A0A087X9M8_POEFO Loading...

Myozenin 2a

AlphaFold DB (A0A3B3UWH5), UniProt , Accession A0A087X9M8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 264 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
1M39.5Very low70.3Confident242 Ų242129.2 Ų129.2100%1.19267%0.666SS**  01110-71.6-177.1158.800107.5
2S56.8Low71.5Confident100 Ų100127.8 Ų127.870%0.69965%0.646SS**  trans-77.2122.6-176.2-170.50000109.3F4S2-F4 WeakPolarHBondContact O-CD2 3.41Å; S2-F4 PolarHBondContact O-N 3.12Å; S2-F4 VanDerWaalsContact O-N 3.08Å
3Q62.1Low72.6Confident189 Ų189129.5 Ų129.588%0.88365%0.646SS**  trans-71.2102.1178.1-65.1-1727.500108.6S5Q3-S5 PolarHBondContact O-N 3.47Å
4F61.7Low73.6Confident182 Ų182129.4 Ų129.480%0.79865%0.645SS**  trans-67.7116.2171.9-71.7-82.2000108.7S2 T6S2-F4 WeakPolarHBondContact O-CD2 3.41Å; S2-F4 PolarHBondContact O-N 3.12Å; S2-F4 VanDerWaalsContact O-N 3.08Å; F4-T6 PolarHBondContact O-N 3.11Å
5S63.3Low74.5Confident75 Ų75127.7 Ų127.752%0.52463%0.634SS.*  trans-55117.7176.6177.70000110.7Q3 M7Q3-S5 PolarHBondContact O-N 3.47Å; S5-M7 PolarHBondContact O-N 3.01Å
6T76.4Confident75.2Confident135 Ų135123 Ų12383%0.82862%0.622SS**  trans-72.90.1178.7480000113.7F4 T8F4-T6 PolarHBondContact O-N 3.11Å; T6-T8 PolarHBondContact O-N 3.12Å
7M77.8Confident75.6Confident53 Ų53118.5 Ų118.526%0.26161%0.608SS.*  trans-68133.1-178.1-65-91.987.300110.9S5 E11 R12S5-M7 PolarHBondContact O-N 3.01Å; M7-E11 HydrophobicContact CB-CB 4.27Å; M7-E11 HydrophobicContact CE-CB 4.32Å; M7-E11 HydrophobicContact CE-CG 4.47Å; M7-E11 HydrophobicContact SD-CB 3.85Å; M7-R12 HydrophobicContact CB-CG 3.82Å; M7-R12 PolarHBondContact O-NH1 2.75Å; M7-R12 PolarHBondContact O-NH2 3.19Å
8T83.3Confident75.9Confident79 Ų79115.1 Ų115.149%0.48560%0.6SS.*  trans-65157.1169.965.20000110.3T6 R10 E11 R12T6-T8 PolarHBondContact O-N 3.12Å; T8-R10 PolarHBondContact O-N 3.22Å; T8-R10 VanDerWaalsContact O-N 3.12Å; T8-E11 WeakPolarHBondContact CB-OE2 3.23Å; T8-E11 PolarHBondContact N-OE2 3.05Å; T8-E11 PolarHBondContact O-N 2.93Å; T8-E11 VanDerWaalsContact OG1-CD 3.28Å; T8-E11 WeakPolarHBondContact OG1-CG 3.22Å; T8-E11 PolarHBondContact OG1-N 3.1Å; T8-E11 PolarHBondContact OG1-OE2 2.91Å; T8-R12 PolarHBondContact O-N 3.37Å
9T81.9Confident76.1Confident88 Ų88114.2 Ų114.254%0.5460%0.595SS.*Hα-helixtrans-57.7-29.6178.9-54.40000112.5K13T9-K13 WeakPolarHBondContact O-CB 3.32Å; T9-K13 WeakPolarHBondContact O-CG 3.42Å; T9-K13 PolarHBondContact O-N 3.28Å; T9-K13 VanDerWaalsContact O-N 3.11Å
10R83.8Confident76.2Confident207 Ų207112.6 Ų112.678%0.78159%0.593SS**Hα-helixtrans-68.5-45.3175.4-175.8-179.5176.6-171.9-1111.8T8 K13 M14T8-R10 PolarHBondContact O-N 3.22Å; T8-R10 VanDerWaalsContact O-N 3.12Å; R10-K13 PolarHBondContact O-N 3.21Å; R10-M14 WeakPolarHBondContact O-CB 3.29Å; R10-M14 PolarHBondContact O-N 2.99Å
11E86.5Confident76.1Confident71 Ų71116.9 Ų116.933%0.33260%0.601SS.*Hα-helixtrans-66.1-41.4178.8-70.2162.1144.100111.5M7 T8 K13 M14 Q15M7-E11 HydrophobicContact CB-CB 4.27Å; M7-E11 HydrophobicContact CE-CB 4.32Å; M7-E11 HydrophobicContact CE-CG 4.47Å; M7-E11 HydrophobicContact SD-CB 3.85Å; T8-E11 WeakPolarHBondContact CB-OE2 3.23Å; T8-E11 PolarHBondContact N-OE2 3.05Å; T8-E11 PolarHBondContact O-N 2.93Å; T8-E11 VanDerWaalsContact OG1-CD 3.28Å; T8-E11 WeakPolarHBondContact OG1-CG 3.22Å; T8-E11 PolarHBondContact OG1-N 3.1Å; T8-E11 PolarHBondContact OG1-OE2 2.91Å; E11-K13 PolarHBondContact O-N 3.25Å; E11-M14 PolarHBondContact O-N 2.76Å; E11-Q15 PolarHBondContact O-N 3.24Å
12R84.9Confident77.4Confident113 Ų113113 Ų11343%0.42658%0.58SS.*Hα-helixtrans-59.9-44173.3-76.9-167.2-74.6-102.2-4.8112.4M7 T8 M14 Q15 A16M7-R12 HydrophobicContact CB-CG 3.82Å; M7-R12 PolarHBondContact O-NH1 2.75Å; M7-R12 PolarHBondContact O-NH2 3.19Å; T8-R12 PolarHBondContact O-N 3.37Å; R12-M14 VanDerWaalsContact C-N 3.33Å; R12-M14 PolarHBondContact O-N 3.22Å; R12-Q15 PolarHBondContact O-N 2.96Å; R12-A16 VanDerWaalsContact O-CB 3.32Å; R12-A16 WeakPolarHBondContact O-CB 3.45Å; R12-A16 PolarHBondContact O-N 3.41Å
13K86.4Confident77.8Confident149 Ų149113.6 Ų113.665%0.64858%0.579SS**Hα-helixtrans-63.6-39.2175.9-78.9-177.6175.6-173.70112T9 R10 E11 A17T9-K13 WeakPolarHBondContact O-CB 3.32Å; T9-K13 WeakPolarHBondContact O-CG 3.42Å; T9-K13 PolarHBondContact O-N 3.28Å; T9-K13 VanDerWaalsContact O-N 3.11Å; R10-K13 PolarHBondContact O-N 3.21Å; E11-K13 PolarHBondContact O-N 3.25Å; K13-A17 VanDerWaalsContact O-CB 3.27Å; K13-A17 WeakPolarHBondContact O-CB 3.1Å; K13-A17 PolarHBondContact O-N 2.78Å
14M86.5Confident77.6Confident128 Ų128110.7 Ų110.763%0.63157%0.566SS**Hα-helixtrans-67.7-43.8178.5-170.3174.271.600111.8R10 E11 R12 A17 A18R10-M14 WeakPolarHBondContact O-CB 3.29Å; R10-M14 PolarHBondContact O-N 2.99Å; E11-M14 PolarHBondContact O-N 2.76Å; R12-M14 VanDerWaalsContact C-N 3.33Å; R12-M14 PolarHBondContact O-N 3.22Å; M14-A17 PolarHBondContact O-N 3.47Å; M14-A18 WeakPolarHBondContact O-CB 3.41Å; M14-A18 PolarHBondContact O-N 3.36Å
15Q86.3Confident77.1Confident104 Ų104104.1 Ų104.149%0.48655%0.549SS..Hα-helixtrans-63.6-45.8174.5-76.9-178.4-12.300111.8E11 R12 A17 A18 I19E11-Q15 PolarHBondContact O-N 3.24Å; R12-Q15 PolarHBondContact O-N 2.96Å; Q15-A17 VanDerWaalsContact C-N 3.33Å; Q15-A17 PolarHBondContact O-N 2.77Å; Q15-A18 PolarHBondContact O-N 3.17Å; Q15-I19 WeakPolarHBondContact O-CG1 3.09Å; Q15-I19 PolarHBondContact O-N 3.26Å
16A85.4Confident76.8Confident53 Ų53108 Ų10844%0.43856%0.559SS.*Hα-helixtrans-60.3-42.9175.800000111.7R12 A18 I19 C20R12-A16 VanDerWaalsContact O-CB 3.32Å; R12-A16 WeakPolarHBondContact O-CB 3.45Å; R12-A16 PolarHBondContact O-N 3.41Å; A16-A18 VanDerWaalsContact C-N 3.34Å; A16-A18 PolarHBondContact O-N 2.76Å; A16-I19 PolarHBondContact O-N 3.43Å; A16-C20 PolarHBondContact O-N 3.27Å; A16-C20 PolarHBondContact O-SG 3.37Å
17A83.5Confident75.8Confident47 Ų47108.7 Ų108.739%0.38855%0.553SS.*Hα-helixtrans-65.8-34.4176.700000113.1K13 M14 Q15 R21K13-A17 VanDerWaalsContact O-CB 3.27Å; K13-A17 WeakPolarHBondContact O-CB 3.1Å; K13-A17 PolarHBondContact O-N 2.78Å; M14-A17 PolarHBondContact O-N 3.47Å; Q15-A17 VanDerWaalsContact C-N 3.33Å; Q15-A17 PolarHBondContact O-N 2.77Å; A17-R21 VanDerWaalsContact O-CG 3.32Å; A17-R21 WeakPolarHBondContact O-CG 3.41Å; A17-R21 PolarHBondContact O-N 2.74Å; A17-R21 VanDerWaalsContact O-N 3.1Å
18A80.6Confident74.6Confident56 Ų56113.9 Ų113.946%0.46358%0.582SS.*Hα-helixtrans-66.1-45.5174.100000111.4M14 Q15 A16 C20 R21 E22M14-A18 WeakPolarHBondContact O-CB 3.41Å; M14-A18 PolarHBondContact O-N 3.36Å; Q15-A18 PolarHBondContact O-N 3.17Å; A16-A18 VanDerWaalsContact C-N 3.34Å; A16-A18 PolarHBondContact O-N 2.76Å; A18-C20 PolarHBondContact O-N 3.42Å; A18-R21 PolarHBondContact O-N 3.02Å; A18-R21 VanDerWaalsContact O-N 3.14Å; A18-E22 PolarHBondContact O-N 2.96Å
19I79.8Confident73.5Confident99 Ų99111.7 Ų111.751%0.50857%0.572SS.*Hα-helixtrans-62.1-42.8175.9-65.4165.8000110.7Q15 A16 R21 E22 V23Q15-I19 WeakPolarHBondContact O-CG1 3.09Å; Q15-I19 PolarHBondContact O-N 3.26Å; A16-I19 PolarHBondContact O-N 3.43Å; I19-R21 VanDerWaalsContact C-N 3.28Å; I19-R21 PolarHBondContact O-N 2.99Å; I19-E22 PolarHBondContact O-N 3.44Å; I19-V23 HydrophobicContact CG2-CG2 4.18Å; I19-V23 WeakPolarHBondContact O-CG2 3.44Å; I19-V23 PolarHBondContact O-N 3.19Å
20C77.6Confident72.6Confident81 Ų81115.4 Ų115.455%0.54758%0.583SS.*Hα-helixtrans-62.6-34.7175.9-66.50000112.3A16 A18 Q24A16-C20 PolarHBondContact O-N 3.27Å; A16-C20 PolarHBondContact O-SG 3.37Å; A18-C20 PolarHBondContact O-N 3.42Å; C20-Q24 WeakPolarHBondContact O-CB 3.44Å; C20-Q24 PolarHBondContact O-N 3.3Å
21R73.9Confident71.7Confident203 Ų203112.6 Ų112.677%0.76658%0.58SS**Hα-helixtrans-71.9-30.2175.6-72.9172-174.6-93.50.1113.1A17 A18 I19A17-R21 VanDerWaalsContact O-CG 3.32Å; A17-R21 WeakPolarHBondContact O-CG 3.41Å; A17-R21 PolarHBondContact O-N 2.74Å; A17-R21 VanDerWaalsContact O-N 3.1Å; A18-R21 PolarHBondContact O-N 3.02Å; A18-R21 VanDerWaalsContact O-N 3.14Å; I19-R21 VanDerWaalsContact C-N 3.28Å; I19-R21 PolarHBondContact O-N 2.99Å
22E68Low70.9Confident160 Ų160115.6 Ų115.675%0.74860%0.599SS**Hα-helixtrans-76.2-40.8177-171.7176.9177.400111.8A18 I19 G25A18-E22 PolarHBondContact O-N 2.96Å; I19-E22 PolarHBondContact O-N 3.44Å; E22-G25 PolarHBondContact O-N 3.04Å
23V64.4Low70.5Confident113 Ų113116.9 Ų116.969%0.68561%0.613SS**Hα-helixtrans-74.8-37.8177.2176.40000111.4I19 G25I19-V23 HydrophobicContact CG2-CG2 4.18Å; I19-V23 WeakPolarHBondContact O-CG2 3.44Å; I19-V23 PolarHBondContact O-N 3.19Å; V23-G25 PolarHBondContact O-N 3.1Å
24Q56.8Low69.7Low129 Ų129111.8 Ų111.860%0.60360%0.603SS**THydrogen-bonded Turntrans-82.740.3171.9-14381.251.500110.9C20 Q26C20-Q24 WeakPolarHBondContact O-CB 3.44Å; C20-Q24 PolarHBondContact O-N 3.3Å; Q24-Q26 PolarHBondContact O-N 3.25Å
25G52.5Low69Low43 Ų43115.6 Ų115.644%0.44362%0.616SS.*THydrogen-bonded Turntrans-47.7100.1-174.800000110.8E22 V23 E27E22-G25 PolarHBondContact O-N 3.04Å; V23-G25 PolarHBondContact O-N 3.1Å; G25-E27 VanDerWaalsContact C-N 3.29Å; G25-E27 PolarHBondContact O-N 2.74Å
26Q56.5Low68.7Low156 Ų156119.4 Ų119.473%0.72963%0.631SS**THydrogen-bonded Turntrans3753.8160.3-145.7163.6-94.200114.7Q24 D28 A29Q24-Q26 PolarHBondContact O-N 3.25Å; Q26-D28 PolarHBondContact O-N 2.87Å; Q26-A29 HydrophobicContact CB-CB 4.22Å; Q26-A29 HydrophobicContact CG-CB 3.53Å; Q26-A29 PolarHBondContact O-N 3.16Å
27E54.7Low68Low150 Ų150123.2 Ų123.270%0.70165%0.648SS**THydrogen-bonded Turntrans-59.6-10.1175.3-63.9-79.1169.300112.6G25G25-E27 VanDerWaalsContact C-N 3.29Å; G25-E27 PolarHBondContact O-N 2.74Å
28D53.8Low67.5Low162 Ų162123 Ų12387%0.86664%0.644SS**THydrogen-bonded Turntrans-117.616.9175.7-70.3-42.3000114Q26 H30Q26-D28 PolarHBondContact O-N 2.87Å; D28-H30 PolarHBondContact O-N 3.1Å; D28-H30 VanDerWaalsContact O-N 3.1Å
29A60.4Low67.4Low34 Ų34124.6 Ų124.628%0.28165%0.648SS.*  trans-73.3104.2156.400000106.6Q26 M31Q26-A29 HydrophobicContact CB-CB 4.22Å; Q26-A29 HydrophobicContact CG-CB 3.53Å; Q26-A29 PolarHBondContact O-N 3.16Å; A29-M31 PolarHBondContact O-N 3.13Å
30H62.4Low67.1Low166 Ų166124.6 Ų124.677%0.76965%0.654SS**  trans-46.494.3154.7175.8-74000107.1D28 D32D28-H30 PolarHBondContact O-N 3.1Å; D28-H30 VanDerWaalsContact O-N 3.1Å; H30-D32 PolarHBondContact O-N 3.09Å
31M65.7Low66.6Low147 Ų147128.3 Ų128.372%0.72466%0.661SS**  trans-55.9108174.4-70.3-91.8-85.600104.1A29 L33A29-M31 PolarHBondContact O-N 3.13Å; M31-L33 HydrophobicContact CB-CD2 4.11Å; M31-L33 WeakPolarHBondContact O-CG 3.43Å; M31-L33 PolarHBondContact O-N 2.75Å
32D68.6Low66.5Low135 Ų135122.5 Ų122.572%0.72265%0.645SS**  trans-67.992.5174-177.47.5000106.2H30 G34H30-D32 PolarHBondContact O-N 3.09Å; D32-G34 PolarHBondContact O-N 3.02Å; D32-G34 PolarHBondContact OD1-N 3.25Å; D32-G34 VanDerWaalsContact OD1-N 3.14Å
33L75.9Confident66.5Low139 Ų139117.8 Ų117.873%0.72863%0.625SS**  trans-68.210179.6-62.3178.2000112M31M31-L33 HydrophobicContact CB-CD2 4.11Å; M31-L33 WeakPolarHBondContact O-CG 3.43Å; M31-L33 PolarHBondContact O-N 2.75Å
34G70.6Confident66.8Low43 Ų43118.4 Ų118.444%0.44362%0.622SS.*  trans65.3173.5-174.600000111.4D32 K36D32-G34 PolarHBondContact O-N 3.02Å; D32-G34 PolarHBondContact OD1-N 3.25Å; D32-G34 VanDerWaalsContact OD1-N 3.14Å; G34-K36 PolarHBondContact O-N 2.77Å; G34-K36 VanDerWaalsContact O-N 3.15Å
35K71.8Confident67.5Low208 Ų208118.1 Ų118.190%0.90462%0.624SS**SBendtrans-67.4116.7167.9-64.7-167.7179.6-174.70107.6V37K35-V37 PolarHBondContact O-N 3.15Å; K35-V37 VanDerWaalsContact O-N 3.1Å
36K79.8Confident68.5Low184 Ų184121.4 Ų121.480%0.863%0.627SS**PPolyproline II helixtrans-50.8121.8171.5-71.4176.1-177.7-79.80107.8G34 S38G34-K36 PolarHBondContact O-N 2.77Å; G34-K36 VanDerWaalsContact O-N 3.15Å; K36-S38 PolarHBondContact O-N 3.41Å
37V71.3Confident69.4Low132 Ų132118 Ų11880%0.861%0.612SS**PPolyproline II helixtrans-60.7122.2172.4-148.70000106.4K35 I43K35-V37 PolarHBondContact O-N 3.15Å; K35-V37 VanDerWaalsContact O-N 3.1Å; V37-I43 HydrophobicContact CG1-CD1 4.4Å
38S72.4Confident70.2Confident42 Ų42113.1 Ų113.129%0.29459%0.59SS.*PPolyproline II helixtrans-65.2156.3-176.162.10000110.2K36 I43K36-S38 PolarHBondContact O-N 3.41Å; S38-I43 WeakPolarHBondContact O-CD1 3.41Å; S38-I43 WeakPolarHBondContact OG-CG1 3.39Å
39V78.4Confident71Confident90 Ų90108.6 Ų108.655%0.54557%0.571SS.*PPolyproline II helixtrans-58.6143.6179.7-179.60000107.6K41 D42 I43V39-K41 PolarHBondContact O-N 2.96Å; V39-D42 WeakPolarHBondContact CB-OD2 3.28Å; V39-D42 PolarHBondContact N-OD2 3.32Å; V39-D42 WeakPolarHBondContact O-CA 3.47Å; V39-D42 VanDerWaalsContact O-CB 3.31Å; V39-D42 WeakPolarHBondContact O-CB 3.08Å; V39-D42 PolarHBondContact O-N 2.97Å; V39-I43 PolarHBondContact O-N 3.26Å
40P73.8Confident71.7Confident99 Ų99110.6 Ų110.664%0.64358%0.576SS**Hα-helixtrans-51.6-26.9-173.1-32.136.1000116.2M44P40-M44 PolarHBondContact O-N 2.91Å
41K66.6Low71.8Confident160 Ų160106.4 Ų106.470%0.69657%0.571SS**Hα-helixtrans-70.7-35.8174-67.5-179.2178.5177.40112.9V39 M44 L45V39-K41 PolarHBondContact O-N 2.96Å; K41-M44 PolarHBondContact O-N 2.64Å; K41-L45 WeakPolarHBondContact O-CG 3.5Å; K41-L45 PolarHBondContact O-N 3.23Å
42D71.9Confident72.3Confident80 Ų80104.5 Ų104.543%0.42857%0.572SS.*Hα-helixtrans-71.4-40.4178.8-55-19.2000109.7V39 M44 L45 E46V39-D42 WeakPolarHBondContact CB-OD2 3.28Å; V39-D42 PolarHBondContact N-OD2 3.32Å; V39-D42 WeakPolarHBondContact O-CA 3.47Å; V39-D42 VanDerWaalsContact O-CB 3.31Å; V39-D42 WeakPolarHBondContact O-CB 3.08Å; V39-D42 PolarHBondContact O-N 2.97Å; D42-M44 VanDerWaalsContact C-N 3.33Å; D42-M44 PolarHBondContact O-N 3.2Å; D42-L45 PolarHBondContact O-N 3.49Å; D42-E46 WeakPolarHBondContact O-CB 3.39Å; D42-E46 PolarHBondContact O-N 2.94Å
43I68.9Low73Confident61 Ų61101.1 Ų101.131%0.31355%0.554SS.*Hα-helixtrans-57.4-45.8171.7-57.3175.8000110.6V37 S38 V39 L45 E46 E47V37-I43 HydrophobicContact CG1-CD1 4.4Å; S38-I43 WeakPolarHBondContact O-CD1 3.41Å; S38-I43 WeakPolarHBondContact OG-CG1 3.39Å; V39-I43 PolarHBondContact O-N 3.26Å; I43-L45 VanDerWaalsContact C-N 3.31Å; I43-L45 PolarHBondContact O-N 3.27Å; I43-E46 PolarHBondContact O-N 3.23Å; I43-E47 HydrophobicContact CG2-CG 4.03Å; I43-E47 WeakPolarHBondContact O-CB 3.47Å; I43-E47 VanDerWaalsContact O-CG 3.24Å; I43-E47 WeakPolarHBondContact O-CG 3.48Å; I43-E47 PolarHBondContact O-N 3.25Å
44M69.6Low73.5Confident127 Ų127104.1 Ų104.163%0.62656%0.555SS**Hα-helixtrans-60.6-39.2178.4-81.3177.736.600112.8P40 K41 D42 L48P40-M44 PolarHBondContact O-N 2.91Å; K41-M44 PolarHBondContact O-N 2.64Å; D42-M44 VanDerWaalsContact C-N 3.33Å; D42-M44 PolarHBondContact O-N 3.2Å; M44-L48 WeakPolarHBondContact O-CB 3.44Å; M44-L48 WeakPolarHBondContact O-CD1 3.34Å; M44-L48 WeakPolarHBondContact O-CG 3.33Å; M44-L48 PolarHBondContact O-N 3.41Å
45L72.3Confident74.2Confident123 Ų123103.9 Ų103.964%0.64455%0.553SS**Hα-helixtrans-73.1-39.9179.2-69.9172.8000111.9K41 D42 I43 L48 S49K41-L45 WeakPolarHBondContact O-CG 3.5Å; K41-L45 PolarHBondContact O-N 3.23Å; D42-L45 PolarHBondContact O-N 3.49Å; I43-L45 VanDerWaalsContact C-N 3.31Å; I43-L45 PolarHBondContact O-N 3.27Å; L45-L48 PolarHBondContact O-N 2.89Å; L45-S49 PolarHBondContact O-N 3.23Å
46E73.4Confident74.9Confident111 Ų11194 Ų9452%0.51951%0.51SS..Hα-helixtrans-64-46.6176-174.9177.6179.500111.7D42 I43 L48 S49 L50D42-E46 WeakPolarHBondContact O-CB 3.39Å; D42-E46 PolarHBondContact O-N 2.94Å; I43-E46 PolarHBondContact O-N 3.23Å; E46-L48 PolarHBondContact O-N 2.87Å; E46-S49 PolarHBondContact O-N 3.36Å; E46-S49 PolarHBondContact O-OG 3.44Å; E46-L50 PolarHBondContact O-N 3.32Å
47E75.6Confident75.2Confident86 Ų8692.2 Ų92.240%0.40250%0.498SS..Hα-helixtrans-65-29.9177.2-70.5-66.8161.500112.5I43 S56I43-E47 HydrophobicContact CG2-CG 4.03Å; I43-E47 WeakPolarHBondContact O-CB 3.47Å; I43-E47 VanDerWaalsContact O-CG 3.24Å; I43-E47 WeakPolarHBondContact O-CG 3.48Å; I43-E47 PolarHBondContact O-N 3.25Å; E47-S56 WeakPolarHBondContact O-CB 3.16Å
48L71Confident76.2Confident47 Ų4790.1 Ų90.125%0.24648%0.483CS..Hα-helixtrans-79-19.9173.9-70.9176000113.3M44 L45 E46 S56 F59M44-L48 WeakPolarHBondContact O-CB 3.44Å; M44-L48 WeakPolarHBondContact O-CD1 3.34Å; M44-L48 WeakPolarHBondContact O-CG 3.33Å; M44-L48 PolarHBondContact O-N 3.41Å; L45-L48 PolarHBondContact O-N 2.89Å; E46-L48 PolarHBondContact O-N 2.87Å; L48-S56 VanDerWaalsContact O-CB 3.29Å; L48-S56 WeakPolarHBondContact O-CB 3.39Å; L48-F59 HydrophobicContact CD1-CD1 4.18Å; L48-F59 HydrophobicContact CD1-CD2 4.37Å; L48-F59 HydrophobicContact CD1-CE1 4.19Å; L48-F59 HydrophobicContact CD1-CE2 4.37Å; L48-F59 HydrophobicContact CD1-CG 4.27Å; L48-F59 HydrophobicContact CD1-CZ 4.29Å; L48-F59 HydrophobicContact CD2-CB 3.66Å; L48-F59 HydrophobicContact CD2-CD1 4.02Å; L48-F59 HydrophobicContact CD2-CD2 4.34Å; L48-F59 HydrophobicContact CD2-CG 3.75Å
49S69.6Low77Confident67 Ų6792.7 Ų92.747%0.46949%0.489SS..Hα-helixtrans-79-36.1177.179.30000111.6L45 E46 A51L45-S49 PolarHBondContact O-N 3.23Å; E46-S49 PolarHBondContact O-N 3.36Å; E46-S49 PolarHBondContact O-OG 3.44Å; S49-A51 PolarHBondContact O-N 2.99Å; S49-A51 VanDerWaalsContact O-N 3.07Å
50L76.7Confident77.3Confident75 Ų7592.8 Ų92.839%0.39348%0.481SS..  trans-56.4109.3178.8-69.4169.6000111.8E46 S52 N53 S56E46-L50 PolarHBondContact O-N 3.32Å; L50-S52 PolarHBondContact O-N 3Å; L50-S52 VanDerWaalsContact O-N 3.15Å; L50-N53 PolarHBondContact O-N 3.44Å; L50-S56 WeakPolarHBondContact O-CB 3.34Å; L50-S56 PolarHBondContact O-OG 3.16Å
51A63.7Low78.1Confident79 Ų7991.2 Ų91.265%0.65347%0.466SS*.THydrogen-bonded Turntrans-69.1-10.9-17800000114.6S49S49-A51 PolarHBondContact O-N 2.99Å; S49-A51 VanDerWaalsContact O-N 3.07Å
52S75.7Confident79.4Confident106 Ų10692.3 Ų92.374%0.74147%0.466SS*.THydrogen-bonded Turntrans-86.1-20.9-179.357.50000113.8L50L50-S52 PolarHBondContact O-N 3Å; L50-S52 VanDerWaalsContact O-N 3.15Å
53N84.5Confident80.1Confident64 Ų6492.2 Ų92.234%0.34246%0.463SS..  trans-79.7139.3-176.5-170.1-49.5000111.8L50 G55 S56 R57L50-N53 PolarHBondContact O-N 3.44Å; N53-G55 VanDerWaalsContact C-N 3.33Å; N53-G55 PolarHBondContact O-N 2.98Å; N53-G55 WeakPolarHBondContact OD1-CA 3.38Å; N53-G55 PolarHBondContact OD1-N 3.47Å; N53-S56 PolarHBondContact O-OG 3.5Å; N53-R57 WeakPolarHBondContact O-CG 3.13Å; N53-R57 PolarHBondContact O-N 3.42Å
54R85.3Confident81.1Confident202 Ų20297.4 Ų97.476%0.76248%0.479SS*.Hα-helixtrans-64.4-37.8176.6-176.7179.8178.5-172.10.2112R57 L58R54-R57 PolarHBondContact O-N 2.96Å; R54-L58 HydrophobicContact CG-CD1 4.26Å; R54-L58 WeakPolarHBondContact O-CG 3.44Å; R54-L58 PolarHBondContact O-N 2.84Å
55G86.3Confident82.2Confident38 Ų3899.2 Ų99.239%0.39248%0.479SS..Hα-helixtrans-63.7-48.1179.600000112.4N53 R57 L58 F59N53-G55 VanDerWaalsContact C-N 3.33Å; N53-G55 PolarHBondContact O-N 2.98Å; N53-G55 WeakPolarHBondContact OD1-CA 3.38Å; N53-G55 PolarHBondContact OD1-N 3.47Å; G55-R57 VanDerWaalsContact C-N 3.32Å; G55-R57 PolarHBondContact O-N 2.91Å; G55-L58 PolarHBondContact O-N 3.4Å; G55-F59 WeakPolarHBondContact O-CB 3.48Å; G55-F59 PolarHBondContact O-N 3.45Å
56S85.5Confident83Confident2 Ų296.1 Ų96.11%0.01447%0.467CS..Hα-helixtrans-60.3-40.5175.963.70000112.2E47 L48 L50 N53 F59 K60E47-S56 WeakPolarHBondContact O-CB 3.16Å; L48-S56 VanDerWaalsContact O-CB 3.29Å; L48-S56 WeakPolarHBondContact O-CB 3.39Å; L50-S56 WeakPolarHBondContact O-CB 3.34Å; L50-S56 PolarHBondContact O-OG 3.16Å; N53-S56 PolarHBondContact O-OG 3.5Å; S56-F59 PolarHBondContact O-N 3.49Å; S56-K60 WeakPolarHBondContact O-CG 3.43Å; S56-K60 PolarHBondContact O-N 3.08Å
57R87.8Confident83.7Confident145 Ų14594.6 Ų94.655%0.54746%0.46SS..Hα-helixtrans-62.3-45.5174.4-70.7174.565177.22.5112.2N53 R54 G55 F59 K60 M61N53-R57 WeakPolarHBondContact O-CG 3.13Å; N53-R57 PolarHBondContact O-N 3.42Å; R54-R57 PolarHBondContact O-N 2.96Å; G55-R57 VanDerWaalsContact C-N 3.32Å; G55-R57 PolarHBondContact O-N 2.91Å; R57-F59 VanDerWaalsContact C-N 3.35Å; R57-K60 PolarHBondContact O-N 2.92Å; R57-M61 WeakPolarHBondContact O-CG 3.27Å; R57-M61 PolarHBondContact O-N 3.25Å
58L91.3Very high84.2Confident89 Ų8997.8 Ų97.847%0.46647%0.473SS..Hα-helixtrans-65.6-38.6178.3-74.2174.7000111.9R54 G55 M61 R62R54-L58 HydrophobicContact CG-CD1 4.26Å; R54-L58 WeakPolarHBondContact O-CG 3.44Å; R54-L58 PolarHBondContact O-N 2.84Å; G55-L58 PolarHBondContact O-N 3.4Å; L58-M61 PolarHBondContact O-N 3.16Å; L58-R62 WeakPolarHBondContact O-CB 3.45Å; L58-R62 PolarHBondContact O-N 2.77Å
59F88.2Confident84.8Confident96 Ų96104 Ų10442%0.42149%0.494SS..Hα-helixtrans-60.4-51.8173.8178.3-99.4000111.2L48 G55 S56 R57 M61 R62 Q63L48-F59 HydrophobicContact CD1-CD1 4.18Å; L48-F59 HydrophobicContact CD1-CD2 4.37Å; L48-F59 HydrophobicContact CD1-CE1 4.19Å; L48-F59 HydrophobicContact CD1-CE2 4.37Å; L48-F59 HydrophobicContact CD1-CG 4.27Å; L48-F59 HydrophobicContact CD1-CZ 4.29Å; L48-F59 HydrophobicContact CD2-CB 3.66Å; L48-F59 HydrophobicContact CD2-CD1 4.02Å; L48-F59 HydrophobicContact CD2-CD2 4.34Å; L48-F59 HydrophobicContact CD2-CG 3.75Å; G55-F59 WeakPolarHBondContact O-CB 3.48Å; G55-F59 PolarHBondContact O-N 3.45Å; S56-F59 PolarHBondContact O-N 3.49Å; R57-F59 VanDerWaalsContact C-N 3.35Å; F59-M61 VanDerWaalsContact C-N 3.31Å; F59-M61 PolarHBondContact O-N 2.92Å; F59-R62 PolarHBondContact O-N 2.78Å; F59-R62 VanDerWaalsContact O-N 3.09Å; F59-Q63 WeakPolarHBondContact O-CB 3.49Å; F59-Q63 PolarHBondContact O-N 3.41Å
60K85.7Confident85.4Confident91 Ų91104.4 Ų104.440%0.39649%0.494SS..Hα-helixtrans-59.5-37.6175.6-71.1-179.9-179.71780112.6S56 R57 R64S56-K60 WeakPolarHBondContact O-CG 3.43Å; S56-K60 PolarHBondContact O-N 3.08Å; R57-K60 PolarHBondContact O-N 2.92Å; K60-R64 WeakPolarHBondContact O-CG 3.39Å; K60-R64 PolarHBondContact O-N 2.73Å
61M90.8Very high84.8Confident66 Ų66109.7 Ų109.733%0.32551%0.514SS..Hα-helixtrans-66.7-41.6173.9-72.8-166-15800112.5R57 L58 F59 R65R57-M61 WeakPolarHBondContact O-CG 3.27Å; R57-M61 PolarHBondContact O-N 3.25Å; L58-M61 PolarHBondContact O-N 3.16Å; F59-M61 VanDerWaalsContact C-N 3.31Å; F59-M61 PolarHBondContact O-N 2.92Å; M61-R65 VanDerWaalsContact O-CG 3.28Å; M61-R65 WeakPolarHBondContact O-CG 3.35Å; M61-R65 PolarHBondContact O-N 3.09Å
62R92.9Very high84.9Confident183 Ų183113.9 Ų113.969%0.69152%0.52SS*.Hα-helixtrans-65.1-43176.9-179.6174.4-79.7141.8-5.9110.7L58 F59 R65 S66L58-R62 WeakPolarHBondContact O-CB 3.45Å; L58-R62 PolarHBondContact O-N 2.77Å; F59-R62 PolarHBondContact O-N 2.78Å; F59-R62 VanDerWaalsContact O-N 3.09Å; R62-R65 WeakPolarHBondContact O-CB 3.35Å; R62-R65 PolarHBondContact O-N 3.31Å; R62-S66 PolarHBondContact O-N 3.16Å; R62-S66 PolarHBondContact O-OG 3.4Å
63Q87.9Confident84.1Confident79 Ų79111.5 Ų111.537%0.36950%0.503SS..Hα-helixtrans-58-51174.5179.7175.26.900111.6F59 R65 S66 E67F59-Q63 WeakPolarHBondContact O-CB 3.49Å; F59-Q63 PolarHBondContact O-N 3.41Å; Q63-R65 VanDerWaalsContact C-N 3.27Å; Q63-R65 PolarHBondContact O-N 3.07Å; Q63-S66 WeakPolarHBondContact CA-OG 3.33Å; Q63-S66 PolarHBondContact O-N 3.42Å; Q63-S66 VanDerWaalsContact O-N 3.09Å; Q63-S66 PolarHBondContact O-OG 3.09Å; Q63-E67 HydrophobicContact CG-CG 4.35Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.46Å; Q63-E67 PolarHBondContact NE2-OE1 2.88Å; Q63-E67 WeakPolarHBondContact O-CB 3.33Å; Q63-E67 VanDerWaalsContact O-CG 3.27Å; Q63-E67 WeakPolarHBondContact O-CG 3.43Å; Q63-E67 PolarHBondContact O-N 3.27Å
64R88.4Confident82.8Confident169 Ų169114.6 Ų114.664%0.63852%0.519SS*.Hα-helixtrans-60.1-36.5175.7-74.7-166.6-64.8171.3-1.9113.2K60 K68K60-R64 WeakPolarHBondContact O-CG 3.39Å; K60-R64 PolarHBondContact O-N 2.73Å; R64-K68 PolarHBondContact O-N 3.44Å; R64-K68 VanDerWaalsContact O-N 3.13Å
65R93.5Very high81.3Confident166 Ų166111.9 Ų111.963%0.62652%0.515SS*.Hα-helixtrans-66.6-41.5175.3-73.6172.5-171.7162.92.8111.3M61 R62 Q63 K68 Y69M61-R65 VanDerWaalsContact O-CG 3.28Å; M61-R65 WeakPolarHBondContact O-CG 3.35Å; M61-R65 PolarHBondContact O-N 3.09Å; R62-R65 WeakPolarHBondContact O-CB 3.35Å; R62-R65 PolarHBondContact O-N 3.31Å; Q63-R65 VanDerWaalsContact C-N 3.27Å; Q63-R65 PolarHBondContact O-N 3.07Å; R65-K68 WeakPolarHBondContact O-CB 3.44Å; R65-Y69 WeakPolarHBondContact O-CD2 3.09Å
66S89.5Confident79.9Confident58 Ų58114.5 Ų114.541%0.40652%0.52SS..Hα-helixtrans-69.4-41.8177.751.80000112R62 Q63 K68 Y69 T70R62-S66 PolarHBondContact O-N 3.16Å; R62-S66 PolarHBondContact O-OG 3.4Å; Q63-S66 WeakPolarHBondContact CA-OG 3.33Å; Q63-S66 PolarHBondContact O-N 3.42Å; Q63-S66 VanDerWaalsContact O-N 3.09Å; Q63-S66 PolarHBondContact O-OG 3.09Å; S66-K68 PolarHBondContact O-N 2.91Å; S66-Y69 PolarHBondContact O-N 3.4Å; S66-Y69 VanDerWaalsContact O-N 3.09Å; S66-T70 WeakPolarHBondContact O-CB 3.35Å; S66-T70 PolarHBondContact O-N 3.2Å; S66-T70 PolarHBondContact O-OG1 3.37Å
67E87.1Confident78.4Confident79 Ų79120.3 Ų120.337%0.36955%0.547SS..Hα-helixtrans-60.2-35.4177.4-71.9166.1176.900111.5Q63 Y69 T70Q63-E67 HydrophobicContact CG-CG 4.35Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.46Å; Q63-E67 PolarHBondContact NE2-OE1 2.88Å; Q63-E67 WeakPolarHBondContact O-CB 3.33Å; Q63-E67 VanDerWaalsContact O-CG 3.27Å; Q63-E67 WeakPolarHBondContact O-CG 3.43Å; Q63-E67 PolarHBondContact O-N 3.27Å; E67-Y69 PolarHBondContact O-N 2.97Å; E67-Y69 VanDerWaalsContact O-N 3.15Å; E67-T70 PolarHBondContact O-N 3.33Å
68K86Confident76.7Confident152 Ų152118.3 Ų118.366%0.66155%0.55SS**THydrogen-bonded Turntrans-58-28.3176-176.4175.8176.7-171.40114.1R64 R65 S66R64-K68 PolarHBondContact O-N 3.44Å; R64-K68 VanDerWaalsContact O-N 3.13Å; R65-K68 WeakPolarHBondContact O-CB 3.44Å; S66-K68 PolarHBondContact O-N 2.91Å
69Y83.6Confident74.9Confident179 Ų179118.6 Ų118.670%0.70255%0.552SS**THydrogen-bonded Turntrans-118.64.1-173.4-55.9-71.4000113.3R65 S66 E67R65-Y69 WeakPolarHBondContact O-CD2 3.09Å; S66-Y69 PolarHBondContact O-N 3.4Å; S66-Y69 VanDerWaalsContact O-N 3.09Å; E67-Y69 PolarHBondContact O-N 2.97Å; E67-Y69 VanDerWaalsContact O-N 3.15Å
70T82.8Confident73.4Confident75 Ų75119.6 Ų119.646%0.4656%0.562SS.*  trans-108.4109.5178.3-48.80000108.7S66 E67 E72S66-T70 WeakPolarHBondContact O-CB 3.35Å; S66-T70 PolarHBondContact O-N 3.2Å; S66-T70 PolarHBondContact O-OG1 3.37Å; E67-T70 PolarHBondContact O-N 3.33Å; T70-E72 HydrophobicContact CG2-CB 4.47Å; T70-E72 PolarHBondContact O-N 2.82Å; T70-E72 VanDerWaalsContact O-N 3.16Å
71F64.9Low71.8Confident185 Ų185122 Ų12281%0.81158%0.575SS**G310 helixtrans-66.6-14.9-174.4-173.6-105.5000113.7S73F71-S73 PolarHBondContact O-N 3.09Å
72E65.2Low70Confident167 Ų167124.6 Ų124.678%0.7859%0.59SS**G310 helixtrans-85.8-1.1-174.4-50.9-165.6-164.700114.4T70 I74T70-E72 HydrophobicContact CG2-CB 4.47Å; T70-E72 PolarHBondContact O-N 2.82Å; T70-E72 VanDerWaalsContact O-N 3.16Å; E72-I74 PolarHBondContact O-N 2.9Å; E72-I74 VanDerWaalsContact O-N 3.1Å
73S59Low67.9Low56 Ų56121.8 Ų121.839%0.39259%0.588SS.*G310 helixtrans-67.2-10.6-176.6-171.90000114.8F71 Q75F71-S73 PolarHBondContact O-N 3.09Å; S73-Q75 PolarHBondContact O-N 3.27Å
74I58Low65.9Low130 Ų130121.7 Ų121.767%0.66760%0.596SS**G310 helixtrans-73.3-10.9-173-57.8173.7000112.4E72E72-I74 PolarHBondContact O-N 2.9Å; E72-I74 VanDerWaalsContact O-N 3.1Å
75Q53.7Low63.7Low144 Ų144121.1 Ų121.167%0.67360%0.601SS**G310 helixtrans-108.18.5-176.4-65.2-72.5-7400114.7S73 E77S73-Q75 PolarHBondContact O-N 3.27Å; Q75-E77 PolarHBondContact O-N 3.21Å; Q75-E77 VanDerWaalsContact O-N 3.15Å
76N55.3Low61.4Low93 Ų93121.5 Ų121.550%0.49761%0.61SS.*  trans-90.152.8179-108.60.3000112.2T78 N79N76-T78 PolarHBondContact O-N 2.98Å; N76-N79 PolarHBondContact O-N 3.02Å
77E54Low59.1Low125 Ų125124.1 Ų124.158%0.58462%0.623SS**Hα-helixtrans-69.3-21-177.5-29.9-161-162.900111.8Q75Q75-E77 PolarHBondContact O-N 3.21Å; Q75-E77 VanDerWaalsContact O-N 3.15Å
78T53.7Low56.8Low102 Ų102128.8 Ų128.863%0.62664%0.642SS**Hα-helixtrans-73.6-24.6177.938.30000114.2N76N76-T78 PolarHBondContact O-N 2.98Å
79N53.3Low54.5Low95 Ų95130.2 Ų130.251%0.50865%0.651SS.*Hα-helixtrans-85.5-22.1-179.6-94-34000114.1N76 Q81N76-N79 PolarHBondContact O-N 3.02Å; N79-Q81 VanDerWaalsContact C-N 3.31Å; N79-Q81 PolarHBondContact O-N 2.86Å
80N55.6Low52.3Low117 Ų117127.7 Ų127.763%0.62666%0.655SS**Hα-helixtrans-70.4-27.8178-80.1-32.5000112.7N83 S84N80-N83 PolarHBondContact O-N 3.15Å; N80-S84 PolarHBondContact O-OG 3.13Å
81Q52.3Low50Low141 Ų141133.4 Ų133.466%0.65968%0.676SS**Hα-helixtrans-72-30.5-177.5-66.8-173.764.700113.2N79N79-Q81 VanDerWaalsContact C-N 3.31Å; N79-Q81 PolarHBondContact O-N 2.86Å
82L53.3Low48.5Very low122 Ų122133.8 Ų133.864%0.63967%0.673SS**Hα-helixtrans-73.3-29.9178.1-69.8172.3000112.8
83N48.9Very low47.1Very low124 Ų124133 Ų13366%0.66368%0.675SS**Hα-helixtrans-81.9-19.9-179.3-166.347.4000113.2N80N80-N83 PolarHBondContact O-N 3.15Å
84S45.5Very low46.2Very low76 Ų76135.9 Ų135.953%0.53169%0.692SS.*Hα-helixtrans-84.1-20.7177.3-60.90000113.6N80N80-S84 PolarHBondContact O-OG 3.13Å
85Q41.8Very low44.9Very low158 Ų158136 Ų13674%0.73870%0.699SS**Hα-helixtrans-81.6-21.8-175.8-164.7167.5-800113.6V87Q85-V87 VanDerWaalsContact C-N 3.31Å; Q85-V87 PolarHBondContact O-N 2.77Å
86E45.3Very low43.8Very low174 Ų174135.7 Ų135.781%0.81371%0.707SS**THydrogen-bonded Turntrans-80.3-4176.6-75.1-149.3138.700114.7
87V42.2Very low42.5Very low112 Ų112135 Ų13568%0.67972%0.722SS**THydrogen-bonded Turntrans-89.8-6.1-176.2178.80000113.5Q85Q85-V87 VanDerWaalsContact C-N 3.31Å; Q85-V87 PolarHBondContact O-N 2.77Å
88F39Very low41.3Very low178 Ų178133.1 Ų133.178%0.78174%0.736SS**SBendtrans-108.447.4-175.8-67.6-76000114.8
89Q36.9Very low40.1Very low182 Ų182131.2 Ų131.285%0.8574%0.737SS**  trans-147.865.6161.1-69.1-1655.700112
90T37.9Very low39.2Very low126 Ų126134 Ų13477%0.77375%0.752SS**  trans-150.564.8152.7-37.30000109.6Y92T90-Y92 HydrophobicContact CG2-CE1 4.42Å
91E33.5Very low38.2Very low194 Ų194135.3 Ų135.391%0.90776%0.759SS**  trans-104.498.6164.9-169.1173.5-171.100108.3
92Y34.8Very low37.4Very low193 Ų193135.9 Ų135.976%0.75777%0.766SS**  trans-144.4104.4148.355-93.7000110.6T90T90-Y92 HydrophobicContact CG2-CE1 4.42Å
93N34.6Very low36.5Very low152 Ų152133.3 Ų133.381%0.81377%0.769SS**  trans72.7127.7150.1-62.2-21.6000121.9
94P40.7Very low35.9Very low115 Ų115133.8 Ų133.875%0.74778%0.776SS**  trans-94.6141.7178.937.1-31.4000111.7
95T29.8Very low35.4Very low133 Ų133139.2 Ų139.282%0.81679%0.793SS**  trans-158.7106.5153.9-55.40000110.6
96T31.5Very low35Very low137 Ų137139.6 Ų139.684%0.8480%0.795SS**  trans67.7105.5141-42.20000120.9
97G27.8Very low34.4Very low79 Ų79137 Ų13781%0.81479%0.793SS**  102.7111.4116.600000119.2
98G28.4Very low33.9Very low85 Ų85137.7 Ų137.788%0.87680%0.801SS**  trans120.3113.613400000118.1
99G29.4Very low33.8Very low63 Ų63138.3 Ų138.365%0.64981%0.807SS**  trans112.49813800000118.1
100N33.7Very low33.5Very low154 Ų154135.8 Ų135.882%0.82480%0.803SS**  37.4138.8122-34.4-26.1000117.4
101D35Very low33.2Very low143 Ų143135.2 Ų135.277%0.76580%0.8SS**  cis-175.4167.638.9-1433.2000111.6
102L35.5Very low33.3Very low153 Ų153131.4 Ų131.480%0.80180%0.795SS**  trans-30.9145.9-177.1-81.477.4000120.4
103G34.6Very low33.3Very low69 Ų69129.5 Ų129.571%0.71180%0.797SS**  trans-81162.5163.800000114.6
104V35.4Very low33.2Very low133 Ų133127.1 Ų127.181%0.80680%0.799SS**  trans-147.1118.6160.2176.10000108.4
105Q36.5Very low33.2Very low191 Ų191126.7 Ų126.789%0.89380%0.799SS**  trans-77.6134.9159.9-69.4177.933.600108.6
106Q33.3Very low33.8Very low166 Ų166128.2 Ų128.278%0.77680%0.802SS**  trans-152.6124.9155.4-164.9135.81700111.7
107P32.8Very low34.3Very low119 Ų119126.5 Ų126.577%0.77379%0.792SS**  trans-88.5141.4174.833.3-31.2000111.4
108C31.2Very low35.3Very low127 Ų127129.4 Ų129.486%0.85879%0.794SS**  trans-107.6112.4172.2-66.20000110.7
109Q36.5Very low36.2Very low191 Ų191132.9 Ų132.989%0.89379%0.789SS**  trans-89.1127.7157.4-75.6-172-10.200108.8
110V30.1Very low37.3Very low129 Ų129135.9 Ų135.978%0.78279%0.794SS**  trans-148.6104.6159.4-1790000110.8
111T31.7Very low38Very low114 Ų114134.2 Ų134.270%0.69979%0.792SS**  trans36.3118.3140.669.10000121.6
112S35.8Very low39Very low114 Ų114131.9 Ų131.980%0.79778%0.78SS**  trans-64.6132.2153.949.60000111.9
113N34.1Very low40.1Very low152 Ų152129.5 Ų129.581%0.81377%0.773SS**  trans-137.5109.6155.8-83.6-36.5000109.2
114A33.8Very low41.2Very low103 Ų103133 Ų13385%0.85178%0.776SS**  trans-72.2127.4167.700000109
115S40.7Very low42.2Very low105 Ų105131.4 Ų131.473%0.73477%0.77SS**  trans-115.3112.1154.728.50000107T117S115-T117 PolarHBondContact O-N 3.48Å
116D41.7Very low43.4Very low165 Ų165127.2 Ų127.288%0.88275%0.753SS**  trans-50.4107.9170.8-80.4-44.4000109.9
117T41.5Very low44.4Very low102 Ų102122.1 Ų122.163%0.62674%0.739SS**  trans-110.8103.7160.5-51.50000106.4S115 M119S115-T117 PolarHBondContact O-N 3.48Å; T117-M119 HydrophobicContact CG2-CE 4.12Å; T117-M119 HydrophobicContact CG2-CG 3.7Å; T117-M119 PolarHBondContact O-N 2.81Å
118T50.4Low45.7Very low140 Ų140123.1 Ų123.186%0.85975%0.746SS**  trans-62.177.9167.8-1.40000108.7V120T118-V120 PolarHBondContact O-N 3.28Å
119M47.3Very low47Very low158 Ų158120.6 Ų120.678%0.77874%0.742SS**  trans-8291.7172-77.7-125.2158.300108.3T117 P121T117-M119 HydrophobicContact CG2-CE 4.12Å; T117-M119 HydrophobicContact CG2-CG 3.7Å; T117-M119 PolarHBondContact O-N 2.81Å; M119-P121 VanDerWaalsContact O-CD 3.22Å; M119-P121 WeakPolarHBondContact O-CD 3.39Å
120V52.5Low47.9Very low126 Ų126119.8 Ų119.876%0.76473%0.731SS**  trans-61.1114.7161.41790000106.6T118 N122T118-V120 PolarHBondContact O-N 3.28Å; V120-N122 PolarHBondContact O-N 3.02Å
121P48.3Very low49.4Very low119 Ų119117.5 Ų117.577%0.77373%0.734SS**  trans-73.5102.1-179.9-5.822.2000107.8M119 P123M119-P121 VanDerWaalsContact O-CD 3.22Å; M119-P121 WeakPolarHBondContact O-CD 3.39Å; P121-P123 WeakPolarHBondContact O-CD 3.47Å
122N56.3Low51Low94 Ų94114 Ų11450%0.50372%0.721SS.*  trans-78.7116.6170-175-5.6000108.4V120 D124 S125V120-N122 PolarHBondContact O-N 3.02Å; N122-D124 PolarHBondContact O-N 3.45Å; N122-D124 VanDerWaalsContact O-N 3.12Å; N122-D124 PolarHBondContact OD1-N 2.93Å; N122-D124 VanDerWaalsContact OD1-N 3.11Å; N122-S125 PolarHBondContact O-N 2.85Å; N122-S125 VanDerWaalsContact O-N 3.12Å
123P57.5Low52.6Low103 Ų103114 Ų11467%0.66972%0.718SS**THydrogen-bonded Turntrans-64.5-13.3-179.627.7-35.7000113.8P121P121-P123 WeakPolarHBondContact O-CD 3.47Å
124D57.4Low54.1Low142 Ų142112.3 Ų112.376%0.75971%0.708SS**THydrogen-bonded Turntrans-91.7-1.2177.9-60.6-33.4000113.4N122 I126N122-D124 PolarHBondContact O-N 3.45Å; N122-D124 VanDerWaalsContact O-N 3.12Å; N122-D124 PolarHBondContact OD1-N 2.93Å; N122-D124 VanDerWaalsContact OD1-N 3.11Å; D124-I126 VanDerWaalsContact C-N 3.32Å; D124-I126 PolarHBondContact O-N 3.22Å
125S57.4Low55.5Low99 Ų99116.3 Ų116.369%0.69271%0.707SS**  trans-93.925.5178.5-173.90000113.3N122N122-S125 PolarHBondContact O-N 2.85Å; N122-S125 VanDerWaalsContact O-N 3.12Å
126I60.8Low56.7Low103 Ų103118.7 Ų118.753%0.52871%0.711SS.*SBendtrans-75.7135.9165.8-56.7173.3000106.6D124D124-I126 VanDerWaalsContact C-N 3.32Å; D124-I126 PolarHBondContact O-N 3.22Å
127A55.3Low57.7Low59 Ų59116 Ų11649%0.48870%0.695SS.*  trans-43.2135.2-178.300000111.9G129 Y130A127-G129 PolarHBondContact O-N 2.7Å; A127-Y130 HydrophobicContact CB-CD2 4.35Å; A127-Y130 PolarHBondContact O-N 2.75Å
128P58.6Low59.2Low140 Ų140115.9 Ų115.991%0.90970%0.697SS**THydrogen-bonded Turntrans-50.1114.8-178.8-2632.9000110.5
129G58.4Low59.9Low75 Ų75114.7 Ų114.777%0.77369%0.691SS**THydrogen-bonded Turntrans123.6-10-179.200000116.5A127A127-G129 PolarHBondContact O-N 2.7Å
130Y57.3Low60.8Low173 Ų173114.6 Ų114.668%0.67869%0.689SS**  trans-114.47.8-178.1-69.5-86.5000114.8A127 G132A127-Y130 HydrophobicContact CB-CD2 4.35Å; A127-Y130 PolarHBondContact O-N 2.75Å; Y130-G132 PolarHBondContact O-N 3.44Å; Y130-G132 VanDerWaalsContact O-N 3.1Å
131G59.6Low61.4Low81 Ų81117.7 Ų117.784%0.83569%0.692SS**SBendtrans-78.724.1-175.600000116.1
132G67.2Low61.7Low42 Ų42119.7 Ų119.743%0.43369%0.689SS.*SBendtrans-176.8165.8178.500000113.8Y130 L134Y130-G132 PolarHBondContact O-N 3.44Å; Y130-G132 VanDerWaalsContact O-N 3.1Å; G132-L134 PolarHBondContact O-N 3.37Å
133P67.6Low61.6Low113 Ų113121 Ų12173%0.73470%0.696SS**SBendtrans-51.3134.1169.8-21.632.1000109.2K135P133-K135 VanDerWaalsContact C-N 3.31Å; P133-K135 WeakPolarHBondContact O-CG 3.29Å; P133-K135 PolarHBondContact O-N 2.98Å
134L66Low61.4Low116 Ų116122 Ų12261%0.60771%0.706SS**  trans-6593.1-178.2-74.587.9000109.1G132 D136 I137G132-L134 PolarHBondContact O-N 3.37Å; L134-D136 PolarHBondContact O-N 3.35Å; L134-I137 HydrophobicContact CB-CB 4.32Å; L134-I137 HydrophobicContact CB-CD1 4.4Å; L134-I137 HydrophobicContact CB-CG1 4.13Å; L134-I137 HydrophobicContact CD2-CD1 3.17Å; L134-I137 HydrophobicContact CD2-CG1 3.67Å; L134-I137 HydrophobicContact CG-CD1 4.38Å
135K63.8Low61.3Low188 Ų188120.6 Ų120.682%0.81770%0.702SS**SBendtrans-72.6-21.6-179-66.9-173.6179.7-178.50112.2P133P133-K135 VanDerWaalsContact C-N 3.31Å; P133-K135 WeakPolarHBondContact O-CG 3.29Å; P133-K135 PolarHBondContact O-N 2.98Å
136D64.9Low61.2Low155 Ų155119.9 Ų119.983%0.82970%0.702SS**SBendtrans-105.1-5.4-170.6-54.9-42.2000113.7L134 P138L134-D136 PolarHBondContact O-N 3.35Å; D136-P138 VanDerWaalsContact O-CD 3.29Å; D136-P138 WeakPolarHBondContact O-CD 3.08Å
137I63.9Low61.2Low107 Ų107119.2 Ų119.255%0.54970%0.703SS.*SBendtrans-84.3112.9169.6-62.8-165.4000107.1L134L134-I137 HydrophobicContact CB-CB 4.32Å; L134-I137 HydrophobicContact CB-CD1 4.4Å; L134-I137 HydrophobicContact CB-CG1 4.13Å; L134-I137 HydrophobicContact CD2-CD1 3.17Å; L134-I137 HydrophobicContact CD2-CG1 3.67Å; L134-I137 HydrophobicContact CG-CD1 4.38Å
138P71.8Confident61.4Low101 Ų101120.3 Ų120.366%0.65671%0.705SS**  trans-57138.2173.625-32.4000108D136 E140D136-P138 VanDerWaalsContact O-CD 3.29Å; D136-P138 WeakPolarHBondContact O-CD 3.08Å; P138-E140 PolarHBondContact O-N 3.06Å
139P66.1Low61.6Low114 Ų114123.7 Ų123.774%0.7471%0.705SS**  trans-50.9124.1179.521.1-32000108.1K141P139-K141 PolarHBondContact O-N 3.22Å
140E65.6Low62.1Low156 Ų156124.6 Ų124.673%0.72970%0.7SS**  trans-50.9109.7176.4-176.7175.3179.600106.7P138 F142P138-E140 PolarHBondContact O-N 3.06Å; E140-F142 HydrophobicContact CG-CD2 4.28Å; E140-F142 PolarHBondContact O-N 3.1Å
141K64.9Low63.1Low191 Ų191123.3 Ų123.383%0.8370%0.695SS**  trans-71.279174-63.9-173.5-177.6-176.20105.4P139 N143P139-K141 PolarHBondContact O-N 3.22Å; K141-N143 PolarHBondContact O-N 3.46Å
142F55.2Low63.7Low161 Ų161124.9 Ų124.971%0.70668%0.68SS**  trans-43.5120.5167.5-110.9-92.7000106.4E140 S144E140-F142 HydrophobicContact CG-CD2 4.28Å; E140-F142 PolarHBondContact O-N 3.1Å; F142-S144 PolarHBondContact O-N 3.29Å
143N53.7Low64.4Low123 Ų123124.1 Ų124.166%0.65867%0.668SS**  trans-49.197.4-165.9-60.2-68.1000110.9K141 T145 A146K141-N143 PolarHBondContact O-N 3.46Å; N143-T145 PolarHBondContact O-N 3.35Å; N143-A146 PolarHBondContact O-N 2.9Å
144S54.8Low65.2Low124 Ų124122.4 Ų122.487%0.86766%0.657SS**THydrogen-bonded Turntrans-66.16.3171.4-64.70000112.3F142F142-S144 PolarHBondContact O-N 3.29Å
145T55.3Low66Low112 Ų112126.3 Ų126.369%0.68766%0.664SS**THydrogen-bonded Turntrans-113.84.1-176.544.70000113.1N143 V147N143-T145 PolarHBondContact O-N 3.35Å; T145-V147 PolarHBondContact O-N 3.41Å
146A55.1Low67Low84 Ų84121.6 Ų121.669%0.69465%0.645SS**SBendtrans-70.9-16.8176.500000113.2N143N143-A146 PolarHBondContact O-N 2.9Å
147V60.5Low67.9Low88 Ų88119.8 Ų119.853%0.53363%0.631SS.*SBendtrans-90.8119.9171.3-165.80000107.6T145 K149 Y151T145-V147 PolarHBondContact O-N 3.41Å; V147-K149 PolarHBondContact O-N 3.15Å; V147-Y151 HydrophobicContact CG1-CD1 4Å; V147-Y151 HydrophobicContact CG1-CG 4.31Å
148P59Low68.9Low83 Ų83117.1 Ų117.154%0.53963%0.625SS.*  trans-52131.7169.9-21.231.2000108.2S150 Y151P148-S150 PolarHBondContact O-N 2.59Å; P148-Y151 PolarHBondContact O-N 2.93Å
149K62.1Low69.6Low210 Ų210115 Ų11591%0.91361%0.608SS**THydrogen-bonded Turntrans-57-2.6179.2-66.9-179.7176.8-178.50114.5V147V147-K149 PolarHBondContact O-N 3.15Å
150S70.1Confident70.4Confident95 Ų95114.7 Ų114.766%0.66460%0.599SS**THydrogen-bonded Turntrans-100.5-11.8177.860.20000114.2P148 H152P148-S150 PolarHBondContact O-N 2.59Å; S150-H152 PolarHBondContact O-N 3.07Å
151Y77.3Confident71.4Confident146 Ų146111.7 Ų111.757%0.57360%0.595SS**  trans-76.5113.2176.4-180-101000108.9V147 P148V147-Y151 HydrophobicContact CG1-CD1 4Å; V147-Y151 HydrophobicContact CG1-CG 4.31Å; P148-Y151 PolarHBondContact O-N 2.93Å
152H73.2Confident72.6Confident113 Ų113105.8 Ų105.852%0.52357%0.573SS.*  trans-104.1130.2168.8-69.8-71.6000108.1S150S150-H152 PolarHBondContact O-N 3.07Å
153S81.6Confident74Confident27 Ų27103 Ų10319%0.18957%0.571CS.*  trans-66.1132176.1176.90000108.8W155 E156 Q157S153-W155 PolarHBondContact O-N 3.21Å; S153-W155 PolarHBondContact OG-N 2.75Å; S153-E156 PolarHBondContact N-OE2 3.37Å; S153-E156 VanDerWaalsContact N-OE2 3.08Å; S153-E156 WeakPolarHBondContact O-CB 3.32Å; S153-E156 PolarHBondContact O-N 3.22Å; S153-Q157 PolarHBondContact O-N 3.18Å; S153-Q157 VanDerWaalsContact O-N 3.16Å
154P84.3Confident75.6Confident77 Ų77100.7 Ų100.750%0.557%0.569SS.*Hα-helixtrans-54.7-27.1172.8-26.835.1000112.8Q157 A158P154-Q157 PolarHBondContact O-N 3.2Å; P154-A158 WeakPolarHBondContact O-CB 3.31Å; P154-A158 PolarHBondContact O-N 3.4Å
155W83.5Confident77Confident198 Ų19898.6 Ų98.675%0.7555%0.547SS*.Hα-helixtrans-70.8-38.6174.3-64.3100.2000112.9S153 Q157 A158 I159S153-W155 PolarHBondContact O-N 3.21Å; S153-W155 PolarHBondContact OG-N 2.75Å; W155-Q157 VanDerWaalsContact C-N 3.3Å; W155-Q157 PolarHBondContact O-N 3.42Å; W155-A158 PolarHBondContact O-N 2.87Å; W155-I159 WeakPolarHBondContact O-CB 3.41Å; W155-I159 WeakPolarHBondContact O-CD1 3.34Å; W155-I159 WeakPolarHBondContact O-CG1 3.06Å; W155-I159 PolarHBondContact O-N 2.89Å
156E84.2Confident78.3Confident89 Ų8994.9 Ų94.942%0.41653%0.528SS..Hα-helixtrans-62-42.5172.8-71.3167.3164.700110.1S153 I159 I160S153-E156 PolarHBondContact N-OE2 3.37Å; S153-E156 VanDerWaalsContact N-OE2 3.08Å; S153-E156 WeakPolarHBondContact O-CB 3.32Å; S153-E156 PolarHBondContact O-N 3.22Å; E156-I159 PolarHBondContact O-N 3.37Å; E156-I160 HydrophobicContact CB-CD1 4.5Å; E156-I160 WeakPolarHBondContact O-CB 3.24Å; E156-I160 WeakPolarHBondContact O-CD1 3.5Å; E156-I160 WeakPolarHBondContact O-CG1 3.36Å; E156-I160 PolarHBondContact O-N 2.91Å
157Q83.3Confident79.5Confident116 Ų11698.1 Ų98.154%0.54253%0.534SS..Hα-helixtrans-63.6-44.5177.4-66.8-179.8-15.800112.3S153 P154 W155 I160 S161S153-Q157 PolarHBondContact O-N 3.18Å; S153-Q157 VanDerWaalsContact O-N 3.16Å; P154-Q157 PolarHBondContact O-N 3.2Å; W155-Q157 VanDerWaalsContact C-N 3.3Å; W155-Q157 PolarHBondContact O-N 3.42Å; Q157-I160 PolarHBondContact O-N 3.26Å; Q157-S161 WeakPolarHBondContact O-CB 3.49Å; Q157-S161 PolarHBondContact O-N 2.82Å; Q157-S161 PolarHBondContact O-OG 3.36Å
158A85Confident80.6Confident51 Ų5198.2 Ų98.242%0.42154%0.535SS..Hα-helixtrans-62.1-43.3177.100000111.9P154 W155 S161P154-A158 WeakPolarHBondContact O-CB 3.31Å; P154-A158 PolarHBondContact O-N 3.4Å; W155-A158 PolarHBondContact O-N 2.87Å; A158-S161 PolarHBondContact O-N 3.04Å; A158-S161 PolarHBondContact O-OG 3.04Å
159I85.9Confident81.7Confident56 Ų5697.3 Ų97.329%0.28753%0.525SS..Hα-helixtrans-69-40.5179.8-67.2163.8000111.4W155 E156 S161 L165 A166 L169W155-I159 WeakPolarHBondContact O-CB 3.41Å; W155-I159 WeakPolarHBondContact O-CD1 3.34Å; W155-I159 WeakPolarHBondContact O-CG1 3.06Å; W155-I159 PolarHBondContact O-N 2.89Å; E156-I159 PolarHBondContact O-N 3.37Å; I159-S161 VanDerWaalsContact C-N 3.32Å; I159-S161 PolarHBondContact O-N 3Å; I159-L165 HydrophobicContact CG2-CB 4.14Å; I159-A166 PolarHBondContact O-N 3.21Å; I159-L169 HydrophobicContact CB-CD1 4.3Å; I159-L169 HydrophobicContact CG2-CB 4.22Å; I159-L169 HydrophobicContact CG2-CD1 3.8Å
160I84.4Confident82.3Confident109 Ų10992.2 Ų92.256%0.55951%0.511SS*.Hα-helixtrans-68.5-32.2177.6-68.5164.6000111.5E156 Q157 D162 L169E156-I160 HydrophobicContact CB-CD1 4.5Å; E156-I160 WeakPolarHBondContact O-CB 3.24Å; E156-I160 WeakPolarHBondContact O-CD1 3.5Å; E156-I160 WeakPolarHBondContact O-CG1 3.36Å; E156-I160 PolarHBondContact O-N 2.91Å; Q157-I160 PolarHBondContact O-N 3.26Å; I160-D162 VanDerWaalsContact C-N 3.3Å; I160-D162 PolarHBondContact O-N 3.27Å; I160-L169 HydrophobicContact CG1-CD1 4.39Å
161S85.8Confident82.5Confident93 Ų9393.2 Ų93.265%0.6552%0.518SS*.Hα-helixtrans-69.2-26.4-178.672.40000114Q157 A158 I159Q157-S161 WeakPolarHBondContact O-CB 3.49Å; Q157-S161 PolarHBondContact O-N 2.82Å; Q157-S161 PolarHBondContact O-OG 3.36Å; A158-S161 PolarHBondContact O-N 3.04Å; A158-S161 PolarHBondContact O-OG 3.04Å; I159-S161 VanDerWaalsContact C-N 3.32Å; I159-S161 PolarHBondContact O-N 3Å
162D90Very high82.1Confident66 Ų6696 Ų9635%0.35353%0.528SS..SBendtrans-95.6112.6176.2-177.9-7.5000109.7I160 A164 L165 A166I160-D162 VanDerWaalsContact C-N 3.3Å; I160-D162 PolarHBondContact O-N 3.27Å; D162-A164 PolarHBondContact O-N 3.07Å; D162-A164 VanDerWaalsContact O-N 3.16Å; D162-A164 WeakPolarHBondContact OD1-CB 3.5Å; D162-A164 PolarHBondContact OD1-N 2.85Å; D162-L165 HydrophobicContact CB-CB 4.13Å; D162-L165 HydrophobicContact CB-CD1 4.07Å; D162-L165 HydrophobicContact CB-CG 4.17Å; D162-L165 PolarHBondContact O-N 3.5Å; D162-L165 WeakPolarHBondContact OD2-CD1 3.35Å; D162-L165 WeakPolarHBondContact OD2-CG 3.27Å; D162-A166 WeakPolarHBondContact O-CB 3.34Å; D162-A166 PolarHBondContact O-N 3.3Å
163P85.2Confident82.1Confident104 Ų10499 Ų9968%0.67554%0.544SS*.Hα-helixtrans-61.2-26.1-177.825.9-34.6000113.2L165P163-L165 VanDerWaalsContact C-N 3.32Å
164A86.8Confident81.8Confident74 Ų74102.2 Ų102.261%0.61256%0.564SS**Hα-helixtrans-74-25.5176.800000112.8D162D162-A164 PolarHBondContact O-N 3.07Å; D162-A164 VanDerWaalsContact O-N 3.16Å; D162-A164 WeakPolarHBondContact OD1-CB 3.5Å; D162-A164 PolarHBondContact OD1-N 2.85Å
165L83.7Confident81.4Confident79 Ų79107.1 Ų107.141%0.41458%0.581SS.*Hα-helixtrans-98.7-27.2-179.5-62.4177.8000112.4I159 D162 P163 D167 T168I159-L165 HydrophobicContact CG2-CB 4.14Å; D162-L165 HydrophobicContact CB-CB 4.13Å; D162-L165 HydrophobicContact CB-CD1 4.07Å; D162-L165 HydrophobicContact CB-CG 4.17Å; D162-L165 PolarHBondContact O-N 3.5Å; D162-L165 WeakPolarHBondContact OD2-CD1 3.35Å; D162-L165 WeakPolarHBondContact OD2-CG 3.27Å; P163-L165 VanDerWaalsContact C-N 3.32Å; L165-D167 PolarHBondContact O-N 3.15Å; L165-T168 WeakPolarHBondContact O-CB 3.48Å; L165-T168 PolarHBondContact O-N 3.47Å; L165-T168 PolarHBondContact O-OG1 3.1Å
166A83Confident80.8Confident34 Ų34105.4 Ų105.428%0.28159%0.585SS.*Hα-helixtrans-55.4-39.7179.200000112.4I159 D162 T168 L169I159-A166 PolarHBondContact O-N 3.21Å; D162-A166 WeakPolarHBondContact O-CB 3.34Å; D162-A166 PolarHBondContact O-N 3.3Å; A166-T168 PolarHBondContact O-N 3.37Å; A166-L169 WeakPolarHBondContact O-CB 3.47Å; A166-L169 PolarHBondContact O-N 3.49Å
167D81.5Confident80.4Confident153 Ų153108.3 Ų108.382%0.81860%0.599SS**THydrogen-bonded Turntrans-66.4-18.8177.9-72.6-12.6000113.5L165L165-D167 PolarHBondContact O-N 3.15Å
168T81.9Confident79.7Confident90 Ų90108 Ų10855%0.55261%0.606SS**THydrogen-bonded Turntrans-87.1-9.6179.273.90000113.2L165 A166 V170L165-T168 WeakPolarHBondContact O-CB 3.48Å; L165-T168 PolarHBondContact O-N 3.47Å; L165-T168 PolarHBondContact O-OG1 3.1Å; A166-T168 PolarHBondContact O-N 3.37Å; T168-V170 PolarHBondContact O-N 2.92Å
169L82Confident78.8Confident64 Ų64112.2 Ų112.234%0.33562%0.618SS.*  trans-74.294.9-177.3-167.4136.1000110.3I159 I160 A166 S171I159-L169 HydrophobicContact CB-CD1 4.3Å; I159-L169 HydrophobicContact CG2-CB 4.22Å; I159-L169 HydrophobicContact CG2-CD1 3.8Å; I160-L169 HydrophobicContact CG1-CD1 4.39Å; A166-L169 WeakPolarHBondContact O-CB 3.47Å; A166-L169 PolarHBondContact O-N 3.49Å; L169-S171 PolarHBondContact O-N 3.05Å
170V76.3Confident77.9Confident102 Ų102115.4 Ų115.462%0.61864%0.64SS**  trans-85.799.9174.8-168.10000108.8T168 R172T168-V170 PolarHBondContact O-N 2.92Å; V170-R172 HydrophobicContact CG1-CG 4.32Å; V170-R172 WeakPolarHBondContact CG1-O 3.05Å; V170-R172 PolarHBondContact O-N 3.15Å; V170-R172 VanDerWaalsContact O-N 3.09Å
171S72.8Confident76.9Confident116 Ų116116.9 Ų116.981%0.81165%0.649SS**SBendtrans-65.5-10.9-179-47.40000114.7L169L169-S171 PolarHBondContact O-N 3.05Å
172R69.7Low75.9Confident206 Ų206118.5 Ų118.578%0.77765%0.65SS**SBendtrans-124.2134.3-18065.6-177.3-178174.21.1110.2V170 P174V170-R172 HydrophobicContact CG1-CG 4.32Å; V170-R172 WeakPolarHBondContact CG1-O 3.05Å; V170-R172 PolarHBondContact O-N 3.15Å; V170-R172 VanDerWaalsContact O-N 3.09Å; R172-P174 WeakPolarHBondContact O-CD 3.27Å
173M74.1Confident75.2Confident174 Ų174120.8 Ų120.886%0.85767%0.668SS**PPolyproline II helixtrans-58126.2168.4-175.9172.152.600108.3E175M173-E175 PolarHBondContact O-N 3.14Å
174P74.8Confident74.5Confident96 Ų96119.8 Ų119.862%0.62368%0.676SS**PPolyproline II helixtrans-54.9130.6174.3-23.833.3000109.5R172 L176R172-P174 WeakPolarHBondContact O-CD 3.27Å; P174-L176 PolarHBondContact O-N 2.93Å
175E74.8Confident73.4Confident180 Ų180125.4 Ų125.484%0.84168%0.683SS**PPolyproline II helixtrans-63.2123.9174.7-170.6165.6-173.700108M173 E177M173-E175 PolarHBondContact O-N 3.14Å; E175-E177 PolarHBondContact O-N 3.44Å; E175-E177 VanDerWaalsContact O-N 3.17Å
176L71.3Confident72.7Confident161 Ų161130.1 Ų130.184%0.84370%0.7SS**  trans-68.2115.9177.1-70.2172.6000107.6P174P174-L176 PolarHBondContact O-N 2.93Å
177E76.8Confident71.9Confident151 Ų151131.6 Ų131.671%0.70671%0.709SS**  trans-49.2130.4172.4-75.4-64.1135.100109.6E175 Q179E175-E177 PolarHBondContact O-N 3.44Å; E175-E177 VanDerWaalsContact O-N 3.17Å; E177-Q179 VanDerWaalsContact C-N 3.31Å; E177-Q179 PolarHBondContact O-N 2.96Å
178P68.8Low71Confident108 Ų108131.8 Ų131.870%0.70170%0.703SS**  trans-59.994.5175.2-21.732.1000109.6T180P178-T180 PolarHBondContact O-N 2.8Å
179Q64.3Low70.2Confident141 Ų141135.1 Ų135.166%0.65972%0.717SS**  trans-68.898.3177.9-71.8-73.4600108.2E177 N181 L182E177-Q179 VanDerWaalsContact C-N 3.31Å; E177-Q179 PolarHBondContact O-N 2.96Å; Q179-N181 PolarHBondContact O-N 2.89Å; Q179-L182 HydrophobicContact CB-CD1 3.2Å; Q179-L182 HydrophobicContact CG-CD1 4.27Å; Q179-L182 VanDerWaalsContact O-CD1 3.23Å; Q179-L182 WeakPolarHBondContact O-CD1 3.32Å
180T68.6Low69.3Low123 Ų123141.8 Ų141.876%0.75574%0.738SS**THydrogen-bonded Turntrans-70.8-10.6-177.457.80000113.4P178P178-T180 PolarHBondContact O-N 2.8Å
181N63.9Low68.5Low140 Ų140143.1 Ų143.175%0.74975%0.746SS**THydrogen-bonded Turntrans-123.944.9-172.1-66.8-72.9000112.5Q179 P183Q179-N181 PolarHBondContact O-N 2.89Å; N181-P183 WeakPolarHBondContact O-CD 3.43Å
182L64.6Low67.7Low127 Ų127141.7 Ų141.767%0.66574%0.741SS**  trans-73.7125.9166.3-85.386.5000109.3Q179 G184Q179-L182 HydrophobicContact CB-CD1 3.2Å; Q179-L182 HydrophobicContact CG-CD1 4.27Å; Q179-L182 VanDerWaalsContact O-CD1 3.23Å; Q179-L182 WeakPolarHBondContact O-CD1 3.32Å; L182-G184 PolarHBondContact O-N 2.9Å
183P74.4Confident67.2Low113 Ų113136.5 Ų136.573%0.73473%0.733SS**  trans-57.5130.6162.424.2-30.2000107.7N181 Y185N181-P183 WeakPolarHBondContact O-CD 3.43Å; P183-Y185 PolarHBondContact O-N 2.67Å
184G69.6Low66.3Low83 Ų83133 Ų13386%0.85672%0.723SS**  trans-57.794.1-175.400000111.5L182 K186L182-G184 PolarHBondContact O-N 2.9Å; G184-K186 PolarHBondContact O-N 3.03Å
185Y65.3Low65.5Low193 Ų193137.9 Ų137.976%0.75774%0.735SS**  trans-73114.7-179.5-164.5-97.6000108.5P183 S187 F188P183-Y185 PolarHBondContact O-N 2.67Å; Y185-S187 PolarHBondContact O-N 3.1Å; Y185-F188 HydrophobicContact CE1-CE2 4.36Å
186K68.8Low64.9Low177 Ų177132.9 Ų132.977%0.7773%0.732SS**  trans-72.2100.2-180-149.3175.2-169.7-69.20107.8G184 F188G184-K186 PolarHBondContact O-N 3.03Å; K186-F188 PolarHBondContact O-N 3.07Å
187S65Low64.3Low66 Ų66126.6 Ų126.646%0.46271%0.706SS.*  trans-67.9119.8177.359.80000110.1Y185 N189Y185-S187 PolarHBondContact O-N 3.1Å; S187-N189 PolarHBondContact O-N 3.21Å
188F63.4Low63.3Low156 Ų156129.9 Ų129.968%0.68472%0.718SS**THydrogen-bonded Turntrans-72.7-5.4175.1-48.6-85.4000112.5Y185 K186 R190Y185-F188 HydrophobicContact CE1-CE2 4.36Å; K186-F188 PolarHBondContact O-N 3.07Å; F188-R190 VanDerWaalsContact C-N 3.27Å; F188-R190 PolarHBondContact O-N 2.91Å
189N65.4Low62.7Low161 Ų161129.5 Ų129.586%0.86172%0.718SS**THydrogen-bonded Turntrans-81.60.9178.6-67.2-30.3000113.8S187 V191S187-N189 PolarHBondContact O-N 3.21Å; N189-V191 PolarHBondContact O-N 3.37Å
190R62.5Low62.2Low203 Ų203131.4 Ų131.477%0.76673%0.725SS**SBendtrans-82.5106158-60.6-176.479.8170.74105.3F188 A192F188-R190 VanDerWaalsContact C-N 3.27Å; F188-R190 PolarHBondContact O-N 2.91Å; R190-A192 PolarHBondContact O-N 3.46Å
191V59Low61.2Low130 Ų130129.6 Ų129.679%0.78872%0.722SS**  trans15101.4169.2-118.40000112.1N189 T193N189-V191 PolarHBondContact O-N 3.37Å; V191-T193 PolarHBondContact O-N 3.19Å; V191-T193 PolarHBondContact O-OG1 3.04Å
192A56.4Low60.9Low87 Ų87128.8 Ų128.872%0.71972%0.724SS**  trans-43.6105.8175.600000108R190 P194R190-A192 PolarHBondContact O-N 3.46Å; A192-P194 WeakPolarHBondContact O-CD 3.46Å
193T59.3Low60.6Low97 Ų97133.5 Ų133.560%0.59573%0.733SS**  trans-78.9101.5172.6-54.30000102.8V191 F195V191-T193 PolarHBondContact O-N 3.19Å; V191-T193 PolarHBondContact O-OG1 3.04Å; T193-F195 PolarHBondContact O-N 2.92Å
194P55.9Low59.4Low101 Ų101134.1 Ų134.166%0.65674%0.737SS**SBendtrans-68.2113.7-179.630-23.4000104.5A192A192-P194 WeakPolarHBondContact O-CD 3.46Å
195F57Low58.6Low197 Ų197136.7 Ų136.786%0.86473%0.731SS**SBendtrans70.682.7178.6-41.7-76.9000115.6T193 G197T193-F195 PolarHBondContact O-N 2.92Å; F195-G197 VanDerWaalsContact C-N 3.26Å; F195-G197 PolarHBondContact O-N 2.94Å
196G63.6Low57.7Low76 Ų76133.5 Ų133.578%0.78473%0.734SS**SBendtrans64.11.9139.900000120.4
197G57.8Low56.7Low29 Ų29133 Ų13330%0.29974%0.738SS.*  trans70.4144.6-175.800000113.2F195 S199F195-G197 VanDerWaalsContact C-N 3.26Å; F195-G197 PolarHBondContact O-N 2.94Å; G197-S199 PolarHBondContact O-N 3.03Å
198F55.6Low55.9Low219 Ų219133.8 Ų133.896%0.96175%0.749SS**THydrogen-bonded Turntrans-65.7-2.5-168.7-63.3-80.7000116.2
199S56.8Low55.1Low101 Ų101131.1 Ų131.171%0.70676%0.755SS**THydrogen-bonded Turntrans-90.2-9.7-172.854.90000115G197G197-S199 PolarHBondContact O-N 3.03Å
200K54Low53.9Low181 Ų181131.4 Ų131.479%0.78776%0.756SS**  trans-14648.3-175.4-62.7-67.2171.7-177.30113.4P202K200-P202 VanDerWaalsContact O-CD 3.32Å; K200-P202 WeakPolarHBondContact O-CD 3.32Å
201A47.8Very low52.9Low85 Ų85130.3 Ų130.370%0.70276%0.76SS**  trans-86.6114.1164.600000109.2R203A201-R203 PolarHBondContact O-N 3.14Å
202P56.4Low52.3Low122 Ų122130.8 Ų130.879%0.79276%0.763SS**  trans-60.5128.6162.5-16.231000108K200K200-P202 VanDerWaalsContact O-CD 3.32Å; K200-P202 WeakPolarHBondContact O-CD 3.32Å
203R59.4Low51.6Low226 Ų226135 Ų13585%0.85377%0.767SS**  trans-55.2135.4172-71.5-90.6-132.4135.35.3108.4A201 D205A201-R203 PolarHBondContact O-N 3.14Å; R203-D205 PolarHBondContact O-N 2.79Å
204P48.3Very low51Low126 Ų126136.3 Ų136.382%0.81878%0.776SS**  trans-70.6115.9171.426.6-29.5000108.9
205D53.9Low50.3Low137 Ų137140.4 Ų140.473%0.73378%0.784SS**  trans-63.9151.4164.9-71.4-38.2000109.8R203 I207R203-D205 PolarHBondContact O-N 2.79Å; D205-I207 PolarHBondContact O-N 2.98Å
206P44.8Very low49.7Very low126 Ų126136.4 Ų136.482%0.81878%0.777SS**  trans-59.5126.1177.7-18.430.5000110.5A208P206-A208 PolarHBondContact O-N 2.97Å
207I47.7Very low48.8Very low166 Ų166142 Ų14285%0.85178%0.783SS**  trans-60.7103-179.5-59.7166.5000108.8D205D205-I207 PolarHBondContact O-N 2.98Å
208A49Very low48.3Very low84 Ų84146.9 Ų146.969%0.69481%0.807SS**  trans-71.8127.8156.400000107.5P206 L210P206-A208 PolarHBondContact O-N 2.97Å; A208-L210 PolarHBondContact O-N 3.21Å
209A47.3Very low47.9Very low99 Ų99141.9 Ų141.982%0.81880%0.796SS**  trans-59.6107.917600000109.4Q211A209-Q211 PolarHBondContact O-N 3.23Å
210L39.3Very low47.3Very low168 Ų168141.3 Ų141.388%0.8880%0.797SS**  trans-73.2123.7176.8-143.886.2000108.4A208A208-L210 PolarHBondContact O-N 3.21Å
211Q42.1Very low46.9Very low179 Ų179141.1 Ų141.184%0.83680%0.804SS**  trans-63.2140.9174.4-64.6-169.916.300110.1A209 E213A209-Q211 PolarHBondContact O-N 3.23Å; Q211-E213 PolarHBondContact O-N 3.47Å; Q211-E213 VanDerWaalsContact O-N 3.1Å
212V45.8Very low47.1Very low141 Ų141145.9 Ų145.986%0.85581%0.812SS**  trans-65.4105.4175.5174.40000108.4
213E42Very low46.5Very low174 Ų174142.2 Ų142.281%0.81380%0.796SS**  trans-97.9115.5167.2-164.1168-173.900108.2Q211 F215Q211-E213 PolarHBondContact O-N 3.47Å; Q211-E213 VanDerWaalsContact O-N 3.1Å; E213-F215 PolarHBondContact O-N 2.92Å
214T46.2Very low46Very low125 Ų125138.6 Ų138.677%0.76779%0.794SS**  trans-65.7110.3179-55.90000109.4
215F41Very low46Very low188 Ų188143.5 Ų143.583%0.82580%0.798SS**  trans-68.9137170.5-77.3-83.6000110.5E213E213-F215 PolarHBondContact O-N 2.92Å
216P44.9Very low45.8Very low113 Ų113140.7 Ų140.773%0.73479%0.794SS**  trans-70.2138.417029.4-32000110.1V218P216-V218 PolarHBondContact O-N 2.86Å; P216-V218 VanDerWaalsContact O-N 3.13Å
217E44.8Very low46.3Very low194 Ų194142.9 Ų142.991%0.90780%0.798SS**  trans-53.6111.1175.8-174.2174.5-179.400110.7
218V47.2Very low46.8Very low131 Ų131142.4 Ų142.479%0.79480%0.797SS**PPolyproline II helixtrans-82.6125.7171.5-96.40000108.8P216 A220P216-V218 PolarHBondContact O-N 2.86Å; P216-V218 VanDerWaalsContact O-N 3.13Å; V218-A220 PolarHBondContact O-N 3.48Å
219P46.7Very low47.1Very low114 Ų114148.3 Ų148.374%0.7480%0.801SS**PPolyproline II helixtrans-57.3135.8177-24.533.5000111.2L221P219-L221 PolarHBondContact O-N 3.45Å; P219-L221 VanDerWaalsContact O-N 3.1Å
220A44.3Very low48Very low88 Ų88149.7 Ų149.773%0.72780%0.801SS**PPolyproline II helixtrans-48.6118174.100000110.1V218 Q222V218-A220 PolarHBondContact O-N 3.48Å; A220-Q222 PolarHBondContact O-N 3.2Å
221L45.2Very low49.3Very low177 Ų177144.4 Ų144.493%0.92778%0.779SS**  trans-69.876.2166.7-75.9175.2000108.8P219 G223P219-L221 PolarHBondContact O-N 3.45Å; P219-L221 VanDerWaalsContact O-N 3.1Å; L221-G223 PolarHBondContact O-N 3.35Å
222Q52.3Low50.4Low185 Ų185145.6 Ų145.686%0.86478%0.782SS**  trans-67.7100.7154.8-165.987.321.400105.9A220A220-Q222 PolarHBondContact O-N 3.2Å
223G43.5Very low51.6Low45 Ų45146.4 Ų146.446%0.46478%0.781SS.*  trans-172.675.5-175.700000113.9L221 Y225L221-G223 PolarHBondContact O-N 3.35Å; G223-Y225 PolarHBondContact O-N 2.99Å; G223-Y225 VanDerWaalsContact O-N 3.16Å
224D49.9Very low53.1Low151 Ų151146.9 Ų146.981%0.80778%0.775SS**SBend62.923.9124.1-61.6-9.6000122.4
225Y48.2Very low54.3Low228 Ų228144.9 Ų144.989%0.89477%0.772SS**  trans-140.751.8171.1-66.3-76.9000116.5G223G223-Y225 PolarHBondContact O-N 2.99Å; G223-Y225 VanDerWaalsContact O-N 3.16Å
226A48.9Very low55.6Low79 Ų79141 Ų14165%0.65378%0.775SS**  trans-15158.216800000113.7N228A226-N228 PolarHBondContact O-N 3.47Å; A226-N228 VanDerWaalsContact O-N 3.15Å
227L56.5Low56.5Low172 Ų172141.6 Ų141.690%0.90177%0.771SS**THydrogen-bonded Turntrans-66.4-7.6173.9-71.6176.7000114.2
228N56.8Low57.6Low156 Ų156135 Ų13583%0.83476%0.755SS**THydrogen-bonded Turntrans-148.245.4-176.9-81.8-63.4000114.2A226 P230A226-N228 PolarHBondContact O-N 3.47Å; A226-N228 VanDerWaalsContact O-N 3.15Å; N228-P230 WeakPolarHBondContact O-CD 3.35Å
229R56.8Low58.3Low208 Ų208141.8 Ų141.879%0.78577%0.767SS**  trans-98110.5161.9-171.4178-178.8-129.71.1109S231R229-S231 PolarHBondContact O-N 3.21Å
230P64.6Low58.6Low127 Ų127141.4 Ų141.483%0.82576%0.762SS**  trans-61.5107.7172-20.532.4000109.2N228N228-P230 WeakPolarHBondContact O-CD 3.35Å
231S67.2Low58.9Low57 Ų57142.8 Ų142.840%0.39977%0.766SS.*  trans-90.3117.2172.968.90000108.9R229 N233 R234R229-S231 PolarHBondContact O-N 3.21Å; S231-N233 PolarHBondContact O-N 2.94Å; S231-R234 PolarHBondContact O-N 3.42Å; S231-R234 WeakPolarHBondContact OG-CG 3.48Å
232F64.9Low59.6Low205 Ų205141.2 Ų141.290%0.89976%0.764SS**THydrogen-bonded Turntrans-67.9-13.5176.3-170.5-99.7000113.3R234F232-R234 VanDerWaalsContact C-N 3.34Å; F232-R234 PolarHBondContact O-N 3.38Å
233N72.4Confident59.3Low157 Ų157135 Ų13584%0.8475%0.75SS**THydrogen-bonded Turntrans-91.115.6179.4-61.1-28.1000113.7S231S231-N233 PolarHBondContact O-N 2.94Å
234R73.5Confident59.6Low184 Ų184136.1 Ų136.169%0.69476%0.761SS**  trans-90.6127.8173.6-101.3-179.4168.8-170.4-3109.8S231 F232S231-R234 PolarHBondContact O-N 3.42Å; S231-R234 WeakPolarHBondContact OG-CG 3.48Å; F232-R234 VanDerWaalsContact C-N 3.34Å; F232-R234 PolarHBondContact O-N 3.38Å
235A70.9Confident59.5Low84 Ų84134.5 Ų134.569%0.69476%0.762SS**  trans-56.9146.316500000109.5L237A235-L237 PolarHBondContact O-N 2.92Å
236A67.3Low59.4Low107 Ų107129.5 Ų129.588%0.88476%0.755SS**  trans-59.4101.2177.100000109.4G238A236-G238 PolarHBondContact O-N 2.92Å
237L64.8Low59.3Low124 Ų124131.8 Ų131.865%0.64976%0.761SS**  trans-74.1115.7164.9-59.3173.7000104.1A235A235-L237 PolarHBondContact O-N 2.92Å
238G68.1Low58.9Low57 Ų57130.5 Ų130.559%0.58875%0.754SS**  trans-55.1-174.6177.600000112.4A236 V240A236-G238 PolarHBondContact O-N 2.92Å; G238-V240 WeakPolarHBondContact O-CG2 3.42Å; G238-V240 PolarHBondContact O-N 3.1Å
239W60.7Low58.3Low273 Ų273128.2 Ų128.2100%1.03475%0.748SS**  trans-68.479.2-178.8-6461.6000110.7
240V52.8Low57.8Low106 Ų106125.4 Ų125.464%0.64275%0.748SS**  trans-92.8105.4169.3-93.70000107.8G238 T242G238-V240 WeakPolarHBondContact O-CG2 3.42Å; G238-V240 PolarHBondContact O-N 3.1Å; V240-T242 PolarHBondContact O-N 3.08Å; V240-T242 PolarHBondContact O-OG1 3.19Å
241S51.8Low56.8Low116 Ų116124.9 Ų124.981%0.81174%0.742SS**  trans-6098.8173.8-163.50000109G243S241-G243 PolarHBondContact O-N 3.22Å
242T58.8Low55.8Low145 Ų145126.8 Ų126.889%0.8976%0.756SS**  trans-97.776.4172.721.10000107.5V240V240-T242 PolarHBondContact O-N 3.08Å; V240-T242 PolarHBondContact O-OG1 3.19Å
243G47.8Very low55Low55 Ų55124.4 Ų124.457%0.56775%0.752SS**SBendtrans-165.7127.8175.800000107.5S241S241-G243 PolarHBondContact O-N 3.22Å
244G48.1Very low53.8Low67 Ų67124 Ų12469%0.69175%0.745SS**  trans-51.9162-164.300000116V246G244-V246 PolarHBondContact O-N 3.49Å
245S48.5Very low52.6Low117 Ų117120.5 Ų120.582%0.81875%0.745SS**  trans-44101177.655.80000111.7T247S245-T247 PolarHBondContact O-N 2.93Å
246V47.2Very low51.4Low124 Ų124122 Ų12275%0.75275%0.747SS**  trans-73.4108.7161.8176.90000105.2G244 L248G244-V246 PolarHBondContact O-N 3.49Å; V246-L248 PolarHBondContact O-N 3.12Å
247T46.6Very low50.4Low127 Ų127124.7 Ų124.778%0.77975%0.745SS**  trans-60101.7169.3-39.90000107.1S245S245-T247 PolarHBondContact O-N 2.93Å
248L48.1Very low49.8Very low144 Ų144126 Ų12675%0.75475%0.751SS**  trans-62.2134.4163.8-67.4172.9000107V246 N250V246-L248 PolarHBondContact O-N 3.12Å; L248-N250 PolarHBondContact O-N 3.06Å; L248-N250 VanDerWaalsContact O-N 3.07Å
249P43.4Very low49.2Very low109 Ų109128.8 Ų128.871%0.70876%0.759SS**  trans-58.6120.7166.324.8-30000107.2V251P249-V251 VanDerWaalsContact C-N 3.32Å; P249-V251 PolarHBondContact O-N 3.41Å
250N46.6Very low48.6Very low149 Ų149125 Ų12580%0.79775%0.752SS**  trans-5895.7171.9-179.515.8000108L248 S252L248-N250 PolarHBondContact O-N 3.06Å; L248-N250 VanDerWaalsContact O-N 3.07Å; N250-S252 VanDerWaalsContact C-N 3.29Å; N250-S252 PolarHBondContact O-N 3.02Å
251V43Very low48.7Very low115 Ų115125.4 Ų125.470%0.69776%0.76SS**  trans-72.697.1165-1790000105.2P249 L253P249-V251 VanDerWaalsContact C-N 3.32Å; P249-V251 PolarHBondContact O-N 3.41Å; V251-L253 PolarHBondContact O-N 3.33Å
252S46.2Very low48.9Very low97 Ų97128.8 Ų128.868%0.67876%0.763SS**  trans-57.7101.7167.9-178.10000107.5N250 E254N250-S252 VanDerWaalsContact C-N 3.29Å; N250-S252 PolarHBondContact O-N 3.02Å; S252-E254 PolarHBondContact O-N 3.11Å
253L48.8Very low48.6Very low156 Ų156129 Ų12982%0.81776%0.758SS**  trans-74.189.2163.3-69.6171.4000106.1V251V251-L253 PolarHBondContact O-N 3.33Å
254E47.2Very low48.4Very low149 Ų149137.6 Ų137.670%0.69679%0.79SS**  trans-60.9126.5160.1-151.1-143.3-172.600106.8S252 T256S252-E254 PolarHBondContact O-N 3.11Å; E254-T256 PolarHBondContact O-N 3.49Å
255P48.6Very low48.4Very low109 Ų109141.1 Ų141.171%0.70880%0.795SS**  trans-69.4101.8172.51.612.1000106.9L257P255-L257 PolarHBondContact O-N 2.77Å
256T44.7Very low48.4Very low117 Ų117142.4 Ų142.472%0.71879%0.794SS**  trans-58.8103.616437.70000107.7E254 I258E254-T256 PolarHBondContact O-N 3.49Å; T256-I258 PolarHBondContact O-N 2.78Å
257L46.8Very low48.4Very low163 Ų163143.4 Ų143.485%0.85380%0.796SS**  trans-56.7106.5166.1-72163.9000107.2P255 P259P255-L257 PolarHBondContact O-N 2.77Å; L257-P259 VanDerWaalsContact O-CD 3.27Å; L257-P259 WeakPolarHBondContact O-CD 3.35Å
258I52Low48.5Very low152 Ų152144.4 Ų144.478%0.77980%0.797SS**  trans-66.7119169-59.4169.7000105.8T256 E260T256-I258 PolarHBondContact O-N 2.78Å; I258-E260 PolarHBondContact O-N 3.41Å
259P55.2Low48.6Very low114 Ų114144.4 Ų144.474%0.7480%0.8SS**  trans-68.3117.1168.6-12.228.3000107.4L257 S261L257-P259 VanDerWaalsContact O-CD 3.27Å; L257-P259 WeakPolarHBondContact O-CD 3.35Å; P259-S261 PolarHBondContact O-N 2.94Å
260E49.1Very low48.9Very low194 Ų194146.7 Ų146.791%0.90781%0.806SS**  trans-58.5109.1162.6-66.7-172.7161.500107.8I258I258-E260 PolarHBondContact O-N 3.41Å
261S54Low49.1Very low114 Ų114146.6 Ų146.680%0.79781%0.807SS**  trans-96.194.5164.858.50000108.2P259P259-S261 PolarHBondContact O-N 2.94Å
262E55.5Low49.6Very low187 Ų187149 Ų14987%0.87482%0.815SS**  trans-61.7120146.4-75.4-163.4134.700108.2
263D53.1Low49.8Very low149 Ų149153.3 Ų153.380%0.79783%0.827SS**  trans-171.5130.6136-117.9-18.1000112.7
264L42.9Very low49.9Very low236 Ų236153.1 Ų153.1100%1.23683%0.828SS**  trans570161.7-77.6122000121.9

Retrieved 264 of 264 residues in 477.6 ms (Link to these results)