A0A077ZDM2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZDM2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 377 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M43.5Very low48.9Very low241 Ų241143.5 Ų143.5100%1.18781%0.81SS**  098.90-74.4178.2172.200106.5
2G40Very low48.8Very low80 Ų80135.1 Ų135.183%0.82578%0.779SS**  trans-83.3125.3176.300000108.7
3V49.2Very low49.1Very low133 Ų133136.6 Ų136.681%0.80678%0.775SS**  trans-106.2110.4168.1-1780000105.4Y5V3-Y5 PolarHBondContact O-N 3.37Å
4D48Very low49.6Very low156 Ų156132.1 Ų132.183%0.83475%0.752SS**  trans-59.9124.3176.4-79.7-41.2000110.3
5Y49.5Very low50.4Low221 Ų221132.5 Ų132.587%0.86774%0.744SS**  trans-97.496.1168.4-135.3-90.3000106.8V3 P7V3-Y5 PolarHBondContact O-N 3.37Å; Y5-P7 VanDerWaalsContact O-CD 3.32Å; Y5-P7 WeakPolarHBondContact O-CD 3.26Å
6S55.6Low51.5Low103 Ų103133.7 Ų133.772%0.7274%0.739SS**  trans-80.1113.3166.2-710000108.3T8S6-T8 PolarHBondContact O-N 2.85Å
7P50Low52.7Low114 Ų114134.3 Ų134.374%0.7474%0.735SS**  trans-70.8122.4170.529-27.9000107.5Y5 G9Y5-P7 VanDerWaalsContact O-CD 3.32Å; Y5-P7 WeakPolarHBondContact O-CD 3.26Å; P7-G9 VanDerWaalsContact C-N 3.33Å; P7-G9 PolarHBondContact O-N 3.01Å
8T48.1Very low54Low137 Ų137133.1 Ų133.184%0.8473%0.728SS**  trans-60.790.4173.829.70000110.3S6S6-T8 PolarHBondContact O-N 2.85Å
9G48.1Very low55.3Low54 Ų54129.9 Ų129.956%0.55771%0.713SS**  trans-78.2-14.2179.300000115.1P7 K11P7-G9 VanDerWaalsContact C-N 3.33Å; P7-G9 PolarHBondContact O-N 3.01Å; G9-K11 PolarHBondContact O-N 3.04Å
10E54.2Low56.6Low177 Ų177127.6 Ų127.683%0.82770%0.703SS**Hα-helixtrans-81.1-13.6-171.7-79.2-179.6154.200115.5
11K51.3Low58Low163 Ų163127.5 Ų127.571%0.70970%0.695SS**Hα-helixtrans-91.3-20.1178.3-75.4-169.3174.8-172.50114.5G9 T14G9-K11 PolarHBondContact O-N 3.04Å; K11-T14 PolarHBondContact O-OG1 2.94Å
12G48Very low60Low42 Ų42118.8 Ų118.843%0.43366%0.662SS.*Hα-helixtrans-86.7-19.5-175.500000114.8
13E52.6Low62.2Low155 Ų155123 Ų12372%0.72465%0.654SS**Hα-helixtrans-85.6-38177.7-72.9-173159.100111.9K16 E17E13-K16 PolarHBondContact O-N 3.06Å; E13-E17 PolarHBondContact O-N 3.02Å; E13-E17 VanDerWaalsContact O-N 3.1Å
14T56.9Low64.1Low74 Ų74121.2 Ų121.245%0.45464%0.639SS.*Hα-helixtrans-68.9-39.9179.750.30000113.1K11 K16 E17 D18K11-T14 PolarHBondContact O-OG1 2.94Å; T14-K16 VanDerWaalsContact C-N 3.31Å; T14-K16 PolarHBondContact O-N 3.15Å; T14-E17 PolarHBondContact O-N 2.76Å; T14-D18 WeakPolarHBondContact O-CB 2.94Å; T14-D18 PolarHBondContact O-N 3.11Å
15E60.7Low66.1Low137 Ų137118.3 Ų118.364%0.6462%0.624SS**Hα-helixtrans-65.9-32.4176.3-75-178.717500112.8T19E15-T19 WeakPolarHBondContact O-CB 3.2Å; E15-T19 VanDerWaalsContact O-CG2 3.3Å; E15-T19 WeakPolarHBondContact O-CG2 3.48Å; E15-T19 PolarHBondContact O-N 3Å; E15-T19 VanDerWaalsContact O-N 3.08Å; E15-T19 PolarHBondContact O-OG1 2.77Å
16K69.2Low68Low152 Ų152112.9 Ų112.966%0.66161%0.609SS**Hα-helixtrans-71.8-37.7174.2-80.1-174.2177.5-179.80111.9E13 T14 T19 T20E13-K16 PolarHBondContact O-N 3.06Å; T14-K16 VanDerWaalsContact C-N 3.31Å; T14-K16 PolarHBondContact O-N 3.15Å; K16-T19 WeakPolarHBondContact CA-OG1 3.38Å; K16-T19 PolarHBondContact O-OG1 2.97Å; K16-T19 VanDerWaalsContact O-OG1 3.05Å; K16-T20 VanDerWaalsContact O-CB 3.3Å; K16-T20 WeakPolarHBondContact O-CB 3.49Å; K16-T20 PolarHBondContact O-N 3.27Å; K16-T20 PolarHBondContact O-OG1 3.25Å
17E71.8Confident69.7Low144 Ų144112.8 Ų112.867%0.67360%0.598SS**Hα-helixtrans-70-42.3179.1-152.8167.5-159.200111.1E13 T14 T20 K21E13-E17 PolarHBondContact O-N 3.02Å; E13-E17 VanDerWaalsContact O-N 3.1Å; T14-E17 PolarHBondContact O-N 2.76Å; E17-T20 PolarHBondContact O-N 3.39Å; E17-K21 WeakPolarHBondContact O-CB 3.36Å; E17-K21 PolarHBondContact O-N 3.3Å
18D75.8Confident71.5Confident113 Ų113110.6 Ų110.660%0.60458%0.582SS**Hα-helixtrans-65.4-41.5175.9-77-23.6000112.4T14 K21 A22T14-D18 WeakPolarHBondContact O-CB 2.94Å; T14-D18 PolarHBondContact O-N 3.11Å; D18-K21 PolarHBondContact O-N 3.25Å; D18-A22 WeakPolarHBondContact O-CB 3.46Å; D18-A22 PolarHBondContact O-N 2.68Å
19T78.4Confident73.5Confident73 Ų73107 Ų10745%0.44856%0.562SS.*Hα-helixtrans-67.1-42.4175.247.30000111.9E15 K16 K21 A22 Y23E15-T19 WeakPolarHBondContact O-CB 3.2Å; E15-T19 VanDerWaalsContact O-CG2 3.3Å; E15-T19 WeakPolarHBondContact O-CG2 3.48Å; E15-T19 PolarHBondContact O-N 3Å; E15-T19 VanDerWaalsContact O-N 3.08Å; E15-T19 PolarHBondContact O-OG1 2.77Å; K16-T19 WeakPolarHBondContact CA-OG1 3.38Å; K16-T19 PolarHBondContact O-OG1 2.97Å; K16-T19 VanDerWaalsContact O-OG1 3.05Å; T19-K21 VanDerWaalsContact C-N 3.33Å; T19-K21 PolarHBondContact O-N 3.18Å; T19-A22 PolarHBondContact O-N 3.33Å; T19-Y23 WeakPolarHBondContact O-CD2 3.18Å; T19-Y23 PolarHBondContact O-N 2.89Å
20T81.7Confident75.5Confident82 Ų82107.9 Ų107.950%0.50356%0.557SS.*Hα-helixtrans-63.1-40.6177.4-530000111.2K16 E17 Y23 L24K16-T20 VanDerWaalsContact O-CB 3.3Å; K16-T20 WeakPolarHBondContact O-CB 3.49Å; K16-T20 PolarHBondContact O-N 3.27Å; K16-T20 PolarHBondContact O-OG1 3.25Å; E17-T20 PolarHBondContact O-N 3.39Å; T20-Y23 PolarHBondContact O-N 2.79Å; T20-L24 HydrophobicContact CG2-CD1 4.25Å; T20-L24 PolarHBondContact O-N 3.19Å
21K86.2Confident77.1Confident127 Ų127106.1 Ų106.155%0.55254%0.543SS*.Hα-helixtrans-63.8-44.6174.5-173.7-179175.9-173.10111.9E17 D18 T19 Y23 L24 D25E17-K21 WeakPolarHBondContact O-CB 3.36Å; E17-K21 PolarHBondContact O-N 3.3Å; D18-K21 PolarHBondContact O-N 3.25Å; T19-K21 VanDerWaalsContact C-N 3.33Å; T19-K21 PolarHBondContact O-N 3.18Å; K21-Y23 VanDerWaalsContact C-N 3.3Å; K21-Y23 PolarHBondContact O-N 2.65Å; K21-L24 PolarHBondContact O-N 2.87Å; K21-L24 VanDerWaalsContact O-N 3.16Å; K21-D25 PolarHBondContact O-N 2.92Å
22A83.9Confident78.9Confident58 Ų58103.3 Ų103.348%0.47954%0.535SS..Hα-helixtrans-60.3-39.3176.700000112.3D18 T19 D25 L26D18-A22 WeakPolarHBondContact O-CB 3.46Å; D18-A22 PolarHBondContact O-N 2.68Å; T19-A22 PolarHBondContact O-N 3.33Å; A22-D25 PolarHBondContact O-N 2.95Å; A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 PolarHBondContact O-N 3.36Å
23Y86.7Confident80.8Confident167 Ų167105.9 Ų105.966%0.65554%0.538SS*.Hα-helixtrans-64.9-40.7174.2-77.9-64.6000112.7T19 T20 K21 L26 E27T19-Y23 WeakPolarHBondContact O-CD2 3.18Å; T19-Y23 PolarHBondContact O-N 2.89Å; T20-Y23 PolarHBondContact O-N 2.79Å; K21-Y23 VanDerWaalsContact C-N 3.3Å; K21-Y23 PolarHBondContact O-N 2.65Å; Y23-L26 PolarHBondContact O-N 2.99Å; Y23-E27 WeakPolarHBondContact O-CB 3.44Å; Y23-E27 PolarHBondContact O-N 3.11Å
24L89.3Confident82.3Confident96 Ų96103 Ų10350%0.50353%0.527SS..Hα-helixtrans-66.2-41.8175.8-86.6153.7000112.4T20 K21 L26 E27 T28T20-L24 HydrophobicContact CG2-CD1 4.25Å; T20-L24 PolarHBondContact O-N 3.19Å; K21-L24 PolarHBondContact O-N 2.87Å; K21-L24 VanDerWaalsContact O-N 3.16Å; L24-L26 VanDerWaalsContact C-N 3.33Å; L24-E27 PolarHBondContact O-N 2.78Å; L24-T28 WeakPolarHBondContact O-CB 3.32Å; L24-T28 PolarHBondContact O-N 3.35Å; L24-T28 PolarHBondContact O-OG1 3.37Å
25D89.7Confident83.8Confident95 Ų95102.6 Ų102.651%0.50853%0.525SS..Hα-helixtrans-64.3-40.7176.3-71.8-17.8000110.3K21 A22 T28 S29K21-D25 PolarHBondContact O-N 2.92Å; A22-D25 PolarHBondContact O-N 2.95Å; D25-T28 PolarHBondContact O-N 3.37Å; D25-S29 WeakPolarHBondContact O-CB 3.47Å; D25-S29 PolarHBondContact O-N 3.35Å
26L90.7Very high85.1Confident108 Ų10898.6 Ų98.657%0.56551%0.512SS*.Hα-helixtrans-65-46.3174.3-174.567.9000111.9A22 Y23 L24 T28 S29 V30A22-L26 WeakPolarHBondContact O-CB 3.37Å; A22-L26 PolarHBondContact O-N 3.36Å; Y23-L26 PolarHBondContact O-N 2.99Å; L24-L26 VanDerWaalsContact C-N 3.33Å; L26-T28 VanDerWaalsContact C-N 3.28Å; L26-T28 PolarHBondContact O-N 3.48Å; L26-S29 PolarHBondContact O-N 3.48Å; L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 2.98Å
27E90.2Very high86.1Confident101 Ų10195.6 Ų95.647%0.47250%0.502SS..Hα-helixtrans-59.1-42177-170.8-168.1153.300111.1Y23 L24 V30 R31Y23-E27 WeakPolarHBondContact O-CB 3.44Å; Y23-E27 PolarHBondContact O-N 3.11Å; L24-E27 PolarHBondContact O-N 2.78Å; E27-V30 PolarHBondContact O-N 2.91Å; E27-R31 WeakPolarHBondContact O-CB 3.11Å; E27-R31 PolarHBondContact O-N 2.87Å; E27-R31 IonicContact OE1-CZ 3.72Å; E27-R31 IonicContact OE1-NH2 2.69Å; E27-R31 PolarHBondContact OE1-NH2 3.4Å
28T88.9Confident86.8Confident67 Ų6795.4 Ų95.441%0.41150%0.501SS..Hα-helixtrans-65.5-45.6177.1-51.80000110.7L24 D25 L26 V30 R31 D32L24-T28 WeakPolarHBondContact O-CB 3.32Å; L24-T28 PolarHBondContact O-N 3.35Å; L24-T28 PolarHBondContact O-OG1 3.37Å; D25-T28 PolarHBondContact O-N 3.37Å; L26-T28 VanDerWaalsContact C-N 3.28Å; L26-T28 PolarHBondContact O-N 3.48Å; T28-V30 VanDerWaalsContact C-N 3.35Å; T28-V30 PolarHBondContact O-N 3.36Å; T28-R31 WeakPolarHBondContact O-CB 3.44Å; T28-R31 PolarHBondContact O-N 2.9Å; T28-R31 VanDerWaalsContact O-N 3.16Å; T28-D32 PolarHBondContact O-N 2.97Å
29S89.4Confident87.5Confident61 Ų6195.9 Ų95.943%0.42750%0.499SS..Hα-helixtrans-62.4-39.7177.4-172.70000112.6D25 L26 R31 D32 I33D25-S29 WeakPolarHBondContact O-CB 3.47Å; D25-S29 PolarHBondContact O-N 3.35Å; L26-S29 PolarHBondContact O-N 3.48Å; S29-R31 VanDerWaalsContact C-N 3.34Å; S29-D32 PolarHBondContact O-N 3.26Å; S29-I33 WeakPolarHBondContact O-CD1 3.49Å; S29-I33 VanDerWaalsContact O-CG1 3.27Å; S29-I33 WeakPolarHBondContact O-CG1 3.33Å; S29-I33 PolarHBondContact O-N 3.35Å; S29-I33 VanDerWaalsContact O-N 3.07Å
30V89.2Confident87.9Confident73 Ų7396.3 Ų96.344%0.44250%0.499SS..Hα-helixtrans-64.7-42175.3170.50000110.2L26 E27 T28 I33 L34L26-V30 WeakPolarHBondContact O-CG2 3.37Å; L26-V30 PolarHBondContact O-N 2.98Å; E27-V30 PolarHBondContact O-N 2.91Å; T28-V30 VanDerWaalsContact C-N 3.35Å; T28-V30 PolarHBondContact O-N 3.36Å; V30-I33 PolarHBondContact O-N 3.38Å; V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.34Å; V30-L34 PolarHBondContact O-N 3.28Å
31R88.4Confident88.4Confident141 Ų14197.8 Ų97.853%0.53250%0.5SS..Hα-helixtrans-62.9-43177.4-169.9174.5-68151.96.8111.9E27 T28 S29 I33 L34 V35E27-R31 WeakPolarHBondContact O-CB 3.11Å; E27-R31 PolarHBondContact O-N 2.87Å; E27-R31 IonicContact OE1-CZ 3.72Å; E27-R31 IonicContact OE1-NH2 2.69Å; E27-R31 PolarHBondContact OE1-NH2 3.4Å; T28-R31 WeakPolarHBondContact O-CB 3.44Å; T28-R31 PolarHBondContact O-N 2.9Å; T28-R31 VanDerWaalsContact O-N 3.16Å; S29-R31 VanDerWaalsContact C-N 3.34Å; R31-I33 VanDerWaalsContact C-N 3.34Å; R31-I33 PolarHBondContact O-N 3.01Å; R31-L34 PolarHBondContact O-N 3.18Å; R31-V35 WeakPolarHBondContact O-CG2 3.42Å; R31-V35 PolarHBondContact O-N 3.44Å
32D88.6Confident88.5Confident103 Ų10394.6 Ų94.655%0.55150%0.497SS*.Hα-helixtrans-64.3-38.9177.8-71.3-13.9000111.9T28 S29 V35 S36T28-D32 PolarHBondContact O-N 2.97Å; S29-D32 PolarHBondContact O-N 3.26Å; D32-V35 PolarHBondContact O-N 3.02Å; D32-S36 WeakPolarHBondContact O-CB 3.32Å; D32-S36 PolarHBondContact O-N 3.4Å
33I87.6Confident88.8Confident96 Ų9696.3 Ų96.349%0.49250%0.498SS..Hα-helixtrans-63.3-45.2173.9-69.2165.3000110.7S29 V30 R31 V35 S36 I37S29-I33 WeakPolarHBondContact O-CD1 3.49Å; S29-I33 VanDerWaalsContact O-CG1 3.27Å; S29-I33 WeakPolarHBondContact O-CG1 3.33Å; S29-I33 PolarHBondContact O-N 3.35Å; S29-I33 VanDerWaalsContact O-N 3.07Å; V30-I33 PolarHBondContact O-N 3.38Å; R31-I33 VanDerWaalsContact C-N 3.34Å; R31-I33 PolarHBondContact O-N 3.01Å; I33-V35 PolarHBondContact O-N 3.31Å; I33-S36 WeakPolarHBondContact O-CB 3.45Å; I33-S36 PolarHBondContact O-N 3.34Å; I33-I37 HydrophobicContact CG2-CD1 3.9Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 WeakPolarHBondContact O-CG1 3.39Å; I33-I37 PolarHBondContact O-N 3.39Å
34L86.1Confident88.9Confident96 Ų9692 Ų9250%0.50349%0.486SS..Hα-helixtrans-62.2-42.4178.7-72.1172.9000112V30 R31 S36 I37 E38V30-L34 HydrophobicContact CG1-CD1 4.17Å; V30-L34 WeakPolarHBondContact O-CG 3.34Å; V30-L34 PolarHBondContact O-N 3.28Å; R31-L34 PolarHBondContact O-N 3.18Å; L34-S36 VanDerWaalsContact C-N 3.33Å; L34-S36 PolarHBondContact O-N 2.97Å; L34-I37 PolarHBondContact O-N 2.96Å; L34-E38 PolarHBondContact O-N 3.31Å
35V87.1Confident89Confident65 Ų6593.2 Ų93.239%0.39449%0.489SS..Hα-helixtrans-61-43.5173.8172.80000110.7R31 D32 I33 I37 E38 E39R31-V35 WeakPolarHBondContact O-CG2 3.42Å; R31-V35 PolarHBondContact O-N 3.44Å; D32-V35 PolarHBondContact O-N 3.02Å; I33-V35 PolarHBondContact O-N 3.31Å; V35-I37 VanDerWaalsContact C-N 3.31Å; V35-I37 PolarHBondContact O-N 3.39Å; V35-E38 PolarHBondContact O-N 2.9Å; V35-E39 HydrophobicContact CG1-CG 4.45Å; V35-E39 WeakPolarHBondContact O-CG 3.32Å; V35-E39 PolarHBondContact O-N 3.43Å
36S88.5Confident89.1Confident53 Ų5390 Ų9037%0.37148%0.479SS..Hα-helixtrans-63.1-36176.7-171.20000112.8D32 I33 L34 N40D32-S36 WeakPolarHBondContact O-CB 3.32Å; D32-S36 PolarHBondContact O-N 3.4Å; I33-S36 WeakPolarHBondContact O-CB 3.45Å; I33-S36 PolarHBondContact O-N 3.34Å; L34-S36 VanDerWaalsContact C-N 3.33Å; L34-S36 PolarHBondContact O-N 2.97Å; S36-N40 WeakPolarHBondContact O-CB 3.47Å; S36-N40 VanDerWaalsContact O-CG 3.24Å; S36-N40 PolarHBondContact O-N 3.47Å; S36-N40 PolarHBondContact O-ND2 2.63Å
37I89.4Confident89.1Confident88 Ų8891.5 Ų91.545%0.45148%0.478SS..Hα-helixtrans-65.1-46.6174.3-69.3167.1000110.5I33 L34 V35 E39 N40 Q41I33-I37 HydrophobicContact CG2-CD1 3.9Å; I33-I37 HydrophobicContact CG2-CG1 4.44Å; I33-I37 WeakPolarHBondContact O-CG1 3.39Å; I33-I37 PolarHBondContact O-N 3.39Å; L34-I37 PolarHBondContact O-N 2.96Å; V35-I37 VanDerWaalsContact C-N 3.31Å; V35-I37 PolarHBondContact O-N 3.39Å; I37-E39 PolarHBondContact O-N 3.19Å; I37-N40 PolarHBondContact O-N 2.89Å; I37-Q41 WeakPolarHBondContact O-CB 3.49Å; I37-Q41 PolarHBondContact O-N 3.03Å
38E88.1Confident89.1Confident141 Ų14191.7 Ų91.766%0.65948%0.478SS*.Hα-helixtrans-60.8-43.5177.3-73-178.4175.600111.9L34 V35 Q41 A42L34-E38 PolarHBondContact O-N 3.31Å; V35-E38 PolarHBondContact O-N 2.9Å; E38-Q41 PolarHBondContact O-N 2.85Å; E38-A42 PolarHBondContact O-N 3.36Å
39E89.1Confident89.1Confident122 Ų12295.2 Ų95.257%0.5749%0.49SS*.Hα-helixtrans-62.2-44.8175.5-73.6-178.1168.500112V35 I37 Q41 A42 L43V35-E39 HydrophobicContact CG1-CG 4.45Å; V35-E39 WeakPolarHBondContact O-CG 3.32Å; V35-E39 PolarHBondContact O-N 3.43Å; I37-E39 PolarHBondContact O-N 3.19Å; E39-Q41 VanDerWaalsContact C-N 3.32Å; E39-Q41 PolarHBondContact O-N 3.2Å; E39-A42 PolarHBondContact O-N 3.11Å; E39-L43 WeakPolarHBondContact O-CG 3.39Å; E39-L43 PolarHBondContact O-N 2.94Å
40N87.8Confident89.1Confident82 Ų8299 Ų9944%0.43950%0.495SS..Hα-helixtrans-64.9-37.2177-76.9-37.5000111.9S36 I37 L43 I44S36-N40 WeakPolarHBondContact O-CB 3.47Å; S36-N40 VanDerWaalsContact O-CG 3.24Å; S36-N40 PolarHBondContact O-N 3.47Å; S36-N40 PolarHBondContact O-ND2 2.63Å; I37-N40 PolarHBondContact O-N 2.89Å; N40-L43 WeakPolarHBondContact O-CB 3.5Å; N40-L43 PolarHBondContact O-N 3Å; N40-I44 VanDerWaalsContact O-CG1 3.3Å; N40-I44 WeakPolarHBondContact O-CG1 3.42Å; N40-I44 PolarHBondContact O-N 3.03Å
41Q91Very high89Confident113 Ų113101.1 Ų101.153%0.52850%0.503SS..Hα-helixtrans-66.7-42.2176.8-167.9147.7-12.800111.4I37 E38 E39 L43 I44 E45I37-Q41 WeakPolarHBondContact O-CB 3.49Å; I37-Q41 PolarHBondContact O-N 3.03Å; E38-Q41 PolarHBondContact O-N 2.85Å; E39-Q41 VanDerWaalsContact C-N 3.32Å; E39-Q41 PolarHBondContact O-N 3.2Å; Q41-L43 VanDerWaalsContact C-N 3.31Å; Q41-L43 PolarHBondContact O-N 2.94Å; Q41-I44 PolarHBondContact O-N 2.97Å; Q41-E45 WeakPolarHBondContact O-CG 3.44Å; Q41-E45 PolarHBondContact O-N 3.47Å
42A89.8Confident89.1Confident60 Ų6096 Ų9650%0.49650%0.495SS..Hα-helixtrans-61.1-38.4172.500000112.4E38 E39 G46E38-A42 PolarHBondContact O-N 3.36Å; E39-A42 PolarHBondContact O-N 3.11Å; A42-G46 PolarHBondContact O-N 2.87Å
43L89.1Confident89.1Confident95 Ų9596.7 Ų96.750%0.49749%0.494SS..Hα-helixtrans-64.5-42.7174-73.6171.9000112E39 N40 Q41 G46 Y47E39-L43 WeakPolarHBondContact O-CG 3.39Å; E39-L43 PolarHBondContact O-N 2.94Å; N40-L43 WeakPolarHBondContact O-CB 3.5Å; N40-L43 PolarHBondContact O-N 3Å; Q41-L43 VanDerWaalsContact C-N 3.31Å; Q41-L43 PolarHBondContact O-N 2.94Å; L43-G46 PolarHBondContact O-N 3.39Å; L43-Y47 HydrophobicContact CB-CE2 4.41Å; L43-Y47 WeakPolarHBondContact O-CD2 3.46Å; L43-Y47 PolarHBondContact O-N 3.41Å
44I89.3Confident89.1Confident77 Ų7798.8 Ų98.840%0.39550%0.497SS..Hα-helixtrans-61.2-48177.2-70.6165.9000110.6N40 Q41 G46 Y47 E48N40-I44 VanDerWaalsContact O-CG1 3.3Å; N40-I44 WeakPolarHBondContact O-CG1 3.42Å; N40-I44 PolarHBondContact O-N 3.03Å; Q41-I44 PolarHBondContact O-N 2.97Å; I44-G46 VanDerWaalsContact C-N 3.29Å; I44-G46 PolarHBondContact O-N 2.93Å; I44-Y47 PolarHBondContact O-N 3.27Å; I44-Y47 VanDerWaalsContact O-N 3.13Å; I44-E48 HydrophobicContact CG2-CG 4.49Å; I44-E48 WeakPolarHBondContact O-CG 3.48Å; I44-E48 PolarHBondContact O-N 2.9Å
45E91.6Very high89.2Confident121 Ų12196.3 Ų96.357%0.56549%0.491SS*.Hα-helixtrans-59.1-41.9176.6-71.5179.9-176.600111.4Q41 Y47 E48 Q49Q41-E45 WeakPolarHBondContact O-CG 3.44Å; Q41-E45 PolarHBondContact O-N 3.47Å; E45-Y47 PolarHBondContact O-N 3.47Å; E45-E48 PolarHBondContact O-N 3Å; E45-Q49 PolarHBondContact O-N 3.31Å
46G91.9Very high89.4Confident28 Ų2898.1 Ų98.129%0.28950%0.498SS..Hα-helixtrans-60.9-40.9174.400000113.3A42 L43 I44 R50A42-G46 PolarHBondContact O-N 2.87Å; L43-G46 PolarHBondContact O-N 3.39Å; I44-G46 VanDerWaalsContact C-N 3.29Å; I44-G46 PolarHBondContact O-N 2.93Å; G46-R50 WeakPolarHBondContact O-CG 3.47Å; G46-R50 PolarHBondContact O-N 2.98Å; G46-R50 VanDerWaalsContact O-N 3.14Å
47Y90.2Very high89.3Confident139 Ų139100.4 Ų100.455%0.54550%0.503SS..Hα-helixtrans-68.9-39.6175.8-74.9-55.3000112.6L43 I44 E45 Q49 R50 L51L43-Y47 HydrophobicContact CB-CE2 4.41Å; L43-Y47 WeakPolarHBondContact O-CD2 3.46Å; L43-Y47 PolarHBondContact O-N 3.41Å; I44-Y47 PolarHBondContact O-N 3.27Å; I44-Y47 VanDerWaalsContact O-N 3.13Å; E45-Y47 PolarHBondContact O-N 3.47Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-Q49 PolarHBondContact O-N 3.01Å; Y47-R50 PolarHBondContact O-N 2.97Å; Y47-L51 WeakPolarHBondContact O-CB 3.21Å; Y47-L51 WeakPolarHBondContact O-CG 3.4Å; Y47-L51 PolarHBondContact O-N 3.25Å
48E91Very high89.2Confident104 Ų104101 Ų10149%0.48651%0.506SS..Hα-helixtrans-62.5-40176.2-73.5-177.3175.200111.4I44 E45 L51 G52 K208I44-E48 HydrophobicContact CG2-CG 4.49Å; I44-E48 WeakPolarHBondContact O-CG 3.48Å; I44-E48 PolarHBondContact O-N 2.9Å; E45-E48 PolarHBondContact O-N 3Å; E48-L51 PolarHBondContact O-N 2.95Å; E48-G52 PolarHBondContact O-N 3.42Å; E48-K208 IonicContact OE1-NZ 3.06Å; E48-K208 PolarHBondContact OE1-NZ 3.16Å
49Q89Confident89.3Confident141 Ų141101.5 Ų101.566%0.65951%0.507SS*.Hα-helixtrans-63.8-43175.3-146.3178.432.700111.9E45 Y47 G52 Q53E45-Q49 PolarHBondContact O-N 3.31Å; Y47-Q49 VanDerWaalsContact C-N 3.3Å; Y47-Q49 PolarHBondContact O-N 3.01Å; Q49-G52 PolarHBondContact O-N 3.22Å; Q49-Q53 WeakPolarHBondContact O-CG 3.34Å; Q49-Q53 PolarHBondContact O-N 3.12Å
50R88Confident89.2Confident142 Ų142103.3 Ų103.354%0.53651%0.508SS..Hα-helixtrans-64.7-41.2174.9-72.8-178.1-163.1176.87.3112.4G46 Y47 G52 Q53 Y54G46-R50 WeakPolarHBondContact O-CG 3.47Å; G46-R50 PolarHBondContact O-N 2.98Å; G46-R50 VanDerWaalsContact O-N 3.14Å; Y47-R50 PolarHBondContact O-N 2.97Å; R50-G52 VanDerWaalsContact C-N 3.29Å; R50-G52 PolarHBondContact O-N 3.1Å; R50-Q53 WeakPolarHBondContact O-CB 3.37Å; R50-Q53 PolarHBondContact O-N 3.27Å; R50-Q53 VanDerWaalsContact O-N 3.16Å; R50-Y54 HydrophobicContact CB-CE2 4.36Å; R50-Y54 VanDerWaalsContact O-CD2 3.24Å; R50-Y54 WeakPolarHBondContact O-CD2 3.32Å; R50-Y54 PolarHBondContact O-N 3.07Å
51L88.6Confident89.2Confident117 Ų117107.5 Ų107.561%0.61352%0.518SS*.Hα-helixtrans-60.9-40.3174.9-76.3170.6000111.4Y47 E48 Y54 A55Y47-L51 WeakPolarHBondContact O-CB 3.21Å; Y47-L51 WeakPolarHBondContact O-CG 3.4Å; Y47-L51 PolarHBondContact O-N 3.25Å; E48-L51 PolarHBondContact O-N 2.95Å; L51-Y54 PolarHBondContact O-N 2.88Å; L51-A55 WeakPolarHBondContact O-CB 3.36Å; L51-A55 PolarHBondContact O-N 3.49Å
52G90.3Very high89.1Confident34 Ų34105.2 Ų105.235%0.35151%0.509SS..Hα-helixtrans-60.5-42.4172.600000112.9E48 Q49 R50 A55 N56E48-G52 PolarHBondContact O-N 3.42Å; Q49-G52 PolarHBondContact O-N 3.22Å; R50-G52 VanDerWaalsContact C-N 3.29Å; R50-G52 PolarHBondContact O-N 3.1Å; G52-A55 PolarHBondContact O-N 3.25Å; G52-N56 PolarHBondContact O-N 3.43Å; G52-N56 VanDerWaalsContact O-N 3.11Å; G52-N56 PolarHBondContact O-ND2 3.44Å
53Q88.7Confident89Confident116 Ų116106.6 Ų106.654%0.54251%0.506SS..Hα-helixtrans-63-47.5175.3-69.6173.32.300111.7Q49 R50 A55 N56 E57Q49-Q53 WeakPolarHBondContact O-CG 3.34Å; Q49-Q53 PolarHBondContact O-N 3.12Å; R50-Q53 WeakPolarHBondContact O-CB 3.37Å; R50-Q53 PolarHBondContact O-N 3.27Å; R50-Q53 VanDerWaalsContact O-N 3.16Å; Q53-A55 VanDerWaalsContact C-N 3.32Å; Q53-A55 PolarHBondContact O-N 3.37Å; Q53-N56 WeakPolarHBondContact O-CB 3.22Å; Q53-N56 PolarHBondContact O-N 3Å; Q53-N56 VanDerWaalsContact O-N 3.13Å; Q53-E57 PolarHBondContact O-N 2.96Å
54Y87.4Confident88.8Confident140 Ų140105 Ų10555%0.54950%0.497SS..Hα-helixtrans-62.6-37177.4-68.9-46000112.9R50 L51 N56 E57 L58R50-Y54 HydrophobicContact CB-CE2 4.36Å; R50-Y54 VanDerWaalsContact O-CD2 3.24Å; R50-Y54 WeakPolarHBondContact O-CD2 3.32Å; R50-Y54 PolarHBondContact O-N 3.07Å; L51-Y54 PolarHBondContact O-N 2.88Å; Y54-N56 VanDerWaalsContact C-N 3.32Å; Y54-N56 PolarHBondContact O-N 3.37Å; Y54-E57 PolarHBondContact O-N 3.2Å; Y54-L58 WeakPolarHBondContact O-CB 2.92Å; Y54-L58 PolarHBondContact O-N 2.86Å
55A88.1Confident88.5Confident45 Ų45104.5 Ų104.537%0.37249%0.493SS..Hα-helixtrans-63.5-38.8174.700000112.1L51 G52 Q53 L58 K59L51-A55 WeakPolarHBondContact O-CB 3.36Å; L51-A55 PolarHBondContact O-N 3.49Å; G52-A55 PolarHBondContact O-N 3.25Å; Q53-A55 VanDerWaalsContact C-N 3.32Å; Q53-A55 PolarHBondContact O-N 3.37Å; A55-L58 PolarHBondContact O-N 3.46Å; A55-K59 WeakPolarHBondContact O-CG 3.48Å; A55-K59 PolarHBondContact O-N 3.38Å
56N89.8Confident88.3Confident103 Ų103103.9 Ų103.955%0.55149%0.488SS*.Hα-helixtrans-69.2-40.8176-72.5-26.5000112.1G52 Q53 Y54 K59 R60G52-N56 PolarHBondContact O-N 3.43Å; G52-N56 VanDerWaalsContact O-N 3.11Å; G52-N56 PolarHBondContact O-ND2 3.44Å; Q53-N56 WeakPolarHBondContact O-CB 3.22Å; Q53-N56 PolarHBondContact O-N 3Å; Q53-N56 VanDerWaalsContact O-N 3.13Å; Y54-N56 VanDerWaalsContact C-N 3.32Å; Y54-N56 PolarHBondContact O-N 3.37Å; N56-K59 PolarHBondContact O-N 2.88Å; N56-R60 PolarHBondContact O-N 3.06Å
57E86.7Confident88.1Confident101 Ų101108.5 Ų108.547%0.47250%0.502SS..Hα-helixtrans-62.5-42.9172.8-73.9-171.715900111.7Q53 Y54 K59 R60 W61Q53-E57 PolarHBondContact O-N 2.96Å; Y54-E57 PolarHBondContact O-N 3.2Å; E57-K59 VanDerWaalsContact C-N 3.32Å; E57-K59 PolarHBondContact O-N 2.98Å; E57-R60 WeakPolarHBondContact O-CB 3.5Å; E57-R60 PolarHBondContact O-N 2.87Å; E57-R60 VanDerWaalsContact O-N 3.12Å; E57-W61 PolarHBondContact O-N 3.48Å
58L86.8Confident87.8Confident100 Ų100105.6 Ų105.652%0.52450%0.499SS..Hα-helixtrans-57.5-44.3174.2-98.9158.9000111.7Y54 A55 N62Y54-L58 WeakPolarHBondContact O-CB 2.92Å; Y54-L58 PolarHBondContact O-N 2.86Å; A55-L58 PolarHBondContact O-N 3.46Å; L58-N62 VanDerWaalsContact O-CB 3.23Å; L58-N62 WeakPolarHBondContact O-CB 3.45Å; L58-N62 PolarHBondContact O-N 2.6Å
59K90.5Very high87.5Confident152 Ų152103.1 Ų103.166%0.66149%0.489SS*.Hα-helixtrans-61.7-43.6174.7-76.2178.5-178.3174.60111.7A55 N56 E57 N62 E63A55-K59 WeakPolarHBondContact O-CG 3.48Å; A55-K59 PolarHBondContact O-N 3.38Å; N56-K59 PolarHBondContact O-N 2.88Å; E57-K59 VanDerWaalsContact C-N 3.32Å; E57-K59 PolarHBondContact O-N 2.98Å; K59-N62 PolarHBondContact O-N 3.31Å; K59-E63 PolarHBondContact O-N 3.17Å
60R88.4Confident87.4Confident159 Ų159101.1 Ų101.160%0.649%0.486SS*.Hα-helixtrans-61.9-48.4178.4-176.6-178.3176.5-169-0.7111.7N56 E57 N62 E63 I64N56-R60 PolarHBondContact O-N 3.06Å; E57-R60 WeakPolarHBondContact O-CB 3.5Å; E57-R60 PolarHBondContact O-N 2.87Å; E57-R60 VanDerWaalsContact O-N 3.12Å; R60-N62 VanDerWaalsContact C-N 3.31Å; R60-N62 PolarHBondContact O-N 2.92Å; R60-E63 PolarHBondContact O-N 3.29Å; R60-I64 HydrophobicContact CG-CD1 4.13Å; R60-I64 WeakPolarHBondContact O-CG1 3.48Å; R60-I64 PolarHBondContact O-N 3.29Å
61W86.4Confident87.1Confident171 Ų17198.1 Ų98.165%0.64849%0.487SS*.Hα-helixtrans-62.1-39.6177.2-78.2115.9000112.2E57 E63 I64 Q65E57-W61 PolarHBondContact O-N 3.48Å; W61-E63 VanDerWaalsContact C-N 3.28Å; W61-E63 PolarHBondContact O-N 3.03Å; W61-I64 HydrophobicContact CE3-CD1 4.17Å; W61-I64 HydrophobicContact CZ3-CD1 4.38Å; W61-I64 PolarHBondContact O-N 3Å; W61-Q65 WeakPolarHBondContact O-CB 3.39Å; W61-Q65 PolarHBondContact O-N 3.3Å
62N88.7Confident86.5Confident65 Ų6593.2 Ų93.235%0.34846%0.463SS..Hα-helixtrans-64.9-33.6177.3-155.633.5000112.1L58 K59 R60 K66 K194L58-N62 VanDerWaalsContact O-CB 3.23Å; L58-N62 WeakPolarHBondContact O-CB 3.45Å; L58-N62 PolarHBondContact O-N 2.6Å; K59-N62 PolarHBondContact O-N 3.31Å; R60-N62 VanDerWaalsContact C-N 3.31Å; R60-N62 PolarHBondContact O-N 2.92Å; N62-K66 PolarHBondContact O-N 3.1Å; N62-K194 PolarHBondContact ND2-NZ 3.09Å; N62-K194 PolarHBondContact OD1-NZ 3.35Å
63E88.5Confident86.3Confident89 Ų8999.3 Ų99.342%0.41648%0.48SS..Hα-helixtrans-75.1-39.7175.6-165.257.5-150.600112.2K59 R60 W61 Q65 K66 Q67K59-E63 PolarHBondContact O-N 3.17Å; R60-E63 PolarHBondContact O-N 3.29Å; W61-E63 VanDerWaalsContact C-N 3.28Å; W61-E63 PolarHBondContact O-N 3.03Å; E63-Q65 VanDerWaalsContact C-N 3.27Å; E63-Q65 PolarHBondContact O-N 3.3Å; E63-K66 PolarHBondContact O-N 3.21Å; E63-K66 IonicContact OE2-NZ 3.88Å; E63-K66 PolarHBondContact OE2-NZ 3.04Å; E63-Q67 WeakPolarHBondContact O-CG 3.47Å; E63-Q67 PolarHBondContact O-N 3.44Å; E63-Q67 VanDerWaalsContact O-N 3.11Å
64I85.1Confident86.2Confident62 Ų62100.5 Ų100.532%0.31848%0.483SS..Hα-helixtrans-58.5-43.7171.5-67.7167.3000110R60 W61 K66 Q67 V68R60-I64 HydrophobicContact CG-CD1 4.13Å; R60-I64 WeakPolarHBondContact O-CG1 3.48Å; R60-I64 PolarHBondContact O-N 3.29Å; W61-I64 HydrophobicContact CE3-CD1 4.17Å; W61-I64 HydrophobicContact CZ3-CD1 4.38Å; W61-I64 PolarHBondContact O-N 3Å; I64-K66 PolarHBondContact O-N 3.26Å; I64-Q67 WeakPolarHBondContact O-CB 3.48Å; I64-Q67 PolarHBondContact O-N 3Å; I64-Q67 VanDerWaalsContact O-N 3.11Å; I64-V68 HydrophobicContact CG2-CG2 4.42Å; I64-V68 WeakPolarHBondContact O-CG2 3.48Å; I64-V68 PolarHBondContact O-N 3.48Å
65Q83Confident85.9Confident66 Ų6695.6 Ų95.631%0.30847%0.47SS..Hα-helixtrans-58.6-45.6177.7-173.461.836.400111.8W61 E63 Q67 V68 D69W61-Q65 WeakPolarHBondContact O-CB 3.39Å; W61-Q65 PolarHBondContact O-N 3.3Å; E63-Q65 VanDerWaalsContact C-N 3.27Å; E63-Q65 PolarHBondContact O-N 3.3Å; Q65-Q67 VanDerWaalsContact C-N 3.29Å; Q65-Q67 PolarHBondContact O-N 3.38Å; Q65-V68 WeakPolarHBondContact O-CB 3.47Å; Q65-V68 PolarHBondContact O-N 3.11Å; Q65-D69 PolarHBondContact NE2-OD1 3.4Å; Q65-D69 VanDerWaalsContact O-CG 3.3Å; Q65-D69 PolarHBondContact O-N 3.03Å
66K87.7Confident85.7Confident108 Ų10897 Ų9747%0.4747%0.467SS..Hα-helixtrans-58.9-41.2175.2-72179-166.1160.10112.4N62 E63 I64 V68 D69 V70N62-K66 PolarHBondContact O-N 3.1Å; E63-K66 PolarHBondContact O-N 3.21Å; E63-K66 IonicContact OE2-NZ 3.88Å; E63-K66 PolarHBondContact OE2-NZ 3.04Å; I64-K66 PolarHBondContact O-N 3.26Å; K66-V68 VanDerWaalsContact C-N 3.33Å; K66-D69 PolarHBondContact O-N 3.12Å; K66-V70 VanDerWaalsContact O-CG2 3.29Å; K66-V70 WeakPolarHBondContact O-CG2 3.48Å; K66-V70 PolarHBondContact O-N 2.96Å
67Q86.4Confident85.5Confident125 Ų12594 Ų9458%0.58446%0.461SS*.Hα-helixtrans-64.7-40.5178.5-68.6179.29.700111.4E63 I64 Q65 V70 S71E63-Q67 WeakPolarHBondContact O-CG 3.47Å; E63-Q67 PolarHBondContact O-N 3.44Å; E63-Q67 VanDerWaalsContact O-N 3.11Å; I64-Q67 WeakPolarHBondContact O-CB 3.48Å; I64-Q67 PolarHBondContact O-N 3Å; I64-Q67 VanDerWaalsContact O-N 3.11Å; Q65-Q67 VanDerWaalsContact C-N 3.29Å; Q65-Q67 PolarHBondContact O-N 3.38Å; Q67-V70 PolarHBondContact O-N 3.37Å; Q67-S71 WeakPolarHBondContact O-CB 3.32Å; Q67-S71 PolarHBondContact O-N 3.29Å
68V84.5Confident85Confident77 Ų7794.4 Ų94.447%0.46746%0.463SS..Hα-helixtrans-61.5-47.7174.4172.60000110.6I64 Q65 K66 V70 S71 A72I64-V68 HydrophobicContact CG2-CG2 4.42Å; I64-V68 WeakPolarHBondContact O-CG2 3.48Å; I64-V68 PolarHBondContact O-N 3.48Å; Q65-V68 WeakPolarHBondContact O-CB 3.47Å; Q65-V68 PolarHBondContact O-N 3.11Å; K66-V68 VanDerWaalsContact C-N 3.33Å; V68-V70 PolarHBondContact O-N 3.45Å; V68-S71 PolarHBondContact O-N 2.88Å; V68-A72 WeakPolarHBondContact O-CB 3.46Å; V68-A72 PolarHBondContact O-N 3.36Å
69D84.5Confident84.6Confident53 Ų5391.2 Ų91.228%0.28345%0.446SS..Hα-helixtrans-62.1-41.6-179.9-67.4-14.8000112.2Q65 K66 A72 K73Q65-D69 PolarHBondContact NE2-OD1 3.4Å; Q65-D69 VanDerWaalsContact O-CG 3.3Å; Q65-D69 PolarHBondContact O-N 3.03Å; K66-D69 PolarHBondContact O-N 3.12Å; D69-A72 PolarHBondContact O-N 3.34Å; D69-K73 WeakPolarHBondContact O-CB 3.32Å; D69-K73 WeakPolarHBondContact O-CG 3.45Å; D69-K73 PolarHBondContact O-N 2.85Å
70V86.5Confident84.2Confident99 Ų9988.4 Ų88.460%0.644%0.438SS*.Hα-helixtrans-64.5-43.3175.7170.50000110.7K66 Q67 V68 K73 K74K66-V70 VanDerWaalsContact O-CG2 3.29Å; K66-V70 WeakPolarHBondContact O-CG2 3.48Å; K66-V70 PolarHBondContact O-N 2.96Å; Q67-V70 PolarHBondContact O-N 3.37Å; V68-V70 PolarHBondContact O-N 3.45Å; V70-K73 PolarHBondContact O-N 3Å; V70-K74 WeakPolarHBondContact O-CB 3.38Å; V70-K74 PolarHBondContact O-N 2.94Å
71S82.9Confident83.7Confident78 Ų7883.4 Ų83.455%0.54543%0.431SS..Hα-helixtrans-64.8-42.4178.2-169.30000111.8Q67 V68 K74 S75Q67-S71 WeakPolarHBondContact O-CB 3.32Å; Q67-S71 PolarHBondContact O-N 3.29Å; V68-S71 PolarHBondContact O-N 2.88Å; S71-K74 PolarHBondContact O-N 3.26Å; S71-S75 PolarHBondContact O-N 3.27Å
72A74.7Confident83.2Confident15 Ų1579.9 Ų79.912%0.12442%0.421CS..Hα-helixtrans-64.2-43.5177.100000111.8V68 D69 K74 S75 K76V68-A72 WeakPolarHBondContact O-CB 3.46Å; V68-A72 PolarHBondContact O-N 3.36Å; D69-A72 PolarHBondContact O-N 3.34Å; A72-K74 VanDerWaalsContact C-N 3.31Å; A72-K74 PolarHBondContact O-N 2.92Å; A72-S75 PolarHBondContact O-N 2.91Å; A72-S75 PolarHBondContact O-OG 2.92Å; A72-S75 VanDerWaalsContact O-OG 3.07Å; A72-K76 WeakPolarHBondContact O-CB 3.5Å; A72-K76 PolarHBondContact O-N 3.3Å
73K86.8Confident82.7Confident162 Ų16280.3 Ų80.370%0.70442%0.421SS*.Hα-helixtrans-60.8-41.6173.9-76.8177-178.9176.20111.9D69 V70 G77D69-K73 WeakPolarHBondContact O-CB 3.32Å; D69-K73 WeakPolarHBondContact O-CG 3.45Å; D69-K73 PolarHBondContact O-N 2.85Å; V70-K73 PolarHBondContact O-N 3Å; K73-G77 PolarHBondContact O-N 3.38Å
74K87.2Confident82.4Confident140 Ų14081.3 Ų81.361%0.60943%0.426SS*.Hα-helixtrans-66.2-44.4178.3-173.1178.1179.5-1790111.7V70 S71 A72 G77 Q78V70-K74 WeakPolarHBondContact O-CB 3.38Å; V70-K74 PolarHBondContact O-N 2.94Å; S71-K74 PolarHBondContact O-N 3.26Å; A72-K74 VanDerWaalsContact C-N 3.31Å; A72-K74 PolarHBondContact O-N 2.92Å; K74-G77 PolarHBondContact O-N 2.93Å; K74-Q78 WeakPolarHBondContact O-CG 3.45Å; K74-Q78 PolarHBondContact O-N 3.44Å
75S80.8Confident82.1Confident37 Ų3783.3 Ų83.326%0.25944%0.436SS..Hα-helixtrans-64-46.5177.2760000110.5S71 A72 G77 Q78 L79S71-S75 PolarHBondContact O-N 3.27Å; A72-S75 PolarHBondContact O-N 2.91Å; A72-S75 PolarHBondContact O-OG 2.92Å; A72-S75 VanDerWaalsContact O-OG 3.07Å; S75-G77 VanDerWaalsContact C-N 3.29Å; S75-G77 PolarHBondContact O-N 3.37Å; S75-Q78 WeakPolarHBondContact O-CB 3.5Å; S75-Q78 PolarHBondContact O-N 2.86Å; S75-L79 VanDerWaalsContact O-CG 3.32Å; S75-L79 WeakPolarHBondContact O-CG 3.42Å; S75-L79 PolarHBondContact O-N 2.92Å
76K84.7Confident81.5Confident74 Ų7481.2 Ų81.232%0.32243%0.427SS..Hα-helixtrans-54.3-45.3175.7-170.1170.9-168.8163.30111.8A72 Q78 L79 L80 D181A72-K76 WeakPolarHBondContact O-CB 3.5Å; A72-K76 PolarHBondContact O-N 3.3Å; K76-Q78 PolarHBondContact O-N 3.02Å; K76-L79 PolarHBondContact O-N 3.44Å; K76-L80 HydrophobicContact CG-CD1 4.36Å; K76-L80 WeakPolarHBondContact O-CG 3.38Å; K76-L80 PolarHBondContact O-N 3.03Å; K76-D181 VanDerWaalsContact NZ-CG 3.28Å; K76-D181 IonicContact NZ-OD1 2.63Å; K76-D181 PolarHBondContact NZ-OD1 3.34Å; K76-D181 IonicContact NZ-OD2 2.78Å; K76-D181 PolarHBondContact NZ-OD2 3.46Å
77G84.7Confident81Confident40 Ų4080.9 Ų80.941%0.41243%0.425SS..Hα-helixtrans-61.4-40.2175.500000113.7K73 K74 S75 A81K73-G77 PolarHBondContact O-N 3.38Å; K74-G77 PolarHBondContact O-N 2.93Å; S75-G77 VanDerWaalsContact C-N 3.29Å; S75-G77 PolarHBondContact O-N 3.37Å; G77-A81 WeakPolarHBondContact O-CB 3.33Å; G77-A81 PolarHBondContact O-N 3.2Å
78Q77.2Confident80.6Confident111 Ų11178.4 Ų78.452%0.51942%0.422SS..Hα-helixtrans-66-39.3176.3-72.7176.3-24.800112.3K74 S75 K76 A81 Q82K74-Q78 WeakPolarHBondContact O-CG 3.45Å; K74-Q78 PolarHBondContact O-N 3.44Å; S75-Q78 WeakPolarHBondContact O-CB 3.5Å; S75-Q78 PolarHBondContact O-N 2.86Å; K76-Q78 PolarHBondContact O-N 3.02Å; Q78-A81 PolarHBondContact O-N 3.38Å; Q78-Q82 WeakPolarHBondContact O-CG 3.38Å; Q78-Q82 PolarHBondContact O-N 2.75Å
79L77.5Confident80.1Confident33 Ų3378.1 Ų78.117%0.17342%0.417CS..Hα-helixtrans-67.6-43.1178.6-64179.9000112S75 K76 A81 Q82 Q83 L173 T177S75-L79 VanDerWaalsContact O-CG 3.32Å; S75-L79 WeakPolarHBondContact O-CG 3.42Å; S75-L79 PolarHBondContact O-N 2.92Å; K76-L79 PolarHBondContact O-N 3.44Å; L79-A81 VanDerWaalsContact C-N 3.31Å; L79-A81 PolarHBondContact O-N 3.24Å; L79-Q82 PolarHBondContact O-N 3.23Å; L79-Q83 WeakPolarHBondContact O-CB 3.43Å; L79-Q83 PolarHBondContact O-N 2.89Å; L79-L173 HydrophobicContact CD1-CD2 3.64Å; L79-L173 HydrophobicContact CD2-CB 4.47Å; L79-L173 HydrophobicContact CD2-CD1 3.75Å; L79-L173 HydrophobicContact CD2-CD2 3.19Å; L79-L173 HydrophobicContact CD2-CG 3.96Å; L79-L173 HydrophobicContact CG-CD2 3.99Å; L79-T177 HydrophobicContact CB-CG2 4.48Å; L79-T177 HydrophobicContact CD1-CG2 3.46Å; L79-T177 VanDerWaalsContact CD1-CG2 3.46Å
80L81.4Confident79.5Confident93 Ų9378.2 Ų78.249%0.48742%0.417SS..Hα-helixtrans-61.9-39.9173.9-69.8172.2000111.8K76 Q83 E84K76-L80 HydrophobicContact CG-CD1 4.36Å; K76-L80 WeakPolarHBondContact O-CG 3.38Å; K76-L80 PolarHBondContact O-N 3.03Å; L80-Q83 WeakPolarHBondContact O-CB 3.48Å; L80-Q83 PolarHBondContact O-N 2.72Å; L80-E84 PolarHBondContact O-N 3.48Å
81A78.8Confident79.3Confident54 Ų5480.6 Ų80.645%0.44642%0.419SS..Hα-helixtrans-65.1-41.2175.800000112.3G77 Q78 L79 Q83 E84 I85G77-A81 WeakPolarHBondContact O-CB 3.33Å; G77-A81 PolarHBondContact O-N 3.2Å; Q78-A81 PolarHBondContact O-N 3.38Å; L79-A81 VanDerWaalsContact C-N 3.31Å; L79-A81 PolarHBondContact O-N 3.24Å; A81-Q83 VanDerWaalsContact C-N 3.34Å; A81-E84 PolarHBondContact O-N 3.49Å; A81-I85 WeakPolarHBondContact O-CG1 3.41Å; A81-I85 PolarHBondContact O-N 2.89Å; A81-I85 VanDerWaalsContact O-N 3.12Å
82Q76Confident79Confident97 Ų9782.3 Ų82.345%0.45342%0.419SS..Hα-helixtrans-61.9-44173.3-76.3177.3-15.800111.2Q78 L79 E84 I85 I86Q78-Q82 WeakPolarHBondContact O-CG 3.38Å; Q78-Q82 PolarHBondContact O-N 2.75Å; L79-Q82 PolarHBondContact O-N 3.23Å; Q82-E84 VanDerWaalsContact C-N 3.32Å; Q82-E84 PolarHBondContact O-N 3.12Å; Q82-I85 PolarHBondContact O-N 3.16Å; Q82-I86 VanDerWaalsContact O-CD1 3.3Å; Q82-I86 WeakPolarHBondContact O-CD1 3.45Å; Q82-I86 WeakPolarHBondContact O-CG1 3.29Å; Q82-I86 PolarHBondContact O-N 3.26Å
83Q77.1Confident78.9Confident73 Ų7382.1 Ų82.134%0.34142%0.416SS..Hα-helixtrans-59.3-41.6178-167.2-17617.200112L79 L80 A81 I86 K87 V170L79-Q83 WeakPolarHBondContact O-CB 3.43Å; L79-Q83 PolarHBondContact O-N 2.89Å; L80-Q83 WeakPolarHBondContact O-CB 3.48Å; L80-Q83 PolarHBondContact O-N 2.72Å; A81-Q83 VanDerWaalsContact C-N 3.34Å; Q83-I86 PolarHBondContact O-N 3.25Å; Q83-K87 WeakPolarHBondContact O-CG 3.39Å; Q83-K87 PolarHBondContact O-N 3.24Å; Q83-V170 HydrophobicContact CG-CG1 4.08Å
84E82.5Confident78.2Confident111 Ų11177.5 Ų77.552%0.51940%0.401SS..Hα-helixtrans-67.3-39.4176.7-78-57.8133.300113.1L80 A81 Q82 I86 K87 S88L80-E84 PolarHBondContact O-N 3.48Å; A81-E84 PolarHBondContact O-N 3.49Å; Q82-E84 VanDerWaalsContact C-N 3.32Å; Q82-E84 PolarHBondContact O-N 3.12Å; E84-I86 PolarHBondContact O-N 3.41Å; E84-K87 PolarHBondContact O-N 2.93Å; E84-K87 IonicContact OE1-NZ 3.81Å; E84-K87 PolarHBondContact OE1-NZ 3.36Å; E84-S88 WeakPolarHBondContact O-CB 3.31Å; E84-S88 PolarHBondContact O-N 3.33Å
85I78.5Confident77.6Confident104 Ų10475.3 Ų75.353%0.53340%0.396SS..Hα-helixtrans-58-41.4172.6-68.8166.6000110A81 Q82 S88 L89A81-I85 WeakPolarHBondContact O-CG1 3.41Å; A81-I85 PolarHBondContact O-N 2.89Å; A81-I85 VanDerWaalsContact O-N 3.12Å; Q82-I85 PolarHBondContact O-N 3.16Å; I85-S88 WeakPolarHBondContact O-CB 3.48Å; I85-S88 PolarHBondContact O-N 3.01Å; I85-L89 HydrophobicContact CG2-CD1 4.01Å; I85-L89 HydrophobicContact CG2-CG 4.45Å; I85-L89 WeakPolarHBondContact O-CG 3.13Å; I85-L89 PolarHBondContact O-N 3.47Å
86I71.1Confident77.1Confident21 Ų2177.8 Ų77.811%0.10841%0.405CS..Hα-helixtrans-71.3-43.7-176.1-67.3164.4000110.9Q82 Q83 E84 S88 L89 I90 I166 V170Q82-I86 VanDerWaalsContact O-CD1 3.3Å; Q82-I86 WeakPolarHBondContact O-CD1 3.45Å; Q82-I86 WeakPolarHBondContact O-CG1 3.29Å; Q82-I86 PolarHBondContact O-N 3.26Å; Q83-I86 PolarHBondContact O-N 3.25Å; E84-I86 PolarHBondContact O-N 3.41Å; I86-S88 VanDerWaalsContact C-N 3.25Å; I86-S88 PolarHBondContact O-N 3.28Å; I86-L89 PolarHBondContact O-N 3.02Å; I86-L89 VanDerWaalsContact O-N 3.16Å; I86-I90 HydrophobicContact CG2-CD1 3.89Å; I86-I90 HydrophobicContact CG2-CG1 4.49Å; I86-I90 WeakPolarHBondContact O-CD1 3.32Å; I86-I90 VanDerWaalsContact O-CG1 3.27Å; I86-I90 WeakPolarHBondContact O-CG1 3.45Å; I86-I90 PolarHBondContact O-N 3.38Å; I86-I166 HydrophobicContact CB-CG2 4.31Å; I86-I166 HydrophobicContact CD1-CG2 3.19Å; I86-I166 HydrophobicContact CG1-CG2 3.39Å; I86-I166 HydrophobicContact CG2-CG2 3.99Å; I86-V170 HydrophobicContact CB-CG2 4.36Å; I86-V170 HydrophobicContact CD1-CG2 3.07Å; I86-V170 HydrophobicContact CG1-CG2 4.25Å; I86-V170 HydrophobicContact CG2-CG2 4.2Å
87K78.1Confident76.3Confident101 Ų10177.3 Ų77.344%0.43941%0.406SS..Hα-helixtrans-56.9-41170.1-71.6178.3-168.3163.60111.9Q83 E84 I90 K91Q83-K87 WeakPolarHBondContact O-CG 3.39Å; Q83-K87 PolarHBondContact O-N 3.24Å; E84-K87 PolarHBondContact O-N 2.93Å; E84-K87 IonicContact OE1-NZ 3.81Å; E84-K87 PolarHBondContact OE1-NZ 3.36Å; K87-I90 PolarHBondContact O-N 2.95Å; K87-K91 WeakPolarHBondContact O-CB 3.36Å; K87-K91 PolarHBondContact O-N 2.93Å
88S77.8Confident75.8Confident74 Ų7481.5 Ų81.552%0.51742%0.415SS..Hα-helixtrans-63-44.6176.4-169.80000111.6E84 I85 I86 K91 E92E84-S88 WeakPolarHBondContact O-CB 3.31Å; E84-S88 PolarHBondContact O-N 3.33Å; I85-S88 WeakPolarHBondContact O-CB 3.48Å; I85-S88 PolarHBondContact O-N 3.01Å; I86-S88 VanDerWaalsContact C-N 3.25Å; I86-S88 PolarHBondContact O-N 3.28Å; S88-K91 PolarHBondContact O-N 3.47Å; S88-E92 PolarHBondContact O-N 3.04Å
89L73.8Confident75.5Confident71 Ų7180.7 Ų80.737%0.37241%0.414SS..Hα-helixtrans-63.8-42.6177.2-74.2169.7000112.1I85 I86 K91 E92 N93I85-L89 HydrophobicContact CG2-CD1 4.01Å; I85-L89 HydrophobicContact CG2-CG 4.45Å; I85-L89 WeakPolarHBondContact O-CG 3.13Å; I85-L89 PolarHBondContact O-N 3.47Å; I86-L89 PolarHBondContact O-N 3.02Å; I86-L89 VanDerWaalsContact O-N 3.16Å; L89-K91 VanDerWaalsContact C-N 3.3Å; L89-K91 PolarHBondContact O-N 2.87Å; L89-E92 PolarHBondContact O-N 3.37Å; L89-N93 WeakPolarHBondContact O-CB 3.38Å; L89-N93 PolarHBondContact O-N 2.9Å
90I72Confident75Confident54 Ų5482.2 Ų82.228%0.27742%0.42SS..Hα-helixtrans-59.7-44175.4-67.5160000110.3I86 K87 N93 T94 V163 E167I86-I90 HydrophobicContact CG2-CD1 3.89Å; I86-I90 HydrophobicContact CG2-CG1 4.49Å; I86-I90 WeakPolarHBondContact O-CD1 3.32Å; I86-I90 VanDerWaalsContact O-CG1 3.27Å; I86-I90 WeakPolarHBondContact O-CG1 3.45Å; I86-I90 PolarHBondContact O-N 3.38Å; K87-I90 PolarHBondContact O-N 2.95Å; I90-N93 PolarHBondContact O-N 3.17Å; I90-T94 PolarHBondContact O-N 3.45Å; I90-T94 PolarHBondContact O-OG1 2.83Å; I90-V163 HydrophobicContact CG1-CG1 4.11Å; I90-E167 HydrophobicContact CD1-CG 3.94Å; I90-E167 WeakPolarHBondContact CD1-OE1 3.45Å; I90-E167 HydrophobicContact CG1-CG 4.5Å; I90-E167 WeakPolarHBondContact CG1-OE1 3.41Å
91K82Confident74.4Confident149 Ų14979.3 Ų79.365%0.64841%0.412SS*.Hα-helixtrans-63.4-43.8177.8-169.8178.4-179.5-178.50111.9K87 S88 L89 T94 L95K87-K91 WeakPolarHBondContact O-CB 3.36Å; K87-K91 PolarHBondContact O-N 2.93Å; S88-K91 PolarHBondContact O-N 3.47Å; L89-K91 VanDerWaalsContact C-N 3.3Å; L89-K91 PolarHBondContact O-N 2.87Å; K91-T94 WeakPolarHBondContact O-CB 3.4Å; K91-T94 PolarHBondContact O-N 2.84Å; K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 3.01Å; K91-L95 VanDerWaalsContact O-N 3.1Å
92E76.9Confident73.9Confident114 Ų11479.8 Ų79.853%0.53341%0.411SS..Hα-helixtrans-63.9-42.1176.4-169.2171.7-172.200111.8S88 L89 T94 L95 L96S88-E92 PolarHBondContact O-N 3.04Å; L89-E92 PolarHBondContact O-N 3.37Å; E92-T94 VanDerWaalsContact C-N 3.29Å; E92-T94 PolarHBondContact O-N 3.45Å; E92-L95 WeakPolarHBondContact O-CB 3.35Å; E92-L95 PolarHBondContact O-N 3.37Å; E92-L95 VanDerWaalsContact O-N 3.17Å; E92-L96 WeakPolarHBondContact O-CG 3.02Å; E92-L96 PolarHBondContact O-N 3.43Å
93N72.4Confident73.5Confident12 Ų1278.9 Ų78.96%0.06441%0.409CS..Hα-helixtrans-62.2-37.3174.6-117.1-29.6000112.7L89 I90 L95 L96 L97 Y156L89-N93 WeakPolarHBondContact O-CB 3.38Å; L89-N93 PolarHBondContact O-N 2.9Å; I90-N93 PolarHBondContact O-N 3.17Å; N93-L95 VanDerWaalsContact C-N 3.34Å; N93-L96 PolarHBondContact O-N 3.32Å; N93-L97 PolarHBondContact O-N 2.94Å; N93-Y156 WeakPolarHBondContact OD1-CE2 3.38Å
94T71Confident73Confident65 Ų6577.6 Ų77.640%0.39941%0.408SS..Hα-helixtrans-64.5-40.9176-51.50000110.8I90 K91 E92 L96 L97 E98I90-T94 PolarHBondContact O-N 3.45Å; I90-T94 PolarHBondContact O-OG1 2.83Å; K91-T94 WeakPolarHBondContact O-CB 3.4Å; K91-T94 PolarHBondContact O-N 2.84Å; E92-T94 VanDerWaalsContact C-N 3.29Å; E92-T94 PolarHBondContact O-N 3.45Å; T94-L96 VanDerWaalsContact C-N 3.34Å; T94-L96 PolarHBondContact O-N 3.02Å; T94-L97 WeakPolarHBondContact O-CB 3.37Å; T94-L97 PolarHBondContact O-N 3.38Å; T94-E98 WeakPolarHBondContact O-CG 3.27Å; T94-E98 PolarHBondContact O-N 3.04Å
95L75Confident72.2Confident93 Ų9380.7 Ų80.749%0.48741%0.414SS..Hα-helixtrans-64.5-38.1174.6-69.1169.3000112.2K91 E92 N93 E98 L99K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 3.01Å; K91-L95 VanDerWaalsContact O-N 3.1Å; E92-L95 WeakPolarHBondContact O-CB 3.35Å; E92-L95 PolarHBondContact O-N 3.37Å; E92-L95 VanDerWaalsContact O-N 3.17Å; N93-L95 VanDerWaalsContact C-N 3.34Å; L95-E98 PolarHBondContact O-N 3.06Å; L95-L99 WeakPolarHBondContact O-CG 3.48Å; L95-L99 PolarHBondContact O-N 3.25Å; L95-L99 VanDerWaalsContact O-N 3.12Å
96L70.3Confident71.7Confident89 Ų8985 Ų8547%0.46642%0.424SS..Hα-helixtrans-63.8-39.9175.2-69.8173000112.1E92 N93 T94 L99 E100E92-L96 WeakPolarHBondContact O-CG 3.02Å; E92-L96 PolarHBondContact O-N 3.43Å; N93-L96 PolarHBondContact O-N 3.32Å; T94-L96 VanDerWaalsContact C-N 3.34Å; T94-L96 PolarHBondContact O-N 3.02Å; L96-L99 PolarHBondContact O-N 3.4Å; L96-E100 PolarHBondContact O-N 3Å
97L68.8Low71.4Confident64 Ų6485.6 Ų85.634%0.33543%0.427SS..Hα-helixtrans-60.9-44.5172.2-92.2166.3000112.6N93 T94 L99 E100 Y156N93-L97 PolarHBondContact O-N 2.94Å; T94-L97 WeakPolarHBondContact O-CB 3.37Å; T94-L97 PolarHBondContact O-N 3.38Å; L97-L99 PolarHBondContact O-N 3.05Å; L97-E100 VanDerWaalsContact O-CB 3.32Å; L97-E100 WeakPolarHBondContact O-CB 3.38Å; L97-E100 PolarHBondContact O-N 3.37Å; L97-E100 VanDerWaalsContact O-N 3.11Å; L97-Y156 WeakPolarHBondContact CD1-OH 3.49Å; L97-Y156 VanDerWaalsContact CD2-OH 3.31Å; L97-Y156 WeakPolarHBondContact CD2-OH 3.42Å; L97-Y156 WeakPolarHBondContact CG-OH 3.47Å
98E72.7Confident71.1Confident128 Ų12885.5 Ų85.560%0.59843%0.431SS*.Hα-helixtrans-63.3-27.6178.6-73.3178.8177.300112.1T94 L95 P102T94-E98 WeakPolarHBondContact O-CG 3.27Å; T94-E98 PolarHBondContact O-N 3.04Å; L95-E98 PolarHBondContact O-N 3.06Å; E98-P102 WeakPolarHBondContact O-CD 3.43Å; E98-P102 WeakPolarHBondContact O-CG 3.04Å
99L71Confident70.8Confident94 Ų9486 Ų8649%0.49243%0.434SS..Hα-helixtrans-78.6-23.9175-70.3169000113.6L95 L96 L97 G101 P102 I103L95-L99 WeakPolarHBondContact O-CG 3.48Å; L95-L99 PolarHBondContact O-N 3.25Å; L95-L99 VanDerWaalsContact O-N 3.12Å; L96-L99 PolarHBondContact O-N 3.4Å; L97-L99 PolarHBondContact O-N 3.05Å; L99-G101 PolarHBondContact O-N 3.19Å; L99-P102 WeakPolarHBondContact O-CD 3.4Å; L99-I103 HydrophobicContact CB-CD1 4.27Å; L99-I103 WeakPolarHBondContact O-CB 3.42Å; L99-I103 WeakPolarHBondContact O-CD1 3.5Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.93Å
100E68.3Low70.6Confident65 Ų6587.2 Ų87.230%0.30444%0.44SS..Hα-helixtrans-59.4-47.6-179.8-167.6-173.6172.300111.6L96 L97 I103 S104 F153L96-E100 PolarHBondContact O-N 3Å; L97-E100 VanDerWaalsContact O-CB 3.32Å; L97-E100 WeakPolarHBondContact O-CB 3.38Å; L97-E100 PolarHBondContact O-N 3.37Å; L97-E100 VanDerWaalsContact O-N 3.11Å; E100-I103 PolarHBondContact O-N 3.13Å; E100-S104 WeakPolarHBondContact O-CB 3.44Å; E100-S104 PolarHBondContact O-N 2.86Å; E100-F153 WeakPolarHBondContact OE1-CE2 3.39Å
101G67.9Low70.6Confident32 Ų3288 Ų8833%0.3345%0.446SS..Hα-helixtrans-61.7-49.9-17900000114.4L99 R105L99-G101 PolarHBondContact O-N 3.19Å; G101-R105 WeakPolarHBondContact O-CB 3.3Å; G101-R105 WeakPolarHBondContact O-CG 3.18Å; G101-R105 PolarHBondContact O-N 2.81Å
102P69Low70.2Confident64 Ų6483.4 Ų83.442%0.41644%0.435SS..Hα-helixtrans-60.5-42.2173.6-25.633.4000113.5E98 L99 R106E98-P102 WeakPolarHBondContact O-CD 3.43Å; E98-P102 WeakPolarHBondContact O-CG 3.04Å; L99-P102 WeakPolarHBondContact O-CD 3.4Å; P102-R106 WeakPolarHBondContact O-CB 3.46Å; P102-R106 PolarHBondContact O-N 3.36Å
103I67.7Low70Confident79 Ų7982.5 Ų82.541%0.40543%0.431SS..Hα-helixtrans-64.5-48.5178.3-69.2169.5000109.8L99 E100 R105 R106 L107 Y149L99-I103 HydrophobicContact CB-CD1 4.27Å; L99-I103 WeakPolarHBondContact O-CB 3.42Å; L99-I103 WeakPolarHBondContact O-CD1 3.5Å; L99-I103 WeakPolarHBondContact O-CG1 3.47Å; L99-I103 PolarHBondContact O-N 2.93Å; E100-I103 PolarHBondContact O-N 3.13Å; I103-R105 PolarHBondContact O-N 3.4Å; I103-R106 PolarHBondContact O-N 3.47Å; I103-R106 VanDerWaalsContact O-N 3.11Å; I103-L107 PolarHBondContact O-N 3.44Å; I103-Y149 HydrophobicContact CG2-CE2 4.14Å
104S65.6Low69.6Low46 Ų4685 Ų8532%0.32244%0.439SS..Hα-helixtrans-60.8-43.7179.1-159.50000111.8E100 R106 L107 D108E100-S104 WeakPolarHBondContact O-CB 3.44Å; E100-S104 PolarHBondContact O-N 2.86Å; S104-R106 VanDerWaalsContact C-N 3.3Å; S104-R106 PolarHBondContact O-N 3.21Å; S104-L107 VanDerWaalsContact O-CB 3.22Å; S104-L107 WeakPolarHBondContact O-CB 3.4Å; S104-L107 PolarHBondContact O-N 3.48Å; S104-D108 PolarHBondContact O-N 3.05Å
105R65.8Low69.8Low175 Ų17588.8 Ų88.866%0.6645%0.45SS*.Hα-helixtrans-60.6-38.2174.6-83.1-174.9-91.3175.9-9.9112.6G101 I103 L107 D108 C109G101-R105 WeakPolarHBondContact O-CB 3.3Å; G101-R105 WeakPolarHBondContact O-CG 3.18Å; G101-R105 PolarHBondContact O-N 2.81Å; I103-R105 PolarHBondContact O-N 3.4Å; R105-L107 VanDerWaalsContact C-N 3.34Å; R105-D108 PolarHBondContact O-N 3.49Å; R105-C109 PolarHBondContact O-N 3.3Å; R105-C109 PolarHBondContact O-SG 3.22Å
106R67.7Low69.8Low196 Ų19692 Ų9274%0.7446%0.456SS*.Hα-helixtrans-70.2-35178.8-155.3149.6-174.6169.7-1.8111.8P102 I103 S104 C109 L110P102-R106 WeakPolarHBondContact O-CB 3.46Å; P102-R106 PolarHBondContact O-N 3.36Å; I103-R106 PolarHBondContact O-N 3.47Å; I103-R106 VanDerWaalsContact O-N 3.11Å; S104-R106 VanDerWaalsContact C-N 3.3Å; S104-R106 PolarHBondContact O-N 3.21Å; R106-C109 PolarHBondContact O-N 2.92Å; R106-L110 WeakPolarHBondContact O-CB 3.46Å; R106-L110 PolarHBondContact O-N 2.99Å
107L65.8Low69.7Low32 Ų3295.1 Ų95.117%0.16846%0.461CS..Hα-helixtrans-61.4-47.6170.8-122.2163.2000111.5I103 S104 R105 C109 L110 N111 W145 Y149I103-L107 PolarHBondContact O-N 3.44Å; S104-L107 VanDerWaalsContact O-CB 3.22Å; S104-L107 WeakPolarHBondContact O-CB 3.4Å; S104-L107 PolarHBondContact O-N 3.48Å; R105-L107 VanDerWaalsContact C-N 3.34Å; L107-C109 VanDerWaalsContact C-N 3.35Å; L107-C109 PolarHBondContact O-N 3.34Å; L107-L110 PolarHBondContact O-N 3.38Å; L107-N111 WeakPolarHBondContact O-CB 3.38Å; L107-N111 PolarHBondContact O-N 3.29Å; L107-W145 HydrophobicContact CD1-CE3 3.67Å; L107-W145 HydrophobicContact CD1-CH2 4.47Å; L107-W145 HydrophobicContact CD1-CZ3 3.31Å; L107-W145 HydrophobicContact CD2-CE3 3.84Å; L107-W145 HydrophobicContact CD2-CZ3 4.11Å; L107-W145 HydrophobicContact CG-CE3 3.73Å; L107-W145 HydrophobicContact CG-CH2 4.4Å; L107-W145 HydrophobicContact CG-CZ3 3.45Å; L107-W145 VanDerWaalsContact CG-CZ3 3.45Å; L107-Y149 HydrophobicContact CD1-CD2 4.01Å; L107-Y149 HydrophobicContact CD1-CE2 4.14Å
108D71.6Confident69.7Low99 Ų9994.3 Ų94.353%0.52946%0.464SS..Hα-helixtrans-62.4-42.2177.2-70.5-27.2000111.6S104 R105 N111 A112S104-D108 PolarHBondContact O-N 3.05Å; R105-D108 PolarHBondContact O-N 3.49Å; D108-N111 PolarHBondContact O-N 3.19Å; D108-A112 WeakPolarHBondContact O-CB 3.15Å; D108-A112 PolarHBondContact O-N 3.08Å
109C71.6Confident69.7Low86 Ų8693 Ų9358%0.58146%0.458SS*.Hα-helixtrans-61.4-45.6174.7-71.90000112.1R105 R106 L107 A112 E113R105-C109 PolarHBondContact O-N 3.3Å; R105-C109 PolarHBondContact O-SG 3.22Å; R106-C109 PolarHBondContact O-N 2.92Å; L107-C109 VanDerWaalsContact C-N 3.35Å; L107-C109 PolarHBondContact O-N 3.34Å; C109-A112 PolarHBondContact O-N 2.81Å; C109-E113 WeakPolarHBondContact O-CB 3.44Å; C109-E113 PolarHBondContact O-N 3Å
110L69.8Low69.6Low95 Ų9592.7 Ų92.750%0.49746%0.457SS..Hα-helixtrans-61.1-45.1176.8-86.6162.6000111.4R106 L107 E113 R114R106-L110 WeakPolarHBondContact O-CB 3.46Å; R106-L110 PolarHBondContact O-N 2.99Å; L107-L110 PolarHBondContact O-N 3.38Å; L110-E113 PolarHBondContact O-N 3.46Å; L110-R114 WeakPolarHBondContact O-CB 3.41Å; L110-R114 PolarHBondContact O-N 3.29Å
111N71.8Confident69.3Low72 Ų7291.2 Ų91.239%0.38545%0.453SS..Hα-helixtrans-63.4-42177-82-25.6000112.2L107 D108 R114 K115L107-N111 WeakPolarHBondContact O-CB 3.38Å; L107-N111 PolarHBondContact O-N 3.29Å; D108-N111 PolarHBondContact O-N 3.19Å; N111-R114 WeakPolarHBondContact O-CB 3.41Å; N111-R114 PolarHBondContact O-N 2.94Å; N111-K115 WeakPolarHBondContact O-CB 3.38Å; N111-K115 PolarHBondContact O-N 3Å
112A72.5Confident68.9Low51 Ų5199.9 Ų99.942%0.42148%0.476SS..Hα-helixtrans-64.3-41.5176.400000111.9D108 C109 K115 R116D108-A112 WeakPolarHBondContact O-CB 3.15Å; D108-A112 PolarHBondContact O-N 3.08Å; C109-A112 PolarHBondContact O-N 2.81Å; A112-K115 PolarHBondContact O-N 3.28Å; A112-R116 PolarHBondContact O-N 3.31Å
113E72.8Confident68.7Low95 Ų95104.8 Ų104.844%0.44449%0.491SS..Hα-helixtrans-67.2-38.4176.8-155.6-177.4-128.600111.4C109 L110 R116 R117C109-E113 WeakPolarHBondContact O-CB 3.44Å; C109-E113 PolarHBondContact O-N 3Å; L110-E113 PolarHBondContact O-N 3.46Å; E113-R116 WeakPolarHBondContact O-CB 3.5Å; E113-R116 PolarHBondContact O-N 2.92Å; E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 3.05Å; E113-R117 IonicContact OE2-CZ 3.99Å; E113-R117 IonicContact OE2-NH2 2.83Å; E113-R117 PolarHBondContact OE2-NH2 3.42Å
114R65.6Low68.2Low65 Ų65105.2 Ų105.225%0.24550%0.497CS..Hα-helixtrans-59-46.9172.5-129.4178.6-170.61674.8111.9L110 N111 R116 R117 A118 S138 E141L110-R114 WeakPolarHBondContact O-CB 3.41Å; L110-R114 PolarHBondContact O-N 3.29Å; N111-R114 WeakPolarHBondContact O-CB 3.41Å; N111-R114 PolarHBondContact O-N 2.94Å; R114-R116 VanDerWaalsContact C-N 3.29Å; R114-R116 PolarHBondContact O-N 2.92Å; R114-R117 PolarHBondContact O-N 3.24Å; R114-A118 PolarHBondContact O-N 3.18Å; R114-S138 WeakPolarHBondContact CD-OG 3.35Å; R114-S138 PolarHBondContact NE-OG 3.01Å; R114-S138 PolarHBondContact NH1-O 2.95Å; R114-S138 PolarHBondContact NH2-O 2.77Å; R114-E141 IonicContact CZ-OE2 2.77Å; R114-E141 IonicContact NH2-OE2 2.95Å; R114-E141 PolarHBondContact NH2-OE2 3.03Å
115K75.1Confident67.7Low144 Ų144112.8 Ų112.863%0.62653%0.528SS*.Hα-helixtrans-61.3-41177.8-159.9175.3-177.1-179.60110.9N111 A112 A118 E119N111-K115 WeakPolarHBondContact O-CB 3.38Å; N111-K115 PolarHBondContact O-N 3Å; A112-K115 PolarHBondContact O-N 3.28Å; K115-A118 PolarHBondContact O-N 3.09Å; K115-E119 WeakPolarHBondContact O-CG 3.45Å; K115-E119 PolarHBondContact O-N 2.98Å
116R73.3Confident67.3Low161 Ų161106.9 Ų106.961%0.60851%0.513SS*.Hα-helixtrans-62.2-47.4174.7-130-174.4-72.2176.8-3.3112.4A112 E113 R114 A118 E119 D120A112-R116 PolarHBondContact O-N 3.31Å; E113-R116 WeakPolarHBondContact O-CB 3.5Å; E113-R116 PolarHBondContact O-N 2.92Å; R114-R116 VanDerWaalsContact C-N 3.29Å; R114-R116 PolarHBondContact O-N 2.92Å; R116-A118 VanDerWaalsContact C-N 3.33Å; R116-A118 PolarHBondContact O-N 3.36Å; R116-E119 PolarHBondContact O-N 3.4Å; R116-D120 PolarHBondContact O-N 3.34Å
117R69.9Low67.1Low154 Ų154103.2 Ų103.258%0.58151%0.508SS*.Hα-helixtrans-62.5-37.6176.7-69.3-174.4-137.5167.74.2112.6E113 R114 S121E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 3.05Å; E113-R117 IonicContact OE2-CZ 3.99Å; E113-R117 IonicContact OE2-NH2 2.83Å; E113-R117 PolarHBondContact OE2-NH2 3.42Å; R114-R117 PolarHBondContact O-N 3.24Å; R117-S121 WeakPolarHBondContact O-CB 3.37Å; R117-S121 PolarHBondContact O-N 3.1Å
118A68.8Low67Low47 Ų47105.2 Ų105.239%0.38853%0.529SS..Hα-helixtrans-66.5-37.2175.300000112.2R114 K115 R116 R122R114-A118 PolarHBondContact O-N 3.18Å; K115-A118 PolarHBondContact O-N 3.09Å; R116-A118 VanDerWaalsContact C-N 3.33Å; R116-A118 PolarHBondContact O-N 3.36Å; A118-R122 PolarHBondContact O-N 3.03Å
119E72Confident67Low102 Ų102104.9 Ų104.948%0.47753%0.531SS..Hα-helixtrans-70.4-40.1174.5-77.4168.5-175.700112.7K115 R116 R122K115-E119 WeakPolarHBondContact O-CG 3.45Å; K115-E119 PolarHBondContact O-N 2.98Å; R116-E119 PolarHBondContact O-N 3.4Å; E119-R122 WeakPolarHBondContact O-CB 3.44Å; E119-R122 PolarHBondContact O-N 2.88Å
120D68.2Low66.7Low86 Ų86106.1 Ų106.146%0.4653%0.528SS..Hα-helixtrans-69.5-37.9176.2-72.5-27.2000111.6R116 R122 K123R116-D120 PolarHBondContact O-N 3.34Å; D120-R122 VanDerWaalsContact C-N 3.25Å; D120-R122 PolarHBondContact O-N 3.27Å; D120-K123 WeakPolarHBondContact O-CB 3.33Å; D120-K123 PolarHBondContact O-N 2.69Å; D120-K123 IonicContact OD1-NZ 2.72Å
121S62.8Low66.4Low34 Ų34103.7 Ų103.724%0.23851%0.514CS..Hα-helixtrans-54.7-40.3170.1160.20000111.6R117 K123 T124 K131R117-S121 WeakPolarHBondContact O-CB 3.37Å; R117-S121 PolarHBondContact O-N 3.1Å; S121-K123 PolarHBondContact O-N 3.11Å; S121-T124 PolarHBondContact O-N 3.09Å; S121-T124 PolarHBondContact O-OG1 3.06Å; S121-K131 WeakPolarHBondContact O-CE 3.47Å; S121-K131 PolarHBondContact O-NZ 3.33Å; S121-K131 VanDerWaalsContact OG-CD 3.32Å; S121-K131 WeakPolarHBondContact OG-CD 3.4Å; S121-K131 WeakPolarHBondContact OG-CG 3.45Å
122R58.8Low66.3Low215 Ų215105.3 Ų105.381%0.81152%0.522SS*.Hα-helixtrans-58.9-28.1175.8-93.4-176.6-178.9-173.81.3113.7A118 E119 D120A118-R122 PolarHBondContact O-N 3.03Å; E119-R122 WeakPolarHBondContact O-CB 3.44Å; E119-R122 PolarHBondContact O-N 2.88Å; D120-R122 VanDerWaalsContact C-N 3.25Å; D120-R122 PolarHBondContact O-N 3.27Å
123K64.8Low66.2Low167 Ų167108.7 Ų108.773%0.72653%0.532SS*.Hα-helixtrans-83.4-20-176.6-65.5175.8-175.7162.60114.4D120 S121D120-K123 WeakPolarHBondContact O-CB 3.33Å; D120-K123 PolarHBondContact O-N 2.69Å; D120-K123 IonicContact OD1-NZ 2.72Å; S121-K123 PolarHBondContact O-N 3.11Å
124T58.2Low66.2Low87 Ų87109.1 Ų109.153%0.53454%0.537SS..SBendtrans-99.2125.8178.5440000110.9S121 S126 K131S121-T124 PolarHBondContact O-N 3.09Å; S121-T124 PolarHBondContact O-OG1 3.06Å; T124-S126 PolarHBondContact O-N 2.84Å; T124-K131 WeakPolarHBondContact O-CE 3.35Å; T124-K131 PolarHBondContact O-NZ 2.96Å
125E55.4Low66.5Low206 Ų206112.3 Ų112.396%0.96355%0.55SS*.  trans-70.453.4-179.6-67.6-177.615900114.1
126S55.6Low66.3Low50 Ų50113.8 Ų113.835%0.3555%0.552SS.*  trans-85.2147.5163.7139.40000110.5T124 A128 E130 K131T124-S126 PolarHBondContact O-N 2.84Å; S126-A128 PolarHBondContact O-N 3.25Å; S126-E130 PolarHBondContact OG-OE2 3.46Å; S126-K131 VanDerWaalsContact O-CE 3.26Å; S126-K131 WeakPolarHBondContact O-CE 3.5Å
127N64Low66.4Low119 Ų119111.6 Ų111.664%0.63655%0.548SS*.  trans-45.8123.7-170-147-3.9000112.1T129 E130 K131N127-T129 PolarHBondContact O-N 3.08Å; N127-E130 PolarHBondContact O-N 3.2Å; N127-K131 PolarHBondContact O-N 2.99Å
128A64.9Low66.2Low74 Ų74105.8 Ų105.861%0.61253%0.532SS*.Hα-helixtrans-54.9-28.9-170.100000114S126 L132S126-A128 PolarHBondContact O-N 3.25Å; A128-L132 PolarHBondContact O-N 3.23Å; A128-L132 VanDerWaalsContact O-N 3.11Å
129T70.2Confident66.2Low92 Ų92108 Ų10856%0.56453%0.534SS*.Hα-helixtrans-65.9-39.4175.316.90000113.6N127 L132 L133N127-T129 PolarHBondContact O-N 3.08Å; T129-L132 PolarHBondContact O-N 3.23Å; T129-L133 PolarHBondContact O-N 3Å
130E67.1Low66Low113 Ų113110.6 Ų110.653%0.52854%0.54SS..Hα-helixtrans-70.7-38.9-179.6-165.7175.7-151.300111S126 N127 L132 L133 L134S126-E130 PolarHBondContact OG-OE2 3.46Å; N127-E130 PolarHBondContact O-N 3.2Å; E130-L132 VanDerWaalsContact C-N 3.34Å; E130-L132 PolarHBondContact O-N 3.23Å; E130-L133 PolarHBondContact O-N 2.95Å; E130-L134 WeakPolarHBondContact O-CG 3.46Å; E130-L134 PolarHBondContact O-N 3.17Å
131K63.5Low66.1Low43 Ų43110.8 Ų110.819%0.18754%0.538CS..Hα-helixtrans-63.8-39.2172.2-63.6-173.5-172.8173.70112.6S121 T124 S126 N127 Y135S121-K131 WeakPolarHBondContact O-CE 3.47Å; S121-K131 PolarHBondContact O-NZ 3.33Å; S121-K131 VanDerWaalsContact OG-CD 3.32Å; S121-K131 WeakPolarHBondContact OG-CD 3.4Å; S121-K131 WeakPolarHBondContact OG-CG 3.45Å; T124-K131 WeakPolarHBondContact O-CE 3.35Å; T124-K131 PolarHBondContact O-NZ 2.96Å; S126-K131 VanDerWaalsContact O-CE 3.26Å; S126-K131 WeakPolarHBondContact O-CE 3.5Å; N127-K131 PolarHBondContact O-N 2.99Å; K131-Y135 WeakPolarHBondContact O-CB 3.42Å; K131-Y135 PolarHBondContact O-N 3.41Å
132L67.9Low66Low106 Ų106110.4 Ų110.456%0.55554%0.537SS*.Hα-helixtrans-65.4-45.9177-139.7106000110.1A128 T129 E130 L134 Y135 W136A128-L132 PolarHBondContact O-N 3.23Å; A128-L132 VanDerWaalsContact O-N 3.11Å; T129-L132 PolarHBondContact O-N 3.23Å; E130-L132 VanDerWaalsContact C-N 3.34Å; E130-L132 PolarHBondContact O-N 3.23Å; L132-L134 PolarHBondContact O-N 2.82Å; L132-Y135 WeakPolarHBondContact O-CB 3.5Å; L132-Y135 PolarHBondContact O-N 3.07Å; L132-W136 PolarHBondContact O-N 2.62Å
133L71.8Confident66.4Low122 Ų122105.4 Ų105.464%0.63953%0.526SS*.Hα-helixtrans-60.5-45.7177.4-80.1163.3000112.4T129 E130 Y135 W136 Q137T129-L133 PolarHBondContact O-N 3Å; E130-L133 PolarHBondContact O-N 2.95Å; L133-Y135 VanDerWaalsContact C-N 3.32Å; L133-Y135 PolarHBondContact O-N 3.37Å; L133-W136 PolarHBondContact O-N 3.09Å; L133-Q137 WeakPolarHBondContact O-CB 3.39Å; L133-Q137 PolarHBondContact O-N 3.49Å
134L71.9Confident66.6Low105 Ų105102 Ų10255%0.5551%0.513SS..Hα-helixtrans-62.1-38.7174.9-76.7167.7000112.3E130 L132 S138E130-L134 WeakPolarHBondContact O-CG 3.46Å; E130-L134 PolarHBondContact O-N 3.17Å; L132-L134 PolarHBondContact O-N 2.82Å; L134-S138 WeakPolarHBondContact O-CB 3.35Å; L134-S138 PolarHBondContact O-N 3.01Å
135Y72.3Confident66.8Low131 Ų131103.9 Ų103.951%0.51451%0.51SS..Hα-helixtrans-63.1-48175177.4-93.5000111.7K131 L132 L133 S138 H139K131-Y135 WeakPolarHBondContact O-CB 3.42Å; K131-Y135 PolarHBondContact O-N 3.41Å; L132-Y135 WeakPolarHBondContact O-CB 3.5Å; L132-Y135 PolarHBondContact O-N 3.07Å; L133-Y135 VanDerWaalsContact C-N 3.32Å; L133-Y135 PolarHBondContact O-N 3.37Å; Y135-S138 WeakPolarHBondContact O-CB 3.44Å; Y135-S138 PolarHBondContact O-N 3.31Å; Y135-H139 AromaticContact CE1-CD2 4Å; Y135-H139 AromaticContact CZ-CD2 3.84Å; Y135-H139 WeakPolarHBondContact O-CB 3.29Å; Y135-H139 PolarHBondContact O-N 2.88Å
136W70.9Confident67.3Low175 Ų17598.4 Ų98.466%0.66349%0.491SS*.Hα-helixtrans-66.9-42.6-179.5-83.482000112.3L132 L133 S138 H139 Y140L132-W136 PolarHBondContact O-N 2.62Å; L133-W136 PolarHBondContact O-N 3.09Å; W136-S138 VanDerWaalsContact C-N 3.35Å; W136-H139 PolarHBondContact O-N 3.21Å; W136-Y140 WeakPolarHBondContact O-CB 3.5Å; W136-Y140 PolarHBondContact O-N 3.35Å
137Q76.4Confident67.9Low115 Ų115105.4 Ų105.454%0.53751%0.51SS..Hα-helixtrans-62-44.3174.7-174.5174.6-5.500111.2L133 H139 Y140 E141L133-Q137 WeakPolarHBondContact O-CB 3.39Å; L133-Q137 PolarHBondContact O-N 3.49Å; Q137-H139 VanDerWaalsContact C-N 3.32Å; Q137-H139 PolarHBondContact O-N 3.49Å; Q137-Y140 PolarHBondContact O-N 3.49Å; Q137-E141 PolarHBondContact O-N 3.26Å
138S65.7Low68Low33 Ų33105.6 Ų105.623%0.23151%0.506CS..Hα-helixtrans-57.8-44.9173.4155.80000112.3R114 L134 Y135 W136 Y140 A142R114-S138 WeakPolarHBondContact CD-OG 3.35Å; R114-S138 PolarHBondContact NE-OG 3.01Å; R114-S138 PolarHBondContact NH1-O 2.95Å; R114-S138 PolarHBondContact NH2-O 2.77Å; L134-S138 WeakPolarHBondContact O-CB 3.35Å; L134-S138 PolarHBondContact O-N 3.01Å; Y135-S138 WeakPolarHBondContact O-CB 3.44Å; Y135-S138 PolarHBondContact O-N 3.31Å; W136-S138 VanDerWaalsContact C-N 3.35Å; S138-Y140 VanDerWaalsContact C-N 3.32Å; S138-Y140 PolarHBondContact O-N 3.38Å; S138-A142 WeakPolarHBondContact O-CB 3.48Å; S138-A142 PolarHBondContact O-N 3.39Å
139H68.5Low68Low93 Ų93105.2 Ų105.243%0.43149%0.49SS..Hα-helixtrans-67.9-34.2-179.1-151.9-56.3000111.9Y135 W136 Q137 L143Y135-H139 AromaticContact CE1-CD2 4Å; Y135-H139 AromaticContact CZ-CD2 3.84Å; Y135-H139 WeakPolarHBondContact O-CB 3.29Å; Y135-H139 PolarHBondContact O-N 2.88Å; W136-H139 PolarHBondContact O-N 3.21Å; Q137-H139 VanDerWaalsContact C-N 3.32Å; Q137-H139 PolarHBondContact O-N 3.49Å; H139-L143 WeakPolarHBondContact O-CB 3.37Å; H139-L143 PolarHBondContact O-N 2.94Å; H139-L143 VanDerWaalsContact O-N 3.1Å
140Y67.2Low68.1Low156 Ų156107 Ų10761%0.61249%0.49SS*.Hα-helixtrans-67.6-50175.4-155.8-85.3000111.1W136 Q137 S138 A142 L143 E144W136-Y140 WeakPolarHBondContact O-CB 3.5Å; W136-Y140 PolarHBondContact O-N 3.35Å; Q137-Y140 PolarHBondContact O-N 3.49Å; S138-Y140 VanDerWaalsContact C-N 3.32Å; S138-Y140 PolarHBondContact O-N 3.38Å; Y140-A142 VanDerWaalsContact C-N 3.28Å; Y140-A142 PolarHBondContact O-N 3.19Å; Y140-L143 WeakPolarHBondContact O-CB 3.43Å; Y140-L143 PolarHBondContact O-N 3.1Å; Y140-E144 WeakPolarHBondContact CE1-OE2 3.41Å; Y140-E144 WeakPolarHBondContact O-CB 3.5Å; Y140-E144 PolarHBondContact O-N 3.38Å
141E69.7Low68.2Low91 Ų91105.2 Ų105.243%0.42549%0.489SS..Hα-helixtrans-59.8-37.6177.1-76.4174.2-164.800112.1R114 Q137 W145R114-E141 IonicContact CZ-OE2 2.77Å; R114-E141 IonicContact NH2-OE2 2.95Å; R114-E141 PolarHBondContact NH2-OE2 3.03Å; Q137-E141 PolarHBondContact O-N 3.26Å; E141-W145 WeakPolarHBondContact O-CB 3.42Å; E141-W145 PolarHBondContact O-N 3.25Å
142A61.7Low68.2Low26 Ų26105.9 Ų105.922%0.21550%0.503CS..Hα-helixtrans-63.9-44.1173.700000112S138 Y140 E144 W145 T146S138-A142 WeakPolarHBondContact O-CB 3.48Å; S138-A142 PolarHBondContact O-N 3.39Å; Y140-A142 VanDerWaalsContact C-N 3.28Å; Y140-A142 PolarHBondContact O-N 3.19Å; A142-E144 VanDerWaalsContact C-N 3.34Å; A142-W145 PolarHBondContact O-N 3.13Å; A142-T146 WeakPolarHBondContact O-CB 3.45Å; A142-T146 PolarHBondContact O-N 3.36Å; A142-T146 PolarHBondContact O-OG1 2.93Å
143L66.8Low68.3Low109 Ų109104.9 Ų104.957%0.57150%0.495SS*.Hα-helixtrans-62.6-41.8177.5-115.9149.6000111.9H139 Y140 T146 R147H139-L143 WeakPolarHBondContact O-CB 3.37Å; H139-L143 PolarHBondContact O-N 2.94Å; H139-L143 VanDerWaalsContact O-N 3.1Å; Y140-L143 WeakPolarHBondContact O-CB 3.43Å; Y140-L143 PolarHBondContact O-N 3.1Å; L143-T146 PolarHBondContact O-N 3.16Å; L143-R147 WeakPolarHBondContact O-CB 3.47Å; L143-R147 PolarHBondContact O-N 3.5Å
144E68.8Low68.4Low96 Ų96104 Ų10445%0.44949%0.487SS..Hα-helixtrans-66.1-44.7178.6-155147.9-147.700110.8Y140 A142 T146 R147 E148Y140-E144 WeakPolarHBondContact CE1-OE2 3.41Å; Y140-E144 WeakPolarHBondContact O-CB 3.5Å; Y140-E144 PolarHBondContact O-N 3.38Å; A142-E144 VanDerWaalsContact C-N 3.34Å; E144-T146 VanDerWaalsContact C-N 3.33Å; E144-T146 PolarHBondContact O-N 3.15Å; E144-R147 WeakPolarHBondContact O-CB 3.45Å; E144-R147 PolarHBondContact O-N 3.4Å; E144-E148 WeakPolarHBondContact O-CG 3.4Å; E144-E148 PolarHBondContact O-N 2.69Å
145W63.6Low68.4Low127 Ų127105.5 Ų105.548%0.48149%0.493SS..Hα-helixtrans-60.7-39.5172.4-119.973.2000113.1L107 E141 A142 R147 E148 Y149L107-W145 HydrophobicContact CD1-CE3 3.67Å; L107-W145 HydrophobicContact CD1-CH2 4.47Å; L107-W145 HydrophobicContact CD1-CZ3 3.31Å; L107-W145 HydrophobicContact CD2-CE3 3.84Å; L107-W145 HydrophobicContact CD2-CZ3 4.11Å; L107-W145 HydrophobicContact CG-CE3 3.73Å; L107-W145 HydrophobicContact CG-CH2 4.4Å; L107-W145 HydrophobicContact CG-CZ3 3.45Å; L107-W145 VanDerWaalsContact CG-CZ3 3.45Å; E141-W145 WeakPolarHBondContact O-CB 3.42Å; E141-W145 PolarHBondContact O-N 3.25Å; A142-W145 PolarHBondContact O-N 3.13Å; W145-R147 VanDerWaalsContact C-N 3.3Å; W145-R147 PolarHBondContact O-N 2.88Å; W145-E148 PolarHBondContact O-N 3.11Å; W145-Y149 WeakPolarHBondContact O-CB 3.43Å; W145-Y149 PolarHBondContact O-N 3.37Å
146T65.8Low68.3Low91 Ų91101.5 Ų101.556%0.55848%0.477SS*.Hα-helixtrans-69.4-33.8-179.7-43.30000110.7A142 L143 E144 K150A142-T146 WeakPolarHBondContact O-CB 3.45Å; A142-T146 PolarHBondContact O-N 3.36Å; A142-T146 PolarHBondContact O-OG1 2.93Å; L143-T146 PolarHBondContact O-N 3.16Å; E144-T146 VanDerWaalsContact C-N 3.33Å; E144-T146 PolarHBondContact O-N 3.15Å; T146-K150 VanDerWaalsContact O-CB 3.29Å; T146-K150 WeakPolarHBondContact O-CB 3.47Å; T146-K150 PolarHBondContact O-N 2.97Å
147R67.5Low68.4Low197 Ų19797.6 Ų97.674%0.74347%0.466SS*.Hα-helixtrans-68.3-44.9174.1-174-176.8134.3166.1-3.6111.6L143 E144 W145 K150 S151L143-R147 WeakPolarHBondContact O-CB 3.47Å; L143-R147 PolarHBondContact O-N 3.5Å; E144-R147 WeakPolarHBondContact O-CB 3.45Å; E144-R147 PolarHBondContact O-N 3.4Å; W145-R147 VanDerWaalsContact C-N 3.3Å; W145-R147 PolarHBondContact O-N 2.88Å; R147-K150 PolarHBondContact O-N 3.11Å; R147-S151 PolarHBondContact O-N 3.35Å
148E65.4Low68.2Low122 Ų12296.9 Ų96.957%0.5747%0.466SS*.Hα-helixtrans-62.2-44.3174.9-71-179176.200111.4E144 W145 S151 A152E144-E148 WeakPolarHBondContact O-CG 3.4Å; E144-E148 PolarHBondContact O-N 2.69Å; W145-E148 PolarHBondContact O-N 3.11Å; E148-S151 WeakPolarHBondContact O-CB 3.44Å; E148-S151 PolarHBondContact O-N 3.26Å; E148-A152 PolarHBondContact O-N 3.01Å
149Y65.1Low68.5Low67 Ų6798.2 Ų98.226%0.26347%0.473SS..Hα-helixtrans-63.4-43.5177.3-164.4-89.9000112.1I103 L107 W145 S151 A152 F153I103-Y149 HydrophobicContact CG2-CE2 4.14Å; L107-Y149 HydrophobicContact CD1-CD2 4.01Å; L107-Y149 HydrophobicContact CD1-CE2 4.14Å; W145-Y149 WeakPolarHBondContact O-CB 3.43Å; W145-Y149 PolarHBondContact O-N 3.37Å; Y149-S151 VanDerWaalsContact C-N 3.33Å; Y149-S151 PolarHBondContact O-N 3.48Å; Y149-A152 PolarHBondContact O-N 2.86Å; Y149-F153 HydrophobicContact CE1-CD2 4.46Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 3.42Å
150K73.2Confident68.7Low130 Ų13098.1 Ų98.157%0.56547%0.469SS*.Hα-helixtrans-61-42.6175.5-176.3175.3175.8179.90111.5T146 R147 F153 E154T146-K150 VanDerWaalsContact O-CB 3.29Å; T146-K150 WeakPolarHBondContact O-CB 3.47Å; T146-K150 PolarHBondContact O-N 2.97Å; R147-K150 PolarHBondContact O-N 3.11Å; K150-F153 PolarHBondContact O-N 2.9Å; K150-E154 WeakPolarHBondContact CE-OE1 3.23Å; K150-E154 IonicContact NZ-OE1 2.93Å; K150-E154 WeakPolarHBondContact O-CB 3.28Å; K150-E154 WeakPolarHBondContact O-CG 3.41Å; K150-E154 PolarHBondContact O-N 3.42Å
151S68.1Low69.4Low74 Ų7496.5 Ų96.552%0.51747%0.465SS..Hα-helixtrans-62.8-42.9176.1-171.80000111.8R147 E148 Y149 M155R147-S151 PolarHBondContact O-N 3.35Å; E148-S151 WeakPolarHBondContact O-CB 3.44Å; E148-S151 PolarHBondContact O-N 3.26Å; Y149-S151 VanDerWaalsContact C-N 3.33Å; Y149-S151 PolarHBondContact O-N 3.48Å; S151-M155 WeakPolarHBondContact O-CB 3.45Å; S151-M155 PolarHBondContact O-N 3.14Å
152A63.6Low69.7Low58 Ų5897.6 Ų97.648%0.47947%0.47SS..Hα-helixtrans-65.6-39.6176.900000111.8E148 Y149 M155 Y156E148-A152 PolarHBondContact O-N 3.01Å; Y149-A152 PolarHBondContact O-N 2.86Å; A152-M155 PolarHBondContact O-N 3.21Å; A152-Y156 WeakPolarHBondContact O-CB 3.5Å; A152-Y156 PolarHBondContact O-N 3.02Å
153F69.8Low70.3Confident85 Ų8597 Ų9737%0.37346%0.463SS..Hα-helixtrans-68.1-41.9178.5-165.9-92.1000112.5E100 Y149 K150 M155 Y156 H157E100-F153 WeakPolarHBondContact OE1-CE2 3.39Å; Y149-F153 HydrophobicContact CE1-CD2 4.46Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 3.42Å; K150-F153 PolarHBondContact O-N 2.9Å; F153-M155 VanDerWaalsContact C-N 3.32Å; F153-Y156 PolarHBondContact O-N 3.35Å; F153-H157 WeakPolarHBondContact O-CB 3.44Å; F153-H157 PolarHBondContact O-N 3.44Å
154E74.2Confident70.8Confident103 Ų10395.7 Ų95.748%0.48146%0.457SS..Hα-helixtrans-63.4-39.8173.4-75.9176.1-177.500111.4K150 H157 N158K150-E154 WeakPolarHBondContact CE-OE1 3.23Å; K150-E154 IonicContact NZ-OE1 2.93Å; K150-E154 WeakPolarHBondContact O-CB 3.28Å; K150-E154 WeakPolarHBondContact O-CG 3.41Å; K150-E154 PolarHBondContact O-N 3.42Å; E154-H157 PolarHBondContact O-N 3.18Å; E154-N158 PolarHBondContact O-N 2.96Å; E154-N158 PolarHBondContact O-ND2 3.49Å
155M72.7Confident71.4Confident137 Ų13797.6 Ų97.668%0.67547%0.466SS*.Hα-helixtrans-63.8-45.5175.6-152.8176.5-148.500111.2S151 A152 F153 H157 N158 V159S151-M155 WeakPolarHBondContact O-CB 3.45Å; S151-M155 PolarHBondContact O-N 3.14Å; A152-M155 PolarHBondContact O-N 3.21Å; F153-M155 VanDerWaalsContact C-N 3.32Å; M155-H157 PolarHBondContact O-N 3.24Å; M155-N158 PolarHBondContact O-N 2.91Å; M155-V159 WeakPolarHBondContact O-CG2 3.49Å; M155-V159 PolarHBondContact O-N 3.34Å
156Y70.3Confident71.8Confident47 Ų4794.6 Ų94.618%0.18446%0.459CS..Hα-helixtrans-58.8-45.6174.5169.4-100.6000112N93 L97 A152 F153 N158 V159 R160N93-Y156 WeakPolarHBondContact OD1-CE2 3.38Å; L97-Y156 WeakPolarHBondContact CD1-OH 3.49Å; L97-Y156 VanDerWaalsContact CD2-OH 3.31Å; L97-Y156 WeakPolarHBondContact CD2-OH 3.42Å; L97-Y156 WeakPolarHBondContact CG-OH 3.47Å; A152-Y156 WeakPolarHBondContact O-CB 3.5Å; A152-Y156 PolarHBondContact O-N 3.02Å; F153-Y156 PolarHBondContact O-N 3.35Å; Y156-N158 VanDerWaalsContact C-N 3.29Å; Y156-N158 PolarHBondContact O-N 3.13Å; Y156-V159 PolarHBondContact O-N 2.91Å; Y156-R160 WeakPolarHBondContact O-CB 3.45Å; Y156-R160 PolarHBondContact O-N 3.25Å; Y156-R160 PolarHBondContact OH-NH1 3.23Å
157H71.6Confident72.2Confident93 Ų9394.3 Ų94.343%0.43145%0.451SS..Hα-helixtrans-66.6-32.2-179.5-156.9-42.9000112.5F153 E154 M155 K161F153-H157 WeakPolarHBondContact O-CB 3.44Å; F153-H157 PolarHBondContact O-N 3.44Å; E154-H157 PolarHBondContact O-N 3.18Å; M155-H157 PolarHBondContact O-N 3.24Å; H157-K161 PolarHBondContact O-N 2.91Å
158N73.4Confident72.8Confident99 Ų9992 Ų9253%0.52945%0.446SS..Hα-helixtrans-69.8-45172.6-75.7-21.4000111.7E154 M155 Y156 R160 K161 E162E154-N158 PolarHBondContact O-N 2.96Å; E154-N158 PolarHBondContact O-ND2 3.49Å; M155-N158 PolarHBondContact O-N 2.91Å; Y156-N158 VanDerWaalsContact C-N 3.29Å; Y156-N158 PolarHBondContact O-N 3.13Å; N158-R160 VanDerWaalsContact C-N 3.27Å; N158-R160 PolarHBondContact O-N 3.44Å; N158-K161 PolarHBondContact O-N 3.04Å; N158-E162 PolarHBondContact O-N 3.16Å
159V71.2Confident73.3Confident62 Ų6290.1 Ų90.138%0.37644%0.443SS..Hα-helixtrans-60.4-38.9175.1172.70000110.9M155 Y156 K161 E162 V163M155-V159 WeakPolarHBondContact O-CG2 3.49Å; M155-V159 PolarHBondContact O-N 3.34Å; Y156-V159 PolarHBondContact O-N 2.91Å; V159-K161 PolarHBondContact O-N 3.16Å; V159-E162 PolarHBondContact O-N 3.14Å; V159-V163 HydrophobicContact CG1-CG2 4.46Å; V159-V163 WeakPolarHBondContact O-CG2 3.38Å; V159-V163 PolarHBondContact O-N 3.2Å
160R73.8Confident73.6Confident91 Ų9188.4 Ų88.434%0.34344%0.439SS..Hα-helixtrans-58.9-46.8175-16979.6-176.7-148.35.6112Y156 N158 E162 V163 D164Y156-R160 WeakPolarHBondContact O-CB 3.45Å; Y156-R160 PolarHBondContact O-N 3.25Å; Y156-R160 PolarHBondContact OH-NH1 3.23Å; N158-R160 VanDerWaalsContact C-N 3.27Å; N158-R160 PolarHBondContact O-N 3.44Å; R160-E162 VanDerWaalsContact C-N 3.34Å; R160-E162 PolarHBondContact O-N 2.84Å; R160-V163 PolarHBondContact O-N 3.36Å; R160-D164 PolarHBondContact O-N 2.97Å
161K80.2Confident73.6Confident122 Ų12284.9 Ų84.953%0.5343%0.434SS..Hα-helixtrans-61.6-42.4176.6-79.6-176.7176.1179.30112.2H157 N158 V159 V163 D164 E165H157-K161 PolarHBondContact O-N 2.91Å; N158-K161 PolarHBondContact O-N 3.04Å; V159-K161 PolarHBondContact O-N 3.16Å; K161-V163 VanDerWaalsContact C-N 3.3Å; K161-V163 PolarHBondContact O-N 2.98Å; K161-D164 PolarHBondContact O-N 2.76Å; K161-E165 PolarHBondContact O-N 2.94Å
162E76.7Confident73.8Confident113 Ų11385.9 Ų85.953%0.52843%0.434SS..Hα-helixtrans-62.5-39.5176.1-70.2-177.1179.100111.4N158 V159 R160 E165 I166N158-E162 PolarHBondContact O-N 3.16Å; V159-E162 PolarHBondContact O-N 3.14Å; R160-E162 VanDerWaalsContact C-N 3.34Å; R160-E162 PolarHBondContact O-N 2.84Å; E162-E165 PolarHBondContact O-N 3.04Å; E162-I166 WeakPolarHBondContact O-CB 3.41Å; E162-I166 WeakPolarHBondContact O-CD1 3.44Å; E162-I166 WeakPolarHBondContact O-CG1 3.5Å; E162-I166 PolarHBondContact O-N 3.39Å
163V74.4Confident74Confident14 Ų1485.2 Ų85.29%0.08542%0.422CS..Hα-helixtrans-65.9-43.7176.1170.50000111.9I90 V159 R160 K161 E165 I166 E167I90-V163 HydrophobicContact CG1-CG1 4.11Å; V159-V163 HydrophobicContact CG1-CG2 4.46Å; V159-V163 WeakPolarHBondContact O-CG2 3.38Å; V159-V163 PolarHBondContact O-N 3.2Å; R160-V163 PolarHBondContact O-N 3.36Å; K161-V163 VanDerWaalsContact C-N 3.3Å; K161-V163 PolarHBondContact O-N 2.98Å; V163-E165 VanDerWaalsContact C-N 3.3Å; V163-E165 PolarHBondContact O-N 3.32Å; V163-I166 CarbonylContact O-C 3.56Å; V163-I166 PolarHBondContact O-N 3.44Å; V163-I166 VanDerWaalsContact O-N 3.13Å; V163-E167 HydrophobicContact CG1-CG 4.5Å; V163-E167 PolarHBondContact O-N 2.88Å
164D77.6Confident73.9Confident81 Ų8182.5 Ų82.543%0.43342%0.418SS..Hα-helixtrans-62.2-38.3177.6-66.2-16.1000111.5R160 K161 K168R160-D164 PolarHBondContact O-N 2.97Å; K161-D164 PolarHBondContact O-N 2.76Å; D164-K168 PolarHBondContact O-N 2.84Å
165E80.4Confident73.6Confident137 Ų13783.1 Ų83.164%0.6442%0.424SS*.Hα-helixtrans-64.9-40.6173.5-75.7-178.6179.900111.9K161 E162 V163 K168 V169K161-E165 PolarHBondContact O-N 2.94Å; E162-E165 PolarHBondContact O-N 3.04Å; V163-E165 VanDerWaalsContact C-N 3.3Å; V163-E165 PolarHBondContact O-N 3.32Å; E165-K168 WeakPolarHBondContact O-CB 3.3Å; E165-K168 PolarHBondContact O-N 3.21Å; E165-V169 WeakPolarHBondContact O-CG2 3.39Å; E165-V169 PolarHBondContact O-N 3.37Å; E165-V169 VanDerWaalsContact O-N 3.09Å
166I73.1Confident73.3Confident64 Ų6479.3 Ų79.333%0.32841%0.412SS..Hα-helixtrans-68.4-41178.4-73.3167.2000111.6I86 E162 V163 K168 V169 V170I86-I166 HydrophobicContact CB-CG2 4.31Å; I86-I166 HydrophobicContact CD1-CG2 3.19Å; I86-I166 HydrophobicContact CG1-CG2 3.39Å; I86-I166 HydrophobicContact CG2-CG2 3.99Å; E162-I166 WeakPolarHBondContact O-CB 3.41Å; E162-I166 WeakPolarHBondContact O-CD1 3.44Å; E162-I166 WeakPolarHBondContact O-CG1 3.5Å; E162-I166 PolarHBondContact O-N 3.39Å; V163-I166 CarbonylContact O-C 3.56Å; V163-I166 PolarHBondContact O-N 3.44Å; V163-I166 VanDerWaalsContact O-N 3.13Å; I166-K168 PolarHBondContact O-N 2.98Å; I166-V169 PolarHBondContact O-N 3.08Å; I166-V170 WeakPolarHBondContact O-CG2 3.49Å; I166-V170 PolarHBondContact O-N 3.38Å
167E74Confident73Confident84 Ų8478.5 Ų78.539%0.39341%0.411SS..Hα-helixtrans-57.6-40.4173.5-82-172166.500111.2I90 V163 V170 A171I90-E167 HydrophobicContact CD1-CG 3.94Å; I90-E167 WeakPolarHBondContact CD1-OE1 3.45Å; I90-E167 HydrophobicContact CG1-CG 4.5Å; I90-E167 WeakPolarHBondContact CG1-OE1 3.41Å; V163-E167 HydrophobicContact CG1-CG 4.5Å; V163-E167 PolarHBondContact O-N 2.88Å; E167-V170 PolarHBondContact O-N 3.47Å; E167-A171 PolarHBondContact O-N 2.92Å
168K80.9Confident72.7Confident149 Ų14979.2 Ų79.265%0.64842%0.418SS*.Hα-helixtrans-64.4-43.3176.3-155.4177.4-175.5-179.10112.1D164 E165 I166 V170 A171 D172D164-K168 PolarHBondContact O-N 2.84Å; E165-K168 WeakPolarHBondContact O-CB 3.3Å; E165-K168 PolarHBondContact O-N 3.21Å; I166-K168 PolarHBondContact O-N 2.98Å; K168-V170 VanDerWaalsContact C-N 3.28Å; K168-V170 PolarHBondContact O-N 3.39Å; K168-A171 PolarHBondContact O-N 3.3Å; K168-D172 PolarHBondContact O-N 3.48Å; K168-D172 VanDerWaalsContact O-N 3.08Å
169V74.8Confident72.3Confident82 Ų8277.3 Ų77.350%0.49741%0.413SS..Hα-helixtrans-62.5-35.6174.8171.20000111.6E165 I166 L173E165-V169 WeakPolarHBondContact O-CG2 3.39Å; E165-V169 PolarHBondContact O-N 3.37Å; E165-V169 VanDerWaalsContact O-N 3.09Å; I166-V169 PolarHBondContact O-N 3.08Å; V169-L173 HydrophobicContact CG1-CD1 3.83Å; V169-L173 WeakPolarHBondContact O-CB 3.24Å; V169-L173 WeakPolarHBondContact O-CD1 3.42Å; V169-L173 WeakPolarHBondContact O-CG 3.27Å; V169-L173 PolarHBondContact O-N 3.49Å
170V72.4Confident71.9Confident31 Ų3177 Ų7719%0.18841%0.409CS..Hα-helixtrans-67-41.4174.9170.50000112.1Q83 I86 I166 E167 K168 L173 G174Q83-V170 HydrophobicContact CG-CG1 4.08Å; I86-V170 HydrophobicContact CB-CG2 4.36Å; I86-V170 HydrophobicContact CD1-CG2 3.07Å; I86-V170 HydrophobicContact CG1-CG2 4.25Å; I86-V170 HydrophobicContact CG2-CG2 4.2Å; I166-V170 WeakPolarHBondContact O-CG2 3.49Å; I166-V170 PolarHBondContact O-N 3.38Å; E167-V170 PolarHBondContact O-N 3.47Å; K168-V170 VanDerWaalsContact C-N 3.28Å; K168-V170 PolarHBondContact O-N 3.39Å; V170-L173 WeakPolarHBondContact O-CB 3.45Å; V170-L173 PolarHBondContact O-N 3.22Å; V170-G174 PolarHBondContact O-N 3.22Å
171A72.5Confident71.6Confident56 Ų5675.4 Ų75.446%0.46341%0.407SS..Hα-helixtrans-60-48.6175.900000110.7E167 K168 L173 G174 D175E167-A171 PolarHBondContact O-N 2.92Å; K168-A171 PolarHBondContact O-N 3.3Å; A171-L173 PolarHBondContact O-N 2.99Å; A171-G174 WeakPolarHBondContact O-CA 3.28Å; A171-G174 PolarHBondContact O-N 2.91Å; A171-D175 PolarHBondContact O-N 2.84Å; A171-D175 VanDerWaalsContact O-N 3.11Å
172D73Confident71Confident95 Ų9576.1 Ų76.151%0.50841%0.412SS..Hα-helixtrans-60.8-33.3177-66-16.2000112.2K168 S176K168-D172 PolarHBondContact O-N 3.48Å; K168-D172 VanDerWaalsContact O-N 3.08Å; D172-S176 PolarHBondContact O-N 3.34Å; D172-S176 VanDerWaalsContact O-N 3.13Å; D172-S176 PolarHBondContact O-OG 2.96Å
173L67.9Low70.4Confident45 Ų4575.4 Ų75.424%0.23641%0.411CS..Hα-helixtrans-72.9-35.7175.1-87.3162.4000113.1L79 V169 V170 A171 S176 T177L79-L173 HydrophobicContact CD1-CD2 3.64Å; L79-L173 HydrophobicContact CD2-CB 4.47Å; L79-L173 HydrophobicContact CD2-CD1 3.75Å; L79-L173 HydrophobicContact CD2-CD2 3.19Å; L79-L173 HydrophobicContact CD2-CG 3.96Å; L79-L173 HydrophobicContact CG-CD2 3.99Å; V169-L173 HydrophobicContact CG1-CD1 3.83Å; V169-L173 WeakPolarHBondContact O-CB 3.24Å; V169-L173 WeakPolarHBondContact O-CD1 3.42Å; V169-L173 WeakPolarHBondContact O-CG 3.27Å; V169-L173 PolarHBondContact O-N 3.49Å; V170-L173 WeakPolarHBondContact O-CB 3.45Å; V170-L173 PolarHBondContact O-N 3.22Å; A171-L173 PolarHBondContact O-N 2.99Å; L173-S176 WeakPolarHBondContact O-CB 3.46Å; L173-S176 PolarHBondContact O-N 2.86Å; L173-T177 PolarHBondContact O-N 2.88Å; L173-T177 PolarHBondContact O-OG1 3.21Å; L173-T177 VanDerWaalsContact O-OG1 3.1Å
174G66.4Low69.9Low27 Ų2778.4 Ų78.428%0.27843%0.426SS..Hα-helixtrans-57.7-50.417200000111.2V170 A171 S176 T177 D178V170-G174 PolarHBondContact O-N 3.22Å; A171-G174 WeakPolarHBondContact O-CA 3.28Å; A171-G174 PolarHBondContact O-N 2.91Å; G174-S176 VanDerWaalsContact C-N 3.27Å; G174-S176 PolarHBondContact O-N 3.48Å; G174-T177 WeakPolarHBondContact CA-OG1 3.44Å; G174-T177 PolarHBondContact O-N 3.32Å; G174-T177 VanDerWaalsContact O-N 3.09Å; G174-T177 PolarHBondContact O-OG1 3.04Å; G174-D178 PolarHBondContact O-N 3.49Å
175D67.9Low69.6Low116 Ų11681.6 Ų81.662%0.6244%0.436SS*.Hα-helixtrans-60.7-38.9176.6-67.7-13.7000111.6A171 D178 S179A171-D175 PolarHBondContact O-N 2.84Å; A171-D175 VanDerWaalsContact O-N 3.11Å; D175-D178 PolarHBondContact O-N 3.4Å; D175-S179 PolarHBondContact O-N 3.3Å; D175-S179 VanDerWaalsContact O-N 3.15Å
176S66.8Low68.9Low58 Ų5880.8 Ų80.841%0.40643%0.432SS..Hα-helixtrans-65.7-38.8175.7-61.30000112.3D172 L173 G174 S179 L180D172-S176 PolarHBondContact O-N 3.34Å; D172-S176 VanDerWaalsContact O-N 3.13Å; D172-S176 PolarHBondContact O-OG 2.96Å; L173-S176 WeakPolarHBondContact O-CB 3.46Å; L173-S176 PolarHBondContact O-N 2.86Å; G174-S176 VanDerWaalsContact C-N 3.27Å; G174-S176 PolarHBondContact O-N 3.48Å; S176-S179 PolarHBondContact O-N 3.13Å; S176-S179 PolarHBondContact O-OG 3.21Å; S176-L180 PolarHBondContact O-N 3.47Å; S176-L180 VanDerWaalsContact O-N 3.16Å
177T64.6Low68.5Low29 Ų2978.8 Ų78.818%0.17843%0.428CS..Hα-helixtrans-67.6-35.8176.139.20000113.1L79 L173 G174 S179 L180 D181L79-T177 HydrophobicContact CB-CG2 4.48Å; L79-T177 HydrophobicContact CD1-CG2 3.46Å; L79-T177 VanDerWaalsContact CD1-CG2 3.46Å; L173-T177 PolarHBondContact O-N 2.88Å; L173-T177 PolarHBondContact O-OG1 3.21Å; L173-T177 VanDerWaalsContact O-OG1 3.1Å; G174-T177 WeakPolarHBondContact CA-OG1 3.44Å; G174-T177 PolarHBondContact O-N 3.32Å; G174-T177 VanDerWaalsContact O-N 3.09Å; G174-T177 PolarHBondContact O-OG1 3.04Å; T177-S179 VanDerWaalsContact C-N 3.31Å; T177-S179 PolarHBondContact O-N 3.11Å; T177-L180 WeakPolarHBondContact O-CB 3.43Å; T177-L180 PolarHBondContact O-N 3.48Å; T177-D181 PolarHBondContact O-N 3.12Å
178D64.6Low68.1Low108 Ų10878 Ų7858%0.57843%0.431SS*.Hα-helixtrans-65.4-38.8175.3-73.4-14.3000111G174 D175 L180 D181 E182G174-D178 PolarHBondContact O-N 3.49Å; D175-D178 PolarHBondContact O-N 3.4Å; D178-L180 VanDerWaalsContact C-N 3.3Å; D178-L180 PolarHBondContact O-N 2.84Å; D178-D181 PolarHBondContact O-N 2.93Å; D178-E182 PolarHBondContact O-N 3.38Å; D178-E182 VanDerWaalsContact O-N 3.1Å
179S65.8Low67.7Low59 Ų5976.1 Ų76.141%0.41342%0.423SS..Hα-helixtrans-62.6-35.3173.383.40000113D175 S176 T177 E182 I183D175-S179 PolarHBondContact O-N 3.3Å; D175-S179 VanDerWaalsContact O-N 3.15Å; S176-S179 PolarHBondContact O-N 3.13Å; S176-S179 PolarHBondContact O-OG 3.21Å; T177-S179 VanDerWaalsContact C-N 3.31Å; T177-S179 PolarHBondContact O-N 3.11Å; S179-E182 PolarHBondContact O-N 2.87Å; S179-I183 WeakPolarHBondContact O-CG1 3.47Å; S179-I183 PolarHBondContact O-N 3.31Å; S179-I183 VanDerWaalsContact O-N 3.14Å
180L62.3Low67.5Low55 Ų5577.1 Ų77.129%0.28843%0.425SS..Hα-helixtrans-70.9-36.4176.5-82.5164.7000112S176 T177 D178 E182 I183 L184S176-L180 PolarHBondContact O-N 3.47Å; S176-L180 VanDerWaalsContact O-N 3.16Å; T177-L180 WeakPolarHBondContact O-CB 3.43Å; T177-L180 PolarHBondContact O-N 3.48Å; D178-L180 VanDerWaalsContact C-N 3.3Å; D178-L180 PolarHBondContact O-N 2.84Å; L180-E182 VanDerWaalsContact C-N 3.29Å; L180-E182 PolarHBondContact O-N 3.32Å; L180-I183 HydrophobicContact CD2-CD1 4.39Å; L180-I183 PolarHBondContact O-N 2.96Å; L180-L184 WeakPolarHBondContact O-CG 3.28Å; L180-L184 PolarHBondContact O-N 3.12Å
181D67.2Low67.3Low59 Ų5980.3 Ų80.332%0.31644%0.441SS..Hα-helixtrans-67.3-30.7174.6-87.10.4000111.4K76 T177 D178 K185K76-D181 VanDerWaalsContact NZ-CG 3.28Å; K76-D181 IonicContact NZ-OD1 2.63Å; K76-D181 PolarHBondContact NZ-OD1 3.34Å; K76-D181 IonicContact NZ-OD2 2.78Å; K76-D181 PolarHBondContact NZ-OD2 3.46Å; T177-D181 PolarHBondContact O-N 3.12Å; D178-D181 PolarHBondContact O-N 2.93Å; D181-K185 WeakPolarHBondContact O-CG 3.46Å; D181-K185 PolarHBondContact O-N 3.43Å
182E67.7Low67.4Low136 Ų13683.7 Ų83.764%0.63645%0.449SS*.Hα-helixtrans-65-45.9168.2-76.4-160.1149.100112.6D178 S179 L180 L184 K185 E186D178-E182 PolarHBondContact O-N 3.38Å; D178-E182 VanDerWaalsContact O-N 3.1Å; S179-E182 PolarHBondContact O-N 2.87Å; L180-E182 VanDerWaalsContact C-N 3.29Å; L180-E182 PolarHBondContact O-N 3.32Å; E182-L184 VanDerWaalsContact C-N 3.28Å; E182-L184 PolarHBondContact O-N 3.49Å; E182-K185 WeakPolarHBondContact O-CB 3.31Å; E182-K185 PolarHBondContact O-N 3.28Å; E182-K185 VanDerWaalsContact O-N 3.09Å; E182-E186 PolarHBondContact O-N 3.33Å
183I64.5Low67.2Low99 Ų9988.1 Ų88.151%0.50846%0.459SS..Hα-helixtrans-59-41.3176-66.2167000110.7S179 L180 E186 G187S179-I183 WeakPolarHBondContact O-CG1 3.47Å; S179-I183 PolarHBondContact O-N 3.31Å; S179-I183 VanDerWaalsContact O-N 3.14Å; L180-I183 HydrophobicContact CD2-CD1 4.39Å; L180-I183 PolarHBondContact O-N 2.96Å; I183-E186 PolarHBondContact O-N 2.88Å; I183-E186 VanDerWaalsContact O-N 3.16Å; I183-G187 PolarHBondContact O-N 3.25Å
184L64.6Low67.4Low76 Ų7689.1 Ų89.140%0.39846%0.461SS..Hα-helixtrans-65.3-37.6176.2-74.8170.6000112.3L180 E182 E186 G187 S188L180-L184 WeakPolarHBondContact O-CG 3.28Å; L180-L184 PolarHBondContact O-N 3.12Å; E182-L184 VanDerWaalsContact C-N 3.28Å; E182-L184 PolarHBondContact O-N 3.49Å; L184-E186 VanDerWaalsContact C-N 3.31Å; L184-E186 PolarHBondContact O-N 3.17Å; L184-G187 PolarHBondContact O-N 3.42Å; L184-S188 PolarHBondContact O-N 2.92Å
185K69.9Low67.9Low149 Ų14990.7 Ų90.765%0.64847%0.468SS*.Hα-helixtrans-63.1-37.8171.3-76.8175.7-177.3170.40111.5D181 E182 G187 S188D181-K185 WeakPolarHBondContact O-CG 3.46Å; D181-K185 PolarHBondContact O-N 3.43Å; E182-K185 WeakPolarHBondContact O-CB 3.31Å; E182-K185 PolarHBondContact O-N 3.28Å; E182-K185 VanDerWaalsContact O-N 3.09Å; K185-G187 VanDerWaalsContact C-N 3.34Å; K185-S188 WeakPolarHBondContact O-CB 3.4Å; K185-S188 PolarHBondContact O-N 3.48Å; K185-S188 PolarHBondContact O-OG 2.89Å
186E66.6Low68.1Low119 Ų11987.6 Ų87.656%0.55646%0.458SS*.Hα-helixtrans-67.3-33.8173.3-66.3-159.4142.200112.9E182 I183 L184 S188 K189 L190E182-E186 PolarHBondContact O-N 3.33Å; I183-E186 PolarHBondContact O-N 2.88Å; I183-E186 VanDerWaalsContact O-N 3.16Å; L184-E186 VanDerWaalsContact C-N 3.31Å; L184-E186 PolarHBondContact O-N 3.17Å; E186-S188 PolarHBondContact O-N 2.89Å; E186-K189 WeakPolarHBondContact O-CA 3.42Å; E186-K189 VanDerWaalsContact O-CB 3.28Å; E186-K189 WeakPolarHBondContact O-CB 3.49Å; E186-K189 PolarHBondContact O-N 3.15Å; E186-L190 PolarHBondContact O-N 2.97Å; E186-L190 VanDerWaalsContact O-N 3.16Å
187G65Low68.4Low22 Ų2288.3 Ų88.323%0.22746%0.462CS..Hα-helixtrans-53.5-38.1169.700000112.8I183 L184 K185 K189 L190 D191I183-G187 PolarHBondContact O-N 3.25Å; L184-G187 PolarHBondContact O-N 3.42Å; K185-G187 VanDerWaalsContact C-N 3.34Å; G187-K189 VanDerWaalsContact C-N 3.28Å; G187-K189 PolarHBondContact O-N 3.04Å; G187-L190 WeakPolarHBondContact O-CA 3.5Å; G187-L190 VanDerWaalsContact O-CB 3.24Å; G187-L190 WeakPolarHBondContact O-CB 3.36Å; G187-L190 PolarHBondContact O-N 3.23Å; G187-D191 PolarHBondContact O-N 3.08Å; G187-D191 VanDerWaalsContact O-N 3.13Å
188S64.9Low69Low67 Ų6790.4 Ų90.447%0.46948%0.478SS..Hα-helixtrans-64.7-30174.780.10000113.5L184 K185 E186 L190 D191 M192L184-S188 PolarHBondContact O-N 2.92Å; K185-S188 WeakPolarHBondContact O-CB 3.4Å; K185-S188 PolarHBondContact O-N 3.48Å; K185-S188 PolarHBondContact O-OG 2.89Å; E186-S188 PolarHBondContact O-N 2.89Å; S188-L190 VanDerWaalsContact C-N 3.34Å; S188-D191 PolarHBondContact O-N 3.34Å; S188-M192 PolarHBondContact O-N 2.94Å
189K73.4Confident69.8Low110 Ų11091.9 Ų91.948%0.47848%0.479SS..Hα-helixtrans-68.9-37.4172.2-59.7176.2-175.8165.60110.2E186 G187 D191 M192 W193E186-K189 WeakPolarHBondContact O-CA 3.42Å; E186-K189 VanDerWaalsContact O-CB 3.28Å; E186-K189 WeakPolarHBondContact O-CB 3.49Å; E186-K189 PolarHBondContact O-N 3.15Å; G187-K189 VanDerWaalsContact C-N 3.28Å; G187-K189 PolarHBondContact O-N 3.04Å; K189-D191 VanDerWaalsContact C-N 3.3Å; K189-D191 PolarHBondContact O-N 3.01Å; K189-M192 HydrophobicContact CB-CE 4.35Å; K189-M192 HydrophobicContact CG-CE 4.2Å; K189-M192 WeakPolarHBondContact O-CB 3.38Å; K189-M192 PolarHBondContact O-N 3.43Å; K189-M192 VanDerWaalsContact O-N 3.14Å; K189-W193 VanDerWaalsContact O-CD1 3.25Å; K189-W193 PolarHBondContact O-N 3.16Å
190L69Low70.5Confident103 Ų10395.5 Ų95.554%0.53949%0.493SS..Hα-helixtrans-61.6-38.7176.1-159.5105.9000111.7E186 G187 S188 M192 W193 K194E186-L190 PolarHBondContact O-N 2.97Å; E186-L190 VanDerWaalsContact O-N 3.16Å; G187-L190 WeakPolarHBondContact O-CA 3.5Å; G187-L190 VanDerWaalsContact O-CB 3.24Å; G187-L190 WeakPolarHBondContact O-CB 3.36Å; G187-L190 PolarHBondContact O-N 3.23Å; S188-L190 VanDerWaalsContact C-N 3.34Å; L190-M192 VanDerWaalsContact C-N 3.34Å; L190-M192 PolarHBondContact O-N 3.38Å; L190-W193 WeakPolarHBondContact O-CB 3.49Å; L190-W193 PolarHBondContact O-N 3.03Å; L190-K194 WeakPolarHBondContact O-CB 3.49Å; L190-K194 PolarHBondContact O-N 2.94Å
191D69.7Low71.2Confident99 Ų9995.4 Ų95.453%0.52950%0.5SS..Hα-helixtrans-64.5-37.2173.7-82.4-26.5000112.6G187 S188 K189 K194 S195G187-D191 PolarHBondContact O-N 3.08Å; G187-D191 VanDerWaalsContact O-N 3.13Å; S188-D191 PolarHBondContact O-N 3.34Å; K189-D191 VanDerWaalsContact C-N 3.3Å; K189-D191 PolarHBondContact O-N 3.01Å; D191-K194 PolarHBondContact O-N 3.25Å; D191-S195 WeakPolarHBondContact O-CB 3.3Å; D191-S195 PolarHBondContact O-N 3.3Å
192M73.3Confident71.9Confident127 Ų12797.4 Ų97.463%0.62651%0.511SS*.Hα-helixtrans-63.2-43171.6-68.3-164.4-6900111.8S188 K189 L190 K194 S195 A196S188-M192 PolarHBondContact O-N 2.94Å; K189-M192 HydrophobicContact CB-CE 4.35Å; K189-M192 HydrophobicContact CG-CE 4.2Å; K189-M192 WeakPolarHBondContact O-CB 3.38Å; K189-M192 PolarHBondContact O-N 3.43Å; K189-M192 VanDerWaalsContact O-N 3.14Å; L190-M192 VanDerWaalsContact C-N 3.34Å; L190-M192 PolarHBondContact O-N 3.38Å; M192-K194 VanDerWaalsContact C-N 3.34Å; M192-K194 PolarHBondContact O-N 3.39Å; M192-S195 PolarHBondContact O-N 2.94Å; M192-A196 WeakPolarHBondContact O-CB 3.49Å; M192-A196 PolarHBondContact O-N 3.28Å
193W69.1Low72.7Confident187 Ų18794.8 Ų94.871%0.70850%0.504SS*.Hα-helixtrans-60.5-43.6174.2-86.396.4000111.8K189 L190 S195 A196 C197K189-W193 VanDerWaalsContact O-CD1 3.25Å; K189-W193 PolarHBondContact O-N 3.16Å; L190-W193 WeakPolarHBondContact O-CB 3.49Å; L190-W193 PolarHBondContact O-N 3.03Å; W193-S195 PolarHBondContact O-N 3.28Å; W193-A196 WeakPolarHBondContact O-CB 3.08Å; W193-A196 PolarHBondContact O-N 3.15Å; W193-C197 PolarHBondContact O-N 2.91Å; W193-C197 PolarHBondContact O-SG 3.42Å; W193-C197 VanDerWaalsContact O-SG 3.34Å
194K72.8Confident73.4Confident67 Ų6792.9 Ų92.929%0.29150%0.503SS..Hα-helixtrans-61.6-44.4176.5-170.5179.3-178-177.20111.8N62 L190 D191 M192 A196 C197 C198N62-K194 PolarHBondContact ND2-NZ 3.09Å; N62-K194 PolarHBondContact OD1-NZ 3.35Å; L190-K194 WeakPolarHBondContact O-CB 3.49Å; L190-K194 PolarHBondContact O-N 2.94Å; D191-K194 PolarHBondContact O-N 3.25Å; M192-K194 VanDerWaalsContact C-N 3.34Å; M192-K194 PolarHBondContact O-N 3.39Å; K194-A196 VanDerWaalsContact C-N 3.33Å; K194-A196 PolarHBondContact O-N 2.92Å; K194-C197 PolarHBondContact O-N 2.98Å; K194-C198 PolarHBondContact O-N 3.49Å; K194-C198 PolarHBondContact O-SG 2.91Å; K194-C198 VanDerWaalsContact O-SG 3.38Å
195S75.9Confident74.3Confident59 Ų5994.8 Ų94.841%0.41351%0.513SS..Hα-helixtrans-60.6-42.4174.4-175.50000111.8D191 M192 W193 C198 K199D191-S195 WeakPolarHBondContact O-CB 3.3Å; D191-S195 PolarHBondContact O-N 3.3Å; M192-S195 PolarHBondContact O-N 2.94Å; W193-S195 PolarHBondContact O-N 3.28Å; S195-C198 PolarHBondContact O-N 3.1Å; S195-K199 WeakPolarHBondContact O-CG 3.43Å; S195-K199 PolarHBondContact O-N 3.21Å
196A72.7Confident75.1Confident51 Ų5194.8 Ų94.842%0.42151%0.513SS..Hα-helixtrans-62.6-45.3175.300000111.8M192 W193 K194 C198 K199 L200M192-A196 WeakPolarHBondContact O-CB 3.49Å; M192-A196 PolarHBondContact O-N 3.28Å; W193-A196 WeakPolarHBondContact O-CB 3.08Å; W193-A196 PolarHBondContact O-N 3.15Å; K194-A196 VanDerWaalsContact C-N 3.33Å; K194-A196 PolarHBondContact O-N 2.92Å; A196-C198 PolarHBondContact O-N 3.43Å; A196-K199 PolarHBondContact O-N 3.46Å; A196-L200 PolarHBondContact O-N 3.03Å
197C73.9Confident75.9Confident73 Ų7392.9 Ų92.949%0.49351%0.507SS..Hα-helixtrans-61.7-42.1176-70.10000112.3W193 K194 K199 L200 A201W193-C197 PolarHBondContact O-N 2.91Å; W193-C197 PolarHBondContact O-SG 3.42Å; W193-C197 VanDerWaalsContact O-SG 3.34Å; K194-C197 PolarHBondContact O-N 2.98Å; C197-K199 VanDerWaalsContact C-N 3.34Å; C197-K199 PolarHBondContact O-N 3.31Å; C197-L200 PolarHBondContact O-N 2.84Å; C197-A201 WeakPolarHBondContact O-CB 3.47Å; C197-A201 PolarHBondContact O-N 3.49Å
198C76.6Confident76.9Confident74 Ų7495.4 Ų95.450%0.551%0.511SS..Hα-helixtrans-62.8-39.9174.9-71.20000112.2K194 S195 A196 A201 N202K194-C198 PolarHBondContact O-N 3.49Å; K194-C198 PolarHBondContact O-SG 2.91Å; K194-C198 VanDerWaalsContact O-SG 3.38Å; S195-C198 PolarHBondContact O-N 3.1Å; A196-C198 PolarHBondContact O-N 3.43Å; C198-A201 PolarHBondContact O-N 3.01Å; C198-N202 PolarHBondContact O-N 3.26Å; C198-N202 VanDerWaalsContact O-N 3.08Å
199K81.1Confident77.9Confident139 Ų13998.2 Ų98.260%0.60452%0.515SS*.Hα-helixtrans-63.9-42.9173.7-72.5176-176.4-179.90111.4S195 A196 C197 N202 V203S195-K199 WeakPolarHBondContact O-CG 3.43Å; S195-K199 PolarHBondContact O-N 3.21Å; A196-K199 PolarHBondContact O-N 3.46Å; C197-K199 VanDerWaalsContact C-N 3.34Å; C197-K199 PolarHBondContact O-N 3.31Å; K199-N202 PolarHBondContact O-N 3.06Å; K199-V203 WeakPolarHBondContact O-CG2 3.44Å; K199-V203 PolarHBondContact O-N 3.25Å
200L80.3Confident78.4Confident134 Ų13497.3 Ų97.370%0.70252%0.515SS*.Hα-helixtrans-62.9-43.7178.2-141.395.4000111.5A196 C197 N202 V203 A204A196-L200 PolarHBondContact O-N 3.03Å; C197-L200 PolarHBondContact O-N 2.84Å; L200-N202 VanDerWaalsContact C-N 3.32Å; L200-N202 PolarHBondContact O-N 3.14Å; L200-V203 PolarHBondContact O-N 3.45Å; L200-V203 VanDerWaalsContact O-N 3.15Å; L200-A204 PolarHBondContact O-N 3.34Å
201A76.5Confident79.3Confident53 Ų5398 Ų9844%0.43852%0.515SS..Hα-helixtrans-61.1-40.1176.200000112C197 C198 A204 L205C197-A201 WeakPolarHBondContact O-CB 3.47Å; C197-A201 PolarHBondContact O-N 3.49Å; C198-A201 PolarHBondContact O-N 3.01Å; A201-A204 PolarHBondContact O-N 2.95Å; A201-L205 WeakPolarHBondContact O-CB 3.39Å; A201-L205 PolarHBondContact O-N 3.13Å
202N83.5Confident80Confident101 Ų10198.4 Ų98.454%0.5451%0.514SS..Hα-helixtrans-65.4-36.4174.5-79.2-16.9000112.8C198 K199 L200 K206C198-N202 PolarHBondContact O-N 3.26Å; C198-N202 VanDerWaalsContact O-N 3.08Å; K199-N202 PolarHBondContact O-N 3.06Å; L200-N202 VanDerWaalsContact C-N 3.32Å; L200-N202 PolarHBondContact O-N 3.14Å; N202-K206 WeakPolarHBondContact O-CG 3.4Å; N202-K206 PolarHBondContact O-N 3.47Å; N202-K206 VanDerWaalsContact O-N 3.12Å
203V83Confident80.7Confident82 Ų8296.5 Ų96.550%0.49750%0.504SS..Hα-helixtrans-66.8-44.1173.5173.20000110.5K199 L200 L205 K206 N207K199-V203 WeakPolarHBondContact O-CG2 3.44Å; K199-V203 PolarHBondContact O-N 3.25Å; L200-V203 PolarHBondContact O-N 3.45Å; L200-V203 VanDerWaalsContact O-N 3.15Å; V203-L205 VanDerWaalsContact C-N 3.33Å; V203-L205 PolarHBondContact O-N 2.86Å; V203-K206 PolarHBondContact O-N 3.25Å; V203-N207 PolarHBondContact O-N 3Å
204A80.8Confident81.4Confident58 Ų5891.7 Ų91.748%0.47949%0.491SS..Hα-helixtrans-60.4-41.7176.500000112.2L200 A201 K206 N207 K208L200-A204 PolarHBondContact O-N 3.34Å; A201-A204 PolarHBondContact O-N 2.95Å; A204-K206 PolarHBondContact O-N 2.98Å; A204-N207 PolarHBondContact O-N 2.9Å; A204-K208 PolarHBondContact O-N 3.35Å
205L82.6Confident81.8Confident116 Ų11692.8 Ų92.861%0.60750%0.5SS*.Hα-helixtrans-60.8-42.5174-103.9159000112.6A201 V203 K209A201-L205 WeakPolarHBondContact O-CB 3.39Å; A201-L205 PolarHBondContact O-N 3.13Å; V203-L205 VanDerWaalsContact C-N 3.33Å; V203-L205 PolarHBondContact O-N 2.86Å; L205-K209 PolarHBondContact O-N 3.43Å; L205-K209 VanDerWaalsContact O-N 3.15Å
206K86.6Confident82.2Confident149 Ų14995.2 Ų95.265%0.64851%0.508SS*.Hα-helixtrans-65.9-41.3175.8-74.2-179.5179.3-173.30111.9N202 V203 A204 K209 L210N202-K206 WeakPolarHBondContact O-CG 3.4Å; N202-K206 PolarHBondContact O-N 3.47Å; N202-K206 VanDerWaalsContact O-N 3.12Å; V203-K206 PolarHBondContact O-N 3.25Å; A204-K206 PolarHBondContact O-N 2.98Å; K206-K209 PolarHBondContact O-N 2.88Å; K206-L210 WeakPolarHBondContact O-CG 3.45Å; K206-L210 PolarHBondContact O-N 3.44Å
207N83.2Confident82.5Confident80 Ų8098 Ų9843%0.42852%0.515SS..Hα-helixtrans-64-44.6176.8-78.44.9000111.5V203 A204 K209 L210 E211V203-N207 PolarHBondContact O-N 3Å; A204-N207 PolarHBondContact O-N 2.9Å; N207-K209 PolarHBondContact O-N 2.89Å; N207-L210 PolarHBondContact O-N 2.61Å; N207-L210 VanDerWaalsContact O-N 3.09Å; N207-E211 WeakPolarHBondContact O-CG 3.44Å; N207-E211 PolarHBondContact O-N 2.95Å
208K85.5Confident82.9Confident75 Ų75100.1 Ų100.133%0.32652%0.516SS..Hα-helixtrans-58.1-38.5175.4-170.9176.4-179.3-178.40111.6E48 A204 Q212E48-K208 IonicContact OE1-NZ 3.06Å; E48-K208 PolarHBondContact OE1-NZ 3.16Å; A204-K208 PolarHBondContact O-N 3.35Å; K208-Q212 VanDerWaalsContact O-CG 3.31Å; K208-Q212 WeakPolarHBondContact O-CG 3.35Å; K208-Q212 PolarHBondContact O-N 2.96Å
209K86.7Confident82.8Confident125 Ų12598.7 Ų98.754%0.54351%0.509SS..Hα-helixtrans-67.4-41.4175.8-168.1-178177.4-166.30112.4L205 K206 N207 Q212 E213L205-K209 PolarHBondContact O-N 3.43Å; L205-K209 VanDerWaalsContact O-N 3.15Å; K206-K209 PolarHBondContact O-N 2.88Å; N207-K209 PolarHBondContact O-N 2.89Å; K209-Q212 PolarHBondContact O-N 3.19Å; K209-E213 VanDerWaalsContact CE-OE1 3.3Å; K209-E213 WeakPolarHBondContact CE-OE1 3.45Å; K209-E213 IonicContact NZ-OE1 3.85Å; K209-E213 WeakPolarHBondContact O-CG 3.45Å; K209-E213 PolarHBondContact O-N 3.29Å
210L84.6Confident82.5Confident92 Ų9296.5 Ų96.548%0.48250%0.504SS..Hα-helixtrans-65.7-39.3175.8-73170.4000111.9K206 N207 E213 I214K206-L210 WeakPolarHBondContact O-CG 3.45Å; K206-L210 PolarHBondContact O-N 3.44Å; N207-L210 PolarHBondContact O-N 2.61Å; N207-L210 VanDerWaalsContact O-N 3.09Å; L210-E213 PolarHBondContact O-N 3.06Å; L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.4Å; L210-I214 PolarHBondContact O-N 2.83Å
211E85.9Confident81.6Confident116 Ų11696 Ų9654%0.54250%0.501SS..Hα-helixtrans-60-45.8173.1-74.3168.4-179.600110.8N207 E213 I214 D215N207-E211 WeakPolarHBondContact O-CG 3.44Å; N207-E211 PolarHBondContact O-N 2.95Å; E211-E213 PolarHBondContact O-N 3.02Å; E211-I214 WeakPolarHBondContact O-CB 3.37Å; E211-I214 PolarHBondContact O-N 3.26Å; E211-D215 PolarHBondContact O-N 3.1Å
212Q86Confident80.7Confident109 Ų109100.7 Ų100.751%0.50951%0.514SS..Hα-helixtrans-61.8-39.9174.6-73.1174.5-16.100113.2K208 K209 D215 L216K208-Q212 VanDerWaalsContact O-CG 3.31Å; K208-Q212 WeakPolarHBondContact O-CG 3.35Å; K208-Q212 PolarHBondContact O-N 2.96Å; K209-Q212 PolarHBondContact O-N 3.19Å; Q212-D215 PolarHBondContact O-N 2.99Å; Q212-L216 WeakPolarHBondContact O-CB 3.48Å; Q212-L216 PolarHBondContact O-N 3.27Å
213E87.6Confident79.4Confident87 Ų87102.3 Ų102.341%0.40752%0.523SS..Hα-helixtrans-65.4-38.9175-75.7173.3-165.800111.4K209 L210 E211 L217K209-E213 VanDerWaalsContact CE-OE1 3.3Å; K209-E213 WeakPolarHBondContact CE-OE1 3.45Å; K209-E213 IonicContact NZ-OE1 3.85Å; K209-E213 WeakPolarHBondContact O-CG 3.45Å; K209-E213 PolarHBondContact O-N 3.29Å; L210-E213 PolarHBondContact O-N 3.06Å; E211-E213 PolarHBondContact O-N 3.02Å; E213-L217 WeakPolarHBondContact O-CB 3.33Å; E213-L217 VanDerWaalsContact O-CG 3.28Å; E213-L217 WeakPolarHBondContact O-CG 3.38Å; E213-L217 PolarHBondContact O-N 3.1Å
214I83Confident77.9Confident85 Ų85105.2 Ų105.244%0.43654%0.536SS..Hα-helixtrans-65-43.3174.9-71.7166000110.9L210 E211 L217 K218L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.4Å; L210-I214 PolarHBondContact O-N 2.83Å; E211-I214 WeakPolarHBondContact O-CB 3.37Å; E211-I214 PolarHBondContact O-N 3.26Å; I214-L217 PolarHBondContact O-N 2.91Å; I214-K218 HydrophobicContact CG2-CD 4.2Å; I214-K218 HydrophobicContact CG2-CG 4.47Å; I214-K218 WeakPolarHBondContact O-CG 3.37Å; I214-K218 PolarHBondContact O-N 3.15Å
215D81.9Confident76.2Confident90 Ų90109.2 Ų109.248%0.48155%0.549SS..Hα-helixtrans-68.2-37.4179.9-69.3-21.7000111.6E211 Q212 K218 A219E211-D215 PolarHBondContact O-N 3.1Å; Q212-D215 PolarHBondContact O-N 2.99Å; D215-K218 PolarHBondContact O-N 3.44Å; D215-K218 IonicContact OD1-NZ 3.78Å; D215-A219 WeakPolarHBondContact O-CB 3.4Å; D215-A219 PolarHBondContact O-N 2.98Å
216L84.2Confident74.3Confident110 Ų110106.4 Ų106.458%0.57655%0.548SS*.Hα-helixtrans-61-43.5169.7-84.1165.8000112.2Q212 K218 A219 N220Q212-L216 WeakPolarHBondContact O-CB 3.48Å; Q212-L216 PolarHBondContact O-N 3.27Å; L216-K218 VanDerWaalsContact C-N 3.34Å; L216-A219 PolarHBondContact O-N 3.13Å; L216-N220 VanDerWaalsContact O-CG 3.25Å; L216-N220 PolarHBondContact O-N 3.36Å; L216-N220 PolarHBondContact O-ND2 3.31Å
217L79.4Confident72.3Confident109 Ų109106.9 Ų106.957%0.57156%0.558SS**Hα-helixtrans-64.7-38.8176.7-74.1169.8000111.9E213 I214 L221E213-L217 WeakPolarHBondContact O-CB 3.33Å; E213-L217 VanDerWaalsContact O-CG 3.28Å; E213-L217 WeakPolarHBondContact O-CG 3.38Å; E213-L217 PolarHBondContact O-N 3.1Å; I214-L217 PolarHBondContact O-N 2.91Å; L217-L221 PolarHBondContact O-N 2.98Å; L217-L221 VanDerWaalsContact O-N 3.08Å
218K81Confident70.9Confident119 Ų119111 Ų11152%0.51758%0.578SS.*Hα-helixtrans-65.4-41.1174.4-74.7174.5-1771680112.2I214 D215 L216 L221 Q222I214-K218 HydrophobicContact CG2-CD 4.2Å; I214-K218 HydrophobicContact CG2-CG 4.47Å; I214-K218 WeakPolarHBondContact O-CG 3.37Å; I214-K218 PolarHBondContact O-N 3.15Å; D215-K218 PolarHBondContact O-N 3.44Å; D215-K218 IonicContact OD1-NZ 3.78Å; L216-K218 VanDerWaalsContact C-N 3.34Å; K218-L221 WeakPolarHBondContact O-CB 3.48Å; K218-L221 PolarHBondContact O-N 3.41Å; K218-Q222 PolarHBondContact O-N 3.22Å
219A76.5Confident69Low43 Ų43117 Ų11736%0.35560%0.6SS.*Hα-helixtrans-64.6-44.8176.800000111.4D215 L216 L221 Q222 D223D215-A219 WeakPolarHBondContact O-CB 3.4Å; D215-A219 PolarHBondContact O-N 2.98Å; L216-A219 PolarHBondContact O-N 3.13Å; A219-L221 PolarHBondContact O-N 3.2Å; A219-Q222 PolarHBondContact O-N 3.27Å; A219-D223 PolarHBondContact O-N 3.47Å; A219-D223 VanDerWaalsContact O-N 3.08Å
220N72.8Confident67.4Low94 Ų94115 Ų11550%0.50360%0.596SS.*Hα-helixtrans-61.4-33.1175.4-69.4-15000112.6L216 Q222 D224L216-N220 VanDerWaalsContact O-CG 3.25Å; L216-N220 PolarHBondContact O-N 3.36Å; L216-N220 PolarHBondContact O-ND2 3.31Å; N220-Q222 VanDerWaalsContact C-N 3.33Å; N220-D224 PolarHBondContact O-N 2.98Å
221L63.1Low66.1Low123 Ų123114.6 Ų114.664%0.64460%0.599SS**Hα-helixtrans-69.6-28.3174.3-92155.3000113.1L217 K218 A219L217-L221 PolarHBondContact O-N 2.98Å; L217-L221 VanDerWaalsContact O-N 3.08Å; K218-L221 WeakPolarHBondContact O-CB 3.48Å; K218-L221 PolarHBondContact O-N 3.41Å; A219-L221 PolarHBondContact O-N 3.2Å
222Q57.1Low64.8Low152 Ų152115.1 Ų115.171%0.7161%0.605SS**Hα-helixtrans-82.4-28.9177.2-74.6-175.9-30.300112.9K218 A219 N220 D224K218-Q222 PolarHBondContact O-N 3.22Å; A219-Q222 PolarHBondContact O-N 3.27Å; N220-Q222 VanDerWaalsContact C-N 3.33Å; Q222-D224 VanDerWaalsContact C-N 3.33Å
223D55Low63.5Low134 Ų134112.1 Ų112.172%0.71760%0.596SS**Hα-helixtrans-75.1-21.6175.7-78.3-19.8000113A219 D225A219-D223 PolarHBondContact O-N 3.47Å; A219-D223 VanDerWaalsContact O-N 3.08Å; D223-D225 VanDerWaalsContact C-N 3.34Å
224D51.6Low62Low143 Ų143114.6 Ų114.677%0.76561%0.611SS**THydrogen-bonded Turntrans-84.70.2176-92.6-13.9000113.9N220 Q222 G226N220-D224 PolarHBondContact O-N 2.98Å; Q222-D224 VanDerWaalsContact C-N 3.33Å; D224-G226 VanDerWaalsContact C-N 3.26Å; D224-G226 PolarHBondContact O-N 3.01Å
225D46.6Very low60.7Low143 Ų143114.9 Ų114.977%0.76562%0.62SS**THydrogen-bonded Turntrans-86.813.2175.2-81.9-31000113.5D223D223-D225 VanDerWaalsContact C-N 3.34Å
226G43.1Very low59.4Low56 Ų56113.1 Ų113.158%0.57761%0.612SS**SBendtrans-100.1106.1173.100000113.3D224D224-G226 VanDerWaalsContact C-N 3.26Å; D224-G226 PolarHBondContact O-N 3.01Å
227D44Very low58.1Low160 Ų160113.8 Ų113.886%0.85661%0.612SS**SBendtrans62.368.3162.5-68.8-23.1000118.5
228L52.4Low57.1Low165 Ų165112.8 Ų112.886%0.86461%0.605SS**  trans-149.945.7158.1-138.587.1000115.7D230L228-D230 PolarHBondContact O-N 3.28Å
229Y47.2Very low56Low201 Ų201112.4 Ų112.479%0.78861%0.606SS**  trans-92.374.9162.7-142-88.3000110.3P231Y229-P231 WeakPolarHBondContact O-CD 3.49Å
230D52.7Low55.2Low84 Ų84114.1 Ų114.145%0.44961%0.613SS.*  trans-84.7107.4161.1-176.20.6000108.4L228 N232 S233 T236L228-D230 PolarHBondContact O-N 3.28Å; D230-N232 PolarHBondContact O-N 3.39Å; D230-N232 WeakPolarHBondContact OD1-CB 3.27Å; D230-N232 PolarHBondContact OD1-N 3.32Å; D230-S233 WeakPolarHBondContact O-CB 3.21Å; D230-S233 PolarHBondContact O-N 3.29Å; D230-T236 PolarHBondContact O-OG1 3.46Å
231P57Low54.6Low84 Ų84115.5 Ų115.555%0.54562%0.615SS.*THydrogen-bonded Turntrans-63.1-7177.325-32.2000113.6Y229Y229-P231 WeakPolarHBondContact O-CD 3.49Å
232N58.2Low54.4Low127 Ų127114.1 Ų114.168%0.67961%0.608SS**THydrogen-bonded Turntrans-103.55.3174.1-65.4-40.8000114.5D230D230-N232 PolarHBondContact O-N 3.39Å; D230-N232 WeakPolarHBondContact OD1-CB 3.27Å; D230-N232 PolarHBondContact OD1-N 3.32Å
233S59.5Low54.6Low45 Ų45111.6 Ų111.632%0.31560%0.599SS.*SBendtrans-68.4137.3174.6178.10000111.3D230 C235 T236D230-S233 WeakPolarHBondContact O-CB 3.21Å; D230-S233 PolarHBondContact O-N 3.29Å; S233-C235 PolarHBondContact O-N 2.93Å; S233-T236 PolarHBondContact O-N 2.91Å; S233-T236 PolarHBondContact O-OG1 3.43Å
234I56.6Low54.7Low140 Ų140108.3 Ų108.372%0.71859%0.586SS**Hα-helixtrans-51.8-28.9177.5-78.3166.6000112Q237 E238I234-Q237 PolarHBondContact O-N 3.29Å; I234-E238 HydrophobicContact CG2-CG 4.32Å; I234-E238 WeakPolarHBondContact O-CG 3.4Å; I234-E238 PolarHBondContact O-N 3.3Å
235C54.2Low55Low91 Ų91104.5 Ų104.562%0.61557%0.57SS**Hα-helixtrans-70.9-30.8-178.8-146.30000113.6S233 M239S233-C235 PolarHBondContact O-N 2.93Å; C235-M239 PolarHBondContact O-N 3.08Å
236T54.3Low55.3Low52 Ų52103 Ų10332%0.31956%0.562SS.*Hα-helixtrans-83-18.4178.141.60000113D230 S233 P240D230-T236 PolarHBondContact O-OG1 3.46Å; S233-T236 PolarHBondContact O-N 2.91Å; S233-T236 PolarHBondContact O-OG1 3.43Å; T236-P240 WeakPolarHBondContact O-CD 3.41Å
237Q58.7Low55.9Low124 Ų124108 Ų10858%0.57957%0.57SS**Hα-helixtrans-88.1-25.8172.6-67.7-169.1-100114I234I234-Q237 PolarHBondContact O-N 3.29Å
238E58.5Low56.2Low89 Ų89105.5 Ų105.542%0.41656%0.561SS.*Hα-helixtrans-89.8-28.8-179.2-73.3-80.1127.600113I234 K241 L242I234-E238 HydrophobicContact CG2-CG 4.32Å; I234-E238 WeakPolarHBondContact O-CG 3.4Å; I234-E238 PolarHBondContact O-N 3.3Å; E238-K241 WeakPolarHBondContact O-CB 3.34Å; E238-K241 PolarHBondContact O-N 3.08Å; E238-K241 IonicContact OE1-NZ 3.8Å; E238-L242 PolarHBondContact O-N 3.01Å
239M57.6Low56.1Low110 Ų110101.9 Ų101.954%0.54255%0.546SS..Hα-helixtrans-56.5-43.8179.1-109.6-72.1-177.700114.2C235 K241 L242 L243C235-M239 PolarHBondContact O-N 3.08Å; M239-K241 VanDerWaalsContact C-N 3.3Å; M239-K241 PolarHBondContact O-N 2.87Å; M239-L242 PolarHBondContact O-N 3.02Å; M239-L243 WeakPolarHBondContact O-CB 3.4Å; M239-L243 PolarHBondContact O-N 3.47Å; M239-L243 HydrophobicContact SD-CD1 3.91Å; M239-L243 HydrophobicContact SD-CG 4.41Å
240P58.7Low55.9Low79 Ų7999.9 Ų99.951%0.51355%0.549SS..Hα-helixtrans-65.2-31.8175.3-21.633.2000113.2T236 S244T236-P240 WeakPolarHBondContact O-CD 3.41Å; P240-S244 WeakPolarHBondContact O-CB 3.49Å; P240-S244 PolarHBondContact O-N 2.89Å; P240-S244 VanDerWaalsContact O-N 3.09Å; P240-S244 PolarHBondContact O-OG 3.17Å
241K60.8Low55.6Low123 Ų123100.8 Ų100.854%0.53557%0.568SS.*Hα-helixtrans-72.2-38.1174.9-70.5177.8-176.7167.10111.5E238 M239 S244 S245E238-K241 WeakPolarHBondContact O-CB 3.34Å; E238-K241 PolarHBondContact O-N 3.08Å; E238-K241 IonicContact OE1-NZ 3.8Å; M239-K241 VanDerWaalsContact C-N 3.3Å; M239-K241 PolarHBondContact O-N 2.87Å; K241-S244 WeakPolarHBondContact CA-OG 3.43Å; K241-S244 PolarHBondContact O-OG 3.32Å; K241-S244 VanDerWaalsContact O-OG 3.06Å; K241-S245 WeakPolarHBondContact O-CB 3.05Å; K241-S245 PolarHBondContact O-N 2.86Å; K241-S245 PolarHBondContact O-OG 3.21Å
242L58.8Low54.6Low95 Ų95100.1 Ų100.150%0.49758%0.576SS.*Hα-helixtrans-71.2-38.5175.4-75.4166.6000112.4E238 M239 S245 L246E238-L242 PolarHBondContact O-N 3.01Å; M239-L242 PolarHBondContact O-N 3.02Å; L242-S245 CarbonylContact O-C 3.59Å; L242-S245 WeakPolarHBondContact O-CB 3.38Å; L242-S245 PolarHBondContact O-N 2.97Å; L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 PolarHBondContact O-N 3.32Å
243L60.4Low54Low99 Ų9998.5 Ų98.552%0.51858%0.58SS.*Hα-helixtrans-67.2-38.4175.5-89154.7000112.9M239 S245 L246 Q247M239-L243 WeakPolarHBondContact O-CB 3.4Å; M239-L243 PolarHBondContact O-N 3.47Å; M239-L243 HydrophobicContact SD-CD1 3.91Å; M239-L243 HydrophobicContact SD-CG 4.41Å; L243-S245 VanDerWaalsContact C-N 3.34Å; L243-L246 PolarHBondContact O-N 2.9Å; L243-Q247 PolarHBondContact O-N 3.06Å
244S58.4Low53Low65 Ų65101.1 Ų101.146%0.45560%0.599SS.*Hα-helixtrans-70.5-30.2172.147.40000112.8P240 K241 T248P240-S244 WeakPolarHBondContact O-CB 3.49Å; P240-S244 PolarHBondContact O-N 2.89Å; P240-S244 VanDerWaalsContact O-N 3.09Å; P240-S244 PolarHBondContact O-OG 3.17Å; K241-S244 WeakPolarHBondContact CA-OG 3.43Å; K241-S244 PolarHBondContact O-OG 3.32Å; K241-S244 VanDerWaalsContact O-OG 3.06Å; S244-T248 PolarHBondContact O-OG1 2.69Å
245S57.8Low52.3Low62 Ų62103.3 Ų103.343%0.43461%0.608SS.*Hα-helixtrans-68.8-34.7168.8-52.10000112.3K241 L242 L243 T248 T249K241-S245 WeakPolarHBondContact O-CB 3.05Å; K241-S245 PolarHBondContact O-N 2.86Å; K241-S245 PolarHBondContact O-OG 3.21Å; L242-S245 CarbonylContact O-C 3.59Å; L242-S245 WeakPolarHBondContact O-CB 3.38Å; L242-S245 PolarHBondContact O-N 2.97Å; L243-S245 VanDerWaalsContact C-N 3.34Å; S245-T248 PolarHBondContact O-N 3.28Å; S245-T248 PolarHBondContact O-OG1 3.09Å; S245-T249 PolarHBondContact O-N 2.87Å; S245-T249 PolarHBondContact O-OG1 3.35Å
246L52.9Low51.4Low113 Ų113107.2 Ų107.259%0.59262%0.615SS**Hα-helixtrans-75.4-38-179.8-109.8132.5000112.9L242 L243 T248 T249 D250L242-L246 WeakPolarHBondContact O-CB 3.33Å; L242-L246 PolarHBondContact O-N 3.32Å; L243-L246 PolarHBondContact O-N 2.9Å; L246-T248 PolarHBondContact O-N 3.39Å; L246-T249 VanDerWaalsContact CA-OG1 3.28Å; L246-T249 WeakPolarHBondContact CA-OG1 3.37Å; L246-T249 PolarHBondContact O-N 2.99Å; L246-T249 VanDerWaalsContact O-N 3.1Å; L246-T249 PolarHBondContact O-OG1 3.31Å; L246-D250 PolarHBondContact O-N 3.46Å
247Q55.3Low50.6Low159 Ų159111.9 Ų111.974%0.74364%0.638SS**Hα-helixtrans-64.6-18.4173.3-78.4-178-18.600113.3L243L243-Q247 PolarHBondContact O-N 3.06Å
248T51.4Low49.6Very low109 Ų109113.5 Ų113.567%0.66965%0.649SS**Hα-helixtrans-93.5-15.5173.644.80000113.6S244 S245 L246S244-T248 PolarHBondContact O-OG1 2.69Å; S245-T248 PolarHBondContact O-N 3.28Å; S245-T248 PolarHBondContact O-OG1 3.09Å; L246-T248 PolarHBondContact O-N 3.39Å
249T48.7Very low48.5Very low88 Ų88118.4 Ų118.454%0.5467%0.671SS.*Hα-helixtrans-88.7-13.317740.10000115.4S245 L246 A251 G252S245-T249 PolarHBondContact O-N 2.87Å; S245-T249 PolarHBondContact O-OG1 3.35Å; L246-T249 VanDerWaalsContact CA-OG1 3.28Å; L246-T249 WeakPolarHBondContact CA-OG1 3.37Å; L246-T249 PolarHBondContact O-N 2.99Å; L246-T249 VanDerWaalsContact O-N 3.1Å; L246-T249 PolarHBondContact O-OG1 3.31Å; T249-A251 PolarHBondContact O-N 3.24Å; T249-G252 PolarHBondContact O-N 2.95Å
250D44.5Very low47.3Very low160 Ų160122 Ų12286%0.85669%0.687SS**THydrogen-bonded Turntrans-771.2179.1-1304.3000114L246L246-D250 PolarHBondContact O-N 3.46Å
251A44.7Very low46.4Very low103 Ų103123.4 Ų123.485%0.85169%0.694SS**THydrogen-bonded Turntrans-104.12.9176.300000114.3T249T249-A251 PolarHBondContact O-N 3.24Å
252G37.6Very low45.1Very low70 Ų70123.5 Ų123.572%0.72271%0.705SS**SBendtrans-134.5-5.9-164.800000119T249T249-G252 PolarHBondContact O-N 2.95Å
253A45.1Very low43.8Very low92 Ų92127.5 Ų127.576%0.7672%0.721SS**  trans-107.983.9-173.500000112.9M255A253-M255 PolarHBondContact O-N 2.86Å; A253-M255 VanDerWaalsContact O-N 3.08Å
254S38.7Very low42.7Very low101 Ų101130 Ų13071%0.70673%0.734SS**  trans-61.2100.5160.9176.40000110.1
255M40.7Very low41.5Very low186 Ų186133 Ų13392%0.91675%0.745SS**  trans-10391.5159.3-97.2-165.6179.800109.9A253A253-M255 PolarHBondContact O-N 2.86Å; A253-M255 VanDerWaalsContact O-N 3.08Å
256K35.8Very low40.4Very low172 Ų172135 Ų13575%0.74876%0.757SS**  trans-57.2146.6151.2-71.2172.5174.31750109.2
257N37.5Very low39.4Very low151 Ų151136.4 Ų136.481%0.80777%0.769SS**  trans73.792.1170-59.2-15000115.5
258I38.8Very low38.3Very low157 Ų157136.6 Ų136.681%0.80577%0.77SS**  -175.579.7112.1-72.9139.3000105.6
259H33.8Very low37.4Very low192 Ų192137 Ų13789%0.88978%0.777SS**  trans-124.274.8161.5-99.57.7000106.7
260E33.3Very low36.7Very low185 Ų185144 Ų14486%0.86479%0.793SS**  trans-136.669166.1-156.8172.4-149.500107.3
261T39.9Very low35.9Very low110 Ų110140.8 Ų140.868%0.67579%0.79SS**  trans-130.393.9168.147.30000108.1H263T261-H263 PolarHBondContact O-N 2.95Å
262V34Very low35.2Very low125 Ų125140 Ų14076%0.75878%0.782SS**  trans17.294.8137-172.30000113.5L264V262-L264 HydrophobicContact CG1-CG 4.08Å; V262-L264 PolarHBondContact O-N 3.29Å
263H31.6Very low34.8Very low178 Ų178143.8 Ų143.882%0.82479%0.785SS**  trans-63.895.1162.1-84.2-83.7000109.2T261 N265T261-H263 PolarHBondContact O-N 2.95Å; H263-N265 PolarHBondContact O-N 2.96Å
264L35.4Very low34.1Very low153 Ų153147.7 Ų147.780%0.80179%0.788SS**  trans-84.997.4155.9-74.5171.6000107.5V262V262-L264 HydrophobicContact CG1-CG 4.08Å; V262-L264 PolarHBondContact O-N 3.29Å
265N34.7Very low33.8Very low127 Ų127150.8 Ų150.868%0.67980%0.797SS**  trans-55.9129.4166.9-79.5-24.9000109.7H263 V267H263-N265 PolarHBondContact O-N 2.96Å; N265-V267 PolarHBondContact O-N 3.47Å
266P34.2Very low33.1Very low105 Ų105148.5 Ų148.568%0.68279%0.788SS**  trans-73.297.1167.629.3-28.8000107.7H268P266-H268 PolarHBondContact O-N 2.92Å; P266-H268 PolarHBondContact O-ND1 3.01Å; P266-H268 VanDerWaalsContact O-ND1 3.1Å
267V32.1Very low33.3Very low141 Ų141146 Ų14686%0.85579%0.792SS**  trans-58.5112.4173.6174.60000108.2N265N265-V267 PolarHBondContact O-N 3.47Å
268H32.8Very low33.1Very low164 Ų164147.9 Ų147.976%0.75980%0.796SS**  trans-57.4143.6178.5-74.46.5000112.8P266 R270P266-H268 PolarHBondContact O-N 2.92Å; P266-H268 PolarHBondContact O-ND1 3.01Å; P266-H268 VanDerWaalsContact O-ND1 3.1Å; H268-R270 PolarHBondContact O-N 3.04Å
269S30.6Very low33.3Very low117 Ų117145.7 Ų145.782%0.81879%0.792SS**  trans-23.4110160.2-53.50000114.5A271S269-A271 VanDerWaalsContact C-N 3.28Å; S269-A271 PolarHBondContact O-N 3.42Å; S269-A271 VanDerWaalsContact O-N 3.13Å
270R34.4Very low33.2Very low234 Ų234143.1 Ų143.188%0.88379%0.789SS**  trans-85.974.8166.6-162.5169.3179155.5-1.5109.4H268H268-R270 PolarHBondContact O-N 3.04Å
271A28.6Very low33.2Very low94 Ų94139.9 Ų139.978%0.77779%0.787SS**  trans-120.874.5164.800000108.3S269S269-A271 VanDerWaalsContact C-N 3.28Å; S269-A271 PolarHBondContact O-N 3.42Å; S269-A271 VanDerWaalsContact O-N 3.13Å
272A29.1Very low32.8Very low85 Ų85138.5 Ų138.570%0.70279%0.794SS**  trans-171.2109.2162.300000106.5
273L29.8Very low32.7Very low150 Ų150139 Ų13979%0.78580%0.798SS**  trans174.786.8148.4-92.8167.4000107.4
274H29.8Very low32.9Very low174 Ų174136.1 Ų136.181%0.80680%0.795SS**  trans-155.7106.9142-100.3-57000107.9
275D32.9Very low32.9Very low167 Ų167134.9 Ų134.989%0.89380%0.799SS**  trans-121.2128.2149.3-113.6-20.4000106.1
276N26.9Very low32.7Very low138 Ų138133.8 Ų133.874%0.73880%0.802SS**  trans-84.4135-178.9-69.4-45.2000109.9
277S38.8Very low32.4Very low118 Ų118137.2 Ų137.283%0.82581%0.808SS**  trans-164.696.9140.74.40000112.3
278E34.4Very low32.3Very low192 Ų192137.1 Ų137.190%0.89781%0.808SS**  trans70.8148141.3-68.8-166.6163.400125.6
279P42.6Very low32.4Very low110 Ų110137.6 Ų137.671%0.71482%0.815SS**  trans-123.7145.8-155.537.7-19.4000114.9
280V31.7Very low32.5Very low139 Ų139140.7 Ų140.784%0.84282%0.816SS**  trans-146.7113.6164.2178.20000112.9
281S33.5Very low32.4Very low117 Ų117140.7 Ų140.782%0.81882%0.816SS**  trans54.5123.2147.575.40000123.1
282G32Very low32.5Very low80 Ų80141 Ų14183%0.82582%0.819SS**  trans157.380155.400000114.2
283T31.8Very low32.5Very low136 Ų136141.6 Ų141.683%0.83482%0.824SS**  trans-62173.616835.40000112.9
284P35.8Very low32.8Very low118 Ų118140.6 Ų140.677%0.76682%0.824SS**  cis-140.5159.9-23.232.5-12.8000114.6
285S35.3Very low33Very low126 Ų126139.8 Ų139.888%0.88182%0.824SS**  -170.8136.6124.373.20000110.1
286S29.6Very low33Very low105 Ų105137.5 Ų137.573%0.73482%0.818SS**  trans-87.1121.2-168.454.70000112.1
287H28Very low33.4Very low177 Ų177139.6 Ų139.682%0.81982%0.821SS**  trans168.989.1133.1-97.2-69000108.9
288V31Very low32.9Very low139 Ų139142.4 Ų142.484%0.84282%0.821SS**  trans-133.5113.5159.7-179.10000107.3Q290V288-Q290 PolarHBondContact O-N 3.43Å; V288-Q290 VanDerWaalsContact O-N 3.1Å
289L34Very low32.8Very low174 Ų174141 Ų14191%0.91182%0.818SS**  trans-63.8106.2173.4-78.3161.2000109.2R291L289-R291 PolarHBondContact O-N 2.92Å
290Q33.3Very low32.2Very low182 Ų182140.7 Ų140.785%0.8583%0.825SS**  trans-79.2114.9170.9-121.3175-2.300110V288V288-Q290 PolarHBondContact O-N 3.43Å; V288-Q290 VanDerWaalsContact O-N 3.1Å
291R32.2Very low32.1Very low234 Ų234138.1 Ų138.188%0.88382%0.818SS**  trans23.9128.5142.1-66.8179.1174.7174.4-2.5119.4L289L289-R291 PolarHBondContact O-N 2.92Å
292A30.7Very low31.9Very low100 Ų100141.7 Ų141.783%0.82682%0.822SS**  trans-132.996.4134.700000109.1
293A28.4Very low31.9Very low98 Ų98149.4 Ų149.481%0.8183%0.826SS**  trans-109.393.7157.400000106
294T37.2Very low31.7Very low128 Ų128148.7 Ų148.779%0.78582%0.824SS**  trans-102.5113.9167.524.40000107.9
295I32.5Very low31.5Very low158 Ų158150.9 Ų150.981%0.8183%0.827SS**  trans-71.9139.2163.7-61.6161.7000107.6
296P34.4Very low31.4Very low118 Ų118148.6 Ų148.677%0.76682%0.816SS**  trans-117.5125153.7190000111.1
297K34.1Very low31.4Very low182 Ų182150 Ų15079%0.79182%0.821SS**  trans-64145.2161.4-73.1178.6172.2-176.90109.6
298E28.6Very low31.6Very low178 Ų178147.6 Ų147.683%0.83282%0.818SS**  trans37.1111.6155.3-76.3174.4134.400118.4
299I32.7Very low31.5Very low161 Ų161149 Ų14983%0.82682%0.816SS**  trans-145.1111.7131.5-79.6119.8000107.2A301I299-A301 HydrophobicContact CG2-CB 4.28Å
300A30.2Very low31.3Very low105 Ų105148.8 Ų148.887%0.86882%0.815SS**  trans-70.7114.4152.500000107.9
301A29.9Very low31.2Very low84 Ų84143.8 Ų143.869%0.69480%0.8SS**  trans175.4111.515300000109.4I299I299-A301 HydrophobicContact CG2-CB 4.28Å
302E27.9Very low31.1Very low193 Ų193138.9 Ų138.990%0.90280%0.796SS**  trans-7.6115.9156-60.6173.5150.900116.9
303R31.5Very low31.3Very low241 Ų241139.8 Ų139.891%0.90979%0.793SS**  trans-155.4145.6139.4-77.5-151.3175.3162.3-1.1111.2
304P29.5Very low31.4Very low121 Ų121146.7 Ų146.779%0.78680%0.798SS**  trans-77.4147.3-16432.2-34.4000112.3A306P304-A306 PolarHBondContact O-N 3.01Å
305I31.7Very low31.2Very low165 Ų165146.2 Ų146.285%0.84680%0.795SS**  trans-59.7103.1177.5-61.2164.8000109T307I305-T307 PolarHBondContact O-N 3.37Å
306A31.5Very low31.3Very low78 Ų78144.3 Ų144.365%0.64579%0.794SS**  trans-67.6117.7164.900000108.5P304 T308P304-A306 PolarHBondContact O-N 3.01Å; A306-T308 VanDerWaalsContact C-N 3.32Å; A306-T308 PolarHBondContact O-N 2.89Å
307T30Very low31.1Very low135 Ų135146.1 Ų146.183%0.82880%0.797SS**  trans-64.886.1169.248.90000109.9I305 Q309I305-T307 PolarHBondContact O-N 3.37Å; T307-Q309 PolarHBondContact O-N 3.22Å
308T33.2Very low31.1Very low126 Ų126148.7 Ų148.777%0.77380%0.802SS**  trans-85.6113.7171.1-42.60000109.1A306 L310A306-T308 VanDerWaalsContact C-N 3.32Å; A306-T308 PolarHBondContact O-N 2.89Å; T308-L310 PolarHBondContact O-N 3.39Å
309Q27.8Very low31.3Very low168 Ų168147.4 Ų147.479%0.78580%0.799SS**  trans-54.7116.1179.9-63.1-179-8.100111.6T307 S311T307-Q309 PolarHBondContact O-N 3.22Å; Q309-S311 PolarHBondContact O-N 3.47Å
310L31Very low31.5Very low170 Ų170145 Ų14589%0.8979%0.792SS**  trans-74.979.2161.6-89.8156000108.4T308T308-L310 PolarHBondContact O-N 3.39Å
311S30.9Very low31.6Very low77 Ų77150.1 Ų150.154%0.53879%0.794SS.*  trans-106.7126.2168.553.80000110.4Q309Q309-S311 PolarHBondContact O-N 3.47Å
312T30.5Very low31.9Very low131 Ų131153 Ų15380%0.80480%0.797SS**  trans88.3125.3162.264.50000119.4
313P34.3Very low32.3Very low119 Ų119149.3 Ų149.377%0.77378%0.784SS**  trans-71.8139.2168.729.9-29.6000109.8T315P313-T315 PolarHBondContact O-N 3.18Å
314R31.2Very low32.6Very low242 Ų242147 Ų14791%0.91378%0.784SS**  trans-58.199.1179.9-169.8175.4-175.3164.30111.1
315T31.4Very low33Very low118 Ų118148 Ų14872%0.72478%0.782SS**  trans-65.7135.9157.522.40000108.8P313 D317P313-T315 PolarHBondContact O-N 3.18Å; T315-D317 PolarHBondContact O-N 2.97Å
316P35.2Very low33.2Very low119 Ų119146.4 Ų146.477%0.77377%0.774SS**  trans-67.1125.4178.226.3-30.7000110R318P316-R318 VanDerWaalsContact C-N 3.28Å; P316-R318 PolarHBondContact O-N 3.48Å
317D29.6Very low33.3Very low156 Ų156148.1 Ų148.183%0.83478%0.779SS**  trans-63.186171.5-79.2-40.9000110.5T315T315-D317 PolarHBondContact O-N 2.97Å
318R34.2Very low33.3Very low236 Ų236153 Ų15389%0.89178%0.784SS**  trans-135.752.5155.9-108.6-172.1-177.7-171.22.5109.3P316 T320P316-R318 VanDerWaalsContact C-N 3.28Å; P316-R318 PolarHBondContact O-N 3.48Å; R318-T320 PolarHBondContact O-N 2.97Å
319I32.6Very low33.6Very low150 Ų150151.5 Ų151.577%0.76978%0.778SS**  trans-85.193.7154.9-59.8176.2000105.4K321I319-K321 PolarHBondContact O-N 3.47Å
320T37Very low33.9Very low112 Ų112146.9 Ų146.969%0.68776%0.763SS**  trans-46128.5154.531.50000107.7R318 L322R318-T320 PolarHBondContact O-N 2.97Å; T320-L322 VanDerWaalsContact C-N 3.33Å; T320-L322 PolarHBondContact O-N 3.25Å
321K32.8Very low34.8Very low211 Ų211142.4 Ų142.492%0.91775%0.746SS**  trans-45.999.7170.3-75.4177.5174.9178.90108.5I319 N323I319-K321 PolarHBondContact O-N 3.47Å; K321-N323 PolarHBondContact O-N 2.99Å
322L37.2Very low35.5Very low144 Ų144144.3 Ų144.375%0.75475%0.749SS**  trans-78.2108.2179-148.896.1000105.9T320 E324T320-L322 VanDerWaalsContact C-N 3.33Å; T320-L322 PolarHBondContact O-N 3.25Å; L322-E324 PolarHBondContact O-N 3.48Å
323N35.7Very low36.2Very low116 Ų116148 Ų14862%0.6275%0.748SS**  trans-47.2117.5173.9-158.5-0000109.6K321 N325K321-N323 PolarHBondContact O-N 2.99Å; N323-N325 PolarHBondContact O-N 3.35Å
324E36.9Very low36.7Very low194 Ų194149.4 Ų149.491%0.90774%0.742SS**THydrogen-bonded Turntrans-6714.6-173.8-68.2-178.7157.600114.6L322L322-E324 PolarHBondContact O-N 3.48Å
325N38.6Very low37.3Very low142 Ų142144 Ų14476%0.75972%0.722SS**THydrogen-bonded Turntrans-119.322.9-172.4-81.7-24.6000115.5N323N323-N325 PolarHBondContact O-N 3.35Å
326I35.3Very low37.9Very low130 Ų130142.5 Ų142.567%0.66771%0.713SS**  trans-111.7118.9174.6-53.3178.5000110.1Y328I326-Y328 PolarHBondContact O-N 3.07Å
327P34.7Very low38.3Very low115 Ų115141.8 Ų141.875%0.74770%0.702SS**  trans-66.4129.317727.9-31.1000109.6S329P327-S329 PolarHBondContact O-N 3.39Å
328Y28.8Very low39.3Very low237 Ų237136.9 Ų136.993%0.92968%0.683SS**  trans-31.5113.3179.8-86.1-101.1000114.5I326I326-Y328 PolarHBondContact O-N 3.07Å
329S39.9Very low39.8Very low94 Ų94130.1 Ų130.166%0.65767%0.668SS**PPolyproline II helixtrans-88.1131.4156.777.30000108.9P327P327-S329 PolarHBondContact O-N 3.39Å
330P34.9Very low40.4Very low71 Ų71126.8 Ų126.846%0.46166%0.657SS.*PPolyproline II helixtrans-64.7140.9176.8-16.128.5000110.5K334 R335P330-K334 HydrophobicContact CB-CB 3.96Å; P330-K334 HydrophobicContact CB-CD 4.45Å; P330-R335 PolarHBondContact O-NE 3.46Å
331S48.2Very low41Very low76 Ų76127 Ų12753%0.53165%0.65SS.*PPolyproline II helixtrans-52148.2175.861.20000111.2R333 K334 R335S331-R333 PolarHBondContact O-N 3.24Å; S331-K334 WeakPolarHBondContact O-CA 3.3Å; S331-K334 PolarHBondContact O-N 2.88Å; S331-R335 PolarHBondContact O-N 2.98Å
332L46.7Very low41.4Very low117 Ų117122 Ų12261%0.61363%0.63SS**Hα-helixtrans-48.3-38.4-175.4-132.1110.6000112.3K334 R335 T336L332-K334 VanDerWaalsContact C-N 3.33Å; L332-K334 PolarHBondContact O-N 3.16Å; L332-R335 PolarHBondContact O-N 3.42Å; L332-R335 VanDerWaalsContact O-N 3.08Å; L332-T336 PolarHBondContact O-N 2.9Å; L332-T336 PolarHBondContact O-OG1 3.47Å
333R44.3Very low41.7Very low209 Ų209120.6 Ų120.679%0.78962%0.623SS**Hα-helixtrans-62.3-32.1177.8-148175-171.9-175.61.8114.2S331 L337S331-R333 PolarHBondContact O-N 3.24Å; R333-L337 PolarHBondContact O-N 2.9Å
334K45.7Very low42.1Very low148 Ų148119.4 Ų119.464%0.64362%0.62SS**Hα-helixtrans-78.3-30.2173.1-81.1-172.7174.4-177.20112.5P330 S331 L332 A338P330-K334 HydrophobicContact CB-CB 3.96Å; P330-K334 HydrophobicContact CB-CD 4.45Å; S331-K334 WeakPolarHBondContact O-CA 3.3Å; S331-K334 PolarHBondContact O-N 2.88Å; L332-K334 VanDerWaalsContact C-N 3.33Å; L332-K334 PolarHBondContact O-N 3.16Å; K334-A338 WeakPolarHBondContact O-CB 3.42Å; K334-A338 PolarHBondContact O-N 2.69Å
335R43.7Very low42.4Very low130 Ų130120.1 Ų120.149%0.49161%0.614SS.*Hα-helixtrans-71.4-41.1175.7-76.9-172.6-85.7155.3-3.3112P330 S331 L332 A338 V339P330-R335 PolarHBondContact O-NE 3.46Å; S331-R335 PolarHBondContact O-N 2.98Å; L332-R335 PolarHBondContact O-N 3.42Å; L332-R335 VanDerWaalsContact O-N 3.08Å; R335-A338 PolarHBondContact O-N 3.39Å; R335-V339 WeakPolarHBondContact O-CG2 3.42Å; R335-V339 PolarHBondContact O-N 2.86Å
336T44.9Very low42.5Very low86 Ų86120.5 Ų120.553%0.52861%0.61SS.*Hα-helixtrans-68.6-37.1178.4-420000112.3L332 C340L332-T336 PolarHBondContact O-N 2.9Å; L332-T336 PolarHBondContact O-OG1 3.47Å; T336-C340 PolarHBondContact O-N 2.91Å; T336-C340 PolarHBondContact O-SG 3.45Å
337L43.6Very low42.7Very low103 Ų103119.1 Ų119.154%0.53961%0.611SS.*Hα-helixtrans-70.3-36.5176.1-77.9167.1000112.9R333 V339 C340 E341R333-L337 PolarHBondContact O-N 2.9Å; L337-V339 PolarHBondContact O-N 2.74Å; L337-C340 PolarHBondContact O-N 3.44Å; L337-E341 WeakPolarHBondContact O-CB 3.36Å; L337-E341 WeakPolarHBondContact O-CG 3.3Å; L337-E341 PolarHBondContact O-N 3Å
338A49.7Very low43Very low54 Ų54117.9 Ų117.945%0.44661%0.605SS.*Hα-helixtrans-66-36.8176.800000112.7K334 R335 E342K334-A338 WeakPolarHBondContact O-CB 3.42Å; K334-A338 PolarHBondContact O-N 2.69Å; R335-A338 PolarHBondContact O-N 3.39Å; A338-E342 WeakPolarHBondContact O-CB 3.5Å; A338-E342 PolarHBondContact O-N 3.38Å
339V45.7Very low43.1Very low94 Ų94115.1 Ų115.157%0.5760%0.603SS**Hα-helixtrans-71.6-35.4177175.60000111.6R335 L337R335-V339 WeakPolarHBondContact O-CG2 3.42Å; R335-V339 PolarHBondContact O-N 2.86Å; L337-V339 PolarHBondContact O-N 2.74Å
340C44.1Very low43Very low79 Ų79120.2 Ų120.253%0.53461%0.613SS.*Hα-helixtrans-73.2-37.3174.2-69.80000112.7T336 L337 T344T336-C340 PolarHBondContact O-N 2.91Å; T336-C340 PolarHBondContact O-SG 3.45Å; L337-C340 PolarHBondContact O-N 3.44Å; C340-T344 PolarHBondContact O-N 2.94Å; C340-T344 PolarHBondContact O-OG1 3.39Å; C340-T344 VanDerWaalsContact O-OG1 3.12Å
341E48.7Very low42.8Very low118 Ų118121.6 Ų121.655%0.55163%0.631SS**Hα-helixtrans-71.6-33.8177.6-77.4-175.8173.900113L337 T344 R345L337-E341 WeakPolarHBondContact O-CB 3.36Å; L337-E341 WeakPolarHBondContact O-CG 3.3Å; L337-E341 PolarHBondContact O-N 3Å; E341-T344 WeakPolarHBondContact CA-OG1 3.32Å; E341-T344 PolarHBondContact O-N 3.49Å; E341-T344 PolarHBondContact O-OG1 3.07Å; E341-R345 PolarHBondContact O-N 2.97Å
342E42.6Very low42.3Very low104 Ų104125.6 Ų125.649%0.48665%0.645SS.*Hα-helixtrans-68.6-35.6178.5-162.9178.5160.800112.6A338 R345 K346A338-E342 WeakPolarHBondContact O-CB 3.5Å; A338-E342 PolarHBondContact O-N 3.38Å; E342-R345 PolarHBondContact O-N 3.39Å; E342-K346 HydrophobicContact CG-CD 4.46Å; E342-K346 PolarHBondContact O-N 3.16Å; E342-K346 IonicContact OE1-NZ 3.86Å; E342-K346 PolarHBondContact OE1-NZ 2.75Å
343N43.9Very low41.6Very low115 Ų115126 Ų12662%0.61565%0.652SS**Hα-helixtrans-70.2-36.3174.4-82-12.1000112.4S347N343-S347 PolarHBondContact O-N 3.27Å
344T42.5Very low41.1Very low91 Ų91123.7 Ų123.756%0.55866%0.655SS**Hα-helixtrans-72-30.2174.742.60000113.2C340 E341 S347C340-T344 PolarHBondContact O-N 2.94Å; C340-T344 PolarHBondContact O-OG1 3.39Å; C340-T344 VanDerWaalsContact O-OG1 3.12Å; E341-T344 WeakPolarHBondContact CA-OG1 3.32Å; E341-T344 PolarHBondContact O-N 3.49Å; E341-T344 PolarHBondContact O-OG1 3.07Å; T344-S347 PolarHBondContact O-OG 2.86Å
345R43Very low40.7Very low209 Ų209122.2 Ų122.279%0.78966%0.66SS**Hα-helixtrans-78.6-28.4175.1-85-176.8171.3167-0114E341 E342 S347E341-R345 PolarHBondContact O-N 2.97Å; E342-R345 PolarHBondContact O-N 3.39Å; R345-S347 VanDerWaalsContact C-N 3.31Å
346K41.1Very low40.1Very low151 Ų151120.4 Ų120.466%0.65767%0.667SS**Hα-helixtrans-76.3-14172.4-78.5173.2173.5160.90113.9E342E342-K346 HydrophobicContact CG-CD 4.46Å; E342-K346 PolarHBondContact O-N 3.16Å; E342-K346 IonicContact OE1-NZ 3.86Å; E342-K346 PolarHBondContact OE1-NZ 2.75Å
347S40.8Very low39.4Very low100 Ų100124.5 Ų124.570%0.69968%0.681SS**THydrogen-bonded Turntrans-92.41.317783.80000115.2N343 T344 R345N343-S347 PolarHBondContact O-N 3.27Å; T344-S347 PolarHBondContact O-OG 2.86Å; R345-S347 VanDerWaalsContact C-N 3.31Å
348S39.7Very low38.8Very low89 Ų89125.2 Ų125.262%0.62269%0.689SS**SBendtrans-120.759.2-176.4171.50000111.8
349M32.1Very low37.8Very low180 Ų180134.3 Ų134.389%0.88771%0.714SS**SBendtrans-178.7122.3150-105.2163.3101.700109.2
350K36.3Very low37.1Very low200 Ų200135.6 Ų135.687%0.8772%0.721SS**  trans91.1102.2-175.3-62.1-178.7174.1-179.60114.8I352K350-I352 PolarHBondContact O-N 2.95Å; K350-I352 VanDerWaalsContact O-N 3.16Å
351A32.2Very low36.4Very low100 Ų100136.2 Ų136.283%0.82673%0.727SS**  trans-47.1116.1155.100000109.5T353A351-T353 PolarHBondContact O-N 3.45Å
352I36.4Very low35.4Very low161 Ų161136.3 Ų136.383%0.82674%0.739SS**  trans-84.9100.9161.4-61.4175.1000105.1K350 L354K350-I352 PolarHBondContact O-N 2.95Å; K350-I352 VanDerWaalsContact O-N 3.16Å; I352-L354 PolarHBondContact O-N 3.49Å
353T32.6Very low34.8Very low126 Ų126138.2 Ų138.277%0.77375%0.752SS**  trans-45.4126.1162.311.30000109.9A351A351-T353 PolarHBondContact O-N 3.45Å
354L34.2Very low34.1Very low160 Ų160138.2 Ų138.284%0.83876%0.756SS**  trans-50.6138.4166.6-78.3143000110.3I352 S356I352-L354 PolarHBondContact O-N 3.49Å; L354-S356 PolarHBondContact O-N 2.9Å
355P36.5Very low33.5Very low116 Ų116142.7 Ų142.775%0.75377%0.768SS**  trans-72.4110.5145.98.29000107.1
356S31.5Very low33Very low93 Ų93137.2 Ų137.265%0.6576%0.758SS**  trans-56149.8152.748.70000109.5L354L354-S356 PolarHBondContact O-N 2.9Å
357E30.4Very low32.7Very low172 Ų172135.5 Ų135.580%0.80476%0.76SS**  trans80125.4173.6-48.8168.2-175.800112.8
358T30.1Very low32.2Very low117 Ų117137.3 Ų137.372%0.71876%0.762SS**  cis-163.311416-10.30000105.9V360T358-V360 VanDerWaalsContact C-N 3.26Å; T358-V360 PolarHBondContact O-N 3.08Å
359Y29.1Very low32Very low246 Ų246141.7 Ų141.797%0.96577%0.769SS**  trans-73.391.1159.3-89.1-89.9000106.7S361Y359-S361 PolarHBondContact O-N 3.05Å; Y359-S361 VanDerWaalsContact O-N 3.15Å
360V31.2Very low31.9Very low120 Ų120141.6 Ų141.673%0.72777%0.767SS**  trans-63.1114.7162.71750000106.3T358 C362T358-V360 VanDerWaalsContact C-N 3.26Å; T358-V360 PolarHBondContact O-N 3.08Å; V360-C362 PolarHBondContact O-N 2.63Å
361S30.3Very low31.6Very low92 Ų92138.7 Ų138.764%0.64377%0.766SS**  trans-51.5107.9167.259.10000108.7Y359 N363Y359-S361 PolarHBondContact O-N 3.05Å; Y359-S361 VanDerWaalsContact O-N 3.15Å; S361-N363 VanDerWaalsContact C-N 3.34Å; S361-N363 PolarHBondContact O-N 3.39Å
362C28Very low31.8Very low120 Ų120139 Ų13981%0.81176%0.761SS**  trans-69103.1162.9-144.20000105.7V360 V364V360-C362 PolarHBondContact O-N 2.63Å; C362-V364 PolarHBondContact O-N 3.4Å
363N28.3Very low31.6Very low144 Ų144142.7 Ų142.777%0.7777%0.765SS**  trans-54.188.6169.1-95.2-37.5000108.9S361 K365S361-N363 VanDerWaalsContact C-N 3.34Å; S361-N363 PolarHBondContact O-N 3.39Å; N363-K365 VanDerWaalsContact C-N 3.31Å; N363-K365 PolarHBondContact O-N 3.24Å; N363-K365 VanDerWaalsContact O-N 3.11Å
364V30.3Very low31.8Very low115 Ų115142.8 Ų142.870%0.69777%0.765SS**  trans-71.3100.3154.3-176.90000104.4C362 V366C362-V364 PolarHBondContact O-N 3.4Å; V364-V366 HydrophobicContact CG1-CG2 3.88Å; V364-V366 PolarHBondContact O-N 2.94Å
365K30.2Very low31.6Very low185 Ų185143 Ų14380%0.80477%0.766SS**  trans-59.885.4156.7-76.9-177176.91790106.6N363 V367N363-K365 VanDerWaalsContact C-N 3.31Å; N363-K365 PolarHBondContact O-N 3.24Å; N363-K365 VanDerWaalsContact O-N 3.11Å; K365-V367 VanDerWaalsContact C-N 3.28Å; K365-V367 PolarHBondContact O-N 3.1Å
366V32.3Very low32.1Very low94 Ų94144 Ų14457%0.5776%0.764SS**  trans-63.5102.9153.9-179.40000103.8V364 D368V364-V366 HydrophobicContact CG1-CG2 3.88Å; V364-V366 PolarHBondContact O-N 2.94Å; V366-D368 HydrophobicContact CG1-CB 4.31Å; V366-D368 PolarHBondContact O-N 3.48Å
367V33.9Very low32.6Very low116 Ų116150.8 Ų150.870%0.70379%0.792SS**  trans-69.278.8161.7178.10000105.2K365 K369K365-V367 VanDerWaalsContact C-N 3.28Å; K365-V367 PolarHBondContact O-N 3.1Å; V367-K369 HydrophobicContact CG1-CG 4.1Å; V367-K369 PolarHBondContact O-N 2.84Å
368D30Very low32.7Very low138 Ų138149.8 Ų149.874%0.73879%0.792SS**  trans-70.281.8157.9-89.1-24.6000106V366 Q370V366-D368 HydrophobicContact CG1-CB 4.31Å; V366-D368 PolarHBondContact O-N 3.48Å; D368-Q370 VanDerWaalsContact C-N 3.27Å; D368-Q370 PolarHBondContact O-N 3.31Å
369K36Very low32.8Very low181 Ų181151.5 Ų151.579%0.78780%0.795SS**  trans-64.4101.9153.9-96-176.2176.5-179.10106.1V367 V371V367-K369 HydrophobicContact CG1-CG 4.1Å; V367-K369 PolarHBondContact O-N 2.84Å; K369-V371 PolarHBondContact O-N 3.49Å
370Q29.7Very low33Very low178 Ų178146.2 Ų146.283%0.83279%0.786SS**  trans-27.6108.9155.5-80.6174.5-4200111.3D368D368-Q370 VanDerWaalsContact C-N 3.27Å; D368-Q370 PolarHBondContact O-N 3.31Å
371V31.5Very low33.1Very low139 Ų139147.8 Ų147.884%0.84279%0.789SS**  trans-118.369.2146.5-172.60000106K369K369-V371 PolarHBondContact O-N 3.49Å
372S36.5Very low33.3Very low105 Ų105151.3 Ų151.373%0.73480%0.799SS**  trans-80.8114.6156.7-81.70000107.6T374S372-T374 PolarHBondContact O-N 3.4Å
373R31.2Very low33.7Very low239 Ų239153.3 Ų153.390%0.90280%0.798SS**  trans-30.1121.5166.5-66.9165.7168.3166.1-4.8112.4
374T36.2Very low34Very low128 Ų128154 Ų15479%0.78580%0.8SS**  trans-119.7107.5147.6-51.50000106.8S372 I376S372-T374 PolarHBondContact O-N 3.4Å; T374-I376 HydrophobicContact CG2-CD1 4.31Å; T374-I376 HydrophobicContact CG2-CG1 4.13Å
375L30.9Very low34.3Very low164 Ų164157 Ų15786%0.85981%0.808SS**  trans-10999.8166.5-152160.3000103.4
376I46.9Very low34.7Very low138 Ų138154.7 Ų154.771%0.70881%0.808SS**  trans-141.4113.2166.9-60.6-178.1000106.8T374T374-I376 HydrophobicContact CG2-CD1 4.31Å; T374-I376 HydrophobicContact CG2-CG1 4.13Å
377L41.1Very low34.9Very low236 Ų236160.2 Ų160.2100%1.23683%0.83SS**  trans70.30168.9-64.5166.2000118.4

Retrieved 377 of 377 residues in 325.6 ms (Link to these results)