A0A3Q0KLC9_SCHMA Loading...

Solute carrier family 25 member 46 AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KLC9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 478 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.5Very low45.9Very low154 Ų15484.9 Ų84.976%0.75940%0.396SS*.  0-44.80-147.4177.5-177.200111.4R5M1-R5 PolarHBondContact O-N 2.99Å
2Y37.9Very low46.4Very low65 Ų6585.9 Ų85.926%0.25540%0.399SS..Hα-helixtrans-67-38.5-178.8-61.7-69000115.1E4 L6 L336Y2-E4 PolarHBondContact O-N 3.07Å; Y2-L6 WeakPolarHBondContact O-CB 3.27Å; Y2-L6 PolarHBondContact O-N 2.87Å; Y2-L336 HydrophobicContact CD1-CD2 4.37Å; Y2-L336 HydrophobicContact CE1-CD2 3.77Å
3S43.4Very low46.2Very low34 Ų3487.5 Ų87.524%0.23841%0.411CS..Hα-helixtrans-68.3-36178.969.30000113.6L6 K7S3-L6 PolarHBondContact O-N 2.82Å; S3-K7 WeakPolarHBondContact O-CG 3.38Å; S3-K7 PolarHBondContact O-N 3.47Å
4E49.1Very low46.4Very low91 Ų9188.3 Ų88.343%0.42542%0.424SS..Hα-helixtrans-69-40.9179-70.7-70.1136.200111.4Y2 K7 Y8Y2-E4 PolarHBondContact O-N 3.07Å; E4-K7 PolarHBondContact O-N 3.43Å; E4-Y8 PolarHBondContact O-N 3.05Å
5R48.4Very low46.1Very low84 Ų8491.5 Ų91.532%0.31744%0.438SS..Hα-helixtrans-68.9-36.1174.6-104.4-166.7170.2178.8-2.4112.3M1 Y8 L9 D335M1-R5 PolarHBondContact O-N 2.99Å; R5-Y8 PolarHBondContact O-N 2.98Å; R5-L9 WeakPolarHBondContact O-CB 3.33Å; R5-L9 VanDerWaalsContact O-CG 3.3Å; R5-L9 WeakPolarHBondContact O-CG 3.29Å; R5-L9 PolarHBondContact O-N 2.99Å; R5-D335 IonicContact CZ-OD1 2.68Å; R5-D335 IonicContact CZ-OD2 3.66Å; R5-D335 IonicContact NH1-OD1 2.74Å; R5-D335 PolarHBondContact NH1-OD1 3Å; R5-D335 IonicContact NH1-OD2 3.42Å; R5-D335 PolarHBondContact NH1-OD2 3.4Å
6L42.3Very low45.6Very low65 Ų6591.9 Ų91.934%0.3444%0.444SS..Hα-helixtrans-59.2-48.1171.4-91.3158.9000111.2Y2 S3 Y8 L9 E10 I56Y2-L6 WeakPolarHBondContact O-CB 3.27Å; Y2-L6 PolarHBondContact O-N 2.87Å; S3-L6 PolarHBondContact O-N 2.82Å; L6-Y8 VanDerWaalsContact C-N 3.32Å; L6-Y8 PolarHBondContact O-N 3.36Å; L6-L9 PolarHBondContact O-N 3.05Å; L6-E10 VanDerWaalsContact O-CB 3.32Å; L6-E10 WeakPolarHBondContact O-CB 3.41Å; L6-E10 PolarHBondContact O-N 3.2Å; L6-I56 HydrophobicContact CD1-CG2 4.14Å
7K48.9Very low45Very low72 Ų7288.8 Ų88.831%0.31344%0.441SS..Hα-helixtrans-58.6-40.8174.1-75.3-178.8178.9179.80113S3 E4 N11S3-K7 WeakPolarHBondContact O-CG 3.38Å; S3-K7 PolarHBondContact O-N 3.47Å; E4-K7 PolarHBondContact O-N 3.43Å; K7-N11 WeakPolarHBondContact O-CB 3.28Å; K7-N11 PolarHBondContact O-N 3.33Å
8Y53.8Low44.4Very low141 Ų14188.4 Ų88.455%0.55345%0.448SS*.Hα-helixtrans-65.8-43.8177.3175.7-97.9000112.3E4 R5 L6 K12E4-Y8 PolarHBondContact O-N 3.05Å; R5-Y8 PolarHBondContact O-N 2.98Å; L6-Y8 VanDerWaalsContact C-N 3.32Å; L6-Y8 PolarHBondContact O-N 3.36Å; Y8-K12 WeakPolarHBondContact O-CB 3.31Å; Y8-K12 PolarHBondContact O-N 3.25Å
9L43.2Very low44Very low43 Ų4388.2 Ų88.223%0.22545%0.452CS..Hα-helixtrans-67.8-38.8178.6-71171.6000111.8R5 L6 K12 L13R5-L9 WeakPolarHBondContact O-CB 3.33Å; R5-L9 VanDerWaalsContact O-CG 3.3Å; R5-L9 WeakPolarHBondContact O-CG 3.29Å; R5-L9 PolarHBondContact O-N 2.99Å; L6-L9 PolarHBondContact O-N 3.05Å; L9-K12 PolarHBondContact O-N 3.15Å; L9-L13 PolarHBondContact O-N 3.47Å
10E53.6Low43.6Very low79 Ų7986.6 Ų86.637%0.36945%0.449SS..Hα-helixtrans-62.3-48.6174.7-175.5174.3-159.600111.5L6 K12 L13 V14 P49L6-E10 VanDerWaalsContact O-CB 3.32Å; L6-E10 WeakPolarHBondContact O-CB 3.41Å; L6-E10 PolarHBondContact O-N 3.2Å; E10-K12 PolarHBondContact O-N 3.34Å; E10-L13 WeakPolarHBondContact O-CB 3.17Å; E10-L13 PolarHBondContact O-N 3.47Å; E10-L13 VanDerWaalsContact O-N 3.16Å; E10-V14 WeakPolarHBondContact O-CG2 3.41Å; E10-V14 PolarHBondContact O-N 3.46Å; E10-P49 WeakPolarHBondContact OE1-CB 3.38Å
11N47.2Very low43.2Very low106 Ų10688.6 Ų88.657%0.56746%0.46SS*.Hα-helixtrans-59.9-35.6175.3-79.9-18.1000112.6K7 Q15K7-N11 WeakPolarHBondContact O-CB 3.28Å; K7-N11 PolarHBondContact O-N 3.33Å; N11-Q15 WeakPolarHBondContact O-CG 3.49Å; N11-Q15 PolarHBondContact O-N 2.99Å; N11-Q15 VanDerWaalsContact O-N 3.17Å
12K51.1Low43.1Very low97 Ų9784.3 Ų84.342%0.42245%0.45SS..Hα-helixtrans-68.9-42176.9-158.3-174.3177.9-161.30111.5Y8 L9 E10 Q15 D16Y8-K12 WeakPolarHBondContact O-CB 3.31Å; Y8-K12 PolarHBondContact O-N 3.25Å; L9-K12 PolarHBondContact O-N 3.15Å; E10-K12 PolarHBondContact O-N 3.34Å; K12-Q15 PolarHBondContact O-N 3.47Å; K12-D16 PolarHBondContact O-N 2.95Å
13L43.6Very low42.9Very low107 Ų10789.9 Ų89.956%0.5648%0.475SS*.Hα-helixtrans-61.8-41.1175.2-94.1158.4000112.7L9 E10 G17 I328L9-L13 PolarHBondContact O-N 3.47Å; E10-L13 WeakPolarHBondContact O-CB 3.17Å; E10-L13 PolarHBondContact O-N 3.47Å; E10-L13 VanDerWaalsContact O-N 3.16Å; L13-G17 PolarHBondContact O-N 3.02Å; L13-I328 HydrophobicContact CD1-CD1 4.27Å
14V49.7Very low42.5Very low98 Ų9895.4 Ų95.459%0.59450%0.501SS*.Hα-helixtrans-66.1-38.5177173.50000111.6E10 S18E10-V14 WeakPolarHBondContact O-CG2 3.41Å; E10-V14 PolarHBondContact O-N 3.46Å; V14-S18 PolarHBondContact O-N 3.17Å; V14-S18 VanDerWaalsContact O-N 3.17Å
15Q41.2Very low41.8Very low137 Ų13798.1 Ų98.164%0.6452%0.519SS*.Hα-helixtrans-68.4-45.1177-77.3-177.7-12.200112.4N11 K12 G17 S18 V19N11-Q15 WeakPolarHBondContact O-CG 3.49Å; N11-Q15 PolarHBondContact O-N 2.99Å; N11-Q15 VanDerWaalsContact O-N 3.17Å; K12-Q15 PolarHBondContact O-N 3.47Å; Q15-G17 VanDerWaalsContact C-N 3.33Å; Q15-G17 PolarHBondContact O-N 3.37Å; Q15-S18 PolarHBondContact O-N 3.34Å; Q15-V19 WeakPolarHBondContact O-CG2 3.37Å; Q15-V19 PolarHBondContact O-N 3.35Å
16D38.9Very low41.1Very low98 Ų98103.2 Ų103.252%0.52455%0.546SS..Hα-helixtrans-68.5-32.1179.7-76.1-22.1000112.4K12 S20K12-D16 PolarHBondContact O-N 2.95Å; D16-S20 PolarHBondContact O-N 3.12Å
17G34.5Very low40.6Very low39 Ų39103.2 Ų103.240%0.40256%0.562SS.*Hα-helixtrans-69.5-34.4173.800000113.9L13 Q15L13-G17 PolarHBondContact O-N 3.02Å; Q15-G17 VanDerWaalsContact C-N 3.33Å; Q15-G17 PolarHBondContact O-N 3.37Å
18S34.5Very low39.7Very low81 Ų81105.8 Ų105.857%0.56659%0.586SS**Hα-helixtrans-70.1-37.8176.7-178.80000112.4V14 Q15 S20 N21 A22V14-S18 PolarHBondContact O-N 3.17Å; V14-S18 VanDerWaalsContact O-N 3.17Å; Q15-S18 PolarHBondContact O-N 3.34Å; S18-S20 PolarHBondContact O-N 3.27Å; S18-N21 PolarHBondContact O-N 3.04Å; S18-A22 PolarHBondContact O-N 2.97Å
19V37.6Very low38.8Very low84 Ų84105.1 Ų105.151%0.50960%0.596SS.*Hα-helixtrans-69.1-32.9179.1177.10000112Q15 N21 A22 F23Q15-V19 WeakPolarHBondContact O-CG2 3.37Å; Q15-V19 PolarHBondContact O-N 3.35Å; V19-N21 VanDerWaalsContact C-N 3.33Å; V19-N21 PolarHBondContact O-N 2.77Å; V19-A22 PolarHBondContact O-N 3.48Å; V19-F23 HydrophobicContact CG1-CD2 4.29Å; V19-F23 HydrophobicContact CG1-CE2 4.45Å
20S34.8Very low38.3Very low57 Ų57111.2 Ų111.240%0.39962%0.624SS.*Hα-helixtrans-70.2-26.8176.6-70.40000113.7D16 S18D16-S20 PolarHBondContact O-N 3.12Å; S18-S20 PolarHBondContact O-N 3.27Å
21N35.3Very low37.3Very low128 Ų128115 Ų11568%0.68465%0.647SS**Hα-helixtrans-85-20.7177.3-75.2-21000113.4S18 V19S18-N21 PolarHBondContact O-N 3.04Å; V19-N21 VanDerWaalsContact C-N 3.33Å; V19-N21 PolarHBondContact O-N 2.77Å
22A35Very low36.2Very low65 Ų65115.8 Ų115.854%0.53766%0.659SS.*Hα-helixtrans-77.8-27.1176.100000113.1S18 V19 L24S18-A22 PolarHBondContact O-N 2.97Å; V19-A22 PolarHBondContact O-N 3.48Å; A22-L24 PolarHBondContact O-N 3.39Å
23F33.7Very low35.4Very low181 Ų181120 Ų12079%0.79468%0.68SS**THydrogen-bonded Turntrans-83.3-4.6-177.5-97.7-85.1000115.2V19V19-F23 HydrophobicContact CG1-CD2 4.29Å; V19-F23 HydrophobicContact CG1-CE2 4.45Å
24L35.8Very low34.7Very low150 Ų150124.3 Ų124.379%0.78570%0.697SS**THydrogen-bonded Turntrans-103.13.2-179.5-81.8167.5000114.3A22A22-L24 PolarHBondContact O-N 3.39Å
25N33.9Very low33.8Very low148 Ų148124.6 Ų124.679%0.79170%0.704SS**  trans-127.117.2-169.8-134.918.8000116.3G27N25-G27 PolarHBondContact O-N 2.98Å
26E33.6Very low33.7Very low192 Ų192124.1 Ų124.190%0.89771%0.71SS**  trans-97.287.4174.5-69.8-152.1149.800112.3
27G33.5Very low33.2Very low65 Ų65127.4 Ų127.467%0.6773%0.727SS**  trans-101.4139.415500000109.5N25N25-G27 PolarHBondContact O-N 2.98Å
28P30.1Very low33.4Very low125 Ų125131 Ų13181%0.81274%0.741SS**  trans-80.9145.3-172.533.3-32000110.8
29V34.1Very low33.3Very low128 Ų128136.2 Ų136.278%0.77675%0.754SS**  trans160.8120.8134.7163.50000111.5
30E31.9Very low33.2Very low170 Ų170137.7 Ų137.779%0.79477%0.765SS**  trans11.2121.7149.2-61.9170.5129.900120
31N32.7Very low33Very low160 Ų160138.5 Ų138.586%0.85678%0.782SS**  179.9138103.6-116.2-27.4000112.4
32C24.9Very low33.2Very low121 Ų121138.3 Ų138.382%0.81879%0.785SS**  trans-71.4126.9171.4-80.80000111.3
33Q34.5Very low33.5Very low187 Ų187138.5 Ų138.587%0.87479%0.787SS**  trans-150115.8147.7-126.8152.5-41.500112.3S35Q33-S35 PolarHBondContact O-N 3.47Å
34E28.1Very low34.2Very low197 Ų197137 Ų13792%0.92179%0.787SS**  trans-54.7117172.8-172.7175.4-174.300111.1
35S31.8Very low34.9Very low104 Ų104135.8 Ų135.873%0.72778%0.781SS**  trans-155.6112.8164.952.40000112.9Q33Q33-S35 PolarHBondContact O-N 3.47Å
36V37.7Very low36.1Very low127 Ų127134.3 Ų134.377%0.7777%0.774SS**  trans52.9105.1146.2-166.40000117.9V38V36-V38 HydrophobicContact CG1-CG2 4.2Å; V36-V38 PolarHBondContact O-N 2.88Å
37D30.1Very low37.8Very low167 Ų167131.1 Ų131.189%0.89376%0.762SS**  trans-65.188.3172.1-147.8-5.8000111.1
38V38Very low39.6Very low115 Ų115131.9 Ų131.970%0.69776%0.757SS**  trans-91.6104.8168.2178.70000107.7V36 P40V36-V38 HydrophobicContact CG1-CG2 4.2Å; V36-V38 PolarHBondContact O-N 2.88Å; V38-P40 WeakPolarHBondContact O-CD 3.49Å
39K31.7Very low41.9Very low190 Ų190127.9 Ų127.983%0.82673%0.731SS**PPolyproline II helixtrans-50.4120.9169-113.5177179.2175.90109.5G41K39-G41 PolarHBondContact O-N 3.12Å
40P35.6Very low43.8Very low115 Ų115123.9 Ų123.975%0.74771%0.711SS**PPolyproline II helixtrans-69123.4171.126.9-29.4000108.3V38 V42V38-P40 WeakPolarHBondContact O-CD 3.49Å; P40-V42 PolarHBondContact O-N 3.48Å
41G30.8Very low46.1Very low73 Ų73121.1 Ų121.175%0.75370%0.701SS**PPolyproline II helixtrans-61.5117.716900000109.3K39 A43K39-G41 PolarHBondContact O-N 3.12Å; G41-A43 VanDerWaalsContact C-N 3.3Å; G41-A43 PolarHBondContact O-N 3Å
42V40.7Very low48.5Very low125 Ų125115.9 Ų115.976%0.75868%0.68SS**  trans-66.994.2168.3177.30000106.6P40P40-V42 PolarHBondContact O-N 3.48Å
43A40Very low51Low68 Ų68110.5 Ų110.556%0.56265%0.645SS**  trans-75.6132.6178.100000110.1G41 N45G41-A43 VanDerWaalsContact C-N 3.3Å; G41-A43 PolarHBondContact O-N 3Å; A43-N45 PolarHBondContact O-N 3.48Å
44D49Very low53Low150 Ų150106 Ų10680%0.80263%0.626SS**G310 helixtrans-24.83.2173.9-58.9-35.2000121.8
45N51.2Low55.6Low124 Ų12498.4 Ų98.466%0.66360%0.601SS**G310 helixtrans-75.8-24.3-177.4-71.6-23.4000114.2A43 L47 S48 P49A43-N45 PolarHBondContact O-N 3.48Å; N45-L47 VanDerWaalsContact C-N 3.27Å; N45-L47 PolarHBondContact O-N 3.46Å; N45-S48 PolarHBondContact O-N 3.42Å; N45-S48 PolarHBondContact O-OG 3.36Å; N45-P49 WeakPolarHBondContact O-CD 3.46Å
46D58.8Low58Low118 Ų11898 Ų9863%0.63159%0.589SS**G310 helixtrans-70.5-19.9-179.7-71.1-17.6000113.6S48 P49D46-S48 VanDerWaalsContact C-N 3.31Å; D46-S48 PolarHBondContact O-N 3.36Å; D46-P49 WeakPolarHBondContact O-CD 3.37Å; D46-P49 WeakPolarHBondContact O-CG 3.47Å
47L68.1Low59.9Low125 Ų12592.6 Ų92.665%0.65456%0.56SS**Hα-helixtrans-70.3-31177.4-176.361.2000111.8N45 L51N45-L47 VanDerWaalsContact C-N 3.27Å; N45-L47 PolarHBondContact O-N 3.46Å; L47-L51 WeakPolarHBondContact O-CB 3.31Å; L47-L51 PolarHBondContact O-N 2.94Å
48S71.2Confident62.3Low81 Ų8188 Ų8857%0.56654%0.538SS*.Hα-helixtrans-66.3-48.1-175.569.10000114.3N45 D46 A52N45-S48 PolarHBondContact O-N 3.42Å; N45-S48 PolarHBondContact O-OG 3.36Å; D46-S48 VanDerWaalsContact C-N 3.31Å; D46-S48 PolarHBondContact O-N 3.36Å; S48-A52 WeakPolarHBondContact O-CB 3.04Å; S48-A52 PolarHBondContact O-N 2.97Å
49P78.2Confident64.6Low41 Ų4185.2 Ų85.227%0.26653%0.526SS..Hα-helixtrans-67.5-39175.326-34.8000112.2E10 N45 D46 L51 A52 G53E10-P49 WeakPolarHBondContact OE1-CB 3.38Å; N45-P49 WeakPolarHBondContact O-CD 3.46Å; D46-P49 WeakPolarHBondContact O-CD 3.37Å; D46-P49 WeakPolarHBondContact O-CG 3.47Å; P49-L51 PolarHBondContact O-N 2.98Å; P49-A52 WeakPolarHBondContact O-CB 3.49Å; P49-A52 PolarHBondContact O-N 3.21Å; P49-G53 PolarHBondContact O-N 3.06Å
50A74.8Confident67.1Low43 Ų4378.7 Ų78.736%0.35551%0.505SS..Hα-helixtrans-63.5-43.9179.300000112.1G53 I54A50-G53 PolarHBondContact O-N 3.33Å; A50-I54 WeakPolarHBondContact O-CG1 3.33Å; A50-I54 PolarHBondContact O-N 3.35Å
51L81.4Confident69.3Low113 Ų11375.3 Ų75.359%0.59248%0.48SS*.Hα-helixtrans-65.9-40.4175-177.262.5000111.2L47 P49 I54 G55L47-L51 WeakPolarHBondContact O-CB 3.31Å; L47-L51 PolarHBondContact O-N 2.94Å; P49-L51 PolarHBondContact O-N 2.98Å; L51-I54 PolarHBondContact O-N 3.06Å; L51-G55 PolarHBondContact O-N 3.34Å
52A81.2Confident72Confident50 Ų5075.9 Ų75.941%0.41346%0.462SS..Hα-helixtrans-60.6-45.6174.300000111.5S48 P49 I54 G55 I56S48-A52 WeakPolarHBondContact O-CB 3.04Å; S48-A52 PolarHBondContact O-N 2.97Å; P49-A52 WeakPolarHBondContact O-CB 3.49Å; P49-A52 PolarHBondContact O-N 3.21Å; A52-I54 PolarHBondContact O-N 3.3Å; A52-G55 PolarHBondContact O-N 3.43Å; A52-I56 WeakPolarHBondContact O-CB 3.47Å; A52-I56 WeakPolarHBondContact O-CD1 3.45Å; A52-I56 WeakPolarHBondContact O-CG1 3.34Å; A52-I56 PolarHBondContact O-N 3Å
53G77.9Confident74.3Confident8 Ų874.3 Ų74.38%0.08245%0.448CS..Hα-helixtrans-63.1-38.6177.600000113.6P49 A50 G57P49-G53 PolarHBondContact O-N 3.06Å; A50-G53 PolarHBondContact O-N 3.33Å; G53-G57 PolarHBondContact O-N 3.17Å
54I77.7Confident76.5Confident92 Ų9275 Ų7547%0.47244%0.44SS..Hα-helixtrans-66-46.7172.2-67.1167.8000110.2A50 L51 A52 I56 G57 V58A50-I54 WeakPolarHBondContact O-CG1 3.33Å; A50-I54 PolarHBondContact O-N 3.35Å; L51-I54 PolarHBondContact O-N 3.06Å; A52-I54 PolarHBondContact O-N 3.3Å; I54-I56 PolarHBondContact O-N 3.26Å; I54-G57 PolarHBondContact O-N 3.01Å; I54-V58 HydrophobicContact CG2-CG2 4.33Å; I54-V58 WeakPolarHBondContact O-CG2 3.3Å; I54-V58 PolarHBondContact O-N 3.09Å
55G81.8Confident78.4Confident38 Ų3868 Ų6839%0.39240%0.403SS..Hα-helixtrans-58.5-46.617900000112.4L51 A52 G57 V58 A59L51-G55 PolarHBondContact O-N 3.34Å; A52-G55 PolarHBondContact O-N 3.43Å; G55-G57 PolarHBondContact O-N 3.46Å; G55-V58 PolarHBondContact O-N 3Å; G55-A59 VanDerWaalsContact O-CB 3.22Å; G55-A59 WeakPolarHBondContact O-CB 3.38Å; G55-A59 PolarHBondContact O-N 2.72Å
56I83Confident80.4Confident94 Ų9465.6 Ų65.648%0.48239%0.39SS..Hα-helixtrans-62-44175.7-67.5162.3000110.4L6 A52 I54 A59 S60L6-I56 HydrophobicContact CD1-CG2 4.14Å; A52-I56 WeakPolarHBondContact O-CB 3.47Å; A52-I56 WeakPolarHBondContact O-CD1 3.45Å; A52-I56 WeakPolarHBondContact O-CG1 3.34Å; A52-I56 PolarHBondContact O-N 3Å; I54-I56 PolarHBondContact O-N 3.26Å; I56-A59 PolarHBondContact O-N 3.11Å; I56-S60 VanDerWaalsContact O-CB 3.3Å; I56-S60 WeakPolarHBondContact O-CB 3.31Å; I56-S60 PolarHBondContact O-N 2.84Å; I56-S60 PolarHBondContact O-OG 2.92Å
57G76.7Confident81.9Confident14 Ų1462.3 Ų62.314%0.14437%0.371CS..Hα-helixtrans-59.5-48.2176.900000112.5G53 I54 G55 S60 M61G53-G57 PolarHBondContact O-N 3.17Å; I54-G57 PolarHBondContact O-N 3.01Å; G55-G57 PolarHBondContact O-N 3.46Å; G57-S60 PolarHBondContact O-N 3.42Å; G57-S60 PolarHBondContact O-OG 2.89Å; G57-M61 PolarHBondContact O-N 3.43Å; G57-M61 VanDerWaalsContact O-N 3.13Å
58V81.3Confident83.1Confident71 Ų7156.8 Ų56.843%0.4334%0.343SS..Hα-helixtrans-65.3-46.2178.2171.10000111.2I54 G55 S60 M61 F62I54-V58 HydrophobicContact CG2-CG2 4.33Å; I54-V58 WeakPolarHBondContact O-CG2 3.3Å; I54-V58 PolarHBondContact O-N 3.09Å; G55-V58 PolarHBondContact O-N 3Å; V58-S60 VanDerWaalsContact C-N 3.33Å; V58-S60 PolarHBondContact O-N 3.28Å; V58-M61 WeakPolarHBondContact O-CB 3.43Å; V58-M61 PolarHBondContact O-N 2.88Å; V58-M61 VanDerWaalsContact O-N 3.16Å; V58-F62 HydrophobicContact CG1-CD2 3.61Å; V58-F62 HydrophobicContact CG1-CE2 3.26Å; V58-F62 HydrophobicContact CG1-CZ 4.39Å; V58-F62 WeakPolarHBondContact O-CD2 3.22Å; V58-F62 PolarHBondContact O-N 3.2Å
59A85.1Confident84.2Confident56 Ų5653 Ų5346%0.46332%0.317SS..Hα-helixtrans-60.6-41.5177.100000112G55 I56 M61 F62 L63G55-A59 VanDerWaalsContact O-CB 3.22Å; G55-A59 WeakPolarHBondContact O-CB 3.38Å; G55-A59 PolarHBondContact O-N 2.72Å; I56-A59 PolarHBondContact O-N 3.11Å; A59-M61 VanDerWaalsContact C-N 3.3Å; A59-M61 PolarHBondContact O-N 2.91Å; A59-F62 PolarHBondContact O-N 3.37Å; A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 2.87Å
60S84.6Confident85Confident53 Ų5351.7 Ų51.737%0.37131%0.309SS..Hα-helixtrans-62.2-38.8176.273.80000112I56 G57 V58 L63 E64I56-S60 VanDerWaalsContact O-CB 3.3Å; I56-S60 WeakPolarHBondContact O-CB 3.31Å; I56-S60 PolarHBondContact O-N 2.84Å; I56-S60 PolarHBondContact O-OG 2.92Å; G57-S60 PolarHBondContact O-N 3.42Å; G57-S60 PolarHBondContact O-OG 2.89Å; V58-S60 VanDerWaalsContact C-N 3.33Å; V58-S60 PolarHBondContact O-N 3.28Å; S60-L63 PolarHBondContact O-N 3.48Å; S60-E64 WeakPolarHBondContact O-CB 3.44Å; S60-E64 PolarHBondContact O-N 3.37Å
61M82.4Confident86Confident45 Ų4551.4 Ų51.422%0.22230%0.299CS..Hα-helixtrans-64.4-43.5175.6-168.4-170102.800111.4G57 V58 A59 V65 R121 L125G57-M61 PolarHBondContact O-N 3.43Å; G57-M61 VanDerWaalsContact O-N 3.13Å; V58-M61 WeakPolarHBondContact O-CB 3.43Å; V58-M61 PolarHBondContact O-N 2.88Å; V58-M61 VanDerWaalsContact O-N 3.16Å; A59-M61 VanDerWaalsContact C-N 3.3Å; A59-M61 PolarHBondContact O-N 2.91Å; M61-V65 WeakPolarHBondContact O-CG2 3.41Å; M61-V65 PolarHBondContact O-N 3.49Å; M61-R121 HydrophobicContact CE-CB 3.36Å; M61-R121 HydrophobicContact CE-CG 4.06Å; M61-R121 HydrophobicContact SD-CB 4.24Å; M61-L125 HydrophobicContact SD-CD1 4.1Å
62F87.6Confident86.6Confident85 Ų8547.8 Ų47.837%0.37328%0.28SS..Hα-helixtrans-62.9-46.3176.3-77-66.1000111.5V58 A59 E64 V65 L66 F118V58-F62 HydrophobicContact CG1-CD2 3.61Å; V58-F62 HydrophobicContact CG1-CE2 3.26Å; V58-F62 HydrophobicContact CG1-CZ 4.39Å; V58-F62 WeakPolarHBondContact O-CD2 3.22Å; V58-F62 PolarHBondContact O-N 3.2Å; A59-F62 PolarHBondContact O-N 3.37Å; F62-E64 PolarHBondContact O-N 3.45Å; F62-V65 PolarHBondContact O-N 3.48Å; F62-L66 WeakPolarHBondContact O-CB 3.41Å; F62-L66 VanDerWaalsContact O-CG 3.26Å; F62-L66 WeakPolarHBondContact O-CG 3.37Å; F62-L66 PolarHBondContact O-N 3.48Å; F62-F118 AromaticContact CD1-CD1 3.52Å; F62-F118 HydrophobicContact CD1-CD1 3.52Å; F62-F118 AromaticContact CD1-CE1 3.21Å; F62-F118 HydrophobicContact CD1-CE1 3.21Å; F62-F118 HydrophobicContact CD1-CE2 4.35Å; F62-F118 HydrophobicContact CD1-CG 4.27Å; F62-F118 AromaticContact CD1-CZ 3.67Å; F62-F118 HydrophobicContact CD1-CZ 3.67Å; F62-F118 AromaticContact CE1-CD1 3.49Å; F62-F118 HydrophobicContact CE1-CD1 3.49Å; F62-F118 VanDerWaalsContact CE1-CD1 3.49Å; F62-F118 HydrophobicContact CE1-CD2 4.46Å; F62-F118 AromaticContact CE1-CE1 3.72Å; F62-F118 HydrophobicContact CE1-CE1 3.72Å; F62-F118 AromaticContact CE1-CG 3.93Å; F62-F118 HydrophobicContact CE1-CG 3.93Å; F62-F118 HydrophobicContact CE1-CZ 4.26Å; F62-F118 HydrophobicContact CG-CE1 4.28Å
63L88.2Confident87.3Confident91 Ų9145.4 Ų45.448%0.47626%0.26SS..Hα-helixtrans-62.9-43-179.4-174.463.3000112A59 S60 V65 L66 L67A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 PolarHBondContact O-N 2.87Å; S60-L63 PolarHBondContact O-N 3.48Å; L63-V65 VanDerWaalsContact C-N 3.32Å; L63-V65 PolarHBondContact O-N 2.96Å; L63-L66 PolarHBondContact O-N 3.33Å; L63-L67 WeakPolarHBondContact O-CB 3.31Å; L63-L67 PolarHBondContact O-N 3.42Å
64E86.3Confident88.1Confident82 Ų8245.6 Ų45.638%0.38326%0.26SS..Hα-helixtrans-58.4-45.3176.4-175.8-179.8170.100111.2S60 F62 S68S60-E64 WeakPolarHBondContact O-CB 3.44Å; S60-E64 PolarHBondContact O-N 3.37Å; F62-E64 PolarHBondContact O-N 3.45Å; E64-S68 WeakPolarHBondContact O-CB 3.47Å; E64-S68 PolarHBondContact O-N 3.32Å; E64-S68 VanDerWaalsContact O-N 3.16Å; E64-S68 PolarHBondContact O-OG 2.89Å
65V90Very high88.9Confident5 Ų541.8 Ų41.83%0.0324%0.239CC..Hα-helixtrans-65.2-49.6176.9173.50000110.5M61 F62 L63 L67 S68 H69 L114 V117 F118 R121M61-V65 WeakPolarHBondContact O-CG2 3.41Å; M61-V65 PolarHBondContact O-N 3.49Å; F62-V65 PolarHBondContact O-N 3.48Å; L63-V65 VanDerWaalsContact C-N 3.32Å; L63-V65 PolarHBondContact O-N 2.96Å; V65-L67 VanDerWaalsContact C-N 3.31Å; V65-L67 PolarHBondContact O-N 2.92Å; V65-S68 PolarHBondContact O-N 2.91Å; V65-S68 PolarHBondContact O-OG 2.9Å; V65-H69 WeakPolarHBondContact O-CB 3.39Å; V65-H69 PolarHBondContact O-N 3.48Å; V65-L114 HydrophobicContact CG1-CD1 3.85Å; V65-V117 HydrophobicContact CG1-CB 4.47Å; V65-V117 HydrophobicContact CG1-CG1 3.7Å; V65-V117 HydrophobicContact CG2-CG1 4.49Å; V65-F118 HydrophobicContact CB-CD1 4.46Å; V65-F118 HydrophobicContact CB-CE1 3.61Å; V65-F118 HydrophobicContact CB-CZ 4.2Å; V65-F118 HydrophobicContact CG1-CD1 4.12Å; V65-F118 HydrophobicContact CG1-CE1 3.44Å; V65-F118 VanDerWaalsContact CG1-CE1 3.44Å; V65-F118 HydrophobicContact CG1-CZ 3.79Å; V65-F118 HydrophobicContact CG2-CE1 4.11Å; V65-R121 HydrophobicContact CG2-CG 4.45Å
66L92.3Very high89.5Confident73 Ų7340.3 Ų40.338%0.38222%0.222SC..Hα-helixtrans-58.8-41.4-177.5-74.3171.5000112.8F62 L63 L114 F118F62-L66 WeakPolarHBondContact O-CB 3.41Å; F62-L66 VanDerWaalsContact O-CG 3.26Å; F62-L66 WeakPolarHBondContact O-CG 3.37Å; F62-L66 PolarHBondContact O-N 3.48Å; L63-L66 PolarHBondContact O-N 3.33Å; L66-L114 HydrophobicContact CD2-CD1 4.22Å; L66-L114 HydrophobicContact CD2-CD2 3.73Å; L66-F118 HydrophobicContact CD2-CZ 4.11Å; L66-F118 HydrophobicContact CG-CZ 4.16Å
67L90.6Very high90Very high48 Ų4835.9 Ų35.925%0.25120%0.199SC..Hα-helixtrans-74.6-35.5-177.6-170.965.7000112.5L63 V65 L418 Q419 F422L63-L67 WeakPolarHBondContact O-CB 3.31Å; L63-L67 PolarHBondContact O-N 3.42Å; V65-L67 VanDerWaalsContact C-N 3.31Å; V65-L67 PolarHBondContact O-N 2.92Å; L67-L418 HydrophobicContact CD1-CD2 3.89Å; L67-L418 HydrophobicContact CG-CD2 4.44Å; L67-Q419 HydrophobicContact CD2-CG 4.2Å; L67-F422 HydrophobicContact CD2-CB 4.48Å; L67-F422 HydrophobicContact CD2-CD1 4.38Å; L67-F422 HydrophobicContact CD2-CG 4.32Å
68S92.7Very high90.9Very high9 Ų935.4 Ų35.46%0.06319%0.194CC..Hα-helixtrans-83.7-25.8-179.156.80000113.5E64 V65 F71 I72E64-S68 WeakPolarHBondContact O-CB 3.47Å; E64-S68 PolarHBondContact O-N 3.32Å; E64-S68 VanDerWaalsContact O-N 3.16Å; E64-S68 PolarHBondContact O-OG 2.89Å; V65-S68 PolarHBondContact O-N 2.91Å; V65-S68 PolarHBondContact O-OG 2.9Å; S68-F71 PolarHBondContact O-N 3.37Å; S68-F71 VanDerWaalsContact O-N 3.11Å; S68-I72 PolarHBondContact O-N 2.88Å
69H94.3Very high91.5Very high1 Ų132 Ų321%0.00517%0.173CC..Hα-helixtrans-54.4-45.4-169.4-168.5-81.7000115.4V65 F71 I72 V73 L110 W111 K112 L114V65-H69 WeakPolarHBondContact O-CB 3.39Å; V65-H69 PolarHBondContact O-N 3.48Å; H69-F71 PolarHBondContact O-N 3.05Å; H69-I72 PolarHBondContact O-N 3.2Å; H69-I72 VanDerWaalsContact O-N 3.11Å; H69-V73 WeakPolarHBondContact CE1-CG2 3.44Å; H69-V73 WeakPolarHBondContact ND1-CG2 3.38Å; H69-V73 WeakPolarHBondContact O-CG2 3.25Å; H69-V73 PolarHBondContact O-N 3.42Å; H69-L110 PolarHBondContact ND1-O 2.94Å; H69-W111 VanDerWaalsContact CE1-C 3.49Å; H69-W111 AromaticContact ND1-CD1 3.84Å; H69-K112 PolarHBondContact CE1-O 3.03Å; H69-K112 PolarHBondContact NE2-O 3.42Å; H69-L114 HydrophobicContact CB-CD1 3.99Å; H69-L114 VanDerWaalsContact CD2-CD1 3.43Å; H69-L114 WeakPolarHBondContact CD2-CD1 3.25Å; H69-L114 VanDerWaalsContact NE2-CA 3.34Å; H69-L114 WeakPolarHBondContact NE2-CA 3.33Å; H69-L114 PolarHBondContact NE2-N 2.87Å
70P95.2Very high91.9Very high15 Ų1529.5 Ų29.510%0.09715%0.152CC..Hα-helixtrans-53.6-40.2178.1-30.239.1000113.7I74 L110 W111P70-I74 WeakPolarHBondContact O-CD1 3.25Å; P70-I74 VanDerWaalsContact O-CG1 3.26Å; P70-I74 WeakPolarHBondContact O-CG1 3.47Å; P70-I74 PolarHBondContact O-N 2.91Å; P70-I74 VanDerWaalsContact O-N 3.16Å; P70-L110 WeakPolarHBondContact CA-O 3.49Å; P70-L110 HydrophobicContact CB-CB 3.97Å; P70-L110 HydrophobicContact CB-CD1 4.38Å; P70-L110 HydrophobicContact CB-CD2 4.2Å; P70-L110 HydrophobicContact CB-CG 4.41Å; P70-L110 HydrophobicContact CG-CB 4.27Å; P70-W111 HydrophobicContact CG-CD2 4.4Å; P70-W111 HydrophobicContact CG-CH2 3.86Å; P70-W111 HydrophobicContact CG-CZ2 3.47Å; P70-W111 VanDerWaalsContact CG-CZ2 3.47Å; P70-W111 HydrophobicContact CG-CZ3 4.46Å
71F95.6Very high92.1Very high37 Ų3727.8 Ų27.816%0.16214%0.139CC..Hα-helixtrans-75.5-36.9-179.1-58.4-78.7000111.8S68 H69 V73 I74 R75 A411 A414 Q415 L418S68-F71 PolarHBondContact O-N 3.37Å; S68-F71 VanDerWaalsContact O-N 3.11Å; H69-F71 PolarHBondContact O-N 3.05Å; F71-V73 VanDerWaalsContact C-N 3.34Å; F71-I74 PolarHBondContact O-N 2.86Å; F71-R75 WeakPolarHBondContact O-CB 3.19Å; F71-R75 PolarHBondContact O-N 3.01Å; F71-A411 WeakPolarHBondContact CD1-O 3.16Å; F71-A414 HydrophobicContact CD1-CB 3.73Å; F71-A414 HydrophobicContact CE1-CB 3.43Å; F71-A414 VanDerWaalsContact CE1-CB 3.43Å; F71-A414 HydrophobicContact CZ-CB 4.43Å; F71-Q415 HydrophobicContact CB-CB 3.66Å; F71-Q415 HydrophobicContact CB-CG 4.07Å; F71-Q415 HydrophobicContact CD1-CB 4.28Å; F71-Q415 HydrophobicContact CD2-CB 3.89Å; F71-Q415 HydrophobicContact CD2-CG 4.02Å; F71-Q415 HydrophobicContact CG-CB 3.66Å; F71-Q415 HydrophobicContact CG-CG 4.2Å; F71-L418 HydrophobicContact CE2-CB 4.37Å; F71-L418 HydrophobicContact CE2-CD2 3.55Å; F71-L418 HydrophobicContact CZ-CB 4.29Å; F71-L418 HydrophobicContact CZ-CD2 3.84Å
72I94.6Very high92.2Very high36 Ų3628.3 Ų28.319%0.18514%0.141CC..Hα-helixtrans-60.8-45.3174.5-64169.4000110S68 H69 R75 N76S68-I72 PolarHBondContact O-N 2.88Å; H69-I72 PolarHBondContact O-N 3.2Å; H69-I72 VanDerWaalsContact O-N 3.11Å; I72-R75 PolarHBondContact O-N 3.44Å; I72-N76 VanDerWaalsContact O-CB 3.27Å; I72-N76 WeakPolarHBondContact O-CB 3.34Å; I72-N76 PolarHBondContact O-N 2.83Å; I72-N76 PolarHBondContact O-OD1 3.16Å; I72-N76 VanDerWaalsContact O-OD1 3.12Å
73V94.9Very high92Very high0 Ų028.7 Ų28.70%015%0.154CC..Hα-helixtrans-60.6-54.2177.4178.60000110.4H69 F71 R75 N76 Q77 F109 K112 I175H69-V73 WeakPolarHBondContact CE1-CG2 3.44Å; H69-V73 WeakPolarHBondContact ND1-CG2 3.38Å; H69-V73 WeakPolarHBondContact O-CG2 3.25Å; H69-V73 PolarHBondContact O-N 3.42Å; F71-V73 VanDerWaalsContact C-N 3.34Å; V73-R75 VanDerWaalsContact C-N 3.3Å; V73-R75 PolarHBondContact O-N 3.01Å; V73-N76 PolarHBondContact O-N 3.48Å; V73-Q77 HydrophobicContact CG1-CG 4.25Å; V73-Q77 WeakPolarHBondContact O-CG 3.38Å; V73-Q77 PolarHBondContact O-N 3.27Å; V73-F109 WeakPolarHBondContact CG1-O 3.2Å; V73-K112 HydrophobicContact CG1-CB 4.43Å; V73-I175 HydrophobicContact CG2-CG2 4.11Å
74I94.9Very high91.8Very high13 Ų1324.9 Ų24.97%0.06714%0.135CC..Hα-helixtrans-56.7-45.4-179.2-67.8164.2000111.2P70 F71 C78 L94 V98 F109 L110 M372 A411P70-I74 WeakPolarHBondContact O-CD1 3.25Å; P70-I74 VanDerWaalsContact O-CG1 3.26Å; P70-I74 WeakPolarHBondContact O-CG1 3.47Å; P70-I74 PolarHBondContact O-N 2.91Å; P70-I74 VanDerWaalsContact O-N 3.16Å; F71-I74 PolarHBondContact O-N 2.86Å; I74-C78 PolarHBondContact O-N 3.3Å; I74-C78 PolarHBondContact O-SG 3.29Å; I74-L94 HydrophobicContact CG2-CD1 4.09Å; I74-L94 HydrophobicContact CG2-CD2 3.81Å; I74-L94 HydrophobicContact CG2-CG 4.45Å; I74-V98 HydrophobicContact CD1-CG1 4.05Å; I74-V98 HydrophobicContact CD1-CG2 3.75Å; I74-V98 HydrophobicContact CG1-CG2 4.04Å; I74-V98 HydrophobicContact CG2-CG2 4.08Å; I74-F109 HydrophobicContact CG1-CE1 4.03Å; I74-F109 HydrophobicContact CG1-CZ 4.35Å; I74-L110 HydrophobicContact CD1-CD2 3.69Å; I74-L110 HydrophobicContact CG1-CD2 3.99Å; I74-M372 HydrophobicContact CG2-CE 3.86Å; I74-A411 HydrophobicContact CB-CB 4.37Å; I74-A411 HydrophobicContact CG2-CB 4.02Å
75R95.3Very high91.6Very high12 Ų1229.8 Ų29.85%0.04516%0.158CC..Hα-helixtrans-61.6-50.4179.1-174.7-174.758172.1-7.3111.3F71 I72 V73 Q77 C78 Q79 Y351 E354 A411F71-R75 WeakPolarHBondContact O-CB 3.19Å; F71-R75 PolarHBondContact O-N 3.01Å; I72-R75 PolarHBondContact O-N 3.44Å; V73-R75 VanDerWaalsContact C-N 3.3Å; V73-R75 PolarHBondContact O-N 3.01Å; R75-Q77 VanDerWaalsContact C-N 3.3Å; R75-Q77 PolarHBondContact O-N 3.45Å; R75-C78 WeakPolarHBondContact O-CB 3.49Å; R75-C78 PolarHBondContact O-N 3.41Å; R75-C78 VanDerWaalsContact O-N 3.09Å; R75-Q79 HydrophobicContact CG-CG 4.35Å; R75-Q79 WeakPolarHBondContact O-CG 3.16Å; R75-Q79 PolarHBondContact O-N 3.2Å; R75-Y351 HydrophobicContact CG-CE2 4.25Å; R75-Y351 WeakPolarHBondContact CG-OH 3.03Å; R75-E354 VanDerWaalsContact CZ-CD 3.47Å; R75-E354 IonicContact CZ-OE1 3.86Å; R75-E354 IonicContact CZ-OE2 3.59Å; R75-E354 IonicContact NE-OE1 2.76Å; R75-E354 IonicContact NE-OE2 3.98Å; R75-E354 IonicContact NH1-OE1 2.65Å; R75-E354 PolarHBondContact NH1-OE1 2.86Å; R75-E354 IonicContact NH1-OE2 3.7Å; R75-E354 PolarHBondContact NH1-OE2 3.39Å; R75-E354 IonicContact NH2-OE1 3.42Å; R75-E354 PolarHBondContact NH2-OE1 3.39Å; R75-E354 IonicContact NH2-OE2 2.87Å; R75-A411 HydrophobicContact CB-CB 3.88Å
76N94.7Very high91.5Very high7 Ų732 Ų324%0.03717%0.173CC..Hα-helixtrans-64.4-36.7-176.5-68.77.2000111.4I72 V73 C78 Q79 V80 I175 I176 L358I72-N76 VanDerWaalsContact O-CB 3.27Å; I72-N76 WeakPolarHBondContact O-CB 3.34Å; I72-N76 PolarHBondContact O-N 2.83Å; I72-N76 PolarHBondContact O-OD1 3.16Å; I72-N76 VanDerWaalsContact O-OD1 3.12Å; V73-N76 PolarHBondContact O-N 3.48Å; N76-C78 VanDerWaalsContact C-N 3.32Å; N76-C78 PolarHBondContact O-N 3.47Å; N76-Q79 PolarHBondContact O-N 2.9Å; N76-Q79 PolarHBondContact OD1-OE1 3.34Å; N76-V80 VanDerWaalsContact O-CG2 3.29Å; N76-V80 WeakPolarHBondContact O-CG2 3.1Å; N76-V80 PolarHBondContact O-N 3.46Å; N76-V80 VanDerWaalsContact O-N 3.16Å; N76-I175 HydrophobicContact CB-CG2 4.42Å; N76-I176 HydrophobicContact CB-CG2 3.65Å; N76-L358 HydrophobicContact CB-CD1 4.36Å
77Q93.8Very high91.4Very high0 Ų030 Ų300%016%0.163CC..Hα-helixtrans-59-43.2173.3-64.6-78.7-19.500111.3V73 R75 I176 M372V73-Q77 HydrophobicContact CG1-CG 4.25Å; V73-Q77 WeakPolarHBondContact O-CG 3.38Å; V73-Q77 PolarHBondContact O-N 3.27Å; R75-Q77 VanDerWaalsContact C-N 3.3Å; R75-Q77 PolarHBondContact O-N 3.45Å; Q77-I176 VanDerWaalsContact NE2-C 3.28Å; Q77-I176 VanDerWaalsContact NE2-CA 3.29Å; Q77-I176 PolarHBondContact NE2-O 3.46Å; Q77-M372 HydrophobicContact CB-CG 3.74Å; Q77-M372 HydrophobicContact CB-SD 4.1Å
78C93.9Very high91.5Very high4 Ų428.1 Ų28.13%0.02715%0.152CC..Hα-helixtrans-68.3-38.8177.2-60.90000112.9I74 R75 N76 K407I74-C78 PolarHBondContact O-N 3.3Å; I74-C78 PolarHBondContact O-SG 3.29Å; R75-C78 WeakPolarHBondContact O-CB 3.49Å; R75-C78 PolarHBondContact O-N 3.41Å; R75-C78 VanDerWaalsContact O-N 3.09Å; N76-C78 VanDerWaalsContact C-N 3.32Å; N76-C78 PolarHBondContact O-N 3.47Å; C78-K407 HydrophobicContact CB-CB 4.48Å
79Q94.8Very high91.4Very high0 Ų030.6 Ų30.60%016%0.164CC..Hα-helixtrans-71.3-35.7-174.4-75.9170.6-39.800113R75 N76 Y351 E354 T355 L358 R359 K407R75-Q79 HydrophobicContact CG-CG 4.35Å; R75-Q79 WeakPolarHBondContact O-CG 3.16Å; R75-Q79 PolarHBondContact O-N 3.2Å; N76-Q79 PolarHBondContact O-N 2.9Å; N76-Q79 PolarHBondContact OD1-OE1 3.34Å; Q79-Y351 HydrophobicContact CG-CE1 4.33Å; Q79-Y351 VanDerWaalsContact NE2-CE1 3.27Å; Q79-Y351 PolarHBondContact NE2-OH 3.2Å; Q79-E354 PolarHBondContact NE2-OE2 3.42Å; Q79-T355 HydrophobicContact CB-CG2 4.01Å; Q79-T355 HydrophobicContact CG-CG2 4.23Å; Q79-T355 WeakPolarHBondContact CG-OG1 3.32Å; Q79-T355 PolarHBondContact NE2-OG1 3.43Å; Q79-T355 VanDerWaalsContact NE2-OG1 3.15Å; Q79-L358 HydrophobicContact CB-CD1 3.97Å; Q79-L358 HydrophobicContact CG-CD1 4.46Å; Q79-R359 PolarHBondContact O-NE 2.78Å; Q79-R359 PolarHBondContact O-NH2 3.45Å; Q79-K407 VanDerWaalsContact CG-O 3.31Å; Q79-K407 WeakPolarHBondContact CG-O 3.35Å
80V92.6Very high91.4Very high4 Ų433.8 Ų33.82%0.02418%0.184CC..Hα-helixtrans-70.6-31.9-176.6171.10000112.4N76 E82 I176 L358 V362 V369 I381N76-V80 VanDerWaalsContact O-CG2 3.29Å; N76-V80 WeakPolarHBondContact O-CG2 3.1Å; N76-V80 PolarHBondContact O-N 3.46Å; N76-V80 VanDerWaalsContact O-N 3.16Å; V80-E82 PolarHBondContact O-N 2.88Å; V80-I176 HydrophobicContact CG1-CD1 4.45Å; V80-I176 HydrophobicContact CG2-CG2 4.17Å; V80-L358 HydrophobicContact CG2-CB 4.18Å; V80-V362 HydrophobicContact CG1-CG1 4.17Å; V80-V362 HydrophobicContact CG2-CG2 4.31Å; V80-V369 HydrophobicContact CG1-CG2 4.33Å; V80-I381 HydrophobicContact CG1-CD1 3.34Å; V80-I381 HydrophobicContact CG1-CG1 3.95Å
81L89.4Confident91.2Very high16 Ų1634.7 Ų34.78%0.08419%0.19CC..  trans-87.996.2-176.4-169.359.7000112.8S83 S84 V379 K407L81-S83 VanDerWaalsContact C-N 3.32Å; L81-S83 WeakPolarHBondContact CD1-OG 3.46Å; L81-S83 PolarHBondContact O-N 3Å; L81-S84 PolarHBondContact O-N 2.92Å; L81-V379 HydrophobicContact CD1-CG1 3.81Å; L81-K407 PolarHBondContact O-NZ 3.18Å
82E85.2Confident91.1Very high56 Ų5640.5 Ų40.526%0.26222%0.215SC..THydrogen-bonded Turntrans-63-35.8178.1-173.7172.4-164.500112.8V80 S84 Y385 S394 K407V80-E82 PolarHBondContact O-N 2.88Å; E82-S84 VanDerWaalsContact C-N 3.32Å; E82-S84 PolarHBondContact O-N 3.35Å; E82-Y385 PolarHBondContact OE2-OH 3.5Å; E82-S394 PolarHBondContact OE1-OG 3.26Å; E82-K407 PolarHBondContact O-NZ 3.05Å
83S82.1Confident91.1Very high94 Ų9441.3 Ų41.366%0.65722%0.222SC*.THydrogen-bonded Turntrans-79.4-5.4-176.257.40000115.5L81L81-S83 VanDerWaalsContact C-N 3.32Å; L81-S83 WeakPolarHBondContact CD1-OG 3.46Å; L81-S83 PolarHBondContact O-N 3Å
84S84.5Confident91Very high10 Ų1041.7 Ų41.77%0.0722%0.224CC..  trans-62.2137.1-178.5148.90000111.8L81 E82 C86 D373 K407L81-S84 PolarHBondContact O-N 2.92Å; E82-S84 VanDerWaalsContact C-N 3.32Å; E82-S84 PolarHBondContact O-N 3.35Å; S84-C86 PolarHBondContact OG-N 3.02Å; S84-C86 PolarHBondContact OG-O 3.4Å; S84-C86 VanDerWaalsContact OG-O 3.07Å; S84-D373 WeakPolarHBondContact CA-OD2 3.42Å; S84-D373 WeakPolarHBondContact CB-OD1 3.34Å; S84-D373 WeakPolarHBondContact CB-OD2 3.47Å; S84-D373 PolarHBondContact OG-OD1 2.88Å; S84-D373 PolarHBondContact OG-OD2 3.43Å; S84-K407 PolarHBondContact O-NZ 2.64Å
85Q82.8Confident91Very high186 Ų18646 Ų4687%0.86925%0.246SC*.SBendtrans-81.8-31-178.7-64.8-174.9-8.600112.3D373Q85-D373 PolarHBondContact N-OD1 3.24Å; Q85-D373 PolarHBondContact N-OD2 3.2Å
86C87.2Confident90.9Very high50 Ų5049 Ų4934%0.33827%0.268SS..  trans-96.5122.8-178.8-160.80000111.7S84 H88 D373S84-C86 PolarHBondContact OG-N 3.02Å; S84-C86 PolarHBondContact OG-O 3.4Å; S84-C86 VanDerWaalsContact OG-O 3.07Å; C86-H88 PolarHBondContact SG-CE1 3.39Å; C86-D373 WeakPolarHBondContact CB-OD1 3.49Å; C86-D373 PolarHBondContact N-OD1 2.95Å
87L90Very high90.8Very high33 Ų3349.3 Ų49.317%0.17327%0.269CS..  trans-78.4-21.8-178.2-60.1174.6000113.8L89 V400 L403 K407 G408L87-L89 HydrophobicContact CB-CD1 4.14Å; L87-L89 HydrophobicContact CB-CG 3.93Å; L87-L89 HydrophobicContact CD1-CD1 4.06Å; L87-L89 PolarHBondContact O-N 3.48Å; L87-V400 HydrophobicContact CD1-CG1 3.97Å; L87-V400 HydrophobicContact CD2-CG1 3.77Å; L87-V400 HydrophobicContact CG-CG1 4.48Å; L87-L403 HydrophobicContact CD1-CD2 3.72Å; L87-L403 HydrophobicContact CD1-CG 3.95Å; L87-K407 HydrophobicContact CD2-CD 4.23Å; L87-K407 HydrophobicContact CD2-CG 3.64Å; L87-K407 CarbonylContact O-C 3.52Å; L87-K407 WeakPolarHBondContact O-CA 3.23Å; L87-G408 PolarHBondContact O-N 3.23Å
88H92.1Very high90.8Very high7 Ų750.1 Ų50.13%0.03228%0.275CS..  trans50.948.4-176.9-65.8-64.2000114.9C86 T93 L94 M372 G408 F409 G410C86-H88 PolarHBondContact SG-CE1 3.39Å; H88-T93 VanDerWaalsContact CA-OG1 3.29Å; H88-T93 WeakPolarHBondContact CA-OG1 3.3Å; H88-T93 PolarHBondContact CE1-O 3.15Å; H88-T93 VanDerWaalsContact CE1-O 3.26Å; H88-T93 PolarHBondContact ND1-O 3.44Å; H88-T93 PolarHBondContact ND1-OG1 3.12Å; H88-L94 HydrophobicContact CB-CD2 3.5Å; H88-L94 HydrophobicContact CB-CG 3.82Å; H88-L94 VanDerWaalsContact CG-CD2 3.47Å; H88-M372 PolarHBondContact NE2-O 3.09Å; H88-G408 CarbonylContact O-C 3.6Å; H88-F409 PolarHBondContact O-N 3.04Å; H88-G410 PolarHBondContact O-N 3.45Å
89L92Very high90.8Very high61 Ų6157.9 Ų57.932%0.31930%0.303SS..  trans-71.5-27.9-178.2-70161000113.2L87 L403 F406 F409 G410L87-L89 HydrophobicContact CB-CD1 4.14Å; L87-L89 HydrophobicContact CB-CG 3.93Å; L87-L89 HydrophobicContact CD1-CD1 4.06Å; L87-L89 PolarHBondContact O-N 3.48Å; L89-L403 HydrophobicContact CD1-CD1 4.29Å; L89-L403 HydrophobicContact CD1-CD2 4.27Å; L89-L403 HydrophobicContact CD1-CG 4.44Å; L89-L403 HydrophobicContact CD2-CD1 4.11Å; L89-F406 HydrophobicContact CD2-CB 4.06Å; L89-F409 HydrophobicContact CD2-CB 4.34Å; L89-G410 WeakPolarHBondContact O-CA 3.48Å; L89-G410 PolarHBondContact O-N 3.24Å
90T93.1Very high90.7Very high68 Ų6861.9 Ų61.942%0.41732%0.321SS..SBendtrans-111.7145.5178.4670000110.4F92 T93T90-F92 PolarHBondContact O-N 3.31Å; T90-T93 PolarHBondContact O-N 2.87Å; T90-T93 PolarHBondContact O-OG1 2.88Å; T90-T93 WeakPolarHBondContact OG1-CG2 3.34Å
91P91.9Very high90.7Very high34 Ų3461.7 Ų61.722%0.22132%0.32CS..Hα-helixtrans-59.3-32.7-17723.9-35.4000112.9T93 L94 I413 A414P91-T93 VanDerWaalsContact C-N 3.27Å; P91-T93 PolarHBondContact O-N 3.31Å; P91-L94 WeakPolarHBondContact O-CB 3.17Å; P91-L94 PolarHBondContact O-N 2.99Å; P91-L94 VanDerWaalsContact O-N 3.11Å; P91-I413 HydrophobicContact CG-CG2 4.45Å; P91-A414 HydrophobicContact CB-CB 3.99Å
92F94.2Very high90.9Very high159 Ų15963.3 Ų63.370%0.69733%0.328SS*.Hα-helixtrans-63-32.2-178.7-56-68.7000113.6T90 L94 I95 P96T90-F92 PolarHBondContact O-N 3.31Å; F92-L94 PolarHBondContact O-N 3.17Å; F92-I95 HydrophobicContact CD1-CD1 4.07Å; F92-I95 PolarHBondContact O-N 3.07Å; F92-P96 WeakPolarHBondContact O-CD 3.35Å
93T93.4Very high91.2Very high53 Ų5367 Ų6733%0.32535%0.345SS..Hα-helixtrans-69.9-23.2178.261.50000112.8H88 T90 P91H88-T93 VanDerWaalsContact CA-OG1 3.29Å; H88-T93 WeakPolarHBondContact CA-OG1 3.3Å; H88-T93 PolarHBondContact CE1-O 3.15Å; H88-T93 VanDerWaalsContact CE1-O 3.26Å; H88-T93 PolarHBondContact ND1-O 3.44Å; H88-T93 PolarHBondContact ND1-OG1 3.12Å; T90-T93 PolarHBondContact O-N 2.87Å; T90-T93 PolarHBondContact O-OG1 2.88Å; T90-T93 WeakPolarHBondContact OG1-CG2 3.34Å; P91-T93 VanDerWaalsContact C-N 3.27Å; P91-T93 PolarHBondContact O-N 3.31Å
94L93.5Very high91.5Very high9 Ų964.8 Ų64.85%0.04733%0.33CS..Hα-helixtrans-79.5-31.3178.9-71.5165000112.3I74 H88 P91 F92 V97 V98 M372 A411I74-L94 HydrophobicContact CG2-CD1 4.09Å; I74-L94 HydrophobicContact CG2-CD2 3.81Å; I74-L94 HydrophobicContact CG2-CG 4.45Å; H88-L94 HydrophobicContact CB-CD2 3.5Å; H88-L94 HydrophobicContact CB-CG 3.82Å; H88-L94 VanDerWaalsContact CG-CD2 3.47Å; P91-L94 WeakPolarHBondContact O-CB 3.17Å; P91-L94 PolarHBondContact O-N 2.99Å; P91-L94 VanDerWaalsContact O-N 3.11Å; F92-L94 PolarHBondContact O-N 3.17Å; L94-V97 PolarHBondContact O-N 2.82Å; L94-V97 VanDerWaalsContact O-N 3.16Å; L94-V98 HydrophobicContact CB-CG2 4.22Å; L94-V98 WeakPolarHBondContact O-CB 3.41Å; L94-V98 VanDerWaalsContact O-CG2 3.27Å; L94-V98 WeakPolarHBondContact O-CG2 3.41Å; L94-V98 PolarHBondContact O-N 3.45Å; L94-M372 HydrophobicContact CD2-CE 3.88Å; L94-A411 HydrophobicContact CD1-CB 3.76Å; L94-A411 VanDerWaalsContact CD1-N 3.28Å
95I93.9Very high91.7Very high102 Ų10265.8 Ų65.852%0.52333%0.333SS..Hα-helixtrans-49.5-52.2-175.7-59.4175.9000113.3F92 V97 R99F92-I95 HydrophobicContact CD1-CD1 4.07Å; F92-I95 PolarHBondContact O-N 3.07Å; I95-V97 PolarHBondContact O-N 2.85Å; I95-R99 WeakPolarHBondContact O-CB 3.39Å; I95-R99 PolarHBondContact O-N 3.24Å
96P93.4Very high92.1Very high77 Ų7758.5 Ų58.550%0.531%0.308SS..Hα-helixtrans-64.6-38.7-178.124.1-34.1000112.8F92 K100F92-P96 WeakPolarHBondContact O-CD 3.35Å; P96-K100 PolarHBondContact O-N 3.3Å
97V93Very high92.2Very high12 Ų1261.5 Ų61.57%0.07332%0.32CS..Hα-helixtrans-71-48.9-179.4179.90000110.3L94 I95 R99 K100 C101 M372L94-V97 PolarHBondContact O-N 2.82Å; L94-V97 VanDerWaalsContact O-N 3.16Å; I95-V97 PolarHBondContact O-N 2.85Å; V97-R99 VanDerWaalsContact C-N 3.27Å; V97-R99 PolarHBondContact O-N 2.93Å; V97-K100 WeakPolarHBondContact O-CB 3.5Å; V97-K100 PolarHBondContact O-N 3.36Å; V97-C101 PolarHBondContact O-N 3.32Å; V97-C101 PolarHBondContact O-SG 3.44Å; V97-C101 VanDerWaalsContact O-SG 3.35Å; V97-M372 HydrophobicContact CG1-CB 4.47Å; V97-M372 HydrophobicContact CG1-CE 3.94Å; V97-M372 WeakPolarHBondContact CG1-O 3.46Å; V97-M372 HydrophobicContact CG1-SD 4.26Å; V97-M372 WeakPolarHBondContact CG2-O 2.92Å
98V94Very high92.1Very high18 Ų1863.2 Ų63.211%0.10934%0.335CS..Hα-helixtrans-60.4-39.6179.6172.20000110.7I74 L94 K100 C101 I102 F109 L110 M372I74-V98 HydrophobicContact CD1-CG1 4.05Å; I74-V98 HydrophobicContact CD1-CG2 3.75Å; I74-V98 HydrophobicContact CG1-CG2 4.04Å; I74-V98 HydrophobicContact CG2-CG2 4.08Å; L94-V98 HydrophobicContact CB-CG2 4.22Å; L94-V98 WeakPolarHBondContact O-CB 3.41Å; L94-V98 VanDerWaalsContact O-CG2 3.27Å; L94-V98 WeakPolarHBondContact O-CG2 3.41Å; L94-V98 PolarHBondContact O-N 3.45Å; V98-K100 VanDerWaalsContact C-N 3.33Å; V98-K100 PolarHBondContact O-N 2.85Å; V98-C101 PolarHBondContact O-N 2.95Å; V98-I102 HydrophobicContact CG1-CD1 3.71Å; V98-I102 HydrophobicContact CG1-CG1 4.3Å; V98-I102 WeakPolarHBondContact O-CB 3.31Å; V98-I102 VanDerWaalsContact O-CG1 3.27Å; V98-I102 WeakPolarHBondContact O-CG1 3.36Å; V98-I102 PolarHBondContact O-N 3.29Å; V98-F109 HydrophobicContact CG1-CE1 4.45Å; V98-L110 HydrophobicContact CG1-CD2 4.41Å; V98-M372 HydrophobicContact CG2-CE 4.15Å
99R94.2Very high92.1Very high167 Ų16762.9 Ų62.963%0.6333%0.333SS*.Hα-helixtrans-59.3-42.8174.4-177.5176.9176.2166.11.2111.9I95 V97 I102 Q103I95-R99 WeakPolarHBondContact O-CB 3.39Å; I95-R99 PolarHBondContact O-N 3.24Å; V97-R99 VanDerWaalsContact C-N 3.27Å; V97-R99 PolarHBondContact O-N 2.93Å; R99-I102 PolarHBondContact O-N 3.02Å; R99-Q103 WeakPolarHBondContact O-CB 3.3Å; R99-Q103 VanDerWaalsContact O-CG 3.22Å; R99-Q103 WeakPolarHBondContact O-CG 3.46Å; R99-Q103 PolarHBondContact O-N 2.9Å
100K93.3Very high92.1Very high83 Ų8360.9 Ų60.936%0.36132%0.323SS..Hα-helixtrans-66.7-42.1175.3-74-176.9171.1-161.70112.6P96 V97 V98 I102 Q103 S104 T374 D376P96-K100 PolarHBondContact O-N 3.3Å; V97-K100 WeakPolarHBondContact O-CB 3.5Å; V97-K100 PolarHBondContact O-N 3.36Å; V98-K100 VanDerWaalsContact C-N 3.33Å; V98-K100 PolarHBondContact O-N 2.85Å; K100-I102 VanDerWaalsContact C-N 3.34Å; K100-I102 PolarHBondContact O-N 3.17Å; K100-Q103 PolarHBondContact O-N 2.84Å; K100-Q103 VanDerWaalsContact O-N 3.15Å; K100-S104 PolarHBondContact O-N 2.99Å; K100-S104 PolarHBondContact O-OG 3.47Å; K100-T374 WeakPolarHBondContact CD-O 3.42Å; K100-D376 IonicContact NZ-OD2 2.78Å
101C91.9Very high92Very high1 Ų162.8 Ų62.81%0.00732%0.323CS..Hα-helixtrans-57.4-48.1173.9-64.50000111.1V97 V98 Q103 S104 Q105 F109V97-C101 PolarHBondContact O-N 3.32Å; V97-C101 PolarHBondContact O-SG 3.44Å; V97-C101 VanDerWaalsContact O-SG 3.35Å; V98-C101 PolarHBondContact O-N 2.95Å; C101-Q103 VanDerWaalsContact C-N 3.32Å; C101-Q103 PolarHBondContact O-N 3.2Å; C101-S104 PolarHBondContact O-N 3.32Å; C101-S104 VanDerWaalsContact O-N 3.15Å; C101-S104 PolarHBondContact O-OG 3.16Å; C101-Q105 PolarHBondContact O-N 3.44Å; C101-F109 HydrophobicContact CB-CD1 3.86Å; C101-F109 HydrophobicContact CB-CD2 4.23Å; C101-F109 HydrophobicContact CB-CE1 3.76Å; C101-F109 HydrophobicContact CB-CE2 4.14Å; C101-F109 HydrophobicContact CB-CG 4.11Å; C101-F109 HydrophobicContact CB-CZ 3.9Å
102I93.7Very high91.9Very high49 Ų4961.5 Ų61.525%0.25131%0.313SS..Hα-helixtrans-63.3-37.8176.9-66.9167.7000111.2V98 R99 K100 S104 G106 L107 F109 L110V98-I102 HydrophobicContact CG1-CD1 3.71Å; V98-I102 HydrophobicContact CG1-CG1 4.3Å; V98-I102 WeakPolarHBondContact O-CB 3.31Å; V98-I102 VanDerWaalsContact O-CG1 3.27Å; V98-I102 WeakPolarHBondContact O-CG1 3.36Å; V98-I102 PolarHBondContact O-N 3.29Å; R99-I102 PolarHBondContact O-N 3.02Å; K100-I102 VanDerWaalsContact C-N 3.34Å; K100-I102 PolarHBondContact O-N 3.17Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 3.32Å; I102-G106 CarbonylContact O-C 3.56Å; I102-G106 WeakPolarHBondContact O-CA 3.38Å; I102-G106 PolarHBondContact O-N 2.99Å; I102-L107 HydrophobicContact CD1-CD2 4.46Å; I102-L107 HydrophobicContact CG2-CD2 3.91Å; I102-L107 HydrophobicContact CG2-CG 4.4Å; I102-F109 HydrophobicContact CG1-CD1 4.29Å; I102-L110 HydrophobicContact CD1-CD1 4.03Å; I102-L110 HydrophobicContact CD1-CG 4.48Å
103Q92Very high91.6Very high133 Ų13354.5 Ų54.562%0.62129%0.286SS*.Hα-helixtrans-66.7-33175.4-76.4172.8-13.600112.6R99 K100 C101R99-Q103 WeakPolarHBondContact O-CB 3.3Å; R99-Q103 VanDerWaalsContact O-CG 3.22Å; R99-Q103 WeakPolarHBondContact O-CG 3.46Å; R99-Q103 PolarHBondContact O-N 2.9Å; K100-Q103 PolarHBondContact O-N 2.84Å; K100-Q103 VanDerWaalsContact O-N 3.15Å; C101-Q103 VanDerWaalsContact C-N 3.32Å; C101-Q103 PolarHBondContact O-N 3.2Å
104S88.3Confident91.5Very high48 Ų4853.5 Ų53.534%0.33628%0.278SS..Hα-helixtrans-90.9-22.9-176.677.20000114.9K100 C101 I102 K180K100-S104 PolarHBondContact O-N 2.99Å; K100-S104 PolarHBondContact O-OG 3.47Å; C101-S104 PolarHBondContact O-N 3.32Å; C101-S104 VanDerWaalsContact O-N 3.15Å; C101-S104 PolarHBondContact O-OG 3.16Å; I102-S104 VanDerWaalsContact C-N 3.32Å; I102-S104 PolarHBondContact O-N 3.32Å; S104-K180 PolarHBondContact OG-NZ 2.96Å; S104-K180 VanDerWaalsContact OG-NZ 3.07Å
105Q88.2Confident91.3Very high31 Ų3154.1 Ų54.115%0.14529%0.287CS..Hα-helixtrans-123.1-10.5-178.2-66.8176.8-1600114.2C101 F109 K112 S178 K180 D370C101-Q105 PolarHBondContact O-N 3.44Å; Q105-F109 HydrophobicContact CB-CB 4.27Å; Q105-K112 VanDerWaalsContact CD-NZ 3.32Å; Q105-S178 PolarHBondContact NE2-OG 2.96Å; Q105-K180 HydrophobicContact CG-CD 4.45Å; Q105-K180 HydrophobicContact CG-CG 4.22Å; Q105-D370 VanDerWaalsContact NE2-CG 3.34Å; Q105-D370 PolarHBondContact NE2-OD1 2.88Å; Q105-D370 PolarHBondContact NE2-OD2 2.72Å; Q105-D370 PolarHBondContact OE1-OD2 3.07Å
106G90.1Very high91.1Very high33 Ų3349.3 Ų49.334%0.3426%0.263SS..  trans79.2-174.3-169.200000113I102 S108 F109I102-G106 CarbonylContact O-C 3.56Å; I102-G106 WeakPolarHBondContact O-CA 3.38Å; I102-G106 PolarHBondContact O-N 2.99Å; G106-S108 PolarHBondContact O-N 3.37Å; G106-F109 PolarHBondContact O-N 2.81Å
107L90.9Very high91Very high114 Ų11446.7 Ų46.760%0.59725%0.245SC*.G310 helixtrans-68.9-15.2179-70.4170.5000113.5I102 F109 L110I102-L107 HydrophobicContact CD1-CD2 4.46Å; I102-L107 HydrophobicContact CG2-CD2 3.91Å; I102-L107 HydrophobicContact CG2-CG 4.4Å; L107-F109 PolarHBondContact O-N 2.89Å; L107-F109 VanDerWaalsContact O-N 3.17Å; L107-L110 PolarHBondContact O-N 3.37Å; L107-L110 VanDerWaalsContact O-N 3.12Å
108S88Confident90.9Very high69 Ų6948.2 Ų48.248%0.48325%0.251SS..G310 helixtrans-52.9-34.6173.7-176.30000111.9G106 L110 W111 K112 D179G106-S108 PolarHBondContact O-N 3.37Å; S108-L110 PolarHBondContact O-N 2.94Å; S108-W111 PolarHBondContact O-N 2.83Å; S108-K112 PolarHBondContact O-N 3.48Å; S108-D179 WeakPolarHBondContact CB-OD2 3.48Å; S108-D179 PolarHBondContact OG-OD2 3.29Å
109F90.6Very high90.8Very high0 Ų049.1 Ų49.10%026%0.255CS..G310 helixtrans-45.8-38.7175.9170.1-111000113.8V73 I74 V98 C101 I102 Q105 G106 L107 K112 D370 M372V73-F109 WeakPolarHBondContact CG1-O 3.2Å; I74-F109 HydrophobicContact CG1-CE1 4.03Å; I74-F109 HydrophobicContact CG1-CZ 4.35Å; V98-F109 HydrophobicContact CG1-CE1 4.45Å; C101-F109 HydrophobicContact CB-CD1 3.86Å; C101-F109 HydrophobicContact CB-CD2 4.23Å; C101-F109 HydrophobicContact CB-CE1 3.76Å; C101-F109 HydrophobicContact CB-CE2 4.14Å; C101-F109 HydrophobicContact CB-CG 4.11Å; C101-F109 HydrophobicContact CB-CZ 3.9Å; I102-F109 HydrophobicContact CG1-CD1 4.29Å; Q105-F109 HydrophobicContact CB-CB 4.27Å; G106-F109 PolarHBondContact O-N 2.81Å; L107-F109 PolarHBondContact O-N 2.89Å; L107-F109 VanDerWaalsContact O-N 3.17Å; F109-K112 HydrophobicContact CD2-CD 4.22Å; F109-K112 WeakPolarHBondContact O-CD 3.36Å; F109-K112 WeakPolarHBondContact O-CG 3.45Å; F109-D370 HydrophobicContact CE2-CB 4.27Å; F109-M372 HydrophobicContact CZ-SD 4.17Å
110L92.7Very high90.7Very high18 Ų1841.9 Ų41.99%0.09423%0.228CC..G310 helixtrans-83.3-16.7-174.9-63.2178.1000113.8H69 P70 I74 V98 I102 L107 S108H69-L110 PolarHBondContact ND1-O 2.94Å; P70-L110 WeakPolarHBondContact CA-O 3.49Å; P70-L110 HydrophobicContact CB-CB 3.97Å; P70-L110 HydrophobicContact CB-CD1 4.38Å; P70-L110 HydrophobicContact CB-CD2 4.2Å; P70-L110 HydrophobicContact CB-CG 4.41Å; P70-L110 HydrophobicContact CG-CB 4.27Å; I74-L110 HydrophobicContact CD1-CD2 3.69Å; I74-L110 HydrophobicContact CG1-CD2 3.99Å; V98-L110 HydrophobicContact CG1-CD2 4.41Å; I102-L110 HydrophobicContact CD1-CD1 4.03Å; I102-L110 HydrophobicContact CD1-CG 4.48Å; L107-L110 PolarHBondContact O-N 3.37Å; L107-L110 VanDerWaalsContact O-N 3.12Å; S108-L110 PolarHBondContact O-N 2.94Å
111W91.6Very high90.5Very high109 Ų10943.5 Ų43.541%0.41323%0.232SC..G310 helixtrans-117.120.8-178.1-75.7-81.9000113.8H69 P70 S108 G113 L114H69-W111 VanDerWaalsContact CE1-C 3.49Å; H69-W111 AromaticContact ND1-CD1 3.84Å; P70-W111 HydrophobicContact CG-CD2 4.4Å; P70-W111 HydrophobicContact CG-CH2 3.86Å; P70-W111 HydrophobicContact CG-CZ2 3.47Å; P70-W111 VanDerWaalsContact CG-CZ2 3.47Å; P70-W111 HydrophobicContact CG-CZ3 4.46Å; S108-W111 PolarHBondContact O-N 2.83Å; W111-G113 PolarHBondContact O-N 3.49Å; W111-L114 HydrophobicContact CB-CB 4.49Å; W111-L114 WeakPolarHBondContact O-CB 3.2Å; W111-L114 PolarHBondContact O-N 2.65Å
112K89.5Confident90.5Very high6 Ų645.1 Ų45.13%0.02625%0.249CC..THydrogen-bonded Turntrans-56.9122.6172.8-71.1175.6159.9170.50112.6H69 V73 Q105 S108 F109 L114 D179 D370H69-K112 PolarHBondContact CE1-O 3.03Å; H69-K112 PolarHBondContact NE2-O 3.42Å; V73-K112 HydrophobicContact CG1-CB 4.43Å; Q105-K112 VanDerWaalsContact CD-NZ 3.32Å; S108-K112 PolarHBondContact O-N 3.48Å; F109-K112 HydrophobicContact CD2-CD 4.22Å; F109-K112 WeakPolarHBondContact O-CD 3.36Å; F109-K112 WeakPolarHBondContact O-CG 3.45Å; K112-L114 VanDerWaalsContact C-N 3.26Å; K112-L114 PolarHBondContact O-N 2.76Å; K112-D179 WeakPolarHBondContact CE-OD1 3.31Å; K112-D179 WeakPolarHBondContact CE-OD2 3.19Å; K112-D370 IonicContact NZ-OD2 3.81Å; K112-D370 PolarHBondContact NZ-OD2 3.33Å
113G87.7Confident90.4Very high12 Ų1244.4 Ų44.412%0.12425%0.246CC..THydrogen-bonded Turntrans72.412.317900000115.3W111 G115 S116 V117W111-G113 PolarHBondContact O-N 3.49Å; G113-G115 PolarHBondContact O-N 3.49Å; G113-G115 VanDerWaalsContact O-N 3.16Å; G113-S116 PolarHBondContact O-N 3.08Å; G113-S116 VanDerWaalsContact O-N 3.1Å; G113-S116 PolarHBondContact O-OG 3.37Å; G113-V117 PolarHBondContact O-N 3.02Å; G113-V117 VanDerWaalsContact O-N 3.16Å
114L91.1Very high90.4Very high32 Ų3239.1 Ų39.117%0.16822%0.222CC..Hα-helixtrans-54-39.1177.4179.271.5000112.1V65 L66 H69 W111 K112 S116 V117 F118V65-L114 HydrophobicContact CG1-CD1 3.85Å; L66-L114 HydrophobicContact CD2-CD1 4.22Å; L66-L114 HydrophobicContact CD2-CD2 3.73Å; H69-L114 HydrophobicContact CB-CD1 3.99Å; H69-L114 VanDerWaalsContact CD2-CD1 3.43Å; H69-L114 WeakPolarHBondContact CD2-CD1 3.25Å; H69-L114 VanDerWaalsContact NE2-CA 3.34Å; H69-L114 WeakPolarHBondContact NE2-CA 3.33Å; H69-L114 PolarHBondContact NE2-N 2.87Å; W111-L114 HydrophobicContact CB-CB 4.49Å; W111-L114 WeakPolarHBondContact O-CB 3.2Å; W111-L114 PolarHBondContact O-N 2.65Å; K112-L114 VanDerWaalsContact C-N 3.26Å; K112-L114 PolarHBondContact O-N 2.76Å; L114-S116 PolarHBondContact O-N 2.88Å; L114-V117 WeakPolarHBondContact O-CB 3.19Å; L114-V117 PolarHBondContact O-N 3.44Å; L114-F118 HydrophobicContact CD1-CE2 3.77Å; L114-F118 HydrophobicContact CD1-CZ 3.9Å; L114-F118 HydrophobicContact CD2-CE2 3.85Å; L114-F118 HydrophobicContact CD2-CZ 4.5Å; L114-F118 HydrophobicContact CG-CD2 4.12Å; L114-F118 HydrophobicContact CG-CE2 3.53Å; L114-F118 HydrophobicContact CG-CZ 4.18Å; L114-F118 WeakPolarHBondContact O-CD2 3.41Å; L114-F118 PolarHBondContact O-N 3.33Å
115G89.8Confident90.5Very high23 Ų2341.2 Ų41.224%0.23723%0.229CC..Hα-helixtrans-58.5-46.5177.900000113.1G113 V117 F118 I119G113-G115 PolarHBondContact O-N 3.49Å; G113-G115 VanDerWaalsContact O-N 3.16Å; G115-V117 VanDerWaalsContact C-N 3.34Å; G115-V117 PolarHBondContact O-N 3.28Å; G115-F118 PolarHBondContact O-N 3Å; G115-I119 WeakPolarHBondContact O-CG1 3.17Å; G115-I119 PolarHBondContact O-N 3.12Å; G115-I119 VanDerWaalsContact O-N 3.15Å
116S89.5Confident90.6Very high0 Ų044.2 Ų44.20%024%0.244CC..Hα-helixtrans-69.3-32.4177.551.10000112.8G113 L114 F118 I119 I120 E174 C190G113-S116 PolarHBondContact O-N 3.08Å; G113-S116 VanDerWaalsContact O-N 3.1Å; G113-S116 PolarHBondContact O-OG 3.37Å; L114-S116 PolarHBondContact O-N 2.88Å; S116-F118 VanDerWaalsContact C-N 3.29Å; S116-F118 PolarHBondContact O-N 3.39Å; S116-I119 PolarHBondContact O-N 3.02Å; S116-I119 VanDerWaalsContact O-N 3.17Å; S116-I120 WeakPolarHBondContact O-CG1 3.25Å; S116-I120 PolarHBondContact O-N 3.25Å; S116-E174 WeakPolarHBondContact CB-OE2 3.36Å; S116-E174 PolarHBondContact OG-OE2 2.87Å; S116-C190 WeakPolarHBondContact CB-SG 3.34Å
117V91.2Very high90.8Very high22 Ų2243.1 Ų43.113%0.13323%0.231CC..Hα-helixtrans-57.2-44.4172.2178.40000111V65 G113 L114 G115 I120 R121 I175V65-V117 HydrophobicContact CG1-CB 4.47Å; V65-V117 HydrophobicContact CG1-CG1 3.7Å; V65-V117 HydrophobicContact CG2-CG1 4.49Å; G113-V117 PolarHBondContact O-N 3.02Å; G113-V117 VanDerWaalsContact O-N 3.16Å; L114-V117 WeakPolarHBondContact O-CB 3.19Å; L114-V117 PolarHBondContact O-N 3.44Å; G115-V117 VanDerWaalsContact C-N 3.34Å; G115-V117 PolarHBondContact O-N 3.28Å; V117-I120 PolarHBondContact O-N 3.44Å; V117-R121 VanDerWaalsContact O-CG 3.27Å; V117-R121 WeakPolarHBondContact O-CG 3.48Å; V117-R121 PolarHBondContact O-N 3.45Å; V117-I175 HydrophobicContact CG2-CD1 3.72Å; V117-I175 HydrophobicContact CG2-CG1 4.07Å
118F91.8Very high90.7Very high45 Ų4538.5 Ų38.520%0.19721%0.206CC..Hα-helixtrans-64.4-40.9176.3-69.7-49.7000113.1F62 V65 L66 L114 G115 S116 R121 G122F62-F118 AromaticContact CD1-CD1 3.52Å; F62-F118 HydrophobicContact CD1-CD1 3.52Å; F62-F118 AromaticContact CD1-CE1 3.21Å; F62-F118 HydrophobicContact CD1-CE1 3.21Å; F62-F118 HydrophobicContact CD1-CE2 4.35Å; F62-F118 HydrophobicContact CD1-CG 4.27Å; F62-F118 AromaticContact CD1-CZ 3.67Å; F62-F118 HydrophobicContact CD1-CZ 3.67Å; F62-F118 AromaticContact CE1-CD1 3.49Å; F62-F118 HydrophobicContact CE1-CD1 3.49Å; F62-F118 VanDerWaalsContact CE1-CD1 3.49Å; F62-F118 HydrophobicContact CE1-CD2 4.46Å; F62-F118 AromaticContact CE1-CE1 3.72Å; F62-F118 HydrophobicContact CE1-CE1 3.72Å; F62-F118 AromaticContact CE1-CG 3.93Å; F62-F118 HydrophobicContact CE1-CG 3.93Å; F62-F118 HydrophobicContact CE1-CZ 4.26Å; F62-F118 HydrophobicContact CG-CE1 4.28Å; V65-F118 HydrophobicContact CB-CD1 4.46Å; V65-F118 HydrophobicContact CB-CE1 3.61Å; V65-F118 HydrophobicContact CB-CZ 4.2Å; V65-F118 HydrophobicContact CG1-CD1 4.12Å; V65-F118 HydrophobicContact CG1-CE1 3.44Å; V65-F118 VanDerWaalsContact CG1-CE1 3.44Å; V65-F118 HydrophobicContact CG1-CZ 3.79Å; V65-F118 HydrophobicContact CG2-CE1 4.11Å; L66-F118 HydrophobicContact CD2-CZ 4.11Å; L66-F118 HydrophobicContact CG-CZ 4.16Å; L114-F118 HydrophobicContact CD1-CE2 3.77Å; L114-F118 HydrophobicContact CD1-CZ 3.9Å; L114-F118 HydrophobicContact CD2-CE2 3.85Å; L114-F118 HydrophobicContact CD2-CZ 4.5Å; L114-F118 HydrophobicContact CG-CD2 4.12Å; L114-F118 HydrophobicContact CG-CE2 3.53Å; L114-F118 HydrophobicContact CG-CZ 4.18Å; L114-F118 WeakPolarHBondContact O-CD2 3.41Å; L114-F118 PolarHBondContact O-N 3.33Å; G115-F118 PolarHBondContact O-N 3Å; S116-F118 VanDerWaalsContact C-N 3.29Å; S116-F118 PolarHBondContact O-N 3.39Å; F118-R121 PolarHBondContact O-N 3.44Å; F118-G122 PolarHBondContact O-N 3.38Å
119I90.6Very high90.9Very high37 Ų3738.2 Ų38.219%0.1920%0.199CC..Hα-helixtrans-61-47175.9-64168.4000110.4G115 S116 R121 G122 L123 L187 V191G115-I119 WeakPolarHBondContact O-CG1 3.17Å; G115-I119 PolarHBondContact O-N 3.12Å; G115-I119 VanDerWaalsContact O-N 3.15Å; S116-I119 PolarHBondContact O-N 3.02Å; S116-I119 VanDerWaalsContact O-N 3.17Å; I119-R121 VanDerWaalsContact C-N 3.31Å; I119-R121 PolarHBondContact O-N 3.28Å; I119-G122 PolarHBondContact O-N 2.92Å; I119-L123 HydrophobicContact CG2-CD1 3.81Å; I119-L123 HydrophobicContact CG2-CG 4.08Å; I119-L123 WeakPolarHBondContact O-CB 3.47Å; I119-L123 VanDerWaalsContact O-CG 3.32Å; I119-L123 WeakPolarHBondContact O-CG 3.14Å; I119-L123 PolarHBondContact O-N 2.93Å; I119-L187 HydrophobicContact CD1-CB 3.74Å; I119-L187 HydrophobicContact CD1-CD2 4.18Å; I119-L187 HydrophobicContact CD1-CG 4.49Å; I119-L187 WeakPolarHBondContact CD1-O 3.48Å; I119-V191 HydrophobicContact CG2-CG2 3.67Å
120I91.9Very high91Very high14 Ų1442.6 Ų42.67%0.07222%0.222CC..Hα-helixtrans-62.4-39.6178.5-64.8-49.5000111.3S116 V117 L123 N124 L164 F167 F168 S171S116-I120 WeakPolarHBondContact O-CG1 3.25Å; S116-I120 PolarHBondContact O-N 3.25Å; V117-I120 PolarHBondContact O-N 3.44Å; I120-L123 HydrophobicContact CD1-CD1 4.32Å; I120-L123 PolarHBondContact O-N 2.84Å; I120-N124 WeakPolarHBondContact O-CB 3.43Å; I120-N124 PolarHBondContact O-N 3.49Å; I120-L164 HydrophobicContact CD1-CD1 4.37Å; I120-L164 HydrophobicContact CG2-CD1 4.38Å; I120-L164 HydrophobicContact CG2-CD2 4.02Å; I120-L164 HydrophobicContact CG2-CG 4.34Å; I120-F167 VanDerWaalsContact CD1-C 3.47Å; I120-F167 HydrophobicContact CD1-CB 3.44Å; I120-F167 VanDerWaalsContact CD1-CB 3.44Å; I120-F168 HydrophobicContact CG2-CD2 4.38Å; I120-S171 WeakPolarHBondContact CG1-OG 3.31Å
121R90.4Very high90.9Very high117 Ų11742.5 Ų42.544%0.44222%0.222SC..Hα-helixtrans-63.4-44.4174.8-68.4-72.4-171.8179.23.3111.8M61 V65 V117 F118 I119 N124 L125M61-R121 HydrophobicContact CE-CB 3.36Å; M61-R121 HydrophobicContact CE-CG 4.06Å; M61-R121 HydrophobicContact SD-CB 4.24Å; V65-R121 HydrophobicContact CG2-CG 4.45Å; V117-R121 VanDerWaalsContact O-CG 3.27Å; V117-R121 WeakPolarHBondContact O-CG 3.48Å; V117-R121 PolarHBondContact O-N 3.45Å; F118-R121 PolarHBondContact O-N 3.44Å; I119-R121 VanDerWaalsContact C-N 3.31Å; I119-R121 PolarHBondContact O-N 3.28Å; R121-N124 PolarHBondContact O-N 3.18Å; R121-L125 WeakPolarHBondContact O-CG 3.32Å; R121-L125 PolarHBondContact O-N 3.42Å; R121-L125 VanDerWaalsContact O-N 3.15Å
122G90.8Very high90.8Very high36 Ų3638.1 Ų38.137%0.37121%0.208SC..Hα-helixtrans-63.3-45.8175.400000112.6F118 I119 N124 L125 M126F118-G122 PolarHBondContact O-N 3.38Å; I119-G122 PolarHBondContact O-N 2.92Å; G122-N124 VanDerWaalsContact C-N 3.33Å; G122-N124 PolarHBondContact O-N 3.36Å; G122-L125 PolarHBondContact O-N 2.9Å; G122-M126 PolarHBondContact O-N 3.05Å
123L92Very high90.8Very high33 Ų3345.3 Ų45.317%0.17324%0.242CC..Hα-helixtrans-61.4-40.8175-74178.1000111.2I119 I120 L125 M126 T127 L164 F167I119-L123 HydrophobicContact CG2-CD1 3.81Å; I119-L123 HydrophobicContact CG2-CG 4.08Å; I119-L123 WeakPolarHBondContact O-CB 3.47Å; I119-L123 VanDerWaalsContact O-CG 3.32Å; I119-L123 WeakPolarHBondContact O-CG 3.14Å; I119-L123 PolarHBondContact O-N 2.93Å; I120-L123 HydrophobicContact CD1-CD1 4.32Å; I120-L123 PolarHBondContact O-N 2.84Å; L123-L125 VanDerWaalsContact C-N 3.35Å; L123-L125 PolarHBondContact O-N 3.44Å; L123-M126 HydrophobicContact CD2-CE 3.68Å; L123-M126 PolarHBondContact O-N 2.89Å; L123-T127 VanDerWaalsContact O-CB 3.29Å; L123-T127 WeakPolarHBondContact O-CB 3.41Å; L123-T127 PolarHBondContact O-N 3.28Å; L123-T127 PolarHBondContact O-OG1 2.98Å; L123-L164 HydrophobicContact CB-CD1 3.6Å; L123-L164 HydrophobicContact CD1-CD1 4.31Å; L123-F167 HydrophobicContact CD1-CB 4.21Å; L123-F167 HydrophobicContact CD1-CD1 4.27Å; L123-F167 HydrophobicContact CD1-CD2 4.43Å; L123-F167 HydrophobicContact CD1-CG 4.05Å
124N92.4Very high91Very high22 Ų2252 Ų5212%0.11827%0.274CS..Hα-helixtrans-60.3-45.2176.1-171.362.9000111.7I120 R121 G122 T127 E128 L164I120-N124 WeakPolarHBondContact O-CB 3.43Å; I120-N124 PolarHBondContact O-N 3.49Å; R121-N124 PolarHBondContact O-N 3.18Å; G122-N124 VanDerWaalsContact C-N 3.33Å; G122-N124 PolarHBondContact O-N 3.36Å; N124-T127 PolarHBondContact O-N 2.86Å; N124-E128 PolarHBondContact ND2-OE1 2.99Å; N124-E128 WeakPolarHBondContact O-CB 3.45Å; N124-E128 VanDerWaalsContact O-CG 3.29Å; N124-E128 WeakPolarHBondContact O-CG 3.41Å; N124-E128 PolarHBondContact O-N 3.47Å; N124-L164 HydrophobicContact CB-CD2 3.67Å
125L89.8Confident90.7Very high92 Ų9252.9 Ų52.948%0.48228%0.28SS..Hα-helixtrans-62.5-42.8176-67.8172.2000111.8M61 R121 G122 L123 N129M61-L125 HydrophobicContact SD-CD1 4.1Å; R121-L125 WeakPolarHBondContact O-CG 3.32Å; R121-L125 PolarHBondContact O-N 3.42Å; R121-L125 VanDerWaalsContact O-N 3.15Å; G122-L125 PolarHBondContact O-N 2.9Å; L123-L125 VanDerWaalsContact C-N 3.35Å; L123-L125 PolarHBondContact O-N 3.44Å; L125-N129 VanDerWaalsContact O-CG 3.26Å; L125-N129 PolarHBondContact O-N 3.14Å; L125-N129 PolarHBondContact O-ND2 3.25Å
126M91.3Very high90.5Very high95 Ų9557.2 Ų57.247%0.46831%0.307SS..Hα-helixtrans-65.1-47.8177.9-174.6-172.576.700111.7G122 L123 N129 L130G122-M126 PolarHBondContact O-N 3.05Å; L123-M126 HydrophobicContact CD2-CE 3.68Å; L123-M126 PolarHBondContact O-N 2.89Å; M126-N129 WeakPolarHBondContact O-CB 3.44Å; M126-N129 PolarHBondContact O-N 3.44Å; M126-L130 HydrophobicContact CE-CD1 4.23Å; M126-L130 HydrophobicContact CG-CD1 3.97Å; M126-L130 HydrophobicContact CG-CG 4.44Å; M126-L130 WeakPolarHBondContact O-CG 3.49Å; M126-L130 PolarHBondContact O-N 2.92Å
127T92.4Very high90.1Very high10 Ų1059.2 Ų59.26%0.06132%0.318CS..Hα-helixtrans-64.6-43.1-179.8-60.40000111L123 N124 N129 L130 V131 V163L123-T127 VanDerWaalsContact O-CB 3.29Å; L123-T127 WeakPolarHBondContact O-CB 3.41Å; L123-T127 PolarHBondContact O-N 3.28Å; L123-T127 PolarHBondContact O-OG1 2.98Å; N124-T127 PolarHBondContact O-N 2.86Å; T127-N129 VanDerWaalsContact C-N 3.28Å; T127-N129 PolarHBondContact O-N 3.25Å; T127-L130 PolarHBondContact O-N 3.28Å; T127-V131 HydrophobicContact CG2-CG2 3.99Å; T127-V131 WeakPolarHBondContact O-CB 3.25Å; T127-V131 VanDerWaalsContact O-CG2 3.22Å; T127-V131 WeakPolarHBondContact O-CG2 3.46Å; T127-V131 PolarHBondContact O-N 3.01Å; T127-V163 HydrophobicContact CG2-CB 3.87Å; T127-V163 HydrophobicContact CG2-CG1 3.95Å; T127-V163 HydrophobicContact CG2-CG2 4.49Å
128E90.5Very high89.5Confident17 Ų1759.7 Ų59.78%0.07932%0.321CS..Hα-helixtrans-59.2-40.8175.5-75.8-177.2-164.900111.6N124 C132 K157N124-E128 PolarHBondContact ND2-OE1 2.99Å; N124-E128 WeakPolarHBondContact O-CB 3.45Å; N124-E128 VanDerWaalsContact O-CG 3.29Å; N124-E128 WeakPolarHBondContact O-CG 3.41Å; N124-E128 PolarHBondContact O-N 3.47Å; E128-C132 VanDerWaalsContact O-CB 3.31Å; E128-C132 WeakPolarHBondContact O-CB 3.2Å; E128-C132 PolarHBondContact O-N 2.76Å; E128-C132 PolarHBondContact O-SG 3.1Å; E128-C132 VanDerWaalsContact O-SG 3.39Å; E128-K157 IonicContact OE1-NZ 3.17Å; E128-K157 PolarHBondContact OE1-NZ 3.44Å; E128-K157 IonicContact OE2-NZ 3.08Å; E128-K157 PolarHBondContact OE2-NZ 3.06Å
129N90.7Very high88.8Confident62 Ų6261.8 Ų61.833%0.33233%0.33SS..Hα-helixtrans-64.5-48.8174.8-70-22.2000112.4L125 M126 T127 V131 C132 E133 K139L125-N129 VanDerWaalsContact O-CG 3.26Å; L125-N129 PolarHBondContact O-N 3.14Å; L125-N129 PolarHBondContact O-ND2 3.25Å; M126-N129 WeakPolarHBondContact O-CB 3.44Å; M126-N129 PolarHBondContact O-N 3.44Å; T127-N129 VanDerWaalsContact C-N 3.28Å; T127-N129 PolarHBondContact O-N 3.25Å; N129-V131 PolarHBondContact O-N 2.88Å; N129-C132 VanDerWaalsContact O-CB 3.31Å; N129-C132 WeakPolarHBondContact O-CB 3.45Å; N129-C132 PolarHBondContact O-N 3.41Å; N129-E133 WeakPolarHBondContact O-CG 3.13Å; N129-E133 PolarHBondContact O-N 2.99Å; N129-K139 VanDerWaalsContact OD1-CE 3.24Å; N129-K139 WeakPolarHBondContact OD1-CE 3.34Å; N129-K139 PolarHBondContact OD1-NZ 2.97Å
130L92.4Very high88Confident92 Ų9264.9 Ų64.948%0.48234%0.344SS..Hα-helixtrans-63.4-41.8-179.3-71.5172.5000112.1M126 T127 C132 E133 L134M126-L130 HydrophobicContact CE-CD1 4.23Å; M126-L130 HydrophobicContact CG-CD1 3.97Å; M126-L130 HydrophobicContact CG-CG 4.44Å; M126-L130 WeakPolarHBondContact O-CG 3.49Å; M126-L130 PolarHBondContact O-N 2.92Å; T127-L130 PolarHBondContact O-N 3.28Å; L130-C132 VanDerWaalsContact C-N 3.33Å; L130-E133 PolarHBondContact O-N 3.03Å; L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.43Å; L130-L134 PolarHBondContact O-N 2.97Å
131V91Very high87Confident16 Ų1666.1 Ų66.110%0.09735%0.352CS..Hα-helixtrans-67.2-38.8176.8-178.20000109.6T127 N129 L134 T135 L156 C159T127-V131 HydrophobicContact CG2-CG2 3.99Å; T127-V131 WeakPolarHBondContact O-CB 3.25Å; T127-V131 VanDerWaalsContact O-CG2 3.22Å; T127-V131 WeakPolarHBondContact O-CG2 3.46Å; T127-V131 PolarHBondContact O-N 3.01Å; N129-V131 PolarHBondContact O-N 2.88Å; V131-L134 PolarHBondContact O-N 3.32Å; V131-T135 HydrophobicContact CG1-CG2 3.99Å; V131-T135 WeakPolarHBondContact O-CB 3.48Å; V131-T135 PolarHBondContact O-N 3.36Å; V131-T135 PolarHBondContact O-OG1 3.5Å; V131-L156 HydrophobicContact CB-CD1 3.74Å; V131-L156 HydrophobicContact CG1-CD1 3.55Å; V131-C159 HydrophobicContact CG1-CB 3.73Å
132C89.1Confident85.9Confident18 Ų1864.2 Ų64.212%0.12236%0.357CS..Hα-helixtrans-57.8-48.2172.9-890000112.5E128 N129 L130 S136 L137 K139 L156E128-C132 VanDerWaalsContact O-CB 3.31Å; E128-C132 WeakPolarHBondContact O-CB 3.2Å; E128-C132 PolarHBondContact O-N 2.76Å; E128-C132 PolarHBondContact O-SG 3.1Å; E128-C132 VanDerWaalsContact O-SG 3.39Å; N129-C132 VanDerWaalsContact O-CB 3.31Å; N129-C132 WeakPolarHBondContact O-CB 3.45Å; N129-C132 PolarHBondContact O-N 3.41Å; L130-C132 VanDerWaalsContact C-N 3.33Å; C132-S136 VanDerWaalsContact O-CA 3.31Å; C132-S136 WeakPolarHBondContact O-CA 3.29Å; C132-S136 PolarHBondContact O-N 3.06Å; C132-L137 PolarHBondContact SG-O 3.11Å; C132-K139 WeakPolarHBondContact SG-CB 3.44Å; C132-L156 HydrophobicContact CB-CD1 4.21Å; C132-L156 WeakPolarHBondContact SG-CD1 3.13Å; C132-L156 WeakPolarHBondContact SG-CD2 3.19Å
133E91.4Very high84.5Confident157 Ų15769 Ų6973%0.73437%0.367SS*.Hα-helixtrans-63.4-41.5178.4-73.4176.9-171.700111.7N129 L130N129-E133 WeakPolarHBondContact O-CG 3.13Å; N129-E133 PolarHBondContact O-N 2.99Å; L130-E133 PolarHBondContact O-N 3.03Å
134L90.7Very high83.1Confident153 Ų15375.4 Ų75.480%0.80140%0.401SS*.Hα-helixtrans-74.4-36.1-177.8-174.263.8000113.5L130 V131L130-L134 VanDerWaalsContact O-CB 3.3Å; L130-L134 WeakPolarHBondContact O-CB 3.43Å; L130-L134 PolarHBondContact O-N 2.97Å; V131-L134 PolarHBondContact O-N 3.32Å
135T85.4Confident82.1Confident49 Ų4975.8 Ų75.830%0.30141%0.405SS..Hα-helixtrans-105.5-5.8-172630000113.9V131 L137V131-T135 HydrophobicContact CG1-CG2 3.99Å; V131-T135 WeakPolarHBondContact O-CB 3.48Å; V131-T135 PolarHBondContact O-N 3.36Å; V131-T135 PolarHBondContact O-OG1 3.5Å; T135-L137 HydrophobicContact CG2-CD1 4.49Å; T135-L137 PolarHBondContact O-N 3.01Å; T135-L137 WeakPolarHBondContact OG1-CB 3.19Å; T135-L137 VanDerWaalsContact OG1-CD1 3.31Å; T135-L137 WeakPolarHBondContact OG1-CD1 3.36Å; T135-L137 VanDerWaalsContact OG1-CG 3.23Å; T135-L137 WeakPolarHBondContact OG1-CG 3.45Å
136S84.6Confident81.6Confident114 Ų11475 Ų7580%0.79741%0.407SS*.  trans5518-17368.70000114.2C132C132-S136 VanDerWaalsContact O-CA 3.31Å; C132-S136 WeakPolarHBondContact O-CA 3.29Å; C132-S136 PolarHBondContact O-N 3.06Å
137L82.7Confident81.2Confident43 Ų4374.8 Ų74.823%0.22542%0.415CS..  trans-74.4148.2-178.1-70.6175.5000111.8C132 T135 K139 L155 L156C132-L137 PolarHBondContact SG-O 3.11Å; T135-L137 HydrophobicContact CG2-CD1 4.49Å; T135-L137 PolarHBondContact O-N 3.01Å; T135-L137 WeakPolarHBondContact OG1-CB 3.19Å; T135-L137 VanDerWaalsContact OG1-CD1 3.31Å; T135-L137 WeakPolarHBondContact OG1-CD1 3.36Å; T135-L137 VanDerWaalsContact OG1-CG 3.23Å; T135-L137 WeakPolarHBondContact OG1-CG 3.45Å; L137-K139 PolarHBondContact O-N 2.84Å; L137-K139 VanDerWaalsContact O-N 3.11Å; L137-L155 HydrophobicContact CD1-CB 4.13Å; L137-L156 HydrophobicContact CB-CB 4.02Å; L137-L156 HydrophobicContact CB-CD1 4.32Å; L137-L156 HydrophobicContact CD1-CB 4.07Å
138P78.5Confident80.8Confident31 Ų3184.5 Ų84.520%0.20145%0.451CS..  trans-67.4112.9-176.627.5-34.7000111.4E140 R149 H153P138-E140 VanDerWaalsContact C-N 3.27Å; P138-E140 PolarHBondContact O-N 3.5Å; P138-R149 HydrophobicContact CB-CG 3.72Å; P138-R149 HydrophobicContact CG-CG 3.78Å; P138-R149 VanDerWaalsContact CG-O 3.3Å; P138-R149 WeakPolarHBondContact CG-O 3.5Å; P138-H153 HydrophobicContact CG-CB 4.39Å; P138-H153 WeakPolarHBondContact O-CB 3.33Å; P138-H153 PolarHBondContact O-ND1 3Å
139K75.3Confident80.6Confident90 Ų9089.7 Ų89.739%0.39147%0.47SS..SBendtrans-64.4-33.8174.4-165.2175.3167.5-172.40112.8N129 C132 L137 H153N129-K139 VanDerWaalsContact OD1-CE 3.24Å; N129-K139 WeakPolarHBondContact OD1-CE 3.34Å; N129-K139 PolarHBondContact OD1-NZ 2.97Å; C132-K139 WeakPolarHBondContact SG-CB 3.44Å; L137-K139 PolarHBondContact O-N 2.84Å; L137-K139 VanDerWaalsContact O-N 3.11Å; K139-H153 PolarHBondContact O-CE1 3.31Å; K139-H153 PolarHBondContact O-ND1 3.44Å
140E74.6Confident80.4Confident101 Ų10190.2 Ų90.247%0.47247%0.472SS..  trans-125.3137.3-171.8-68.4174.3-165.500111.6P138 R149P138-E140 VanDerWaalsContact C-N 3.27Å; P138-E140 PolarHBondContact O-N 3.5Å; E140-R149 PolarHBondContact O-NE 3.23Å; E140-R149 VanDerWaalsContact O-NE 3.07Å; E140-R149 PolarHBondContact O-NH2 2.96Å
141V71.4Confident80.2Confident41 Ų4190.9 Ų90.925%0.24848%0.475CS..  trans-126.4117.1-177.1-177.60000107S145 L150 H153V141-S145 WeakPolarHBondContact CG1-OG 3.22Å; V141-L150 HydrophobicContact CG1-CD1 4.01Å; V141-H153 HydrophobicContact CG2-CB 3.17Å
142S66.4Low80.1Confident77 Ų7790.5 Ų90.554%0.53848%0.475SS..  trans-81.9156.8167.360.70000109.9L144 S145S142-L144 PolarHBondContact O-N 2.69Å; S142-S145 VanDerWaalsContact O-CB 3.31Å; S142-S145 WeakPolarHBondContact O-CB 3.42Å; S142-S145 PolarHBondContact O-N 3.33Å; S142-S145 PolarHBondContact O-OG 3.34Å
143K61.6Low80.2Confident136 Ų13689.9 Ų89.959%0.59147%0.47SS*.THydrogen-bonded Turntrans-55.8-25.2179.9-65-176.3179.4-177.40113.6
144L63.8Low80.3Confident168 Ų16884.4 Ų84.488%0.8845%0.446SS*.THydrogen-bonded Turntrans-99.99.1-178.5-157.865.9000113.5S142S142-L144 PolarHBondContact O-N 2.69Å
145S70.2Confident80.4Confident29 Ų2981.2 Ų81.220%0.20343%0.429CS..  trans-67.8147.4-177.966.70000112.3V141 S142V141-S145 WeakPolarHBondContact CG1-OG 3.22Å; S142-S145 VanDerWaalsContact O-CB 3.31Å; S142-S145 WeakPolarHBondContact O-CB 3.42Å; S142-S145 PolarHBondContact O-N 3.33Å; S142-S145 PolarHBondContact O-OG 3.34Å
146S80.3Confident80.8Confident75 Ų7578.9 Ų78.952%0.52442%0.415SS..  trans-56.7144.5173.61800000110.8R148 R149 L150S146-R148 PolarHBondContact O-N 2.94Å; S146-R149 WeakPolarHBondContact O-CA 3.21Å; S146-R149 WeakPolarHBondContact O-CB 3.45Å; S146-R149 PolarHBondContact O-N 3.27Å; S146-L150 PolarHBondContact O-N 3.42Å; S146-L150 VanDerWaalsContact O-N 3.13Å
147S81.5Confident81.2Confident91 Ų9174.7 Ų74.764%0.63638%0.382SS*.Hα-helixtrans-51.7-31.4176.558.10000113.3L150 L151S147-L150 PolarHBondContact O-N 2.88Å; S147-L151 WeakPolarHBondContact O-CB 3.43Å; S147-L151 PolarHBondContact O-N 3.24Å
148R85.2Confident81.8Confident215 Ų21574.9 Ų74.981%0.81139%0.385SS*.Hα-helixtrans-62.7-41173.5-66.8-175.2-179.7178.30.6112.6S146 L151 G152S146-R148 PolarHBondContact O-N 2.94Å; R148-L151 PolarHBondContact O-N 3.47Å; R148-G152 PolarHBondContact O-N 2.81Å
149R85.8Confident82.5Confident126 Ų12676 Ų7648%0.47539%0.393SS..Hα-helixtrans-70.5-39.2177.8-171.4171.5176.6137.1-2.5110.9P138 E140 S146 G152 H153P138-R149 HydrophobicContact CB-CG 3.72Å; P138-R149 HydrophobicContact CG-CG 3.78Å; P138-R149 VanDerWaalsContact CG-O 3.3Å; P138-R149 WeakPolarHBondContact CG-O 3.5Å; E140-R149 PolarHBondContact O-NE 3.23Å; E140-R149 VanDerWaalsContact O-NE 3.07Å; E140-R149 PolarHBondContact O-NH2 2.96Å; S146-R149 WeakPolarHBondContact O-CA 3.21Å; S146-R149 WeakPolarHBondContact O-CB 3.45Å; S146-R149 PolarHBondContact O-N 3.27Å; R149-G152 PolarHBondContact O-N 2.83Å; R149-H153 PolarHBondContact O-N 3.44Å
150L86.4Confident83.4Confident73 Ų7371.7 Ų71.738%0.38237%0.374SS..Hα-helixtrans-60.7-47.1172.7178.564000111.4V141 S146 S147 G152 H153 L154V141-L150 HydrophobicContact CG1-CD1 4.01Å; S146-L150 PolarHBondContact O-N 3.42Å; S146-L150 VanDerWaalsContact O-N 3.13Å; S147-L150 PolarHBondContact O-N 2.88Å; L150-G152 PolarHBondContact O-N 3.42Å; L150-H153 PolarHBondContact O-N 3.2Å; L150-L154 HydrophobicContact CD1-CG 4.48Å; L150-L154 HydrophobicContact CG-CD1 4.35Å; L150-L154 WeakPolarHBondContact O-CG 3.33Å; L150-L154 PolarHBondContact O-N 3.16Å
151L87.1Confident84.4Confident105 Ų10568.4 Ų68.455%0.5536%0.358SS..Hα-helixtrans-61.6-43.2177.6-177.961.3000111.8S147 R148 H153 L154 L155S147-L151 WeakPolarHBondContact O-CB 3.43Å; S147-L151 PolarHBondContact O-N 3.24Å; R148-L151 PolarHBondContact O-N 3.47Å; L151-H153 VanDerWaalsContact C-N 3.29Å; L151-H153 PolarHBondContact O-N 3.25Å; L151-L154 PolarHBondContact O-N 2.97Å; L151-L155 HydrophobicContact CG-CD1 4.42Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.32Å
152G90.2Very high85.5Confident9 Ų969 Ų699%0.09336%0.361CS..Hα-helixtrans-58.7-40.1174.800000112.8R148 R149 L150 L155 L156R148-G152 PolarHBondContact O-N 2.81Å; R149-G152 PolarHBondContact O-N 2.83Å; L150-G152 PolarHBondContact O-N 3.42Å; G152-L155 PolarHBondContact O-N 3.31Å; G152-L156 PolarHBondContact O-N 2.96Å
153H91.4Very high86.8Confident5 Ų569 Ų692%0.02336%0.358CS..Hα-helixtrans-69.9-38.1175.8-177.775.4000113.1P138 K139 V141 R149 L150 L151 L155 L156 K157 Y248P138-H153 HydrophobicContact CG-CB 4.39Å; P138-H153 WeakPolarHBondContact O-CB 3.33Å; P138-H153 PolarHBondContact O-ND1 3Å; K139-H153 PolarHBondContact O-CE1 3.31Å; K139-H153 PolarHBondContact O-ND1 3.44Å; V141-H153 HydrophobicContact CG2-CB 3.17Å; R149-H153 PolarHBondContact O-N 3.44Å; L150-H153 PolarHBondContact O-N 3.2Å; L151-H153 VanDerWaalsContact C-N 3.29Å; L151-H153 PolarHBondContact O-N 3.25Å; H153-L155 VanDerWaalsContact C-N 3.33Å; H153-L156 WeakPolarHBondContact O-CB 3.42Å; H153-L156 PolarHBondContact O-N 3.47Å; H153-K157 WeakPolarHBondContact NE2-CE 3.49Å; H153-K157 WeakPolarHBondContact O-CG 3.3Å; H153-K157 PolarHBondContact O-N 3.32Å; H153-Y248 AromaticContact CD2-CE1 3.74Å; H153-Y248 AromaticContact CD2-CZ 3.84Å; H153-Y248 PolarHBondContact CD2-OH 3.29Å; H153-Y248 AromaticContact NE2-CE1 3.71Å; H153-Y248 AromaticContact NE2-CZ 3.39Å; H153-Y248 PolarHBondContact NE2-OH 3.4Å; H153-Y248 VanDerWaalsContact NE2-OH 3.07Å
154L92.5Very high88.3Confident41 Ų4162.6 Ų62.622%0.21533%0.33CS..Hα-helixtrans-64.3-39.7174.1-68.7176.3000111.3L150 L151 K157 V158 V245 Y248 V249L150-L154 HydrophobicContact CD1-CG 4.48Å; L150-L154 HydrophobicContact CG-CD1 4.35Å; L150-L154 WeakPolarHBondContact O-CG 3.33Å; L150-L154 PolarHBondContact O-N 3.16Å; L151-L154 PolarHBondContact O-N 2.97Å; L154-K157 PolarHBondContact O-N 2.72Å; L154-V158 WeakPolarHBondContact O-CG2 3.46Å; L154-V158 PolarHBondContact O-N 2.84Å; L154-V245 HydrophobicContact CD2-CG1 4.25Å; L154-Y248 HydrophobicContact CD2-CD1 4.12Å; L154-Y248 HydrophobicContact CD2-CE1 4.26Å; L154-V249 HydrophobicContact CD2-CG2 3.65Å
155L93.4Very high89.7Confident86 Ų8654.6 Ų54.645%0.4529%0.288SS..Hα-helixtrans-62-43.5173.8-72.1171.9000111.9L137 L151 G152 H153 K157 V158 C159L137-L155 HydrophobicContact CD1-CB 4.13Å; L151-L155 HydrophobicContact CG-CD1 4.42Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 3.32Å; G152-L155 PolarHBondContact O-N 3.31Å; H153-L155 VanDerWaalsContact C-N 3.33Å; L155-K157 VanDerWaalsContact C-N 3.32Å; L155-K157 PolarHBondContact O-N 2.85Å; L155-V158 WeakPolarHBondContact O-CB 3.27Å; L155-V158 PolarHBondContact O-N 3.16Å; L155-C159 PolarHBondContact O-N 3.46Å; L155-C159 PolarHBondContact O-SG 3.43Å; L155-C159 VanDerWaalsContact O-SG 3.41Å
156L93.2Very high90.7Very high0 Ų053.3 Ų53.30%028%0.279CS..Hα-helixtrans-55.5-47.6172.7172.476.5000111.4V131 C132 L137 G152 H153 C159 S160V131-L156 HydrophobicContact CB-CD1 3.74Å; V131-L156 HydrophobicContact CG1-CD1 3.55Å; C132-L156 HydrophobicContact CB-CD1 4.21Å; C132-L156 WeakPolarHBondContact SG-CD1 3.13Å; C132-L156 WeakPolarHBondContact SG-CD2 3.19Å; L137-L156 HydrophobicContact CB-CB 4.02Å; L137-L156 HydrophobicContact CB-CD1 4.32Å; L137-L156 HydrophobicContact CD1-CB 4.07Å; G152-L156 PolarHBondContact O-N 2.96Å; H153-L156 WeakPolarHBondContact O-CB 3.42Å; H153-L156 PolarHBondContact O-N 3.47Å; L156-C159 PolarHBondContact O-N 3.49Å; L156-S160 WeakPolarHBondContact O-CB 3.48Å; L156-S160 PolarHBondContact O-N 3.41Å; L156-S160 PolarHBondContact O-OG 3.32Å
157K92.6Very high91.3Very high26 Ų2650.6 Ų50.611%0.11326%0.258CS..Hα-helixtrans-62.1-43.3177-69.1-64.9-169-171.80111.6E128 H153 L154 L155 S160 W161 V245E128-K157 IonicContact OE1-NZ 3.17Å; E128-K157 PolarHBondContact OE1-NZ 3.44Å; E128-K157 IonicContact OE2-NZ 3.08Å; E128-K157 PolarHBondContact OE2-NZ 3.06Å; H153-K157 WeakPolarHBondContact NE2-CE 3.49Å; H153-K157 WeakPolarHBondContact O-CG 3.3Å; H153-K157 PolarHBondContact O-N 3.32Å; L154-K157 PolarHBondContact O-N 2.72Å; L155-K157 VanDerWaalsContact C-N 3.32Å; L155-K157 PolarHBondContact O-N 2.85Å; K157-S160 PolarHBondContact O-N 3.42Å; K157-W161 VanDerWaalsContact O-CD1 3.24Å; K157-W161 PolarHBondContact O-N 3.11Å; K157-V245 HydrophobicContact CB-CG2 4.17Å
158V95.2Very high91.8Very high48 Ų4847.8 Ų47.829%0.29123%0.234SC..Hα-helixtrans-58.3-52.6175.9166.70000110.9L154 L155 S160 W161 V162 V241 V245L154-V158 WeakPolarHBondContact O-CG2 3.46Å; L154-V158 PolarHBondContact O-N 2.84Å; L155-V158 WeakPolarHBondContact O-CB 3.27Å; L155-V158 PolarHBondContact O-N 3.16Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 3.24Å; V158-W161 PolarHBondContact O-N 3.23Å; V158-V162 WeakPolarHBondContact O-CG2 3.45Å; V158-V162 PolarHBondContact O-N 2.7Å; V158-V241 HydrophobicContact CB-CG1 4.24Å; V158-V241 HydrophobicContact CG1-CG1 4.02Å; V158-V241 HydrophobicContact CG2-CG1 3.9Å; V158-V245 HydrophobicContact CG2-CG1 4.3Å; V158-V245 HydrophobicContact CG2-CG2 3.95Å
159C94.4Very high92.1Very high54 Ų5437.6 Ų37.637%0.36520%0.196SC..Hα-helixtrans-58.6-41.4178.6-70.80000112V131 L155 L156 V162 V163V131-C159 HydrophobicContact CG1-CB 3.73Å; L155-C159 PolarHBondContact O-N 3.46Å; L155-C159 PolarHBondContact O-SG 3.43Å; L155-C159 VanDerWaalsContact O-SG 3.41Å; L156-C159 PolarHBondContact O-N 3.49Å; C159-V162 PolarHBondContact O-N 3.26Å; C159-V163 PolarHBondContact O-N 3.21Å
160S94.4Very high92.2Very high0 Ų031.8 Ų31.80%018%0.175CC..Hα-helixtrans-62.8-45.7178.9-55.70000111.8L156 K157 V158 V162 V163 L164L156-S160 WeakPolarHBondContact O-CB 3.48Å; L156-S160 PolarHBondContact O-N 3.41Å; L156-S160 PolarHBondContact O-OG 3.32Å; K157-S160 PolarHBondContact O-N 3.42Å; V158-S160 VanDerWaalsContact C-N 3.28Å; V158-S160 PolarHBondContact O-N 3.24Å; S160-V162 PolarHBondContact O-N 2.91Å; S160-V163 PolarHBondContact O-N 3.5Å; S160-L164 WeakPolarHBondContact O-CB 3.38Å; S160-L164 PolarHBondContact O-N 3.29Å
161W95.3Very high92.4Very high32 Ų3228.5 Ų28.512%0.12116%0.158CC..Hα-helixtrans-69.7-30178.4-81.1106.5000113.7K157 V158 L164 T165 F168 V240 V241 N244K157-W161 VanDerWaalsContact O-CD1 3.24Å; K157-W161 PolarHBondContact O-N 3.11Å; V158-W161 PolarHBondContact O-N 3.23Å; W161-L164 HydrophobicContact CD2-CD2 4.5Å; W161-L164 HydrophobicContact CE3-CB 4.36Å; W161-L164 HydrophobicContact CE3-CD2 3.94Å; W161-L164 HydrophobicContact CE3-CG 4.48Å; W161-L164 HydrophobicContact CH2-CD2 4.03Å; W161-L164 HydrophobicContact CZ3-CD2 3.69Å; W161-L164 HydrophobicContact CZ3-CG 4.41Å; W161-L164 PolarHBondContact O-N 3.19Å; W161-T165 WeakPolarHBondContact O-CB 3.38Å; W161-T165 PolarHBondContact O-N 3.15Å; W161-T165 PolarHBondContact O-OG1 2.54Å; W161-F168 HydrophobicContact CZ3-CD2 4.13Å; W161-F168 HydrophobicContact CZ3-CG 4.3Å; W161-V240 HydrophobicContact CE3-CG1 4.31Å; W161-V241 HydrophobicContact CB-CG2 3.95Å; W161-N244 HydrophobicContact CD2-CB 3.43Å; W161-N244 VanDerWaalsContact CD2-CB 3.43Å; W161-N244 HydrophobicContact CE3-CB 3.9Å; W161-N244 HydrophobicContact CG-CB 3.89Å; W161-N244 HydrophobicContact CH2-CB 3.96Å; W161-N244 WeakPolarHBondContact CH2-OD1 3.4Å; W161-N244 HydrophobicContact CZ2-CB 3.51Å; W161-N244 VanDerWaalsContact CZ2-CG 3.44Å; W161-N244 WeakPolarHBondContact CZ2-OD1 3.48Å; W161-N244 HydrophobicContact CZ3-CB 4.14Å; W161-N244 VanDerWaalsContact CZ3-CG 3.42Å; W161-N244 WeakPolarHBondContact CZ3-ND2 3.29Å
162V94.5Very high92.7Very high52 Ų5223.7 Ų23.732%0.31513%0.133SC..Hα-helixtrans-61.4-47.8172170.90000110.6V158 C159 S160 L164 T165 F237 V241V158-V162 WeakPolarHBondContact O-CG2 3.45Å; V158-V162 PolarHBondContact O-N 2.7Å; C159-V162 PolarHBondContact O-N 3.26Å; S160-V162 PolarHBondContact O-N 2.91Å; V162-L164 VanDerWaalsContact C-N 3.31Å; V162-L164 PolarHBondContact O-N 3.47Å; V162-T165 PolarHBondContact O-N 3.06Å; V162-F237 HydrophobicContact CG1-CD1 4.16Å; V162-F237 HydrophobicContact CG1-CD2 4.37Å; V162-F237 HydrophobicContact CG1-CE1 4.14Å; V162-F237 HydrophobicContact CG1-CE2 4.36Å; V162-F237 HydrophobicContact CG1-CG 4.3Å; V162-F237 HydrophobicContact CG1-CZ 4.26Å; V162-F237 VanDerWaalsContact O-CE1 3.22Å; V162-F237 WeakPolarHBondContact O-CE1 3.3Å; V162-V241 HydrophobicContact CG2-CG2 3.75Å
163V93Very high92.6Very high79 Ų7923.7 Ų23.748%0.47913%0.131SC..Hα-helixtrans-64.6-36.9177.5175.30000111.5T127 C159 S160 P166T127-V163 HydrophobicContact CG2-CB 3.87Å; T127-V163 HydrophobicContact CG2-CG1 3.95Å; T127-V163 HydrophobicContact CG2-CG2 4.49Å; C159-V163 PolarHBondContact O-N 3.21Å; S160-V163 PolarHBondContact O-N 3.5Å; V163-P166 WeakPolarHBondContact O-CD 3.38Å
164L94Very high92.5Very high0 Ų024.4 Ų24.40%013%0.134CC..Hα-helixtrans-79.8-22.5-176.9-166.162.7000114.1I120 L123 N124 S160 W161 V162 F167 F168I120-L164 HydrophobicContact CD1-CD1 4.37Å; I120-L164 HydrophobicContact CG2-CD1 4.38Å; I120-L164 HydrophobicContact CG2-CD2 4.02Å; I120-L164 HydrophobicContact CG2-CG 4.34Å; L123-L164 HydrophobicContact CB-CD1 3.6Å; L123-L164 HydrophobicContact CD1-CD1 4.31Å; N124-L164 HydrophobicContact CB-CD2 3.67Å; S160-L164 WeakPolarHBondContact O-CB 3.38Å; S160-L164 PolarHBondContact O-N 3.29Å; W161-L164 HydrophobicContact CD2-CD2 4.5Å; W161-L164 HydrophobicContact CE3-CB 4.36Å; W161-L164 HydrophobicContact CE3-CD2 3.94Å; W161-L164 HydrophobicContact CE3-CG 4.48Å; W161-L164 HydrophobicContact CH2-CD2 4.03Å; W161-L164 HydrophobicContact CZ3-CD2 3.69Å; W161-L164 HydrophobicContact CZ3-CG 4.41Å; W161-L164 PolarHBondContact O-N 3.19Å; V162-L164 VanDerWaalsContact C-N 3.31Å; V162-L164 PolarHBondContact O-N 3.47Å; L164-F167 HydrophobicContact CD1-CB 4.38Å; L164-F167 PolarHBondContact O-N 3.28Å; L164-F168 PolarHBondContact O-N 2.96Å
165T93.5Very high92.5Very high0 Ų022.9 Ų22.90%013%0.126CC..Hα-helixtrans-48.9-47.7-175.6-67.20000115.3W161 V162 F167 F168 S169 V233 L236 F237 V240W161-T165 WeakPolarHBondContact O-CB 3.38Å; W161-T165 PolarHBondContact O-N 3.15Å; W161-T165 PolarHBondContact O-OG1 2.54Å; V162-T165 PolarHBondContact O-N 3.06Å; T165-F167 VanDerWaalsContact C-N 3.3Å; T165-F167 PolarHBondContact O-N 2.9Å; T165-F168 PolarHBondContact O-N 3.23Å; T165-S169 WeakPolarHBondContact O-CB 3.3Å; T165-S169 PolarHBondContact O-N 3.22Å; T165-V233 HydrophobicContact CG2-CG1 4.32Å; T165-L236 HydrophobicContact CG2-CB 3.88Å; T165-F237 HydrophobicContact CG2-CD1 3.6Å; T165-F237 HydrophobicContact CG2-CE1 4.01Å; T165-V240 HydrophobicContact CG2-CB 4.15Å; T165-V240 HydrophobicContact CG2-CG1 4.27Å; T165-V240 HydrophobicContact CG2-CG2 4.09Å
166P91Very high92.3Very high2 Ų218.8 Ų18.81%0.01311%0.105CC..Hα-helixtrans-59.1-40.7178.120.1-33000112.9V163 A170 G194 L198 V233V163-P166 WeakPolarHBondContact O-CD 3.38Å; P166-A170 PolarHBondContact O-N 3.49Å; P166-G194 WeakPolarHBondContact CB-O 3.4Å; P166-L198 HydrophobicContact CB-CB 4.13Å; P166-L198 HydrophobicContact CG-CB 4.39Å; P166-L198 HydrophobicContact CG-CD1 4.34Å; P166-V233 HydrophobicContact CB-CG1 4.11Å
167F91.9Very high92.2Very high18 Ų1820.1 Ų20.18%0.07911%0.111CC..Hα-helixtrans-71.6-42.7179.3-55.3-76.2000111.4I120 L123 L164 T165 S169 A170 S171 V191 F195I120-F167 VanDerWaalsContact CD1-C 3.47Å; I120-F167 HydrophobicContact CD1-CB 3.44Å; I120-F167 VanDerWaalsContact CD1-CB 3.44Å; L123-F167 HydrophobicContact CD1-CB 4.21Å; L123-F167 HydrophobicContact CD1-CD1 4.27Å; L123-F167 HydrophobicContact CD1-CD2 4.43Å; L123-F167 HydrophobicContact CD1-CG 4.05Å; L164-F167 HydrophobicContact CD1-CB 4.38Å; L164-F167 PolarHBondContact O-N 3.28Å; T165-F167 VanDerWaalsContact C-N 3.3Å; T165-F167 PolarHBondContact O-N 2.9Å; F167-S169 VanDerWaalsContact C-N 3.28Å; F167-S169 PolarHBondContact O-N 3.31Å; F167-A170 WeakPolarHBondContact O-CB 3.32Å; F167-A170 PolarHBondContact O-N 2.99Å; F167-A170 VanDerWaalsContact O-N 3.12Å; F167-S171 PolarHBondContact O-N 3.28Å; F167-V191 HydrophobicContact CD1-CG1 4.31Å; F167-V191 HydrophobicContact CE1-CG1 3.85Å; F167-V191 WeakPolarHBondContact CE1-O 3.36Å; F167-F195 HydrophobicContact CE1-CD1 4.43Å; F167-F195 AromaticContact CE1-CD2 3.79Å; F167-F195 HydrophobicContact CE1-CD2 3.79Å; F167-F195 HydrophobicContact CE1-CE1 4.39Å; F167-F195 AromaticContact CE1-CE2 3.73Å; F167-F195 HydrophobicContact CE1-CE2 3.73Å; F167-F195 HydrophobicContact CE1-CG 4.16Å; F167-F195 HydrophobicContact CE1-CZ 4.05Å; F167-F195 HydrophobicContact CZ-CD1 4.08Å; F167-F195 HydrophobicContact CZ-CD2 4.15Å; F167-F195 AromaticContact CZ-CE1 3.77Å; F167-F195 HydrophobicContact CZ-CE1 3.77Å; F167-F195 AromaticContact CZ-CE2 3.83Å; F167-F195 HydrophobicContact CZ-CE2 3.83Å; F167-F195 HydrophobicContact CZ-CG 4.27Å; F167-F195 AromaticContact CZ-CZ 3.64Å; F167-F195 HydrophobicContact CZ-CZ 3.64Å
168F92.9Very high91.9Very high33 Ų3318.9 Ų18.915%0.14511%0.106CC..Hα-helixtrans-58.8-40.7174.9179.1-107.3000112I120 W161 L164 T165 A170 S171 I172 V240 V357I120-F168 HydrophobicContact CG2-CD2 4.38Å; W161-F168 HydrophobicContact CZ3-CD2 4.13Å; W161-F168 HydrophobicContact CZ3-CG 4.3Å; L164-F168 PolarHBondContact O-N 2.96Å; T165-F168 PolarHBondContact O-N 3.23Å; F168-A170 VanDerWaalsContact C-N 3.33Å; F168-A170 PolarHBondContact O-N 2.95Å; F168-S171 PolarHBondContact O-N 2.9Å; F168-S171 PolarHBondContact O-OG 3.41Å; F168-I172 HydrophobicContact CD1-CD1 3.72Å; F168-I172 HydrophobicContact CE1-CD1 3.27Å; F168-I172 HydrophobicContact CE1-CG1 4.28Å; F168-I172 HydrophobicContact CE2-CD1 4.23Å; F168-I172 HydrophobicContact CE2-CG1 4.43Å; F168-I172 HydrophobicContact CG-CD1 4.38Å; F168-I172 HydrophobicContact CZ-CD1 3.57Å; F168-I172 HydrophobicContact CZ-CG1 4.19Å; F168-I172 WeakPolarHBondContact O-CG1 3.26Å; F168-I172 PolarHBondContact O-N 3.19Å; F168-V240 HydrophobicContact CD1-CG1 3.65Å; F168-V240 HydrophobicContact CD1-CG2 4.17Å; F168-V240 HydrophobicContact CE1-CG1 4.02Å; F168-V240 HydrophobicContact CE1-CG2 4.33Å; F168-V240 HydrophobicContact CG-CG1 4.46Å; F168-V357 HydrophobicContact CE1-CG1 4.15Å
169S91.1Very high91.3Very high0 Ų019.1 Ų19.10%011%0.106CC..Hα-helixtrans-64.1-37.3175.5-171.60000112.6T165 F167 V173 R197 L236 C361T165-S169 WeakPolarHBondContact O-CB 3.3Å; T165-S169 PolarHBondContact O-N 3.22Å; F167-S169 VanDerWaalsContact C-N 3.28Å; F167-S169 PolarHBondContact O-N 3.31Å; S169-V173 PolarHBondContact O-N 2.78Å; S169-R197 PolarHBondContact OG-NH1 3.36Å; S169-L236 WeakPolarHBondContact OG-CD1 3.07Å; S169-C361 PolarHBondContact OG-O 3.41Å
170A88.3Confident90.4Very high5 Ų521.3 Ų21.34%0.04111%0.109CC..Hα-helixtrans-69.2-41.9174.200000112.2P166 F167 F168 I172 V173 E174 C190 D193P166-A170 PolarHBondContact O-N 3.49Å; F167-A170 WeakPolarHBondContact O-CB 3.32Å; F167-A170 PolarHBondContact O-N 2.99Å; F167-A170 VanDerWaalsContact O-N 3.12Å; F168-A170 VanDerWaalsContact C-N 3.33Å; F168-A170 PolarHBondContact O-N 2.95Å; A170-I172 VanDerWaalsContact C-N 3.35Å; A170-I172 PolarHBondContact O-N 3.02Å; A170-V173 WeakPolarHBondContact O-CB 3.43Å; A170-V173 PolarHBondContact O-N 3.01Å; A170-E174 PolarHBondContact O-N 3.46Å; A170-C190 WeakPolarHBondContact CB-O 3.37Å; A170-D193 HydrophobicContact CB-CB 3.93Å
171S91.1Very high89.3Confident4 Ų423 Ų233%0.02812%0.122CC..Hα-helixtrans-65.5-37.8179.572.90000112.3I120 F167 F168 V173 E174 I175I120-S171 WeakPolarHBondContact CG1-OG 3.31Å; F167-S171 PolarHBondContact O-N 3.28Å; F168-S171 PolarHBondContact O-N 2.9Å; F168-S171 PolarHBondContact O-OG 3.41Å; S171-V173 VanDerWaalsContact C-N 3.27Å; S171-V173 PolarHBondContact O-N 3.46Å; S171-E174 PolarHBondContact O-N 2.94Å; S171-E174 VanDerWaalsContact O-N 3.15Å; S171-I175 WeakPolarHBondContact O-CD1 3.44Å; S171-I175 WeakPolarHBondContact O-CG1 3.27Å; S171-I175 PolarHBondContact O-N 3.39Å
172I92.1Very high88.1Confident3 Ų323.4 Ų23.42%0.01513%0.131CC..Hα-helixtrans-57.4-44.8174.7-73.3165.7000110.3F168 A170 E174 I175 I176 L358 C361 V362F168-I172 HydrophobicContact CD1-CD1 3.72Å; F168-I172 HydrophobicContact CE1-CD1 3.27Å; F168-I172 HydrophobicContact CE1-CG1 4.28Å; F168-I172 HydrophobicContact CE2-CD1 4.23Å; F168-I172 HydrophobicContact CE2-CG1 4.43Å; F168-I172 HydrophobicContact CG-CD1 4.38Å; F168-I172 HydrophobicContact CZ-CD1 3.57Å; F168-I172 HydrophobicContact CZ-CG1 4.19Å; F168-I172 WeakPolarHBondContact O-CG1 3.26Å; F168-I172 PolarHBondContact O-N 3.19Å; A170-I172 VanDerWaalsContact C-N 3.35Å; A170-I172 PolarHBondContact O-N 3.02Å; I172-E174 VanDerWaalsContact C-N 3.28Å; I172-E174 PolarHBondContact O-N 3.48Å; I172-I175 PolarHBondContact O-N 3.49Å; I172-I176 WeakPolarHBondContact O-CG1 3.1Å; I172-I176 PolarHBondContact O-N 2.8Å; I172-I176 VanDerWaalsContact O-N 3.11Å; I172-L358 HydrophobicContact CB-CD2 4.39Å; I172-L358 HydrophobicContact CD1-CD2 3.85Å; I172-L358 HydrophobicContact CG1-CD2 3.91Å; I172-L358 HydrophobicContact CG2-CD2 3.53Å; I172-C361 HydrophobicContact CB-CB 4.45Å; I172-C361 HydrophobicContact CD1-CB 3.88Å; I172-C361 HydrophobicContact CG2-CB 4.33Å; I172-V362 HydrophobicContact CG2-CG2 3.51Å
173V89.4Confident86.8Confident10 Ų1026.3 Ų26.36%0.06114%0.141CC..Hα-helixtrans-59.7-40.7177.8162.50000111.6S169 A170 S171 I176 Q177 V362 T365 T367S169-V173 PolarHBondContact O-N 2.78Å; A170-V173 WeakPolarHBondContact O-CB 3.43Å; A170-V173 PolarHBondContact O-N 3.01Å; S171-V173 VanDerWaalsContact C-N 3.27Å; S171-V173 PolarHBondContact O-N 3.46Å; V173-I176 PolarHBondContact O-N 3.39Å; V173-Q177 VanDerWaalsContact O-CB 3.26Å; V173-Q177 WeakPolarHBondContact O-CB 3.23Å; V173-Q177 PolarHBondContact O-N 3.01Å; V173-V362 HydrophobicContact CG2-CG2 4.27Å; V173-T365 HydrophobicContact CG2-CG2 3.85Å; V173-T367 HydrophobicContact CG1-CG2 3.52Å
174E88.7Confident85.3Confident19 Ų1928.7 Ų28.79%0.08916%0.158CC..Hα-helixtrans-68.4-35.7177.9-166.5176.7178.200112.8S116 A170 S171 I172 I176 T185S116-E174 WeakPolarHBondContact CB-OE2 3.36Å; S116-E174 PolarHBondContact OG-OE2 2.87Å; A170-E174 PolarHBondContact O-N 3.46Å; S171-E174 PolarHBondContact O-N 2.94Å; S171-E174 VanDerWaalsContact O-N 3.15Å; I172-E174 VanDerWaalsContact C-N 3.28Å; I172-E174 PolarHBondContact O-N 3.48Å; E174-I176 VanDerWaalsContact C-N 3.35Å; E174-T185 HydrophobicContact CG-CG2 4.22Å; E174-T185 VanDerWaalsContact OE1-CB 3.28Å; E174-T185 WeakPolarHBondContact OE1-CB 3.43Å; E174-T185 PolarHBondContact OE1-OG1 3.17Å
175I91.7Very high83.9Confident10 Ų1032.1 Ų32.15%0.05118%0.179CC..Hα-helixtrans-64.4-39.8176.3-69159.1000111.7V73 N76 V117 S171 I172V73-I175 HydrophobicContact CG2-CG2 4.11Å; N76-I175 HydrophobicContact CB-CG2 4.42Å; V117-I175 HydrophobicContact CG2-CD1 3.72Å; V117-I175 HydrophobicContact CG2-CG1 4.07Å; S171-I175 WeakPolarHBondContact O-CD1 3.44Å; S171-I175 WeakPolarHBondContact O-CG1 3.27Å; S171-I175 PolarHBondContact O-N 3.39Å; I172-I175 PolarHBondContact O-N 3.49Å
176I90.6Very high82.6Confident0 Ų035.9 Ų35.90%020%0.202CC..Hα-helixtrans-94.5-13.8-17358.2118.2000114.3N76 Q77 V80 I172 V173 E174 S178 V362 V369 I381N76-I176 HydrophobicContact CB-CG2 3.65Å; Q77-I176 VanDerWaalsContact NE2-C 3.28Å; Q77-I176 VanDerWaalsContact NE2-CA 3.29Å; Q77-I176 PolarHBondContact NE2-O 3.46Å; V80-I176 HydrophobicContact CG1-CD1 4.45Å; V80-I176 HydrophobicContact CG2-CG2 4.17Å; I172-I176 WeakPolarHBondContact O-CG1 3.1Å; I172-I176 PolarHBondContact O-N 2.8Å; I172-I176 VanDerWaalsContact O-N 3.11Å; V173-I176 PolarHBondContact O-N 3.39Å; E174-I176 VanDerWaalsContact C-N 3.35Å; I176-S178 PolarHBondContact O-N 2.89Å; I176-V362 HydrophobicContact CD1-CB 4.06Å; I176-V362 HydrophobicContact CD1-CG1 3.3Å; I176-V362 HydrophobicContact CD1-CG2 3.49Å; I176-V362 VanDerWaalsContact CD1-CG2 3.49Å; I176-V362 HydrophobicContact CG1-CG1 4.49Å; I176-V362 HydrophobicContact CG1-CG2 3.89Å; I176-V369 HydrophobicContact CD1-CG2 3.8Å; I176-I381 HydrophobicContact CD1-CD1 4.09Å
177Q89.3Confident81.6Confident28 Ų2840.6 Ų40.613%0.13123%0.227CC..SBendtrans-67.2132.5178.9-173.6169.96.300111.1V173 A181V173-Q177 VanDerWaalsContact O-CB 3.26Å; V173-Q177 WeakPolarHBondContact O-CB 3.23Å; V173-Q177 PolarHBondContact O-N 3.01Å; Q177-A181 PolarHBondContact NE2-O 3.28Å
178S87Confident80.9Confident0 Ų045.6 Ų45.60%025%0.253CS..  trans-70.5132176.8-1770000111.4Q105 I176 K180 A181 S182 L368 D370 V378Q105-S178 PolarHBondContact NE2-OG 2.96Å; I176-S178 PolarHBondContact O-N 2.89Å; S178-K180 PolarHBondContact O-N 3.43Å; S178-K180 VanDerWaalsContact O-N 3.11Å; S178-K180 PolarHBondContact OG-N 3.15Å; S178-A181 CarbonylContact O-C 3.37Å; S178-A181 WeakPolarHBondContact O-CA 3.22Å; S178-A181 PolarHBondContact O-N 2.91Å; S178-S182 WeakPolarHBondContact O-CB 3.18Å; S178-S182 PolarHBondContact O-N 3.49Å; S178-L368 WeakPolarHBondContact CB-O 3.5Å; S178-L368 PolarHBondContact N-O 3.04Å; S178-D370 VanDerWaalsContact CB-OD1 3.23Å; S178-D370 WeakPolarHBondContact CB-OD1 3.42Å; S178-D370 PolarHBondContact OG-OD1 3.26Å; S178-V378 VanDerWaalsContact OG-CG1 3.3Å; S178-V378 WeakPolarHBondContact OG-CG1 3.43Å
179D83.1Confident80.2Confident53 Ų5345.8 Ų45.828%0.28326%0.259SS..THydrogen-bonded Turntrans-55.2-26.4171.8-75.1-6.6000113.3S108 K112 A181 S182S108-D179 WeakPolarHBondContact CB-OD2 3.48Å; S108-D179 PolarHBondContact OG-OD2 3.29Å; K112-D179 WeakPolarHBondContact CE-OD1 3.31Å; K112-D179 WeakPolarHBondContact CE-OD2 3.19Å; D179-A181 PolarHBondContact O-N 2.99Å; D179-S182 WeakPolarHBondContact CA-OG 3.24Å; D179-S182 PolarHBondContact O-OG 2.91Å
180K75.9Confident79.5Confident99 Ų9945.9 Ų45.943%0.4326%0.26SS..THydrogen-bonded Turntrans-67.9-21175.5-68.1176.7179.2163.20112.7S104 Q105 S178 D376 V378S104-K180 PolarHBondContact OG-NZ 2.96Å; S104-K180 VanDerWaalsContact OG-NZ 3.07Å; Q105-K180 HydrophobicContact CG-CD 4.45Å; Q105-K180 HydrophobicContact CG-CG 4.22Å; S178-K180 PolarHBondContact O-N 3.43Å; S178-K180 VanDerWaalsContact O-N 3.11Å; S178-K180 PolarHBondContact OG-N 3.15Å; K180-D376 PolarHBondContact NZ-O 2.88Å; K180-V378 HydrophobicContact CB-CG1 4.21Å; K180-V378 HydrophobicContact CD-CG1 4.13Å
181A71.8Confident79.1Confident35 Ų3547.1 Ų47.129%0.28927%0.266SS..SBendtrans-124.74.8-175.300000112.6Q177 S178 D179 L368Q177-A181 PolarHBondContact NE2-O 3.28Å; S178-A181 CarbonylContact O-C 3.37Å; S178-A181 WeakPolarHBondContact O-CA 3.22Å; S178-A181 PolarHBondContact O-N 2.91Å; D179-A181 PolarHBondContact O-N 2.99Å; A181-L368 HydrophobicContact CB-CB 3.66Å; A181-L368 HydrophobicContact CB-CD1 3.58Å; A181-L368 HydrophobicContact CB-CG 4.09Å
182S70Confident78.6Confident42 Ų4251 Ų5129%0.29429%0.286SS..  trans-87.8137.1-18070.50000109.9S178 D179S178-S182 WeakPolarHBondContact O-CB 3.18Å; S178-S182 PolarHBondContact O-N 3.49Å; D179-S182 WeakPolarHBondContact CA-OG 3.24Å; D179-S182 PolarHBondContact O-OG 2.91Å
183E66.8Low77.9Confident113 Ų11352.3 Ų52.353%0.52829%0.293SS..  trans-76.4153.4158.6-67.5179.7175.200107.5T185E183-T185 PolarHBondContact O-N 2.81Å
184P62Low77.2Confident129 Ų12951.8 Ų51.884%0.83829%0.29SS*.  trans-56.7108.2175.823.5-33.4000109.6
185T64Low76.9Confident71 Ų7155.3 Ų55.344%0.43631%0.306SS..  trans-78.8128.1179.456.70000108.9E174 E183E174-T185 HydrophobicContact CG-CG2 4.22Å; E174-T185 VanDerWaalsContact OE1-CB 3.28Å; E174-T185 WeakPolarHBondContact OE1-CB 3.43Å; E174-T185 PolarHBondContact OE1-OG1 3.17Å; E183-T185 PolarHBondContact O-N 2.81Å
186T65.6Low76.2Confident80 Ų8058.5 Ų58.549%0.49132%0.318SS..  trans-88.4150.6165.568.70000108.4L188 S189T186-L188 PolarHBondContact O-N 3.45Å; T186-L188 VanDerWaalsContact O-N 3.09Å; T186-S189 PolarHBondContact N-OG 3.12Å; T186-S189 WeakPolarHBondContact O-CA 3.05Å; T186-S189 WeakPolarHBondContact O-CB 3.27Å; T186-S189 PolarHBondContact O-N 2.83Å; T186-S189 PolarHBondContact O-OG 3.38Å; T186-S189 PolarHBondContact OG1-N 3.5Å; T186-S189 PolarHBondContact OG1-OG 3.2Å
187L71.2Confident75.4Confident101 Ų10159.8 Ų59.853%0.52932%0.322SS..Hα-helixtrans-50.6-37.2175.1-67.3-178.7000112.2I119 S189I119-L187 HydrophobicContact CD1-CB 3.74Å; I119-L187 HydrophobicContact CD1-CD2 4.18Å; I119-L187 HydrophobicContact CD1-CG 4.49Å; I119-L187 WeakPolarHBondContact CD1-O 3.48Å; L187-S189 VanDerWaalsContact C-N 3.33Å; L187-S189 PolarHBondContact O-N 2.85Å
188L76.3Confident74.7Confident122 Ų12261.6 Ų61.664%0.63933%0.333SS*.Hα-helixtrans-73.6-23.3178.3-60.6-178.8000113.2T186 C190 V191 L192T186-L188 PolarHBondContact O-N 3.45Å; T186-L188 VanDerWaalsContact O-N 3.09Å; L188-C190 VanDerWaalsContact C-N 3.27Å; L188-C190 PolarHBondContact O-N 3.39Å; L188-V191 PolarHBondContact O-N 3.06Å; L188-V191 VanDerWaalsContact O-N 3.15Å; L188-L192 WeakPolarHBondContact O-CB 3.26Å; L188-L192 VanDerWaalsContact O-CG 3.32Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 3.48Å
189S77.4Confident74Confident37 Ų3768 Ų6826%0.25936%0.361SS..Hα-helixtrans-58.5-40.3176.6-58.90000111.2T186 L187 V191 L192 D193T186-S189 PolarHBondContact N-OG 3.12Å; T186-S189 WeakPolarHBondContact O-CA 3.05Å; T186-S189 WeakPolarHBondContact O-CB 3.27Å; T186-S189 PolarHBondContact O-N 2.83Å; T186-S189 PolarHBondContact O-OG 3.38Å; T186-S189 PolarHBondContact OG1-N 3.5Å; T186-S189 PolarHBondContact OG1-OG 3.2Å; L187-S189 VanDerWaalsContact C-N 3.33Å; L187-S189 PolarHBondContact O-N 2.85Å; S189-V191 PolarHBondContact O-N 3.43Å; S189-L192 PolarHBondContact O-N 2.88Å; S189-D193 VanDerWaalsContact O-CB 3.26Å; S189-D193 WeakPolarHBondContact O-CB 3.11Å; S189-D193 PolarHBondContact O-N 2.9Å
190C76.7Confident73.1Confident3 Ų370 Ų702%0.0237%0.368CS..Hα-helixtrans-62.6-41.7176.6179.30000112.1S116 A170 L188 G194S116-C190 WeakPolarHBondContact CB-SG 3.34Å; A170-C190 WeakPolarHBondContact CB-O 3.37Å; L188-C190 VanDerWaalsContact C-N 3.27Å; L188-C190 PolarHBondContact O-N 3.39Å; C190-G194 PolarHBondContact O-N 3.28Å
191V79.9Confident72.1Confident30 Ų3070.7 Ų70.718%0.18237%0.374CS..Hα-helixtrans-67.6-45.7179.21780000110.2I119 F167 L188 S189 G194 F195I119-V191 HydrophobicContact CG2-CG2 3.67Å; F167-V191 HydrophobicContact CD1-CG1 4.31Å; F167-V191 HydrophobicContact CE1-CG1 3.85Å; F167-V191 WeakPolarHBondContact CE1-O 3.36Å; L188-V191 PolarHBondContact O-N 3.06Å; L188-V191 VanDerWaalsContact O-N 3.15Å; S189-V191 PolarHBondContact O-N 3.43Å; V191-G194 PolarHBondContact O-N 3.42Å; V191-F195 HydrophobicContact CG1-CD2 3.85Å; V191-F195 HydrophobicContact CG1-CE2 3.57Å; V191-F195 VanDerWaalsContact O-CD2 3.24Å; V191-F195 WeakPolarHBondContact O-CD2 3.22Å; V191-F195 PolarHBondContact O-N 2.91Å
192L81.1Confident71Confident86 Ų8672.7 Ų72.745%0.4538%0.384SS..Hα-helixtrans-61.7-46.1176.7-70.6172.1000111.6L188 S189 G194 F195 Y196L188-L192 WeakPolarHBondContact O-CB 3.26Å; L188-L192 VanDerWaalsContact O-CG 3.32Å; L188-L192 WeakPolarHBondContact O-CG 3.44Å; L188-L192 PolarHBondContact O-N 3.48Å; S189-L192 PolarHBondContact O-N 2.88Å; L192-G194 VanDerWaalsContact C-N 3.26Å; L192-G194 PolarHBondContact O-N 3.33Å; L192-F195 PolarHBondContact O-N 2.87Å; L192-F195 VanDerWaalsContact O-N 3.12Å; L192-Y196 HydrophobicContact CB-CD2 4.4Å; L192-Y196 HydrophobicContact CB-CE2 4.07Å; L192-Y196 WeakPolarHBondContact O-CD2 3.2Å; L192-Y196 PolarHBondContact O-N 3.21Å
193D76.6Confident70.1Confident30 Ų3073 Ų7316%0.1639%0.386CS..Hα-helixtrans-59.6-37.6175.2-83.6-16.6000111.5A170 S189 Y196 R197 R206A170-D193 HydrophobicContact CB-CB 3.93Å; S189-D193 VanDerWaalsContact O-CB 3.26Å; S189-D193 WeakPolarHBondContact O-CB 3.11Å; S189-D193 PolarHBondContact O-N 2.9Å; D193-Y196 PolarHBondContact O-N 2.9Å; D193-R197 WeakPolarHBondContact O-CG 3.42Å; D193-R197 PolarHBondContact O-N 3.27Å; D193-R206 IonicContact OD1-CZ 3.65Å; D193-R206 IonicContact OD1-NH1 3.01Å; D193-R206 PolarHBondContact OD1-NH1 3.43Å; D193-R206 IonicContact OD1-NH2 2.78Å; D193-R206 IonicContact OD2-CZ 2.68Å; D193-R206 IonicContact OD2-NH1 3.35Å; D193-R206 PolarHBondContact OD2-NH1 3.05Å; D193-R206 IonicContact OD2-NH2 3.18Å; D193-R206 PolarHBondContact OD2-NH2 3.11Å
194G76.2Confident69.3Low0 Ų070.7 Ų70.70%038%0.383CS..Hα-helixtrans-60.5-48.6171.500000112.6P166 C190 V191 L192 Y196 R197 L198P166-G194 WeakPolarHBondContact CB-O 3.4Å; C190-G194 PolarHBondContact O-N 3.28Å; V191-G194 PolarHBondContact O-N 3.42Å; L192-G194 VanDerWaalsContact C-N 3.26Å; L192-G194 PolarHBondContact O-N 3.33Å; G194-Y196 PolarHBondContact O-N 3.02Å; G194-R197 WeakPolarHBondContact O-CB 3.37Å; G194-R197 PolarHBondContact O-N 3.35Å; G194-L198 PolarHBondContact O-N 2.91Å
195F81Confident68.5Low93 Ų9368.6 Ų68.641%0.40837%0.369SS..Hα-helixtrans-63.2-41.2176.1-78.5-64.7000112.8F167 V191 L192 R197 L198 F199F167-F195 HydrophobicContact CE1-CD1 4.43Å; F167-F195 AromaticContact CE1-CD2 3.79Å; F167-F195 HydrophobicContact CE1-CD2 3.79Å; F167-F195 HydrophobicContact CE1-CE1 4.39Å; F167-F195 AromaticContact CE1-CE2 3.73Å; F167-F195 HydrophobicContact CE1-CE2 3.73Å; F167-F195 HydrophobicContact CE1-CG 4.16Å; F167-F195 HydrophobicContact CE1-CZ 4.05Å; F167-F195 HydrophobicContact CZ-CD1 4.08Å; F167-F195 HydrophobicContact CZ-CD2 4.15Å; F167-F195 AromaticContact CZ-CE1 3.77Å; F167-F195 HydrophobicContact CZ-CE1 3.77Å; F167-F195 AromaticContact CZ-CE2 3.83Å; F167-F195 HydrophobicContact CZ-CE2 3.83Å; F167-F195 HydrophobicContact CZ-CG 4.27Å; F167-F195 AromaticContact CZ-CZ 3.64Å; F167-F195 HydrophobicContact CZ-CZ 3.64Å; V191-F195 HydrophobicContact CG1-CD2 3.85Å; V191-F195 HydrophobicContact CG1-CE2 3.57Å; V191-F195 VanDerWaalsContact O-CD2 3.24Å; V191-F195 WeakPolarHBondContact O-CD2 3.22Å; V191-F195 PolarHBondContact O-N 2.91Å; L192-F195 PolarHBondContact O-N 2.87Å; L192-F195 VanDerWaalsContact O-N 3.12Å; F195-R197 VanDerWaalsContact C-N 3.3Å; F195-R197 PolarHBondContact O-N 3.22Å; F195-L198 PolarHBondContact O-N 2.68Å; F195-L198 VanDerWaalsContact O-N 3.14Å; F195-F199 AromaticContact CD1-CE2 3.95Å; F195-F199 HydrophobicContact CD1-CE2 3.95Å; F195-F199 WeakPolarHBondContact O-CD2 3.37Å; F195-F199 PolarHBondContact O-N 3.29Å
196Y76.6Confident67.7Low77 Ų7771.2 Ų71.230%0.30237%0.371SS..Hα-helixtrans-60.2-41.4176.4-72.9-54.5000111.9L192 D193 G194 H200 M201L192-Y196 HydrophobicContact CB-CD2 4.4Å; L192-Y196 HydrophobicContact CB-CE2 4.07Å; L192-Y196 WeakPolarHBondContact O-CD2 3.2Å; L192-Y196 PolarHBondContact O-N 3.21Å; D193-Y196 PolarHBondContact O-N 2.9Å; G194-Y196 PolarHBondContact O-N 3.02Å; Y196-H200 PolarHBondContact O-N 3.16Å; Y196-M201 HydrophobicContact CD1-CB 4.07Å; Y196-M201 PolarHBondContact O-N 3.13Å
197R73.9Confident66.6Low27 Ų2775 Ų7510%0.10239%0.387CS..Hα-helixtrans-61.3-43.6173.3-75.1176.4177.1-105.418.4111.8S169 D193 G194 F195 V233 C361S169-R197 PolarHBondContact OG-NH1 3.36Å; D193-R197 WeakPolarHBondContact O-CG 3.42Å; D193-R197 PolarHBondContact O-N 3.27Å; G194-R197 WeakPolarHBondContact O-CB 3.37Å; G194-R197 PolarHBondContact O-N 3.35Å; F195-R197 VanDerWaalsContact C-N 3.3Å; F195-R197 PolarHBondContact O-N 3.22Å; R197-V233 VanDerWaalsContact C-CG2 3.44Å; R197-V233 HydrophobicContact CB-CG2 3.63Å; R197-V233 WeakPolarHBondContact O-CG2 3.32Å; R197-C361 PolarHBondContact NH1-O 3.44Å; R197-C361 PolarHBondContact NH2-O 2.92Å; R197-C361 VanDerWaalsContact NH2-O 3.13Å
198L76.2Confident65.2Low66 Ų6673.5 Ų73.535%0.34640%0.397SS..Hα-helixtrans-63.6-47.6-178.1-176.563000112.3P166 G194 F195 H200P166-L198 HydrophobicContact CB-CB 4.13Å; P166-L198 HydrophobicContact CG-CB 4.39Å; P166-L198 HydrophobicContact CG-CD1 4.34Å; G194-L198 PolarHBondContact O-N 2.91Å; F195-L198 PolarHBondContact O-N 2.68Å; F195-L198 VanDerWaalsContact O-N 3.14Å; L198-H200 VanDerWaalsContact C-N 3.28Å; L198-H200 PolarHBondContact O-N 3.44Å; L198-H200 PolarHBondContact O-ND1 3.16Å
199F71.3Confident63.5Low134 Ų13472.9 Ų72.959%0.58840%0.402SS*.THydrogen-bonded Turntrans-855.1-175.5-68.8-68.9000114.4F195 M201F195-F199 AromaticContact CD1-CE2 3.95Å; F195-F199 HydrophobicContact CD1-CE2 3.95Å; F195-F199 WeakPolarHBondContact O-CD2 3.37Å; F195-F199 PolarHBondContact O-N 3.29Å; F199-M201 HydrophobicContact CB-CG 3.89Å; F199-M201 PolarHBondContact O-N 2.86Å
200H64.5Low61.7Low96 Ų9677.6 Ų77.644%0.44443%0.432SS..THydrogen-bonded Turntrans46.733.3-172.6-63.774.1000111.9Y196 L198 W234Y196-H200 PolarHBondContact O-N 3.16Å; L198-H200 VanDerWaalsContact C-N 3.28Å; L198-H200 PolarHBondContact O-N 3.44Å; L198-H200 PolarHBondContact O-ND1 3.16Å; H200-W234 AromaticContact CE1-CE3 3.48Å; H200-W234 VanDerWaalsContact CE1-CE3 3.48Å; H200-W234 AromaticContact CE1-CH2 3.9Å; H200-W234 AromaticContact CE1-CZ3 3.03Å; H200-W234 WeakPolarHBondContact CE1-CZ3 3.39Å; H200-W234 AromaticContact ND1-CZ3 3.81Å; H200-W234 AromaticContact NE2-CE3 3.84Å; H200-W234 AromaticContact NE2-CH2 3.65Å; H200-W234 AromaticContact NE2-CZ3 3.23Å; H200-W234 WeakPolarHBondContact NE2-CZ3 3.36Å
201M53.9Low60.1Low112 Ų11280 Ų8055%0.55246%0.458SS*.  trans-77.8135.1179.4-80.4-161.4170.600108.2Y196 F199 S203Y196-M201 HydrophobicContact CD1-CB 4.07Å; Y196-M201 PolarHBondContact O-N 3.13Å; F199-M201 HydrophobicContact CB-CG 3.89Å; F199-M201 PolarHBondContact O-N 2.86Å; M201-S203 PolarHBondContact O-N 3.11Å
202P50.8Low58.3Low77 Ų7782.8 Ų82.850%0.548%0.479SS..  trans-61.4114.3178.828.2-34.4000107.5S204 P224P202-S204 PolarHBondContact O-N 3.19Å; P202-P224 HydrophobicContact CB-CB 3.96Å; P202-P224 HydrophobicContact CB-CG 3.79Å; P202-P224 HydrophobicContact CG-CG 4.25Å
203S49.4Very low56.6Low49 Ų4988 Ų8834%0.34350%0.503SS..  trans-49.4141.2-177.1-57.60000110.1M201 P224M201-S203 PolarHBondContact O-N 3.11Å; S203-P224 WeakPolarHBondContact O-CB 3.12Å; S203-P224 WeakPolarHBondContact O-CG 3.06Å
204S50Low54.9Low65 Ų6596.3 Ų96.346%0.45554%0.538SS..  trans-47.4147.3167.641.70000110.8P202 R206P202-S204 PolarHBondContact O-N 3.19Å; S204-R206 PolarHBondContact O-N 3.19Å
205P46.1Very low53Low84 Ų84106.8 Ų106.855%0.54558%0.578SS.*  trans-61.2101.6-169.723.2-32000111.2L207P205-L207 PolarHBondContact O-N 2.97Å
206R47.4Very low50.8Low126 Ų126108.7 Ų108.748%0.47560%0.602SS.*  trans-72.780.2164.3-87176.9155.2103.2-6.5108.6D193 S204D193-R206 IonicContact OD1-CZ 3.65Å; D193-R206 IonicContact OD1-NH1 3.01Å; D193-R206 PolarHBondContact OD1-NH1 3.43Å; D193-R206 IonicContact OD1-NH2 2.78Å; D193-R206 IonicContact OD2-CZ 2.68Å; D193-R206 IonicContact OD2-NH1 3.35Å; D193-R206 PolarHBondContact OD2-NH1 3.05Å; D193-R206 IonicContact OD2-NH2 3.18Å; D193-R206 PolarHBondContact OD2-NH2 3.11Å; S204-R206 PolarHBondContact O-N 3.19Å
207L41.2Very low49.1Very low160 Ų160107.7 Ų107.784%0.83862%0.616SS**SBendtrans-173.697.5151.1-139.772.3000110.6P205 S209P205-L207 PolarHBondContact O-N 2.97Å; L207-S209 PolarHBondContact O-N 2.98Å
208G43Very low47.4Very low70 Ų70116.3 Ų116.372%0.72266%0.657SS**  trans73.132.3141.900000121P210G208-P210 WeakPolarHBondContact O-CD 3.4Å
209S40.1Very low46Very low108 Ų108119.5 Ų119.576%0.75568%0.679SS**  trans-112.2103.1172-166.50000113L207 G211L207-S209 PolarHBondContact O-N 2.98Å; S209-G211 PolarHBondContact O-N 3.46Å; S209-G211 VanDerWaalsContact O-N 3.15Å
210P40.6Very low45Very low136 Ų136121 Ų12188%0.88369%0.691SS**  trans-79.389.6166.332-27.4000107.8G208G208-P210 WeakPolarHBondContact O-CD 3.4Å
211G42.1Very low43.8Very low55 Ų55127.6 Ų127.657%0.56771%0.712SS**  trans-148.376.8-167.100000115.1S209S209-G211 PolarHBondContact O-N 3.46Å; S209-G211 VanDerWaalsContact O-N 3.15Å
212S42.2Very low43.3Very low88 Ų88126.1 Ų126.162%0.61571%0.713SS**  trans40.691.9137.1161.80000116.7F214S212-F214 PolarHBondContact O-N 3.19Å; S212-F214 VanDerWaalsContact O-N 3.14Å
213M46.3Very low43Very low196 Ų196129.4 Ų129.497%0.96673%0.725SS**THydrogen-bonded Turntrans-748.2171.2-147.3175.5-169.700113.8
214F40.6Very low42.7Very low204 Ų204128.9 Ų128.990%0.89572%0.72SS**THydrogen-bonded Turntrans-132.217.8-171.3-108.9-83.9000116.6S212S212-F214 PolarHBondContact O-N 3.19Å; S212-F214 VanDerWaalsContact O-N 3.14Å
215R35.5Very low42.3Very low220 Ų220131.8 Ų131.883%0.8373%0.729SS**SBendtrans-128.7101.6174.3-149.6173.2-172.7177.51.4112.1G217R215-G217 PolarHBondContact O-N 3.44Å
216S35.7Very low42.2Very low133 Ų133131.6 Ų131.693%0.9374%0.735SS**  trans-32.2114.7166.6-169.20000112.7
217G39.7Very low42.4Very low56 Ų56127.5 Ų127.558%0.57772%0.724SS**  trans175.1124.9175.300000111.2R215 T219R215-G217 PolarHBondContact O-N 3.44Å; G217-T219 PolarHBondContact O-N 3.08Å
218H39.8Very low42.9Very low208 Ų208125.6 Ų125.696%0.96372%0.724SS**  trans-5398.1-178.6-88.8-67000113.2
219T46.9Very low44.2Very low132 Ų132129.1 Ų129.181%0.8172%0.716SS**  trans-95.8114.8165.747.60000110G217 R221G217-T219 PolarHBondContact O-N 3.08Å; T219-R221 PolarHBondContact O-N 2.68Å
220I49.4Very low46Very low166 Ų166126.7 Ų126.785%0.85169%0.694SS**  trans-46.5128.1172.8-65.4165.7000109.6S222I220-S222 PolarHBondContact O-N 3.18Å
221R39.4Very low47.9Very low235 Ų235120.6 Ų120.689%0.88765%0.654SS**  trans-54.797.6177.1-76.8179.9161.7179.1-5110.6T219 I223T219-R221 PolarHBondContact O-N 2.68Å; R221-I223 PolarHBondContact O-N 2.78Å; R221-I223 VanDerWaalsContact O-N 3.11Å
222S44.1Very low49.8Very low80 Ų80119.5 Ų119.556%0.55964%0.637SS**  trans-67.9106.7160.656.90000107.7I220 P224I220-S222 PolarHBondContact O-N 3.18Å; S222-P224 WeakPolarHBondContact O-CD 3.26Å
223I42.8Very low51.9Low146 Ų146115.5 Ų115.575%0.74961%0.609SS**  trans-57.5121.4175.7-60.5160.6000107.7R221 I225R221-I223 PolarHBondContact O-N 2.78Å; R221-I223 VanDerWaalsContact O-N 3.11Å; I223-I225 PolarHBondContact O-N 3.48Å
224P42.9Very low53.8Low39 Ų39113.1 Ų113.125%0.25359%0.589SS.*  trans-73124.6177-2.818.3000109.3P202 S203 S222 A226P202-P224 HydrophobicContact CB-CB 3.96Å; P202-P224 HydrophobicContact CB-CG 3.79Å; P202-P224 HydrophobicContact CG-CG 4.25Å; S203-P224 WeakPolarHBondContact O-CB 3.12Å; S203-P224 WeakPolarHBondContact O-CG 3.06Å; S222-P224 WeakPolarHBondContact O-CD 3.26Å; P224-A226 PolarHBondContact O-N 3.07Å
225I42.1Very low56.2Low125 Ų125109.1 Ų109.164%0.64157%0.568SS**  trans-69.199.2179.5-60.4161.9000107.1I223 T227I223-I225 PolarHBondContact O-N 3.48Å; I225-T227 PolarHBondContact O-N 3.42Å
226A44.3Very low58.9Low81 Ų8198.7 Ų98.767%0.66953%0.529SS*.  trans-55.6110.3165.200000107.6P224 S228P224-A226 PolarHBondContact O-N 3.07Å; A226-S228 PolarHBondContact O-N 2.87Å
227T51.7Low61.6Low39 Ų3994.7 Ų94.724%0.23950%0.495CS..  trans-65.8105.7173.7450000107.6I225 R229 L230 G364 R366I225-T227 PolarHBondContact O-N 3.42Å; T227-R229 PolarHBondContact O-N 3.48Å; T227-L230 PolarHBondContact O-N 3.11Å; T227-L230 VanDerWaalsContact O-N 3.09Å; T227-G364 WeakPolarHBondContact CB-O 3.46Å; T227-G364 PolarHBondContact OG1-O 3.31Å; T227-G364 VanDerWaalsContact OG1-O 3.09Å; T227-R366 HydrophobicContact CG2-CG 4.07Å; T227-R366 VanDerWaalsContact CG2-NE 3.34Å
228S52Low64.2Low121 Ų12196.3 Ų96.385%0.84650%0.495SS*.THydrogen-bonded Turntrans-55.5-9.5-178.456.30000115A226A226-S228 PolarHBondContact O-N 2.87Å
229R69.3Low66.9Low143 Ų14386.6 Ų86.654%0.5445%0.45SS..THydrogen-bonded Turntrans-99.8-7.5-176.6-58.9-176.2-178.4-178.7-0.6114.3T227 L231 Q363T227-R229 PolarHBondContact O-N 3.48Å; R229-L231 PolarHBondContact O-N 2.67Å; R229-Q363 WeakPolarHBondContact O-CG 3.46Å; R229-Q363 PolarHBondContact O-NE2 3.21Å; R229-Q363 VanDerWaalsContact O-NE2 3.07Å
230L78.7Confident69.2Low57 Ų5780.3 Ų80.330%0.29841%0.412SS..SBendtrans-69.7122.9178.2-17667.1000109.2T227 Q363 T365T227-L230 PolarHBondContact O-N 3.11Å; T227-L230 VanDerWaalsContact O-N 3.09Å; L230-Q363 WeakPolarHBondContact CD1-O 3.29Å; L230-T365 HydrophobicContact CD1-CG2 3.93Å
231L80.2Confident71.5Confident9 Ų973.3 Ų73.35%0.04738%0.377CS..PPolyproline II helixtrans-64.8133.5175.6-79.497.7000109.8R229 V233 R235 L236 L360 Q363R229-L231 PolarHBondContact O-N 2.67Å; L231-V233 PolarHBondContact O-N 3.34Å; L231-R235 HydrophobicContact CD2-CB 4.11Å; L231-L236 HydrophobicContact CB-CD2 4.45Å; L231-L360 HydrophobicContact CD1-CD2 4.28Å; L231-L360 HydrophobicContact CD2-CD2 3.93Å; L231-Q363 HydrophobicContact CD1-CB 4Å; L231-Q363 HydrophobicContact CD1-CG 3.7Å
232P82.9Confident74.2Confident31 Ų3166.9 Ų66.920%0.20136%0.36CS..PPolyproline II helixtrans-55.2139.8167.5-25.734.8000111.6W234 R235P232-W234 HydrophobicContact CB-CD2 3.49Å; P232-W234 VanDerWaalsContact CB-CD2 3.49Å; P232-W234 HydrophobicContact CB-CE3 3.79Å; P232-W234 HydrophobicContact CB-CG 4.22Å; P232-W234 HydrophobicContact CB-CH2 3.53Å; P232-W234 HydrophobicContact CB-CZ2 3.19Å; P232-W234 HydrophobicContact CB-CZ3 3.83Å; P232-W234 HydrophobicContact CG-CH2 3.98Å; P232-W234 HydrophobicContact CG-CZ2 3.48Å; P232-W234 VanDerWaalsContact CG-CZ2 3.48Å; P232-W234 PolarHBondContact O-N 3.12Å; P232-W234 VanDerWaalsContact O-N 3.1Å; P232-R235 WeakPolarHBondContact O-CB 3.33Å; P232-R235 PolarHBondContact O-N 3.4Å
233V85.8Confident76.7Confident5 Ų563.7 Ų63.73%0.0334%0.336CS..Hα-helixtrans-57.3-32.5-175.1176.80000112.4T165 P166 R197 L231 R235 L236 F237T165-V233 HydrophobicContact CG2-CG1 4.32Å; P166-V233 HydrophobicContact CB-CG1 4.11Å; R197-V233 VanDerWaalsContact C-CG2 3.44Å; R197-V233 HydrophobicContact CB-CG2 3.63Å; R197-V233 WeakPolarHBondContact O-CG2 3.32Å; L231-V233 PolarHBondContact O-N 3.34Å; V233-R235 PolarHBondContact O-N 2.87Å; V233-L236 WeakPolarHBondContact O-CA 3.32Å; V233-L236 WeakPolarHBondContact O-CB 3.24Å; V233-L236 PolarHBondContact O-N 2.71Å; V233-F237 HydrophobicContact CG1-CD1 4.36Å; V233-F237 HydrophobicContact CG1-CE1 3.61Å; V233-F237 HydrophobicContact CG1-CZ 3.85Å; V233-F237 PolarHBondContact O-N 3.42Å
234W86.2Confident79.2Confident146 Ų14658.2 Ų58.255%0.55331%0.308SS*.Hα-helixtrans-63.3-26.3178.161.778.6000113.7H200 P232 L236 F237 P238H200-W234 AromaticContact CE1-CE3 3.48Å; H200-W234 VanDerWaalsContact CE1-CE3 3.48Å; H200-W234 AromaticContact CE1-CH2 3.9Å; H200-W234 AromaticContact CE1-CZ3 3.03Å; H200-W234 WeakPolarHBondContact CE1-CZ3 3.39Å; H200-W234 AromaticContact ND1-CZ3 3.81Å; H200-W234 AromaticContact NE2-CE3 3.84Å; H200-W234 AromaticContact NE2-CH2 3.65Å; H200-W234 AromaticContact NE2-CZ3 3.23Å; H200-W234 WeakPolarHBondContact NE2-CZ3 3.36Å; P232-W234 HydrophobicContact CB-CD2 3.49Å; P232-W234 VanDerWaalsContact CB-CD2 3.49Å; P232-W234 HydrophobicContact CB-CE3 3.79Å; P232-W234 HydrophobicContact CB-CG 4.22Å; P232-W234 HydrophobicContact CB-CH2 3.53Å; P232-W234 HydrophobicContact CB-CZ2 3.19Å; P232-W234 HydrophobicContact CB-CZ3 3.83Å; P232-W234 HydrophobicContact CG-CH2 3.98Å; P232-W234 HydrophobicContact CG-CZ2 3.48Å; P232-W234 VanDerWaalsContact CG-CZ2 3.48Å; P232-W234 PolarHBondContact O-N 3.12Å; P232-W234 VanDerWaalsContact O-N 3.1Å; W234-L236 VanDerWaalsContact C-N 3.27Å; W234-F237 HydrophobicContact CB-CD2 4.16Å; W234-F237 HydrophobicContact CB-CE2 4.1Å; W234-P238 WeakPolarHBondContact O-CD 3.36Å
235R90.4Very high81.7Confident119 Ų11957.1 Ų57.145%0.44930%0.301SS..Hα-helixtrans-75.1-18.9172.6-67.1-165.5175.1171.83.7112.3L231 P232 V233 P239 D386L231-R235 HydrophobicContact CD2-CB 4.11Å; P232-R235 WeakPolarHBondContact O-CB 3.33Å; P232-R235 PolarHBondContact O-N 3.4Å; V233-R235 PolarHBondContact O-N 2.87Å; R235-P239 WeakPolarHBondContact O-CD 3.21Å; R235-D386 WeakPolarHBondContact CD-O 3.31Å; R235-D386 PolarHBondContact NH1-O 2.91Å
236L91.6Very high84.3Confident1 Ų152.1 Ų52.11%0.00528%0.28CS..Hα-helixtrans-85.8-21.6176.4-58.2177.5000112.8T165 S169 L231 V233 W234 P239 V240 L360T165-L236 HydrophobicContact CG2-CB 3.88Å; S169-L236 WeakPolarHBondContact OG-CD1 3.07Å; L231-L236 HydrophobicContact CB-CD2 4.45Å; V233-L236 WeakPolarHBondContact O-CA 3.32Å; V233-L236 WeakPolarHBondContact O-CB 3.24Å; V233-L236 PolarHBondContact O-N 2.71Å; W234-L236 VanDerWaalsContact C-N 3.27Å; L236-P239 VanDerWaalsContact O-CD 3.23Å; L236-P239 WeakPolarHBondContact O-CD 3.43Å; L236-P239 WeakPolarHBondContact O-CG 3.26Å; L236-V240 HydrophobicContact CB-CG2 4.41Å; L236-V240 VanDerWaalsContact O-CB 3.29Å; L236-V240 WeakPolarHBondContact O-CB 3.35Å; L236-V240 WeakPolarHBondContact O-CG2 3.35Å; L236-V240 PolarHBondContact O-N 3.31Å; L236-V240 VanDerWaalsContact O-N 3.09Å; L236-L360 HydrophobicContact CD2-CB 3.76Å
237F93.5Very high86.7Confident50 Ų5050.2 Ų50.222%0.21926%0.257CS..Hα-helixtrans-57.1-53.7-179-61-39.9000113V162 T165 V233 W234 V240 V241V162-F237 HydrophobicContact CG1-CD1 4.16Å; V162-F237 HydrophobicContact CG1-CD2 4.37Å; V162-F237 HydrophobicContact CG1-CE1 4.14Å; V162-F237 HydrophobicContact CG1-CE2 4.36Å; V162-F237 HydrophobicContact CG1-CG 4.3Å; V162-F237 HydrophobicContact CG1-CZ 4.26Å; V162-F237 VanDerWaalsContact O-CE1 3.22Å; V162-F237 WeakPolarHBondContact O-CE1 3.3Å; T165-F237 HydrophobicContact CG2-CD1 3.6Å; T165-F237 HydrophobicContact CG2-CE1 4.01Å; V233-F237 HydrophobicContact CG1-CD1 4.36Å; V233-F237 HydrophobicContact CG1-CE1 3.61Å; V233-F237 HydrophobicContact CG1-CZ 3.85Å; V233-F237 PolarHBondContact O-N 3.42Å; W234-F237 HydrophobicContact CB-CD2 4.16Å; W234-F237 HydrophobicContact CB-CE2 4.1Å; F237-V240 PolarHBondContact O-N 2.82Å; F237-V241 VanDerWaalsContact O-CB 3.26Å; F237-V241 WeakPolarHBondContact O-CB 3.02Å; F237-V241 WeakPolarHBondContact O-CG2 3.33Å; F237-V241 PolarHBondContact O-N 3.39Å
238P94.8Very high88.7Confident89 Ų8951.5 Ų51.558%0.57826%0.258SS*.Hα-helixtrans-59.1-49.5-176.9-21.533.5000114W234 L242W234-P238 WeakPolarHBondContact O-CD 3.36Å; P238-L242 WeakPolarHBondContact O-CB 3.33Å; P238-L242 PolarHBondContact O-N 3.07Å
239P95.7Very high90.7Very high5 Ų549 Ų493%0.03224%0.238CC..Hα-helixtrans-72.1-33.9-177.530.9-38000113.2R235 L236 L243 V357 L360 F388R235-P239 WeakPolarHBondContact O-CD 3.21Å; L236-P239 VanDerWaalsContact O-CD 3.23Å; L236-P239 WeakPolarHBondContact O-CD 3.43Å; L236-P239 WeakPolarHBondContact O-CG 3.26Å; P239-L243 WeakPolarHBondContact O-CB 3.37Å; P239-L243 PolarHBondContact O-N 3.47Å; P239-V357 HydrophobicContact CB-CG2 3.84Å; P239-V357 WeakPolarHBondContact O-CG2 3.37Å; P239-L360 HydrophobicContact CB-CD1 4.45Å; P239-L360 HydrophobicContact CG-CD1 4.14Å; P239-F388 HydrophobicContact CB-CB 4.24Å; P239-F388 HydrophobicContact CB-CD2 3.5Å; P239-F388 HydrophobicContact CB-CE2 4.11Å; P239-F388 HydrophobicContact CB-CG 4.06Å; P239-F388 HydrophobicContact CG-CB 4.45Å; P239-F388 HydrophobicContact CG-CD2 4.43Å
240V95.9Very high92Very high0 Ų043.9 Ų43.90%022%0.222CC..Hα-helixtrans-69.6-42.4176.71730000111.4W161 T165 F168 L236 F237 L243 N244 V357W161-V240 HydrophobicContact CE3-CG1 4.31Å; T165-V240 HydrophobicContact CG2-CB 4.15Å; T165-V240 HydrophobicContact CG2-CG1 4.27Å; T165-V240 HydrophobicContact CG2-CG2 4.09Å; F168-V240 HydrophobicContact CD1-CG1 3.65Å; F168-V240 HydrophobicContact CD1-CG2 4.17Å; F168-V240 HydrophobicContact CE1-CG1 4.02Å; F168-V240 HydrophobicContact CE1-CG2 4.33Å; F168-V240 HydrophobicContact CG-CG1 4.46Å; L236-V240 HydrophobicContact CB-CG2 4.41Å; L236-V240 VanDerWaalsContact O-CB 3.29Å; L236-V240 WeakPolarHBondContact O-CB 3.35Å; L236-V240 WeakPolarHBondContact O-CG2 3.35Å; L236-V240 PolarHBondContact O-N 3.31Å; L236-V240 VanDerWaalsContact O-N 3.09Å; F237-V240 PolarHBondContact O-N 2.82Å; V240-L243 PolarHBondContact O-N 3.41Å; V240-N244 PolarHBondContact O-N 3.03Å; V240-N244 VanDerWaalsContact O-N 3.09Å; V240-N244 PolarHBondContact O-ND2 3.22Å; V240-V357 HydrophobicContact CG2-CG1 3.78Å
241V96.7Very high92.7Very high19 Ų1944.6 Ų44.612%0.11522%0.221CC..Hα-helixtrans-64.9-44.8175.2171.70000110.3V158 W161 V162 F237 L243 N244 V245V158-V241 HydrophobicContact CB-CG1 4.24Å; V158-V241 HydrophobicContact CG1-CG1 4.02Å; V158-V241 HydrophobicContact CG2-CG1 3.9Å; W161-V241 HydrophobicContact CB-CG2 3.95Å; V162-V241 HydrophobicContact CG2-CG2 3.75Å; F237-V241 VanDerWaalsContact O-CB 3.26Å; F237-V241 WeakPolarHBondContact O-CB 3.02Å; F237-V241 WeakPolarHBondContact O-CG2 3.33Å; F237-V241 PolarHBondContact O-N 3.39Å; V241-L243 VanDerWaalsContact C-N 3.33Å; V241-L243 PolarHBondContact O-N 3.49Å; V241-N244 PolarHBondContact O-N 3.07Å; V241-V245 HydrophobicContact CG1-CG2 3.85Å; V241-V245 VanDerWaalsContact O-CB 3.24Å; V241-V245 WeakPolarHBondContact O-CB 3.42Å; V241-V245 WeakPolarHBondContact O-CG2 3.42Å; V241-V245 PolarHBondContact O-N 3.27Å
242L96.4Very high93.2Very high100 Ų10046.8 Ų46.852%0.52424%0.237SC..Hα-helixtrans-57.3-46.3177.1177.764.1000111.5P238 G246 V353P238-L242 WeakPolarHBondContact O-CB 3.33Å; P238-L242 PolarHBondContact O-N 3.07Å; L242-G246 VanDerWaalsContact O-CA 3.22Å; L242-G246 WeakPolarHBondContact O-CA 3.38Å; L242-G246 PolarHBondContact O-N 3.01Å; L242-V353 HydrophobicContact CD2-CG1 4.47Å
243L96.6Very high93.7Very high13 Ų1352.5 Ų52.57%0.06826%0.259CS..Hα-helixtrans-58.5-55.8177.3175.963.2000111.2P239 V240 V241 H247 L350 V353 E354 V357P239-L243 WeakPolarHBondContact O-CB 3.37Å; P239-L243 PolarHBondContact O-N 3.47Å; V240-L243 PolarHBondContact O-N 3.41Å; V241-L243 VanDerWaalsContact C-N 3.33Å; V241-L243 PolarHBondContact O-N 3.49Å; L243-H247 VanDerWaalsContact O-CB 3.26Å; L243-H247 WeakPolarHBondContact O-CB 3.22Å; L243-H247 PolarHBondContact O-N 3.22Å; L243-L350 HydrophobicContact CD1-CB 4.17Å; L243-L350 HydrophobicContact CD1-CD2 4.31Å; L243-L350 WeakPolarHBondContact O-CD2 3.41Å; L243-V353 HydrophobicContact CB-CG1 4.14Å; L243-V353 HydrophobicContact CD1-CB 4.42Å; L243-V353 HydrophobicContact CD1-CG1 4.29Å; L243-E354 HydrophobicContact CD1-CB 3.88Å; L243-E354 HydrophobicContact CD2-CB 4.42Å; L243-V357 HydrophobicContact CB-CG2 4.21Å; L243-V357 HydrophobicContact CD2-CB 4.04Å; L243-V357 HydrophobicContact CD2-CG1 3.99Å; L243-V357 HydrophobicContact CD2-CG2 4.11Å
244N95.6Very high94.1Very high30 Ų3052.9 Ų52.916%0.1626%0.263CS..Hα-helixtrans-79.4-39.2-169.3-68.5-76.1000113.7W161 V240 V241 H247 Y248W161-N244 HydrophobicContact CD2-CB 3.43Å; W161-N244 VanDerWaalsContact CD2-CB 3.43Å; W161-N244 HydrophobicContact CE3-CB 3.9Å; W161-N244 HydrophobicContact CG-CB 3.89Å; W161-N244 HydrophobicContact CH2-CB 3.96Å; W161-N244 WeakPolarHBondContact CH2-OD1 3.4Å; W161-N244 HydrophobicContact CZ2-CB 3.51Å; W161-N244 VanDerWaalsContact CZ2-CG 3.44Å; W161-N244 WeakPolarHBondContact CZ2-OD1 3.48Å; W161-N244 HydrophobicContact CZ3-CB 4.14Å; W161-N244 VanDerWaalsContact CZ3-CG 3.42Å; W161-N244 WeakPolarHBondContact CZ3-ND2 3.29Å; V240-N244 PolarHBondContact O-N 3.03Å; V240-N244 VanDerWaalsContact O-N 3.09Å; V240-N244 PolarHBondContact O-ND2 3.22Å; V241-N244 PolarHBondContact O-N 3.07Å; N244-H247 PolarHBondContact O-N 2.99Å; N244-Y248 PolarHBondContact O-N 2.9Å; N244-Y248 VanDerWaalsContact O-N 3.12Å
245V95.4Very high94.3Very high17 Ų1746.8 Ų46.810%0.10324%0.242CC..Hα-helixtrans-70.9-39.6174.4-179.70000110L154 K157 V158 V241 H247 Y248 V249L154-V245 HydrophobicContact CD2-CG1 4.25Å; K157-V245 HydrophobicContact CB-CG2 4.17Å; V158-V245 HydrophobicContact CG2-CG1 4.3Å; V158-V245 HydrophobicContact CG2-CG2 3.95Å; V241-V245 HydrophobicContact CG1-CG2 3.85Å; V241-V245 VanDerWaalsContact O-CB 3.24Å; V241-V245 WeakPolarHBondContact O-CB 3.42Å; V241-V245 WeakPolarHBondContact O-CG2 3.42Å; V241-V245 PolarHBondContact O-N 3.27Å; V245-H247 VanDerWaalsContact C-N 3.3Å; V245-H247 PolarHBondContact O-N 3Å; V245-Y248 PolarHBondContact O-N 3.15Å; V245-V249 WeakPolarHBondContact O-CG2 3.49Å; V245-V249 PolarHBondContact O-N 3.27Å
246G95.8Very high94.1Very high20 Ų2044.3 Ų44.321%0.20624%0.241CC..Hα-helixtrans-58.9-42.5172.700000111.7L242 Y248 V249 V250 L350L242-G246 VanDerWaalsContact O-CA 3.22Å; L242-G246 WeakPolarHBondContact O-CA 3.38Å; L242-G246 PolarHBondContact O-N 3.01Å; G246-Y248 PolarHBondContact O-N 2.89Å; G246-V249 PolarHBondContact O-N 3.02Å; G246-V250 WeakPolarHBondContact O-CG2 3.47Å; G246-V250 PolarHBondContact O-N 2.88Å; G246-L350 VanDerWaalsContact C-CD2 3.47Å
247H96Very high94.1Very high40 Ų4046.9 Ų46.919%0.18526%0.256CS..Hα-helixtrans-60.6-47.4177.5-169.8-75000111.1L243 N244 V245 V249 V250 R251 D347 L350L243-H247 VanDerWaalsContact O-CB 3.26Å; L243-H247 WeakPolarHBondContact O-CB 3.22Å; L243-H247 PolarHBondContact O-N 3.22Å; N244-H247 PolarHBondContact O-N 2.99Å; V245-H247 VanDerWaalsContact C-N 3.3Å; V245-H247 PolarHBondContact O-N 3Å; H247-V249 VanDerWaalsContact C-N 3.34Å; H247-V249 PolarHBondContact O-N 3.15Å; H247-V250 PolarHBondContact O-N 2.82Å; H247-R251 WeakPolarHBondContact O-CB 3.34Å; H247-R251 PolarHBondContact O-N 3.04Å; H247-D347 IonicContact CD2-OD1 3.88Å; H247-D347 PolarHBondContact CD2-OD1 3.3Å; H247-D347 IonicContact CE1-OD1 3.55Å; H247-D347 IonicContact NE2-OD1 2.65Å; H247-D347 PolarHBondContact NE2-OD1 3.15Å; H247-L350 VanDerWaalsContact CA-CD2 3.43Å; H247-L350 HydrophobicContact CB-CD2 3.75Å
248Y93.6Very high93.9Very high67 Ų6745 Ų4526%0.26325%0.25SC..Hα-helixtrans-57.2-45.2175176.6-99.3000112.7H153 L154 N244 V245 G246 S252H153-Y248 AromaticContact CD2-CE1 3.74Å; H153-Y248 AromaticContact CD2-CZ 3.84Å; H153-Y248 PolarHBondContact CD2-OH 3.29Å; H153-Y248 AromaticContact NE2-CE1 3.71Å; H153-Y248 AromaticContact NE2-CZ 3.39Å; H153-Y248 PolarHBondContact NE2-OH 3.4Å; H153-Y248 VanDerWaalsContact NE2-OH 3.07Å; L154-Y248 HydrophobicContact CD2-CD1 4.12Å; L154-Y248 HydrophobicContact CD2-CE1 4.26Å; N244-Y248 PolarHBondContact O-N 2.9Å; N244-Y248 VanDerWaalsContact O-N 3.12Å; V245-Y248 PolarHBondContact O-N 3.15Å; G246-Y248 PolarHBondContact O-N 2.89Å; Y248-S252 VanDerWaalsContact O-CB 3.24Å; Y248-S252 WeakPolarHBondContact O-CB 3.43Å; Y248-S252 PolarHBondContact O-N 3.35Å
249V94.3Very high93.4Very high68 Ų6841.7 Ų41.741%0.41223%0.227SC..Hα-helixtrans-65-50.2180172.10000111.2L154 V245 G246 H247 S252 F253L154-V249 HydrophobicContact CD2-CG2 3.65Å; V245-V249 WeakPolarHBondContact O-CG2 3.49Å; V245-V249 PolarHBondContact O-N 3.27Å; G246-V249 PolarHBondContact O-N 3.02Å; H247-V249 VanDerWaalsContact C-N 3.34Å; H247-V249 PolarHBondContact O-N 3.15Å; V249-S252 PolarHBondContact O-N 3.07Å; V249-F253 PolarHBondContact O-N 3.48Å
250V95.7Very high92.9Very high36 Ų3650.2 Ų50.222%0.21826%0.26CS..Hα-helixtrans-63.5-44.2179.8177.30000110.5G246 H247 S252 F253 A254 V345 A346 V349 L350G246-V250 WeakPolarHBondContact O-CG2 3.47Å; G246-V250 PolarHBondContact O-N 2.88Å; H247-V250 PolarHBondContact O-N 2.82Å; V250-S252 PolarHBondContact O-N 2.79Å; V250-F253 PolarHBondContact O-N 2.96Å; V250-A254 WeakPolarHBondContact O-CB 3.14Å; V250-A254 PolarHBondContact O-N 3.01Å; V250-V345 HydrophobicContact CG1-CG1 4.47Å; V250-A346 HydrophobicContact CB-CB 4.22Å; V250-A346 HydrophobicContact CG1-CB 4.03Å; V250-V349 HydrophobicContact CG1-CB 4.42Å; V250-L350 HydrophobicContact CG2-CD1 3.95Å
251R94.5Very high92.4Very high71 Ų7158.2 Ų58.227%0.26829%0.291SS..Hα-helixtrans-59.7-44.2175.1-179.5-169.2173.5155.12.7111.8H247 A254 S255 A342 N343 A346H247-R251 WeakPolarHBondContact O-CB 3.34Å; H247-R251 PolarHBondContact O-N 3.04Å; R251-A254 PolarHBondContact O-N 3.28Å; R251-S255 WeakPolarHBondContact O-CB 3.27Å; R251-S255 PolarHBondContact O-N 3.22Å; R251-A342 HydrophobicContact CG-CB 4.3Å; R251-N343 WeakPolarHBondContact CD-OD1 3.31Å; R251-N343 PolarHBondContact NE-OD1 3.2Å; R251-N343 PolarHBondContact NH1-OD1 3.01Å; R251-A346 HydrophobicContact CB-CB 4.01Å
252S90.6Very high91.6Very high56 Ų5662.5 Ų62.539%0.39231%0.305SS..Hα-helixtrans-63.7-44.1179.9-176.70000111.8Y248 V249 V250 S255 T256Y248-S252 VanDerWaalsContact O-CB 3.24Å; Y248-S252 WeakPolarHBondContact O-CB 3.43Å; Y248-S252 PolarHBondContact O-N 3.35Å; V249-S252 PolarHBondContact O-N 3.07Å; V250-S252 PolarHBondContact O-N 2.79Å; S252-S255 PolarHBondContact O-N 3.39Å; S252-T256 PolarHBondContact O-N 3.06Å; S252-T256 VanDerWaalsContact O-N 3.11Å; S252-T256 PolarHBondContact O-OG1 3.49Å
253F92.2Very high90.5Very high151 Ų15159.8 Ų59.866%0.66230%0.295SS*.Hα-helixtrans-64.4-50.8174.7-177.1-100.5000111.6V249 V250 S255 T256 V257V249-F253 PolarHBondContact O-N 3.48Å; V250-F253 PolarHBondContact O-N 2.96Å; F253-S255 VanDerWaalsContact C-N 3.28Å; F253-S255 PolarHBondContact O-N 3.36Å; F253-T256 WeakPolarHBondContact O-CB 3.47Å; F253-T256 PolarHBondContact O-N 3.26Å; F253-T256 VanDerWaalsContact O-N 3.1Å; F253-V257 HydrophobicContact CD1-CG2 4.39Å; F253-V257 HydrophobicContact CE1-CG2 4.01Å; F253-V257 HydrophobicContact CZ-CG2 4.13Å; F253-V257 WeakPolarHBondContact O-CG2 3.45Å; F253-V257 PolarHBondContact O-N 3.18Å
254A94.2Very high88.9Confident12 Ų1261 Ų6110%0.09931%0.311CS..Hα-helixtrans-61.4-35.2178.700000112.1V250 R251 V257 A258 A342 V345V250-A254 WeakPolarHBondContact O-CB 3.14Å; V250-A254 PolarHBondContact O-N 3.01Å; R251-A254 PolarHBondContact O-N 3.28Å; A254-V257 PolarHBondContact O-N 3.28Å; A254-A258 WeakPolarHBondContact O-CB 3.43Å; A254-A258 PolarHBondContact O-N 2.83Å; A254-A342 HydrophobicContact CB-CB 3.91Å; A254-V345 HydrophobicContact CB-CB 4.12Å; A254-V345 HydrophobicContact CB-CG1 4.04Å
255S90.3Very high87.1Confident18 Ų1864.8 Ų64.813%0.12633%0.331CS..Hα-helixtrans-67.5-37.7175.4176.90000111.8R251 S252 F253 L259 A342R251-S255 WeakPolarHBondContact O-CB 3.27Å; R251-S255 PolarHBondContact O-N 3.22Å; S252-S255 PolarHBondContact O-N 3.39Å; F253-S255 VanDerWaalsContact C-N 3.28Å; F253-S255 PolarHBondContact O-N 3.36Å; S255-L259 VanDerWaalsContact O-CB 3.25Å; S255-L259 WeakPolarHBondContact O-CB 3.18Å; S255-L259 WeakPolarHBondContact O-CG 3.27Å; S255-L259 PolarHBondContact O-N 3Å; S255-A342 VanDerWaalsContact N-CB 3.31Å
256T87Confident85.3Confident68 Ų6865.8 Ų65.842%0.41734%0.335SS..Hα-helixtrans-64.3-45175.1-58.60000110.9S252 F253 Y260S252-T256 PolarHBondContact O-N 3.06Å; S252-T256 VanDerWaalsContact O-N 3.11Å; S252-T256 PolarHBondContact O-OG1 3.49Å; F253-T256 WeakPolarHBondContact O-CB 3.47Å; F253-T256 PolarHBondContact O-N 3.26Å; F253-T256 VanDerWaalsContact O-N 3.1Å; T256-Y260 PolarHBondContact O-N 3.12Å; T256-Y260 VanDerWaalsContact O-N 3.08Å
257V90.6Very high83.5Confident54 Ų5468.8 Ų68.833%0.32735%0.346SS..Hα-helixtrans-65.7-47.2177.1175.40000111.1F253 A254 L259 Y260 Y261F253-V257 HydrophobicContact CD1-CG2 4.39Å; F253-V257 HydrophobicContact CE1-CG2 4.01Å; F253-V257 HydrophobicContact CZ-CG2 4.13Å; F253-V257 WeakPolarHBondContact O-CG2 3.45Å; F253-V257 PolarHBondContact O-N 3.18Å; A254-V257 PolarHBondContact O-N 3.28Å; V257-L259 VanDerWaalsContact C-N 3.35Å; V257-L259 PolarHBondContact O-N 3.24Å; V257-Y260 WeakPolarHBondContact O-CB 3.46Å; V257-Y260 PolarHBondContact O-N 2.9Å; V257-Y260 VanDerWaalsContact O-N 3.12Å; V257-Y261 HydrophobicContact CG1-CD2 3.61Å; V257-Y261 HydrophobicContact CG1-CE2 3.42Å; V257-Y261 VanDerWaalsContact CG1-CE2 3.42Å; V257-Y261 WeakPolarHBondContact O-CD2 3.39Å; V257-Y261 PolarHBondContact O-N 3.47Å
258A89.3Confident81.5Confident11 Ų1174.1 Ų74.19%0.09136%0.364CS..Hα-helixtrans-63.6-39.3-18000000112.1A254 Y260 Y261 W262 A338 T341A254-A258 WeakPolarHBondContact O-CB 3.43Å; A254-A258 PolarHBondContact O-N 2.83Å; A258-Y260 VanDerWaalsContact C-N 3.34Å; A258-Y261 PolarHBondContact O-N 3.19Å; A258-W262 WeakPolarHBondContact O-CB 3.46Å; A258-W262 PolarHBondContact O-N 2.66Å; A258-A338 HydrophobicContact CB-CB 3.9Å; A258-T341 WeakPolarHBondContact CB-OG1 3.25Å
259L85.6Confident79.8Confident19 Ų1976 Ų7610%0.09938%0.379CS..Hα-helixtrans-64.8-38.8173.2-75.3170.5000111.5S255 V257 Y261 S263 D335 A338S255-L259 VanDerWaalsContact O-CB 3.25Å; S255-L259 WeakPolarHBondContact O-CB 3.18Å; S255-L259 WeakPolarHBondContact O-CG 3.27Å; S255-L259 PolarHBondContact O-N 3Å; V257-L259 VanDerWaalsContact C-N 3.35Å; V257-L259 PolarHBondContact O-N 3.24Å; L259-Y261 VanDerWaalsContact C-N 3.34Å; L259-Y261 PolarHBondContact O-N 3.31Å; L259-S263 WeakPolarHBondContact O-CA 3.43Å; L259-S263 WeakPolarHBondContact O-CB 3.42Å; L259-S263 PolarHBondContact O-N 3.46Å; L259-D335 WeakPolarHBondContact CD2-OD1 3.36Å; L259-A338 HydrophobicContact CD2-CB 3.52Å; L259-A338 HydrophobicContact CG-CB 3.75Å
260Y85Confident78.1Confident185 Ų18578.1 Ų78.173%0.72538%0.384SS*.Hα-helixtrans-62.3-42.1174.8-178.8-102.4000112T256 V257 A258 G264T256-Y260 PolarHBondContact O-N 3.12Å; T256-Y260 VanDerWaalsContact O-N 3.08Å; V257-Y260 WeakPolarHBondContact O-CB 3.46Å; V257-Y260 PolarHBondContact O-N 2.9Å; V257-Y260 VanDerWaalsContact O-N 3.12Å; A258-Y260 VanDerWaalsContact C-N 3.34Å; Y260-G264 PolarHBondContact O-N 3.38Å
261Y85.1Confident76.3Confident167 Ų16783.7 Ų83.766%0.65540%0.401SS*.Hα-helixtrans-70.3-41.2177.5-79.3-70.5000113.7V257 A258 L259V257-Y261 HydrophobicContact CG1-CD2 3.61Å; V257-Y261 HydrophobicContact CG1-CE2 3.42Å; V257-Y261 VanDerWaalsContact CG1-CE2 3.42Å; V257-Y261 WeakPolarHBondContact O-CD2 3.39Å; V257-Y261 PolarHBondContact O-N 3.47Å; A258-Y261 PolarHBondContact O-N 3.19Å; L259-Y261 VanDerWaalsContact C-N 3.34Å; L259-Y261 PolarHBondContact O-N 3.31Å
262W80.4Confident74.4Confident109 Ų10983.9 Ų83.941%0.41341%0.407SS..Hα-helixtrans-83.7-42.7-176.9-70121.3000113.3A258 G264 A334 F337A258-W262 WeakPolarHBondContact O-CB 3.46Å; A258-W262 PolarHBondContact O-N 2.66Å; W262-G264 VanDerWaalsContact C-N 3.3Å; W262-G264 PolarHBondContact O-N 2.94Å; W262-A334 HydrophobicContact CB-CB 4.47Å; W262-F337 AromaticContact CD1-CD1 3.87Å; W262-F337 HydrophobicContact CD2-CD1 4.03Å; W262-F337 HydrophobicContact CD2-CE1 4.4Å; W262-F337 AromaticContact CE2-CD1 3.4Å; W262-F337 AromaticContact CE2-CE1 3.43Å; W262-F337 VanDerWaalsContact CE2-CE1 3.43Å; W262-F337 HydrophobicContact CG-CD1 4.33Å; W262-F337 HydrophobicContact CH2-CE1 4.09Å; W262-F337 AromaticContact CZ2-CD1 3.75Å; W262-F337 HydrophobicContact CZ2-CD1 3.75Å; W262-F337 AromaticContact CZ2-CE1 3.27Å; W262-F337 HydrophobicContact CZ2-CE1 3.27Å; W262-F337 HydrophobicContact CZ2-CZ 4.24Å; W262-F337 AromaticContact NE1-CD1 3.29Å; W262-F337 VanDerWaalsContact NE1-CD1 3.29Å; W262-F337 AromaticContact NE1-CE1 3.57Å
263S72.8Confident72.8Confident43 Ų4383.5 Ų83.530%0.30141%0.408SS..Hα-helixtrans-70.3-26.1177.7-168.70000112.1L259 N265 E266 D267L259-S263 WeakPolarHBondContact O-CA 3.43Å; L259-S263 WeakPolarHBondContact O-CB 3.42Å; L259-S263 PolarHBondContact O-N 3.46Å; S263-N265 PolarHBondContact O-N 2.63Å; S263-N265 VanDerWaalsContact O-N 3.16Å; S263-E266 WeakPolarHBondContact O-CB 3.29Å; S263-E266 PolarHBondContact O-N 3.01Å; S263-D267 PolarHBondContact O-N 2.95Å
264G63.8Low71.3Confident39 Ų3981.3 Ų81.340%0.40240%0.399SS..THydrogen-bonded Turntrans-62.3-22.2-179.400000114.4Y260 W262Y260-G264 PolarHBondContact O-N 3.38Å; W262-G264 VanDerWaalsContact C-N 3.3Å; W262-G264 PolarHBondContact O-N 2.94Å
265N57.1Low69.6Low109 Ų10987 Ų8758%0.58343%0.425SS*.THydrogen-bonded Turntrans-81.8-24.8171.9-82.9-0.3000112.8S263 R268S263-N265 PolarHBondContact O-N 2.63Å; S263-N265 VanDerWaalsContact O-N 3.16Å; N265-R268 WeakPolarHBondContact O-CB 3.39Å; N265-R268 PolarHBondContact O-N 3.09Å
266E57.6Low68Low39 Ų3991.3 Ų91.318%0.18245%0.447CS..Hα-helixtrans-80.5-37.1-175.3-61.5-177.4136.600111.9S263 R268 L269 E270 A334S263-E266 WeakPolarHBondContact O-CB 3.29Å; S263-E266 PolarHBondContact O-N 3.01Å; E266-R268 PolarHBondContact O-N 3.26Å; E266-L269 CarbonylContact O-C 3.57Å; E266-L269 WeakPolarHBondContact O-CA 3.42Å; E266-L269 PolarHBondContact O-N 3.16Å; E266-E270 PolarHBondContact O-N 3.38Å; E266-A334 VanDerWaalsContact CD-CB 3.46Å; E266-A334 WeakPolarHBondContact OE1-CB 3.29Å; E266-A334 VanDerWaalsContact OE2-CB 3.3Å; E266-A334 WeakPolarHBondContact OE2-CB 3.24Å
267D57.1Low66.5Low83 Ų8393.9 Ų93.944%0.44445%0.453SS..Hα-helixtrans-58.7-20.7172.3-65.1-13.9000112.2S263 R271S263-D267 PolarHBondContact O-N 2.95Å; D267-R271 WeakPolarHBondContact O-CB 3.39Å; D267-R271 VanDerWaalsContact O-CG 3.3Å; D267-R271 WeakPolarHBondContact O-CG 3.5Å; D267-R271 PolarHBondContact O-N 2.92Å; D267-R271 PolarHBondContact O-NE 3.45Å
268R55.7Low64.8Low152 Ų15295.5 Ų95.557%0.57446%0.459SS*.Hα-helixtrans-79.4-42.8173.6-157.4173.381.389.7-1.4111.1N265 E266 D272N265-R268 WeakPolarHBondContact O-CB 3.39Å; N265-R268 PolarHBondContact O-N 3.09Å; E266-R268 PolarHBondContact O-N 3.26Å; R268-D272 IonicContact NH1-OD2 3.6Å; R268-D272 WeakPolarHBondContact O-CB 3.33Å; R268-D272 PolarHBondContact O-N 3.38Å
269L56.7Low63.2Low107 Ų107104.1 Ų104.156%0.5649%0.491SS*.Hα-helixtrans-69.4-39.8177.8-70.9163.2000112.4E266 D272 A273E266-L269 CarbonylContact O-C 3.57Å; E266-L269 WeakPolarHBondContact O-CA 3.42Å; E266-L269 PolarHBondContact O-N 3.16Å; L269-D272 PolarHBondContact O-N 3.3Å; L269-A273 VanDerWaalsContact O-CB 3.31Å; L269-A273 WeakPolarHBondContact O-CB 3.4Å; L269-A273 PolarHBondContact O-N 2.98Å
270E60Low61.7Low112 Ų112109.8 Ų109.852%0.52352%0.515SS..Hα-helixtrans-63.7-44.7174.7-172.8171.9-164.200110.5E266 A273 E274E266-E270 PolarHBondContact O-N 3.38Å; E270-A273 PolarHBondContact O-N 2.68Å; E270-E274 WeakPolarHBondContact O-CB 3.46Å; E270-E274 WeakPolarHBondContact O-CG 3.38Å; E270-E274 PolarHBondContact O-N 3.03Å
271R57.2Low60.1Low152 Ų152104.5 Ų104.557%0.57450%0.502SS*.Hα-helixtrans-63.7-41.7173.8-80.2-174.4-74.4162.5-7.7113D267 A273 E274 M275D267-R271 WeakPolarHBondContact O-CB 3.39Å; D267-R271 VanDerWaalsContact O-CG 3.3Å; D267-R271 WeakPolarHBondContact O-CG 3.5Å; D267-R271 PolarHBondContact O-N 2.92Å; D267-R271 PolarHBondContact O-NE 3.45Å; R271-A273 VanDerWaalsContact C-N 3.3Å; R271-A273 PolarHBondContact O-N 2.86Å; R271-E274 PolarHBondContact O-N 3.15Å; R271-M275 WeakPolarHBondContact O-CB 3.31Å; R271-M275 WeakPolarHBondContact O-CG 3.48Å; R271-M275 PolarHBondContact O-N 2.88Å
272D55Low58.4Low76 Ų76102 Ų10241%0.40650%0.497SS..Hα-helixtrans-64.3-37.9177.1-69.2-16.7000110.4R268 L269 M275 D276R268-D272 IonicContact NH1-OD2 3.6Å; R268-D272 WeakPolarHBondContact O-CB 3.33Å; R268-D272 PolarHBondContact O-N 3.38Å; L269-D272 PolarHBondContact O-N 3.3Å; D272-M275 PolarHBondContact O-N 2.74Å; D272-D276 PolarHBondContact O-N 3.02Å; D272-D276 VanDerWaalsContact O-N 3.12Å
273A57.3Low56.8Low48 Ų4899.8 Ų99.840%0.39751%0.507SS..Hα-helixtrans-69.5-40.9175.100000113.3L269 E270 R271 M275 D276 F277L269-A273 VanDerWaalsContact O-CB 3.31Å; L269-A273 WeakPolarHBondContact O-CB 3.4Å; L269-A273 PolarHBondContact O-N 2.98Å; E270-A273 PolarHBondContact O-N 2.68Å; R271-A273 VanDerWaalsContact C-N 3.3Å; R271-A273 PolarHBondContact O-N 2.86Å; A273-M275 VanDerWaalsContact C-N 3.33Å; A273-D276 PolarHBondContact O-N 3.46Å; A273-F277 VanDerWaalsContact O-CB 3.31Å; A273-F277 WeakPolarHBondContact O-CB 3.18Å; A273-F277 PolarHBondContact O-N 2.73Å
274E59.4Low55.6Low104 Ų104106.1 Ų106.149%0.48653%0.53SS..Hα-helixtrans-63.4-37.8174-75.4-180169.400111.9E270 R271 F277 N278E270-E274 WeakPolarHBondContact O-CB 3.46Å; E270-E274 WeakPolarHBondContact O-CG 3.38Å; E270-E274 PolarHBondContact O-N 3.03Å; R271-E274 PolarHBondContact O-N 3.15Å; E274-F277 WeakPolarHBondContact O-CB 3.22Å; E274-F277 PolarHBondContact O-N 3.5Å; E274-N278 PolarHBondContact O-N 3.37Å
275M58.7Low54.7Low131 Ų131111.3 Ų111.365%0.64555%0.548SS*.Hα-helixtrans-67.1-44.4177.4-73.6-68.1-67.900112R271 D272 A273 F277 N278 Y279R271-M275 WeakPolarHBondContact O-CB 3.31Å; R271-M275 WeakPolarHBondContact O-CG 3.48Å; R271-M275 PolarHBondContact O-N 2.88Å; D272-M275 PolarHBondContact O-N 2.74Å; A273-M275 VanDerWaalsContact C-N 3.33Å; M275-F277 VanDerWaalsContact C-N 3.27Å; M275-F277 PolarHBondContact O-N 3.04Å; M275-N278 PolarHBondContact O-N 2.94Å; M275-Y279 PolarHBondContact O-N 3.05Å; M275-Y279 VanDerWaalsContact O-N 3.12Å
276D57.8Low54Low110 Ų110115.2 Ų115.259%0.58856%0.555SS**Hα-helixtrans-64-33.5174.1-86.7-5.8000112.1D272 A273 K280D272-D276 PolarHBondContact O-N 3.02Å; D272-D276 VanDerWaalsContact O-N 3.12Å; A273-D276 PolarHBondContact O-N 3.46Å; D276-K280 PolarHBondContact O-N 3.01Å
277F54.2Low53.1Low122 Ų122120.8 Ų120.854%0.53559%0.586SS.*Hα-helixtrans-69.2-45.8176.8-179.7-97.2000112.8A273 E274 M275 Y279 K280 T281A273-F277 VanDerWaalsContact O-CB 3.31Å; A273-F277 WeakPolarHBondContact O-CB 3.18Å; A273-F277 PolarHBondContact O-N 2.73Å; E274-F277 WeakPolarHBondContact O-CB 3.22Å; E274-F277 PolarHBondContact O-N 3.5Å; M275-F277 VanDerWaalsContact C-N 3.27Å; M275-F277 PolarHBondContact O-N 3.04Å; F277-Y279 VanDerWaalsContact C-N 3.32Å; F277-Y279 PolarHBondContact O-N 3.44Å; F277-K280 PolarHBondContact O-N 3.44Å; F277-T281 WeakPolarHBondContact O-CB 3.24Å; F277-T281 PolarHBondContact O-N 2.98Å; F277-T281 PolarHBondContact O-OG1 3.09Å
278N55.6Low52.2Low87 Ų87127.9 Ų127.947%0.46561%0.606SS.*Hα-helixtrans-64.5-38.2177.4-79.7-25.7000111.6E274 M275 K280 T281 E282E274-N278 PolarHBondContact O-N 3.37Å; M275-N278 PolarHBondContact O-N 2.94Å; N278-K280 PolarHBondContact O-N 3.11Å; N278-T281 PolarHBondContact O-N 3.17Å; N278-E282 WeakPolarHBondContact O-CB 3.4Å; N278-E282 PolarHBondContact O-N 3.41Å
279Y54.8Low51Low193 Ų193127.1 Ų127.176%0.75762%0.623SS**Hα-helixtrans-62.8-41.2176.5-170.8-98.2000112.5M275 F277 G283M275-Y279 PolarHBondContact O-N 3.05Å; M275-Y279 VanDerWaalsContact O-N 3.12Å; F277-Y279 VanDerWaalsContact C-N 3.32Å; F277-Y279 PolarHBondContact O-N 3.44Å; Y279-G283 PolarHBondContact O-N 2.88Å
280K54.8Low50.1Low138 Ų138127.8 Ų127.860%0.664%0.636SS**Hα-helixtrans-75.4-35.1178.6-74.7178.1-179.3172.20113.3D276 F277 N278D276-K280 PolarHBondContact O-N 3.01Å; F277-K280 PolarHBondContact O-N 3.44Å; N278-K280 PolarHBondContact O-N 3.11Å
281T51.5Low49Very low74 Ų74125.6 Ų125.645%0.45464%0.644SS.*Hα-helixtrans-77-39.2-178.2-550000112.3F277 N278 G283F277-T281 WeakPolarHBondContact O-CB 3.24Å; F277-T281 PolarHBondContact O-N 2.98Å; F277-T281 PolarHBondContact O-OG1 3.09Å; N278-T281 PolarHBondContact O-N 3.17Å; T281-G283 VanDerWaalsContact C-N 3.32Å; T281-G283 PolarHBondContact O-N 3.46Å
282E49.4Very low47.9Very low115 Ų115128.4 Ų128.454%0.53766%0.661SS.*Hα-helixtrans-73-23.4176.9-70.8-161.617400113.3N278 F284 R286N278-E282 WeakPolarHBondContact O-CB 3.4Å; N278-E282 PolarHBondContact O-N 3.41Å; E282-F284 VanDerWaalsContact C-N 3.29Å; E282-F284 PolarHBondContact O-N 2.98Å; E282-R286 IonicContact OE2-NH1 3.93Å
283G47.4Very low46.9Very low62 Ų62130 Ų13064%0.63968%0.675SS**Hα-helixtrans-65.8-26178.500000114.6Y279 T281Y279-G283 PolarHBondContact O-N 2.88Å; T281-G283 VanDerWaalsContact C-N 3.32Å; T281-G283 PolarHBondContact O-N 3.46Å
284F47Very low45.9Very low175 Ų175134.4 Ų134.477%0.76869%0.69SS**Hα-helixtrans-91.4-22.5-177.2-99.3-93.6000114.4E282E282-F284 VanDerWaalsContact C-N 3.29Å; E282-F284 PolarHBondContact O-N 2.98Å
285N44.5Very low44.9Very low148 Ų148138 Ų13879%0.79171%0.707SS**Hα-helixtrans-1106.2-167.5-133.3-10.2000115.1
286R42.4Very low44.1Very low192 Ų192141.5 Ų141.573%0.72571%0.714SS**SBendtrans-102.43.5-173.3-136.1171166.1155.9-3.6115.7E282E282-R286 IonicContact OE2-NH1 3.93Å
287N38.9Very low43.3Very low156 Ų156140.9 Ų140.983%0.83472%0.724SS**SBendtrans-107.156.1174.4-80.4-9.9000112.4
288R38.2Very low42.6Very low232 Ų232143 Ų14388%0.87574%0.739SS**SBendtrans-168136.7155.1-113.5175.1-90.3-168.4-2.1107.4
289C29.5Very low41.9Very low135 Ų135143.5 Ų143.591%0.91275%0.748SS**  trans88.459.6-179.3-52.90000116.8
290S39.1Very low41Very low121 Ų121142 Ų14285%0.84675%0.752SS**  trans-108.3122.3142.362.60000107.9
291G35.9Very low40.4Very low66 Ų66139.9 Ų139.968%0.6876%0.761SS**  trans-66.1159.2-160.100000117.3
292F34.6Very low40Very low212 Ų212144.7 Ų144.793%0.9378%0.778SS**  trans-174.3143.5135.4-99.1-74.1000107.4
293P33.5Very low39.2Very low109 Ų109145.4 Ų145.471%0.70879%0.791SS**  trans-100.4157-165.541-34000113.3
294I36.5Very low38.7Very low140 Ų140148.1 Ų148.172%0.71880%0.8SS**  trans70.6102.1160.8-41.2-168.3000117.7
295H39.5Very low38.7Very low179 Ų179145.3 Ų145.383%0.82980%0.797SS**  -160.8139.9119.6-130.7-94.6000112.7
296Y40.7Very low38.7Very low206 Ų206142.9 Ų142.981%0.80879%0.791SS**  trans-60.9128.4-177-71.8-101.1000113.5
297A40.5Very low38.6Very low97 Ų97141.9 Ų141.980%0.80280%0.795SS**  trans-159.3115.4150.700000110.1
298I41.3Very low38.6Very low165 Ų165145 Ų14585%0.84680%0.795SS**  trans-82.8153.2175.3-81.2175.4000109.6
299P39.2Very low39.1Very low99 Ų99140.2 Ų140.264%0.64378%0.782SS**  trans-101.2173.1-141.239.1-32.2000113.3
300N37.5Very low40.2Very low160 Ų160137.2 Ų137.286%0.85676%0.76SS**  trans174.5112.8140.7-85.1-22.1000111.5
301A40.6Very low41Very low95 Ų95135.4 Ų135.479%0.78574%0.744SS**  trans-172.194.1148.800000110.5
302H43.5Very low42.2Very low174 Ų174136 Ų13681%0.80673%0.731SS**  trans9.1101.7156.3-60.5-80000119.4
303T33.2Very low43.4Very low131 Ų131130.1 Ų130.180%0.80471%0.708SS**  10.8107.4125.617.20000118.5
304S37.2Very low44.6Very low119 Ų119129.2 Ų129.283%0.83270%0.697SS**  trans-151.556.4143.353.40000109.7
305V46.5Very low46.3Very low116 Ų116126.4 Ų126.470%0.70369%0.686SS**  trans-119.3-8.6-177179.20000112.5E307V305-E307 PolarHBondContact O-N 3.16Å
306S44.1Very low47.9Very low97 Ų97122.1 Ų122.168%0.67867%0.669SS**Hα-helixtrans-79.3-16.2-174.2-156.60000115
307E40.3Very low49.3Very low170 Ų170117 Ų11779%0.79466%0.655SS**Hα-helixtrans-90.8-26.6-176.8-97.9175.9163.700114.5V305 T310V305-E307 PolarHBondContact O-N 3.16Å; E307-T310 PolarHBondContact O-OG1 2.89Å
308R39.3Very low50.6Low221 Ų221119.7 Ų119.783%0.83465%0.645SS**Hα-helixtrans-76.9-25.1175.3-83-174-169.3170.64.5113T311R308-T311 PolarHBondContact O-OG1 2.91Å; R308-T311 VanDerWaalsContact O-OG1 3.05Å
309H48.4Very low52Low132 Ų132116.6 Ų116.661%0.61163%0.627SS**Hα-helixtrans-79.1-30-176.4-167.8-86.3000112.3M313H309-M313 VanDerWaalsContact O-CG 3.27Å; H309-M313 WeakPolarHBondContact O-CG 3.3Å; H309-M313 PolarHBondContact O-N 3.44Å
310T53.9Low53.4Low73 Ų73120.1 Ų120.145%0.44863%0.628SS.*Hα-helixtrans-72-41.5177.151.20000111.5E307 D312 M313 D314E307-T310 PolarHBondContact O-OG1 2.89Å; T310-D312 PolarHBondContact O-N 3.33Å; T310-M313 PolarHBondContact O-N 2.9Å; T310-D314 PolarHBondContact O-N 3.01Å
311T55.3Low55.1Low82 Ų82118.3 Ų118.350%0.50361%0.614SS.*Hα-helixtrans-65-37.2178.854.60000113.1R308 T315R308-T311 PolarHBondContact O-OG1 2.91Å; R308-T311 VanDerWaalsContact O-OG1 3.05Å; T311-T315 VanDerWaalsContact O-CG2 3.28Å; T311-T315 WeakPolarHBondContact O-CG2 3.46Å; T311-T315 PolarHBondContact O-N 2.87Å; T311-T315 PolarHBondContact O-OG1 3.22Å
312D60.3Low56.6Low78 Ų78117.9 Ų117.942%0.41760%0.599SS.*Hα-helixtrans-68.6-41.3179.1-139.314000110.3T310 T315 L316T310-D312 PolarHBondContact O-N 3.33Å; D312-T315 PolarHBondContact O-N 3.38Å; D312-T315 PolarHBondContact O-OG1 2.99Å; D312-L316 VanDerWaalsContact O-CG 3.29Å; D312-L316 WeakPolarHBondContact O-CG 3.39Å; D312-L316 PolarHBondContact O-N 3.4Å
313M59.4Low58Low90 Ų90113.3 Ų113.344%0.44358%0.583SS.*Hα-helixtrans-64.8-42.8176.6-71.2-62.2-66.200112.9H309 T310 T315 L316 I317H309-M313 VanDerWaalsContact O-CG 3.27Å; H309-M313 WeakPolarHBondContact O-CG 3.3Å; H309-M313 PolarHBondContact O-N 3.44Å; T310-M313 PolarHBondContact O-N 2.9Å; M313-T315 VanDerWaalsContact C-N 3.35Å; M313-T315 PolarHBondContact O-N 3.46Å; M313-L316 PolarHBondContact O-N 3.13Å; M313-L316 HydrophobicContact SD-CD1 4.41Å; M313-I317 WeakPolarHBondContact O-CG1 3.45Å; M313-I317 PolarHBondContact O-N 3.2Å
314D59.8Low59.8Low90 Ų90109.3 Ų109.348%0.48156%0.564SS.*Hα-helixtrans-61.5-45.5177-70.2-23.1000110.6T310 L316 I317 Y318T310-D314 PolarHBondContact O-N 3.01Å; D314-L316 VanDerWaalsContact C-N 3.3Å; D314-L316 PolarHBondContact O-N 3.09Å; D314-I317 PolarHBondContact O-N 2.89Å; D314-I317 VanDerWaalsContact O-N 3.17Å; D314-Y318 HydrophobicContact CB-CE2 4.44Å; D314-Y318 WeakPolarHBondContact O-CD2 3.19Å; D314-Y318 PolarHBondContact O-N 3.43Å
315T73.1Confident61.6Low80 Ų80107.7 Ų107.749%0.49155%0.545SS..Hα-helixtrans-61.7-37.2177.661.80000112.8T311 D312 M313 Q319T311-T315 VanDerWaalsContact O-CG2 3.28Å; T311-T315 WeakPolarHBondContact O-CG2 3.46Å; T311-T315 PolarHBondContact O-N 2.87Å; T311-T315 PolarHBondContact O-OG1 3.22Å; D312-T315 PolarHBondContact O-N 3.38Å; D312-T315 PolarHBondContact O-OG1 2.99Å; M313-T315 VanDerWaalsContact C-N 3.35Å; M313-T315 PolarHBondContact O-N 3.46Å; T315-Q319 WeakPolarHBondContact O-CB 3.44Å; T315-Q319 PolarHBondContact O-N 3.4Å
316L71.9Confident63Low90 Ų90105 Ų10547%0.47153%0.525SS..Hα-helixtrans-67.9-37.6175.4-71.7170.8000112.4D312 M313 D314 Q319 R320D312-L316 VanDerWaalsContact O-CG 3.29Å; D312-L316 WeakPolarHBondContact O-CG 3.39Å; D312-L316 PolarHBondContact O-N 3.4Å; M313-L316 PolarHBondContact O-N 3.13Å; M313-L316 HydrophobicContact SD-CD1 4.41Å; D314-L316 VanDerWaalsContact C-N 3.3Å; D314-L316 PolarHBondContact O-N 3.09Å; L316-Q319 PolarHBondContact O-N 3.36Å; L316-R320 WeakPolarHBondContact O-CB 3.3Å; L316-R320 PolarHBondContact O-N 2.95Å
317I69.6Low64.5Low98 Ų98103.1 Ų103.150%0.50352%0.515SS..Hα-helixtrans-65.1-45.6175.7-68.3167000110.5M313 D314 R320 Q321M313-I317 WeakPolarHBondContact O-CG1 3.45Å; M313-I317 PolarHBondContact O-N 3.2Å; D314-I317 PolarHBondContact O-N 2.89Å; D314-I317 VanDerWaalsContact O-N 3.17Å; I317-R320 WeakPolarHBondContact O-CB 3.34Å; I317-R320 PolarHBondContact O-N 3.24Å; I317-Q321 PolarHBondContact O-N 2.77Å
318Y68.4Low66.2Low153 Ų15398.7 Ų98.760%0.650%0.496SS*.Hα-helixtrans-59.7-46.8174.5-75.5-68.2000111.7D314 R320 Q321 D322D314-Y318 HydrophobicContact CB-CE2 4.44Å; D314-Y318 WeakPolarHBondContact O-CD2 3.19Å; D314-Y318 PolarHBondContact O-N 3.43Å; Y318-R320 VanDerWaalsContact C-N 3.29Å; Y318-R320 PolarHBondContact O-N 3.48Å; Y318-Q321 WeakPolarHBondContact O-CB 3.22Å; Y318-Q321 PolarHBondContact O-N 2.9Å; Y318-Q321 VanDerWaalsContact O-N 3.09Å; Y318-D322 PolarHBondContact O-N 3.11Å
319Q71.7Confident68.2Low101 Ų10189.3 Ų89.347%0.47246%0.461SS..Hα-helixtrans-61.9-36.9177.9-168.3-175.6-53.700112.3T315 L316 T323T315-Q319 WeakPolarHBondContact O-CB 3.44Å; T315-Q319 PolarHBondContact O-N 3.4Å; L316-Q319 PolarHBondContact O-N 3.36Å; Q319-T323 PolarHBondContact O-N 2.65Å; Q319-T323 VanDerWaalsContact O-N 3.11Å; Q319-T323 PolarHBondContact O-OG1 3.41Å
320R68.7Low69.6Low172 Ų17285 Ų8565%0.64944%0.442SS*.Hα-helixtrans-63.6-42.2174.1-175.5178.1-177.5172.1-0.2111.2L316 I317 Y318 A324L316-R320 WeakPolarHBondContact O-CB 3.3Å; L316-R320 PolarHBondContact O-N 2.95Å; I317-R320 WeakPolarHBondContact O-CB 3.34Å; I317-R320 PolarHBondContact O-N 3.24Å; Y318-R320 VanDerWaalsContact C-N 3.29Å; Y318-R320 PolarHBondContact O-N 3.48Å; R320-A324 VanDerWaalsContact O-CB 3.31Å; R320-A324 WeakPolarHBondContact O-CB 3.23Å; R320-A324 PolarHBondContact O-N 2.59Å
321Q71.7Confident70.9Confident123 Ų12386.2 Ų86.258%0.57544%0.438SS*.Hα-helixtrans-65-43.3179.2-172.6171.6-0.700111.9I317 Y318 A324 L325I317-Q321 PolarHBondContact O-N 2.77Å; Y318-Q321 WeakPolarHBondContact O-CB 3.22Å; Y318-Q321 PolarHBondContact O-N 2.9Å; Y318-Q321 VanDerWaalsContact O-N 3.09Å; Q321-A324 PolarHBondContact O-N 2.68Å; Q321-L325 WeakPolarHBondContact O-CB 3.32Å; Q321-L325 PolarHBondContact O-N 3.36Å
322D72.2Confident72.2Confident86 Ų8687.2 Ų87.246%0.4643%0.433SS..Hα-helixtrans-66-42.6178.8-70.7-22.9000112.1Y318 A324 L325 Q326Y318-D322 PolarHBondContact O-N 3.11Å; D322-A324 VanDerWaalsContact C-N 3.35Å; D322-A324 PolarHBondContact O-N 2.99Å; D322-L325 PolarHBondContact O-N 3.49Å; D322-Q326 WeakPolarHBondContact O-CB 3Å; D322-Q326 PolarHBondContact O-N 2.83Å
323T72.6Confident73.4Confident77 Ų7784.6 Ų84.647%0.47242%0.418SS..Hα-helixtrans-64.7-41.3178-45.40000111Q319 Q326 A327Q319-T323 PolarHBondContact O-N 2.65Å; Q319-T323 VanDerWaalsContact O-N 3.11Å; Q319-T323 PolarHBondContact O-OG1 3.41Å; T323-Q326 PolarHBondContact O-N 2.86Å; T323-A327 PolarHBondContact O-N 3.16Å
324A72.2Confident74.6Confident48 Ų4880.7 Ų80.740%0.39740%0.4SS..Hα-helixtrans-65.5-42.517600000111.8R320 Q321 D322 Q326 A327 I328R320-A324 VanDerWaalsContact O-CB 3.31Å; R320-A324 WeakPolarHBondContact O-CB 3.23Å; R320-A324 PolarHBondContact O-N 2.59Å; Q321-A324 PolarHBondContact O-N 2.68Å; D322-A324 VanDerWaalsContact C-N 3.35Å; D322-A324 PolarHBondContact O-N 2.99Å; A324-Q326 VanDerWaalsContact C-N 3.33Å; A324-Q326 PolarHBondContact O-N 3.17Å; A324-A327 PolarHBondContact O-N 2.92Å; A324-I328 WeakPolarHBondContact O-CD1 3.35Å; A324-I328 VanDerWaalsContact O-CG1 3.25Å; A324-I328 WeakPolarHBondContact O-CG1 3.43Å; A324-I328 PolarHBondContact O-N 3.45Å
325L75Confident75.8Confident84 Ų8477.7 Ų77.744%0.4438%0.384SS..Hα-helixtrans-60.2-44.9175.9-170.297.6000111Q321 D322 I328 Y329 Y430 L434Q321-L325 WeakPolarHBondContact O-CB 3.32Å; Q321-L325 PolarHBondContact O-N 3.36Å; D322-L325 PolarHBondContact O-N 3.49Å; L325-I328 PolarHBondContact O-N 3.16Å; L325-Y329 WeakPolarHBondContact O-CB 3.29Å; L325-Y329 PolarHBondContact O-N 2.92Å; L325-Y430 VanDerWaalsContact CD2-OH 3.22Å; L325-Y430 WeakPolarHBondContact CD2-OH 3.48Å; L325-L434 HydrophobicContact CD2-CD2 4.27Å
326Q76Confident76.5Confident61 Ų6175.8 Ų75.829%0.28537%0.37SS..Hα-helixtrans-62.9-45.3178.6-173.460.328.200112D322 T323 A324 I328 Y329 D330D322-Q326 WeakPolarHBondContact O-CB 3Å; D322-Q326 PolarHBondContact O-N 2.83Å; T323-Q326 PolarHBondContact O-N 2.86Å; A324-Q326 VanDerWaalsContact C-N 3.33Å; A324-Q326 PolarHBondContact O-N 3.17Å; Q326-I328 VanDerWaalsContact C-N 3.35Å; Q326-I328 PolarHBondContact O-N 3.37Å; Q326-Y329 WeakPolarHBondContact O-CB 3.12Å; Q326-Y329 PolarHBondContact O-N 3.1Å; Q326-D330 PolarHBondContact NE2-OD1 2.82Å; Q326-D330 PolarHBondContact NE2-OD2 3.27Å; Q326-D330 PolarHBondContact O-N 3.15Å
327A75Confident77.3Confident56 Ų5673.2 Ų73.246%0.46336%0.356SS..Hα-helixtrans-62.5-39.9176.700000112.6T323 A324 Y329 R331T323-A327 PolarHBondContact O-N 3.16Å; A324-A327 PolarHBondContact O-N 2.92Å; A327-Y329 VanDerWaalsContact C-N 3.35Å; A327-R331 WeakPolarHBondContact O-CB 3.38Å; A327-R331 PolarHBondContact O-N 3.06Å; A327-R331 VanDerWaalsContact O-N 3.15Å
328I76Confident78.3Confident77 Ų7768.6 Ų68.640%0.39533%0.332SS..Hα-helixtrans-64.1-42.8174.9-68.4164.8000110.6L13 A324 L325 Q326 Y332L13-I328 HydrophobicContact CD1-CD1 4.27Å; A324-I328 WeakPolarHBondContact O-CD1 3.35Å; A324-I328 VanDerWaalsContact O-CG1 3.25Å; A324-I328 WeakPolarHBondContact O-CG1 3.43Å; A324-I328 PolarHBondContact O-N 3.45Å; L325-I328 PolarHBondContact O-N 3.16Å; Q326-I328 VanDerWaalsContact C-N 3.35Å; Q326-I328 PolarHBondContact O-N 3.37Å; I328-Y332 WeakPolarHBondContact O-CB 3.32Å; I328-Y332 PolarHBondContact O-N 3.41Å
329Y80.7Confident79.4Confident25 Ų2561.6 Ų61.610%0.09831%0.306CS..Hα-helixtrans-62.3-50.8178.4169-94.3000112.2L325 Q326 A327 R331 Y332 Y333 R427 Y430L325-Y329 WeakPolarHBondContact O-CB 3.29Å; L325-Y329 PolarHBondContact O-N 2.92Å; Q326-Y329 WeakPolarHBondContact O-CB 3.12Å; Q326-Y329 PolarHBondContact O-N 3.1Å; A327-Y329 VanDerWaalsContact C-N 3.35Å; Y329-R331 VanDerWaalsContact C-N 3.34Å; Y329-R331 PolarHBondContact O-N 2.97Å; Y329-Y332 WeakPolarHBondContact O-CB 3.04Å; Y329-Y332 PolarHBondContact O-N 2.76Å; Y329-Y332 VanDerWaalsContact O-N 3.12Å; Y329-Y333 PolarHBondContact O-N 3.22Å; Y329-R427 WeakPolarHBondContact OH-CA 3.22Å; Y329-R427 WeakPolarHBondContact OH-CB 3.34Å; Y329-R427 VanDerWaalsContact OH-CG 3.25Å; Y329-R427 WeakPolarHBondContact OH-CG 3.49Å; Y329-Y430 AromaticContact CD1-CD1 3.82Å; Y329-Y430 HydrophobicContact CD1-CD1 3.82Å; Y329-Y430 AromaticContact CD1-CE1 3.47Å; Y329-Y430 HydrophobicContact CD1-CE1 3.47Å; Y329-Y430 VanDerWaalsContact CD1-CE1 3.47Å; Y329-Y430 AromaticContact CD2-CD1 3.55Å; Y329-Y430 HydrophobicContact CD2-CD1 3.55Å; Y329-Y430 HydrophobicContact CD2-CD2 4.09Å; Y329-Y430 AromaticContact CD2-CE1 3.4Å; Y329-Y430 HydrophobicContact CD2-CE1 3.4Å; Y329-Y430 AromaticContact CD2-CE2 3.98Å; Y329-Y430 HydrophobicContact CD2-CE2 3.98Å; Y329-Y430 AromaticContact CD2-CG 3.88Å; Y329-Y430 HydrophobicContact CD2-CG 3.88Å; Y329-Y430 AromaticContact CD2-CZ 3.64Å; Y329-Y430 AromaticContact CE1-CD1 3.64Å; Y329-Y430 HydrophobicContact CE1-CD1 3.64Å; Y329-Y430 AromaticContact CE1-CE1 3.81Å; Y329-Y430 HydrophobicContact CE1-CE1 3.81Å; Y329-Y430 AromaticContact CE2-CD1 3.35Å; Y329-Y430 HydrophobicContact CE2-CD1 3.35Å; Y329-Y430 HydrophobicContact CE2-CD2 4.11Å; Y329-Y430 AromaticContact CE2-CE1 3.74Å; Y329-Y430 HydrophobicContact CE2-CE1 3.74Å; Y329-Y430 HydrophobicContact CE2-CE2 4.46Å; Y329-Y430 AromaticContact CE2-CG 3.54Å; Y329-Y430 HydrophobicContact CE2-CG 3.54Å; Y329-Y430 AromaticContact CG-CD1 3.78Å; Y329-Y430 HydrophobicContact CG-CD1 3.78Å; Y329-Y430 AromaticContact CG-CE1 3.26Å; Y329-Y430 HydrophobicContact CG-CE1 3.26Å; Y329-Y430 HydrophobicContact CG-CE2 4.45Å; Y329-Y430 AromaticContact CG-CZ 3.66Å; Y329-Y430 AromaticContact CZ-CD1 3.41Å; Y329-Y430 VanDerWaalsContact CZ-CD1 3.41Å; Y329-Y430 AromaticContact CZ-CE1 3.95Å; Y329-Y430 AromaticContact CZ-CG 3.95Å
330D79.4Confident80.3Confident40 Ų4057.6 Ų57.621%0.21429%0.288CS..Hα-helixtrans-60.4-47.1-178.1-76.1-35.8000110.3Q326 Y332 Y333 A334Q326-D330 PolarHBondContact NE2-OD1 2.82Å; Q326-D330 PolarHBondContact NE2-OD2 3.27Å; Q326-D330 PolarHBondContact O-N 3.15Å; D330-Y332 VanDerWaalsContact C-N 3.32Å; D330-Y332 PolarHBondContact O-N 3.29Å; D330-Y333 WeakPolarHBondContact O-CA 3.33Å; D330-Y333 WeakPolarHBondContact O-CB 3.33Å; D330-Y333 PolarHBondContact O-N 2.9Å; D330-Y333 VanDerWaalsContact O-N 3.07Å; D330-A334 PolarHBondContact O-N 2.93Å
331R80.9Confident81.4Confident100 Ų10051.1 Ų51.138%0.37727%0.267SS..Hα-helixtrans-57.6-42.5174.3-177.6-178.9178.2-1806.1112.9A327 Y329 Y333 A334 D335A327-R331 WeakPolarHBondContact O-CB 3.38Å; A327-R331 PolarHBondContact O-N 3.06Å; A327-R331 VanDerWaalsContact O-N 3.15Å; Y329-R331 VanDerWaalsContact C-N 3.34Å; Y329-R331 PolarHBondContact O-N 2.97Å; R331-Y333 VanDerWaalsContact C-N 3.33Å; R331-A334 PolarHBondContact O-N 3.11Å; R331-D335 WeakPolarHBondContact O-CB 3.36Å; R331-D335 PolarHBondContact O-N 3.22Å
332Y82.4Confident82.5Confident102 Ų10245.2 Ų45.240%0.424%0.24SC..Hα-helixtrans-64.6-40.6177.5-178.9-101.5000111.2I328 Y329 D330 D335 L336I328-Y332 WeakPolarHBondContact O-CB 3.32Å; I328-Y332 PolarHBondContact O-N 3.41Å; Y329-Y332 WeakPolarHBondContact O-CB 3.04Å; Y329-Y332 PolarHBondContact O-N 2.76Å; Y329-Y332 VanDerWaalsContact O-N 3.12Å; D330-Y332 VanDerWaalsContact C-N 3.32Å; D330-Y332 PolarHBondContact O-N 3.29Å; Y332-D335 PolarHBondContact O-N 2.84Å; Y332-L336 HydrophobicContact CD1-CD1 3.8Å; Y332-L336 HydrophobicContact CD1-CG 4.29Å; Y332-L336 HydrophobicContact CE1-CD1 3.33Å; Y332-L336 HydrophobicContact CE1-CD2 4.5Å; Y332-L336 HydrophobicContact CE1-CG 3.95Å; Y332-L336 WeakPolarHBondContact O-CG 3.5Å; Y332-L336 PolarHBondContact O-N 3.44Å
333Y84.2Confident83.6Confident24 Ų2442 Ų429%0.09422%0.222CC..Hα-helixtrans-64.1-45.5176.1-173.9-91.2000112Y329 D330 R331 L336 F337 I423 F424 R427Y329-Y333 PolarHBondContact O-N 3.22Å; D330-Y333 WeakPolarHBondContact O-CA 3.33Å; D330-Y333 WeakPolarHBondContact O-CB 3.33Å; D330-Y333 PolarHBondContact O-N 2.9Å; D330-Y333 VanDerWaalsContact O-N 3.07Å; R331-Y333 VanDerWaalsContact C-N 3.33Å; Y333-L336 PolarHBondContact O-N 3.45Å; Y333-F337 WeakPolarHBondContact O-CB 3.38Å; Y333-F337 PolarHBondContact O-N 3.39Å; Y333-I423 HydrophobicContact CD2-CG2 3.98Å; Y333-I423 HydrophobicContact CE2-CG2 3.28Å; Y333-F424 WeakPolarHBondContact OH-CD1 3.35Å; Y333-F424 WeakPolarHBondContact OH-CE1 3.42Å; Y333-R427 HydrophobicContact CD2-CB 4.11Å; Y333-R427 HydrophobicContact CE2-CB 3.59Å; Y333-R427 HydrophobicContact CE2-CG 4.19Å
334A85.5Confident84.7Confident8 Ų841.8 Ų41.87%0.06622%0.215CC..Hα-helixtrans-63.1-41.7175.600000112.2W262 E266 D330 R331 L336 F337 A338W262-A334 HydrophobicContact CB-CB 4.47Å; E266-A334 VanDerWaalsContact CD-CB 3.46Å; E266-A334 WeakPolarHBondContact OE1-CB 3.29Å; E266-A334 VanDerWaalsContact OE2-CB 3.3Å; E266-A334 WeakPolarHBondContact OE2-CB 3.24Å; D330-A334 PolarHBondContact O-N 2.93Å; R331-A334 PolarHBondContact O-N 3.11Å; A334-L336 PolarHBondContact O-N 3.02Å; A334-F337 PolarHBondContact O-N 2.9Å; A334-A338 WeakPolarHBondContact O-CB 3.5Å; A334-A338 PolarHBondContact O-N 3.37Å
335D85.7Confident85.9Confident27 Ų2742.6 Ų42.614%0.14422%0.215CC..Hα-helixtrans-60.1-43.9174.2-84.7-23.2000111.8R5 L259 R331 Y332 G339R5-D335 IonicContact CZ-OD1 2.68Å; R5-D335 IonicContact CZ-OD2 3.66Å; R5-D335 IonicContact NH1-OD1 2.74Å; R5-D335 PolarHBondContact NH1-OD1 3Å; R5-D335 IonicContact NH1-OD2 3.42Å; R5-D335 PolarHBondContact NH1-OD2 3.4Å; L259-D335 WeakPolarHBondContact CD2-OD1 3.36Å; R331-D335 WeakPolarHBondContact O-CB 3.36Å; R331-D335 PolarHBondContact O-N 3.22Å; Y332-D335 PolarHBondContact O-N 2.84Å; D335-G339 PolarHBondContact O-N 3.45Å
336L86.8Confident86.9Confident39 Ų3938.6 Ų38.620%0.20419%0.194CC..Hα-helixtrans-62.4-47.1176.6-77.4177.9000111.7Y2 Y332 Y333 A334 G339 M340Y2-L336 HydrophobicContact CD1-CD2 4.37Å; Y2-L336 HydrophobicContact CE1-CD2 3.77Å; Y332-L336 HydrophobicContact CD1-CD1 3.8Å; Y332-L336 HydrophobicContact CD1-CG 4.29Å; Y332-L336 HydrophobicContact CE1-CD1 3.33Å; Y332-L336 HydrophobicContact CE1-CD2 4.5Å; Y332-L336 HydrophobicContact CE1-CG 3.95Å; Y332-L336 WeakPolarHBondContact O-CG 3.5Å; Y332-L336 PolarHBondContact O-N 3.44Å; Y333-L336 PolarHBondContact O-N 3.45Å; A334-L336 PolarHBondContact O-N 3.02Å; L336-G339 PolarHBondContact O-N 3.15Å; L336-M340 WeakPolarHBondContact O-CB 3.29Å; L336-M340 PolarHBondContact O-N 3.39Å
337F88.9Confident87.9Confident37 Ų3736.6 Ų36.616%0.16219%0.185CC..Hα-helixtrans-68.6-38.8-178.5-162.3-85.5000111.6W262 Y333 A334 G339 M340 T341 F424W262-F337 AromaticContact CD1-CD1 3.87Å; W262-F337 HydrophobicContact CD2-CD1 4.03Å; W262-F337 HydrophobicContact CD2-CE1 4.4Å; W262-F337 AromaticContact CE2-CD1 3.4Å; W262-F337 AromaticContact CE2-CE1 3.43Å; W262-F337 VanDerWaalsContact CE2-CE1 3.43Å; W262-F337 HydrophobicContact CG-CD1 4.33Å; W262-F337 HydrophobicContact CH2-CE1 4.09Å; W262-F337 AromaticContact CZ2-CD1 3.75Å; W262-F337 HydrophobicContact CZ2-CD1 3.75Å; W262-F337 AromaticContact CZ2-CE1 3.27Å; W262-F337 HydrophobicContact CZ2-CE1 3.27Å; W262-F337 HydrophobicContact CZ2-CZ 4.24Å; W262-F337 AromaticContact NE1-CD1 3.29Å; W262-F337 VanDerWaalsContact NE1-CD1 3.29Å; W262-F337 AromaticContact NE1-CE1 3.57Å; Y333-F337 WeakPolarHBondContact O-CB 3.38Å; Y333-F337 PolarHBondContact O-N 3.39Å; A334-F337 PolarHBondContact O-N 2.9Å; F337-G339 VanDerWaalsContact C-N 3.34Å; F337-M340 HydrophobicContact CD2-CE 3.64Å; F337-M340 HydrophobicContact CE2-CE 3.53Å; F337-M340 HydrophobicContact CG-CE 4.35Å; F337-M340 HydrophobicContact CZ-CE 4.15Å; F337-M340 PolarHBondContact O-N 2.98Å; F337-T341 HydrophobicContact CD1-CG2 3.8Å; F337-T341 HydrophobicContact CE1-CG2 3.47Å; F337-T341 VanDerWaalsContact CE1-CG2 3.47Å; F337-T341 HydrophobicContact CZ-CG2 4.23Å; F337-T341 WeakPolarHBondContact O-CB 3.35Å; F337-T341 WeakPolarHBondContact O-CG2 3.13Å; F337-T341 PolarHBondContact O-N 2.82Å; F337-T341 PolarHBondContact O-OG1 3.47Å; F337-F424 HydrophobicContact CE2-CE2 4.33Å; F337-F424 HydrophobicContact CE2-CZ 4.08Å
338A90.7Very high88.9Confident0 Ų036 Ų360%018%0.176CC..Hα-helixtrans-63.2-39.6171.700000111.9A258 L259 A334 T341 A342A258-A338 HydrophobicContact CB-CB 3.9Å; L259-A338 HydrophobicContact CD2-CB 3.52Å; L259-A338 HydrophobicContact CG-CB 3.75Å; A334-A338 WeakPolarHBondContact O-CB 3.5Å; A334-A338 PolarHBondContact O-N 3.37Å; A338-T341 WeakPolarHBondContact CA-OG1 3.42Å; A338-T341 PolarHBondContact O-OG1 3.28Å; A338-A342 WeakPolarHBondContact O-CB 3.39Å; A338-A342 PolarHBondContact O-N 2.93Å
339G90.6Very high89.9Confident6 Ų636.5 Ų36.56%0.06218%0.182CC..Hα-helixtrans-64.1-44.4174.200000112.8D335 L336 F337 A342 N343D335-G339 PolarHBondContact O-N 3.45Å; L336-G339 PolarHBondContact O-N 3.15Å; F337-G339 VanDerWaalsContact C-N 3.34Å; G339-A342 PolarHBondContact O-N 3.26Å; G339-N343 PolarHBondContact O-N 3.15Å; G339-N343 PolarHBondContact O-ND2 3.46Å
340M91Very high90.7Very high18 Ų1836.2 Ų36.29%0.08918%0.182CC..Hα-helixtrans-64.2-48177.6-177.4-178.466.300111.7L336 F337 A342 N343 F344 Y416 Q419 A420 I423L336-M340 WeakPolarHBondContact O-CB 3.29Å; L336-M340 PolarHBondContact O-N 3.39Å; F337-M340 HydrophobicContact CD2-CE 3.64Å; F337-M340 HydrophobicContact CE2-CE 3.53Å; F337-M340 HydrophobicContact CG-CE 4.35Å; F337-M340 HydrophobicContact CZ-CE 4.15Å; F337-M340 PolarHBondContact O-N 2.98Å; M340-A342 VanDerWaalsContact C-N 3.32Å; M340-A342 PolarHBondContact O-N 2.95Å; M340-N343 PolarHBondContact O-N 2.75Å; M340-F344 PolarHBondContact O-N 3.25Å; M340-Y416 HydrophobicContact CG-CD1 3.83Å; M340-Y416 HydrophobicContact CG-CE1 4.15Å; M340-Q419 HydrophobicContact SD-CB 3.99Å; M340-A420 HydrophobicContact CE-CB 3.76Å; M340-A420 HydrophobicContact SD-CB 4.05Å; M340-I423 HydrophobicContact CB-CD1 4.47Å; M340-I423 HydrophobicContact CE-CD1 4.34Å; M340-I423 HydrophobicContact SD-CD1 3.76Å
341T93Very high91.5Very high35 Ų3534.3 Ų34.322%0.21517%0.172CC..Hα-helixtrans-62.7-39.2177.648.30000111.8A258 F337 A338 F344 V345A258-T341 WeakPolarHBondContact CB-OG1 3.25Å; F337-T341 HydrophobicContact CD1-CG2 3.8Å; F337-T341 HydrophobicContact CE1-CG2 3.47Å; F337-T341 VanDerWaalsContact CE1-CG2 3.47Å; F337-T341 HydrophobicContact CZ-CG2 4.23Å; F337-T341 WeakPolarHBondContact O-CB 3.35Å; F337-T341 WeakPolarHBondContact O-CG2 3.13Å; F337-T341 PolarHBondContact O-N 2.82Å; F337-T341 PolarHBondContact O-OG1 3.47Å; A338-T341 WeakPolarHBondContact CA-OG1 3.42Å; A338-T341 PolarHBondContact O-OG1 3.28Å; T341-F344 PolarHBondContact O-N 2.94Å; T341-V345 VanDerWaalsContact O-CG2 3.29Å; T341-V345 WeakPolarHBondContact O-CG2 3.37Å; T341-V345 PolarHBondContact O-N 3.18Å
342A94.8Very high92.2Very high0 Ų030.8 Ų30.80%016%0.162CC..Hα-helixtrans-63.7-41.7174.700000113.2R251 A254 S255 A338 G339 M340 A346R251-A342 HydrophobicContact CG-CB 4.3Å; A254-A342 HydrophobicContact CB-CB 3.91Å; S255-A342 VanDerWaalsContact N-CB 3.31Å; A338-A342 WeakPolarHBondContact O-CB 3.39Å; A338-A342 PolarHBondContact O-N 2.93Å; G339-A342 PolarHBondContact O-N 3.26Å; M340-A342 VanDerWaalsContact C-N 3.32Å; M340-A342 PolarHBondContact O-N 2.95Å; A342-A346 WeakPolarHBondContact O-CB 3.29Å; A342-A346 PolarHBondContact O-N 3.39Å
343N94.3Very high92.9Very high17 Ų1727.4 Ų27.49%0.09115%0.152CC..Hα-helixtrans-63.1-45.4174.4-80.5-35.8000111.4R251 G339 M340 V345 A346 D347 Y416R251-N343 WeakPolarHBondContact CD-OD1 3.31Å; R251-N343 PolarHBondContact NE-OD1 3.2Å; R251-N343 PolarHBondContact NH1-OD1 3.01Å; G339-N343 PolarHBondContact O-N 3.15Å; G339-N343 PolarHBondContact O-ND2 3.46Å; M340-N343 PolarHBondContact O-N 2.75Å; N343-V345 PolarHBondContact O-N 3.36Å; N343-A346 PolarHBondContact O-N 3.48Å; N343-D347 PolarHBondContact O-N 3.37Å; N343-Y416 HydrophobicContact CB-CE1 4.11Å; N343-Y416 WeakPolarHBondContact CB-OH 3.4Å; N343-Y416 PolarHBondContact O-OH 3.46Å
344F95.5Very high93.4Very high73 Ų7327.6 Ų27.632%0.3215%0.154SC..Hα-helixtrans-58.6-48.1177.5175.7-112.3000111.7M340 T341 A346 D347 V348 L412 Y416M340-F344 PolarHBondContact O-N 3.25Å; T341-F344 PolarHBondContact O-N 2.94Å; F344-A346 VanDerWaalsContact C-N 3.31Å; F344-A346 PolarHBondContact O-N 3.47Å; F344-D347 PolarHBondContact O-N 3.45Å; F344-V348 HydrophobicContact CD1-CG2 4.44Å; F344-V348 HydrophobicContact CD2-CG2 4.06Å; F344-V348 HydrophobicContact CE1-CG2 4.08Å; F344-V348 HydrophobicContact CE2-CG2 3.68Å; F344-V348 HydrophobicContact CG-CG2 4.45Å; F344-V348 HydrophobicContact CZ-CG2 3.7Å; F344-V348 VanDerWaalsContact O-CG2 3.27Å; F344-V348 WeakPolarHBondContact O-CG2 3.31Å; F344-V348 PolarHBondContact O-N 2.93Å; F344-L412 HydrophobicContact CE2-CD2 4.45Å; F344-Y416 VanDerWaalsContact CA-CZ 3.46Å; F344-Y416 HydrophobicContact CB-CD1 3.83Å; F344-Y416 HydrophobicContact CB-CD2 4.26Å; F344-Y416 HydrophobicContact CB-CE1 3.72Å; F344-Y416 HydrophobicContact CB-CE2 4.15Å; F344-Y416 HydrophobicContact CB-CG 4.09Å; F344-Y416 HydrophobicContact CD2-CD1 4.34Å; F344-Y416 AromaticContact CD2-CD2 3.44Å; F344-Y416 HydrophobicContact CD2-CD2 3.44Å; F344-Y416 VanDerWaalsContact CD2-CD2 3.44Å; F344-Y416 AromaticContact CD2-CE2 3.83Å; F344-Y416 HydrophobicContact CD2-CE2 3.83Å; F344-Y416 AromaticContact CD2-CG 3.71Å; F344-Y416 HydrophobicContact CD2-CG 3.71Å; F344-Y416 HydrophobicContact CE2-CD2 4.25Å; F344-Y416 HydrophobicContact CG-CD1 4.48Å; F344-Y416 HydrophobicContact CG-CD2 4.3Å; F344-Y416 HydrophobicContact CG-CG 4.27Å; F344-Y416 PolarHBondContact N-OH 3.15Å
345V96.7Very high93.9Very high65 Ų6527.2 Ų27.239%0.39415%0.151SC..Hα-helixtrans-59.8-43.4177.1171.70000110.9V250 A254 T341 N343 V348 V349V250-V345 HydrophobicContact CG1-CG1 4.47Å; A254-V345 HydrophobicContact CB-CB 4.12Å; A254-V345 HydrophobicContact CB-CG1 4.04Å; T341-V345 VanDerWaalsContact O-CG2 3.29Å; T341-V345 WeakPolarHBondContact O-CG2 3.37Å; T341-V345 PolarHBondContact O-N 3.18Å; N343-V345 PolarHBondContact O-N 3.36Å; V345-V348 PolarHBondContact O-N 3.42Å; V345-V349 HydrophobicContact CG1-CG2 4.3Å; V345-V349 WeakPolarHBondContact O-CB 3.38Å; V345-V349 VanDerWaalsContact O-CG2 3.23Å; V345-V349 WeakPolarHBondContact O-CG2 3.44Å; V345-V349 PolarHBondContact O-N 2.95Å
346A97.1Very high94.4Very high0 Ų026.1 Ų26.10%015%0.145CC..Hα-helixtrans-61.4-45.8177.300000112.3V250 R251 A342 N343 F344 V348 V349 L350V250-A346 HydrophobicContact CB-CB 4.22Å; V250-A346 HydrophobicContact CG1-CB 4.03Å; R251-A346 HydrophobicContact CB-CB 4.01Å; A342-A346 WeakPolarHBondContact O-CB 3.29Å; A342-A346 PolarHBondContact O-N 3.39Å; N343-A346 PolarHBondContact O-N 3.48Å; F344-A346 VanDerWaalsContact C-N 3.31Å; F344-A346 PolarHBondContact O-N 3.47Å; A346-V348 PolarHBondContact O-N 3.37Å; A346-V349 PolarHBondContact O-N 3.36Å; A346-L350 WeakPolarHBondContact O-CB 3.27Å; A346-L350 PolarHBondContact O-N 2.89Å
347D96.5Very high94.8Very high19 Ų1924.2 Ų24.210%0.10214%0.135CC..Hα-helixtrans-63.2-41.5177.6-72.4-17.7000112.1H247 N343 F344 Y351 L412 Y416H247-D347 IonicContact CD2-OD1 3.88Å; H247-D347 PolarHBondContact CD2-OD1 3.3Å; H247-D347 IonicContact CE1-OD1 3.55Å; H247-D347 IonicContact NE2-OD1 2.65Å; H247-D347 PolarHBondContact NE2-OD1 3.15Å; N343-D347 PolarHBondContact O-N 3.37Å; F344-D347 PolarHBondContact O-N 3.45Å; D347-Y351 WeakPolarHBondContact O-CA 3.49Å; D347-Y351 VanDerWaalsContact O-CB 3.3Å; D347-Y351 WeakPolarHBondContact O-CB 3.37Å; D347-Y351 PolarHBondContact O-N 3.39Å; D347-L412 HydrophobicContact CB-CD1 3.86Å; D347-L412 HydrophobicContact CB-CD2 4.12Å; D347-Y416 VanDerWaalsContact OD2-CE2 3.3Å; D347-Y416 WeakPolarHBondContact OD2-CE2 3.42Å; D347-Y416 PolarHBondContact OD2-OH 3.36Å
348V96.8Very high95.1Very high44 Ų4422.8 Ų22.827%0.26713%0.129SC..Hα-helixtrans-65.2-45.6179.1171.90000111.3F344 V345 A346 F409 L412F344-V348 HydrophobicContact CD1-CG2 4.44Å; F344-V348 HydrophobicContact CD2-CG2 4.06Å; F344-V348 HydrophobicContact CE1-CG2 4.08Å; F344-V348 HydrophobicContact CE2-CG2 3.68Å; F344-V348 HydrophobicContact CG-CG2 4.45Å; F344-V348 HydrophobicContact CZ-CG2 3.7Å; F344-V348 VanDerWaalsContact O-CG2 3.27Å; F344-V348 WeakPolarHBondContact O-CG2 3.31Å; F344-V348 PolarHBondContact O-N 2.93Å; V345-V348 PolarHBondContact O-N 3.42Å; A346-V348 PolarHBondContact O-N 3.37Å; V348-F409 HydrophobicContact CG1-CZ 4.49Å; V348-F409 HydrophobicContact CG2-CE2 4.05Å; V348-F409 HydrophobicContact CG2-CZ 3.96Å; V348-L412 HydrophobicContact CG2-CD2 4.01Å
349V96.8Very high95.3Very high87 Ų8723 Ų2353%0.52713%0.13SC..Hα-helixtrans-67.7-37.8-178.5176.80000111.1V250 V345 A346V250-V349 HydrophobicContact CG1-CB 4.42Å; V345-V349 HydrophobicContact CG1-CG2 4.3Å; V345-V349 WeakPolarHBondContact O-CB 3.38Å; V345-V349 VanDerWaalsContact O-CG2 3.23Å; V345-V349 WeakPolarHBondContact O-CG2 3.44Å; V345-V349 PolarHBondContact O-N 2.95Å; A346-V349 PolarHBondContact O-N 3.36Å
350L96.8Very high95.4Very high19 Ų1922.9 Ų22.910%0.09913%0.128CC..Hα-helixtrans-94.30.5-178.2-88.757.8000114.4L243 G246 H247 V250 A346 P352 V353 E354L243-L350 HydrophobicContact CD1-CB 4.17Å; L243-L350 HydrophobicContact CD1-CD2 4.31Å; L243-L350 WeakPolarHBondContact O-CD2 3.41Å; G246-L350 VanDerWaalsContact C-CD2 3.47Å; H247-L350 VanDerWaalsContact CA-CD2 3.43Å; H247-L350 HydrophobicContact CB-CD2 3.75Å; V250-L350 HydrophobicContact CG2-CD1 3.95Å; A346-L350 WeakPolarHBondContact O-CB 3.27Å; A346-L350 PolarHBondContact O-N 2.89Å; L350-P352 VanDerWaalsContact C-CD 3.43Å; L350-P352 VanDerWaalsContact C-N 3.33Å; L350-V353 WeakPolarHBondContact O-CB 3.31Å; L350-V353 PolarHBondContact O-N 2.85Å; L350-E354 PolarHBondContact O-N 2.99Å
351Y96.6Very high95.4Very high0 Ų022 Ų220%012%0.123CC..Hα-helixtrans-50.8-43.6-179.2-158.1-83.1000114.1R75 Q79 D347 V353 E354 T355 L405 F406 K407 G408 F409 L412R75-Y351 HydrophobicContact CG-CE2 4.25Å; R75-Y351 WeakPolarHBondContact CG-OH 3.03Å; Q79-Y351 HydrophobicContact CG-CE1 4.33Å; Q79-Y351 VanDerWaalsContact NE2-CE1 3.27Å; Q79-Y351 PolarHBondContact NE2-OH 3.2Å; D347-Y351 WeakPolarHBondContact O-CA 3.49Å; D347-Y351 VanDerWaalsContact O-CB 3.3Å; D347-Y351 WeakPolarHBondContact O-CB 3.37Å; D347-Y351 PolarHBondContact O-N 3.39Å; Y351-V353 VanDerWaalsContact C-N 3.34Å; Y351-V353 PolarHBondContact O-N 3.46Å; Y351-E354 PolarHBondContact O-N 3.26Å; Y351-T355 PolarHBondContact O-N 3.25Å; Y351-T355 PolarHBondContact O-OG1 3.06Å; Y351-L405 WeakPolarHBondContact CD1-O 3.38Å; Y351-L405 VanDerWaalsContact CE1-O 3.24Å; Y351-L405 WeakPolarHBondContact CE1-O 3.19Å; Y351-F406 AromaticContact CD1-CD1 3.74Å; Y351-F406 HydrophobicContact CD1-CD1 3.74Å; Y351-F406 HydrophobicContact CD1-CE1 4.23Å; Y351-F406 HydrophobicContact CD1-CG 4.24Å; Y351-F406 HydrophobicContact CE1-CB 4.5Å; Y351-F406 HydrophobicContact CE1-CD1 4.39Å; Y351-F406 HydrophobicContact CG-CD1 4.09Å; Y351-F406 HydrophobicContact CG-CE1 4.25Å; Y351-K407 PolarHBondContact OH-O 3.41Å; Y351-G408 PolarHBondContact OH-O 2.99Å; Y351-F409 HydrophobicContact CD1-CD2 4.49Å; Y351-F409 AromaticContact CD2-CD2 3.85Å; Y351-F409 HydrophobicContact CD2-CD2 3.85Å; Y351-F409 HydrophobicContact CD2-CE2 4.26Å; Y351-F409 HydrophobicContact CE1-CD2 4.48Å; Y351-F409 AromaticContact CE2-CD2 3.77Å; Y351-F409 HydrophobicContact CE2-CD2 3.77Å; Y351-F409 HydrophobicContact CG-CD2 4.19Å; Y351-F409 WeakPolarHBondContact OH-CA 3.44Å; Y351-F409 PolarHBondContact OH-N 2.9Å; Y351-F409 VanDerWaalsContact OH-N 3.11Å; Y351-L412 HydrophobicContact CD2-CD2 3.92Å; Y351-L412 HydrophobicContact CE2-CB 4.27Å; Y351-L412 HydrophobicContact CE2-CD2 4.1Å
352P95.9Very high95.2Very high27 Ų2720.3 Ų20.318%0.17511%0.113CC..Hα-helixtrans-66.2-37.2178.3-2134.9000112.6L350 T355 L356 L405 F406L350-P352 VanDerWaalsContact C-CD 3.43Å; L350-P352 VanDerWaalsContact C-N 3.33Å; P352-T355 PolarHBondContact O-N 2.98Å; P352-L356 VanDerWaalsContact O-CG 3.31Å; P352-L356 WeakPolarHBondContact O-CG 3.37Å; P352-L356 PolarHBondContact O-N 3.35Å; P352-L356 VanDerWaalsContact O-N 3.16Å; P352-L405 HydrophobicContact CB-CB 4.1Å; P352-L405 HydrophobicContact CB-CD1 3.86Å; P352-F406 HydrophobicContact CG-CE1 4.41Å; P352-F406 HydrophobicContact CG-CE2 3.8Å; P352-F406 HydrophobicContact CG-CZ 3.63Å
353V96.4Very high95Very high31 Ų3120.7 Ų20.719%0.18812%0.115CC..Hα-helixtrans-69.5-42.1178.3-177.70000110.1L242 L243 L350 Y351 T355 L356 V357 F388L242-V353 HydrophobicContact CD2-CG1 4.47Å; L243-V353 HydrophobicContact CB-CG1 4.14Å; L243-V353 HydrophobicContact CD1-CB 4.42Å; L243-V353 HydrophobicContact CD1-CG1 4.29Å; L350-V353 WeakPolarHBondContact O-CB 3.31Å; L350-V353 PolarHBondContact O-N 2.85Å; Y351-V353 VanDerWaalsContact C-N 3.34Å; Y351-V353 PolarHBondContact O-N 3.46Å; V353-T355 VanDerWaalsContact C-N 3.34Å; V353-T355 PolarHBondContact O-N 2.96Å; V353-L356 PolarHBondContact O-N 3.3Å; V353-V357 HydrophobicContact CG1-CG2 4.34Å; V353-V357 WeakPolarHBondContact O-CB 3.38Å; V353-V357 VanDerWaalsContact O-CG2 3.31Å; V353-V357 WeakPolarHBondContact O-CG2 3.26Å; V353-V357 PolarHBondContact O-N 2.9Å; V353-F388 HydrophobicContact CG1-CE2 4.25Å; V353-F388 HydrophobicContact CG1-CZ 4.38Å
354E96.2Very high94.4Very high28 Ų2820.5 Ų20.513%0.13112%0.117CC..Hα-helixtrans-55.3-50.4174.3-177.5178.7-137.300110.7R75 Q79 L243 L350 Y351 L356 V357 L358R75-E354 VanDerWaalsContact CZ-CD 3.47Å; R75-E354 IonicContact CZ-OE1 3.86Å; R75-E354 IonicContact CZ-OE2 3.59Å; R75-E354 IonicContact NE-OE1 2.76Å; R75-E354 IonicContact NE-OE2 3.98Å; R75-E354 IonicContact NH1-OE1 2.65Å; R75-E354 PolarHBondContact NH1-OE1 2.86Å; R75-E354 IonicContact NH1-OE2 3.7Å; R75-E354 PolarHBondContact NH1-OE2 3.39Å; R75-E354 IonicContact NH2-OE1 3.42Å; R75-E354 PolarHBondContact NH2-OE1 3.39Å; R75-E354 IonicContact NH2-OE2 2.87Å; Q79-E354 PolarHBondContact NE2-OE2 3.42Å; L243-E354 HydrophobicContact CD1-CB 3.88Å; L243-E354 HydrophobicContact CD2-CB 4.42Å; L350-E354 PolarHBondContact O-N 2.99Å; Y351-E354 PolarHBondContact O-N 3.26Å; E354-L356 VanDerWaalsContact C-N 3.33Å; E354-L356 PolarHBondContact O-N 3.33Å; E354-V357 PolarHBondContact O-N 2.76Å; E354-L358 HydrophobicContact CG-CD1 4.02Å; E354-L358 HydrophobicContact CG-CG 4.44Å; E354-L358 VanDerWaalsContact O-CG 3.29Å; E354-L358 WeakPolarHBondContact O-CG 3.41Å; E354-L358 PolarHBondContact O-N 3.28Å
355T95.7Very high93.7Very high0 Ų018.5 Ų18.50%011%0.11CC..Hα-helixtrans-58.9-43179.7-60.50000112.4Q79 Y351 P352 V353 R359 L405Q79-T355 HydrophobicContact CB-CG2 4.01Å; Q79-T355 HydrophobicContact CG-CG2 4.23Å; Q79-T355 WeakPolarHBondContact CG-OG1 3.32Å; Q79-T355 PolarHBondContact NE2-OG1 3.43Å; Q79-T355 VanDerWaalsContact NE2-OG1 3.15Å; Y351-T355 PolarHBondContact O-N 3.25Å; Y351-T355 PolarHBondContact O-OG1 3.06Å; P352-T355 PolarHBondContact O-N 2.98Å; V353-T355 VanDerWaalsContact C-N 3.34Å; V353-T355 PolarHBondContact O-N 2.96Å; T355-R359 WeakPolarHBondContact O-CG 3.44Å; T355-R359 PolarHBondContact O-N 3.09Å; T355-R359 VanDerWaalsContact O-N 3.15Å; T355-L405 HydrophobicContact CG2-CD2 3.97Å; T355-L405 PolarHBondContact OG1-O 3.04Å
356L95.5Very high92.9Very high3 Ų323.4 Ų23.42%0.01612%0.122CC..Hα-helixtrans-66.9-42.7177.4-69.5169000112.1P352 V353 E354 R359 L360 F388 A391 L392 L405P352-L356 VanDerWaalsContact O-CG 3.31Å; P352-L356 WeakPolarHBondContact O-CG 3.37Å; P352-L356 PolarHBondContact O-N 3.35Å; P352-L356 VanDerWaalsContact O-N 3.16Å; V353-L356 PolarHBondContact O-N 3.3Å; E354-L356 VanDerWaalsContact C-N 3.33Å; E354-L356 PolarHBondContact O-N 3.33Å; L356-R359 PolarHBondContact O-N 3.47Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.5Å; L356-L360 PolarHBondContact O-N 2.92Å; L356-F388 HydrophobicContact CB-CD2 4.08Å; L356-F388 HydrophobicContact CB-CE2 3.61Å; L356-F388 HydrophobicContact CB-CZ 4.43Å; L356-F388 HydrophobicContact CD1-CD2 4.46Å; L356-F388 HydrophobicContact CD1-CE1 4.41Å; L356-F388 HydrophobicContact CD1-CE2 3.67Å; L356-F388 HydrophobicContact CD1-CZ 3.63Å; L356-F388 HydrophobicContact CG-CE2 4.3Å; L356-A391 HydrophobicContact CD2-CB 3.93Å; L356-L392 HydrophobicContact CD1-CB 4.06Å; L356-L392 HydrophobicContact CD1-CD1 3.86Å; L356-L392 HydrophobicContact CD1-CG 4.49Å; L356-L405 HydrophobicContact CD1-CD1 4.5Å; L356-L405 HydrophobicContact CD2-CD2 3.83Å; L356-L405 HydrophobicContact CG-CD2 3.95Å
357V95.5Very high92.3Very high0 Ų023.7 Ų23.70%012%0.124CC..Hα-helixtrans-60.8-45.8176.41680000110.9F168 P239 V240 L243 V353 E354 R359 L360 C361F168-V357 HydrophobicContact CE1-CG1 4.15Å; P239-V357 HydrophobicContact CB-CG2 3.84Å; P239-V357 WeakPolarHBondContact O-CG2 3.37Å; V240-V357 HydrophobicContact CG2-CG1 3.78Å; L243-V357 HydrophobicContact CB-CG2 4.21Å; L243-V357 HydrophobicContact CD2-CB 4.04Å; L243-V357 HydrophobicContact CD2-CG1 3.99Å; L243-V357 HydrophobicContact CD2-CG2 4.11Å; V353-V357 HydrophobicContact CG1-CG2 4.34Å; V353-V357 WeakPolarHBondContact O-CB 3.38Å; V353-V357 VanDerWaalsContact O-CG2 3.31Å; V353-V357 WeakPolarHBondContact O-CG2 3.26Å; V353-V357 PolarHBondContact O-N 2.9Å; E354-V357 PolarHBondContact O-N 2.76Å; V357-R359 VanDerWaalsContact C-N 3.34Å; V357-R359 PolarHBondContact O-N 2.97Å; V357-L360 PolarHBondContact O-N 2.94Å; V357-C361 WeakPolarHBondContact O-CB 3.38Å; V357-C361 PolarHBondContact O-N 2.88Å; V357-C361 PolarHBondContact O-SG 3.08Å; V357-C361 VanDerWaalsContact O-SG 3.38Å
358L95Very high92Very high6 Ų625.6 Ų25.63%0.03113%0.134CC..Hα-helixtrans-58.1-46.7178.2-71.7170.3000111.4N76 Q79 V80 I172 E354 L360 C361 V362N76-L358 HydrophobicContact CB-CD1 4.36Å; Q79-L358 HydrophobicContact CB-CD1 3.97Å; Q79-L358 HydrophobicContact CG-CD1 4.46Å; V80-L358 HydrophobicContact CG2-CB 4.18Å; I172-L358 HydrophobicContact CB-CD2 4.39Å; I172-L358 HydrophobicContact CD1-CD2 3.85Å; I172-L358 HydrophobicContact CG1-CD2 3.91Å; I172-L358 HydrophobicContact CG2-CD2 3.53Å; E354-L358 HydrophobicContact CG-CD1 4.02Å; E354-L358 HydrophobicContact CG-CG 4.44Å; E354-L358 VanDerWaalsContact O-CG 3.29Å; E354-L358 WeakPolarHBondContact O-CG 3.41Å; E354-L358 PolarHBondContact O-N 3.28Å; L358-L360 VanDerWaalsContact C-N 3.33Å; L358-L360 PolarHBondContact O-N 3.21Å; L358-C361 PolarHBondContact O-N 3.02Å; L358-V362 WeakPolarHBondContact O-CB 3.28Å; L358-V362 WeakPolarHBondContact O-CG2 3.14Å; L358-V362 PolarHBondContact O-N 3.45Å
359R94.1Very high91.7Very high5 Ų523.6 Ų23.62%0.01912%0.122CC..Hα-helixtrans-60-41.3176.6-72.8179.2-172173.75.9112.5Q79 T355 L356 V357 Q363 Y385 S395 G404Q79-R359 PolarHBondContact O-NE 2.78Å; Q79-R359 PolarHBondContact O-NH2 3.45Å; T355-R359 WeakPolarHBondContact O-CG 3.44Å; T355-R359 PolarHBondContact O-N 3.09Å; T355-R359 VanDerWaalsContact O-N 3.15Å; L356-R359 PolarHBondContact O-N 3.47Å; V357-R359 VanDerWaalsContact C-N 3.34Å; V357-R359 PolarHBondContact O-N 2.97Å; R359-Q363 WeakPolarHBondContact O-CB 3.29Å; R359-Q363 PolarHBondContact O-N 3.46Å; R359-Q363 VanDerWaalsContact O-N 3.12Å; R359-Y385 HydrophobicContact CB-CE2 3.93Å; R359-S395 PolarHBondContact NH1-OG 3.42Å; R359-G404 PolarHBondContact NH2-O 3.39Å
360L92.9Very high91.5Very high3 Ų319.8 Ų19.82%0.01610%0.098CC..Hα-helixtrans-69.5-42.1178-67.8168.4000113.1L231 L236 P239 L356 V357 L358 V362 Y385 F388 A391L231-L360 HydrophobicContact CD1-CD2 4.28Å; L231-L360 HydrophobicContact CD2-CD2 3.93Å; L236-L360 HydrophobicContact CD2-CB 3.76Å; P239-L360 HydrophobicContact CB-CD1 4.45Å; P239-L360 HydrophobicContact CG-CD1 4.14Å; L356-L360 VanDerWaalsContact O-CG 3.27Å; L356-L360 WeakPolarHBondContact O-CG 3.5Å; L356-L360 PolarHBondContact O-N 2.92Å; V357-L360 PolarHBondContact O-N 2.94Å; L358-L360 VanDerWaalsContact C-N 3.33Å; L358-L360 PolarHBondContact O-N 3.21Å; L360-V362 VanDerWaalsContact C-N 3.25Å; L360-V362 PolarHBondContact O-N 3.33Å; L360-Y385 HydrophobicContact CD2-CD2 4.24Å; L360-F388 HydrophobicContact CD1-CB 4.03Å; L360-F388 HydrophobicContact CD1-CD2 3.96Å; L360-A391 HydrophobicContact CD2-CB 4.13Å; L360-A391 HydrophobicContact CG-CB 4.46Å
361C91.5Very high91.2Very high0 Ų019.9 Ų19.90%010%0.099CC..Hα-helixtrans-64-34.1-179-76.90000112.5S169 I172 R197 V357 L358S169-C361 PolarHBondContact OG-O 3.41Å; I172-C361 HydrophobicContact CB-CB 4.45Å; I172-C361 HydrophobicContact CD1-CB 3.88Å; I172-C361 HydrophobicContact CG2-CB 4.33Å; R197-C361 PolarHBondContact NH1-O 3.44Å; R197-C361 PolarHBondContact NH2-O 2.92Å; R197-C361 VanDerWaalsContact NH2-O 3.13Å; V357-C361 WeakPolarHBondContact O-CB 3.38Å; V357-C361 PolarHBondContact O-N 2.88Å; V357-C361 PolarHBondContact O-SG 3.08Å; V357-C361 VanDerWaalsContact O-SG 3.38Å; L358-C361 PolarHBondContact O-N 3.02Å
362V89.8Confident91Very high0 Ų020 Ų200%010%0.1CC..Hα-helixtrans-91.5-27.9-173176.80000112.8V80 I172 V173 I176 L358 L360 G364 T365 T367 I381V80-V362 HydrophobicContact CG1-CG1 4.17Å; V80-V362 HydrophobicContact CG2-CG2 4.31Å; I172-V362 HydrophobicContact CG2-CG2 3.51Å; V173-V362 HydrophobicContact CG2-CG2 4.27Å; I176-V362 HydrophobicContact CD1-CB 4.06Å; I176-V362 HydrophobicContact CD1-CG1 3.3Å; I176-V362 HydrophobicContact CD1-CG2 3.49Å; I176-V362 VanDerWaalsContact CD1-CG2 3.49Å; I176-V362 HydrophobicContact CG1-CG1 4.49Å; I176-V362 HydrophobicContact CG1-CG2 3.89Å; L358-V362 WeakPolarHBondContact O-CB 3.28Å; L358-V362 WeakPolarHBondContact O-CG2 3.14Å; L358-V362 PolarHBondContact O-N 3.45Å; L360-V362 VanDerWaalsContact C-N 3.25Å; L360-V362 PolarHBondContact O-N 3.33Å; V362-G364 PolarHBondContact O-N 2.93Å; V362-T365 WeakPolarHBondContact O-CB 3.5Å; V362-T365 WeakPolarHBondContact O-CG2 3.26Å; V362-T365 PolarHBondContact O-N 2.99Å; V362-T365 PolarHBondContact O-OG1 2.76Å; V362-T367 WeakPolarHBondContact CG1-OG1 3.14Å; V362-I381 HydrophobicContact CB-CD1 4.24Å; V362-I381 HydrophobicContact CG1-CD1 2.97Å; V362-I381 HydrophobicContact CG1-CG1 4.4Å
363Q89.5Confident90.8Very high8 Ų821.1 Ų21.14%0.03710%0.104CC..THydrogen-bonded Turntrans-48.5140.9178.3158.6175.5-27.300113R229 L230 L231 R359 T365 S383 Y385R229-Q363 WeakPolarHBondContact O-CG 3.46Å; R229-Q363 PolarHBondContact O-NE2 3.21Å; R229-Q363 VanDerWaalsContact O-NE2 3.07Å; L230-Q363 WeakPolarHBondContact CD1-O 3.29Å; L231-Q363 HydrophobicContact CD1-CB 4Å; L231-Q363 HydrophobicContact CD1-CG 3.7Å; R359-Q363 WeakPolarHBondContact O-CB 3.29Å; R359-Q363 PolarHBondContact O-N 3.46Å; R359-Q363 VanDerWaalsContact O-N 3.12Å; Q363-T365 PolarHBondContact O-N 3.24Å; Q363-S383 WeakPolarHBondContact CG-O 3.22Å; Q363-Y385 VanDerWaalsContact CD-N 3.35Å; Q363-Y385 PolarHBondContact NE2-O 3.38Å; Q363-Y385 VanDerWaalsContact OE1-CD2 3.27Å
364G81.2Confident90.5Very high13 Ų1322.6 Ų22.613%0.13411%0.113CC..THydrogen-bonded Turntrans77.1-2.1173.700000114.9T227 V362 R366T227-G364 WeakPolarHBondContact CB-O 3.46Å; T227-G364 PolarHBondContact OG1-O 3.31Å; T227-G364 VanDerWaalsContact OG1-O 3.09Å; V362-G364 PolarHBondContact O-N 2.93Å; G364-R366 VanDerWaalsContact C-N 3.33Å; G364-R366 PolarHBondContact O-N 3.19Å
365T81.1Confident90.1Very high30 Ų3021.5 Ų21.518%0.18411%0.109CC..SBendtrans-84.4-2.8-177.161.80000114.4V173 L230 V362 Q363 T367V173-T365 HydrophobicContact CG2-CG2 3.85Å; L230-T365 HydrophobicContact CD1-CG2 3.93Å; V362-T365 WeakPolarHBondContact O-CB 3.5Å; V362-T365 WeakPolarHBondContact O-CG2 3.26Å; V362-T365 PolarHBondContact O-N 2.99Å; V362-T365 PolarHBondContact O-OG1 2.76Å; Q363-T365 PolarHBondContact O-N 3.24Å; T365-T367 PolarHBondContact O-N 2.92Å; T365-T367 VanDerWaalsContact O-N 3.16Å; T365-T367 WeakPolarHBondContact OG1-CG2 3.02Å; T365-T367 PolarHBondContact OG1-OG1 2.89Å
366R80.9Confident89.6Confident168 Ų16825 Ų2563%0.63413%0.128SC*.  trans52.429.2-174.3-60.6-178178.2165.63.6113.5T227 G364T227-R366 HydrophobicContact CG2-CG 4.07Å; T227-R366 VanDerWaalsContact CG2-NE 3.34Å; G364-R366 VanDerWaalsContact C-N 3.33Å; G364-R366 PolarHBondContact O-N 3.19Å
367T84.7Confident89.2Confident7 Ų728.7 Ų28.74%0.04315%0.15CC..  trans-75.7141.6179.144.70000110.8V173 V362 T365 I381V173-T367 HydrophobicContact CG1-CG2 3.52Å; V362-T367 WeakPolarHBondContact CG1-OG1 3.14Å; T365-T367 PolarHBondContact O-N 2.92Å; T365-T367 VanDerWaalsContact O-N 3.16Å; T365-T367 WeakPolarHBondContact OG1-CG2 3.02Å; T365-T367 PolarHBondContact OG1-OG1 2.89Å; T367-I381 PolarHBondContact O-N 3.37Å; T367-I381 WeakPolarHBondContact OG1-CD1 3.39Å
368L89.1Confident89Confident59 Ų5930.7 Ų30.731%0.30916%0.162SC..EExtended strand (participates in β ladder)trans-99.1126172.3-64.7179.6000108.2S178 A181 V378 P380S178-L368 WeakPolarHBondContact CB-O 3.5Å; S178-L368 PolarHBondContact N-O 3.04Å; A181-L368 HydrophobicContact CB-CB 3.66Å; A181-L368 HydrophobicContact CB-CD1 3.58Å; A181-L368 HydrophobicContact CB-CG 4.09Å; L368-V378 HydrophobicContact CB-CB 4.32Å; L368-V378 HydrophobicContact CB-CG2 4.45Å; L368-V378 HydrophobicContact CD1-CG2 4.23Å; L368-P380 HydrophobicContact CD2-CB 3.71Å
369V90.9Very high88.8Confident2 Ų232 Ų321%0.01217%0.171CC..EExtended strand (participates in β ladder)trans-110.3151.5-175.21760000109.2V80 I176 V378 V379 I381V80-V369 HydrophobicContact CG1-CG2 4.33Å; I176-V369 HydrophobicContact CD1-CG2 3.8Å; V369-V378 CarbonylContact O-C 3.53Å; V369-V378 VanDerWaalsContact O-CA 3.29Å; V369-V378 WeakPolarHBondContact O-CA 3.49Å; V369-V379 PolarHBondContact N-O 2.92Å; V369-V379 PolarHBondContact O-N 3.3Å; V369-I381 HydrophobicContact CG2-CD1 3.48Å; V369-I381 VanDerWaalsContact CG2-CD1 3.48Å; V369-I381 HydrophobicContact CG2-CG1 3.74Å
370D91.7Very high88.6Confident7 Ų735.2 Ų35.24%0.03719%0.192CC..EExtended strand (participates in β ladder)trans-73.2130.2177.1-65.2-52.6000110.7Q105 F109 K112 S178 M372Q105-D370 VanDerWaalsContact NE2-CG 3.34Å; Q105-D370 PolarHBondContact NE2-OD1 2.88Å; Q105-D370 PolarHBondContact NE2-OD2 2.72Å; Q105-D370 PolarHBondContact OE1-OD2 3.07Å; F109-D370 HydrophobicContact CE2-CB 4.27Å; K112-D370 IonicContact NZ-OD2 3.81Å; K112-D370 PolarHBondContact NZ-OD2 3.33Å; S178-D370 VanDerWaalsContact CB-OD1 3.23Å; S178-D370 WeakPolarHBondContact CB-OD1 3.42Å; S178-D370 PolarHBondContact OG-OD1 3.26Å; D370-M372 PolarHBondContact O-N 3.45Å
371N92Very high88.4Confident21 Ų2136.4 Ų36.411%0.11220%0.198CC..  trans-75.2102-179.9-173.10.6000111D373 T374 G375 V377 V379N371-D373 PolarHBondContact O-N 2.84Å; N371-D373 WeakPolarHBondContact OD1-CB 3.48Å; N371-D373 PolarHBondContact OD1-N 2.88Å; N371-T374 PolarHBondContact O-N 3.19Å; N371-G375 WeakPolarHBondContact O-CA 3.21Å; N371-G375 PolarHBondContact O-N 3.48Å; N371-V377 WeakPolarHBondContact CB-O 3.39Å; N371-V377 PolarHBondContact N-O 3.34Å; N371-V379 HydrophobicContact CB-CG2 3.81Å
372M92Very high88.1Confident3 Ų341.3 Ų41.32%0.01523%0.228CC..THydrogen-bonded Turntrans-69.7-5.4177.3-64.9-61-60.900114.2I74 Q77 H88 L94 V97 V98 F109 D370I74-M372 HydrophobicContact CG2-CE 3.86Å; Q77-M372 HydrophobicContact CB-CG 3.74Å; Q77-M372 HydrophobicContact CB-SD 4.1Å; H88-M372 PolarHBondContact NE2-O 3.09Å; L94-M372 HydrophobicContact CD2-CE 3.88Å; V97-M372 HydrophobicContact CG1-CB 4.47Å; V97-M372 HydrophobicContact CG1-CE 3.94Å; V97-M372 WeakPolarHBondContact CG1-O 3.46Å; V97-M372 HydrophobicContact CG1-SD 4.26Å; V97-M372 WeakPolarHBondContact CG2-O 2.92Å; V98-M372 HydrophobicContact CG2-CE 4.15Å; F109-M372 HydrophobicContact CZ-SD 4.17Å; D370-M372 PolarHBondContact O-N 3.45Å
373D91.3Very high87.9Confident50 Ų5042.3 Ų42.327%0.26724%0.235SC..THydrogen-bonded Turntrans-81.2-34.9171.5-66.2-28.4000112.1S84 Q85 C86 N371S84-D373 WeakPolarHBondContact CA-OD2 3.42Å; S84-D373 WeakPolarHBondContact CB-OD1 3.34Å; S84-D373 WeakPolarHBondContact CB-OD2 3.47Å; S84-D373 PolarHBondContact OG-OD1 2.88Å; S84-D373 PolarHBondContact OG-OD2 3.43Å; Q85-D373 PolarHBondContact N-OD1 3.24Å; Q85-D373 PolarHBondContact N-OD2 3.2Å; C86-D373 WeakPolarHBondContact CB-OD1 3.49Å; C86-D373 PolarHBondContact N-OD1 2.95Å; N371-D373 PolarHBondContact O-N 2.84Å; N371-D373 WeakPolarHBondContact OD1-CB 3.48Å; N371-D373 PolarHBondContact OD1-N 2.88Å
374T90.3Very high87.8Confident62 Ų6245.6 Ų45.638%0.3826%0.259SS..THydrogen-bonded Turntrans-113.7-35.7-173-50.70000113.4K100 N371 D376K100-T374 WeakPolarHBondContact CD-O 3.42Å; N371-T374 PolarHBondContact O-N 3.19Å; T374-D376 HydrophobicContact CG2-CB 4.49Å
375G87Confident88.3Confident4 Ų445.4 Ų45.44%0.04125%0.254CS..SBendtrans86.5-9.1-178.800000116.1N371N371-G375 WeakPolarHBondContact O-CA 3.21Å; N371-G375 PolarHBondContact O-N 3.48Å
376D84.6Confident88.6Confident73 Ų7349.6 Ų49.639%0.3928%0.275SS..SBendtrans-114.6-21.7-169.9-59.3-37000114.1K100 K180 T374K100-D376 IonicContact NZ-OD2 2.78Å; K180-D376 PolarHBondContact NZ-O 2.88Å; T374-D376 HydrophobicContact CG2-CB 4.49Å
377V89.1Confident89.1Confident81 Ų8142.3 Ų42.349%0.49125%0.252SS..  trans-111.9150.1-172.2-178.10000110.8N371N371-V377 WeakPolarHBondContact CB-O 3.39Å; N371-V377 PolarHBondContact N-O 3.34Å
378V90.8Very high89.5Confident42 Ų4243.7 Ų43.726%0.25526%0.258SS..EExtended strand (participates in β ladder)trans-99.5141.3170.8-61.70000110.8S178 K180 L368 V369S178-V378 VanDerWaalsContact OG-CG1 3.3Å; S178-V378 WeakPolarHBondContact OG-CG1 3.43Å; K180-V378 HydrophobicContact CB-CG1 4.21Å; K180-V378 HydrophobicContact CD-CG1 4.13Å; L368-V378 HydrophobicContact CB-CB 4.32Å; L368-V378 HydrophobicContact CB-CG2 4.45Å; L368-V378 HydrophobicContact CD1-CG2 4.23Å; V369-V378 CarbonylContact O-C 3.53Å; V369-V378 VanDerWaalsContact O-CA 3.29Å; V369-V378 WeakPolarHBondContact O-CA 3.49Å
379V90.8Very high89.8Confident34 Ų3449 Ų4921%0.20628%0.279CS..EExtended strand (participates in β ladder)trans-121.8132.5-176.8174.40000109.6L81 V369 N371L81-V379 HydrophobicContact CD1-CG1 3.81Å; V369-V379 PolarHBondContact N-O 2.92Å; V369-V379 PolarHBondContact O-N 3.3Å; N371-V379 HydrophobicContact CB-CG2 3.81Å
380P90.4Very high89.9Confident72 Ų7251.7 Ų51.747%0.46829%0.293SS..EExtended strand (participates in β ladder)trans-74.5146.4173.830.8-34.5000111.3L368 V382L368-P380 HydrophobicContact CD2-CB 3.71Å; P380-V382 HydrophobicContact CG-CG2 4.37Å; P380-V382 PolarHBondContact O-N 3.12Å
381I87.7Confident90Very high29 Ų2951.3 Ų51.315%0.14929%0.291CS..  trans-83.7116.2174.7-59172.3000109.4V80 I176 V362 T367 V369 S383V80-I381 HydrophobicContact CG1-CD1 3.34Å; V80-I381 HydrophobicContact CG1-CG1 3.95Å; I176-I381 HydrophobicContact CD1-CD1 4.09Å; V362-I381 HydrophobicContact CB-CD1 4.24Å; V362-I381 HydrophobicContact CG1-CD1 2.97Å; V362-I381 HydrophobicContact CG1-CG1 4.4Å; T367-I381 PolarHBondContact O-N 3.37Å; T367-I381 WeakPolarHBondContact OG1-CD1 3.39Å; V369-I381 HydrophobicContact CG2-CD1 3.48Å; V369-I381 VanDerWaalsContact CG2-CD1 3.48Å; V369-I381 HydrophobicContact CG2-CG1 3.74Å; I381-S383 WeakPolarHBondContact CG2-OG 3.44Å
382V84.6Confident90.1Very high103 Ų10352.7 Ų52.762%0.62430%0.298SS*.  trans-106.60.1-175.7-1700000112.3P380P380-V382 HydrophobicContact CG-CG2 4.37Å; P380-V382 PolarHBondContact O-N 3.12Å
383S85.8Confident90.2Very high21 Ų2162 Ų6215%0.14733%0.333CS..  trans-66.6138.3-17859.70000112.9Q363 I381Q363-S383 WeakPolarHBondContact CG-O 3.22Å; I381-S383 WeakPolarHBondContact CG2-OG 3.44Å
384S87.7Confident90.3Very high76 Ų7661.8 Ų61.853%0.53134%0.336SS..  trans-138.599.8174.960.20000110.5
385Y90.9Very high90.3Very high10 Ų1058.9 Ų58.94%0.03932%0.318CS..  trans-105.4143.6175.1-47-68.6000110.1E82 R359 L360 Q363 G387 D390 A391E82-Y385 PolarHBondContact OE2-OH 3.5Å; R359-Y385 HydrophobicContact CB-CE2 3.93Å; L360-Y385 HydrophobicContact CD2-CD2 4.24Å; Q363-Y385 VanDerWaalsContact CD-N 3.35Å; Q363-Y385 PolarHBondContact NE2-O 3.38Å; Q363-Y385 VanDerWaalsContact OE1-CD2 3.27Å; Y385-G387 VanDerWaalsContact C-N 3.33Å; Y385-D390 WeakPolarHBondContact CA-OD2 3.3Å; Y385-A391 VanDerWaalsContact CD1-CA 3.45Å; Y385-A391 HydrophobicContact CD1-CB 3.78Å; Y385-A391 HydrophobicContact CD2-CB 3.89Å; Y385-A391 HydrophobicContact CE1-CB 4.22Å; Y385-A391 HydrophobicContact CE2-CB 4.31Å; Y385-A391 HydrophobicContact CG-CB 3.58Å
386D89Confident90.6Very high117 Ų11763 Ų6363%0.62634%0.339SS*.SBendtrans-75.9-25.8174.6-78.1-37.8000112.4R235 D390R235-D386 WeakPolarHBondContact CD-O 3.31Å; R235-D386 PolarHBondContact NH1-O 2.91Å; D386-D390 HydrophobicContact CB-CB 4.32Å; D386-D390 PolarHBondContact N-OD2 3.38Å
387G90.1Very high90.9Very high15 Ų1562.8 Ų62.816%0.15535%0.353CS..SBendtrans179.1-170.3178.600000112.5Y385 F389 D390 A391Y385-G387 VanDerWaalsContact C-N 3.33Å; G387-F389 PolarHBondContact O-N 3.26Å; G387-D390 PolarHBondContact O-N 3.43Å; G387-A391 PolarHBondContact O-N 3.21Å
388F93.7Very high90.9Very high37 Ų3760.2 Ų60.216%0.16234%0.339CS..Hα-helixtrans-61-45.9-175-178.7-94.3000114.1P239 V353 L356 L360 D390 A391 L392P239-F388 HydrophobicContact CB-CB 4.24Å; P239-F388 HydrophobicContact CB-CD2 3.5Å; P239-F388 HydrophobicContact CB-CE2 4.11Å; P239-F388 HydrophobicContact CB-CG 4.06Å; P239-F388 HydrophobicContact CG-CB 4.45Å; P239-F388 HydrophobicContact CG-CD2 4.43Å; V353-F388 HydrophobicContact CG1-CE2 4.25Å; V353-F388 HydrophobicContact CG1-CZ 4.38Å; L356-F388 HydrophobicContact CB-CD2 4.08Å; L356-F388 HydrophobicContact CB-CE2 3.61Å; L356-F388 HydrophobicContact CB-CZ 4.43Å; L356-F388 HydrophobicContact CD1-CD2 4.46Å; L356-F388 HydrophobicContact CD1-CE1 4.41Å; L356-F388 HydrophobicContact CD1-CE2 3.67Å; L356-F388 HydrophobicContact CD1-CZ 3.63Å; L356-F388 HydrophobicContact CG-CE2 4.3Å; L360-F388 HydrophobicContact CD1-CB 4.03Å; L360-F388 HydrophobicContact CD1-CD2 3.96Å; F388-D390 VanDerWaalsContact C-N 3.29Å; F388-D390 PolarHBondContact O-N 2.83Å; F388-A391 PolarHBondContact O-N 3.13Å; F388-L392 WeakPolarHBondContact O-CB 3.31Å; F388-L392 PolarHBondContact O-N 3.24Å
389F94.5Very high90.8Very high169 Ų16965 Ų6574%0.74137%0.371SS*.Hα-helixtrans-69-28.8-179.8-66.9-70.8000113G387 R393G387-F389 PolarHBondContact O-N 3.26Å; F389-R393 WeakPolarHBondContact O-CB 3.22Å; F389-R393 PolarHBondContact O-N 3.46Å
390D93.8Very high90.7Very high59 Ų5966.3 Ų66.332%0.31638%0.379SS..Hα-helixtrans-71.9-44.7174.1-17644.4000111Y385 D386 G387 F388 L392 R393 S394Y385-D390 WeakPolarHBondContact CA-OD2 3.3Å; D386-D390 HydrophobicContact CB-CB 4.32Å; D386-D390 PolarHBondContact N-OD2 3.38Å; G387-D390 PolarHBondContact O-N 3.43Å; F388-D390 VanDerWaalsContact C-N 3.29Å; F388-D390 PolarHBondContact O-N 2.83Å; D390-L392 VanDerWaalsContact C-N 3.3Å; D390-L392 PolarHBondContact O-N 3.38Å; D390-R393 PolarHBondContact O-N 3.21Å; D390-S394 WeakPolarHBondContact O-CB 3.29Å; D390-S394 PolarHBondContact O-N 3.05Å
391A92.9Very high90.6Very high0 Ų063.7 Ų63.70%037%0.365CS..Hα-helixtrans-59.1-40.8171.900000112.6L356 L360 Y385 G387 F388 S395L356-A391 HydrophobicContact CD2-CB 3.93Å; L360-A391 HydrophobicContact CD2-CB 4.13Å; L360-A391 HydrophobicContact CG-CB 4.46Å; Y385-A391 VanDerWaalsContact CD1-CA 3.45Å; Y385-A391 HydrophobicContact CD1-CB 3.78Å; Y385-A391 HydrophobicContact CD2-CB 3.89Å; Y385-A391 HydrophobicContact CE1-CB 4.22Å; Y385-A391 HydrophobicContact CE2-CB 4.31Å; Y385-A391 HydrophobicContact CG-CB 3.58Å; G387-A391 PolarHBondContact O-N 3.21Å; F388-A391 PolarHBondContact O-N 3.13Å; A391-S395 WeakPolarHBondContact O-CB 3.47Å; A391-S395 PolarHBondContact O-N 3.37Å; A391-S395 PolarHBondContact O-OG 2.89Å
392L94.8Very high90.8Very high50 Ų5067.2 Ų67.226%0.26238%0.383SS..Hα-helixtrans-64-46.3175177.461.2000111.2L356 F388 D390 S395 L396 L405L356-L392 HydrophobicContact CD1-CB 4.06Å; L356-L392 HydrophobicContact CD1-CD1 3.86Å; L356-L392 HydrophobicContact CD1-CG 4.49Å; F388-L392 WeakPolarHBondContact O-CB 3.31Å; F388-L392 PolarHBondContact O-N 3.24Å; D390-L392 VanDerWaalsContact C-N 3.3Å; D390-L392 PolarHBondContact O-N 3.38Å; L392-S395 PolarHBondContact O-N 3.37Å; L392-L396 HydrophobicContact CD1-CD1 3.81Å; L392-L396 HydrophobicContact CD1-CG 4.21Å; L392-L396 HydrophobicContact CG-CD1 3.76Å; L392-L396 WeakPolarHBondContact O-CB 3.4Å; L392-L396 WeakPolarHBondContact O-CD1 3.47Å; L392-L396 VanDerWaalsContact O-CG 3.29Å; L392-L396 WeakPolarHBondContact O-CG 3.44Å; L392-L396 PolarHBondContact O-N 3.48Å; L392-L405 HydrophobicContact CD1-CD1 4.39Å
393R94.6Very high91.1Very high197 Ų19766 Ų6674%0.74337%0.373SS*.Hα-helixtrans-61.7-45.3176.9175.2177.4-97.1-175.1-6.1111.8F389 D390 S395 L396 G397F389-R393 WeakPolarHBondContact O-CB 3.22Å; F389-R393 PolarHBondContact O-N 3.46Å; D390-R393 PolarHBondContact O-N 3.21Å; R393-S395 VanDerWaalsContact C-N 3.31Å; R393-S395 PolarHBondContact O-N 2.91Å; R393-L396 PolarHBondContact O-N 3.01Å; R393-G397 PolarHBondContact O-N 3.36Å
394S92.2Very high91.3Very high46 Ų4665.2 Ų65.232%0.32237%0.368SS..Hα-helixtrans-58-46.2175.7-174.20000111E82 D390 L396 G397 S398E82-S394 PolarHBondContact OE1-OG 3.26Å; D390-S394 WeakPolarHBondContact O-CB 3.29Å; D390-S394 PolarHBondContact O-N 3.05Å; S394-L396 PolarHBondContact O-N 3.44Å; S394-G397 PolarHBondContact O-N 2.95Å; S394-S398 PolarHBondContact O-N 3.33Å; S394-S398 VanDerWaalsContact O-N 3.08Å
395S91.6Very high91.6Very high2 Ų261.7 Ų61.71%0.01434%0.343CS..Hα-helixtrans-64.1-41.3179.9-57.90000112.3R359 A391 L392 R393 S398R359-S395 PolarHBondContact NH1-OG 3.42Å; A391-S395 WeakPolarHBondContact O-CB 3.47Å; A391-S395 PolarHBondContact O-N 3.37Å; A391-S395 PolarHBondContact O-OG 2.89Å; L392-S395 PolarHBondContact O-N 3.37Å; R393-S395 VanDerWaalsContact C-N 3.31Å; R393-S395 PolarHBondContact O-N 2.91Å; S395-S398 WeakPolarHBondContact O-CB 3.36Å; S395-S398 PolarHBondContact O-N 3.05Å; S395-S398 PolarHBondContact O-OG 2.85Å
396L92.4Very high91.8Very high91 Ų9163.6 Ų63.648%0.47635%0.352SS..Hα-helixtrans-68.8-31.5176.6-73.8160.5000112.9L392 R393 S394 I402L392-L396 HydrophobicContact CD1-CD1 3.81Å; L392-L396 HydrophobicContact CD1-CG 4.21Å; L392-L396 HydrophobicContact CG-CD1 3.76Å; L392-L396 WeakPolarHBondContact O-CB 3.4Å; L392-L396 WeakPolarHBondContact O-CD1 3.47Å; L392-L396 VanDerWaalsContact O-CG 3.29Å; L392-L396 WeakPolarHBondContact O-CG 3.44Å; L392-L396 PolarHBondContact O-N 3.48Å; R393-L396 PolarHBondContact O-N 3.01Å; S394-L396 PolarHBondContact O-N 3.44Å; L396-I402 HydrophobicContact CD2-CB 4.37Å
397G91.3Very high92Very high67 Ų6758.2 Ų58.269%0.69132%0.323SS*.Hα-helixtrans-82.2-11.4177.500000114.5R393 S394R393-G397 PolarHBondContact O-N 3.36Å; S394-G397 PolarHBondContact O-N 2.95Å
398S89.6Confident92.2Very high28 Ų2857.5 Ų57.520%0.19632%0.315CS..SBendtrans-63153175.677.60000111.2S394 S395 V400 G401S394-S398 PolarHBondContact O-N 3.33Å; S394-S398 VanDerWaalsContact O-N 3.08Å; S395-S398 WeakPolarHBondContact O-CB 3.36Å; S395-S398 PolarHBondContact O-N 3.05Å; S395-S398 PolarHBondContact O-OG 2.85Å; S398-V400 PolarHBondContact O-N 3.27Å; S398-V400 VanDerWaalsContact O-N 3.09Å; S398-G401 PolarHBondContact O-N 3.48Å; S398-G401 PolarHBondContact OG-N 2.92Å
399P87.9Confident92.3Very high142 Ų14257.5 Ų57.592%0.92232%0.315SS*.THydrogen-bonded Turntrans-61.1-21.4179.324.2-34.8000113.7
400V88.5Confident92.3Very high61 Ų6149.4 Ų49.437%0.3728%0.28SS..THydrogen-bonded Turntrans-82.8-23.7175.7-1720000111.3L87 S398 L403 G404L87-V400 HydrophobicContact CD1-CG1 3.97Å; L87-V400 HydrophobicContact CD2-CG1 3.77Å; L87-V400 HydrophobicContact CG-CG1 4.48Å; S398-V400 PolarHBondContact O-N 3.27Å; S398-V400 VanDerWaalsContact O-N 3.09Å; V400-L403 HydrophobicContact CG1-CB 4.07Å; V400-G404 VanDerWaalsContact CG1-N 3.31Å
401G89.5Confident92.4Very high17 Ų1746.7 Ų46.718%0.17527%0.266CS..G310 helixtrans62-144.6-174.200000112.6S398 L403 G404S398-G401 PolarHBondContact O-N 3.48Å; S398-G401 PolarHBondContact OG-N 2.92Å; G401-L403 PolarHBondContact O-N 3.38Å; G401-L403 VanDerWaalsContact O-N 3.15Å; G401-G404 PolarHBondContact O-N 3.12Å
402I90.6Very high92.6Very high103 Ų10346.7 Ų46.753%0.52827%0.266SS..G310 helixtrans-61.2-26-175.7-158.8163.6000113.5L396 G404 L405L396-I402 HydrophobicContact CD2-CB 4.37Å; I402-G404 PolarHBondContact O-N 3.38Å; I402-L405 HydrophobicContact CG1-CD1 4.24Å; I402-L405 WeakPolarHBondContact O-CB 3.31Å; I402-L405 PolarHBondContact O-N 2.87Å
403L91.5Very high92.6Very high78 Ų7847.4 Ų47.441%0.40827%0.269SS..G310 helixtrans-65.1-22.5177.5-168.268.5000111.7L87 L89 V400 G401 L405 F406L87-L403 HydrophobicContact CD1-CD2 3.72Å; L87-L403 HydrophobicContact CD1-CG 3.95Å; L89-L403 HydrophobicContact CD1-CD1 4.29Å; L89-L403 HydrophobicContact CD1-CD2 4.27Å; L89-L403 HydrophobicContact CD1-CG 4.44Å; L89-L403 HydrophobicContact CD2-CD1 4.11Å; V400-L403 HydrophobicContact CG1-CB 4.07Å; G401-L403 PolarHBondContact O-N 3.38Å; G401-L403 VanDerWaalsContact O-N 3.15Å; L403-L405 PolarHBondContact O-N 3.36Å; L403-F406 PolarHBondContact O-N 2.92Å
404G91.1Very high92.7Very high5 Ų539.1 Ų39.15%0.05224%0.243CC..G310 helixtrans-68.5-13.3172.600000114R359 V400 G401 I402 K407R359-G404 PolarHBondContact NH2-O 3.39Å; V400-G404 VanDerWaalsContact CG1-N 3.31Å; G401-G404 PolarHBondContact O-N 3.12Å; I402-G404 PolarHBondContact O-N 3.38Å; G404-K407 WeakPolarHBondContact O-CG 3.23Å
405L93.5Very high92.8Very high2 Ų237.4 Ų37.41%0.0123%0.23CC..G310 helixtrans-84.7-13.7170.1-62.7177000112.6Y351 P352 T355 L356 L392 I402 L403 K407Y351-L405 WeakPolarHBondContact CD1-O 3.38Å; Y351-L405 VanDerWaalsContact CE1-O 3.24Å; Y351-L405 WeakPolarHBondContact CE1-O 3.19Å; P352-L405 HydrophobicContact CB-CB 4.1Å; P352-L405 HydrophobicContact CB-CD1 3.86Å; T355-L405 HydrophobicContact CG2-CD2 3.97Å; T355-L405 PolarHBondContact OG1-O 3.04Å; L356-L405 HydrophobicContact CD1-CD1 4.5Å; L356-L405 HydrophobicContact CD2-CD2 3.83Å; L356-L405 HydrophobicContact CG-CD2 3.95Å; L392-L405 HydrophobicContact CD1-CD1 4.39Å; I402-L405 HydrophobicContact CG1-CD1 4.24Å; I402-L405 WeakPolarHBondContact O-CB 3.31Å; I402-L405 PolarHBondContact O-N 2.87Å; L403-L405 PolarHBondContact O-N 3.36Å; L405-K407 VanDerWaalsContact C-N 3.33Å
406F94.6Very high93Very high49 Ų4938.3 Ų38.322%0.21523%0.233CC..SBendtrans-96.921.3176.1-71.9-89.1000112.6L89 Y351 P352 L403 G408 F409L89-F406 HydrophobicContact CD2-CB 4.06Å; Y351-F406 AromaticContact CD1-CD1 3.74Å; Y351-F406 HydrophobicContact CD1-CD1 3.74Å; Y351-F406 HydrophobicContact CD1-CE1 4.23Å; Y351-F406 HydrophobicContact CD1-CG 4.24Å; Y351-F406 HydrophobicContact CE1-CB 4.5Å; Y351-F406 HydrophobicContact CE1-CD1 4.39Å; Y351-F406 HydrophobicContact CG-CD1 4.09Å; Y351-F406 HydrophobicContact CG-CE1 4.25Å; P352-F406 HydrophobicContact CG-CE1 4.41Å; P352-F406 HydrophobicContact CG-CE2 3.8Å; P352-F406 HydrophobicContact CG-CZ 3.63Å; L403-F406 PolarHBondContact O-N 2.92Å; F406-G408 PolarHBondContact O-N 3.36Å; F406-F409 HydrophobicContact CB-CB 4.49Å; F406-F409 AromaticContact CD1-CD2 3.83Å; F406-F409 HydrophobicContact CD1-CD2 3.83Å; F406-F409 HydrophobicContact CD1-CE2 4.18Å; F406-F409 HydrophobicContact CD1-CG 4.46Å; F406-F409 HydrophobicContact CE1-CD2 4.49Å; F406-F409 HydrophobicContact CE1-CE2 4.43Å; F406-F409 VanDerWaalsContact O-CB 3.26Å; F406-F409 WeakPolarHBondContact O-CB 3.41Å; F406-F409 PolarHBondContact O-N 2.59Å
407K93.7Very high93.1Very high4 Ų436.8 Ų36.82%0.01723%0.233CC..THydrogen-bonded Turntrans-60.9134.1175-74.7-171.8-173-167.10110.7C78 Q79 L81 E82 S84 L87 Y351 G404 L405 F409C78-K407 HydrophobicContact CB-CB 4.48Å; Q79-K407 VanDerWaalsContact CG-O 3.31Å; Q79-K407 WeakPolarHBondContact CG-O 3.35Å; L81-K407 PolarHBondContact O-NZ 3.18Å; E82-K407 PolarHBondContact O-NZ 3.05Å; S84-K407 PolarHBondContact O-NZ 2.64Å; L87-K407 HydrophobicContact CD2-CD 4.23Å; L87-K407 HydrophobicContact CD2-CG 3.64Å; L87-K407 CarbonylContact O-C 3.52Å; L87-K407 WeakPolarHBondContact O-CA 3.23Å; Y351-K407 PolarHBondContact OH-O 3.41Å; G404-K407 WeakPolarHBondContact O-CG 3.23Å; L405-K407 VanDerWaalsContact C-N 3.33Å; K407-F409 VanDerWaalsContact C-N 3.3Å; K407-F409 PolarHBondContact O-N 2.86Å
408G93.9Very high93.2Very high0 Ų036.7 Ų36.70%022%0.216CC..THydrogen-bonded Turntrans76.510.1-178.600000114.9L87 H88 Y351 F406 G410 A411L87-G408 PolarHBondContact O-N 3.23Å; H88-G408 CarbonylContact O-C 3.6Å; Y351-G408 PolarHBondContact OH-O 2.99Å; F406-G408 PolarHBondContact O-N 3.36Å; G408-G410 PolarHBondContact O-N 3.34Å; G408-G410 VanDerWaalsContact O-N 3.08Å; G408-A411 VanDerWaalsContact O-CB 3.29Å; G408-A411 WeakPolarHBondContact O-CB 3.49Å; G408-A411 PolarHBondContact O-N 2.57Å
409F95.6Very high93.2Very high37 Ų3736.6 Ų36.616%0.16221%0.213CC..Hα-helixtrans-57.9-27.1-178.3-170.5-101.1000112.9H88 L89 V348 Y351 F406 K407 A411 L412 I413H88-F409 PolarHBondContact O-N 3.04Å; L89-F409 HydrophobicContact CD2-CB 4.34Å; V348-F409 HydrophobicContact CG1-CZ 4.49Å; V348-F409 HydrophobicContact CG2-CE2 4.05Å; V348-F409 HydrophobicContact CG2-CZ 3.96Å; Y351-F409 HydrophobicContact CD1-CD2 4.49Å; Y351-F409 AromaticContact CD2-CD2 3.85Å; Y351-F409 HydrophobicContact CD2-CD2 3.85Å; Y351-F409 HydrophobicContact CD2-CE2 4.26Å; Y351-F409 HydrophobicContact CE1-CD2 4.48Å; Y351-F409 AromaticContact CE2-CD2 3.77Å; Y351-F409 HydrophobicContact CE2-CD2 3.77Å; Y351-F409 HydrophobicContact CG-CD2 4.19Å; Y351-F409 WeakPolarHBondContact OH-CA 3.44Å; Y351-F409 PolarHBondContact OH-N 2.9Å; Y351-F409 VanDerWaalsContact OH-N 3.11Å; F406-F409 HydrophobicContact CB-CB 4.49Å; F406-F409 AromaticContact CD1-CD2 3.83Å; F406-F409 HydrophobicContact CD1-CD2 3.83Å; F406-F409 HydrophobicContact CD1-CE2 4.18Å; F406-F409 HydrophobicContact CD1-CG 4.46Å; F406-F409 HydrophobicContact CE1-CD2 4.49Å; F406-F409 HydrophobicContact CE1-CE2 4.43Å; F406-F409 VanDerWaalsContact O-CB 3.26Å; F406-F409 WeakPolarHBondContact O-CB 3.41Å; F406-F409 PolarHBondContact O-N 2.59Å; K407-F409 VanDerWaalsContact C-N 3.3Å; K407-F409 PolarHBondContact O-N 2.86Å; F409-A411 PolarHBondContact O-N 2.83Å; F409-L412 HydrophobicContact CD2-CD2 4.03Å; F409-L412 HydrophobicContact CE2-CD2 3.63Å; F409-L412 HydrophobicContact CZ-CD2 4.27Å; F409-L412 VanDerWaalsContact O-CB 3.31Å; F409-L412 WeakPolarHBondContact O-CB 3.16Å; F409-L412 PolarHBondContact O-N 3.35Å; F409-I413 HydrophobicContact CD1-CD1 3.74Å; F409-I413 HydrophobicContact CD1-CG1 3.99Å; F409-I413 HydrophobicContact CE1-CD1 3.71Å; F409-I413 HydrophobicContact CE1-CG1 3.81Å; F409-I413 PolarHBondContact O-N 2.98Å; F409-I413 VanDerWaalsContact O-N 3.15Å
410G95.5Very high93.4Very high0 Ų030.8 Ų30.80%018%0.177CC..Hα-helixtrans-58.4-30.9173.100000113.6H88 L89 G408 I413 A414H88-G410 PolarHBondContact O-N 3.45Å; L89-G410 WeakPolarHBondContact O-CA 3.48Å; L89-G410 PolarHBondContact O-N 3.24Å; G408-G410 PolarHBondContact O-N 3.34Å; G408-G410 VanDerWaalsContact O-N 3.08Å; G410-I413 PolarHBondContact O-N 3.41Å; G410-A414 WeakPolarHBondContact O-CB 3.26Å; G410-A414 PolarHBondContact O-N 3.29Å
411A95.9Very high93.6Very high2 Ų233.4 Ų33.42%0.01719%0.188CC..Hα-helixtrans-69.2-37.1176.100000111.4F71 I74 R75 L94 G408 F409 A414 Q415F71-A411 WeakPolarHBondContact CD1-O 3.16Å; I74-A411 HydrophobicContact CB-CB 4.37Å; I74-A411 HydrophobicContact CG2-CB 4.02Å; R75-A411 HydrophobicContact CB-CB 3.88Å; L94-A411 HydrophobicContact CD1-CB 3.76Å; L94-A411 VanDerWaalsContact CD1-N 3.28Å; G408-A411 VanDerWaalsContact O-CB 3.29Å; G408-A411 WeakPolarHBondContact O-CB 3.49Å; G408-A411 PolarHBondContact O-N 2.57Å; F409-A411 PolarHBondContact O-N 2.83Å; A411-A414 PolarHBondContact O-N 3.47Å; A411-Q415 WeakPolarHBondContact O-CB 3.32Å; A411-Q415 PolarHBondContact O-N 3.49Å
412L95.9Very high93.6Very high0 Ų037 Ų370%020%0.199CC..Hα-helixtrans-62.8-47.3174.1-171.873.4000110.9F344 D347 V348 Y351 F409 A414 Q415 Y416F344-L412 HydrophobicContact CE2-CD2 4.45Å; D347-L412 HydrophobicContact CB-CD1 3.86Å; D347-L412 HydrophobicContact CB-CD2 4.12Å; V348-L412 HydrophobicContact CG2-CD2 4.01Å; Y351-L412 HydrophobicContact CD2-CD2 3.92Å; Y351-L412 HydrophobicContact CE2-CB 4.27Å; Y351-L412 HydrophobicContact CE2-CD2 4.1Å; F409-L412 HydrophobicContact CD2-CD2 4.03Å; F409-L412 HydrophobicContact CE2-CD2 3.63Å; F409-L412 HydrophobicContact CZ-CD2 4.27Å; F409-L412 VanDerWaalsContact O-CB 3.31Å; F409-L412 WeakPolarHBondContact O-CB 3.16Å; F409-L412 PolarHBondContact O-N 3.35Å; L412-A414 VanDerWaalsContact C-N 3.31Å; L412-A414 PolarHBondContact O-N 2.76Å; L412-Q415 WeakPolarHBondContact O-CB 3.46Å; L412-Q415 PolarHBondContact O-N 2.78Å; L412-Y416 HydrophobicContact CD1-CD2 4.08Å; L412-Y416 HydrophobicContact CD1-CE2 3.67Å; L412-Y416 HydrophobicContact CG-CD2 4.14Å; L412-Y416 HydrophobicContact CG-CE2 4.15Å; L412-Y416 WeakPolarHBondContact O-CD2 3.33Å; L412-Y416 PolarHBondContact O-N 3.4Å; L412-Y416 VanDerWaalsContact O-N 3.14Å
413I96.2Very high93.4Very high64 Ų6433.1 Ų33.133%0.32818%0.179SC..Hα-helixtrans-58.9-45.7176.5-62.5173.8000110.2P91 F409 G410 Q415 Y416 A417P91-I413 HydrophobicContact CG-CG2 4.45Å; F409-I413 HydrophobicContact CD1-CD1 3.74Å; F409-I413 HydrophobicContact CD1-CG1 3.99Å; F409-I413 HydrophobicContact CE1-CD1 3.71Å; F409-I413 HydrophobicContact CE1-CG1 3.81Å; F409-I413 PolarHBondContact O-N 2.98Å; F409-I413 VanDerWaalsContact O-N 3.15Å; G410-I413 PolarHBondContact O-N 3.41Å; I413-Q415 VanDerWaalsContact C-N 3.34Å; I413-Q415 PolarHBondContact O-N 3.35Å; I413-Y416 PolarHBondContact O-N 2.89Å; I413-A417 VanDerWaalsContact O-CB 3.25Å; I413-A417 WeakPolarHBondContact O-CB 3.24Å; I413-A417 PolarHBondContact O-N 2.8Å
414A95.3Very high93.4Very high23 Ų2334.5 Ų34.519%0.1918%0.182CC..Hα-helixtrans-62.4-40178.700000112.7F71 P91 G410 A411 L412 A417 L418F71-A414 HydrophobicContact CD1-CB 3.73Å; F71-A414 HydrophobicContact CE1-CB 3.43Å; F71-A414 VanDerWaalsContact CE1-CB 3.43Å; F71-A414 HydrophobicContact CZ-CB 4.43Å; P91-A414 HydrophobicContact CB-CB 3.99Å; G410-A414 WeakPolarHBondContact O-CB 3.26Å; G410-A414 PolarHBondContact O-N 3.29Å; A411-A414 PolarHBondContact O-N 3.47Å; L412-A414 VanDerWaalsContact C-N 3.31Å; L412-A414 PolarHBondContact O-N 2.76Å; A414-A417 PolarHBondContact O-N 3.28Å; A414-L418 WeakPolarHBondContact O-CB 3.21Å; A414-L418 PolarHBondContact O-N 2.99Å
415Q95.4Very high93.3Very high11 Ų1136.1 Ų36.15%0.05120%0.198CC..Hα-helixtrans-57.3-54.4176.3-174.8-173-60.200111.2F71 A411 L412 I413 L418 Q419F71-Q415 HydrophobicContact CB-CB 3.66Å; F71-Q415 HydrophobicContact CB-CG 4.07Å; F71-Q415 HydrophobicContact CD1-CB 4.28Å; F71-Q415 HydrophobicContact CD2-CB 3.89Å; F71-Q415 HydrophobicContact CD2-CG 4.02Å; F71-Q415 HydrophobicContact CG-CB 3.66Å; F71-Q415 HydrophobicContact CG-CG 4.2Å; A411-Q415 WeakPolarHBondContact O-CB 3.32Å; A411-Q415 PolarHBondContact O-N 3.49Å; L412-Q415 WeakPolarHBondContact O-CB 3.46Å; L412-Q415 PolarHBondContact O-N 2.78Å; I413-Q415 VanDerWaalsContact C-N 3.34Å; I413-Q415 PolarHBondContact O-N 3.35Å; Q415-L418 PolarHBondContact O-N 3.35Å; Q415-Q419 WeakPolarHBondContact O-CG 3.34Å; Q415-Q419 PolarHBondContact O-N 3.01Å
416Y94.6Very high93Very high21 Ų2139.9 Ų39.98%0.08222%0.218CC..Hα-helixtrans-71.9-30.1-177.5-77.8-78.9000112.6M340 N343 F344 D347 L412 I413 Q419 A420M340-Y416 HydrophobicContact CG-CD1 3.83Å; M340-Y416 HydrophobicContact CG-CE1 4.15Å; N343-Y416 HydrophobicContact CB-CE1 4.11Å; N343-Y416 WeakPolarHBondContact CB-OH 3.4Å; N343-Y416 PolarHBondContact O-OH 3.46Å; F344-Y416 VanDerWaalsContact CA-CZ 3.46Å; F344-Y416 HydrophobicContact CB-CD1 3.83Å; F344-Y416 HydrophobicContact CB-CD2 4.26Å; F344-Y416 HydrophobicContact CB-CE1 3.72Å; F344-Y416 HydrophobicContact CB-CE2 4.15Å; F344-Y416 HydrophobicContact CB-CG 4.09Å; F344-Y416 HydrophobicContact CD2-CD1 4.34Å; F344-Y416 AromaticContact CD2-CD2 3.44Å; F344-Y416 HydrophobicContact CD2-CD2 3.44Å; F344-Y416 VanDerWaalsContact CD2-CD2 3.44Å; F344-Y416 AromaticContact CD2-CE2 3.83Å; F344-Y416 HydrophobicContact CD2-CE2 3.83Å; F344-Y416 AromaticContact CD2-CG 3.71Å; F344-Y416 HydrophobicContact CD2-CG 3.71Å; F344-Y416 HydrophobicContact CE2-CD2 4.25Å; F344-Y416 HydrophobicContact CG-CD1 4.48Å; F344-Y416 HydrophobicContact CG-CD2 4.3Å; F344-Y416 HydrophobicContact CG-CG 4.27Å; F344-Y416 PolarHBondContact N-OH 3.15Å; D347-Y416 VanDerWaalsContact OD2-CE2 3.3Å; D347-Y416 WeakPolarHBondContact OD2-CE2 3.42Å; D347-Y416 PolarHBondContact OD2-OH 3.36Å; L412-Y416 HydrophobicContact CD1-CD2 4.08Å; L412-Y416 HydrophobicContact CD1-CE2 3.67Å; L412-Y416 HydrophobicContact CG-CD2 4.14Å; L412-Y416 HydrophobicContact CG-CE2 4.15Å; L412-Y416 WeakPolarHBondContact O-CD2 3.33Å; L412-Y416 PolarHBondContact O-N 3.4Å; L412-Y416 VanDerWaalsContact O-N 3.14Å; I413-Y416 PolarHBondContact O-N 2.89Å; Y416-Q419 PolarHBondContact O-N 3.21Å; Y416-A420 WeakPolarHBondContact O-CB 3.35Å; Y416-A420 PolarHBondContact O-N 3.46Å
417A94.3Very high92.6Very high58 Ų5841 Ų4148%0.47922%0.221SC..Hα-helixtrans-63.7-42.8170.600000111.6I413 A414 L421I413-A417 VanDerWaalsContact O-CB 3.25Å; I413-A417 WeakPolarHBondContact O-CB 3.24Å; I413-A417 PolarHBondContact O-N 2.8Å; A414-A417 PolarHBondContact O-N 3.28Å; A417-L421 VanDerWaalsContact O-CB 3.31Å; A417-L421 WeakPolarHBondContact O-CB 3.44Å; A417-L421 PolarHBondContact O-N 3.16Å
418L93.2Very high92.2Very high65 Ų6544.8 Ų44.834%0.3425%0.246SC..Hα-helixtrans-66.3-44.1175.9-176.169000111.6L67 F71 A414 Q415 L421 F422L67-L418 HydrophobicContact CD1-CD2 3.89Å; L67-L418 HydrophobicContact CG-CD2 4.44Å; F71-L418 HydrophobicContact CE2-CB 4.37Å; F71-L418 HydrophobicContact CE2-CD2 3.55Å; F71-L418 HydrophobicContact CZ-CB 4.29Å; F71-L418 HydrophobicContact CZ-CD2 3.84Å; A414-L418 WeakPolarHBondContact O-CB 3.21Å; A414-L418 PolarHBondContact O-N 2.99Å; Q415-L418 PolarHBondContact O-N 3.35Å; L418-L421 PolarHBondContact O-N 3.03Å; L418-F422 WeakPolarHBondContact O-CB 3.48Å; L418-F422 PolarHBondContact O-N 3.12Å
419Q91.4Very high91.9Very high27 Ų2749.7 Ų49.713%0.12627%0.272CS..Hα-helixtrans-62.9-42.7176.9-72.3176.4-8.400111.7L67 M340 Q415 Y416 F422 I423L67-Q419 HydrophobicContact CD2-CG 4.2Å; M340-Q419 HydrophobicContact SD-CB 3.99Å; Q415-Q419 WeakPolarHBondContact O-CG 3.34Å; Q415-Q419 PolarHBondContact O-N 3.01Å; Y416-Q419 PolarHBondContact O-N 3.21Å; Q419-F422 WeakPolarHBondContact O-CB 3.36Å; Q419-F422 PolarHBondContact O-N 3.47Å; Q419-I423 WeakPolarHBondContact O-CG1 3.41Å; Q419-I423 PolarHBondContact O-N 3.23Å
420A91.3Very high91.4Very high19 Ų1950.2 Ų50.216%0.15727%0.273CS..Hα-helixtrans-62-46.9174.500000110.9M340 Y416 F422 I423 F424M340-A420 HydrophobicContact CE-CB 3.76Å; M340-A420 HydrophobicContact SD-CB 4.05Å; Y416-A420 WeakPolarHBondContact O-CB 3.35Å; Y416-A420 PolarHBondContact O-N 3.46Å; A420-F422 VanDerWaalsContact C-N 3.28Å; A420-F422 PolarHBondContact O-N 2.58Å; A420-I423 PolarHBondContact O-N 3.45Å; A420-F424 HydrophobicContact CB-CD2 4.35Å; A420-F424 HydrophobicContact CB-CE2 4.24Å; A420-F424 WeakPolarHBondContact O-CD2 3.32Å; A420-F424 PolarHBondContact O-N 3.05Å
421L92.4Very high90.7Very high117 Ų11754 Ų5461%0.61329%0.291SS*.Hα-helixtrans-58.9-39.9176179.763.9000111.9A417 L418 F424 G425A417-L421 VanDerWaalsContact O-CB 3.31Å; A417-L421 WeakPolarHBondContact O-CB 3.44Å; A417-L421 PolarHBondContact O-N 3.16Å; L418-L421 PolarHBondContact O-N 3.03Å; L421-F424 PolarHBondContact O-N 2.99Å; L421-G425 PolarHBondContact O-N 3.1Å
422F89.9Confident90.1Very high92 Ų9259.3 Ų59.340%0.40432%0.315SS..Hα-helixtrans-63-45.9176.2-177.5-103.1000111.6L67 L418 Q419 A420 G425 I426L67-F422 HydrophobicContact CD2-CB 4.48Å; L67-F422 HydrophobicContact CD2-CD1 4.38Å; L67-F422 HydrophobicContact CD2-CG 4.32Å; L418-F422 WeakPolarHBondContact O-CB 3.48Å; L418-F422 PolarHBondContact O-N 3.12Å; Q419-F422 WeakPolarHBondContact O-CB 3.36Å; Q419-F422 PolarHBondContact O-N 3.47Å; A420-F422 VanDerWaalsContact C-N 3.28Å; A420-F422 PolarHBondContact O-N 2.58Å; F422-G425 PolarHBondContact O-N 2.89Å; F422-I426 HydrophobicContact CD1-CD1 3.72Å; F422-I426 HydrophobicContact CE1-CD1 3.28Å; F422-I426 HydrophobicContact CE1-CG1 4.36Å; F422-I426 HydrophobicContact CE2-CD1 4.39Å; F422-I426 HydrophobicContact CG-CD1 4.45Å; F422-I426 HydrophobicContact CZ-CD1 3.66Å; F422-I426 HydrophobicContact CZ-CG1 4.42Å; F422-I426 WeakPolarHBondContact O-CG1 3.41Å; F422-I426 PolarHBondContact O-N 3.3Å
423I87.1Confident89.5Confident22 Ų2263.8 Ų63.811%0.11334%0.339CS..Hα-helixtrans-63.1-45.9176.4-69.4170.4000111Y333 M340 Q419 A420 G425 I426 R427Y333-I423 HydrophobicContact CD2-CG2 3.98Å; Y333-I423 HydrophobicContact CE2-CG2 3.28Å; M340-I423 HydrophobicContact CB-CD1 4.47Å; M340-I423 HydrophobicContact CE-CD1 4.34Å; M340-I423 HydrophobicContact SD-CD1 3.76Å; Q419-I423 WeakPolarHBondContact O-CG1 3.41Å; Q419-I423 PolarHBondContact O-N 3.23Å; A420-I423 PolarHBondContact O-N 3.45Å; I423-G425 VanDerWaalsContact C-N 3.32Å; I423-G425 PolarHBondContact O-N 3.23Å; I423-I426 PolarHBondContact O-N 2.98Å; I423-R427 PolarHBondContact O-N 2.87Å
424F89.7Confident88.5Confident107 Ų10763.6 Ų63.647%0.46934%0.338SS..Hα-helixtrans-62.6-38.2175.1-76.4-62000112.2Y333 F337 A420 L421 R427 C428Y333-F424 WeakPolarHBondContact OH-CD1 3.35Å; Y333-F424 WeakPolarHBondContact OH-CE1 3.42Å; F337-F424 HydrophobicContact CE2-CE2 4.33Å; F337-F424 HydrophobicContact CE2-CZ 4.08Å; A420-F424 HydrophobicContact CB-CD2 4.35Å; A420-F424 HydrophobicContact CB-CE2 4.24Å; A420-F424 WeakPolarHBondContact O-CD2 3.32Å; A420-F424 PolarHBondContact O-N 3.05Å; L421-F424 PolarHBondContact O-N 2.99Å; F424-R427 PolarHBondContact O-N 3.31Å; F424-C428 WeakPolarHBondContact O-CB 3.43Å; F424-C428 PolarHBondContact O-N 3.38Å
425G89.6Confident87.4Confident38 Ų3867.1 Ų67.139%0.39236%0.36SS..Hα-helixtrans-64.2-42.817600000112.2L421 F422 I423 R427 C428 L429L421-G425 PolarHBondContact O-N 3.1Å; F422-G425 PolarHBondContact O-N 2.89Å; I423-G425 VanDerWaalsContact C-N 3.32Å; I423-G425 PolarHBondContact O-N 3.23Å; G425-R427 VanDerWaalsContact C-N 3.3Å; G425-R427 PolarHBondContact O-N 3.29Å; G425-C428 PolarHBondContact O-N 2.94Å; G425-L429 WeakPolarHBondContact O-CB 3.03Å; G425-L429 PolarHBondContact O-N 2.75Å
426I87.3Confident86.7Confident81 Ų8172.4 Ų72.442%0.41539%0.388SS..Hα-helixtrans-61.2-41.4172.9-71168.1000110.6F422 I423 L429 Y430F422-I426 HydrophobicContact CD1-CD1 3.72Å; F422-I426 HydrophobicContact CE1-CD1 3.28Å; F422-I426 HydrophobicContact CE1-CG1 4.36Å; F422-I426 HydrophobicContact CE2-CD1 4.39Å; F422-I426 HydrophobicContact CG-CD1 4.45Å; F422-I426 HydrophobicContact CZ-CD1 3.66Å; F422-I426 HydrophobicContact CZ-CG1 4.42Å; F422-I426 WeakPolarHBondContact O-CG1 3.41Å; F422-I426 PolarHBondContact O-N 3.3Å; I423-I426 PolarHBondContact O-N 2.98Å; I426-L429 PolarHBondContact O-N 2.99Å; I426-Y430 WeakPolarHBondContact O-CB 3.48Å; I426-Y430 PolarHBondContact O-N 3.49Å
427R86.1Confident85.6Confident74 Ų7481.4 Ų81.428%0.27942%0.422SS..Hα-helixtrans-62.8-48.6176.7173.1168-176.1141.99.1112.9Y329 Y333 I423 F424 G425 L429 Y430 E431Y329-R427 WeakPolarHBondContact OH-CA 3.22Å; Y329-R427 WeakPolarHBondContact OH-CB 3.34Å; Y329-R427 VanDerWaalsContact OH-CG 3.25Å; Y329-R427 WeakPolarHBondContact OH-CG 3.49Å; Y333-R427 HydrophobicContact CD2-CB 4.11Å; Y333-R427 HydrophobicContact CE2-CB 3.59Å; Y333-R427 HydrophobicContact CE2-CG 4.19Å; I423-R427 PolarHBondContact O-N 2.87Å; F424-R427 PolarHBondContact O-N 3.31Å; G425-R427 VanDerWaalsContact C-N 3.3Å; G425-R427 PolarHBondContact O-N 3.29Å; R427-L429 VanDerWaalsContact C-N 3.29Å; R427-L429 PolarHBondContact O-N 2.85Å; R427-Y430 PolarHBondContact O-N 3.03Å; R427-E431 HydrophobicContact CG-CG 4.45Å; R427-E431 WeakPolarHBondContact CG-OE1 3.38Å; R427-E431 IonicContact CZ-OE1 3.68Å; R427-E431 IonicContact NE-OE1 3.84Å; R427-E431 PolarHBondContact NE-OE1 3.09Å; R427-E431 IonicContact NH2-OE1 2.71Å; R427-E431 PolarHBondContact NH2-OE1 3.27Å; R427-E431 WeakPolarHBondContact O-CG 3.33Å; R427-E431 PolarHBondContact O-N 3.14Å
428C86.3Confident84.3Confident82 Ų8281.8 Ų81.855%0.55443%0.426SS*.Hα-helixtrans-60.8-40.5176.8-1740000111.6F424 G425 H432F424-C428 WeakPolarHBondContact O-CB 3.43Å; F424-C428 PolarHBondContact O-N 3.38Å; G425-C428 PolarHBondContact O-N 2.94Å; C428-H432 VanDerWaalsContact O-CB 3.31Å; C428-H432 WeakPolarHBondContact O-CB 3.15Å; C428-H432 PolarHBondContact O-N 3.29Å
429L87.6Confident82.6Confident103 Ų10383.5 Ų83.554%0.53944%0.441SS..Hα-helixtrans-63.1-45.1175.1179.363.8000111.7G425 I426 R427 H432 L433G425-L429 WeakPolarHBondContact O-CB 3.03Å; G425-L429 PolarHBondContact O-N 2.75Å; I426-L429 PolarHBondContact O-N 2.99Å; R427-L429 VanDerWaalsContact C-N 3.29Å; R427-L429 PolarHBondContact O-N 2.85Å; L429-H432 PolarHBondContact O-N 3.38Å; L429-L433 HydrophobicContact CD1-CD1 4.21Å; L429-L433 HydrophobicContact CD1-CG 4.26Å; L429-L433 HydrophobicContact CG-CD1 3.98Å; L429-L433 HydrophobicContact CG-CG 4.44Å; L429-L433 WeakPolarHBondContact O-CB 3.23Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.48Å; L429-L433 PolarHBondContact O-N 3.09Å
430Y83.9Confident80.8Confident48 Ų4887.7 Ų87.719%0.18847%0.47CS..Hα-helixtrans-63-48.1178.8178.6-99.5000111.8L325 Y329 I426 R427 H432 L433 L434L325-Y430 VanDerWaalsContact CD2-OH 3.22Å; L325-Y430 WeakPolarHBondContact CD2-OH 3.48Å; Y329-Y430 AromaticContact CD1-CD1 3.82Å; Y329-Y430 HydrophobicContact CD1-CD1 3.82Å; Y329-Y430 AromaticContact CD1-CE1 3.47Å; Y329-Y430 HydrophobicContact CD1-CE1 3.47Å; Y329-Y430 VanDerWaalsContact CD1-CE1 3.47Å; Y329-Y430 AromaticContact CD2-CD1 3.55Å; Y329-Y430 HydrophobicContact CD2-CD1 3.55Å; Y329-Y430 HydrophobicContact CD2-CD2 4.09Å; Y329-Y430 AromaticContact CD2-CE1 3.4Å; Y329-Y430 HydrophobicContact CD2-CE1 3.4Å; Y329-Y430 AromaticContact CD2-CE2 3.98Å; Y329-Y430 HydrophobicContact CD2-CE2 3.98Å; Y329-Y430 AromaticContact CD2-CG 3.88Å; Y329-Y430 HydrophobicContact CD2-CG 3.88Å; Y329-Y430 AromaticContact CD2-CZ 3.64Å; Y329-Y430 AromaticContact CE1-CD1 3.64Å; Y329-Y430 HydrophobicContact CE1-CD1 3.64Å; Y329-Y430 AromaticContact CE1-CE1 3.81Å; Y329-Y430 HydrophobicContact CE1-CE1 3.81Å; Y329-Y430 AromaticContact CE2-CD1 3.35Å; Y329-Y430 HydrophobicContact CE2-CD1 3.35Å; Y329-Y430 HydrophobicContact CE2-CD2 4.11Å; Y329-Y430 AromaticContact CE2-CE1 3.74Å; Y329-Y430 HydrophobicContact CE2-CE1 3.74Å; Y329-Y430 HydrophobicContact CE2-CE2 4.46Å; Y329-Y430 AromaticContact CE2-CG 3.54Å; Y329-Y430 HydrophobicContact CE2-CG 3.54Å; Y329-Y430 AromaticContact CG-CD1 3.78Å; Y329-Y430 HydrophobicContact CG-CD1 3.78Å; Y329-Y430 AromaticContact CG-CE1 3.26Å; Y329-Y430 HydrophobicContact CG-CE1 3.26Å; Y329-Y430 HydrophobicContact CG-CE2 4.45Å; Y329-Y430 AromaticContact CG-CZ 3.66Å; Y329-Y430 AromaticContact CZ-CD1 3.41Å; Y329-Y430 VanDerWaalsContact CZ-CD1 3.41Å; Y329-Y430 AromaticContact CZ-CE1 3.95Å; Y329-Y430 AromaticContact CZ-CG 3.95Å; I426-Y430 WeakPolarHBondContact O-CB 3.48Å; I426-Y430 PolarHBondContact O-N 3.49Å; R427-Y430 PolarHBondContact O-N 3.03Å; Y430-H432 VanDerWaalsContact C-N 3.29Å; Y430-H432 PolarHBondContact O-N 3.38Å; Y430-L433 PolarHBondContact O-N 3.07Å; Y430-L434 HydrophobicContact CD1-CD1 3.77Å; Y430-L434 HydrophobicContact CD1-CG 4.27Å; Y430-L434 HydrophobicContact CE1-CD1 3.18Å; Y430-L434 HydrophobicContact CE1-CG 3.89Å; Y430-L434 HydrophobicContact CE2-CD1 4.43Å; Y430-L434 HydrophobicContact CE2-CD2 4.45Å; Y430-L434 HydrophobicContact CE2-CG 4.33Å; Y430-L434 WeakPolarHBondContact O-CG 2.89Å; Y430-L434 PolarHBondContact O-N 2.83Å
431E80.9Confident78.9Confident81 Ų8192.4 Ų92.438%0.37950%0.499SS..Hα-helixtrans-59.3-40.5175.6-70.9172.6-174.900111.2R427 L434 C435R427-E431 HydrophobicContact CG-CG 4.45Å; R427-E431 WeakPolarHBondContact CG-OE1 3.38Å; R427-E431 IonicContact CZ-OE1 3.68Å; R427-E431 IonicContact NE-OE1 3.84Å; R427-E431 PolarHBondContact NE-OE1 3.09Å; R427-E431 IonicContact NH2-OE1 2.71Å; R427-E431 PolarHBondContact NH2-OE1 3.27Å; R427-E431 WeakPolarHBondContact O-CG 3.33Å; R427-E431 PolarHBondContact O-N 3.14Å; E431-L434 PolarHBondContact O-N 3.41Å; E431-C435 PolarHBondContact O-N 3.48Å; E431-C435 PolarHBondContact O-SG 3.48Å; E431-C435 VanDerWaalsContact O-SG 3.33Å
432H83.6Confident76.8Confident112 Ų11292.9 Ų92.952%0.51951%0.507SS..Hα-helixtrans-66-42.1176-169.863.6000112.9C428 L429 Y430 C435 L436C428-H432 VanDerWaalsContact O-CB 3.31Å; C428-H432 WeakPolarHBondContact O-CB 3.15Å; C428-H432 PolarHBondContact O-N 3.29Å; L429-H432 PolarHBondContact O-N 3.38Å; Y430-H432 VanDerWaalsContact C-N 3.29Å; Y430-H432 PolarHBondContact O-N 3.38Å; H432-C435 PolarHBondContact O-N 3.15Å; H432-L436 WeakPolarHBondContact O-CG 3.47Å; H432-L436 PolarHBondContact O-N 2.84Å
433L83.4Confident74.5Confident95 Ų9594.3 Ų94.350%0.49752%0.519SS..Hα-helixtrans-65-39.6176.6-73171.6000111.7L429 Y430 L436 W437L429-L433 HydrophobicContact CD1-CD1 4.21Å; L429-L433 HydrophobicContact CD1-CG 4.26Å; L429-L433 HydrophobicContact CG-CD1 3.98Å; L429-L433 HydrophobicContact CG-CG 4.44Å; L429-L433 WeakPolarHBondContact O-CB 3.23Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.48Å; L429-L433 PolarHBondContact O-N 3.09Å; Y430-L433 PolarHBondContact O-N 3.07Å; L433-L436 PolarHBondContact O-N 3.5Å; L433-W437 WeakPolarHBondContact O-CB 3.03Å; L433-W437 PolarHBondContact O-N 2.98Å
434L75.2Confident72.2Confident59 Ų59101 Ų10131%0.30956%0.555SS.*Hα-helixtrans-63-42.3174.3-74.8-179.3000112L325 Y430 E431 L436 W437 A438L325-L434 HydrophobicContact CD2-CD2 4.27Å; Y430-L434 HydrophobicContact CD1-CD1 3.77Å; Y430-L434 HydrophobicContact CD1-CG 4.27Å; Y430-L434 HydrophobicContact CE1-CD1 3.18Å; Y430-L434 HydrophobicContact CE1-CG 3.89Å; Y430-L434 HydrophobicContact CE2-CD1 4.43Å; Y430-L434 HydrophobicContact CE2-CD2 4.45Å; Y430-L434 HydrophobicContact CE2-CG 4.33Å; Y430-L434 WeakPolarHBondContact O-CG 2.89Å; Y430-L434 PolarHBondContact O-N 2.83Å; E431-L434 PolarHBondContact O-N 3.41Å; L434-L436 VanDerWaalsContact C-N 3.31Å; L434-L436 PolarHBondContact O-N 3.31Å; L434-W437 PolarHBondContact O-N 3Å; L434-A438 PolarHBondContact O-N 2.99Å
435C72.8Confident69.7Low98 Ų98103.2 Ų103.266%0.66256%0.564SS**Hα-helixtrans-63.8-36.3175.8-69.80000112.7E431 H432 W437E431-C435 PolarHBondContact O-N 3.48Å; E431-C435 PolarHBondContact O-SG 3.48Å; E431-C435 VanDerWaalsContact O-SG 3.33Å; H432-C435 PolarHBondContact O-N 3.15Å; C435-W437 VanDerWaalsContact C-N 3.31Å
436L80.1Confident66.9Low122 Ų122106.8 Ų106.864%0.63958%0.578SS**Hα-helixtrans-71.6-27.7176-72.6169.1000112.7H432 L433 L434 A438H432-L436 WeakPolarHBondContact O-CG 3.47Å; H432-L436 PolarHBondContact O-N 2.84Å; L433-L436 PolarHBondContact O-N 3.5Å; L434-L436 VanDerWaalsContact C-N 3.31Å; L434-L436 PolarHBondContact O-N 3.31Å; L436-A438 VanDerWaalsContact C-N 3.31Å
437W72.1Confident64.4Low209 Ų209112.9 Ų112.979%0.79260%0.597SS**THydrogen-bonded Turntrans-83.6-2179.4-168-91.6000113.5L433 L434 C435 P439L433-W437 WeakPolarHBondContact O-CB 3.03Å; L433-W437 PolarHBondContact O-N 2.98Å; L434-W437 PolarHBondContact O-N 3Å; C435-W437 VanDerWaalsContact C-N 3.31Å; W437-P439 WeakPolarHBondContact O-CD 3.49Å; W437-P439 VanDerWaalsContact O-N 3.11Å
438A66.3Low61.8Low67 Ų67114.7 Ų114.755%0.55462%0.621SS**PPolyproline II helixtrans-53.7121.2178.600000110.6L434 L436L434-A438 PolarHBondContact O-N 2.99Å; L436-A438 VanDerWaalsContact C-N 3.31Å
439P57.5Low59.4Low101 Ų101119.1 Ų119.166%0.65663%0.631SS**PPolyproline II helixtrans-61.8144.9-175.322.1-31.1000110.6W437W437-P439 WeakPolarHBondContact O-CD 3.49Å; W437-P439 VanDerWaalsContact O-N 3.11Å
440P52.9Low56.7Low114 Ų114118.7 Ų118.774%0.7464%0.637SS**PPolyproline II helixtrans-59.2138.4-179.224.2-32.6000110T442P440-T442 PolarHBondContact O-N 3.14Å
441P52.6Low54.4Low119 Ų119122.4 Ų122.477%0.77367%0.67SS**PPolyproline II helixtrans-58.7126.3175.323.4-31.3000108.9D443P441-D443 PolarHBondContact O-N 3.01Å
442T47.6Very low52.4Low127 Ų127122.7 Ų122.778%0.77968%0.681SS**  trans-63.2109.8169.539.50000108.1P440 N444P440-T442 PolarHBondContact O-N 3.14Å; T442-N444 PolarHBondContact O-N 2.94Å
443D41.9Very low50Low121 Ų121128.9 Ų128.965%0.64770%0.7SS**  trans-71.278.9-179.8-139.15.6000108.5P441 K445P441-D443 PolarHBondContact O-N 3.01Å; D443-K445 PolarHBondContact O-N 3.27Å; D443-K445 IonicContact OD1-NZ 3.83Å
444N38.5Very low47.9Very low162 Ų162130 Ų13087%0.86671%0.712SS**  trans-7567.1164.9-89-16.5000108.8T442T442-N444 PolarHBondContact O-N 2.94Å
445K37.7Very low45.9Very low155 Ų155134.8 Ų134.867%0.67474%0.739SS**  trans-98.8119.8169-94.8180-171.9157.40109.6D443D443-K445 PolarHBondContact O-N 3.27Å; D443-K445 IonicContact OD1-NZ 3.83Å
446V31.7Very low44.3Very low112 Ų112136.7 Ų136.768%0.67975%0.747SS**  trans78.289151.4-1680000116.2
447Y33.1Very low42.3Very low209 Ų209135.5 Ų135.582%0.8275%0.749SS**  -14773.5121.7-94.6-74.5000108.9K449Y447-K449 HydrophobicContact CD1-CG 4.47Å; Y447-K449 PolarHBondContact O-N 2.93Å
448S32.5Very low40.7Very low112 Ų112131.8 Ų131.878%0.78375%0.749SS**  trans-68.981.8146.956.30000107S450S448-S450 VanDerWaalsContact C-N 3.26Å; S448-S450 PolarHBondContact O-N 3.41Å
449K36.1Very low39.3Very low175 Ų175133.1 Ų133.176%0.76176%0.76SS**  trans-78.489.4165.2-134.9177.1-171.1177.30106.5Y447 S451Y447-K449 HydrophobicContact CD1-CG 4.47Å; Y447-K449 PolarHBondContact O-N 2.93Å; K449-S451 VanDerWaalsContact C-N 3.3Å; K449-S451 PolarHBondContact O-N 2.89Å
450S31.4Very low38.4Very low95 Ų95136.3 Ų136.366%0.66476%0.764SS**  trans-57.4100154.658.60000106.9S448 S452S448-S450 VanDerWaalsContact C-N 3.26Å; S448-S450 PolarHBondContact O-N 3.41Å; S450-S452 PolarHBondContact O-N 3.11Å
451S35.5Very low37.8Very low126 Ų126138.5 Ų138.588%0.88176%0.764SS**  trans-78.875.5164.9-170.30000108K449K449-S451 VanDerWaalsContact C-N 3.3Å; K449-S451 PolarHBondContact O-N 2.89Å
452S38.8Very low37.1Very low87 Ų87136 Ų13661%0.60876%0.76SS**  trans-98.3120.9155.249.70000106.7S450S450-S452 PolarHBondContact O-N 3.11Å
453R32.7Very low36.7Very low241 Ų241137.2 Ų137.291%0.90976%0.761SS**  trans-34.3135.3173-75.5174.2169.6170.6-4.7113.3
454P38.6Very low36.6Very low118 Ų118139.7 Ų139.777%0.76677%0.769SS**  trans-111.8126.4155.131.3-18.2000111.1
455N33.1Very low36.7Very low160 Ų160136.3 Ų136.386%0.85676%0.758SS**  trans-68.1137.8162.5-74-26.2000109.6
456V40.7Very low36.8Very low139 Ų139136.7 Ų136.784%0.84277%0.766SS**  trans-143.2126.3153.7-179.30000109.5
457S36.3Very low37.2Very low96 Ų96135.6 Ų135.667%0.67177%0.769SS**  trans-71155.7173.154.90000113.6
458T38.7Very low37.6Very low131 Ų131130.9 Ų130.980%0.80477%0.773SS**  -179.2124.2124.627.90000112.7
459A37.9Very low37.8Very low95 Ų95129 Ų12979%0.78577%0.771SS**  trans62.1143.613900000119.4
460F37.6Very low38Very low169 Ų169128 Ų12874%0.74177%0.774SS**  cis-170.2148.810.8-161.9-111.5000107.8
461E41.1Very low38.6Very low159 Ų159128.8 Ų128.874%0.74378%0.779SS**  trans7.1147.3156.8-55.2176.9168.700120.8
462G38.7Very low38.8Very low66 Ų66128.7 Ų128.768%0.6878%0.776SS**  cis165.5179.214.800000110.4
463L37.9Very low38.7Very low153 Ų153129.5 Ų129.580%0.80178%0.782SS**  trans82103.8171.4-72.8133.7000118.1
464E40.7Very low38.9Very low173 Ų173123.7 Ų123.781%0.80877%0.773SS**  75.8137.396.7-81.8-167.4154.400113.1
465S40Very low38.9Very low92 Ų92123.3 Ų123.364%0.64377%0.768SS**  cis-169.1144.90.959.70000108.3
466I38.8Very low39Very low162 Ų162121.7 Ų121.783%0.83176%0.76SS**  trans44.2112.5136.3-54.7166.8000119.8
467A40.5Very low38.7Very low90 Ų90121.3 Ų121.374%0.74475%0.753SS**  158.2116.1110.300000114.6
468A41.4Very low38.5Very low110 Ų110132.5 Ų132.591%0.90978%0.781SS**  trans57.4127.2136.900000122.6
469G37.5Very low38.5Very low72 Ų72132.6 Ų132.674%0.74278%0.779SS**  trans146.785.1147.300000116.7
470D39.2Very low38.5Very low154 Ų154134.5 Ų134.582%0.82478%0.779SS**  trans43105.6147.2-66.2-17.5000122.7
471S43.8Very low38.6Very low111 Ų111132.6 Ų132.678%0.77678%0.781SS**  55.7149.6112.8103.90000121.4
472P40.4Very low38.4Very low124 Ų124131.1 Ų131.181%0.80578%0.783SS**  -125.5152-118.137.6-22.4000115
473S36.1Very low38.4Very low105 Ų105135.1 Ų135.173%0.73479%0.79SS**  trans-160.8154.3146.367.60000111.6
474T36.9Very low38.4Very low119 Ų119133.9 Ų133.973%0.7379%0.789SS**  trans76.3115.9155.927.20000118.5
475V38.6Very low38.3Very low110 Ų110131.1 Ų131.167%0.66779%0.788SS**  97.5121.5119.61710000117
476D35.3Very low38.1Very low126 Ų126134.2 Ų134.267%0.67480%0.799SS**  trans86.3117.7149.2-63.6-11.4000121.3
477N34.5Very low38.1Very low131 Ų131131.8 Ų131.870%0.70180%0.796SS**  56.6101.4129.3-64.4-28.1000116.9
478W32.5Very low37.8Very low330 Ų330135.6 Ų135.6100%1.2580%0.801SS**  -138.60117-8881.3000109.6

Retrieved 478 of 478 residues in 121.3 ms (Link to these results)