A0A077ZA06_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZA06, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 189 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
1M56.6Low69.4Low243 Ų243125 Ų125100%1.19765%0.647SS**  0116.10-69.1167.717300107.7
2I58.5Low69.7Low162 Ų162129.2 Ų129.283%0.83165%0.648SS**PPolyproline II helixtrans-91.5119.5176-59.2172.9000106.5S4I2-S4 PolarHBondContact O-N 2.96Å
3P61.1Low70.2Confident80 Ų80129.2 Ų129.252%0.51964%0.641SS.*PPolyproline II helixtrans-61.4125.117225.6-32.5000108.6I5 I8P3-I5 PolarHBondContact O-N 3.32Å; P3-I8 HydrophobicContact CB-CD1 4.47Å; P3-I8 HydrophobicContact CG-CD1 4.05Å; P3-I8 HydrophobicContact CG-CG1 4.5Å
4S73.4Confident70.4Confident78 Ų78130.4 Ų130.455%0.54564%0.635SS.*PPolyproline II helixtrans-56.5134.4-179.4-1720000109.7I2 L6 S7I2-S4 PolarHBondContact O-N 2.96Å; S4-L6 PolarHBondContact O-N 3.18Å; S4-S7 VanDerWaalsContact O-CB 3.27Å; S4-S7 WeakPolarHBondContact O-CB 3.37Å; S4-S7 PolarHBondContact O-N 3.34Å
5I73.7Confident70.6Confident127 Ų127129.3 Ų129.365%0.65163%0.633SS**Hα-helixtrans-54-34.8-170.8-63.1169.8000111.5P3 S7 I8 M9P3-I5 PolarHBondContact O-N 3.32Å; I5-S7 VanDerWaalsContact C-N 3.29Å; I5-S7 PolarHBondContact O-N 2.78Å; I5-I8 PolarHBondContact O-N 3.47Å; I5-M9 HydrophobicContact CG2-CG 4.43Å; I5-M9 HydrophobicContact CG2-SD 4.33Å; I5-M9 WeakPolarHBondContact O-CG 3.07Å; I5-M9 PolarHBondContact O-N 3.23Å
6L72.7Confident70.8Confident135 Ų135128.9 Ų128.971%0.70763%0.629SS**Hα-helixtrans-55.5-38.4174.1-66169.8000113.3S4 M9 Y10S4-L6 PolarHBondContact O-N 3.18Å; L6-M9 PolarHBondContact O-N 3.06Å; L6-Y10 WeakPolarHBondContact O-CB 3.44Å; L6-Y10 PolarHBondContact O-N 3.4Å
7S73.1Confident71.1Confident65 Ų65126.8 Ų126.846%0.45562%0.621SS.*Hα-helixtrans-67.1-42.2178.2-169.10000111.5S4 I5 M9 Y10 E11S4-S7 VanDerWaalsContact O-CB 3.27Å; S4-S7 WeakPolarHBondContact O-CB 3.37Å; S4-S7 PolarHBondContact O-N 3.34Å; I5-S7 VanDerWaalsContact C-N 3.29Å; I5-S7 PolarHBondContact O-N 2.78Å; S7-M9 VanDerWaalsContact C-N 3.35Å; S7-M9 PolarHBondContact O-N 3.26Å; S7-Y10 PolarHBondContact O-N 2.82Å; S7-E11 PolarHBondContact O-N 3.24Å
8I71.2Confident71.5Confident84 Ų84125.6 Ų125.643%0.43162%0.618SS.*Hα-helixtrans-66.1-39.2176.6-60.7162.8000110.8P3 I5 R12P3-I8 HydrophobicContact CB-CD1 4.47Å; P3-I8 HydrophobicContact CG-CD1 4.05Å; P3-I8 HydrophobicContact CG-CG1 4.5Å; I5-I8 PolarHBondContact O-N 3.47Å; I8-R12 PolarHBondContact O-N 3.36Å; I8-R12 VanDerWaalsContact O-N 3.07Å
9M73.9Confident71.9Confident125 Ų125123.9 Ų123.962%0.61662%0.616SS**Hα-helixtrans-66.8-38.5175.1-69.9-173.971.100112.4I5 L6 S7 R12 K13I5-M9 HydrophobicContact CG2-CG 4.43Å; I5-M9 HydrophobicContact CG2-SD 4.33Å; I5-M9 WeakPolarHBondContact O-CG 3.07Å; I5-M9 PolarHBondContact O-N 3.23Å; L6-M9 PolarHBondContact O-N 3.06Å; S7-M9 VanDerWaalsContact C-N 3.35Å; S7-M9 PolarHBondContact O-N 3.26Å; M9-R12 PolarHBondContact O-N 3Å; M9-K13 WeakPolarHBondContact O-CB 3.39Å; M9-K13 PolarHBondContact O-N 2.83Å
10Y75.4Confident72.4Confident166 Ų166124.7 Ų124.765%0.65162%0.615SS**Hα-helixtrans-68.1-45178.6-161.9-91.4000111.7L6 S7 R12 K13 R14L6-Y10 WeakPolarHBondContact O-CB 3.44Å; L6-Y10 PolarHBondContact O-N 3.4Å; S7-Y10 PolarHBondContact O-N 2.82Å; Y10-R12 PolarHBondContact O-N 3.39Å; Y10-K13 PolarHBondContact O-N 3.33Å; Y10-R14 WeakPolarHBondContact O-CB 3.46Å; Y10-R14 PolarHBondContact O-N 3.36Å
11E73.7Confident72.8Confident110 Ų110121 Ų12151%0.51461%0.605SS.*Hα-helixtrans-57.4-46.7172.5-78.6-65.4147.500111.8S7 K13 R14 L15S7-E11 PolarHBondContact O-N 3.24Å; E11-K13 PolarHBondContact O-N 3.25Å; E11-R14 PolarHBondContact O-N 2.94Å; E11-L15 WeakPolarHBondContact O-CB 3.36Å; E11-L15 PolarHBondContact O-N 2.67Å
12R73.1Confident74.2Confident175 Ų175111.2 Ų111.266%0.6657%0.566SS**Hα-helixtrans-60.6-46.6176.1-80.3-167.5176-154.50.2112.8I8 M9 Y10 R14 L15 E16I8-R12 PolarHBondContact O-N 3.36Å; I8-R12 VanDerWaalsContact O-N 3.07Å; M9-R12 PolarHBondContact O-N 3Å; Y10-R12 PolarHBondContact O-N 3.39Å; R12-R14 VanDerWaalsContact C-N 3.3Å; R12-R14 PolarHBondContact O-N 3.45Å; R12-L15 PolarHBondContact O-N 3.38Å; R12-E16 WeakPolarHBondContact O-CG 3.35Å; R12-E16 PolarHBondContact O-N 2.83Å
13K76.2Confident75.5Confident129 Ų129108.4 Ų108.456%0.56155%0.552SS**Hα-helixtrans-61.9-40.9179.1-174172.2-178.8178.40111.5M9 Y10 E11 L15 E16 D17M9-K13 WeakPolarHBondContact O-CB 3.39Å; M9-K13 PolarHBondContact O-N 2.83Å; Y10-K13 PolarHBondContact O-N 3.33Å; E11-K13 PolarHBondContact O-N 3.25Å; K13-L15 VanDerWaalsContact C-N 3.34Å; K13-L15 PolarHBondContact O-N 3.32Å; K13-E16 PolarHBondContact O-N 2.68Å; K13-D17 PolarHBondContact O-N 3.17Å
14R73.1Confident76.9Confident146 Ų146107.9 Ų107.955%0.55155%0.547SS*.Hα-helixtrans-64.2-38.7176.5-157.8177.7-168.7-150.80.2112.1Y10 E11 R12 D17 D18Y10-R14 WeakPolarHBondContact O-CB 3.46Å; Y10-R14 PolarHBondContact O-N 3.36Å; E11-R14 PolarHBondContact O-N 2.94Å; R12-R14 VanDerWaalsContact C-N 3.3Å; R12-R14 PolarHBondContact O-N 3.45Å; R14-D17 PolarHBondContact O-N 2.81Å; R14-D18 WeakPolarHBondContact O-CB 3.49Å; R14-D18 PolarHBondContact O-N 3.05Å
15L73.4Confident77.7Confident115 Ų115109.3 Ų109.360%0.60255%0.548SS*.Hα-helixtrans-67.8-35.8175-147.176.9000112.5E11 R12 K13 T19E11-L15 WeakPolarHBondContact O-CB 3.36Å; E11-L15 PolarHBondContact O-N 2.67Å; R12-L15 PolarHBondContact O-N 3.38Å; K13-L15 VanDerWaalsContact C-N 3.34Å; K13-L15 PolarHBondContact O-N 3.32Å; L15-T19 WeakPolarHBondContact O-CB 3.16Å; L15-T19 VanDerWaalsContact O-CG2 3.29Å; L15-T19 WeakPolarHBondContact O-CG2 3.35Å; L15-T19 PolarHBondContact O-N 3.32Å; L15-T19 PolarHBondContact O-OG1 3.49Å
16E74.6Confident78.5Confident123 Ų123108.4 Ų108.458%0.57554%0.544SS*.Hα-helixtrans-67-44.3172.1-74.5172.7-176.500111.6R12 K13 T19 F20R12-E16 WeakPolarHBondContact O-CG 3.35Å; R12-E16 PolarHBondContact O-N 2.83Å; K13-E16 PolarHBondContact O-N 2.68Å; E16-T19 WeakPolarHBondContact CA-OG1 3.43Å; E16-T19 PolarHBondContact O-N 3.11Å; E16-T19 PolarHBondContact O-OG1 3.1Å; E16-T19 VanDerWaalsContact O-OG1 3.07Å; E16-F20 VanDerWaalsContact O-CB 3.29Å; E16-F20 WeakPolarHBondContact O-CB 3.35Å; E16-F20 PolarHBondContact O-N 2.78Å
17D75.7Confident79.3Confident93 Ų93105.3 Ų105.350%0.49753%0.533SS..Hα-helixtrans-64-43.4175.7-72.8-33.6000111.7K13 R14 F20 A21K13-D17 PolarHBondContact O-N 3.17Å; R14-D17 PolarHBondContact O-N 2.81Å; D17-F20 PolarHBondContact O-N 3.05Å; D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.33Å; D17-A21 PolarHBondContact O-N 2.71Å
18D78.2Confident80.2Confident105 Ų105105.5 Ų105.556%0.56153%0.531SS*.Hα-helixtrans-66.5-39.5177.4-80.2-21.3000112.2R14 G22R14-D18 WeakPolarHBondContact O-CB 3.49Å; R14-D18 PolarHBondContact O-N 3.05Å; D18-G22 PolarHBondContact O-N 3.25Å
19T78.9Confident81.2Confident93 Ų93106.8 Ų106.857%0.57154%0.537SS*.Hα-helixtrans-71.5-3617650.20000112.2L15 E16 G22 L23L15-T19 WeakPolarHBondContact O-CB 3.16Å; L15-T19 VanDerWaalsContact O-CG2 3.29Å; L15-T19 WeakPolarHBondContact O-CG2 3.35Å; L15-T19 PolarHBondContact O-N 3.32Å; L15-T19 PolarHBondContact O-OG1 3.49Å; E16-T19 WeakPolarHBondContact CA-OG1 3.43Å; E16-T19 PolarHBondContact O-N 3.11Å; E16-T19 PolarHBondContact O-OG1 3.1Å; E16-T19 VanDerWaalsContact O-OG1 3.07Å; T19-G22 PolarHBondContact O-N 3.06Å; T19-L23 WeakPolarHBondContact O-CB 3.45Å; T19-L23 PolarHBondContact O-N 3.17Å
20F81.3Confident82.1Confident140 Ų140104.4 Ų104.461%0.61453%0.529SS*.Hα-helixtrans-65.3-45.9172.1-175.4-99.7000111.6E16 D17 G22 L23 V24E16-F20 VanDerWaalsContact O-CB 3.29Å; E16-F20 WeakPolarHBondContact O-CB 3.35Å; E16-F20 PolarHBondContact O-N 2.78Å; D17-F20 PolarHBondContact O-N 3.05Å; F20-G22 PolarHBondContact O-N 3.09Å; F20-L23 PolarHBondContact O-N 2.67Å; F20-V24 HydrophobicContact CD1-CG2 4.18Å; F20-V24 HydrophobicContact CE1-CG2 3.83Å; F20-V24 HydrophobicContact CZ-CG2 4.01Å; F20-V24 WeakPolarHBondContact O-CG2 3.44Å; F20-V24 PolarHBondContact O-N 2.7Å
21A82.3Confident83Confident47 Ų47100.3 Ų100.339%0.38852%0.521SS..Hα-helixtrans-60-43.7174.500000111.8D17 L23 V24 L25D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.33Å; D17-A21 PolarHBondContact O-N 2.71Å; A21-L23 PolarHBondContact O-N 3.47Å; A21-V24 PolarHBondContact O-N 3.31Å; A21-L25 WeakPolarHBondContact O-CB 3.21Å; A21-L25 WeakPolarHBondContact O-CG 3.18Å; A21-L25 PolarHBondContact O-N 2.82Å
22G85.1Confident83.9Confident37 Ų37101 Ų10138%0.38152%0.523SS..Hα-helixtrans-60.5-41.5174.200000113.2D18 T19 F20 L25 L26D18-G22 PolarHBondContact O-N 3.25Å; T19-G22 PolarHBondContact O-N 3.06Å; F20-G22 PolarHBondContact O-N 3.09Å; G22-L25 PolarHBondContact O-N 2.82Å; G22-L26 WeakPolarHBondContact O-CB 3.5Å; G22-L26 PolarHBondContact O-N 3.22Å
23L86.4Confident84.9Confident104 Ų10496.9 Ų96.955%0.54552%0.517SS..Hα-helixtrans-66.3-43176-174.467.9000111.8T19 F20 A21 L26 C27T19-L23 WeakPolarHBondContact O-CB 3.45Å; T19-L23 PolarHBondContact O-N 3.17Å; F20-L23 PolarHBondContact O-N 2.67Å; A21-L23 PolarHBondContact O-N 3.47Å; L23-L26 PolarHBondContact O-N 2.78Å; L23-C27 WeakPolarHBondContact O-CB 3.39Å; L23-C27 PolarHBondContact O-N 3.08Å; L23-C27 PolarHBondContact O-SG 3.3Å; L23-C27 VanDerWaalsContact O-SG 3.36Å
24V89.3Confident85.7Confident68 Ų6895.8 Ų95.841%0.41252%0.516SS..Hα-helixtrans-62.2-44175.2170.90000110.9F20 A21 C27 T28F20-V24 HydrophobicContact CD1-CG2 4.18Å; F20-V24 HydrophobicContact CE1-CG2 3.83Å; F20-V24 HydrophobicContact CZ-CG2 4.01Å; F20-V24 WeakPolarHBondContact O-CG2 3.44Å; F20-V24 PolarHBondContact O-N 2.7Å; A21-V24 PolarHBondContact O-N 3.31Å; V24-C27 PolarHBondContact O-N 3.16Å; V24-T28 WeakPolarHBondContact O-CG2 3.43Å; V24-T28 PolarHBondContact O-N 3.47Å; V24-T28 PolarHBondContact O-OG1 3.18Å
25L90.1Very high86.6Confident108 Ų10897 Ų9757%0.56552%0.52SS*.Hα-helixtrans-60.9-45.2174.6-75169.4000111.7A21 G22 C27 T28 M29A21-L25 WeakPolarHBondContact O-CB 3.21Å; A21-L25 WeakPolarHBondContact O-CG 3.18Å; A21-L25 PolarHBondContact O-N 2.82Å; G22-L25 PolarHBondContact O-N 2.82Å; L25-C27 PolarHBondContact O-N 2.88Å; L25-T28 WeakPolarHBondContact CA-OG1 3.34Å; L25-T28 PolarHBondContact O-N 3.34Å; L25-T28 PolarHBondContact O-OG1 2.75Å; L25-M29 WeakPolarHBondContact O-CG 3.3Å; L25-M29 PolarHBondContact O-N 3.5Å
26L90.3Very high87.4Confident109 Ų10993 Ų9357%0.57150%0.502SS*.Hα-helixtrans-62.3-43.1177.4-171.3143.9000111.8G22 L23 M29 V30G22-L26 WeakPolarHBondContact O-CB 3.5Å; G22-L26 PolarHBondContact O-N 3.22Å; L23-L26 PolarHBondContact O-N 2.78Å; L26-M29 PolarHBondContact O-N 2.81Å; L26-V30 HydrophobicContact CD2-CG2 4.29Å; L26-V30 WeakPolarHBondContact O-CG2 3.38Å; L26-V30 PolarHBondContact O-N 3.36Å
27C90.9Very high88.1Confident69 Ų6990.9 Ų90.947%0.46650%0.5SS..Hα-helixtrans-61.2-44.6174.6-75.70000112.6L23 V24 L25 V30 V31L23-C27 WeakPolarHBondContact O-CB 3.39Å; L23-C27 PolarHBondContact O-N 3.08Å; L23-C27 PolarHBondContact O-SG 3.3Å; L23-C27 VanDerWaalsContact O-SG 3.36Å; V24-C27 PolarHBondContact O-N 3.16Å; L25-C27 PolarHBondContact O-N 2.88Å; C27-V30 PolarHBondContact O-N 3Å; C27-V31 WeakPolarHBondContact O-CG2 3.21Å; C27-V31 PolarHBondContact O-N 2.79Å
28T91.2Very high88.6Confident69 Ų6989.1 Ų89.142%0.42350%0.498SS..Hα-helixtrans-65.6-38.1177.256.20000112.2V24 L25 V31 F32V24-T28 WeakPolarHBondContact O-CG2 3.43Å; V24-T28 PolarHBondContact O-N 3.47Å; V24-T28 PolarHBondContact O-OG1 3.18Å; L25-T28 WeakPolarHBondContact CA-OG1 3.34Å; L25-T28 PolarHBondContact O-N 3.34Å; L25-T28 PolarHBondContact O-OG1 2.75Å; T28-V31 PolarHBondContact O-N 3.2Å; T28-F32 WeakPolarHBondContact O-CB 3.31Å; T28-F32 PolarHBondContact O-N 3.4Å
29M91.8Very high88.8Confident111 Ų11189.7 Ų89.755%0.54750%0.497SS..Hα-helixtrans-62.8-42.7173.2-71.4-61.6114.400112.5L25 L26 F32 V33L25-M29 WeakPolarHBondContact O-CG 3.3Å; L25-M29 PolarHBondContact O-N 3.5Å; L26-M29 PolarHBondContact O-N 2.81Å; M29-F32 PolarHBondContact O-N 2.82Å; M29-V33 WeakPolarHBondContact O-CG2 3.35Å; M29-V33 PolarHBondContact O-N 3.49Å
30V93.3Very high88.9Confident75 Ų7592.3 Ų92.346%0.45550%0.501SS..Hα-helixtrans-62.5-45.6175.6170.20000111.1L26 C27 F32 V33 I34L26-V30 HydrophobicContact CD2-CG2 4.29Å; L26-V30 WeakPolarHBondContact O-CG2 3.38Å; L26-V30 PolarHBondContact O-N 3.36Å; C27-V30 PolarHBondContact O-N 3Å; V30-F32 VanDerWaalsContact C-N 3.34Å; V30-F32 PolarHBondContact O-N 3.42Å; V30-V33 PolarHBondContact O-N 2.81Å; V30-I34 HydrophobicContact CG1-CD1 3.8Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.4Å; V30-I34 PolarHBondContact O-N 2.82Å
31V93.4Very high88.7Confident80 Ų8089.5 Ų89.549%0.48550%0.499SS..Hα-helixtrans-62.4-40.4176.4171.80000111.6C27 T28 I34 R35C27-V31 WeakPolarHBondContact O-CG2 3.21Å; C27-V31 PolarHBondContact O-N 2.79Å; T28-V31 PolarHBondContact O-N 3.2Å; V31-I34 PolarHBondContact O-N 2.96Å; V31-R35 PolarHBondContact O-N 3.23Å
32F94.1Very high88.2Confident126 Ų12692.9 Ų92.955%0.55351%0.507SS*.Hα-helixtrans-62.8-47.9176-177.2-101.8000111.7T28 M29 V30 I34 R35 C36T28-F32 WeakPolarHBondContact O-CB 3.31Å; T28-F32 PolarHBondContact O-N 3.4Å; M29-F32 PolarHBondContact O-N 2.82Å; V30-F32 VanDerWaalsContact C-N 3.34Å; V30-F32 PolarHBondContact O-N 3.42Å; F32-I34 VanDerWaalsContact C-N 3.33Å; F32-I34 PolarHBondContact O-N 2.92Å; F32-R35 PolarHBondContact O-N 3.42Å; F32-R35 VanDerWaalsContact O-N 3.17Å; F32-C36 PolarHBondContact O-N 2.86Å; F32-C36 PolarHBondContact O-SG 3.17Å; F32-C36 VanDerWaalsContact O-SG 3.42Å
33V93.6Very high87.5Confident87 Ų8797 Ų9753%0.52752%0.516SS..Hα-helixtrans-60.8-41.5176.2170.70000111.5M29 V30 C36 C37M29-V33 WeakPolarHBondContact O-CG2 3.35Å; M29-V33 PolarHBondContact O-N 3.49Å; V30-V33 PolarHBondContact O-N 2.81Å; V33-C36 PolarHBondContact O-N 3.47Å; V33-C37 WeakPolarHBondContact O-CB 3.32Å; V33-C37 PolarHBondContact O-N 2.94Å; V33-C37 PolarHBondContact O-SG 2.91Å
34I93.7Very high86.4Confident106 Ų10699.2 Ų99.254%0.54452%0.523SS..Hα-helixtrans-61.7-44.6175.3-69.1165.5000110.8V30 V31 F32 C37 A38V30-I34 HydrophobicContact CG1-CD1 3.8Å; V30-I34 VanDerWaalsContact O-CG1 3.27Å; V30-I34 WeakPolarHBondContact O-CG1 3.4Å; V30-I34 PolarHBondContact O-N 2.82Å; V31-I34 PolarHBondContact O-N 2.96Å; F32-I34 VanDerWaalsContact C-N 3.33Å; F32-I34 PolarHBondContact O-N 2.92Å; I34-C37 PolarHBondContact O-N 3.41Å; I34-A38 WeakPolarHBondContact O-CB 3.4Å; I34-A38 PolarHBondContact O-N 3.29Å
35R91.3Very high85.1Confident171 Ų171100.5 Ų100.565%0.64553%0.528SS*.Hα-helixtrans-62.9-48.8176.1-80.8-173.4164.7170.2-3.5112.4V31 F32 C37 A38 E39V31-R35 PolarHBondContact O-N 3.23Å; F32-R35 PolarHBondContact O-N 3.42Å; F32-R35 VanDerWaalsContact O-N 3.17Å; R35-C37 VanDerWaalsContact C-N 3.27Å; R35-C37 PolarHBondContact O-N 3.06Å; R35-A38 CarbonylContact O-C 3.57Å; R35-A38 WeakPolarHBondContact O-CB 3.43Å; R35-A38 PolarHBondContact O-N 2.93Å; R35-E39 WeakPolarHBondContact O-CG 3.33Å; R35-E39 PolarHBondContact O-N 3.36Å
36C90.2Very high83.7Confident32 Ų3299.4 Ų99.422%0.21652%0.523CS..Hα-helixtrans-61.6-33.7176.7-670000112.9F32 V33 K40F32-C36 PolarHBondContact O-N 2.86Å; F32-C36 PolarHBondContact O-SG 3.17Å; F32-C36 VanDerWaalsContact O-SG 3.42Å; V33-C36 PolarHBondContact O-N 3.47Å; C36-K40 WeakPolarHBondContact O-CB 3.45Å; C36-K40 VanDerWaalsContact O-CG 3.31Å; C36-K40 WeakPolarHBondContact O-CG 3.45Å; C36-K40 PolarHBondContact O-N 2.88Å
37C89.3Confident82.2Confident79 Ų7998.8 Ų98.853%0.53452%0.52SS..Hα-helixtrans-68.6-40.5172.4-75.70000112.1V33 I34 R35 S41V33-C37 WeakPolarHBondContact O-CB 3.32Å; V33-C37 PolarHBondContact O-N 2.94Å; V33-C37 PolarHBondContact O-SG 2.91Å; I34-C37 PolarHBondContact O-N 3.41Å; R35-C37 VanDerWaalsContact C-N 3.27Å; R35-C37 PolarHBondContact O-N 3.06Å; C37-S41 VanDerWaalsContact O-CB 3.28Å; C37-S41 WeakPolarHBondContact O-CB 3.32Å; C37-S41 PolarHBondContact O-N 3.25Å
38A86.3Confident80.5Confident56 Ų5696.7 Ų96.746%0.46351%0.51SS..Hα-helixtrans-65.3-45.1175.200000111.8I34 R35 S41 Q42I34-A38 WeakPolarHBondContact O-CB 3.4Å; I34-A38 PolarHBondContact O-N 3.29Å; R35-A38 CarbonylContact O-C 3.57Å; R35-A38 WeakPolarHBondContact O-CB 3.43Å; R35-A38 PolarHBondContact O-N 2.93Å; A38-S41 WeakPolarHBondContact O-CB 3.35Å; A38-S41 PolarHBondContact O-N 3.33Å; A38-Q42 WeakPolarHBondContact O-CB 3.28Å; A38-Q42 PolarHBondContact O-N 3.45Å
39E82.8Confident78.7Confident116 Ų11696.2 Ų96.254%0.54251%0.505SS..Hα-helixtrans-61.4-47.1175.6-73.6171.1179.800111.9R35 S41 Q42 Q43R35-E39 WeakPolarHBondContact O-CG 3.33Å; R35-E39 PolarHBondContact O-N 3.36Å; E39-S41 VanDerWaalsContact C-N 3.3Å; E39-S41 PolarHBondContact O-N 3.18Å; E39-Q42 PolarHBondContact O-N 3.4Å; E39-Q43 WeakPolarHBondContact O-CB 3.49Å; E39-Q43 PolarHBondContact O-N 3.39Å
40K80.5Confident76.9Confident148 Ų14897.6 Ų97.664%0.64351%0.51SS*.Hα-helixtrans-61.3-38.7174.3-77.3176178.8174.90112.2C36 H44C36-K40 WeakPolarHBondContact O-CB 3.45Å; C36-K40 VanDerWaalsContact O-CG 3.31Å; C36-K40 WeakPolarHBondContact O-CG 3.45Å; C36-K40 PolarHBondContact O-N 2.88Å; K40-H44 WeakPolarHBondContact O-CB 3.41Å; K40-H44 PolarHBondContact O-N 2.95Å
41S75.9Confident75Confident81 Ų81104.5 Ų104.557%0.56653%0.528SS*.Hα-helixtrans-64.8-43.1174.6-171.50000111.5C37 A38 E39 H44 N45C37-S41 VanDerWaalsContact O-CB 3.28Å; C37-S41 WeakPolarHBondContact O-CB 3.32Å; C37-S41 PolarHBondContact O-N 3.25Å; A38-S41 WeakPolarHBondContact O-CB 3.35Å; A38-S41 PolarHBondContact O-N 3.33Å; E39-S41 VanDerWaalsContact C-N 3.3Å; E39-S41 PolarHBondContact O-N 3.18Å; S41-H44 PolarHBondContact O-N 2.95Å; S41-N45 WeakPolarHBondContact O-CB 3.35Å; S41-N45 PolarHBondContact O-N 2.87Å
42Q73.5Confident73.1Confident119 Ų119108 Ų10856%0.55654%0.536SS*.Hα-helixtrans-66.4-41.5176.7-172.6177.32.200111.8A38 E39 N45 N46A38-Q42 WeakPolarHBondContact O-CB 3.28Å; A38-Q42 PolarHBondContact O-N 3.45Å; E39-Q42 PolarHBondContact O-N 3.4Å; Q42-N45 CarbonylContact O-C 3.58Å; Q42-N45 PolarHBondContact O-N 3.39Å; Q42-N46 WeakPolarHBondContact O-CB 3.27Å; Q42-N46 VanDerWaalsContact O-CG 3.32Å; Q42-N46 PolarHBondContact O-N 3Å
43Q69.4Low71.2Confident123 Ų123109.5 Ų109.558%0.57554%0.542SS*.Hα-helixtrans-65.6-41.4175.6-164.1-177.326.500111.3E39 N45 N46 N47E39-Q43 WeakPolarHBondContact O-CB 3.49Å; E39-Q43 PolarHBondContact O-N 3.39Å; Q43-N45 VanDerWaalsContact C-N 3.33Å; Q43-N46 PolarHBondContact O-N 2.91Å; Q43-N47 WeakPolarHBondContact O-CB 3.32Å; Q43-N47 PolarHBondContact O-N 3.37Å
44H64.2Low69.1Low150 Ų150114.2 Ų114.269%0.69456%0.559SS**Hα-helixtrans-66.7-33.9172.6-173.9-86.7000112.2K40 S41 G48K40-H44 WeakPolarHBondContact O-CB 3.41Å; K40-H44 PolarHBondContact O-N 2.95Å; S41-H44 PolarHBondContact O-N 2.95Å; H44-G48 WeakPolarHBondContact O-CA 3.38Å; H44-G48 PolarHBondContact O-N 3.4Å
45N61.8Low66.8Low96 Ų96112.3 Ų112.351%0.51356%0.559SS.*Hα-helixtrans-71.8-36.2174.2-161.419.4000111.7S41 Q42 Q43 N49S41-N45 WeakPolarHBondContact O-CB 3.35Å; S41-N45 PolarHBondContact O-N 2.87Å; Q42-N45 CarbonylContact O-C 3.58Å; Q42-N45 PolarHBondContact O-N 3.39Å; Q43-N45 VanDerWaalsContact C-N 3.33Å; N45-N49 WeakPolarHBondContact O-CB 3.3Å; N45-N49 PolarHBondContact O-N 3.26Å
46N60.2Low65Low85 Ų85106.2 Ų106.246%0.45555%0.549SS..Hα-helixtrans-69.5-48175.4-75.9-10.4000111.8Q42 Q43 G48 N49 Q50Q42-N46 WeakPolarHBondContact O-CB 3.27Å; Q42-N46 VanDerWaalsContact O-CG 3.32Å; Q42-N46 PolarHBondContact O-N 3Å; Q43-N46 PolarHBondContact O-N 2.91Å; N46-G48 VanDerWaalsContact C-N 3.34Å; N46-G48 PolarHBondContact O-N 3.36Å; N46-N49 CarbonylContact O-C 3.36Å; N46-N49 PolarHBondContact O-N 3.44Å; N46-Q50 PolarHBondContact O-N 3.45Å
47N58.1Low62.9Low96 Ų96110.5 Ų110.551%0.51358%0.577SS.*Hα-helixtrans-67.4-36.2175.2-70.31.4000111.5Q43 N49 Q50 R51Q43-N47 WeakPolarHBondContact O-CB 3.32Å; Q43-N47 PolarHBondContact O-N 3.37Å; N47-N49 VanDerWaalsContact C-N 3.34Å; N47-Q50 PolarHBondContact O-N 3.44Å; N47-R51 PolarHBondContact O-N 2.89Å; N47-R51 VanDerWaalsContact O-N 3.08Å
48G56.7Low61.1Low25 Ų25115.2 Ų115.226%0.25860%0.596SS.*Hα-helixtrans-64.5-35.7170.800000112.9H44 N46 K52H44-G48 WeakPolarHBondContact O-CA 3.38Å; H44-G48 PolarHBondContact O-N 3.4Å; N46-G48 VanDerWaalsContact C-N 3.34Å; N46-G48 PolarHBondContact O-N 3.36Å; G48-K52 WeakPolarHBondContact O-CB 3.33Å; G48-K52 VanDerWaalsContact O-CG 3.3Å; G48-K52 WeakPolarHBondContact O-CG 3.45Å; G48-K52 PolarHBondContact O-N 3.34Å
49N53.2Low59.3Low59 Ų59120.1 Ų120.132%0.31661%0.609SS.*Hα-helixtrans-74-33.2171.8-101.7-16.9000112.3N45 N46 N47 R51 K52 K53N45-N49 WeakPolarHBondContact O-CB 3.3Å; N45-N49 PolarHBondContact O-N 3.26Å; N46-N49 CarbonylContact O-C 3.36Å; N46-N49 PolarHBondContact O-N 3.44Å; N47-N49 VanDerWaalsContact C-N 3.34Å; N49-R51 VanDerWaalsContact C-N 3.34Å; N49-K52 CarbonylContact O-C 3.6Å; N49-K52 PolarHBondContact O-N 3.32Å; N49-K52 VanDerWaalsContact O-N 3.09Å; N49-K53 WeakPolarHBondContact O-CA 3.42Å; N49-K53 WeakPolarHBondContact O-CB 3.43Å; N49-K53 WeakPolarHBondContact O-CG 3.38Å; N49-K53 PolarHBondContact O-N 3.29Å
50Q54.6Low57.8Low139 Ų139123.7 Ų123.765%0.6563%0.626SS**Hα-helixtrans-62.8-44171.9-72.8-170.63.300110.6N46 N47 K52 K53 Q54N46-Q50 PolarHBondContact O-N 3.45Å; N47-Q50 PolarHBondContact O-N 3.44Å; Q50-K52 PolarHBondContact O-N 2.93Å; Q50-K53 PolarHBondContact O-N 3.48Å; Q50-Q54 PolarHBondContact O-N 3.46Å; Q50-Q54 VanDerWaalsContact O-N 3.11Å
51R52.6Low55.9Low221 Ų221127.8 Ų127.883%0.83464%0.637SS**Hα-helixtrans-63.5-21.8171.1-104.8-176.6169.9-177.8-2.8114.8N47 N49N47-R51 PolarHBondContact O-N 2.89Å; N47-R51 VanDerWaalsContact O-N 3.08Å; N49-R51 VanDerWaalsContact C-N 3.34Å
52K54Low54.6Low153 Ų153128.7 Ų128.767%0.66564%0.643SS**Hα-helixtrans-104-3.8177.2-72.3178.5179.5179.10115G48 N49 Q50G48-K52 WeakPolarHBondContact O-CB 3.33Å; G48-K52 VanDerWaalsContact O-CG 3.3Å; G48-K52 WeakPolarHBondContact O-CG 3.45Å; G48-K52 PolarHBondContact O-N 3.34Å; N49-K52 CarbonylContact O-C 3.6Å; N49-K52 PolarHBondContact O-N 3.32Å; N49-K52 VanDerWaalsContact O-N 3.09Å; Q50-K52 PolarHBondContact O-N 2.93Å
53K53.6Low53.9Low157 Ų157132 Ų13268%0.68366%0.656SS**Hα-helixtrans-106.7-20.6176-72.6-175.9179.1-167.20112N49 Q50 A55N49-K53 WeakPolarHBondContact O-CA 3.42Å; N49-K53 WeakPolarHBondContact O-CB 3.43Å; N49-K53 WeakPolarHBondContact O-CG 3.38Å; N49-K53 PolarHBondContact O-N 3.29Å; Q50-K53 PolarHBondContact O-N 3.48Å; K53-A55 VanDerWaalsContact C-N 3.29Å
54Q50.1Low53.1Low186 Ų186131.7 Ų131.787%0.86967%0.665SS**SBendtrans-70.3-29.2158.9-75.4-170.9-12.100112Q50 G56Q50-Q54 PolarHBondContact O-N 3.46Å; Q50-Q54 VanDerWaalsContact O-N 3.11Å; Q54-G56 VanDerWaalsContact C-N 3.26Å; Q54-G56 PolarHBondContact O-N 3.45Å; Q54-G56 VanDerWaalsContact O-N 3.17Å
55A45.6Very low52.5Low66 Ų66128.6 Ų128.655%0.54566%0.66SS.*SBendtrans-81.277.8158.100000108.7K53K53-A55 VanDerWaalsContact C-N 3.29Å
56G52.5Low52.1Low43 Ų43131.7 Ų131.744%0.44367%0.666SS.*  trans-56.3-177.4165.300000111.3Q54 L58Q54-G56 VanDerWaalsContact C-N 3.26Å; Q54-G56 PolarHBondContact O-N 3.45Å; Q54-G56 VanDerWaalsContact O-N 3.17Å; G56-L58 PolarHBondContact O-N 2.92Å; G56-L58 VanDerWaalsContact O-N 3.16Å
57P47Very low51.7Low122 Ų122133.8 Ų133.879%0.79268%0.675SS**  trans-47.8132.6166.7-21.332.3000108.5E59P57-E59 PolarHBondContact O-N 3.36Å
58L51.1Low51.4Low178 Ų178131.1 Ų131.193%0.93267%0.67SS**  trans-66.872.7152.4-88149.2000106G56 E60G56-L58 PolarHBondContact O-N 2.92Å; G56-L58 VanDerWaalsContact O-N 3.16Å; L58-E60 PolarHBondContact O-N 2.9Å
59E48Very low51Low159 Ų159138.8 Ų138.874%0.74369%0.692SS**  trans-46.7135135.6-76.1-168.4135.900105.6P57 R61P57-E59 PolarHBondContact O-N 3.36Å; E59-R61 PolarHBondContact O-N 3.36Å
60E50.6Low50.9Low191 Ų191139.5 Ų139.589%0.89370%0.695SS**  trans-63.183.1167.3-66.2179119.400106.9L58 S62L58-E60 PolarHBondContact O-N 2.9Å; E60-S62 PolarHBondContact O-N 2.98Å
61R42.2Very low50.8Low235 Ų235138.7 Ų138.789%0.88769%0.691SS**  trans-65.189.5165.7-160.6176.9-164.9-179.24.9103.7E59 K63E59-R61 PolarHBondContact O-N 3.36Å; R61-K63 PolarHBondContact O-N 2.91Å
62S48.8Very low50.9Low99 Ų99132.9 Ų132.969%0.69268%0.68SS**  trans-39.9119.7179.344.10000106.1E60E60-S62 PolarHBondContact O-N 2.98Å
63K56.9Low50.9Low188 Ų188129.7 Ų129.782%0.81767%0.669SS**  trans-46.4123.9176.3-63.2174.5-176.1173.70104.7R61 S65R61-K63 PolarHBondContact O-N 2.91Å; K63-S65 PolarHBondContact O-N 3.06Å
64P52.9Low51Low118 Ų118130.2 Ų130.277%0.76667%0.667SS**  trans-54.4115.3176.322.5-31.7000104.8Y66P64-Y66 PolarHBondContact O-N 3.33Å
65S51.5Low51.2Low85 Ų85128.3 Ų128.359%0.59466%0.658SS**  trans-74.877.2-170.2-170.60000107.8K63 I67 G68K63-S65 PolarHBondContact O-N 3.06Å; S65-I67 PolarHBondContact O-N 2.98Å; S65-I67 VanDerWaalsContact O-N 3.17Å; S65-G68 PolarHBondContact O-N 3.49Å; S65-G68 VanDerWaalsContact O-N 3.1Å
66Y53.5Low51.7Low161 Ų161128.4 Ų128.463%0.63165%0.654SS**THydrogen-bonded Turntrans-65.8-15.5-179.5-160.7-102.7000110.8P64 R69 I70P64-Y66 PolarHBondContact O-N 3.33Å; Y66-R69 PolarHBondContact O-N 3.38Å; Y66-I70 HydrophobicContact CD1-CD1 3.7Å; Y66-I70 HydrophobicContact CD1-CG1 4.16Å; Y66-I70 HydrophobicContact CE1-CD1 3.85Å; Y66-I70 HydrophobicContact CE1-CG1 4.04Å; Y66-I70 WeakPolarHBondContact O-CD1 3.38Å; Y66-I70 WeakPolarHBondContact O-CG1 3.34Å; Y66-I70 PolarHBondContact O-N 3.12Å
67I53Low51.8Low128 Ų128132.7 Ų132.766%0.65666%0.663SS**Hα-helixtrans-64.8-40172.9-60.2170.4000110.6S65 R69S65-I67 PolarHBondContact O-N 2.98Å; S65-I67 VanDerWaalsContact O-N 3.17Å; I67-R69 VanDerWaalsContact C-N 3.34Å; I67-R69 PolarHBondContact O-N 2.97Å
68G50.9Low52.2Low40 Ų40132.9 Ų132.941%0.41265%0.653SS.*Hα-helixtrans-80.1-3.4-179.800000116S65S65-G68 PolarHBondContact O-N 3.49Å; S65-G68 VanDerWaalsContact O-N 3.1Å
69R49.3Very low52.3Low187 Ų187129.3 Ų129.371%0.70664%0.639SS**Hα-helixtrans-103.5-18.5172.2-66.9-169-175.2-170.11113.1Y66 I67 I73Y66-R69 PolarHBondContact O-N 3.38Å; I67-R69 VanDerWaalsContact C-N 3.34Å; I67-R69 PolarHBondContact O-N 2.97Å; R69-I73 WeakPolarHBondContact O-CD1 3.39Å; R69-I73 WeakPolarHBondContact O-CG1 3.37Å; R69-I73 PolarHBondContact O-N 2.86Å
70I50.8Low52.6Low73 Ų73124.9 Ų124.937%0.37463%0.63SS.*Hα-helixtrans-72.5-34.3175.1-67.8165.2000110.5Y66 I73 R74Y66-I70 HydrophobicContact CD1-CD1 3.7Å; Y66-I70 HydrophobicContact CD1-CG1 4.16Å; Y66-I70 HydrophobicContact CE1-CD1 3.85Å; Y66-I70 HydrophobicContact CE1-CG1 4.04Å; Y66-I70 WeakPolarHBondContact O-CD1 3.38Å; Y66-I70 WeakPolarHBondContact O-CG1 3.34Å; Y66-I70 PolarHBondContact O-N 3.12Å; I70-I73 CarbonylContact O-C 3.52Å; I70-I73 PolarHBondContact O-N 3.42Å; I70-R74 WeakPolarHBondContact O-CB 3.39Å; I70-R74 PolarHBondContact O-N 2.88Å
71E52.6Low52.7Low122 Ų122120.9 Ų120.957%0.5761%0.614SS**Hα-helixtrans-63.9-43.8177.4-71.5172.7166.600112I73 R74 E75E71-I73 VanDerWaalsContact C-N 3.28Å; E71-I73 PolarHBondContact O-N 3.46Å; E71-R74 WeakPolarHBondContact O-CA 3.46Å; E71-R74 WeakPolarHBondContact O-CB 3.42Å; E71-R74 PolarHBondContact O-N 3.23Å; E71-E75 PolarHBondContact O-N 2.88Å
72V53.7Low53.1Low99 Ų99117.5 Ų117.560%0.661%0.609SS**Hα-helixtrans-64.4-31.2175.1-172.60000112.4S76V72-S76 WeakPolarHBondContact O-CB 3.29Å; V72-S76 PolarHBondContact O-N 2.92Å; V72-S76 PolarHBondContact O-OG 3.46Å
73I53.9Low53.1Low86 Ų86121.4 Ų121.444%0.44162%0.616SS.*Hα-helixtrans-78.2-26.6173.4-63.6168.1000111.2R69 I70 E71 S76 Q77R69-I73 WeakPolarHBondContact O-CD1 3.39Å; R69-I73 WeakPolarHBondContact O-CG1 3.37Å; R69-I73 PolarHBondContact O-N 2.86Å; I70-I73 CarbonylContact O-C 3.52Å; I70-I73 PolarHBondContact O-N 3.42Å; E71-I73 VanDerWaalsContact C-N 3.28Å; E71-I73 PolarHBondContact O-N 3.46Å; I73-S76 WeakPolarHBondContact CA-OG 3.46Å; I73-S76 PolarHBondContact O-OG 3.47Å; I73-Q77 HydrophobicContact CG2-CG 4.48Å; I73-Q77 WeakPolarHBondContact O-CB 3.29Å; I73-Q77 WeakPolarHBondContact O-CG 3.39Å; I73-Q77 PolarHBondContact O-N 3Å
74R55.4Low52.7Low169 Ų169117.4 Ų117.464%0.63861%0.608SS**Hα-helixtrans-71.4-50.4175-125.5176.1-167.61583111.3I70 E71 S76 Q77 Q78I70-R74 WeakPolarHBondContact O-CB 3.39Å; I70-R74 PolarHBondContact O-N 2.88Å; E71-R74 WeakPolarHBondContact O-CA 3.46Å; E71-R74 WeakPolarHBondContact O-CB 3.42Å; E71-R74 PolarHBondContact O-N 3.23Å; R74-S76 VanDerWaalsContact C-N 3.3Å; R74-S76 PolarHBondContact O-N 2.89Å; R74-Q77 PolarHBondContact O-N 3.4Å; R74-Q78 WeakPolarHBondContact O-CB 3.48Å; R74-Q78 PolarHBondContact O-N 3.31Å
75E55Low52.6Low145 Ų145118.7 Ų118.768%0.67861%0.606SS**Hα-helixtrans-65.2-34.4-179.5-67.6-178.3156.900112.2E71 T79E71-E75 PolarHBondContact O-N 2.88Å; E75-T79 PolarHBondContact O-N 3.19Å; E75-T79 PolarHBondContact O-OG1 3.33Å
76S57.3Low52.3Low68 Ų68121.6 Ų121.648%0.47662%0.615SS.*Hα-helixtrans-78.6-23.6175.555.50000114.8V72 I73 R74 A80V72-S76 WeakPolarHBondContact O-CB 3.29Å; V72-S76 PolarHBondContact O-N 2.92Å; V72-S76 PolarHBondContact O-OG 3.46Å; I73-S76 WeakPolarHBondContact CA-OG 3.46Å; I73-S76 PolarHBondContact O-OG 3.47Å; R74-S76 VanDerWaalsContact C-N 3.3Å; R74-S76 PolarHBondContact O-N 2.89Å; S76-A80 WeakPolarHBondContact O-CB 3.27Å
77Q53.5Low52.1Low133 Ų133123.9 Ų123.962%0.62163%0.628SS**Hα-helixtrans-84.8-30.4168.7-75.8-173.23.200112.9I73 R74 A80 N81I73-Q77 HydrophobicContact CG2-CG 4.48Å; I73-Q77 WeakPolarHBondContact O-CB 3.29Å; I73-Q77 WeakPolarHBondContact O-CG 3.39Å; I73-Q77 PolarHBondContact O-N 3Å; R74-Q77 PolarHBondContact O-N 3.4Å; Q77-A80 PolarHBondContact O-N 2.92Å; Q77-N81 WeakPolarHBondContact O-CB 3.45Å; Q77-N81 PolarHBondContact O-N 3.43Å
78Q55Low51.7Low127 Ų127126.6 Ų126.659%0.59364%0.638SS**Hα-helixtrans-75-36-176.6-164.3159.5-7.800111.6R74 A80R74-Q78 WeakPolarHBondContact O-CB 3.48Å; R74-Q78 PolarHBondContact O-N 3.31Å; Q78-A80 VanDerWaalsContact C-N 3.34Å
79T53.4Low51.3Low103 Ų103129.9 Ų129.963%0.63266%0.655SS**Hα-helixtrans-72.9-22.2169.847.10000114E75E75-T79 PolarHBondContact O-N 3.19Å; E75-T79 PolarHBondContact O-OG1 3.33Å
80A55Low51.1Low66 Ų66127.7 Ų127.755%0.54566%0.662SS.*Hα-helixtrans-86.8-12.3177.500000114.4S76 Q77 Q78S76-A80 WeakPolarHBondContact O-CB 3.27Å; Q77-A80 PolarHBondContact O-N 2.92Å; Q78-A80 VanDerWaalsContact C-N 3.34Å
81N51.7Low50.6Low106 Ų106132.9 Ų132.957%0.56769%0.685SS**Hα-helixtrans-109.1-6.3-173.8-15110.6000114.2Q77Q77-N81 WeakPolarHBondContact O-CB 3.45Å; Q77-N81 PolarHBondContact O-N 3.43Å
82E52.3Low50.6Low165 Ų165133.2 Ų133.277%0.77170%0.695SS**SBendtrans-85.3-11.2172.8-73.3-171134.600113.9
83Q48.5Very low50.3Low180 Ų180137.2 Ų137.284%0.84171%0.707SS**SBendtrans-91.3-7.5177.5-71.9-164.9-8.100114.9
84T48.5Very low50Low105 Ų105138.3 Ų138.364%0.64473%0.729SS**SBendtrans-105.1-7.6-168.8-4.80000115
85I50.3Low49.8Very low145 Ų145134.8 Ų134.874%0.74474%0.736SS**SBendtrans-11041.5-178.1-40.2-179000111.2
86N46Very low49.6Very low145 Ų145136.9 Ų136.978%0.77574%0.743SS**SBendtrans-153.963.3175.6-141.3-10.2000113.2
87K47.4Very low49.3Very low209 Ų209140.4 Ų140.491%0.90976%0.757SS**  trans-164.950.5173.6-110.7157.3-161.6174.70114
88Q45.1Very low48.7Very low185 Ų185142.3 Ų142.386%0.86477%0.765SS**SBendtrans-143.6104.3164.4-115.11708.200112.9
89S43Very low48.2Very low109 Ų109147.4 Ų147.476%0.76278%0.779SS**  trans47.586.914560.80000119.6
90V44.4Very low48.2Very low142 Ų142146.5 Ų146.586%0.86178%0.775SS**  trans-135.4121.3133.3179.70000108.1
91Q41.9Very low47.8Very low182 Ų182148.9 Ų148.985%0.8578%0.779SS**  trans-75.1135.3165-64171.9-4.300108.4
92V52Low47.6Very low128 Ų128151.3 Ų151.378%0.77678%0.784SS**  trans174.3134.7141.1147.80000109.1
93E47.8Very low47.6Very low183 Ų183149 Ų14986%0.85579%0.786SS**  trans18.5113162.1-59.8-177.611700120.9
94A45.9Very low47.6Very low109 Ų109144.1 Ų144.190%0.90178%0.776SS**  trans-151.3115.9137.100000109.7
95A51.5Low47.6Very low96 Ų96148 Ų14879%0.79379%0.787SS**  trans-94.7132.4177.100000111.6
96K51Low47.3Very low189 Ų189149 Ų14982%0.82279%0.789SS**  trans88.2125.2161.8-60-178.5177.1178.50119.3
97N51.4Low47.2Very low142 Ų142148.9 Ų148.976%0.75979%0.793SS**  trans75.8131.8156.5-52.9-4.9000116.4
98E41.4Very low47.1Very low173 Ų173147.7 Ų147.781%0.80879%0.791SS**  cis-158.5120.45.1-136.3-179.4142.100114.1
99R44.9Very low47.4Very low234 Ų234150.3 Ų150.388%0.88379%0.793SS**  trans59164.3149.7-104-153.8140.2100.5-3.2121.6
100P52.8Low47.7Very low83 Ų83150.6 Ų150.654%0.53979%0.79SS.*  -142.7-171.4-116.745.3-24.6000118.1
101D45.7Very low47.8Very low117 Ų117152.8 Ų152.863%0.62679%0.791SS**  trans70.4148.7149.3-73.6-17.6000119.3
102K47.1Very low48.4Very low156 Ų156151.3 Ų151.368%0.67879%0.788SS**  cis-169.1144.5-3.8-117.8161.8-169.5144.80111.9
103S52.8Low48.8Very low116 Ų116155.3 Ų155.381%0.81180%0.795SS**  trans54.4158.9143.871.20000120.9
104A48.7Very low49.1Very low78 Ų78152 Ų15265%0.64579%0.789SS**  cis-168.4162.910.200000112
105H49Very low49.2Very low187 Ų187151.6 Ų151.687%0.86679%0.786SS**  trans59.4163.3157.4-79.9-101000118
106E43.7Very low49.5Very low167 Ų167153.9 Ų153.978%0.7879%0.785SS**  cis-165.5135.522.5-166.1-178.1146.200111.7
107T44.5Very low49.7Very low141 Ų141152.2 Ų152.287%0.86579%0.785SS**  trans-177.9121.41369.60000114.2
108Q45Very low50Low185 Ų185152.6 Ų152.686%0.86478%0.783SS**  trans-148.9112.3160-161.1179.661.900109.2
109R50.2Low50.9Low239 Ų239150 Ų15090%0.90278%0.78SS**  trans-14296.7173.7-81.9-177.4169.9-179.1-3.4106.6
110V49.3Very low51.3Low116 Ų116142.5 Ų142.570%0.70377%0.768SS**  59.477.579.3-170.50000113.1
111Q46.6Very low51.3Low188 Ų188144.6 Ų144.688%0.87978%0.782SS**  30.1105.4119.7-167.5172.769.300117.6
112L55Low51.8Low151 Ų151142.3 Ų142.379%0.79179%0.787SS**  trans-151.993.8168.8-93.3168.3000109.7
113F60.5Low52Low212 Ų212145.8 Ų145.893%0.9380%0.797SS**  trans-174.8108.5148.5-82.3-53.3000108.1
114P54Low51.9Low113 Ų113145.4 Ų145.473%0.73479%0.794SS**  trans-71162.5175.2-18.833.8000113D116P114-D116 WeakPolarHBondContact CB-OD2 3.5Å
115A47.3Very low52.1Low101 Ų101147.1 Ų147.184%0.83580%0.801SS**  trans-119.3107.8170.700000108.8
116D57.8Low52.8Low143 Ų143143.5 Ų143.577%0.76580%0.796SS**  trans-162.4141.2-178.9-37.4-112000106.6P114P114-D116 WeakPolarHBondContact CB-OD2 3.5Å
117D55.1Low53.5Low155 Ų155142.8 Ų142.883%0.82980%0.797SS**  cis-159.5-176.3-26.9-166.27.8000107.7
118E58.3Low54.2Low150 Ų150141.9 Ų141.970%0.70179%0.791SS**  trans57.4111.2163.4-86.7-92.6113.700119.6
119P60.5Low54.6Low117 Ų117138.9 Ų138.976%0.7679%0.788SS**  trans-81.9115.9164.232.6-30000111.4
120A52.6Low54.9Low77 Ų77134.2 Ų134.264%0.63677%0.774SS**  trans-55.1128-178.400000113.6G122A120-G122 PolarHBondContact O-N 3.49Å
121P53.1Low55.5Low127 Ų127132.6 Ų132.683%0.82577%0.773SS**THydrogen-bonded Turntrans-74.8116.5178.129.8-33.5000110.4
122G56.7Low56.5Low70 Ų70133.5 Ų133.572%0.72277%0.768SS**THydrogen-bonded Turntrans160.7-13.3174.700000117.5A120 S124A120-G122 PolarHBondContact O-N 3.49Å; G122-S124 PolarHBondContact O-N 3.32Å
123Y52.2Low56.8Low229 Ų229133.3 Ų133.390%0.89877%0.768SS**  trans-76.492177.7-78.4-83.9000111.7S125Y123-S125 PolarHBondContact O-N 2.95Å
124S50.3Low56.8Low108 Ų108130.3 Ų130.376%0.75576%0.761SS**  trans-59.7129.4175.549.40000111.8G122 C126G122-S124 PolarHBondContact O-N 3.32Å; S124-C126 PolarHBondContact O-N 2.97Å
125S51.7Low57.4Low113 Ų113130.4 Ų130.479%0.7976%0.762SS**  trans-60.5116.6-173.9-176.50000113.2Y123Y123-S125 PolarHBondContact O-N 2.95Å
126C64.6Low58.1Low112 Ų112134 Ų13476%0.75776%0.763SS**  trans-132.2-0.5164.664.60000113.5S124S124-C126 PolarHBondContact O-N 2.97Å
127L57.2Low58.4Low152 Ų152132.2 Ų132.280%0.79676%0.76SS**SBendtrans-128.169.3-174.1-70.2175.6000112
128T59.5Low59.1Low121 Ų121130.9 Ų130.974%0.74276%0.759SS**  trans-178.1101.4139.918.40000109.7K130T128-K130 PolarHBondContact O-N 3.48Å
129P54.5Low58.8Low123 Ų123128.3 Ų128.380%0.79976%0.758SS**  trans-57129.5156.4-18.732.2000108.2A131P129-A131 PolarHBondContact O-N 2.87Å
130K57Low58.6Low141 Ų141128.7 Ų128.761%0.61376%0.76SS**  trans-54.8111.2-178.5-141.5160.5-179.6174.90108.9T128 W132T128-K130 PolarHBondContact O-N 3.48Å; K130-W132 HydrophobicContact CD-CE3 4.11Å; K130-W132 HydrophobicContact CD-CZ3 4Å; K130-W132 HydrophobicContact CG-CD2 3.87Å; K130-W132 HydrophobicContact CG-CE3 3.55Å; K130-W132 HydrophobicContact CG-CH2 4.02Å; K130-W132 HydrophobicContact CG-CZ2 4.3Å; K130-W132 HydrophobicContact CG-CZ3 3.67Å; K130-W132 PolarHBondContact O-N 3.42Å
131A60.7Low58.5Low82 Ų82133.1 Ų133.168%0.67877%0.768SS**THydrogen-bonded Turntrans-72.821-167.900000114.7P129P129-A131 PolarHBondContact O-N 2.87Å
132W68Low58.4Low206 Ų206135.3 Ų135.378%0.7877%0.767SS**THydrogen-bonded Turntrans-122.6-5.2-163.9-35.1-37.4000112.7K130K130-W132 HydrophobicContact CD-CE3 4.11Å; K130-W132 HydrophobicContact CD-CZ3 4Å; K130-W132 HydrophobicContact CG-CD2 3.87Å; K130-W132 HydrophobicContact CG-CE3 3.55Å; K130-W132 HydrophobicContact CG-CH2 4.02Å; K130-W132 HydrophobicContact CG-CZ2 4.3Å; K130-W132 HydrophobicContact CG-CZ3 3.67Å; K130-W132 PolarHBondContact O-N 3.42Å
133D61.9Low58Low147 Ų147139.5 Ų139.579%0.78677%0.768SS**  trans-103.812.9-177.2-98.9-29.7000114
134L58.9Low58Low149 Ų149134.9 Ų134.978%0.7876%0.764SS**SBendtrans-88.5129.7175.1-73171.5000110.6M136L134-M136 PolarHBondContact O-N 3.07Å
135P67.6Low58Low116 Ų116138.3 Ų138.375%0.75377%0.768SS**PPolyproline II helixtrans-60.5131.4173.326.1-33.4000109.5
136M62.7Low57.8Low176 Ų176143.6 Ų143.687%0.86777%0.77SS**PPolyproline II helixtrans-53.5125-174.4-169.316462.400110.7L134L134-M136 PolarHBondContact O-N 3.07Å
137P64.1Low57.1Low106 Ų106145.2 Ų145.269%0.68877%0.767SS**PPolyproline II helixtrans-63.1140.3-178.825.5-33.7000110.1S139P137-S139 PolarHBondContact O-N 3.27Å
138P68.5Low56.8Low126 Ų126146.4 Ų146.482%0.81877%0.768SS**PPolyproline II helixtrans-61.7137.6-179.825.3-33.9000110.9
139S53.4Low56.6Low97 Ų97150.7 Ų150.768%0.67878%0.776SS**PPolyproline II helixtrans-52.4140.9-171.2-57.50000113.8P137 Q141P137-S139 PolarHBondContact O-N 3.27Å; S139-Q141 VanDerWaalsContact C-N 3.28Å; S139-Q141 PolarHBondContact O-N 2.92Å
140P55.1Low56.5Low124 Ų124153.8 Ų153.881%0.80578%0.777SS**SBendtrans-75.475-179.632.2-36.3000111.7
141Q51.2Low56.5Low171 Ų171153.5 Ų153.580%0.79978%0.783SS**  trans-133.415.7177.8-79.3-169.7-3600114.8S139S139-Q141 VanDerWaalsContact C-N 3.28Å; S139-Q141 PolarHBondContact O-N 2.92Å
142Q51.7Low56.3Low172 Ų172161.6 Ų161.680%0.80480%0.796SS**SBendtrans-1204.5174.4-81-165.1-12.800116T144Q142-T144 PolarHBondContact O-N 2.77Å
143E48.1Very low55.7Low158 Ų158161.3 Ų161.374%0.73880%0.8SS**THydrogen-bonded Turntrans-76.8-17.8178.6-68.3-159.9127.300114.2H147E143-H147 PolarHBondContact O-CD2 3.48Å
144T51.2Low55.4Low132 Ų132159.6 Ų159.681%0.8180%0.795SS**THydrogen-bonded Turntrans-80.9-23.9-172.2-23.90000114.7Q142Q142-T144 PolarHBondContact O-N 2.77Å
145E50.4Low55.3Low180 Ų180162.3 Ų162.384%0.84180%0.8SS**THydrogen-bonded Turntrans-98.1-21.3-170.4-153.5-175.8153.300114.3
146R47.3Very low54.9Low224 Ų224165.3 Ų165.385%0.84580%0.801SS**SBendtrans-85.9-7.8-177.5-86.8-176.6169.4-175.7-1115.4
147H50Low54.5Low146 Ų146163 Ų16368%0.67679%0.793SS**SBendtrans-87.2-17.2-173.9-83.5-100.1000115.3E143E143-H147 PolarHBondContact O-CD2 3.48Å
148E51.6Low54.1Low177 Ų177161.8 Ų161.883%0.82779%0.792SS**G310 helixtrans-76-29.6-171-156.1179.716300114.4K150E148-K150 VanDerWaalsContact C-N 3.27Å; E148-K150 PolarHBondContact O-N 3.21Å
149K54.7Low53.4Low211 Ų211164.8 Ų164.892%0.91779%0.792SS**G310 helixtrans-77.20.6-174.8-72.8179.2179.8168.90115.3
150K53.4Low53.5Low188 Ų188166.7 Ų166.782%0.81779%0.79SS**G310 helixtrans-99.4-2.4-173.8-133.9170.1-173.7173.60115.9E148E148-K150 VanDerWaalsContact C-N 3.27Å; E148-K150 PolarHBondContact O-N 3.21Å
151N56.2Low53.6Low136 Ų136169.5 Ų169.573%0.72779%0.789SS**SBendtrans-97.710.4-169-103.2-18.8000117.6
152R56Low53.8Low251 Ų251166.6 Ų166.695%0.94778%0.783SS**SBendtrans-98.4-2.5-176.9-97.8-177.8175.5-178.8-0.8117.5
153K55.3Low53.7Low200 Ų200168.2 Ų168.287%0.8778%0.782SS**SBendtrans-109.7-0.1-174.9-75.2-173176.6179.10116.9
154T56.9Low54.1Low111 Ų111164 Ų16468%0.68177%0.774SS**SBendtrans-98.4-10.2-172.740.20000115.8K156T154-K156 PolarHBondContact O-N 3.26Å
155K56.4Low54.3Low206 Ų206166.4 Ų166.490%0.89677%0.773SS**THydrogen-bonded Turntrans-80.8-6.7-174-148.3167.6-174.2173.90115.6
156K58Low54.4Low179 Ų179165.5 Ų165.578%0.77877%0.767SS**THydrogen-bonded Turntrans-90.8-18.3-175.2-123.7179.8-176.9-178.90115.8T154T154-K156 PolarHBondContact O-N 3.26Å
157N55Low54.9Low129 Ų129159.1 Ų159.169%0.6975%0.752SS**SBendtrans-98.3-6-171.2-77.8-13.7000116.1
158A55.4Low55.3Low80 Ų80160.2 Ų160.266%0.66176%0.755SS**THydrogen-bonded Turntrans-73.1-39.2177.800000113.2H160A158-H160 PolarHBondContact O-N 3.29Å
159K55.2Low55.5Low188 Ų188160.1 Ų160.182%0.81775%0.752SS**THydrogen-bonded Turntrans-73.9-16-176.2-83.9-172.1173-177.10115.2
160H55.5Low55.6Low138 Ų138154.5 Ų154.564%0.63973%0.732SS**THydrogen-bonded Turntrans-88.8-19.8-179.7-74.6-83.8000114.1A158 T162A158-H160 PolarHBondContact O-N 3.29Å; H160-T162 PolarHBondContact O-N 2.9Å
161K55.6Low55.7Low182 Ų182155.2 Ų155.279%0.79173%0.73SS**THydrogen-bonded Turntrans-75.6-21-172.7-120.1177.7-178.31790114.8
162T55.9Low55.7Low110 Ų110156.3 Ų156.368%0.67573%0.73SS**THydrogen-bonded Turntrans-92.1-20.3177.129.90000114.3H160H160-T162 PolarHBondContact O-N 2.9Å
163R49.6Very low55.8Low207 Ų207152.5 Ų152.578%0.78172%0.72SS**THydrogen-bonded Turntrans-83-33.3-178.4-145.9175-173-168.80.6113K165R163-K165 PolarHBondContact O-N 3.42Å
164A57Low55.7Low68 Ų68148 Ų14856%0.56271%0.71SS**THydrogen-bonded Turntrans-75.4-15.9-177.800000115.3T167A164-T167 PolarHBondContact O-OG1 3.49Å
165K55.5Low55.6Low184 Ų184146.9 Ų146.980%0.871%0.712SS**THydrogen-bonded Turntrans-85.8-19.1176.5-91.9-168.6173.1-172.30114.3R163R163-K165 PolarHBondContact O-N 3.42Å
166K53.1Low55.6Low161 Ų161145.9 Ų145.970%0.771%0.71SS**THydrogen-bonded Turntrans-80.7-44.5175.9-71.5-169172.5-171.50112K168 K169 D170K166-K168 PolarHBondContact O-N 2.96Å; K166-K169 PolarHBondContact O-N 3.01Å; K166-D170 PolarHBondContact O-N 3.19Å
167T57.8Low55.4Low89 Ų89141.3 Ų141.355%0.54671%0.706SS.*Hα-helixtrans-62-20-176.451.20000115.5A164A164-T167 PolarHBondContact O-OG1 3.49Å
168K56.5Low55.3Low169 Ų169139.8 Ų139.874%0.73571%0.705SS**Hα-helixtrans-83.1-20175.4-145178.3-174.7-174.40113.5K166K166-K168 PolarHBondContact O-N 2.96Å
169K57.3Low54.7Low176 Ų176142 Ų14277%0.76571%0.713SS**Hα-helixtrans-88.3-31.4176.7-155.8174.4-174.8-1790112K166K166-K169 PolarHBondContact O-N 3.01Å
170D56.3Low54.4Low92 Ų92141.7 Ų141.749%0.49271%0.711SS.*Hα-helixtrans-79.4-27.4179.1-60.4-41.1000113.4K166 H172 K173 T174K166-D170 PolarHBondContact O-N 3.19Å; D170-H172 PolarHBondContact O-N 3.33Å; D170-H172 VanDerWaalsContact O-N 3.12Å; D170-K173 PolarHBondContact O-N 2.81Å; D170-T174 PolarHBondContact O-OG1 3.48Å
171R55.5Low54.3Low204 Ų204144.4 Ų144.477%0.7772%0.724SS**THydrogen-bonded Turntrans-58.3-25.2177.8-100.3-174.2176.5-178-0.9114.8
172H55.5Low53.7Low158 Ų158145.1 Ų145.173%0.73173%0.727SS**THydrogen-bonded Turntrans-87.7-5.8177.2-72.8-79.2000113.9D170D170-H172 PolarHBondContact O-N 3.33Å; D170-H172 VanDerWaalsContact O-N 3.12Å
173K57.9Low53.8Low172 Ų172149.6 Ų149.675%0.74874%0.737SS**THydrogen-bonded Turntrans-90.5-27.7174.9-72.2-169169.3-167.50113.5D170D170-K173 PolarHBondContact O-N 2.81Å
174T53.8Low53.8Low106 Ų106148.6 Ų148.665%0.6574%0.739SS**G310 helixtrans-85.1-14.5-176.9-20.80000113.7D170 Q176 A177D170-T174 PolarHBondContact O-OG1 3.48Å; T174-Q176 VanDerWaalsContact C-N 3.27Å; T174-Q176 PolarHBondContact O-N 3.07Å; T174-A177 PolarHBondContact O-N 3.25Å
175A55.7Low53.4Low87 Ų87154.2 Ų154.272%0.71975%0.753SS**G310 helixtrans-75.9-5.4-175.900000115
176Q54.8Low53.1Low185 Ų185151.1 Ų151.186%0.86476%0.755SS**G310 helixtrans-101.57.3174.6-71.1-169.2-15.700113.6T174 S178T174-Q176 VanDerWaalsContact C-N 3.27Å; T174-Q176 PolarHBondContact O-N 3.07Å; Q176-S178 PolarHBondContact O-N 3.36Å
177A55.3Low52.5Low83 Ų83151.7 Ų151.769%0.68676%0.76SS**SBendtrans-78.1100.7173.300000110.9T174T174-A177 PolarHBondContact O-N 3.25Å
178S51.3Low52.2Low96 Ų96157.5 Ų157.567%0.67178%0.778SS**  trans-41.7141.5-173.8-159.60000117.3Q176 K180Q176-S178 PolarHBondContact O-N 3.36Å; S178-K180 PolarHBondContact O-N 3.04Å
179P44.4Very low51.5Low128 Ų128162.3 Ų162.383%0.83180%0.799SS**  trans-8299.4175.433.2-32.9000111.9
180K47.7Very low51.2Low180 Ų180161.6 Ų161.678%0.78380%0.8SS**  trans-136108.3164.6-78.5-176.3175.5178.10110.2S178S178-K180 PolarHBondContact O-N 3.04Å
181H53.2Low50.9Low195 Ų195165.3 Ų165.390%0.90382%0.816SS**  -178.6152.7123.5-108.3-88.4000112.8
182K44.3Very low50.7Low198 Ų198163.1 Ų163.186%0.86182%0.819SS**  trans-90.1147.1-177.2-58.7175.8177.3179.40112.8
183K56.6Low50.4Low204 Ų204163.4 Ų163.489%0.88782%0.824SS**  trans-165.4118.2145.9-101.1178.8176.5-173.70105
184K51.1Low49.9Very low185 Ų185162.9 Ų162.980%0.80483%0.829SS**  cis59125.149.7-90-152172.3-1620114.4
185E46.9Very low49.7Very low186 Ų186166.7 Ų166.787%0.86984%0.841SS**  trans66.7145.9174-68.1156.912400116.2
186S49.2Very low49.3Very low120 Ų120172.4 Ų172.484%0.83985%0.85SS**  cis-134.6158.918.954.90000115.9
187E42.3Very low48.8Very low173 Ų173171.4 Ų171.481%0.80885%0.848SS**  trans-87.4150.6-179.1176.5173.1-144.500112.6
188K50.1Low48.3Very low210 Ų210178.8 Ų178.891%0.91386%0.862SS**  trans-159.191155.7-101.8-165.5-177.8-174.30110.7
189K42.5Very low48Very low270 Ų270186.3 Ų186.3100%1.17488%0.879SS**  trans-141.90148.6-94.4-163.4174.3-173.40107.9

Retrieved 189 of 189 residues in 763.8 ms (Link to these results)