A0A060WJX8_ONCMY Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A060WJX8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 265 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
1M60.1Low70.5Confident193 Ų193133.5 Ų133.595%0.95166%0.661SS**  0-18.20-61.9-53.4-122.200113.6W3M1-W3 PolarHBondContact O-N 3.44Å
2E70.9Confident69.4Low159 Ų159131.4 Ų131.474%0.74365%0.653SS**  trans-78.7-16.8-172.2-56.9-174.5159.400115.2V5E2-V5 PolarHBondContact O-N 3.45Å
3W78.4Confident68.3Low208 Ų208129.4 Ų129.479%0.78866%0.655SS**Hα-helixtrans-77.6-31.9-174.2-56.154.3000111.2M1 V5 L6 V7M1-W3 PolarHBondContact O-N 3.44Å; W3-V5 PolarHBondContact O-N 3.21Å; W3-L6 PolarHBondContact O-N 3.31Å; W3-V7 WeakPolarHBondContact O-CG2 3.41Å; W3-V7 PolarHBondContact O-N 3.41Å
4Y79.1Confident67.1Low171 Ų171125.4 Ų125.467%0.67165%0.645SS**Hα-helixtrans-64.9-30.5175.7-66.1-74.3000112.2L8Y4-L8 WeakPolarHBondContact O-CB 3.35Å; Y4-L8 WeakPolarHBondContact O-CG 3.45Å; Y4-L8 PolarHBondContact O-N 3.03Å
5V78.2Confident66.1Low84 Ų84122.7 Ų122.751%0.50964%0.642SS.*Hα-helixtrans-70.6-41.7177.5-176.90000110.6E2 W3 L8 I9E2-V5 PolarHBondContact O-N 3.45Å; W3-V5 PolarHBondContact O-N 3.21Å; V5-L8 PolarHBondContact O-N 2.98Å; V5-I9 HydrophobicContact CG1-CD1 3.88Å; V5-I9 WeakPolarHBondContact O-CD1 3.38Å; V5-I9 VanDerWaalsContact O-CG1 3.23Å; V5-I9 WeakPolarHBondContact O-CG1 3.37Å; V5-I9 PolarHBondContact O-N 3.29Å
6L70.8Confident65.4Low115 Ų115121.9 Ų121.960%0.60264%0.644SS**Hα-helixtrans-66-40.2175.8-68.2172.5000112.2W3 I9 L10W3-L6 PolarHBondContact O-N 3.31Å; L6-I9 PolarHBondContact O-N 3.38Å; L6-L10 PolarHBondContact O-N 3.43Å; L6-L10 VanDerWaalsContact O-N 3.08Å
7V74.8Confident65Low95 Ų95119.5 Ų119.558%0.57663%0.628SS**Hα-helixtrans-64.9-40.5174.8174.60000110.9W3 L10 S11W3-V7 WeakPolarHBondContact O-CG2 3.41Å; W3-V7 PolarHBondContact O-N 3.41Å; V7-L10 PolarHBondContact O-N 3.06Å; V7-S11 WeakPolarHBondContact O-CB 3.21Å; V7-S11 PolarHBondContact O-N 2.98Å; V7-S11 PolarHBondContact O-OG 2.93Å
8L68Low64.6Low101 Ų101116.3 Ų116.353%0.52962%0.622SS.*Hα-helixtrans-62.5-44.9175.4-86.3162.3000112Y4 V5 L10 S11 L12Y4-L8 WeakPolarHBondContact O-CB 3.35Å; Y4-L8 WeakPolarHBondContact O-CG 3.45Å; Y4-L8 PolarHBondContact O-N 3.03Å; V5-L8 PolarHBondContact O-N 2.98Å; L8-L10 PolarHBondContact O-N 2.93Å; L8-S11 WeakPolarHBondContact CA-OG 3.14Å; L8-S11 PolarHBondContact O-N 3.07Å; L8-S11 VanDerWaalsContact O-N 3.16Å; L8-S11 PolarHBondContact O-OG 3.08Å; L8-L12 HydrophobicContact CD2-CD1 4.46Å; L8-L12 WeakPolarHBondContact O-CD1 3.23Å; L8-L12 PolarHBondContact O-N 3.33Å
9I67.2Low64.9Low118 Ų118115 Ų11561%0.60562%0.615SS**Hα-helixtrans-65.2-36179.4-66.1163.2000112.2V5 L6V5-I9 HydrophobicContact CG1-CD1 3.88Å; V5-I9 WeakPolarHBondContact O-CD1 3.38Å; V5-I9 VanDerWaalsContact O-CG1 3.23Å; V5-I9 WeakPolarHBondContact O-CG1 3.37Å; V5-I9 PolarHBondContact O-N 3.29Å; L6-I9 PolarHBondContact O-N 3.38Å
10L64.6Low65.8Low156 Ų156111 Ų11182%0.81760%0.596SS**Hα-helixtrans-76.3-22.1174.9-89.9146.7000113.6L6 V7 L8L6-L10 PolarHBondContact O-N 3.43Å; L6-L10 VanDerWaalsContact O-N 3.08Å; V7-L10 PolarHBondContact O-N 3.06Å; L8-L10 PolarHBondContact O-N 2.93Å
11S63.5Low66.5Low69 Ų69108 Ų10848%0.48358%0.583SS.*Hα-helixtrans-96.6-10.7-177.871.80000114.6V7 L8 P13V7-S11 WeakPolarHBondContact O-CB 3.21Å; V7-S11 PolarHBondContact O-N 2.98Å; V7-S11 PolarHBondContact O-OG 2.93Å; L8-S11 WeakPolarHBondContact CA-OG 3.14Å; L8-S11 PolarHBondContact O-N 3.07Å; L8-S11 VanDerWaalsContact O-N 3.16Å; L8-S11 PolarHBondContact O-OG 3.08Å; S11-P13 WeakPolarHBondContact O-CD 3.01Å
12L57.2Low67.5Low108 Ų108101 Ų10157%0.56555%0.554SS**SBendtrans-78.2103.5167.1-95.476.7000107L8 S14L8-L12 HydrophobicContact CD2-CD1 4.46Å; L8-L12 WeakPolarHBondContact O-CD1 3.23Å; L8-L12 PolarHBondContact O-N 3.33Å; L12-S14 PolarHBondContact O-N 3.41Å; L12-S14 VanDerWaalsContact O-N 3.12Å
13P55.3Low68.1Low105 Ų10597.3 Ų97.368%0.68254%0.536SS*.  trans-56.9126.2165.927.3-32.7000105.9S11 S15S11-P13 WeakPolarHBondContact O-CD 3.01Å; P13-S15 PolarHBondContact O-N 2.99Å
14S50.9Low68.4Low73 Ų7387.6 Ų87.651%0.5150%0.5SS..  trans-42.8105.2176.3-50.60000108L12 T16 Q17L12-S14 PolarHBondContact O-N 3.41Å; L12-S14 VanDerWaalsContact O-N 3.12Å; S14-T16 PolarHBondContact O-N 3.16Å; S14-Q17 VanDerWaalsContact O-CB 3.3Å; S14-Q17 WeakPolarHBondContact O-CB 3.4Å; S14-Q17 PolarHBondContact O-N 3.43Å
15S52.3Low68.5Low86 Ų8683.9 Ų83.960%0.60149%0.491SS*.Hα-helixtrans-58.6-20.4-174.5-60.30000111.5P13 Q17 A18 D19P13-S15 PolarHBondContact O-N 2.99Å; S15-Q17 PolarHBondContact O-N 3.44Å; S15-A18 PolarHBondContact O-N 3.02Å; S15-D19 PolarHBondContact O-N 2.79Å
16T55.4Low68.8Low109 Ų10984.6 Ų84.667%0.66949%0.489SS*.Hα-helixtrans-59.9-26.4169.859.70000114.4S14 C20S14-T16 PolarHBondContact O-N 3.16Å; T16-C20 WeakPolarHBondContact O-CB 3.35Å; T16-C20 PolarHBondContact O-N 2.85Å
17Q57.6Low69.4Low82 Ų8279.3 Ų79.338%0.38346%0.461SS..Hα-helixtrans-79.1-36.9-179.8-171.7176.10.300112.2S14 S15 D19 C20 S21S14-Q17 VanDerWaalsContact O-CB 3.3Å; S14-Q17 WeakPolarHBondContact O-CB 3.4Å; S14-Q17 PolarHBondContact O-N 3.43Å; S15-Q17 PolarHBondContact O-N 3.44Å; Q17-D19 VanDerWaalsContact C-N 3.32Å; Q17-C20 PolarHBondContact O-N 3.06Å; Q17-S21 PolarHBondContact O-N 3.04Å
18A58.5Low69.6Low62 Ų6275.9 Ų75.951%0.51244%0.443SS..Hα-helixtrans-63.6-42.4176.400000110.6S15 S21S15-A18 PolarHBondContact O-N 3.02Å; A18-S21 PolarHBondContact O-OG 3.12Å
19D70.9Confident70.1Confident91 Ų9177.9 Ų77.949%0.48745%0.45SS..Hα-helixtrans-66.9-40.5178.6-62.2-28.1000111.4S15 Q17 S21 S22 H23S15-D19 PolarHBondContact O-N 2.79Å; Q17-D19 VanDerWaalsContact C-N 3.32Å; D19-S21 VanDerWaalsContact C-N 3.33Å; D19-S21 PolarHBondContact O-N 2.92Å; D19-S22 PolarHBondContact O-N 3.29Å; D19-S22 VanDerWaalsContact O-N 3.17Å; D19-S22 PolarHBondContact O-OG 3.16Å; D19-H23 PolarHBondContact O-CD2 3.14Å; D19-H23 PolarHBondContact O-N 3.4Å
20C81.9Confident70.4Confident34 Ų3474.8 Ų74.823%0.2343%0.433CS..Hα-helixtrans-56.3-43.9179.2-156.60000112.7T16 Q17 S22 H23 C24 C47T16-C20 WeakPolarHBondContact O-CB 3.35Å; T16-C20 PolarHBondContact O-N 2.85Å; Q17-C20 PolarHBondContact O-N 3.06Å; C20-S22 PolarHBondContact O-N 2.94Å; C20-H23 PolarHBondContact O-N 2.83Å; C20-C24 PolarHBondContact O-N 3.48Å; C20-C47 HydrophobicContact CB-CB 3.79Å; C20-C47 WeakPolarHBondContact CB-SG 3.19Å; C20-C47 WeakPolarHBondContact SG-CB 3.05Å; C20-C47 CovalentContact SG-SG 2.04Å; C20-C47 PolarHBondContact SG-SG 3.32Å
21S80.9Confident70.6Confident48 Ų4869.1 Ų69.134%0.33640%0.403SS..Hα-helixtrans-63.7-39.5179.873.30000112.7Q17 A18 D19 C24 L25Q17-S21 PolarHBondContact O-N 3.04Å; A18-S21 PolarHBondContact O-OG 3.12Å; D19-S21 VanDerWaalsContact C-N 3.33Å; D19-S21 PolarHBondContact O-N 2.92Å; S21-C24 PolarHBondContact O-N 3.37Å; S21-L25 PolarHBondContact O-N 2.78Å
22S81.9Confident70.4Confident47 Ų4773.3 Ų73.333%0.32942%0.419SS..Hα-helixtrans-69.5-39.217878.40000111.9D19 C20 L25 Q26D19-S22 PolarHBondContact O-N 3.29Å; D19-S22 VanDerWaalsContact O-N 3.17Å; D19-S22 PolarHBondContact O-OG 3.16Å; C20-S22 PolarHBondContact O-N 2.94Å; S22-L25 PolarHBondContact O-N 3.33Å; S22-Q26 WeakPolarHBondContact O-CG 3.37Å; S22-Q26 PolarHBondContact O-N 3.45Å
23H82.3Confident70.6Confident82 Ų8275.1 Ų75.138%0.3843%0.429SS..Hα-helixtrans-65-38.4175.8-74.7-59.8000112.3D19 C20 Q26 C27D19-H23 PolarHBondContact O-CD2 3.14Å; D19-H23 PolarHBondContact O-N 3.4Å; C20-H23 PolarHBondContact O-N 2.83Å; H23-Q26 PolarHBondContact O-N 3.23Å; H23-C27 WeakPolarHBondContact O-CB 3.3Å; H23-C27 PolarHBondContact O-N 3.47Å
24C84.9Confident70.8Confident3 Ų373.2 Ų73.22%0.0242%0.416CS..Hα-helixtrans-62.8-39173.3-80.30000112.7C20 S21 C27 A28 C43 T44 C47C20-C24 PolarHBondContact O-N 3.48Å; S21-C24 PolarHBondContact O-N 3.37Å; C24-C27 WeakPolarHBondContact O-CB 3.49Å; C24-C27 PolarHBondContact O-N 2.86Å; C24-A28 WeakPolarHBondContact O-CB 3.49Å; C24-A28 PolarHBondContact O-N 2.78Å; C24-C43 HydrophobicContact CB-CB 3.68Å; C24-C43 WeakPolarHBondContact CB-SG 3.43Å; C24-C43 WeakPolarHBondContact SG-CB 3.4Å; C24-C43 PolarHBondContact SG-O 3.07Å; C24-C43 VanDerWaalsContact SG-O 3.41Å; C24-C43 CovalentContact SG-SG 2.04Å; C24-C43 PolarHBondContact SG-SG 3Å; C24-T44 HydrophobicContact CB-CG2 4.19Å; C24-C47 PolarHBondContact SG-SG 3.32Å
25L82Confident71.1Confident94 Ų9479.1 Ų79.149%0.49244%0.435SS..Hα-helixtrans-68.1-42.1176.2-71.3175.6000112.2S21 S22 C27 A28 Q29S21-L25 PolarHBondContact O-N 2.78Å; S22-L25 PolarHBondContact O-N 3.33Å; L25-C27 VanDerWaalsContact C-N 3.33Å; L25-C27 PolarHBondContact O-N 3.24Å; L25-A28 PolarHBondContact O-N 3.48Å; L25-Q29 WeakPolarHBondContact O-CG 3.5Å; L25-Q29 PolarHBondContact O-N 3.43Å; L25-Q29 VanDerWaalsContact O-N 3.1Å
26Q83.6Confident71.8Confident99 Ų9979.1 Ų79.146%0.46343%0.428SS..Hα-helixtrans-63-40.6175.2-71.1179.14.300111.7S22 H23 Q29 Q30S22-Q26 WeakPolarHBondContact O-CG 3.37Å; S22-Q26 PolarHBondContact O-N 3.45Å; H23-Q26 PolarHBondContact O-N 3.23Å; Q26-Q29 PolarHBondContact O-N 3.01Å; Q26-Q30 WeakPolarHBondContact O-CG 3.44Å; Q26-Q30 PolarHBondContact O-N 3.38Å
27C83.5Confident72.5Confident3 Ų378.8 Ų78.82%0.0243%0.428CS..Hα-helixtrans-59.2-46.6171.8-110.10000112.5H23 C24 L25 Q29 Q30 I31 C60 T63H23-C27 WeakPolarHBondContact O-CB 3.3Å; H23-C27 PolarHBondContact O-N 3.47Å; C24-C27 WeakPolarHBondContact O-CB 3.49Å; C24-C27 PolarHBondContact O-N 2.86Å; L25-C27 VanDerWaalsContact C-N 3.33Å; L25-C27 PolarHBondContact O-N 3.24Å; C27-Q29 PolarHBondContact O-N 3.34Å; C27-Q30 PolarHBondContact O-N 3.24Å; C27-I31 PolarHBondContact O-N 3.17Å; C27-C60 HydrophobicContact CB-CB 3.82Å; C27-C60 WeakPolarHBondContact CB-SG 3.41Å; C27-C60 VanDerWaalsContact SG-C 3.59Å; C27-C60 WeakPolarHBondContact SG-CA 3.48Å; C27-C60 WeakPolarHBondContact SG-CB 3.33Å; C27-C60 PolarHBondContact SG-O 3.37Å; C27-C60 VanDerWaalsContact SG-O 3.38Å; C27-C60 CovalentContact SG-SG 2.02Å; C27-C60 PolarHBondContact SG-SG 3.49Å; C27-T63 PolarHBondContact SG-OG1 3.31Å; C27-T63 VanDerWaalsContact SG-OG1 3.39Å
28A80.4Confident73.4Confident24 Ų2475.7 Ų75.720%0.19841%0.414CS..Hα-helixtrans-63.1-33-177.700000112.8C24 L25 Q30 I31C24-A28 WeakPolarHBondContact O-CB 3.49Å; C24-A28 PolarHBondContact O-N 2.78Å; L25-A28 PolarHBondContact O-N 3.48Å; A28-Q30 VanDerWaalsContact C-N 3.34Å; A28-I31 VanDerWaalsContact CA-CD1 3.48Å; A28-I31 HydrophobicContact CB-CD1 4.19Å; A28-I31 WeakPolarHBondContact O-CB 3.31Å; A28-I31 WeakPolarHBondContact O-CD1 3.15Å; A28-I31 WeakPolarHBondContact O-CG1 3.4Å
29Q78.2Confident74.5Confident143 Ų14376.7 Ų76.767%0.66841%0.411SS*.Hα-helixtrans-71.2-29.8173.8-69.4177.9-4.200112.6L25 Q26 C27 I31L25-Q29 WeakPolarHBondContact O-CG 3.5Å; L25-Q29 PolarHBondContact O-N 3.43Å; L25-Q29 VanDerWaalsContact O-N 3.1Å; Q26-Q29 PolarHBondContact O-N 3.01Å; C27-Q29 PolarHBondContact O-N 3.34Å; Q29-I31 VanDerWaalsContact C-N 3.33Å
30Q72Confident75Confident52 Ų5274 Ų7424%0.24340%0.399CS..Hα-helixtrans-79.3-11.7179.7-69.6175.822.900113.9Q26 C27 A28 L32 N33Q26-Q30 WeakPolarHBondContact O-CG 3.44Å; Q26-Q30 PolarHBondContact O-N 3.38Å; C27-Q30 PolarHBondContact O-N 3.24Å; A28-Q30 VanDerWaalsContact C-N 3.34Å; Q30-L32 PolarHBondContact O-N 3.41Å; Q30-N33 PolarHBondContact O-N 3.26Å; Q30-N33 VanDerWaalsContact O-N 3.1Å
31I68.9Low75Confident37 Ų3777.8 Ų77.819%0.1942%0.417CS..G310 helixtrans-58.9-26.9173.2-61.8165.1000111.9C27 A28 Q29 N33 T34 V38C27-I31 PolarHBondContact O-N 3.17Å; A28-I31 VanDerWaalsContact CA-CD1 3.48Å; A28-I31 HydrophobicContact CB-CD1 4.19Å; A28-I31 WeakPolarHBondContact O-CB 3.31Å; A28-I31 WeakPolarHBondContact O-CD1 3.15Å; A28-I31 WeakPolarHBondContact O-CG1 3.4Å; Q29-I31 VanDerWaalsContact C-N 3.33Å; I31-N33 PolarHBondContact O-N 3.04Å; I31-T34 PolarHBondContact O-N 2.95Å; I31-T34 VanDerWaalsContact O-N 3.15Å; I31-V38 HydrophobicContact CD1-CB 3.73Å; I31-V38 VanDerWaalsContact CD1-N 3.33Å; I31-V38 WeakPolarHBondContact CD1-O 3.45Å; I31-V38 HydrophobicContact CG1-CB 4.23Å
32L59.3Low75.1Confident158 Ų15877.4 Ų77.483%0.82741%0.412SS*.G310 helixtrans-60.7-18178.3-67.2174.1000113Q30Q30-L32 PolarHBondContact O-N 3.41Å
33N61.6Low75.2Confident145 Ų14575.1 Ų75.178%0.77540%0.396SS*.G310 helixtrans-110.7-1.2-179.4-61.3-35.9000113.9Q30 I31Q30-N33 PolarHBondContact O-N 3.26Å; Q30-N33 VanDerWaalsContact O-N 3.1Å; I31-N33 PolarHBondContact O-N 3.04Å
34T58.9Low75.3Confident65 Ų6572.6 Ų72.640%0.39939%0.387SS..SBendtrans-135145.3-177.553.80000111.9I31 I36I31-T34 PolarHBondContact O-N 2.95Å; I31-T34 VanDerWaalsContact O-N 3.15Å; T34-I36 PolarHBondContact O-N 3.41Å
35E57.9Low75.1Confident197 Ų19775.8 Ų75.892%0.92140%0.403SS*.SBendtrans-71.61.9-170.6-62.3-175.1164.500115P37E35-P37 WeakPolarHBondContact O-CD 3.47Å
36I66.8Low75.3Confident87 Ų8772.2 Ų72.245%0.44638%0.384SS..  trans-106.4106.6-174.9-54.2172.6000109.5T34 V38 K59T34-I36 PolarHBondContact O-N 3.41Å; I36-V38 HydrophobicContact CG2-CG2 4.48Å; I36-V38 PolarHBondContact O-N 3.02Å; I36-K59 HydrophobicContact CG2-CD 4.01Å; I36-K59 HydrophobicContact CG2-CG 4.43Å
37P70Confident75.2Confident102 Ų10268.8 Ų68.866%0.66237%0.371SS*.  trans-72.2114.7175.429.3-32.7000110E35E35-P37 WeakPolarHBondContact O-CD 3.47Å
38V76.4Confident75Confident16 Ų1673.7 Ų73.710%0.09739%0.393CS..  trans-100.9135.1168.11770000108.7I31 I36 E56 K59I31-V38 HydrophobicContact CD1-CB 3.73Å; I31-V38 VanDerWaalsContact CD1-N 3.33Å; I31-V38 WeakPolarHBondContact CD1-O 3.45Å; I31-V38 HydrophobicContact CG1-CB 4.23Å; I36-V38 HydrophobicContact CG2-CG2 4.48Å; I36-V38 PolarHBondContact O-N 3.02Å; V38-E56 WeakPolarHBondContact CA-OE2 3.44Å; V38-E56 HydrophobicContact CG1-CB 4.24Å; V38-K59 HydrophobicContact CG2-CB 3.83Å; V38-K59 HydrophobicContact CG2-CD 4.25Å
39N82.3Confident74.7Confident83 Ų8375.4 Ų75.444%0.44441%0.413SS..  trans-91.6121.9175.9-177.76.7000109.4L41 T42 C43N39-L41 VanDerWaalsContact C-N 3.26Å; N39-L41 PolarHBondContact O-N 3.1Å; N39-L41 PolarHBondContact OD1-N 3.23Å; N39-T42 HydrophobicContact CB-CG2 4.33Å; N39-T42 WeakPolarHBondContact CB-OG1 3.42Å; N39-T42 PolarHBondContact O-N 3.42Å; N39-T42 PolarHBondContact O-OG1 2.79Å; N39-C43 PolarHBondContact O-N 3.35Å
40S82.1Confident74.2Confident35 Ų3572.7 Ų72.725%0.24541%0.406CS..Hα-helixtrans-59.6-39.6-176.556.10000112.1C43 T44S40-C43 PolarHBondContact O-N 2.99Å; S40-T44 WeakPolarHBondContact O-CG2 3.44Å; S40-T44 PolarHBondContact O-N 3.21Å; S40-T44 PolarHBondContact O-OG1 2.94Å
41L80.8Confident73.9Confident114 Ų11473.6 Ų73.660%0.59741%0.412SS*.Hα-helixtrans-69.8-33.7-177.9-63.3175.8000112.3N39 T44 L45N39-L41 VanDerWaalsContact C-N 3.26Å; N39-L41 PolarHBondContact O-N 3.1Å; N39-L41 PolarHBondContact OD1-N 3.23Å; L41-T44 WeakPolarHBondContact CA-OG1 3.19Å; L41-T44 PolarHBondContact O-OG1 3.5Å; L41-L45 WeakPolarHBondContact O-CB 3.47Å; L41-L45 WeakPolarHBondContact O-CD1 3.47Å; L41-L45 WeakPolarHBondContact O-CG 3.1Å; L41-L45 PolarHBondContact O-N 3.38Å
42T83.7Confident73.6Confident39 Ų3980.4 Ų80.424%0.23945%0.448CS..Hα-helixtrans-74.6-39.2174.7520000110.5N39 T44 L45 E46N39-T42 HydrophobicContact CB-CG2 4.33Å; N39-T42 WeakPolarHBondContact CB-OG1 3.42Å; N39-T42 PolarHBondContact O-N 3.42Å; N39-T42 PolarHBondContact O-OG1 2.79Å; T42-T44 VanDerWaalsContact C-N 3.34Å; T42-T44 PolarHBondContact O-N 3.19Å; T42-L45 PolarHBondContact O-N 3.06Å; T42-E46 WeakPolarHBondContact O-CB 3.38Å; T42-E46 VanDerWaalsContact O-CG 3.28Å; T42-E46 WeakPolarHBondContact O-CG 3.49Å; T42-E46 PolarHBondContact O-N 3.35Å
43C83.9Confident74Confident0 Ų076.7 Ų76.70%043%0.432CS..Hα-helixtrans-58.9-42.8175-169.60000112.1C24 N39 S40 E46 C47C24-C43 HydrophobicContact CB-CB 3.68Å; C24-C43 WeakPolarHBondContact CB-SG 3.43Å; C24-C43 WeakPolarHBondContact SG-CB 3.4Å; C24-C43 PolarHBondContact SG-O 3.07Å; C24-C43 VanDerWaalsContact SG-O 3.41Å; C24-C43 CovalentContact SG-SG 2.04Å; C24-C43 PolarHBondContact SG-SG 3Å; N39-C43 PolarHBondContact O-N 3.35Å; S40-C43 PolarHBondContact O-N 2.99Å; C43-E46 PolarHBondContact O-N 3.42Å; C43-C47 WeakPolarHBondContact O-CB 3.41Å; C43-C47 PolarHBondContact O-N 2.93Å; C43-C47 PolarHBondContact O-SG 3.01Å
44T83.4Confident74.6Confident29 Ų2973.8 Ų73.818%0.17842%0.42CS..Hα-helixtrans-66.2-39.8175.853.30000112.3C24 S40 L41 T42 C47 E48C24-T44 HydrophobicContact CB-CG2 4.19Å; S40-T44 WeakPolarHBondContact O-CG2 3.44Å; S40-T44 PolarHBondContact O-N 3.21Å; S40-T44 PolarHBondContact O-OG1 2.94Å; L41-T44 WeakPolarHBondContact CA-OG1 3.19Å; L41-T44 PolarHBondContact O-OG1 3.5Å; T42-T44 VanDerWaalsContact C-N 3.34Å; T42-T44 PolarHBondContact O-N 3.19Å; T44-C47 WeakPolarHBondContact O-CB 3.49Å; T44-C47 PolarHBondContact O-N 3.41Å; T44-E48 VanDerWaalsContact O-CG 3.31Å; T44-E48 WeakPolarHBondContact O-CG 2.88Å; T44-E48 PolarHBondContact O-N 3.41Å
45L82.3Confident75.4Confident69 Ų6973.1 Ų73.136%0.36142%0.421SS..Hα-helixtrans-69.9-32.5178.2-71.3173.5000112.8L41 T42 G49 T50 L51L41-L45 WeakPolarHBondContact O-CB 3.47Å; L41-L45 WeakPolarHBondContact O-CD1 3.47Å; L41-L45 WeakPolarHBondContact O-CG 3.1Å; L41-L45 PolarHBondContact O-N 3.38Å; T42-L45 PolarHBondContact O-N 3.06Å; L45-G49 PolarHBondContact O-N 3.5Å; L45-T50 WeakPolarHBondContact CB-OG1 3.05Å; L45-T50 PolarHBondContact O-N 3.41Å; L45-T50 VanDerWaalsContact O-N 3.07Å; L45-T50 PolarHBondContact O-OG1 3.48Å; L45-L51 HydrophobicContact CB-CD1 3.88Å; L45-L51 HydrophobicContact CB-CG 4.18Å
46E84.5Confident76.4Confident19 Ų1965.4 Ų65.49%0.08939%0.385CS..Hα-helixtrans-69.4-41.1171.1-68-171.4168.700111.2T42 C43 E48 G49 L51 T53 A55 E56 L57T42-E46 WeakPolarHBondContact O-CB 3.38Å; T42-E46 VanDerWaalsContact O-CG 3.28Å; T42-E46 WeakPolarHBondContact O-CG 3.49Å; T42-E46 PolarHBondContact O-N 3.35Å; C43-E46 PolarHBondContact O-N 3.42Å; E46-E48 VanDerWaalsContact C-N 3.32Å; E46-E48 PolarHBondContact O-N 3.35Å; E46-G49 PolarHBondContact O-N 3.45Å; E46-L51 HydrophobicContact CG-CB 4.04Å; E46-L51 HydrophobicContact CG-CD1 4.27Å; E46-T53 WeakPolarHBondContact CG-O 3.49Å; E46-T53 WeakPolarHBondContact OE1-CB 3.35Å; E46-T53 PolarHBondContact OE1-OG1 3.45Å; E46-A55 PolarHBondContact OE2-N 2.99Å; E46-E56 WeakPolarHBondContact OE2-CB 3.33Å; E46-E56 PolarHBondContact OE2-N 3.33Å; E46-L57 PolarHBondContact OE2-N 2.96Å
47C82.1Confident76.9Confident27 Ų2764 Ų6418%0.18238%0.378CS..Hα-helixtrans-59.4-38.7172.1-83.70000112.9C20 C24 C43 T44 G49 L57C20-C47 HydrophobicContact CB-CB 3.79Å; C20-C47 WeakPolarHBondContact CB-SG 3.19Å; C20-C47 WeakPolarHBondContact SG-CB 3.05Å; C20-C47 CovalentContact SG-SG 2.04Å; C20-C47 PolarHBondContact SG-SG 3.32Å; C24-C47 PolarHBondContact SG-SG 3.32Å; C43-C47 WeakPolarHBondContact O-CB 3.41Å; C43-C47 PolarHBondContact O-N 2.93Å; C43-C47 PolarHBondContact O-SG 3.01Å; T44-C47 WeakPolarHBondContact O-CB 3.49Å; T44-C47 PolarHBondContact O-N 3.41Å; C47-G49 PolarHBondContact O-N 2.04Å; C47-L57 HydrophobicContact CB-CD1 4.38Å; C47-L57 WeakPolarHBondContact SG-CD1 3.45Å
48E79Confident77.3Confident107 Ų10763.1 Ų63.150%0.537%0.368SS..THydrogen-bonded Turntrans-75.9-6.1177.3-68.1-178168.300112.7T44 E46 T50T44-E48 VanDerWaalsContact O-CG 3.31Å; T44-E48 WeakPolarHBondContact O-CG 2.88Å; T44-E48 PolarHBondContact O-N 3.41Å; E46-E48 VanDerWaalsContact C-N 3.32Å; E46-E48 PolarHBondContact O-N 3.35Å; E48-T50 HydrophobicContact CB-CG2 4.1Å; E48-T50 PolarHBondContact O-N 2.04Å
49G74.3Confident77.6Confident59 Ų5965.9 Ų65.961%0.60838%0.378SS*.THydrogen-bonded Turntrans72.612.5-179.600000114.2L45 E46 C47 L51L45-G49 PolarHBondContact O-N 3.5Å; E46-G49 PolarHBondContact O-N 3.45Å; C47-G49 PolarHBondContact O-N 2.04Å; G49-L51 VanDerWaalsContact C-N 3.27Å
50T68.8Low77.5Confident86 Ų8662.2 Ų62.253%0.52836%0.359SS..SBendtrans-75.2-19.9178.1640000112.5L45 E48L45-T50 WeakPolarHBondContact CB-OG1 3.05Å; L45-T50 PolarHBondContact O-N 3.41Å; L45-T50 VanDerWaalsContact O-N 3.07Å; L45-T50 PolarHBondContact O-OG1 3.48Å; E48-T50 HydrophobicContact CB-CG2 4.1Å; E48-T50 PolarHBondContact O-N 2.04Å
51L65.2Low77.4Confident71 Ų7161.9 Ų61.937%0.37236%0.361SS..SBendtrans-116.8134.8174.3-62.9178.6000109.6L45 E46 G49 T53L45-L51 HydrophobicContact CB-CD1 3.88Å; L45-L51 HydrophobicContact CB-CG 4.18Å; E46-L51 HydrophobicContact CG-CB 4.04Å; E46-L51 HydrophobicContact CG-CD1 4.27Å; G49-L51 VanDerWaalsContact C-N 3.27Å; L51-T53 PolarHBondContact O-N 3.38Å
52L62.3Low77.1Confident181 Ų18163.2 Ų63.295%0.94836%0.362SS*.SBendtrans-78.3-5.9176.3-71.3110.3000113.3
53T67.1Low76.6Confident79 Ų7962.7 Ų62.749%0.48536%0.359SS..  trans-82135.1174.654.60000108.5E46 L51E46-T53 WeakPolarHBondContact CG-O 3.49Å; E46-T53 WeakPolarHBondContact OE1-CB 3.35Å; E46-T53 PolarHBondContact OE1-OG1 3.45Å; L51-T53 PolarHBondContact O-N 3.38Å
54T74.5Confident76Confident84 Ų8465.7 Ų65.752%0.51537%0.373SS..  trans-111.515.817359.30000111.3E56 D58T54-E56 PolarHBondContact O-N 3.42Å; T54-D58 WeakPolarHBondContact O-CB 3.47Å; T54-D58 PolarHBondContact O-N 3.47Å
55A76.5Confident75.3Confident51 Ų5170.9 Ų70.942%0.42140%0.395SS..Hα-helixtrans-72.7-33.7-165.900000112.2E46 K59E46-A55 PolarHBondContact OE2-N 2.99Å; A55-K59 WeakPolarHBondContact O-CD 3.28Å; A55-K59 WeakPolarHBondContact O-CG 3.01Å; A55-K59 PolarHBondContact O-N 3.39Å
56E77.7Confident74.4Confident35 Ų3571.5 Ų71.516%0.16441%0.405CS..Hα-helixtrans-83-34.3178.7-61.8-57.3138.900111.1V38 E46 T54 K59 C60V38-E56 WeakPolarHBondContact CA-OE2 3.44Å; V38-E56 HydrophobicContact CG1-CB 4.24Å; E46-E56 WeakPolarHBondContact OE2-CB 3.33Å; E46-E56 PolarHBondContact OE2-N 3.33Å; T54-E56 PolarHBondContact O-N 3.42Å; E56-K59 PolarHBondContact O-N 3.39Å; E56-K59 IonicContact OE1-NZ 2.67Å; E56-K59 PolarHBondContact OE1-NZ 3.09Å; E56-K59 IonicContact OE2-NZ 3.64Å; E56-C60 PolarHBondContact O-N 3.47Å
57L78Confident73.3Confident58 Ų5878.1 Ų78.130%0.30443%0.429SS..Hα-helixtrans-61.3-46.4172-160.3104.7000112.2E46 C47 K59 C60 G61E46-L57 PolarHBondContact OE2-N 2.96Å; C47-L57 HydrophobicContact CB-CD1 4.38Å; C47-L57 WeakPolarHBondContact SG-CD1 3.45Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 2.02Å; L57-C60 WeakPolarHBondContact O-CB 3.45Å; L57-C60 PolarHBondContact O-N 3.39Å; L57-G61 PolarHBondContact O-N 3.23Å
58D79.3Confident72.3Confident84 Ų8480.3 Ų80.345%0.44945%0.449SS..Hα-helixtrans-66-35.4178.8-79.2-19.1000112.6T54 C60 G61 K62T54-D58 WeakPolarHBondContact O-CB 3.47Å; T54-D58 PolarHBondContact O-N 3.47Å; D58-C60 VanDerWaalsContact C-N 3.35Å; D58-G61 PolarHBondContact O-N 3.29Å; D58-K62 WeakPolarHBondContact O-CD 3.43Å; D58-K62 VanDerWaalsContact O-CG 3.28Å; D58-K62 WeakPolarHBondContact O-CG 3.38Å; D58-K62 PolarHBondContact O-N 3.49Å; D58-K62 VanDerWaalsContact O-N 3.11Å
59K80.9Confident71.2Confident73 Ų7380.7 Ų80.732%0.31746%0.459SS..Hα-helixtrans-63.2-44.7173.6-74.9167.8-170.9177.30110.5I36 V38 A55 E56 L57 K62 T63I36-K59 HydrophobicContact CG2-CD 4.01Å; I36-K59 HydrophobicContact CG2-CG 4.43Å; V38-K59 HydrophobicContact CG2-CB 3.83Å; V38-K59 HydrophobicContact CG2-CD 4.25Å; A55-K59 WeakPolarHBondContact O-CD 3.28Å; A55-K59 WeakPolarHBondContact O-CG 3.01Å; A55-K59 PolarHBondContact O-N 3.39Å; E56-K59 PolarHBondContact O-N 3.39Å; E56-K59 IonicContact OE1-NZ 2.67Å; E56-K59 PolarHBondContact OE1-NZ 3.09Å; E56-K59 IonicContact OE2-NZ 3.64Å; L57-K59 VanDerWaalsContact C-N 3.34Å; L57-K59 PolarHBondContact O-N 2.02Å; K59-K62 PolarHBondContact O-N 3.38Å; K59-T63 PolarHBondContact O-N 3.38Å
60C81.1Confident69.9Low7 Ų781 Ų815%0.04746%0.462CS..Hα-helixtrans-62.1-46.5176.4174.60000112C27 E56 L57 D58 K62 T63 Q64C27-C60 HydrophobicContact CB-CB 3.82Å; C27-C60 WeakPolarHBondContact CB-SG 3.41Å; C27-C60 VanDerWaalsContact SG-C 3.59Å; C27-C60 WeakPolarHBondContact SG-CA 3.48Å; C27-C60 WeakPolarHBondContact SG-CB 3.33Å; C27-C60 PolarHBondContact SG-O 3.37Å; C27-C60 VanDerWaalsContact SG-O 3.38Å; C27-C60 CovalentContact SG-SG 2.02Å; C27-C60 PolarHBondContact SG-SG 3.49Å; E56-C60 PolarHBondContact O-N 3.47Å; L57-C60 WeakPolarHBondContact O-CB 3.45Å; L57-C60 PolarHBondContact O-N 3.39Å; D58-C60 VanDerWaalsContact C-N 3.35Å; C60-K62 VanDerWaalsContact C-N 3.3Å; C60-K62 PolarHBondContact O-N 3.4Å; C60-T63 PolarHBondContact O-N 3.38Å; C60-T63 VanDerWaalsContact O-N 3.13Å; C60-T63 PolarHBondContact O-OG1 3.01Å; C60-Q64 PolarHBondContact O-N 3.38Å; C60-Q64 VanDerWaalsContact O-N 3.08Å; C60-Q64 PolarHBondContact SG-NE2 2.99Å; C60-Q64 VanDerWaalsContact SG-NE2 3.39Å
61G79.1Confident68.4Low27 Ų2781.7 Ų81.728%0.27847%0.471SS..Hα-helixtrans-57.9-39.2177.400000113.4L57 D58 Q64 Q65L57-G61 PolarHBondContact O-N 3.23Å; D58-G61 PolarHBondContact O-N 3.29Å; G61-Q64 PolarHBondContact O-N 3.08Å; G61-Q65 WeakPolarHBondContact O-CG 3.45Å; G61-Q65 PolarHBondContact O-N 3.08Å
62K76.6Confident67Low142 Ų14286.1 Ų86.162%0.61749%0.489SS*.Hα-helixtrans-65.3-40.1176.1-72.2167.5-175.2170.40112.8D58 K59 C60 Q65 S66D58-K62 WeakPolarHBondContact O-CD 3.43Å; D58-K62 VanDerWaalsContact O-CG 3.28Å; D58-K62 WeakPolarHBondContact O-CG 3.38Å; D58-K62 PolarHBondContact O-N 3.49Å; D58-K62 VanDerWaalsContact O-N 3.11Å; K59-K62 PolarHBondContact O-N 3.38Å; C60-K62 VanDerWaalsContact C-N 3.3Å; C60-K62 PolarHBondContact O-N 3.4Å; K62-Q65 PolarHBondContact O-N 3.33Å; K62-S66 PolarHBondContact O-N 3.27Å; K62-S66 VanDerWaalsContact O-N 3.14Å; K62-S66 PolarHBondContact O-OG 3.39Å
63T71.1Confident66.1Low28 Ų2886.7 Ų86.717%0.17248%0.484CS..Hα-helixtrans-68.1-34.3176.859.80000112.7C27 K59 C60 S66 R67C27-T63 PolarHBondContact SG-OG1 3.31Å; C27-T63 VanDerWaalsContact SG-OG1 3.39Å; K59-T63 PolarHBondContact O-N 3.38Å; C60-T63 PolarHBondContact O-N 3.38Å; C60-T63 VanDerWaalsContact O-N 3.13Å; C60-T63 PolarHBondContact O-OG1 3.01Å; T63-S66 WeakPolarHBondContact CA-OG 2.84Å; T63-S66 PolarHBondContact O-OG 3.46Å; T63-R67 PolarHBondContact O-N 3.47Å
64Q72.6Confident64.6Low63 Ų6388.3 Ų88.329%0.29450%0.499SS..Hα-helixtrans-70.4-41.4175-68.2-177.214.200112C60 G61 S66 R67 A68C60-Q64 PolarHBondContact O-N 3.38Å; C60-Q64 VanDerWaalsContact O-N 3.08Å; C60-Q64 PolarHBondContact SG-NE2 2.99Å; C60-Q64 VanDerWaalsContact SG-NE2 3.39Å; G61-Q64 PolarHBondContact O-N 3.08Å; Q64-S66 VanDerWaalsContact C-N 3.32Å; Q64-S66 PolarHBondContact O-N 2.85Å; Q64-R67 WeakPolarHBondContact O-CB 2.97Å; Q64-R67 PolarHBondContact O-N 3.25Å; Q64-A68 PolarHBondContact O-N 3.09Å; Q64-A68 VanDerWaalsContact O-N 3.08Å
65Q68.8Low62.6Low138 Ų13892.5 Ų92.565%0.64552%0.519SS*.Hα-helixtrans-62-38176.1-75175.87.600112.4G61 K62 R67 A68 V69G61-Q65 WeakPolarHBondContact O-CG 3.45Å; G61-Q65 PolarHBondContact O-N 3.08Å; K62-Q65 PolarHBondContact O-N 3.33Å; Q65-R67 PolarHBondContact O-N 3.41Å; Q65-A68 PolarHBondContact O-N 3.31Å; Q65-V69 PolarHBondContact O-N 3.04Å
66S63.1Low60.8Low82 Ų8299.3 Ų99.357%0.57354%0.541SS*.Hα-helixtrans-63.7-23.717453.80000113.8K62 T63 Q64K62-S66 PolarHBondContact O-N 3.27Å; K62-S66 VanDerWaalsContact O-N 3.14Å; K62-S66 PolarHBondContact O-OG 3.39Å; T63-S66 WeakPolarHBondContact CA-OG 2.84Å; T63-S66 PolarHBondContact O-OG 3.46Å; Q64-S66 VanDerWaalsContact C-N 3.32Å; Q64-S66 PolarHBondContact O-N 2.85Å
67R62.2Low58.5Low158 Ų158105.8 Ų105.860%0.59658%0.577SS**Hα-helixtrans-83.5-38.4176.4-175.6175.5-179.1134.53.8112.5T63 Q64 Q65 V69 G70 S71T63-R67 PolarHBondContact O-N 3.47Å; Q64-R67 WeakPolarHBondContact O-CB 2.97Å; Q64-R67 PolarHBondContact O-N 3.25Å; Q65-R67 PolarHBondContact O-N 3.41Å; R67-V69 PolarHBondContact O-N 2.73Å; R67-G70 PolarHBondContact O-N 3.38Å; R67-G70 VanDerWaalsContact O-N 3.09Å; R67-S71 PolarHBondContact O-N 3.43Å
68A59.3Low56.4Low73 Ų73107.3 Ų107.360%0.60360%0.598SS**Hα-helixtrans-59.5-34.9177.500000111.8Q64 Q65Q64-A68 PolarHBondContact O-N 3.09Å; Q64-A68 VanDerWaalsContact O-N 3.08Å; Q65-A68 PolarHBondContact O-N 3.31Å
69V55.9Low54Low115 Ų115106.9 Ų106.970%0.69761%0.614SS**THydrogen-bonded Turntrans-81.1-20.9177.4-176.80000112.7Q65 R67Q65-V69 PolarHBondContact O-N 3.04Å; R67-V69 PolarHBondContact O-N 2.73Å
70G47.1Very low52.2Low66 Ų66109.2 Ų109.268%0.6864%0.637SS**THydrogen-bonded Turntrans-89.21.3-179.600000115.4R67R67-G70 PolarHBondContact O-N 3.38Å; R67-G70 VanDerWaalsContact O-N 3.09Å
71S38.6Very low49.7Very low101 Ų101120.6 Ų120.671%0.70668%0.678SS**SBendtrans-110.116.9-172.3-166.50000114.4R67R67-S71 PolarHBondContact O-N 3.43Å
72E36.2Very low47.5Very low163 Ų163124.4 Ų124.476%0.76270%0.701SS**SBendtrans-119.317.5179.8-75.1-162.8135.400114.9
73F42.2Very low45.4Very low193 Ų193123.2 Ų123.285%0.84671%0.706SS**  trans-12983.3173-70.7-76.3000111.5
74S35.8Very low43.9Very low113 Ų113127.9 Ų127.979%0.7974%0.736SS**  trans-153.495.8159.6-62.90000107.4
75D33.5Very low41.8Very low173 Ų173132.3 Ų132.393%0.92576%0.757SS**  trans-159.7132.9144.8-92.1-30.7000108.8
76E38.4Very low40.1Very low193 Ų193137.3 Ų137.390%0.90277%0.77SS**  trans-86.9147.3-177.5-52.2-142129.900111
77D29.1Very low38.7Very low172 Ų172141.4 Ų141.492%0.9278%0.78SS**  trans-163150.4134.6-148.3-0.5000113.4
78A34.5Very low37.2Very low89 Ų89140.6 Ų140.674%0.73679%0.787SS**  trans-104.2116.9-168.900000113.5
79G28.2Very low35.9Very low76 Ų76143.3 Ų143.378%0.78479%0.792SS**  trans53.2178.8150.400000121.3
80P42Very low35.1Very low122 Ų122146 Ų14679%0.79280%0.797SS**  cis-129170.3-39.238.3-23.4000114.1
81R30Very low34.3Very low245 Ų245150.3 Ų150.393%0.92580%0.804SS**  trans74.7133.7156.2-138167-179.7178.6-1115.8
82S33.1Very low34.3Very low107 Ų107149.9 Ų149.975%0.74881%0.807SS**  cis-158.9157.940.945.60000113.4
83T31.6Very low34.2Very low118 Ų118147.4 Ų147.472%0.72481%0.808SS**  trans-56.2166.9176.349.50000115.7
84P39Very low34.1Very low125 Ų125146.4 Ų146.481%0.81281%0.809SS**  -132.4129.58331.7-15.8000115.1
85E29.6Very low34.1Very low156 Ų156144.7 Ų144.773%0.72980%0.802SS**  trans12.7125.7139-60.7170.6169.900119.9
86R33.4Very low35.1Very low244 Ų244144.8 Ų144.892%0.92180%0.803SS**  -164.8106.9115.4-94.8174.5-150.5144.84.5110.4
87E32.3Very low35.2Very low168 Ų168141 Ų14179%0.78579%0.793SS**  trans0.2133.6142.6-59.7161.1174.500116.1
88D30.8Very low35.7Very low140 Ų140138.3 Ų138.375%0.74978%0.782SS**  -153.7142.357.1-81.9-39.2000114.9
89D33.5Very low36.8Very low130 Ų130143.1 Ų143.170%0.69579%0.786SS**  trans50.4103.4142.3-54.7-25.9000122
90Q37.8Very low37.8Very low171 Ų171151 Ų15180%0.79979%0.792SS**  58.3115.882.7-64.2-173.262.100113.7
91D31.4Very low38.1Very low157 Ų157156 Ų15684%0.8480%0.797SS**  -157155.469.8-85.6-40.1000115
92A37.8Very low39Very low93 Ų93147.9 Ų147.977%0.76979%0.79SS**  trans-78.5151.8-17500000115.5
93S35Very low40.2Very low111 Ų111146.2 Ų146.278%0.77679%0.789SS**  -179.4110.9125.242.10000112.9
94I39.3Very low41.2Very low171 Ų171149.4 Ų149.488%0.87779%0.794SS**  19.4114.4128.8-51.5169.9000115.9
95A36.4Very low42.3Very low77 Ų77151.1 Ų151.164%0.63679%0.794SS**  172.8127.1121.500000112.6V97A95-V97 HydrophobicContact CB-CG2 3.97Å; A95-V97 PolarHBondContact O-N 3.44Å; A95-V97 VanDerWaalsContact O-N 3.12Å
96N54.7Low43.8Very low175 Ų175153 Ų15394%0.93680%0.8SS**  trans-50.3110.9154.8-83.7-57.1000110.2
97V38.9Very low44.9Very low115 Ų115151.5 Ų151.570%0.69780%0.795SS**  trans-138.298.6172.7177.50000110.9A95A95-V97 HydrophobicContact CB-CG2 3.97Å; A95-V97 PolarHBondContact O-N 3.44Å; A95-V97 VanDerWaalsContact O-N 3.12Å
98V40.8Very low46.1Very low115 Ų115151.8 Ų151.870%0.69780%0.8SS**  trans78.8112.8131.4-178.20000119R100V98-R100 PolarHBondContact O-N 2.86Å
99K57.9Low47Very low189 Ų189150.5 Ų150.582%0.82279%0.793SS**  trans-10.9106.9143.4-63.8170.6179.1173.80114Y101K99-Y101 PolarHBondContact O-N 3.06Å
100R48.6Very low47.9Very low241 Ų241151.6 Ų151.691%0.90979%0.791SS**  trans-92.891.5166.7-71-174.8-179.8-121.41.9110.2V98 G102V98-R100 PolarHBondContact O-N 2.86Å; R100-G102 PolarHBondContact O-N 2.87Å
101Y48.6Very low48.8Very low227 Ų227149.7 Ų149.789%0.8979%0.786SS**  trans-64.4106.8151.2-89.1-94.3000107.5K99K99-Y101 PolarHBondContact O-N 3.06Å
102G49.6Very low50Low76 Ų76151.4 Ų151.478%0.78479%0.786SS**  trans-111.275176.900000110.4R100 F104R100-G102 PolarHBondContact O-N 2.87Å; G102-F104 PolarHBondContact O-N 3.27Å
103G56.6Low50.6Low71 Ų71152.4 Ų152.473%0.73278%0.779SS**  trans-64.7125.2161.600000109.4
104F54.4Low51.5Low186 Ų186156 Ų15682%0.81678%0.781SS**  trans-173.7111.1137-124.7-98.6000107.7G102 K106G102-F104 PolarHBondContact O-N 3.27Å; F104-K106 PolarHBondContact O-N 3.01Å
105I61.9Low52Low160 Ų160155.8 Ų155.882%0.82178%0.78SS**  trans-52108.2170.3-68.5158.3000107.8R107I105-R107 PolarHBondContact O-N 3.04Å
106K60.1Low52.5Low196 Ų196159.7 Ų159.785%0.85279%0.789SS**  trans-79.8113.3176.3-166170.6-178.4175.50108.1F104 I108F104-K106 PolarHBondContact O-N 3.01Å; K106-I108 PolarHBondContact O-N 3.43Å
107R55.7Low51.8Low213 Ų213157 Ų15780%0.80478%0.78SS**  trans-53.2125.6177.3-59.8173.5-139.6167.75.3109.9I105 D109I105-R107 PolarHBondContact O-N 3.04Å; R107-D109 PolarHBondContact O-N 2.98Å
108I59.3Low52Low174 Ų174156.6 Ų156.689%0.89278%0.782SS**  trans-69.3106.7166.2-65163.4000106.2K106K106-I108 PolarHBondContact O-N 3.43Å
109D48.3Very low52.3Low113 Ų113155.8 Ų155.860%0.60478%0.779SS**  trans-102.6120.9174.6-150.114.9000109.4R107R107-D109 PolarHBondContact O-N 2.98Å
110K53.9Low51.1Low153 Ų153159.1 Ų159.167%0.66579%0.787SS**  trans56107151.1-67.7157.2-165.9139.90119.5K112K110-K112 PolarHBondContact O-N 3.49Å
111N55.1Low50.7Low130 Ų130157.9 Ų157.970%0.69578%0.782SS**  12.6103.2115.7-177.118.8000115.8N113N111-N113 PolarHBondContact OD1-N 3.23Å; N111-N113 PolarHBondContact OD1-OD1 3.07Å
112K56.3Low50.3Low193 Ų193154.3 Ų154.384%0.83977%0.774SS**  trans-13289.8149.8-59.5-175.7-172-177.70107.2K110K110-K112 PolarHBondContact O-N 3.49Å
113N51.9Low49.8Very low114 Ų114158.9 Ų158.961%0.6178%0.78SS**  trans21113.8131-51.8-17.6000114.6N111N111-N113 PolarHBondContact OD1-N 3.23Å; N111-N113 PolarHBondContact OD1-OD1 3.07Å
114K52.7Low49.2Very low188 Ų188159 Ų15982%0.81778%0.781SS**  60.313996.4-67.4-172.4-177.3-174.10113.1
115L51.3Low48.6Very low165 Ų165156.3 Ų156.386%0.86478%0.78SS**  trans86.497.2-175.8-45.3171.2000109.2
116L45.6Very low47.7Very low159 Ų159159.8 Ų159.883%0.83278%0.784SS**SBend-160.2126.268.7-76.8167.4000111.8
117T40.5Very low47.1Very low120 Ų120160 Ų16074%0.73679%0.785SS**  trans77.792.2136.7-31.50000119.5
118S42.9Very low46.1Very low105 Ų105153.3 Ų153.373%0.73478%0.783SS**  trans-53.5154.1144.355.70000111
119P46.2Very low45.6Very low99 Ų99148.7 Ų148.764%0.64377%0.771SS**  -154.8109.2101.529.3-7.9000115.3
120W33.4Very low45.5Very low259 Ų259154 Ų15498%0.98178%0.784SS**  trans-154.271.9148.2-70.7101.5000110.1
121R40.8Very low45.3Very low214 Ų214151.3 Ų151.381%0.80879%0.79SS**  trans-79.8141.2138.5-81-88.1-146.9-87.7-2.2104.1
122E39.2Very low45.3Very low153 Ų153154.9 Ų154.972%0.71580%0.8SS**  cis-164.5154.229.5-92.9134.6-154.100106.9
123N40.6Very low45.3Very low172 Ų172150.2 Ų150.292%0.9279%0.789SS**  trans171.7125.7132.6-83.8-22.1000111.2
124G42.3Very low45.5Very low74 Ų74154 Ų15476%0.76380%0.801SS**  trans11465.1154.800000117.6Y126G124-Y126 PolarHBondContact O-N 3.21Å
125V41.7Very low45.8Very low128 Ų128153.9 Ų153.978%0.77680%0.8SS**  trans-66.3119.6156.7171.20000109
126Y44.4Very low45.9Very low234 Ų234153.5 Ų153.592%0.91879%0.788SS**  trans-119.6100.6150.6-92.5-81000108.9G124G124-Y126 PolarHBondContact O-N 3.21Å
127K46.5Very low46.5Very low199 Ų199153 Ų15387%0.86578%0.782SS**  trans-67.8127.6157-95.7178.7171177.50107.5
128G36.4Very low47.4Very low74 Ų74152 Ų15276%0.76377%0.772SS**  trans-173.478.8173.300000110.4
129A47.8Very low48.1Very low77 Ų77151.9 Ų151.964%0.63676%0.762SS**  trans-60.9148.5163.100000109.9
130Y46.3Very low48.6Very low224 Ų224153 Ų15388%0.87876%0.762SS**  trans82.299167-48.3-74.5000118.1
131A50.5Low49.7Very low97 Ų97149 Ų14980%0.80275%0.747SS**  -176.766.9123.600000110.5
132F53.2Low50.4Low204 Ų204147.2 Ų147.290%0.89575%0.745SS**  trans-72.9131.3156.2-73.8-78000107.5K134F132-K134 PolarHBondContact O-N 3.43Å
133P56.7Low50.7Low96 Ų96149.6 Ų149.662%0.62375%0.753SS**  trans-62.7136.5-179.824.9-32.3000109.6K135P133-K135 PolarHBondContact O-N 3.49Å
134K56.6Low51.2Low194 Ų194144.6 Ų144.684%0.84374%0.742SS**THydrogen-bonded Turntrans-55.311179.9-63.9178.9175.5-179.70116F132F132-K134 PolarHBondContact O-N 3.43Å
135K59.3Low51.4Low185 Ų185149.3 Ų149.380%0.80474%0.744SS**THydrogen-bonded Turntrans-97.7-1.7-175.5-61.6-171.8178.8-176.70113.9P133P133-K135 PolarHBondContact O-N 3.49Å
136Y53Low51.2Low157 Ų157154.8 Ų154.862%0.61675%0.751SS**SBendtrans-108.4-4.7-178-152.8-100.5000114.4L139 L140Y136-L139 HydrophobicContact CD2-CD1 4Å; Y136-L139 HydrophobicContact CE2-CD1 3.88Å; Y136-L140 HydrophobicContact CD1-CD1 4.17Å; Y136-L140 HydrophobicContact CE1-CD1 4.33Å; Y136-L140 HydrophobicContact CE1-CG 4.45Å
137E57.8Low50.9Low149 Ų149151.1 Ų151.170%0.69675%0.747SS**Hα-helixtrans-75.5-34.5179.5-154.5176.5-17400112L139 L140 R141E137-L139 VanDerWaalsContact C-N 3.28Å; E137-L139 PolarHBondContact O-N 3.4Å; E137-L140 PolarHBondContact O-N 3.11Å; E137-R141 PolarHBondContact O-N 2.92Å
138D59.3Low50.6Low98 Ų98149.3 Ų149.352%0.52475%0.746SS.*Hα-helixtrans-70.2-20.2179.1-75.2-31.8000114.1R141D138-R141 IonicContact OD1-CZ 3.91Å; D138-R141 IonicContact OD1-NH1 2.94Å; D138-R141 PolarHBondContact OD1-NH1 3.44Å
139L57.3Low50.5Low102 Ų102150.8 Ų150.853%0.53475%0.745SS.*Hα-helixtrans-80.6-27.3175.9-74.8172.5000112.4Y136 E137Y136-L139 HydrophobicContact CD2-CD1 4Å; Y136-L139 HydrophobicContact CE2-CD1 3.88Å; E137-L139 VanDerWaalsContact C-N 3.28Å; E137-L139 PolarHBondContact O-N 3.4Å
140L58.2Low49.8Very low122 Ų122156 Ų15664%0.63976%0.756SS**Hα-helixtrans-83.8-28.1178.7-70.6165.2000112.1Y136 E137 K142Y136-L140 HydrophobicContact CD1-CD1 4.17Å; Y136-L140 HydrophobicContact CE1-CD1 4.33Å; Y136-L140 HydrophobicContact CE1-CG 4.45Å; E137-L140 PolarHBondContact O-N 3.11Å; L140-K142 PolarHBondContact O-N 2.73Å
141R56Low49.1Very low175 Ų175155.4 Ų155.466%0.6676%0.759SS**G310 helixtrans-68.6-18.2175.2-156.7163.686.4-116.44.2113.6E137 D138E137-R141 PolarHBondContact O-N 2.92Å; D138-R141 IonicContact OD1-CZ 3.91Å; D138-R141 IonicContact OD1-NH1 2.94Å; D138-R141 PolarHBondContact OD1-NH1 3.44Å
142K55.8Low48.3Very low178 Ų178154.7 Ų154.777%0.77475%0.748SS**G310 helixtrans-82.8-4.2-176.3-100.6179.5177.2177.40116.4L140L140-K142 PolarHBondContact O-N 2.73Å
143F45.8Very low47.5Very low202 Ų202152.5 Ų152.589%0.88674%0.74SS**G310 helixtrans-100.9-2.2176.5-82-80.8000114.3
144G50.4Low46.3Very low67 Ų67153.2 Ų153.269%0.69174%0.739SS**SBendtrans-104.3-23.7-167.600000118.2
145E46Very low45.4Very low173 Ų173155.7 Ų155.781%0.80875%0.745SS**  trans-140.1109.1-169.7-95.4162.814900111.8
146R37.3Very low44.4Very low244 Ų244155.6 Ų155.692%0.92175%0.747SS**  trans-130.678151.3-72.9-165.2-138.1104.64.8107.6
147D38.7Very low43.3Very low156 Ų156151.9 Ų151.983%0.83476%0.756SS**  trans-106135.5150.8-89.9-32.8000109
148L41.1Very low42.1Very low161 Ų161148.7 Ų148.784%0.84376%0.764SS**  trans-8.1128.4166-59.7164000118.5
149S34.1Very low40.8Very low106 Ų106151.5 Ų151.574%0.74178%0.779SS**  trans-177.4122135.2-89.40000109.1
150E33.3Very low39.9Very low185 Ų185151.8 Ų151.886%0.86479%0.785SS**  82.1104.889.4-154.4168.7-145.300109.3
151F29.8Very low38.8Very low212 Ų212153 Ų15393%0.9379%0.792SS**  trans-96.598.4-176.2-146.7-85.8000106.4
152S33.6Very low38.1Very low82 Ų82150.7 Ų150.757%0.57380%0.802SS**  trans-92.9134.7169.458.80000109.7
153E38.1Very low37.4Very low159 Ų159150.3 Ų150.374%0.74380%0.804SS**  trans69.6139.4141.3-64.3163.4-157.500116.2
154D30.5Very low37.1Very low111 Ų111148.5 Ų148.559%0.59480%0.803SS**  cis-172.2143.911.4-108.8-16.7000106.2
155Y38Very low36.6Very low245 Ų245153 Ų15396%0.96181%0.812SS**  trans-142.9113.2151.2-84.5-76.5000108.8
156Q38.3Very low36.3Very low183 Ų183153.3 Ų153.386%0.85582%0.815SS**  trans-83.8156.3172.5-82.3176.636.800112.6
157G30.9Very low36.2Very low79 Ų79145.3 Ų145.381%0.81481%0.808SS**  trans114.4100.8161.700000110.9
158G32.5Very low36.1Very low83 Ų83145.4 Ų145.486%0.85681%0.806SS**  99136.95000000107.3
159D30.6Very low35.9Very low156 Ų156145.1 Ų145.183%0.83480%0.798SS**  cis-173.6163.3-6.7-161.2-2.2000105.6
160V39.3Very low36.3Very low108 Ų108146.4 Ų146.466%0.65580%0.796SS**  trans86.2103.6158.9-158.20000122.5
161D33.7Very low36.6Very low148 Ų148145.1 Ų145.179%0.79180%0.795SS**  30.1130.6127.9-55.7-28000123
162S42.4Very low37.3Very low126 Ų126143.1 Ų143.188%0.88179%0.794SS**  -170.9153.1109.5-145.50000112.7
163E41.6Very low38Very low171 Ų171146.6 Ų146.680%0.79980%0.802SS**  trans-97.7162.8-160.2-52.4171.4165.300113.1
164N37.9Very low38.4Very low164 Ų164143.8 Ų143.888%0.87781%0.806SS**  trans68.6113.1162.6-91.8-10.2000119.9
165D40.4Very low39.5Very low162 Ų162143 Ų14387%0.86682%0.815SS**  -157.5143112.2-160.112.7000111.8
166M39.5Very low40.4Very low179 Ų179134.9 Ų134.988%0.88280%0.798SS**  trans-84.3127-174170.8-169.4-82.300110.1
167G36.1Very low41.3Very low76 Ų76133.7 Ų133.778%0.78480%0.796SS**  trans-172.978.617900000116.4
168M36.2Very low42.5Very low158 Ų158136.5 Ų136.578%0.77879%0.793SS**  trans-0.5129.4153.6-91.6-177.3163.300121.3
169F37.4Very low43.8Very low154 Ų154143.1 Ų143.168%0.67580%0.798SS**  trans84.9108.7139.1-65.2-53.5000121.7
170N42.8Very low45.2Very low133 Ų133140.9 Ų140.971%0.71179%0.79SS**  trans76.392.8138-52.9-32.5000117.9
171D39.4Very low46.1Very low158 Ų158143.5 Ų143.585%0.84579%0.792SS**  trans-145.3102.8138.2-83-43.5000107.5E173D171-E173 PolarHBondContact O-N 3.22Å
172D43.8Very low47.3Very low170 Ų170148.4 Ų148.491%0.90980%0.8SS**  trans-6778.3167.7-80.4-43.9000108.4A174D172-A174 PolarHBondContact O-N 3.4Å
173E48.4Very low47.8Very low155 Ų155152 Ų15272%0.72480%0.795SS**  trans-67.361.4163-165.9175.1162.200109.2D171 A175D171-E173 PolarHBondContact O-N 3.22Å; E173-A175 PolarHBondContact O-N 3.13Å
174A46.8Very low48.6Very low101 Ų101147.4 Ų147.484%0.83579%0.794SS**THydrogen-bonded Turntrans-75.625.9166.300000111.8D172D172-A174 PolarHBondContact O-N 3.4Å
175A54.3Low49.8Very low95 Ų95143.1 Ų143.179%0.78579%0.789SS**THydrogen-bonded Turntrans-103.16.2179.600000113.2E173E173-A175 PolarHBondContact O-N 3.13Å
176A55.7Low50.9Low73 Ų73142.9 Ų142.960%0.60378%0.78SS**SBendtrans-110.98-17300000116.1
177I58.6Low51.6Low159 Ų159142.5 Ų142.582%0.81578%0.781SS**SBendtrans-133.475.5176.7-44.5177.4000111.5
178N55.9Low52.9Low138 Ų138147.2 Ų147.274%0.73878%0.775SS**  trans-164.167.6148.2-112.7-64.1000111.6V180N178-V180 PolarHBondContact O-N 3.42Å; N178-V180 WeakPolarHBondContact OD1-CG2 3.45Å
179K59Low53.9Low221 Ų221149.7 Ų149.796%0.96178%0.781SS**  trans-79.362.4157.4-74.9-176.8-176.2-179.70109.4
180V60.3Low54.7Low110 Ų110151.2 Ų151.267%0.66779%0.788SS**  trans-93119.8166.5175.90000107.7N178 R182N178-V180 PolarHBondContact O-N 3.42Å; N178-V180 WeakPolarHBondContact OD1-CG2 3.45Å; V180-R182 PolarHBondContact O-N 3.14Å; V180-R182 VanDerWaalsContact O-N 3.11Å
181K58.8Low55.2Low162 Ų162147.5 Ų147.570%0.70478%0.782SS**  trans-47.5115.1-178.7-64.2173180175.60109.9Y183K181-Y183 HydrophobicContact CB-CD2 3.86Å; K181-Y183 HydrophobicContact CB-CE2 3.68Å; K181-Y183 HydrophobicContact CD-CE2 4.01Å; K181-Y183 HydrophobicContact CG-CE2 4.47Å; K181-Y183 PolarHBondContact O-N 3.3Å
182R57.5Low55.8Low252 Ų252145.9 Ų145.995%0.95178%0.78SS**  trans-65.484.5167.9-83.5-175.6-168.7-147.61.2109V180V180-R182 PolarHBondContact O-N 3.14Å; V180-R182 VanDerWaalsContact O-N 3.11Å
183Y53.5Low56Low200 Ų200147.4 Ų147.478%0.78478%0.778SS**  trans-70.2131.7161.8-82-87.7000108.9K181K181-Y183 HydrophobicContact CB-CD2 3.86Å; K181-Y183 HydrophobicContact CB-CE2 3.68Å; K181-Y183 HydrophobicContact CD-CE2 4.01Å; K181-Y183 HydrophobicContact CG-CE2 4.47Å; K181-Y183 PolarHBondContact O-N 3.3Å
184G57.8Low55.7Low76 Ų76146 Ų14678%0.78478%0.781SS**  trans-65159.5-173.400000113.3
185G63.9Low55.7Low74 Ų74151.1 Ų151.176%0.76378%0.784SS**  trans104.596.3150.500000114.6
186F62.3Low54.9Low156 Ų156152 Ų15268%0.68478%0.784SS**  trans87.164.3134.1-139.1-112.8000118.4R188F186-R188 HydrophobicContact CD1-CG 3.87Å; F186-R188 HydrophobicContact CE1-CG 3.44Å; F186-R188 VanDerWaalsContact CE1-CG 3.44Å; F186-R188 HydrophobicContact CZ-CG 3.84Å; F186-R188 VanDerWaalsContact CZ-CZ 3.49Å; F186-R188 PolarHBondContact O-N 3.13Å
187L55.6Low54.3Low171 Ų171157.9 Ų157.990%0.89580%0.796SS**  trans-82.3100149.3-82.989.3000109.6K189L187-K189 PolarHBondContact O-N 3.19Å
188R63.2Low53.2Low176 Ų176161.4 Ų161.466%0.66480%0.799SS**  trans-66.5117.2160.2-71.2-175.9178.9-93.5-3.1107.6F186 F190F186-R188 HydrophobicContact CD1-CG 3.87Å; F186-R188 HydrophobicContact CE1-CG 3.44Å; F186-R188 VanDerWaalsContact CE1-CG 3.44Å; F186-R188 HydrophobicContact CZ-CG 3.84Å; F186-R188 VanDerWaalsContact CZ-CZ 3.49Å; F186-R188 PolarHBondContact O-N 3.13Å; R188-F190 VanDerWaalsContact C-N 3.31Å; R188-F190 HydrophobicContact CB-CD2 4.45Å; R188-F190 PolarHBondContact O-N 3.17Å
189K57.9Low52.1Low209 Ų209159.9 Ų159.991%0.90980%0.799SS**  trans-67.285.4172.8-63179.3-178.8-177.10110.3L187L187-K189 PolarHBondContact O-N 3.19Å
190F53.1Low50.9Low186 Ų186156.7 Ų156.782%0.81679%0.792SS**  trans-96.996.9148.9-72-73.6000106.3R188R188-F190 VanDerWaalsContact C-N 3.31Å; R188-F190 HydrophobicContact CB-CD2 4.45Å; R188-F190 PolarHBondContact O-N 3.17Å
191G53.9Low49.7Very low56 Ų56156.5 Ų156.558%0.57780%0.796SS**  trans-62148.9173.400000110.6K193G191-K193 PolarHBondContact O-N 3.15Å; G191-K193 VanDerWaalsContact O-N 3.08Å
192P52.2Low48.5Very low124 Ų124159.2 Ų159.281%0.80580%0.802SS**  trans-64.1112.2176.719.5-23000109.7T194P192-T194 PolarHBondContact O-N 3.02Å
193K47.5Very low47.4Very low201 Ų201155 Ų15587%0.87479%0.793SS**  trans-6899.7168.7-73.4-96.1-175.6172.40107.6G191 K195G191-K193 PolarHBondContact O-N 3.15Å; G191-K193 VanDerWaalsContact O-N 3.08Å; K193-K195 PolarHBondContact O-N 2.8Å
194T41.3Very low47Very low127 Ų127155 Ų15578%0.77980%0.8SS**  trans-57.1116.4168.151.30000108.9P192 S196P192-T194 PolarHBondContact O-N 3.02Å; T194-S196 PolarHBondContact O-N 3.1Å; T194-S196 VanDerWaalsContact O-N 3.11Å
195K46.6Very low46.1Very low208 Ų208154.6 Ų154.690%0.90480%0.796SS**  trans-67.7103.3170.4-59.3-176.5-177.3-179.20107.7K193K193-K195 PolarHBondContact O-N 2.8Å
196S38.5Very low44.7Very low112 Ų112155.4 Ų155.478%0.78379%0.79SS**  trans-97.2112.3166-170.20000108.4T194T194-S196 PolarHBondContact O-N 3.1Å; T194-S196 VanDerWaalsContact O-N 3.11Å
197K42.6Very low43.8Very low198 Ų198160.3 Ų160.386%0.86180%0.804SS**  trans-71.5129.8168.6-70.4176.7173.5-1790108.4
198R35.8Very low43.4Very low233 Ų233159.5 Ų159.588%0.87980%0.795SS**  trans-160.3109.1149.9-111.9174.9-176.4-161.50.1112.1
199S32.6Very low42.9Very low105 Ų105159.5 Ų159.573%0.73480%0.803SS**  trans40.8128140.958.20000122.8
200D34.8Very low42.8Very low154 Ų154157.7 Ų157.782%0.82480%0.802SS**  trans6.8126151.5-72.5-46.3000120.7
201S33.3Very low42.9Very low106 Ų106157 Ų15774%0.74180%0.802SS**  170.8130113.3-74.50000112.2
202R34.5Very low43.5Very low220 Ų220162 Ų16283%0.8381%0.807SS**  trans69.3118.3146.1-72.3178151.7134.2-4.3121.5
203E34.5Very low43.6Very low163 Ų163168 Ų16876%0.76281%0.814SS**  trans67108.1130.1-67.6177.8-168.200120.4G205E203-G205 PolarHBondContact O-N 2.7Å
204Q45.3Very low43.9Very low201 Ų201167.3 Ų167.394%0.93981%0.807SS**  trans21.498.4133.2-77.2169.7-900117
205G38.1Very low44.8Very low67 Ų67165 Ų16569%0.69181%0.808SS**  trans-164.7134.9162.700000109.5E203E203-G205 PolarHBondContact O-N 2.7Å
206S35.8Very low45.6Very low90 Ų90158.1 Ų158.163%0.62980%0.797SS**  trans60.280.617468.80000116.9E208S206-E208 PolarHBondContact O-N 2.67Å
207R42.6Very low46.5Very low260 Ų260161.5 Ų161.598%0.98180%0.797SS**  trans-67.165.2147.4-156.4178.8-175.8177.80.2108.2E209R207-E209 PolarHBondContact O-N 3.03Å
208E47.2Very low47Very low154 Ų154160.1 Ų160.172%0.7280%0.796SS**  trans-70.892.2169.4-88.2165.6-150.100106.8S206 L210S206-E208 PolarHBondContact O-N 2.67Å; E208-L210 VanDerWaalsContact C-N 3.33Å; E208-L210 PolarHBondContact O-N 3.11Å
209E52.3Low48.2Very low176 Ų176159.4 Ų159.482%0.82279%0.793SS**  trans-34.899.1157.3-170.8172.9-166.300108.7R207 Q211R207-E209 PolarHBondContact O-N 3.03Å; E209-Q211 PolarHBondContact O-N 2.71Å
210L57.3Low49.5Very low170 Ų170163.5 Ų163.589%0.8979%0.793SS**  trans-63.879.6171.9-90.7151.7000107.1E208 K212E208-L210 VanDerWaalsContact C-N 3.33Å; E208-L210 PolarHBondContact O-N 3.11Å; L210-K212 VanDerWaalsContact C-N 3.33Å; L210-K212 PolarHBondContact O-N 2.69Å
211Q54.6Low50.5Low173 Ų173163.7 Ų163.781%0.80879%0.792SS**  trans-57.8101.5175.3-166.1178.640.400105.4E209 R213E209-Q211 PolarHBondContact O-N 2.71Å; Q211-R213 PolarHBondContact O-N 3.43Å
212K65.3Low51.7Low159 Ų159167.5 Ų167.569%0.69179%0.79SS**  trans-50.5114.1-176.9-62.3164.7138.9-171.80107.1L210 Y214L210-K212 VanDerWaalsContact C-N 3.33Å; L210-K212 PolarHBondContact O-N 2.69Å; K212-Y214 HydrophobicContact CB-CD2 3.37Å; K212-Y214 HydrophobicContact CB-CE2 3.67Å; K212-Y214 HydrophobicContact CD-CD2 3.95Å; K212-Y214 HydrophobicContact CD-CE2 3.53Å; K212-Y214 HydrophobicContact CG-CD2 4.17Å; K212-Y214 HydrophobicContact CG-CE2 3.97Å; K212-Y214 PolarHBondContact O-N 3.45Å
213R54.4Low52.5Low252 Ų252161.6 Ų161.695%0.95178%0.781SS**  trans-68.864.9165.6-72.7-176.8176.1-152.30.3108.6Q211 G215Q211-R213 PolarHBondContact O-N 3.43Å; R213-G215 PolarHBondContact O-N 2.78Å
214Y54.6Low53.4Low185 Ų185163.4 Ų163.473%0.72579%0.786SS**  trans-72.766.1159.5-84.1-90.5000107.9K212K212-Y214 HydrophobicContact CB-CD2 3.37Å; K212-Y214 HydrophobicContact CB-CE2 3.67Å; K212-Y214 HydrophobicContact CD-CD2 3.95Å; K212-Y214 HydrophobicContact CD-CE2 3.53Å; K212-Y214 HydrophobicContact CG-CD2 4.17Å; K212-Y214 HydrophobicContact CG-CE2 3.97Å; K212-Y214 PolarHBondContact O-N 3.45Å
215G60.3Low53.7Low78 Ų78160.1 Ų160.180%0.80477%0.774SS**  trans-111.124.8-179.300000112.9R213R213-G215 PolarHBondContact O-N 2.78Å
216G63.9Low54.5Low64 Ų64163.8 Ų163.866%0.6678%0.778SS**SBendtrans-141.8-10.7-170.600000117.5
217F56.7Low55.3Low183 Ų183164.6 Ų164.680%0.80378%0.775SS**SBendtrans-113.6-10-174.9-165.7-103.7000114.9R219F217-R219 PolarHBondContact O-N 3.16Å
218M52.8Low56Low170 Ų170159.9 Ų159.984%0.83777%0.768SS**  trans-81.867166.3-68.3-66.3-87.700109.3R220M218-R220 PolarHBondContact O-N 2.94Å
219R61.4Low56.6Low217 Ų217158.2 Ų158.282%0.81977%0.765SS**  trans-6489.2154.1-79-169.3176107.4-1.1105.8F217 I221F217-R219 PolarHBondContact O-N 3.16Å; R219-I221 PolarHBondContact O-N 2.86Å
220R60.7Low56.7Low191 Ų191154.5 Ų154.572%0.72175%0.754SS**  trans2.482.5161.9-65.3-178.8-78.6-104.52.2112.4M218 R222M218-R220 PolarHBondContact O-N 2.94Å; R220-R222 HydrophobicContact CB-CG 4.3Å; R220-R222 PolarHBondContact O-N 3.26Å
221I56.1Low56.6Low158 Ų158152.6 Ų152.681%0.8174%0.744SS**  trans-69.782.2151-57.3175.8000102.8R219 P223R219-I221 PolarHBondContact O-N 2.86Å; I221-P223 WeakPolarHBondContact O-CD 3.2Å
222R58.3Low56.8Low187 Ų187151.7 Ų151.771%0.70674%0.737SS**  trans-62.7122.7163.9-75.6-170.3173.7106.3-4.7104.2R220 K224R220-R222 HydrophobicContact CB-CG 4.3Å; R220-R222 PolarHBondContact O-N 3.26Å; R222-K224 PolarHBondContact O-N 3.31Å; R222-K224 VanDerWaalsContact O-N 3.16Å
223P50.5Low56.3Low96 Ų96152.4 Ų152.462%0.62374%0.736SS**  trans-51.8130.4164.921.4-28.8000106.2I221 L225I221-P223 WeakPolarHBondContact O-CD 3.2Å; P223-L225 PolarHBondContact O-N 3.29Å
224K54.1Low56.4Low201 Ų201146.2 Ų146.287%0.87472%0.722SS**  trans-54.391.6171.6-70.5178.7177.1175.30106.4R222 N226R222-K224 PolarHBondContact O-N 3.31Å; R222-K224 VanDerWaalsContact O-N 3.16Å; K224-N226 PolarHBondContact O-OD1 2.84Å; K224-N226 VanDerWaalsContact O-OD1 3.11Å
225L50.6Low56.5Low132 Ų132141.7 Ų141.769%0.69171%0.71SS**  trans-86.9115.2168.6-92.8163.3000105.3P223 N227P223-L225 PolarHBondContact O-N 3.29Å; L225-N227 PolarHBondContact O-N 2.94Å
226N55.5Low56.6Low143 Ų143143.5 Ų143.577%0.76570%0.698SS**  trans-60.982.9-178.7-39.3-24000107.6K224K224-N226 PolarHBondContact O-OD1 2.84Å; K224-N226 VanDerWaalsContact O-OD1 3.11Å
227N53.1Low56.7Low107 Ų107148.2 Ų148.257%0.57270%0.7SS**  trans-148.1102.8171.7-85.2-50.9000108.1L225 N229 T230L225-N227 PolarHBondContact O-N 2.94Å; N227-N229 PolarHBondContact O-N 2.88Å; N227-T230 PolarHBondContact O-N 3.12Å; N227-T230 PolarHBondContact O-OG1 2.76Å; N227-T230 VanDerWaalsContact O-OG1 3.13Å
228L56.3Low56.9Low161 Ų161149.6 Ų149.684%0.84370%0.7SS**THydrogen-bonded Turntrans-46.2-19.8-178.2-139.789000114.3
229N59.2Low57.2Low120 Ų120149.4 Ų149.464%0.64269%0.691SS**Hα-helixtrans-81.7-19-174.3-65.1-20.5000114.4N227N227-N229 PolarHBondContact O-N 2.88Å
230T54.5Low57.6Low97 Ų97140.5 Ų140.560%0.59567%0.667SS**Hα-helixtrans-87.2-32.4-177.653.40000113.8N227 K232 W233N227-T230 PolarHBondContact O-N 3.12Å; N227-T230 PolarHBondContact O-OG1 2.76Å; N227-T230 VanDerWaalsContact O-OG1 3.13Å; T230-K232 VanDerWaalsContact C-N 3.32Å; T230-K232 PolarHBondContact O-N 2.83Å; T230-W233 PolarHBondContact O-N 3.04Å
231L56.2Low58.3Low130 Ų130133.1 Ų133.168%0.68165%0.65SS**Hα-helixtrans-67.4-31.9173.1-100.790.5000112.5W233 D234 N235L231-W233 VanDerWaalsContact C-N 3.28Å; L231-W233 PolarHBondContact O-N 3.31Å; L231-D234 PolarHBondContact O-N 3.06Å; L231-N235 PolarHBondContact O-ND2 3.41Å; L231-N235 VanDerWaalsContact O-ND2 3.09Å
232K57.6Low59.1Low154 Ų154130.9 Ų130.967%0.6763%0.634SS**Hα-helixtrans-62.6-35.9179.3-171.1174.7170.9170.20112T230 Q236T230-K232 VanDerWaalsContact C-N 3.32Å; T230-K232 PolarHBondContact O-N 2.83Å; K232-Q236 PolarHBondContact O-N 2.9Å
233W55.6Low59.9Low174 Ų174125.5 Ų125.566%0.65962%0.619SS**Hα-helixtrans-71.8-27.3-179.1-89.270.5000114.3T230 L231T230-W233 PolarHBondContact O-N 3.04Å; L231-W233 VanDerWaalsContact C-N 3.28Å; L231-W233 PolarHBondContact O-N 3.31Å
234D57.4Low60.9Low122 Ų122127.4 Ų127.465%0.65261%0.614SS**Hα-helixtrans-75.8-37.2179-157.629.3000111.4L231 Q236 K237 R238L231-D234 PolarHBondContact O-N 3.06Å; D234-Q236 PolarHBondContact O-N 3.11Å; D234-K237 PolarHBondContact O-N 2.84Å; D234-R238 PolarHBondContact O-N 2.75Å
235N56.8Low61.9Low91 Ų91126.9 Ų126.949%0.48761%0.607SS.*Hα-helixtrans-67.2-34175.6-71.9-60.3000112.7L231 K237 R238 Y239L231-N235 PolarHBondContact O-ND2 3.41Å; L231-N235 VanDerWaalsContact O-ND2 3.09Å; N235-K237 VanDerWaalsContact C-N 3.33Å; N235-K237 PolarHBondContact O-N 3.31Å; N235-R238 PolarHBondContact O-N 3.22Å; N235-Y239 WeakPolarHBondContact O-CD2 3.5Å; N235-Y239 PolarHBondContact O-N 3.42Å
236Q62.1Low63.1Low116 Ų116126.4 Ų126.454%0.54260%0.601SS.*Hα-helixtrans-66.6-33.5178.2-169.9167.99.800112.9K232 D234 G240K232-Q236 PolarHBondContact O-N 2.9Å; D234-Q236 PolarHBondContact O-N 3.11Å; Q236-G240 PolarHBondContact O-N 3.27Å
237K64.6Low64Low162 Ų162126.7 Ų126.770%0.70459%0.592SS**Hα-helixtrans-76.7-25.9179.3-67.2-164.1179.6-172.10113.3D234 N235D234-K237 PolarHBondContact O-N 2.84Å; N235-K237 VanDerWaalsContact C-N 3.33Å; N235-K237 PolarHBondContact O-N 3.31Å
238R61.9Low64.8Low213 Ų213130.3 Ų130.380%0.80460%0.603SS**Hα-helixtrans-80.2-32.7-177-145.6171-169.2-117.61.8113.4D234 N235D234-R238 PolarHBondContact O-N 2.75Å; N235-R238 PolarHBondContact O-N 3.22Å
239Y59Low65.2Low165 Ų165127.7 Ų127.765%0.64759%0.589SS**Hα-helixtrans-95-16.8-179.5-70.8-80.1000114.6N235 G241N235-Y239 WeakPolarHBondContact O-CD2 3.5Å; N235-Y239 PolarHBondContact O-N 3.42Å; Y239-G241 VanDerWaalsContact C-N 3.34Å; Y239-G241 PolarHBondContact O-N 2.88Å
240G69.4Low65.6Low30 Ų30125.1 Ų125.131%0.30958%0.581SS.*Hα-helixtrans-68-25.2-177.300000115.5Q236 R244Q236-G240 PolarHBondContact O-N 3.27Å; G240-R244 WeakPolarHBondContact O-CB 3.28Å; G240-R244 WeakPolarHBondContact O-CG 3.49Å; G240-R244 PolarHBondContact O-N 3.25Å
241G74.9Confident65.8Low36 Ų36126.4 Ų126.437%0.37159%0.588SS.*Hα-helixtrans-77.8-26.8-176.400000114.7Y239 R245Y239-G241 VanDerWaalsContact C-N 3.34Å; Y239-G241 PolarHBondContact O-N 2.88Å; G241-R245 WeakPolarHBondContact O-CG 3.35Å; G241-R245 PolarHBondContact O-NE 2.67Å
242F73.3Confident65.6Low111 Ų111129.4 Ų129.449%0.48759%0.59SS.*Hα-helixtrans-78-47176.8179.3-101000110.8R244 R245 H246 Y247F242-R244 VanDerWaalsContact C-N 3.35Å; F242-R244 PolarHBondContact O-N 3.38Å; F242-R245 PolarHBondContact O-N 2.98Å; F242-R245 VanDerWaalsContact O-N 3.16Å; F242-H246 AromaticContact CD2-CD2 3.37Å; F242-H246 WeakPolarHBondContact CD2-CD2 3.35Å; F242-H246 AromaticContact CD2-NE2 3.81Å; F242-H246 AromaticContact CE2-CD2 3.19Å; F242-H246 WeakPolarHBondContact CE2-CD2 3.19Å; F242-H246 AromaticContact CE2-NE2 3.49Å; F242-H246 WeakPolarHBondContact CE2-NE2 3.38Å; F242-H246 AromaticContact CZ-CD2 3.78Å; F242-H246 PolarHBondContact O-CD2 3.43Å; F242-H246 PolarHBondContact O-N 2.85Å; F242-Y247 HydrophobicContact CE1-CE2 4.02Å
243L74.6Confident65.5Low74 Ų74127 Ų12739%0.38759%0.593SS.*Hα-helixtrans-61.4-38.9177.6-71164000112.6R245 Y247 K248 L249L243-R245 PolarHBondContact O-N 2.84Å; L243-Y247 HydrophobicContact CD2-CD2 3.95Å; L243-Y247 CarbonylContact O-C 3.44Å; L243-Y247 WeakPolarHBondContact O-CA 3.37Å; L243-Y247 WeakPolarHBondContact O-CB 3.15Å; L243-Y247 PolarHBondContact O-N 2.92Å; L243-K248 PolarHBondContact O-N 3.11Å; L243-K248 VanDerWaalsContact O-N 3.14Å; L243-L249 HydrophobicContact CD2-CD1 4.47Å
244R72.6Confident65.3Low136 Ų136126.1 Ų126.151%0.51360%0.601SS.*Hα-helixtrans-65.3-33.7175.2-81.6-177.6-177.3-89.3-1.2113.9G240 F242G240-R244 WeakPolarHBondContact O-CB 3.28Å; G240-R244 WeakPolarHBondContact O-CG 3.49Å; G240-R244 PolarHBondContact O-N 3.25Å; F242-R244 VanDerWaalsContact C-N 3.35Å; F242-R244 PolarHBondContact O-N 3.38Å
245R75Confident65Low191 Ų191128.7 Ų128.772%0.72161%0.609SS**Hα-helixtrans-81.5-42.5-177.1-75.6-176-71.2-175.94112.6G241 F242 L243G241-R245 WeakPolarHBondContact O-CG 3.35Å; G241-R245 PolarHBondContact O-NE 2.67Å; F242-R245 PolarHBondContact O-N 2.98Å; F242-R245 VanDerWaalsContact O-N 3.16Å; L243-R245 PolarHBondContact O-N 2.84Å
246H75.3Confident64.6Low122 Ų122133 Ų13357%0.56563%0.626SS**Hα-helixtrans-94.5-32.1-174.4-68.6-77000113.4F242F242-H246 AromaticContact CD2-CD2 3.37Å; F242-H246 WeakPolarHBondContact CD2-CD2 3.35Å; F242-H246 AromaticContact CD2-NE2 3.81Å; F242-H246 AromaticContact CE2-CD2 3.19Å; F242-H246 WeakPolarHBondContact CE2-CD2 3.19Å; F242-H246 AromaticContact CE2-NE2 3.49Å; F242-H246 WeakPolarHBondContact CE2-NE2 3.38Å; F242-H246 AromaticContact CZ-CD2 3.78Å; F242-H246 PolarHBondContact O-CD2 3.43Å; F242-H246 PolarHBondContact O-N 2.85Å
247Y74.2Confident63.8Low148 Ų148133.5 Ų133.558%0.5864%0.64SS**SBendtrans-118-2.2-172.2-61.7-82.4000113.5F242 L243 L249F242-Y247 HydrophobicContact CE1-CE2 4.02Å; L243-Y247 HydrophobicContact CD2-CD2 3.95Å; L243-Y247 CarbonylContact O-C 3.44Å; L243-Y247 WeakPolarHBondContact O-CA 3.37Å; L243-Y247 WeakPolarHBondContact O-CB 3.15Å; L243-Y247 PolarHBondContact O-N 2.92Å; Y247-L249 PolarHBondContact O-N 3.08Å
248K71.2Confident63Low184 Ų184130.8 Ų130.880%0.864%0.641SS**  trans49.417.3-177.4-63.8179.3-179173.40114.7L243 S250L243-K248 PolarHBondContact O-N 3.11Å; L243-K248 VanDerWaalsContact O-N 3.14Å; K248-S250 PolarHBondContact O-N 3.03Å
249L63.7Low62.4Low106 Ų106125.5 Ų125.556%0.55564%0.637SS**  trans-71.3104.1178.4-73.3159.4000108.5L243 Y247L243-L249 HydrophobicContact CD2-CD1 4.47Å; Y247-L249 PolarHBondContact O-N 3.08Å
250S66.7Low61.9Low66 Ų66128 Ų12846%0.46265%0.647SS.*  trans-88.3117.316662.80000109.1K248 R252K248-S250 PolarHBondContact O-N 3.03Å; S250-R252 PolarHBondContact O-N 2.81Å
251V58.8Low61.3Low124 Ų124133.2 Ų133.275%0.75267%0.667SS**  trans-74.747.9171.6-166.70000110.5
252R53.7Low60.1Low193 Ų193138.9 Ų138.973%0.72869%0.689SS**  trans-93109.5154.2-81-168152.392.23.5103.4S250 D254S250-R252 PolarHBondContact O-N 2.81Å; R252-D254 PolarHBondContact O-N 3.22Å; R252-D254 VanDerWaalsContact O-N 3.07Å
253S55.3Low59Low104 Ų104143 Ų14373%0.72771%0.707SS**  trans-53111.5163.724.30000106.7E255S253-E255 PolarHBondContact O-N 3.39Å
254D51.6Low58Low155 Ų155142.9 Ų142.983%0.82972%0.724SS**  trans-66.989.1162.3-67.8-38.8000105.4R252 E256R252-D254 PolarHBondContact O-N 3.22Å; R252-D254 VanDerWaalsContact O-N 3.07Å; D254-E256 PolarHBondContact O-N 3.37Å
255E51.1Low56.4Low175 Ų175148.3 Ų148.382%0.81876%0.762SS**  trans-68.5105.5159.6-70.8-170.4166.700106S253S253-E255 PolarHBondContact O-N 3.39Å
256E48.3Very low55.5Low181 Ų181146.2 Ų146.285%0.84676%0.764SS**PPolyproline II helixtrans-56.3125.8168-73179.4148.400109.2D254 S258D254-E256 PolarHBondContact O-N 3.37Å; E256-S258 PolarHBondContact O-N 2.8Å
257P45.6Very low54.5Low127 Ų127147.4 Ų147.483%0.82577%0.774SS**PPolyproline II helixtrans-73.6116.9164.729.1-29.5000108.7
258S46.7Very low53.4Low105 Ų105147.4 Ų147.473%0.73479%0.785SS**PPolyproline II helixtrans-61.9160.6162.857.80000111.9E256E256-S258 PolarHBondContact O-N 2.8Å
259S49.4Very low52.3Low103 Ų103145.2 Ų145.272%0.7278%0.784SS**  trans94.3104.2168.279.70000117.5
260Y48.1Very low51.6Low218 Ų218147.7 Ų147.786%0.85580%0.798SS**  -169.1132.987.9-117.1-95000110.3
261D56.4Low50.6Low138 Ų138153.1 Ų153.174%0.73882%0.821SS**  trans-61.2133.6166.9-63.6-73.5000110.8
262D50.4Low50Low155 Ų155155.2 Ų155.283%0.82983%0.826SS**  trans-149.586155.3-16529.6000109.3G264D262-G264 PolarHBondContact O-N 3.5Å
263F50.9Low49.8Very low198 Ų198152.3 Ų152.387%0.86883%0.833SS**  trans-83.497.7164.1-76.3-81.3000107.8L265F263-L265 PolarHBondContact O-N 3.18Å
264G53.8Low49.3Very low71 Ų71156.3 Ų156.373%0.73284%0.842SS**  trans-72.7116.6170.900000112D262D262-G264 PolarHBondContact O-N 3.5Å
265L39.1Very low49.1Very low250 Ų250156.5 Ų156.5100%1.30984%0.843SS**  trans-1040147.2-99.9167.6000107.8F263F263-L265 PolarHBondContact O-N 3.18Å

Retrieved 265 of 265 residues in 107.6 ms (Link to these results)

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