Å; G137-P139 VanDerWaalsContact C-CD 3.45Å; G137-P139 WeakPolarHBondContact O-CD 3.25Å; P139-I160 HydrophobicContact CB-CG2 3.72Å; P139-I160 HydrophobicContact CG-CG2 3.51Å
140L65.6Low65.3Low17 Ų1788 Ų889%0.08949%0.486CS..THydrogen-bonded Turntrans-95.4-2-175-63.1142.2000113P124 V138 Y150 I160 V168P124-L140 HydrophobicContact CG-CD1 4.42Å; V138-L140 PolarHBondContact O-N 2.63Å; V138-L140 VanDerWaalsContact O-N 3.13Å; L140-Y150 HydrophobicContact CB-CD1 3.74Å; L140-Y150 HydrophobicContact CB-CE1 4.15Å; L140-Y150 HydrophobicContact CB-CG 4.03Å; L140-Y150 HydrophobicContact CD2-CD1 4.13Å; L140-Y150 HydrophobicContact CD2-CD2 3.87Å; L140-Y150 HydrophobicContact CD2-CG 3.5Å; L140-Y150 HydrophobicContact CG-CD1 4.49Å; L140-Y150 HydrophobicContact CG-CG 4.28Å; L140-I160 HydrophobicContact CD2-CD1 4.29Å; L140-V168 HydrophobicContact CD1-CG2 4.08Å
141K62.7Low65.2Low126 Ų12689.5 Ų89.555%0.54849%0.491SS..SBendtrans-60.2133.4-179.7-164.7174.1-176.6174.50109.5V138 V143V138-K141 HydrophobicContact CB-CB 4.4Å; V138-K141 HydrophobicContact CG1-CB 4.08Å; V138-K141 PolarHBondContact O-N 3.16Å; K141-V143 PolarHBondContact O-N 2.77Å
142P55.2Low65Low83 Ų8393.5 Ų93.554%0.53949%0.489SS..  trans-61.9115.1-176.321.9-33000110.5V121V121-P142 HydrophobicContact CG1-CG 3.83Å; V121-P142 VanDerWaalsContact O-CD 3.24Å; V121-P142 WeakPolarHBondContact O-CD 3.2Å
143V58.8Low64.9Low97 Ų9786.9 Ų86.959%0.58846%0.463SS*.  trans-82.1137.7168.2-173.50000107K141 N145 R146K141-V143 PolarHBondContact O-N 2.77Å; V143-N145 PolarHBondContact O-N 2.98Å; V143-R146 PolarHBondContact O-N 3.3Å
144P49.3Very low64.5Low124 Ų12492 Ų9281%0.80548%0.479SS*.THydrogen-bonded Turntrans-6315.1-167.920.5-31.9000117.8
145N47.3Very low64.1Low141 Ų14190.5 Ų90.575%0.75448%0.478SS*.THydrogen-bonded Turntrans-141.59.8-179.2-85-27000115.2V143V143-N145 PolarHBondContact O-N 2.98Å
146R54.7Low63.6Low201 Ų20190.5 Ų90.576%0.75848%0.475SS*.  trans-106.1110.7173.4-79.5-171.8179.6-175.81.2110.4V143 A148V143-R146 PolarHBondContact O-N 3.3Å; R146-A148 VanDerWaalsContact C-N 3.32Å; R146-A148 PolarHBondContact O-N 2.74Å
147H48.4Very low63.5Low189 Ų18988.4 Ų88.488%0.87547%0.467SS*.SBendtrans-80.3-6.1-174.9-62.3-29.9000115
148A53.3Low63.1Low51 Ų5193 Ų9342%0.42150%0.498SS..SBendtrans-114.497.8172.600000109.2R146R146-A148 VanDerWaalsContact C-N 3.32Å; R146-A148 PolarHBondContact O-N 2.74Å
149G62.9Low62.8Low45 Ų4594 Ų9446%0.46452%0.518SS..  trans-62155.6171.900000111.1L151 Y152G149-L151 PolarHBondContact O-N 3.12Å; G149-Y152 PolarHBondContact O-N 3.36Å
150Y72.8Confident63.2Low11 Ų1194.2 Ų94.24%0.04352%0.516CS..THydrogen-bonded Turntrans-58.7-20.3-179.179.5-87.3000113.6L120 G123 L140 Y152 W157 V168 V172L120-Y150 WeakPolarHBondContact O-CE1 3.31Å; L120-Y150 PolarHBondContact O-OH 3.47Å; G123-Y150 VanDerWaalsContact CA-OH 3.25Å; G123-Y150 WeakPolarHBondContact CA-OH 3.46Å; L140-Y150 HydrophobicContact CB-CD1 3.74Å; L140-Y150 HydrophobicContact CB-CE1 4.15Å; L140-Y150 HydrophobicContact CB-CG 4.03Å; L140-Y150 HydrophobicContact CD2-CD1 4.13Å; L140-Y150 HydrophobicContact CD2-CD2 3.87Å; L140-Y150 HydrophobicContact CD2-CG 3.5Å; L140-Y150 HydrophobicContact CG-CD1 4.49Å; L140-Y150 HydrophobicContact CG-CG 4.28Å; Y150-Y152 VanDerWaalsContact C-N 3.29Å; Y150-Y152 PolarHBondContact O-N 3.43Å; Y150-W157 AromaticContact CD2-NE1 3.62Å; Y150-W157 PolarHBondContact O-NE1 2.98Å; Y150-V168 HydrophobicContact CD2-CG1 3.98Å; Y150-V168 HydrophobicContact CE2-CG1 3.9Å; Y150-V172 HydrophobicContact CE2-CG2 3.64Å
151L72.3Confident63.6Low69 Ų6994.4 Ų94.436%0.36152%0.519SS..THydrogen-bonded Turntrans-63.1-30.4174.6-66.4169.6000113.8L120 G149 V172L120-L151 HydrophobicContact CD1-CD2 4.43Å; L120-L151 HydrophobicContact CD2-CD1 4.02Å; L120-L151 HydrophobicContact CD2-CD2 4.09Å; L120-L151 HydrophobicContact CG-CD1 4.05Å; L120-L151 HydrophobicContact CG-CD2 3.75Å; G149-L151 PolarHBondContact O-N 3.12Å; L151-V172 HydrophobicContact CD2-CG1 4Å; L151-V172 HydrophobicContact CD2-CG2 3.87Å
152Y70.8Confident64.1Low207 Ų20793.6 Ų93.681%0.81252%0.519SS*.THydrogen-bonded Turntrans-91.8-27.1-178.4-167.9-102000112.4G149 Y150G149-Y152 PolarHBondContact O-N 3.36Å; Y150-Y152 VanDerWaalsContact C-N 3.29Å; Y150-Y152 PolarHBondContact O-N 3.43Å
153N72.5Confident64.7Low63 Ų6395.3 Ų95.334%0.33752%0.519SS..  trans-111.886.3-176.1-162.1-2.6000111.7S155 M156N153-S155 PolarHBondContact O-N 3.13Å; N153-S155 PolarHBondContact OD1-OG 3.3Å; N153-M156 HydrophobicContact CB-CE 3.88Å; N153-M156 HydrophobicContact CB-CG 4.43Å; N153-M156 PolarHBondContact O-N 3.16Å; N153-M156 VanDerWaalsContact O-N 3.16Å
154Q70.3Confident65Low136 Ų13691 Ų9164%0.63649%0.492SS*.G310 helixtrans-60.6-24.7180-68.4178-3.700113.2M156 W157Q154-M156 PolarHBondContact O-N 2.95Å; Q154-M156 VanDerWaalsContact O-N 3.09Å; Q154-W157 HydrophobicContact CG-CH2 4.11Å; Q154-W157 HydrophobicContact CG-CZ2 4.12Å; Q154-W157 HydrophobicContact CG-CZ3 4.3Å; Q154-W157 WeakPolarHBondContact O-CB 3.48Å; Q154-W157 PolarHBondContact O-N 3.48Å
155S70.6Confident65.8Low85 Ų8592.8 Ų92.859%0.59449%0.49SS*.G310 helixtrans-61.8-18.5177.169.30000113.5N153 S158N153-S155 PolarHBondContact O-N 3.13Å; N153-S155 PolarHBondContact OD1-OG 3.3Å; S155-S158 PolarHBondContact O-OG 2.99Å
156M67.6Low67Low51 Ų5189.8 Ų89.825%0.25148%0.48SS..G310 helixtrans-80.9-14.8176.5-65.8-158.1-75.300113.5N153 Q154 I160N153-M156 HydrophobicContact CB-CE 3.88Å; N153-M156 HydrophobicContact CB-CG 4.43Å; N153-M156 PolarHBondContact O-N 3.16Å; N153-M156 VanDerWaalsContact O-N 3.16Å; Q154-M156 PolarHBondContact O-N 2.95Å; Q154-M156 VanDerWaalsContact O-N 3.09Å; M156-I160 HydrophobicContact CB-CD1 3.89Å; M156-I160 VanDerWaalsContact O-CD1 3.32Å; M156-I160 WeakPolarHBondContact O-CD1 3.4Å; M156-I160 WeakPolarHBondContact O-CG1 3.16Å
157W72.1Confident68.1Low48 Ų4880.7 Ų80.718%0.18245%0.447CS..Hα-helixtrans-74.3-30.9-173.7-61.82.9000112.5Y150 Q154 V168 E169 V172Y150-W157 AromaticContact CD2-NE1 3.62Å; Y150-W157 PolarHBondContact O-NE1 2.98Å; Q154-W157 HydrophobicContact CG-CH2 4.11Å; Q154-W157 HydrophobicContact CG-CZ2 4.12Å; Q154-W157 HydrophobicContact CG-CZ3 4.3Å; Q154-W157 WeakPolarHBondContact O-CB 3.48Å; Q154-W157 PolarHBondContact O-N 3.48Å; W157-V168 HydrophobicContact CB-CB 4.35Å; W157-V168 HydrophobicContact CB-CG1 4.24Å; W157-V168 HydrophobicContact CD2-CG1 3.87Å; W157-V168 HydrophobicContact CG-CB 4.28Å; W157-V168 HydrophobicContact CG-CG1 3.67Å; W157-E169 HydrophobicContact CE3-CB 4.05Å; W157-E169 HydrophobicContact CZ3-CB 4.05Å; W157-E169 HydrophobicContact CZ3-CG 4.14Å; W157-V172 HydrophobicContact CH2-CB 4.29Å; W157-V172 HydrophobicContact CH2-CG1 3.98Å; W157-V172 HydrophobicContact CH2-CG2 4.35Å; W157-V172 HydrophobicContact CZ2-CG1 4.32Å; W157-V172 HydrophobicContact CZ2-CG2 4.17Å
158S63.6Low69.5Low111 Ų11172 Ų7278%0.77641%0.407SS*.Hα-helixtrans-83.9-8.6-174.554.20000115S155S155-S158 PolarHBondContact O-OG 2.99Å
159G64.9Low70.8Confident71 Ų7175 Ų7573%0.73241%0.412SS*.Hα-helixtrans-123.5-8.6-170.400000116.6
160I71.1Confident71.7Confident53 Ų5376.7 Ų76.727%0.27241%0.405SS..Hα-helixtrans-103.3-43.2-171-62.1173.4000112.2Y128 P139 L140 M156Y128-I160 VanDerWaalsContact CB-O 3.23Å; Y128-I160 WeakPolarHBondContact CB-O 3.34Å; P139-I160 HydrophobicContact CB-CG2 3.72Å; P139-I160 HydrophobicContact CG-CG2 3.51Å; L140-I160 HydrophobicContact CD2-CD1 4.29Å; M156-I160 HydrophobicContact CB-CD1 3.89Å; M156-I160 VanDerWaalsContact O-CD1 3.32Å; M156-I160 WeakPolarHBondContact O-CD1 3.4Å; M156-I160 WeakPolarHBondContact O-CG1 3.16Å
161C74.1Confident72.3Confident21 Ų2176.6 Ų76.614%0.14241%0.405CS..  trans-97.3118.2-179.2-63.90000110C126 V167 V168C126-C161 HydrophobicContact CB-CB 3.54Å; C126-C161 WeakPolarHBondContact CB-SG 2.96Å; C126-C161 VanDerWaalsContact SG-CA 3.6Å; C126-C161 WeakPolarHBondContact SG-CB 3.17Å; C126-C161 CovalentContact SG-SG 2.04Å; C126-C161 PolarHBondContact SG-SG 2.99Å; C161-V167 HydrophobicContact CB-CG1 4.2Å; C161-V168 HydrophobicContact CB-CG2 4.36Å
162L73.1Confident72.9Confident108 Ų10874.2 Ų74.257%0.56539%0.393SS*.  trans-83.4-33.7179.1-73.8159.9000112.3L127 N129 L134L127-L162 PolarHBondContact O-N 3.37Å; N129-L162 HydrophobicContact CB-CD1 3.99Å; L134-L162 HydrophobicContact CD2-CD1 3.63Å
163K68.1Low73.8Confident120 Ų12067.5 Ų67.552%0.52237%0.374SS..BIsolated β-bridgetrans-154.3141.5178.2-160.2156.7-175.9164.90110.4Y49 L127Y49-K163 WeakPolarHBondContact OH-CE 3.37Å; L127-K163 PolarHBondContact N-O 2.98Å; L127-K163 VanDerWaalsContact N-O 3.15Å
164P65.6Low74.6Confident5 Ų565.4 Ų65.43%0.03236%0.362CS..SBendcis-66.3160.3-10.3-2.214.2000114E44 Y49 V167E44-P164 HydrophobicContact CG-CB 4.13Å; E44-P164 WeakPolarHBondContact OE1-CB 2.91Å; Y49-P164 HydrophobicContact CE1-CG 4.46Å; Y49-P164 HydrophobicContact CE2-CG 4.29Å; P164-V167 HydrophobicContact CB-CB 4.24Å; P164-V167 HydrophobicContact CG-CB 4.06Å; P164-V167 HydrophobicContact CG-CG2 4.05Å
165E66.6Low75.5Confident163 Ų16359.2 Ų59.276%0.76233%0.333SS*.THydrogen-bonded Turntrans-74.9135.9-178.8-164.9174.4176.400108.8E44 V167E44-E165 PolarHBondContact OE1-N 3.43Å; E165-V167 PolarHBondContact O-N 3.27Å; E165-V167 VanDerWaalsContact O-N 3.11Å
166S71.3Confident76.4Confident78 Ų7857 Ų5755%0.54532%0.318SS..THydrogen-bonded Turntrans60.214.6-177.772.80000117.2V168 E169 W170S166-V168 PolarHBondContact O-N 3.39Å; S166-V168 VanDerWaalsContact O-N 3.1Å; S166-E169 PolarHBondContact O-N 3.24Å; S166-W170 PolarHBondContact O-N 3.49Å
167V77.5Confident77.6Confident10 Ų1059 Ų596%0.06133%0.328CS..Hα-helixtrans-56-32.3-179.9700000113.6P124 C126 C161 P164 E165 N171P124-V167 HydrophobicContact CB-CG2 4.38Å; C126-V167 HydrophobicContact CB-CG1 4.08Å; C161-V167 HydrophobicContact CB-CG1 4.2Å; P164-V167 HydrophobicContact CB-CB 4.24Å; P164-V167 HydrophobicContact CG-CB 4.06Å; P164-V167 HydrophobicContact CG-CG2 4.05Å; E165-V167 PolarHBondContact O-N 3.27Å; E165-V167 VanDerWaalsContact O-N 3.11Å; V167-N171 WeakPolarHBondContact CG2-ND2 3.46Å; V167-N171 WeakPolarHBondContact O-CB 3.49Å; V167-N171 PolarHBondContact O-N 3.39Å; V167-N171 VanDerWaalsContact O-N 3.1Å; V167-N171 PolarHBondContact O-ND2 3.19Å
168V77.7Confident78.5Confident5 Ų556.9 Ų56.93%0.0332%0.32CS..Hα-helixtrans-67.5-51.3-178.5-176.70000111.2P124 L140 Y150 W157 C161 S166 W170 N171 V172P124-V168 HydrophobicContact CG-CG2 4.14Å; L140-V168 HydrophobicContact CD1-CG2 4.08Å; Y150-V168 HydrophobicContact CD2-CG1 3.98Å; Y150-V168 HydrophobicContact CE2-CG1 3.9Å; W157-V168 HydrophobicContact CB-CB 4.35Å; W157-V168 HydrophobicContact CB-CG1 4.24Å; W157-V168 HydrophobicContact CD2-CG1 3.87Å; W157-V168 HydrophobicContact CG-CB 4.28Å; W157-V168 HydrophobicContact CG-CG1 3.67Å; C161-V168 HydrophobicContact CB-CG2 4.36Å; S166-V168 PolarHBondContact O-N 3.39Å; S166-V168 VanDerWaalsContact O-N 3.1Å; V168-W170 VanDerWaalsContact C-N 3.3Å; V168-W170 PolarHBondContact O-N 3.25Å; V168-N171 PolarHBondContact O-N 2.93Å; V168-V172 HydrophobicContact CG1-CG2 4.43Å; V168-V172 WeakPolarHBondContact O-CB 3.28Å; V168-V172 WeakPolarHBondContact O-CG2 3.33Å; V168-V172 PolarHBondContact O-N 2.99Å
169E81.6Confident79.8Confident114 Ų11452.5 Ų52.553%0.53329%0.291SS..Hα-helixtrans-59.5-45.9178.6-178.1176.1173.800110.6W157 S166 N171 V172 V173W157-E169 HydrophobicContact CE3-CB 4.05Å; W157-E169 HydrophobicContact CZ3-CB 4.05Å; W157-E169 HydrophobicContact CZ3-CG 4.14Å; S166-E169 PolarHBondContact O-N 3.24Å; E169-N171 PolarHBondContact O-N 3.06Å; E169-V172 PolarHBondContact O-N 2.89Å; E169-V173 HydrophobicContact CG-CG2 4.33Å; E169-V173 VanDerWaalsContact O-CG2 3.3Å; E169-V173 WeakPolarHBondContact O-CG2 3.24Å; E169-V173 PolarHBondContact O-N 3.21Å
170W82.2Confident81.2Confident82 Ų8254.5 Ų54.531%0.31128%0.283SS..Hα-helixtrans-61.4-45.3-177.3-147.981.8000112.7L39 S166 V168 L174L39-W170 HydrophobicContact CB-CH2 3.45Å; L39-W170 VanDerWaalsContact CB-CH2 3.45Å; L39-W170 HydrophobicContact CB-CZ2 4.01Å; L39-W170 HydrophobicContact CB-CZ3 4.1Å; L39-W170 HydrophobicContact CD2-CH2 3.95Å; L39-W170 HydrophobicContact CD2-CZ2 3.99Å; L39-W170 HydrophobicContact CG-CH2 4.21Å; L39-W170 HydrophobicContact CG-CZ2 4.39Å; L39-W170 WeakPolarHBondContact O-CH2 3.41Å; L39-W170 WeakPolarHBondContact O-CZ3 3.38Å; S166-W170 PolarHBondContact O-N 3.49Å; V168-W170 VanDerWaalsContact C-N 3.3Å; V168-W170 PolarHBondContact O-N 3.25Å; W170-L174 HydrophobicContact CD2-CD1 3.75Å; W170-L174 HydrophobicContact CE3-CD1 3.31Å; W170-L174 HydrophobicContact CE3-CG 4.44Å; W170-L174 HydrophobicContact CH2-CD1 3.73Å; W170-L174 HydrophobicContact CZ2-CD1 4.07Å; W170-L174 HydrophobicContact CZ3-CD1 3.3Å; W170-L174 VanDerWaalsContact O-CG 3.31Å; W170-L174 WeakPolarHBondContact O-CG 3.35Å; W170-L174 PolarHBondContact O-N 3.38Å; W170-L174 VanDerWaalsContact O-N 3.1Å
171N84.7Confident82.2Confident8 Ų852.3 Ų52.34%0.04327%0.272CS..Hα-helixtrans-65.7-43175.4-82.9-94.1000111.8L40 P124 V167 V168 E169 V173 L174 F175L40-N171 HydrophobicContact CD2-CB 4.39Å; L40-N171 VanDerWaalsContact CD2-OD1 3.32Å; L40-N171 WeakPolarHBondContact CD2-OD1 3.34Å; P124-N171 HydrophobicContact CB-CB 4.14Å; P124-N171 HydrophobicContact CG-CB 4.36Å; V167-N171 WeakPolarHBondContact CG2-ND2 3.46Å; V167-N171 WeakPolarHBondContact O-CB 3.49Å; V167-N171 PolarHBondContact O-N 3.39Å; V167-N171 VanDerWaalsContact O-N 3.1Å; V167-N171 PolarHBondContact O-ND2 3.19Å; V168-N171 PolarHBondContact O-N 2.93Å; E169-N171 PolarHBondContact O-N 3.06Å; N171-V173 PolarHBondContact O-N 2.64Å; N171-L174 PolarHBondContact O-N 3.27Å; N171-F175 HydrophobicContact CB-CD2 4.24Å; N171-F175 HydrophobicContact CB-CE2 4.42Å; N171-F175 WeakPolarHBondContact O-CB 3.49Å; N171-F175 VanDerWaalsContact O-CD2 3.24Å; N171-F175 WeakPolarHBondContact O-CD2 3.48Å; N171-F175 PolarHBondContact O-N 3.13Å
172V85.6Confident83.2Confident19 Ų1951.3 Ų51.312%0.11527%0.266CS..Hα-helixtrans-60.9-46.7179.6170.20000110.8L120 Y150 L151 W157 V168 E169 S176L120-V172 HydrophobicContact CD1-CG1 4.48Å; L120-V172 WeakPolarHBondContact CD1-O 3.44Å; Y150-V172 HydrophobicContact CE2-CG2 3.64Å; L151-V172 HydrophobicContact CD2-CG1 4Å; L151-V172 HydrophobicContact CD2-CG2 3.87Å; W157-V172 HydrophobicContact CH2-CB 4.29Å; W157-V172 HydrophobicContact CH2-CG1 3.98Å; W157-V172 HydrophobicContact CH2-CG2 4.35Å; W157-V172 HydrophobicContact CZ2-CG1 4.32Å; W157-V172 HydrophobicContact CZ2-CG2 4.17Å; V168-V172 HydrophobicContact CG1-CG2 4.43Å; V168-V172 WeakPolarHBondContact O-CB 3.28Å; V168-V172 WeakPolarHBondContact O-CG2 3.33Å; V168-V172 PolarHBondContact O-N 2.99Å; E169-V172 PolarHBondContact O-N 2.89Å; V172-S176 WeakPolarHBondContact O-CB 3.41Å; V172-S176 PolarHBondContact O-N 3Å; V172-S176 PolarHBondContact O-OG 3.02Å; V172-S176 VanDerWaalsContact O-OG 3.12Å
173V88.9Confident84.2Confident67 Ų6748.1 Ų48.141%0.40626%0.255SS..Hα-helixtrans-62.3-50.5179.1173.40000110.7E169 N171 S176 M177E169-V173 HydrophobicContact CG-CG2 4.33Å; E169-V173 VanDerWaalsContact O-CG2 3.3Å; E169-V173 WeakPolarHBondContact O-CG2 3.24Å; E169-V173 PolarHBondContact O-N 3.21Å; N171-V173 PolarHBondContact O-N 2.64Å; V173-S176 PolarHBondContact O-N 3.27Å; V173-S176 PolarHBondContact O-OG 3.09Å; V173-M177 WeakPolarHBondContact O-CG 3.48Å; V173-M177 PolarHBondContact O-N 3.46Å
174L88.9Confident85.4Confident18 Ų1843.9 Ų43.99%0.09424%0.243CC..Hα-helixtrans-66.9-45.7-176.8-66.7175.7000113.4L39 L40 W170 N171 S176 M177 M178L39-L174 HydrophobicContact CB-CD1 3.64Å; L39-L174 HydrophobicContact CB-CD2 4.26Å; L39-L174 HydrophobicContact CD1-CD2 4.01Å; L40-L174 HydrophobicContact CD1-CB 4.11Å; L40-L174 HydrophobicContact CD2-CB 3.87Å; L40-L174 HydrophobicContact CD2-CD1 4.06Å; L40-L174 HydrophobicContact CG-CB 3.74Å; L40-L174 HydrophobicContact CG-CD1 3.88Å; L40-L174 HydrophobicContact CG-CG 4.49Å; W170-L174 HydrophobicContact CD2-CD1 3.75Å; W170-L174 HydrophobicContact CE3-CD1 3.31Å; W170-L174 HydrophobicContact CE3-CG 4.44Å; W170-L174 HydrophobicContact CH2-CD1 3.73Å; W170-L174 HydrophobicContact CZ2-CD1 4.07Å; W170-L174 HydrophobicContact CZ3-CD1 3.3Å; W170-L174 VanDerWaalsContact O-CG 3.31Å; W170-L174 WeakPolarHBondContact O-CG 3.35Å; W170-L174 PolarHBondContact O-N 3.38Å; W170-L174 VanDerWaalsContact O-N 3.1Å; N171-L174 PolarHBondContact O-N 3.27Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.24Å; L174-M177 PolarHBondContact O-N 3.1Å; L174-M178 WeakPolarHBondContact O-CG 3.39Å; L174-M178 PolarHBondContact O-N 2.93Å
175F88.6Confident86.7Confident6 Ų643.7 Ų43.73%0.02624%0.241CC..Hα-helixtrans-64.7-35.5176.5-81.1-60.4000111.7L40 L120 N171 M178 A179L40-F175 HydrophobicContact CD1-CD1 3.65Å; L40-F175 HydrophobicContact CD1-CD2 4.24Å; L40-F175 HydrophobicContact CD1-CE1 3.56Å; L40-F175 HydrophobicContact CD1-CE2 4.14Å; L40-F175 HydrophobicContact CD1-CG 4Å; L40-F175 HydrophobicContact CD1-CZ 3.81Å; L40-F175 HydrophobicContact CD2-CD2 3.8Å; L40-F175 HydrophobicContact CD2-CE2 3.59Å; L40-F175 HydrophobicContact CD2-CG 4.35Å; L40-F175 HydrophobicContact CD2-CZ 3.98Å; L40-F175 HydrophobicContact CG-CZ 4.47Å; L120-F175 HydrophobicContact CD1-CB 3.41Å; L120-F175 VanDerWaalsContact CD1-CB 3.41Å; N171-F175 HydrophobicContact CB-CD2 4.24Å; N171-F175 HydrophobicContact CB-CE2 4.42Å; N171-F175 WeakPolarHBondContact O-CB 3.49Å; N171-F175 VanDerWaalsContact O-CD2 3.24Å; N171-F175 WeakPolarHBondContact O-CD2 3.48Å; N171-F175 PolarHBondContact O-N 3.13Å; F175-M178 PolarHBondContact O-N 3.09Å; F175-A179 WeakPolarHBondContact O-CB 3.35Å; F175-A179 PolarHBondContact O-N 3.48Å
176S90.7Very high88Confident39 Ų3936.8 Ų36.827%0.27321%0.212SC..Hα-helixtrans-65.6-42.8174.774.70000112.3V172 V173 L174 M178 A179 I180V172-S176 WeakPolarHBondContact O-CB 3.41Å; V172-S176 PolarHBondContact O-N 3Å; V172-S176 PolarHBondContact O-OG 3.02Å; V172-S176 VanDerWaalsContact O-OG 3.12Å; V173-S176 PolarHBondContact O-N 3.27Å; V173-S176 PolarHBondContact O-OG 3.09Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.24Å; S176-M178 PolarHBondContact O-N 2.93Å; S176-A179 PolarHBondContact O-N 3.18Å; S176-I180 VanDerWaalsContact O-CG1 3.31Å; S176-I180 WeakPolarHBondContact O-CG1 3.32Å; S176-I180 PolarHBondContact O-N 3.2Å
177M92Very high89.1Confident94 Ų9437.6 Ų37.646%0.46321%0.213SC..Hα-helixtrans-62.2-43.8176-75.6-63.6-15800111.5V173 L174 I180 C181V173-M177 WeakPolarHBondContact O-CG 3.48Å; V173-M177 PolarHBondContact O-N 3.46Å; L174-M177 PolarHBondContact O-N 3.1Å; M177-I180 PolarHBondContact O-N 3.01Å; M177-C181 WeakPolarHBondContact O-CB 3.31Å; M177-C181 PolarHBondContact O-N 3.42Å; M177-C181 PolarHBondContact O-SG 2.89Å
178M91.1Very high89.7Confident2 Ų239 Ų391%0.0122%0.221CC..Hα-helixtrans-61.6-43.4174.1-72.4-179.76100112.2S36 N37 L40 L174 F175 S176 S182S36-M178 VanDerWaalsContact CB-CG 3.42Å; N37-M178 HydrophobicContact CB-CE 3.97Å; N37-M178 HydrophobicContact CB-SD 4.09Å; L40-M178 HydrophobicContact CD1-SD 3.54Å; L40-M178 VanDerWaalsContact CD1-SD 3.54Å; L174-M178 WeakPolarHBondContact O-CG 3.39Å; L174-M178 PolarHBondContact O-N 2.93Å; F175-M178 PolarHBondContact O-N 3.09Å; S176-M178 PolarHBondContact O-N 2.93Å; M178-S182 VanDerWaalsContact O-CB 3.24Å; M178-S182 WeakPolarHBondContact O-CB 3.23Å; M178-S182 PolarHBondContact O-N 3.22Å; M178-S182 PolarHBondContact O-OG 3.42Å
179A91.8Very high90.3Very high20 Ų2038.9 Ų38.917%0.16522%0.22CC..Hα-helixtrans-62.6-45.6178.100000111.8F175 S176 S182 A183F175-A179 WeakPolarHBondContact O-CB 3.35Å; F175-A179 PolarHBondContact O-N 3.48Å; S176-A179 PolarHBondContact O-N 3.18Å; A179-S182 PolarHBondContact O-OG 3.21Å; A179-S182 VanDerWaalsContact O-OG 3.12Å; A179-A183 WeakPolarHBondContact O-CB 2.98Å; A179-A183 PolarHBondContact O-N 3.26Å
180I93.8Very high90.7Very high112 Ų11234.5 Ų34.557%0.57421%0.205SC*.Hα-helixtrans-64.9-47.5178.6-66.3165000110.8S176 M177 A183 A184S176-I180 VanDerWaalsContact O-CG1 3.31Å; S176-I180 WeakPolarHBondContact O-CG1 3.32Å; S176-I180 PolarHBondContact O-N 3.2Å; M177-I180 PolarHBondContact O-N 3.01Å; I180-A183 PolarHBondContact O-N 3.44Å; I180-A184 WeakPolarHBondContact O-CB 3.09Å; I180-A184 PolarHBondContact O-N 3.45Å
181C93.5Very high91Very high7 Ų734.4 Ų34.45%0.04721%0.21CC..Hα-helixtrans-63.6-45.2-179.6-67.60000111.5M29 C33 M177 A184 Q185M29-C181 HydrophobicContact CB-CB 4.46Å; M29-C181 HydrophobicContact SD-CB 3.98Å; M29-C181 VanDerWaalsContact SD-SG 3.63Å; C33-C181 WeakPolarHBondContact SG-CB 3.3Å; M177-C181 WeakPolarHBondContact O-CB 3.31Å; M177-C181 PolarHBondContact O-N 3.42Å; M177-C181 PolarHBondContact O-SG 2.89Å; C181-A184 PolarHBondContact O-N 2.04Å; C181-Q185 VanDerWaalsContact O-CG 3.24Å; C181-Q185 WeakPolarHBondContact O-CG 3.3Å; C181-Q185 PolarHBondContact O-N 3.1Å
182S93.1Very high91.1Very high0 Ų034 Ų340%021%0.208CC..Hα-helixtrans-68.4-36.7178.259.30000112.7C113 M178 A179 Q185 A186C113-S182 WeakPolarHBondContact CA-OG 3.34Å; C113-S182 WeakPolarHBondContact CB-OG 3.24Å; C113-S182 PolarHBondContact N-OG 3.37Å; M178-S182 VanDerWaalsContact O-CB 3.24Å; M178-S182 WeakPolarHBondContact O-CB 3.23Å; M178-S182 PolarHBondContact O-N 3.22Å; M178-S182 PolarHBondContact O-OG 3.42Å; A179-S182 PolarHBondContact O-OG 3.21Å; A179-S182 VanDerWaalsContact O-OG 3.12Å; S182-Q185 WeakPolarHBondContact O-CB 3.45Å; S182-Q185 PolarHBondContact O-N 2.71Å; S182-A186 WeakPolarHBondContact O-CB 3.49Å; S182-A186 PolarHBondContact O-N 3.47Å
183A94.3Very high91.2Very high41 Ų4134.4 Ų34.434%0.33921%0.209SC..Hα-helixtrans-62.1-44.4171.600000111.6A179 I180 Q185 A186 V187A179-A183 WeakPolarHBondContact O-CB 2.98Å; A179-A183 PolarHBondContact O-N 3.26Å; I180-A183 PolarHBondContact O-N 3.44Å; A183-Q185 PolarHBondContact O-N 3.43Å; A183-A186 WeakPolarHBondContact O-CB 3.17Å; A183-A186 PolarHBondContact O-N 3.1Å; A183-V187 WeakPolarHBondContact O-CG2 3.43Å; A183-V187 PolarHBondContact O-N 3.26Å
184A94.1Very high91.1Very high32 Ų3236.2 Ų36.226%0.26422%0.216SC..Hα-helixtrans-62.5-42.4175.400000112I180 C181 A186 V187 L188I180-A184 WeakPolarHBondContact O-CB 3.09Å; I180-A184 PolarHBondContact O-N 3.45Å; C181-A184 PolarHBondContact O-N 2.04Å; A184-A186 VanDerWaalsContact C-N 3.35Å; A184-A186 PolarHBondContact O-N 2.82Å; A184-V187 PolarHBondContact O-N 2.94Å; A184-L188 WeakPolarHBondContact O-CG 3.32Å; A184-L188 PolarHBondContact O-N 3.02Å
185Q93.4Very high90.8Very high0 Ų038.9 Ų38.90%023%0.23CC..Hα-helixtrans-58.3-45.6173.4-71.5169.5-7.200111.5L26 M29 V72 A109 C181 S182 A183 V187 L188 C189L26-Q185 HydrophobicContact CD2-CB 4.04Å; L26-Q185 HydrophobicContact CD2-CG 3.71Å; M29-Q185 HydrophobicContact CB-CG 4.11Å; V72-Q185 HydrophobicContact CG1-CG 4.24Å; A109-Q185 HydrophobicContact CB-CB 3.96Å; C181-Q185 VanDerWaalsContact O-CG 3.24Å; C181-Q185 WeakPolarHBondContact O-CG 3.3Å; C181-Q185 PolarHBondContact O-N 3.1Å; S182-Q185 WeakPolarHBondContact O-CB 3.45Å; S182-Q185 PolarHBondContact O-N 2.71Å; A183-Q185 PolarHBondContact O-N 3.43Å; Q185-V187 PolarHBondContact O-N 3.11Å; Q185-L188 PolarHBondContact O-N 3.43Å; Q185-C189 WeakPolarHBondContact O-CB 3.24Å; Q185-C189 PolarHBondContact O-N 3.26Å; Q185-C189 PolarHBondContact O-SG 2.87Å; Q185-C189 VanDerWaalsContact O-SG 3.41Å
186A93.4Very high90.4Very high18 Ų1838.8 Ų38.815%0.14923%0.231CC..Hα-helixtrans-60.1-44.4177.900000111.8L106 A109 S182 A183 A184 C189 G190L106-A186 HydrophobicContact CD1-CB 3.78Å; L106-A186 VanDerWaalsContact CD1-O 3.29Å; L106-A186 WeakPolarHBondContact CD1-O 3.34Å; A109-A186 HydrophobicContact CB-CB 4.02Å; S182-A186 WeakPolarHBondContact O-CB 3.49Å; S182-A186 PolarHBondContact O-N 3.47Å; A183-A186 WeakPolarHBondContact O-CB 3.17Å; A183-A186 PolarHBondContact O-N 3.1Å; A184-A186 VanDerWaalsContact C-N 3.35Å; A184-A186 PolarHBondContact O-N 2.82Å; A186-C189 PolarHBondContact O-N 2.89Å; A186-G190 PolarHBondContact O-N 2.88Å
187V93.8Very high90Very high95 Ų9541.2 Ų41.258%0.57624%0.24SC*.Hα-helixtrans-61.1-48.5176.3173.10000111.1A183 A184 Q185 C189 G190 L191A183-V187 WeakPolarHBondContact O-CG2 3.43Å; A183-V187 PolarHBondContact O-N 3.26Å; A184-V187 PolarHBondContact O-N 2.94Å; Q185-V187 PolarHBondContact O-N 3.11Å; V187-C189 PolarHBondContact O-N 3.17Å; V187-G190 PolarHBondContact O-N 3.11Å; V187-L191 HydrophobicContact CG1-CD1 4.28Å; V187-L191 WeakPolarHBondContact O-CG 3.34Å; V187-L191 PolarHBondContact O-N 3.3Å
188L90.7Very high89.3Confident41 Ų4141.1 Ų41.122%0.21525%0.245CC..Hα-helixtrans-62.5-42.8179.4-68.4175000112.2V22 L26 A184 Q185 L191 N192V22-L188 HydrophobicContact CG1-CB 4.06Å; V22-L188 HydrophobicContact CG2-CD2 4.36Å; L26-L188 HydrophobicContact CD2-CD1 4.18Å; L26-L188 HydrophobicContact CG-CD1 4.38Å; A184-L188 WeakPolarHBondContact O-CG 3.32Å; A184-L188 PolarHBondContact O-N 3.02Å; Q185-L188 PolarHBondContact O-N 3.43Å; L188-L191 PolarHBondContact O-N 3.21Å; L188-N192 VanDerWaalsContact O-CG 3.29Å; L188-N192 PolarHBondContact O-N 2.86Å; L188-N192 VanDerWaalsContact O-N 3.08Å
189C90.5Very high88.4Confident2 Ų242.1 Ų42.11%0.01426%0.256CS..Hα-helixtrans-63.4-41.2174-75.60000111.8L106 Q185 A186 V187 N192 I193L106-C189 HydrophobicContact CB-CB 4.1Å; Q185-C189 WeakPolarHBondContact O-CB 3.24Å; Q185-C189 PolarHBondContact O-N 3.26Å; Q185-C189 PolarHBondContact O-SG 2.87Å; Q185-C189 VanDerWaalsContact O-SG 3.41Å; A186-C189 PolarHBondContact O-N 2.89Å; V187-C189 PolarHBondContact O-N 3.17Å; C189-N192 WeakPolarHBondContact O-CB 3.3Å; C189-N192 PolarHBondContact O-N 2.93Å; C189-I193 WeakPolarHBondContact O-CG1 3.28Å; C189-I193 PolarHBondContact O-N 2.92Å
190G89.6Confident87.6Confident22 Ų2242.3 Ų42.323%0.22725%0.254CS..Hα-helixtrans-60.6-45.9175.800000112.8A186 V187 N192 I193 L194A186-G190 PolarHBondContact O-N 2.88Å; V187-G190 PolarHBondContact O-N 3.11Å; G190-N192 VanDerWaalsContact C-N 3.29Å; G190-N192 PolarHBondContact O-N 3.43Å; G190-I193 WeakPolarHBondContact O-CB 2.99Å; G190-I193 PolarHBondContact O-N 2.93Å; G190-L194 PolarHBondContact O-N 2.9Å; G190-L194 VanDerWaalsContact O-N 3.14Å
191L88.9Confident86.5Confident79 Ų7942 Ų4241%0.41426%0.257SS..Hα-helixtrans-61.8-37.3174.5-66.9174.3000111.8Y18 V187 L188 L194 N195Y18-L191 WeakPolarHBondContact OH-CB 3.45Å; V187-L191 HydrophobicContact CG1-CD1 4.28Å; V187-L191 WeakPolarHBondContact O-CG 3.34Å; V187-L191 PolarHBondContact O-N 3.3Å; L188-L191 PolarHBondContact O-N 3.21Å; L191-L194 PolarHBondContact O-N 2.87Å; L191-N195 PolarHBondContact O-N 3.11Å; L191-N195 PolarHBondContact O-ND2 3.08Å; L191-N195 VanDerWaalsContact O-ND2 3.11Å
192N87.2Confident85.3Confident1 Ų146.4 Ų46.41%0.00528%0.284CS..Hα-helixtrans-66.5-35.1175.1-71.5-13.3000113.1Y18 V22 F79 L188 C189 G190 N195 S196Y18-N192 WeakPolarHBondContact CE1-OD1 3.23Å; Y18-N192 PolarHBondContact OH-OD1 3.39Å; V22-N192 WeakPolarHBondContact CG1-ND2 3.48Å; F79-N192 WeakPolarHBondContact CE2-ND2 3.28Å; F79-N192 HydrophobicContact CZ-CB 4.38Å; F79-N192 VanDerWaalsContact CZ-ND2 3.32Å; F79-N192 WeakPolarHBondContact CZ-ND2 3.44Å; L188-N192 VanDerWaalsContact O-CG 3.29Å; L188-N192 PolarHBondContact O-N 2.86Å; L188-N192 VanDerWaalsContact O-N 3.08Å; C189-N192 WeakPolarHBondContact O-CB 3.3Å; C189-N192 PolarHBondContact O-N 2.93Å; G190-N192 VanDerWaalsContact C-N 3.29Å; G190-N192 PolarHBondContact O-N 3.43Å; N192-N195 PolarHBondContact O-N 3.44Å; N192-S196 WeakPolarHBondContact O-CB 3.48Å; N192-S196 PolarHBondContact O-N 3.15Å; N192-S196 PolarHBondContact O-OG 3.36Å
193I87.8Confident83.7Confident27 Ų2748.1 Ų48.114%0.13830%0.301CS..Hα-helixtrans-62.4-49173.7-67.5164.2000109.6L106 C189 G190 N195 S196 L197L106-I193 HydrophobicContact CB-CD1 4.26Å; L106-I193 HydrophobicContact CD2-CD1 3.72Å; C189-I193 WeakPolarHBondContact O-CG1 3.28Å; C189-I193 PolarHBondContact O-N 2.92Å; G190-I193 WeakPolarHBondContact O-CB 2.99Å; G190-I193 PolarHBondContact O-N 2.93Å; I193-N195 VanDerWaalsContact C-N 3.34Å; I193-N195 PolarHBondContact O-N 3.08Å; I193-S196 WeakPolarHBondContact O-CB 3.09Å; I193-S196 PolarHBondContact O-N 3.2Å; I193-S196 VanDerWaalsContact O-N 3.1Å; I193-L197 HydrophobicContact CG2-CD1 3.92Å; I193-L197 HydrophobicContact CG2-CG 4.28Å; I193-L197 VanDerWaalsContact O-CG 3.32Å; I193-L197 WeakPolarHBondContact O-CG 3.42Å; I193-L197 PolarHBondContact O-N 2.81Å
194L85.9Confident81.6Confident104 Ų10451.6 Ų51.655%0.54531%0.31SS..Hα-helixtrans-57.4-46.6177.3-65.5175.9000111.7G190 L191 S196 L197 V198G190-L194 PolarHBondContact O-N 2.9Å; G190-L194 VanDerWaalsContact O-N 3.14Å; L191-L194 PolarHBondContact O-N 2.87Å; L194-S196 VanDerWaalsContact C-N 3.3Å; L194-S196 PolarHBondContact O-N 3.42Å; L194-L197 PolarHBondContact O-N 3.29Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.47Å
195N82.4Confident79.1Confident74 Ų7453.5 Ų53.540%0.39633%0.333SS..Hα-helixtrans-61.8-38176.8-73.3-37.2000112.5Y18 L191 N192 I193 G199Y18-N195 WeakPolarHBondContact CE1-ND2 3.37Å; L191-N195 PolarHBondContact O-N 3.11Å; L191-N195 PolarHBondContact O-ND2 3.08Å; L191-N195 VanDerWaalsContact O-ND2 3.11Å; N192-N195 PolarHBondContact O-N 3.44Å; I193-N195 VanDerWaalsContact C-N 3.34Å; I193-N195 PolarHBondContact O-N 3.08Å; N195-G199 PolarHBondContact O-N 3.33Å
196S81.1Confident76.8Confident5 Ų559.4 Ų59.44%0.03536%0.363CS..Hα-helixtrans-69.3-39.8177.4-58.70000111.8N192 I193 L194 G199 L200N192-S196 WeakPolarHBondContact O-CB 3.48Å; N192-S196 PolarHBondContact O-N 3.15Å; N192-S196 PolarHBondContact O-OG 3.36Å; I193-S196 WeakPolarHBondContact O-CB 3.09Å; I193-S196 PolarHBondContact O-N 3.2Å; I193-S196 VanDerWaalsContact O-N 3.1Å; L194-S196 VanDerWaalsContact C-N 3.3Å; L194-S196 PolarHBondContact O-N 3.42Å; S196-G199 PolarHBondContact O-N 2.84Å; S196-L200 WeakPolarHBondContact O-CG 3.38Å; S196-L200 PolarHBondContact O-N 3.26Å
197L81.6Confident73.7Confident90 Ų9068.8 Ų68.847%0.47140%0.395SS..Hα-helixtrans-64.4-45.7176.3-70.5172.2000111.6I193 L194 G199 L200 V201I193-L197 HydrophobicContact CG2-CD1 3.92Å; I193-L197 HydrophobicContact CG2-CG 4.28Å; I193-L197 VanDerWaalsContact O-CG 3.32Å; I193-L197 WeakPolarHBondContact O-CG 3.42Å; I193-L197 PolarHBondContact O-N 2.81Å; L194-L197 PolarHBondContact O-N 3.29Å; L197-G199 VanDerWaalsContact C-N 3.28Å; L197-G199 PolarHBondContact O-N 3.29Å; L197-L200 PolarHBondContact O-N 3.39Å; L197-L200 VanDerWaalsContact O-N 3.13Å; L197-V201 WeakPolarHBondContact O-CG2 3.01Å; L197-V201 PolarHBondContact O-N 3.47Å
198V78.2Confident71.2Confident91 Ų9173.6 Ų73.655%0.55243%0.428SS*.Hα-helixtrans-59.4-42.5174173.70000110.4L194 L200 V201 V202L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.47Å; V198-L200 VanDerWaalsContact C-N 3.33Å; V198-L200 PolarHBondContact O-N 3.02Å; V198-V201 PolarHBondContact O-N 3.14Å; V198-V202 HydrophobicContact CG1-CG2 4.07Å; V198-V202 WeakPolarHBondContact O-CB 3.36Å; V198-V202 VanDerWaalsContact O-CG2 3.3Å; V198-V202 WeakPolarHBondContact O-CG2 3.26Å; V198-V202 PolarHBondContact O-N 3.33Å
199G72.1Confident70.3Confident24 Ų2475.3 Ų75.325%0.24744%0.439CS..Hα-helixtrans-61.1-37.6174.900000113.8N195 S196 L197 G203N195-G199 PolarHBondContact O-N 3.33Å; S196-G199 PolarHBondContact O-N 2.84Å; L197-G199 VanDerWaalsContact C-N 3.28Å; L197-G199 PolarHBondContact O-N 3.29Å; G199-G203 WeakPolarHBondContact O-CA 3.25Å; G199-G203 PolarHBondContact O-N 3.36Å
200L74Confident69.2Low23 Ų2379.1 Ų79.112%0.1246%0.461CS..Hα-helixtrans-70-43.1176.4-75169.6000112.2M95 F96 S196 L197 V198 Q204M95-L200 HydrophobicContact CB-CD2 3.82Å; M95-L200 HydrophobicContact CB-CG 4.26Å; F96-L200 HydrophobicContact CD1-CD1 4.2Å; F96-L200 HydrophobicContact CD2-CD2 3.81Å; F96-L200 HydrophobicContact CE1-CD1 3.99Å; F96-L200 HydrophobicContact CE1-CD2 4.46Å; F96-L200 HydrophobicContact CE2-CD2 3.63Å; F96-L200 HydrophobicContact CG-CD2 4.28Å; F96-L200 HydrophobicContact CZ-CD1 4.2Å; F96-L200 HydrophobicContact CZ-CD2 3.99Å; S196-L200 WeakPolarHBondContact O-CG 3.38Å; S196-L200 PolarHBondContact O-N 3.26Å; L197-L200 PolarHBondContact O-N 3.39Å; L197-L200 VanDerWaalsContact O-N 3.13Å; V198-L200 VanDerWaalsContact C-N 3.33Å; V198-L200 PolarHBondContact O-N 3.02Å; L200-Q204 WeakPolarHBondContact O-CG 3.43Å; L200-Q204 PolarHBondContact O-N 3.33Å
201V72.2Confident68.1Low105 Ų10582.3 Ų82.364%0.63647%0.474SS*.Hα-helixtrans-69.4-50-179.9174.70000111.1L197 V198 G203 Q204L197-V201 WeakPolarHBondContact O-CG2 3.01Å; L197-V201 PolarHBondContact O-N 3.47Å; V198-V201 PolarHBondContact O-N 3.14Å; V201-G203 VanDerWaalsContact C-N 3.29Å; V201-G203 PolarHBondContact O-N 3.02Å; V201-Q204 WeakPolarHBondContact O-CB 3.18Å; V201-Q204 PolarHBondContact O-N 3.28Å
202V67Low66.8Low101 Ų10182.5 Ų82.561%0.61248%0.478SS*.Hα-helixtrans-67.5-32.8179.5177.40000111.1V198 Q204 G205V198-V202 HydrophobicContact CG1-CG2 4.07Å; V198-V202 WeakPolarHBondContact O-CB 3.36Å; V198-V202 VanDerWaalsContact O-CG2 3.3Å; V198-V202 WeakPolarHBondContact O-CG2 3.26Å; V198-V202 PolarHBondContact O-N 3.33Å; V202-Q204 PolarHBondContact O-N 3.39Å; V202-G205 PolarHBondContact O-N 3.41Å
203G58.7Low65.6Low35 Ų3587.6 Ų87.636%0.36151%0.507SS..G310 helixtrans-65.6-13172.300000114.6G199 V201G199-G203 WeakPolarHBondContact O-CA 3.25Å; G199-G203 PolarHBondContact O-N 3.36Å; V201-G203 VanDerWaalsContact C-N 3.29Å; V201-G203 PolarHBondContact O-N 3.02Å
204Q50.6Low64.1Low115 Ų11591.6 Ų91.654%0.53753%0.532SS..G310 helixtrans-78.4-18.9174.4-52-151.6-16.600113.6L200 V201 V202 I206L200-Q204 WeakPolarHBondContact O-CG 3.43Å; L200-Q204 PolarHBondContact O-N 3.33Å; V201-Q204 WeakPolarHBondContact O-CB 3.18Å; V201-Q204 PolarHBondContact O-N 3.28Å; V202-Q204 PolarHBondContact O-N 3.39Å; Q204-I206 VanDerWaalsContact C-N 3.35Å
205G42.6Very low62.5Low72 Ų7290.7 Ų90.774%0.74253%0.531SS*.G310 helixtrans-83.3-4.8-179.600000115.1V202V202-G205 PolarHBondContact O-N 3.41Å
206I44.8Very low61Low123 Ų12392 Ų9263%0.63154%0.541SS*.  trans-110.278.3175-49.4176.8000107Q204Q204-I206 VanDerWaalsContact C-N 3.35Å
207R28.6Very low59.3Low215 Ų21599.3 Ų99.381%0.81158%0.583SS**  trans-83.1132.5158.6-72.7-172.3-176.5-152.72107.2
208P41.4Very low57.3Low197 Ų197100.1 Ų100.1100%1.27959%0.594SS**  trans-61.6016628.9-33000110.9

Retrieved 208 of 208 residues in 284.8 ms (Link to these results)

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