A0A087XUI3_POEFO Loading...

Cartilage associated protein

AlphaFold DB , UniProt , Accession A0A087XUI3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 397 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
1M38.3Very low38.5Very low244 Ų244138 Ų138100%1.20281%0.807SS**  0141.40-87171.517000107.9
2A34.7Very low38.5Very low101 Ų101138.4 Ų138.484%0.83580%0.802SS**  trans87.4121.1-176.700000116.6
3P46.8Very low38.3Very low120 Ų120136.1 Ų136.178%0.77980%0.796SS**  trans-111.5174.2-178.837.1-22.6000114.8
4S36.7Very low38.1Very low98 Ų98137.8 Ų137.869%0.68580%0.799SS**  trans65.6117.8152.362.20000121.1
5T38.5Very low38Very low137 Ų137138.9 Ų138.984%0.8480%0.8SS**  -175.5156.398.229.80000111.6
6P41Very low37.8Very low98 Ų98134.8 Ų134.864%0.63679%0.788SS**  trans-101.9161.4-158.437.9-30.4000115
7S40.4Very low37.6Very low107 Ų107133.7 Ų133.775%0.74878%0.783SS**  trans-50.6127.3167.347.60000114.7
8H34.9Very low37.3Very low156 Ų156136.7 Ų136.772%0.72279%0.785SS**  trans-12893.3157.6-78.1-73.5000109.8F10H8-F10 PolarHBondContact O-N 3.19Å
9L37.1Very low37.2Very low177 Ų177133.7 Ų133.793%0.92777%0.769SS**  trans-7499.9157.8-84.4156.4000107.1S11L9-S11 PolarHBondContact O-N 3.32Å
10F37.7Very low37.3Very low176 Ų176131.3 Ų131.377%0.77276%0.761SS**  trans-75.1101.1167-105.5-89.6000108.5H8 L12H8-F10 PolarHBondContact O-N 3.19Å; F10-L12 PolarHBondContact O-N 3.17Å
11S37.2Very low37.5Very low104 Ų104128.3 Ų128.373%0.72775%0.751SS**  trans-7299.2167.3-170.40000108.5L9 C13L9-S11 PolarHBondContact O-N 3.32Å; S11-C13 PolarHBondContact O-N 3.21Å
12L38.8Very low38Very low143 Ų143117.4 Ų117.475%0.74970%0.699SS**  trans-76.794.7166.9-112.998.4000108.4F10 L14F10-L12 PolarHBondContact O-N 3.17Å; L12-L14 PolarHBondContact O-N 3.11Å; L12-L14 VanDerWaalsContact O-N 3.11Å
13C36.1Very low38.7Very low108 Ų108116.9 Ų116.973%0.7368%0.682SS**  trans-69.298.8161.6-77.70000108.6S11 L15S11-C13 PolarHBondContact O-N 3.21Å; C13-L15 VanDerWaalsContact C-N 3.33Å; C13-L15 PolarHBondContact O-N 3.01Å
14L34.8Very low39Very low160 Ų160114.3 Ų114.384%0.83867%0.667SS**  trans-6892.7162.7-88.1152.2000108.3L12 A16L12-L14 PolarHBondContact O-N 3.11Å; L12-L14 VanDerWaalsContact O-N 3.11Å; L14-A16 VanDerWaalsContact C-N 3.29Å; L14-A16 PolarHBondContact O-N 3.03Å
15L36.8Very low40Very low154 Ų154110.8 Ų110.881%0.80664%0.639SS**  trans-67.193.4160.5-87.7152.7000107.4C13 V17C13-L15 VanDerWaalsContact C-N 3.33Å; C13-L15 PolarHBondContact O-N 3.01Å; L15-V17 VanDerWaalsContact C-N 3.29Å; L15-V17 PolarHBondContact O-N 2.97Å
16A34.4Very low41Very low73 Ų73105.1 Ų105.160%0.60360%0.602SS**  trans-67.292.7164.400000107.9L14 F18L14-A16 VanDerWaalsContact C-N 3.29Å; L14-A16 PolarHBondContact O-N 3.03Å; A16-F18 VanDerWaalsContact C-N 3.31Å; A16-F18 HydrophobicContact CB-CD2 4.42Å; A16-F18 HydrophobicContact CB-CE2 4.21Å; A16-F18 PolarHBondContact O-N 3.02Å
17V35Very low41.8Very low117 Ų117105.7 Ų105.771%0.70960%0.597SS**  trans-69.896.8164.7-178.80000106L15 V19L15-V17 VanDerWaalsContact C-N 3.29Å; L15-V17 PolarHBondContact O-N 2.97Å; V17-V19 HydrophobicContact CG1-CG2 3.93Å; V17-V19 PolarHBondContact O-N 3.43Å
18F31.9Very low42.9Very low188 Ų188110.1 Ų110.183%0.82560%0.603SS**  trans-66.489.7163.8-78-86.2000107.1A16 S20A16-F18 VanDerWaalsContact C-N 3.31Å; A16-F18 HydrophobicContact CB-CD2 4.42Å; A16-F18 HydrophobicContact CB-CE2 4.21Å; A16-F18 PolarHBondContact O-N 3.02Å; F18-S20 PolarHBondContact O-N 3.35Å
19V36.6Very low44.9Very low80 Ų80104.4 Ų104.449%0.48558%0.575SS.*  trans-66.196.5161.6-177.40000105V17 A21V17-V19 HydrophobicContact CG1-CG2 3.93Å; V17-V19 PolarHBondContact O-N 3.43Å; V19-A21 VanDerWaalsContact C-N 3.29Å; V19-A21 PolarHBondContact O-N 3.07Å
20S38.7Very low46.8Very low85 Ų8597.8 Ų97.859%0.59454%0.543SS*.  trans-57.6100.2166.917.60000106.9F18 V22F18-S20 PolarHBondContact O-N 3.35Å; S20-V22 PolarHBondContact O-N 2.9Å
21A40.6Very low48.8Very low68 Ų6891.7 Ų91.756%0.56252%0.517SS*.  trans-56.8117172.600000107V19 N23V19-A21 VanDerWaalsContact C-N 3.29Å; V19-A21 PolarHBondContact O-N 3.07Å; A21-N23 VanDerWaalsContact C-N 3.32Å; A21-N23 PolarHBondContact O-N 2.93Å; A21-N23 PolarHBondContact O-OD1 2.85Å
22V49.1Very low50.8Low16 Ų1697.6 Ų97.610%0.09752%0.523CS..  trans-66.6102.7167-178.10000105.7S20 A159 L198S20-V22 PolarHBondContact O-N 2.9Å; V22-A159 HydrophobicContact CG2-CB 3.51Å; V22-L198 HydrophobicContact CG1-CD2 4.31Å
23N48.9Very low52.9Low90 Ų9094.8 Ų94.848%0.48152%0.515SS..  trans-60.7144.3170.8-74.416.4000108.8A21 E27A21-N23 VanDerWaalsContact C-N 3.32Å; A21-N23 PolarHBondContact O-N 2.93Å; A21-N23 PolarHBondContact O-OD1 2.85Å; N23-E27 VanDerWaalsContact CA-OE1 3.25Å; N23-E27 WeakPolarHBondContact CA-OE1 3.37Å; N23-E27 HydrophobicContact CB-CG 4.35Å; N23-E27 WeakPolarHBondContact CB-OE1 3.3Å; N23-E27 WeakPolarHBondContact CB-OE2 3.36Å; N23-E27 PolarHBondContact ND2-OE2 2.85Å
24S54.8Low55.4Low66 Ų6690.4 Ų90.446%0.46248%0.484SS..  trans-60.3144.2174.174.90000109.6Y26 E27S24-Y26 PolarHBondContact O-N 3.28Å; S24-E27 PolarHBondContact N-OE1 3.15Å; S24-E27 PolarHBondContact O-N 3.26Å; S24-E27 VanDerWaalsContact O-N 3.11Å; S24-E27 WeakPolarHBondContact OG-CG 3.33Å
25Q56.1Low57.9Low23 Ų2384.9 Ų84.911%0.10746%0.457CS..THydrogen-bonded Turntrans-51.4-21.6-173.5-177.264.520.400113.6L69 L198Q25-L69 HydrophobicContact CG-CD1 4.47Å; Q25-L198 HydrophobicContact CB-CB 4.1Å; Q25-L198 HydrophobicContact CB-CD2 4.48Å
26Y60.9Low60.3Low18 Ų1888.1 Ų88.17%0.07146%0.459CS..THydrogen-bonded Turntrans-117.516.4-173.1-57.8-76.1000115S24 K28 Y29 R70 R73 E199S24-Y26 PolarHBondContact O-N 3.28Å; Y26-K28 PolarHBondContact O-N 2.95Å; Y26-Y29 HydrophobicContact CD1-CG 4.35Å; Y26-Y29 VanDerWaalsContact O-CB 3.29Å; Y26-Y29 WeakPolarHBondContact O-CB 3.38Å; Y26-Y29 PolarHBondContact O-N 3.25Å; Y26-R70 HydrophobicContact CD1-CG 4.33Å; Y26-R70 HydrophobicContact CE1-CG 4.32Å; Y26-R73 HydrophobicContact CE1-CB 3.86Å; Y26-R73 HydrophobicContact CE1-CG 4.26Å; Y26-R73 VanDerWaalsContact CE2-NH1 3.31Å; Y26-E199 WeakPolarHBondContact CE2-OE1 3.01Å; Y26-E199 PolarHBondContact OH-OE1 2.8Å
27E58Low62.9Low110 Ų11092.1 Ų92.151%0.51447%0.465SS..THydrogen-bonded Turntrans-57.2-28.8-178.7-80.3-179-165.300114.6N23 S24N23-E27 VanDerWaalsContact CA-OE1 3.25Å; N23-E27 WeakPolarHBondContact CA-OE1 3.37Å; N23-E27 HydrophobicContact CB-CG 4.35Å; N23-E27 WeakPolarHBondContact CB-OE1 3.3Å; N23-E27 WeakPolarHBondContact CB-OE2 3.36Å; N23-E27 PolarHBondContact ND2-OE2 2.85Å; S24-E27 PolarHBondContact N-OE1 3.15Å; S24-E27 PolarHBondContact O-N 3.26Å; S24-E27 VanDerWaalsContact O-N 3.11Å; S24-E27 WeakPolarHBondContact OG-CG 3.33Å
28K62.4Low65.5Low201 Ų20188.2 Ų88.287%0.87444%0.439SS*.THydrogen-bonded Turntrans-99.20.3177.5-62.4-178.7-178.4176.30113.5Y26Y26-K28 PolarHBondContact O-N 2.95Å
29Y77.7Confident68.4Low36 Ų3681.3 Ų81.314%0.14141%0.41CS..  trans-73.9136.6179.5170.9-96.1000110.4Y26 F31 F34 R73 L74 D77Y26-Y29 HydrophobicContact CD1-CG 4.35Å; Y26-Y29 VanDerWaalsContact O-CB 3.29Å; Y26-Y29 WeakPolarHBondContact O-CB 3.38Å; Y26-Y29 PolarHBondContact O-N 3.25Å; Y29-F31 HydrophobicContact CE1-CB 4.41Å; Y29-F34 HydrophobicContact CD2-CD2 4.27Å; Y29-F34 HydrophobicContact CD2-CE2 4.39Å; Y29-F34 HydrophobicContact CE2-CD2 4.09Å; Y29-F34 HydrophobicContact CE2-CE2 4.34Å; Y29-R73 HydrophobicContact CE1-CG 4.06Å; Y29-R73 HydrophobicContact CE2-CB 4.32Å; Y29-R73 HydrophobicContact CE2-CG 4.18Å; Y29-L74 HydrophobicContact CE2-CB 4.21Å; Y29-L74 WeakPolarHBondContact OH-CA 3.5Å; Y29-D77 WeakPolarHBondContact CE1-OD2 2.93Å; Y29-D77 VanDerWaalsContact CZ-OD2 3.23Å; Y29-D77 WeakPolarHBondContact OH-CB 3.32Å; Y29-D77 PolarHBondContact OH-OD2 3.04Å
30S76.7Confident71.2Confident38 Ų3880 Ų8027%0.26640%0.4SS..  trans-145.1117.81711680000109R32 S33 F34S30-R32 PolarHBondContact O-N 3.26Å; S30-R32 PolarHBondContact OG-N 3.32Å; S30-S33 WeakPolarHBondContact CB-OG 3.45Å; S30-S33 CarbonylContact O-C 3.46Å; S30-S33 PolarHBondContact O-N 3.22Å; S30-S33 VanDerWaalsContact O-N 3.13Å; S30-S33 PolarHBondContact OG-N 3.43Å; S30-S33 VanDerWaalsContact OG-N 3.15Å; S30-S33 PolarHBondContact OG-OG 2.99Å; S30-F34 PolarHBondContact O-N 3.38Å
31F78.6Confident73.9Confident48 Ų4877.3 Ų77.321%0.21138%0.38CS..THydrogen-bonded Turntrans-51.2-38.8172.3167.9-107.2000112.3Y29 L74 D77 S78 F81 L123Y29-F31 HydrophobicContact CE1-CB 4.41Å; F31-L74 HydrophobicContact CD2-CD1 4.29Å; F31-D77 HydrophobicContact CD2-CB 3.92Å; F31-S78 WeakPolarHBondContact CE2-OG 3.26Å; F31-F81 HydrophobicContact CE1-CB 4.4Å; F31-F81 HydrophobicContact CE1-CD2 4.02Å; F31-F81 HydrophobicContact CE1-CE2 4.43Å; F31-F81 HydrophobicContact CE1-CG 4.05Å; F31-F81 HydrophobicContact CZ-CB 3.92Å; F31-F81 HydrophobicContact CZ-CD1 4.08Å; F31-F81 HydrophobicContact CZ-CD2 4.28Å; F31-F81 AromaticContact CZ-CG 3.83Å; F31-F81 HydrophobicContact CZ-CG 3.83Å; F31-L123 HydrophobicContact CE2-CD1 4.37Å; F31-L123 HydrophobicContact CE2-CD2 4.41Å; F31-L123 HydrophobicContact CZ-CD1 4.06Å; F31-L123 HydrophobicContact CZ-CD2 3.83Å
32R79.5Confident76.5Confident227 Ų22774.4 Ų74.486%0.85736%0.355SS*.THydrogen-bonded Turntrans-81.1-23.8-177.7-66.3-174.9177.4179.2-0.5113.7S30S30-R32 PolarHBondContact O-N 3.26Å; S30-R32 PolarHBondContact OG-N 3.32Å
33S84.4Confident78.8Confident84 Ų8475.6 Ų75.659%0.58736%0.36SS*.SBendtrans-135.749.1-172.365.20000111.5S30S30-S33 WeakPolarHBondContact CB-OG 3.45Å; S30-S33 CarbonylContact O-C 3.46Å; S30-S33 PolarHBondContact O-N 3.22Å; S30-S33 VanDerWaalsContact O-N 3.13Å; S30-S33 PolarHBondContact OG-N 3.43Å; S30-S33 VanDerWaalsContact OG-N 3.15Å; S30-S33 PolarHBondContact OG-OG 2.99Å
34F86.7Confident81Confident17 Ų1774.6 Ų74.68%0.07536%0.359CS..  trans-64.1133.8176.4-166.4-84.9000110.6Y29 S30 R36 E38 L39 R70 L71 L74Y29-F34 HydrophobicContact CD2-CD2 4.27Å; Y29-F34 HydrophobicContact CD2-CE2 4.39Å; Y29-F34 HydrophobicContact CE2-CD2 4.09Å; Y29-F34 HydrophobicContact CE2-CE2 4.34Å; S30-F34 PolarHBondContact O-N 3.38Å; F34-R36 PolarHBondContact O-N 3.39Å; F34-E38 HydrophobicContact CE1-CB 3.84Å; F34-E38 HydrophobicContact CZ-CB 4.31Å; F34-L39 HydrophobicContact CD1-CD2 3.56Å; F34-L39 HydrophobicContact CD1-CG 3.71Å; F34-L39 HydrophobicContact CE1-CD2 3.81Å; F34-L39 HydrophobicContact CE1-CG 4.02Å; F34-L39 HydrophobicContact CG-CD2 4.41Å; F34-R70 HydrophobicContact CE2-CB 3.99Å; F34-R70 HydrophobicContact CZ-CB 4.26Å; F34-L71 HydrophobicContact CE1-CD2 3.93Å; F34-L71 HydrophobicContact CZ-CD2 3.72Å; F34-L71 HydrophobicContact CZ-CG 4.19Å; F34-L74 HydrophobicContact CB-CD1 4.09Å; F34-L74 HydrophobicContact CB-CD2 4.22Å; F34-L74 HydrophobicContact CD1-CD2 3.98Å; F34-L74 HydrophobicContact CD2-CB 4Å; F34-L74 HydrophobicContact CD2-CD1 3.95Å; F34-L74 HydrophobicContact CD2-CD2 3.74Å; F34-L74 HydrophobicContact CD2-CG 4.09Å; F34-L74 HydrophobicContact CE1-CD2 4.26Å; F34-L74 HydrophobicContact CE2-CB 3.98Å; F34-L74 HydrophobicContact CE2-CD2 4.02Å; F34-L74 HydrophobicContact CE2-CG 4.44Å; F34-L74 HydrophobicContact CG-CD1 4.19Å; F34-L74 HydrophobicContact CG-CD2 3.7Å; F34-L74 HydrophobicContact CG-CG 4.42Å; F34-L74 HydrophobicContact CZ-CD2 4.28Å
35P88.3Confident83.1Confident43 Ų4371.4 Ų71.428%0.27934%0.337SS..  trans-60.9122.7-177.4-2232.6000112.4H37 E38 L39P35-H37 VanDerWaalsContact C-N 3.26Å; P35-H37 PolarHBondContact O-N 2.61Å; P35-E38 HydrophobicContact CB-CB 4.32Å; P35-E38 HydrophobicContact CB-CG 4.06Å; P35-E38 PolarHBondContact O-N 3.47Å; P35-E38 VanDerWaalsContact O-N 3.11Å; P35-L39 PolarHBondContact O-N 3.05Å
36R86.9Confident85.1Confident223 Ų22370.6 Ų70.684%0.84233%0.333SS*.G310 helixtrans-63-29.8-175.6-69-174.7-177.1178.31.8114.1F34 E38 L39F34-R36 PolarHBondContact O-N 3.39Å; R36-E38 VanDerWaalsContact C-N 3.28Å; R36-L39 PolarHBondContact O-N 3.32Å
37H89Confident86.8Confident156 Ų15674.9 Ų74.972%0.72235%0.352SS*.G310 helixtrans-75.3-18.8179.763.9-86.2000112.8P35P35-H37 VanDerWaalsContact C-N 3.26Å; P35-H37 PolarHBondContact O-N 2.61Å
38E90.3Very high88.7Confident36 Ų3674 Ų7417%0.16835%0.345CS..G310 helixtrans-91.7-7.5175.1-62-178-154.300112.3F34 P35 R36 M40 V67 R70F34-E38 HydrophobicContact CE1-CB 3.84Å; F34-E38 HydrophobicContact CZ-CB 4.31Å; P35-E38 HydrophobicContact CB-CB 4.32Å; P35-E38 HydrophobicContact CB-CG 4.06Å; P35-E38 PolarHBondContact O-N 3.47Å; P35-E38 VanDerWaalsContact O-N 3.11Å; R36-E38 VanDerWaalsContact C-N 3.28Å; E38-M40 PolarHBondContact O-N 3.4Å; E38-V67 HydrophobicContact CB-CG1 4.49Å; E38-R70 VanDerWaalsContact CD-NH2 3.32Å; E38-R70 IonicContact OE1-NH2 2.99Å; E38-R70 IonicContact OE2-CZ 3.76Å; E38-R70 VanDerWaalsContact OE2-CZ 3.23Å; E38-R70 IonicContact OE2-NE 3.23Å; E38-R70 PolarHBondContact OE2-NE 2.88Å; E38-R70 IonicContact OE2-NH2 3.53Å; E38-R70 PolarHBondContact OE2-NH2 3.2Å
39L92.4Very high90.4Very high42 Ų4264.5 Ų64.522%0.2230%0.303CS..  trans-72113179.3-78.4171.2000110.8F34 P35 R36 L71 L74 P124F34-L39 HydrophobicContact CD1-CD2 3.56Å; F34-L39 HydrophobicContact CD1-CG 3.71Å; F34-L39 HydrophobicContact CE1-CD2 3.81Å; F34-L39 HydrophobicContact CE1-CG 4.02Å; F34-L39 HydrophobicContact CG-CD2 4.41Å; P35-L39 PolarHBondContact O-N 3.05Å; R36-L39 PolarHBondContact O-N 3.32Å; L39-L71 HydrophobicContact CD2-CD2 4.49Å; L39-L74 HydrophobicContact CD2-CD2 3.64Å; L39-P124 HydrophobicContact CD1-CB 3.83Å; L39-P124 HydrophobicContact CD2-CB 4.05Å
40M94.7Very high91.4Very high53 Ų5364.5 Ų64.526%0.26131%0.306SS..SBendtrans-154169.4172.658.2-179.560.700109.7E38 L42 A45 Y64 L71E38-M40 PolarHBondContact O-N 3.4Å; M40-L42 PolarHBondContact O-N 3.3Å; M40-A45 HydrophobicContact CG-CB 4.05Å; M40-A45 HydrophobicContact SD-CB 3.77Å; M40-Y64 HydrophobicContact CE-CE1 4.45Å; M40-Y64 HydrophobicContact SD-CE1 4.02Å; M40-L71 HydrophobicContact CG-CD1 3.74Å; M40-L71 WeakPolarHBondContact O-CD1 3.49Å
41P96.1Very high92.4Very high28 Ų2867.1 Ų67.118%0.18232%0.317CS..  trans-58.8130.5173.6-25.836.3000112.1E43 S44 A45 Q128 S129P41-E43 VanDerWaalsContact C-N 3.3Å; P41-E43 PolarHBondContact O-N 3.37Å; P41-S44 PolarHBondContact O-N 2.92Å; P41-S44 VanDerWaalsContact O-N 3.16Å; P41-A45 PolarHBondContact O-N 2.88Å; P41-Q128 HydrophobicContact CG-CB 4.46Å; P41-S129 VanDerWaalsContact CB-OG 3.3Å; P41-S129 WeakPolarHBondContact CB-OG 3.44Å; P41-S129 WeakPolarHBondContact CG-OG 3.34Å
42L95.8Very high93.4Very high7 Ų765.7 Ų65.74%0.03731%0.311CS..Hα-helixtrans-52.6-49.7179.6171.861.4000111.6M40 S44 A45 Y46 S68 L71 Y72 P131 T135 I136 F139M40-L42 PolarHBondContact O-N 3.3Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.2Å; L42-A45 PolarHBondContact O-N 3.48Å; L42-Y46 WeakPolarHBondContact O-CB 3.43Å; L42-Y46 PolarHBondContact O-N 3.49Å; L42-S68 WeakPolarHBondContact CD1-O 3.31Å; L42-L71 HydrophobicContact CB-CB 4.43Å; L42-L71 HydrophobicContact CD1-CB 3.94Å; L42-Y72 HydrophobicContact CD2-CD2 4.06Å; L42-Y72 HydrophobicContact CD2-CG 4.48Å; L42-P131 HydrophobicContact CB-CB 4.36Å; L42-P131 HydrophobicContact CD2-CB 4.07Å; L42-P131 HydrophobicContact CD2-CG 3.99Å; L42-P131 HydrophobicContact CG-CB 4.44Å; L42-T135 HydrophobicContact CD2-CG2 4.28Å; L42-T135 HydrophobicContact CG-CG2 4.27Å; L42-I136 HydrophobicContact CD2-CD1 4.26Å; L42-F139 HydrophobicContact CD1-CE1 3.97Å; L42-F139 HydrophobicContact CD1-CE2 4.3Å; L42-F139 HydrophobicContact CD1-CZ 3.7Å; L42-F139 HydrophobicContact CG-CZ 4.48Å
43E95.8Very high94.3Very high42 Ų4257.5 Ų57.520%0.19628%0.28CS..Hα-helixtrans-63.3-37-177.3-175.5169.2-173.300112.1P41 K47 P131 S132P41-E43 VanDerWaalsContact C-N 3.3Å; P41-E43 PolarHBondContact O-N 3.37Å; E43-K47 HydrophobicContact CG-CD 4.03Å; E43-K47 HydrophobicContact CG-CG 4.46Å; E43-K47 WeakPolarHBondContact O-CB 3.3Å; E43-K47 WeakPolarHBondContact O-CG 3.5Å; E43-K47 PolarHBondContact O-N 3.06Å; E43-K47 VanDerWaalsContact OE1-CE 3.27Å; E43-K47 WeakPolarHBondContact OE1-CE 3.37Å; E43-K47 IonicContact OE1-NZ 3.56Å; E43-K47 PolarHBondContact OE1-NZ 3.3Å; E43-P131 HydrophobicContact CB-CB 4.32Å; E43-S132 PolarHBondContact OE2-N 3.4Å
44S97Very high94.9Very high68 Ų6858.9 Ų58.948%0.47629%0.285SS..Hα-helixtrans-67-44.9175.6-580000112P41 L42 Y46 Y48P41-S44 PolarHBondContact O-N 2.92Å; P41-S44 VanDerWaalsContact O-N 3.16Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.2Å; S44-Y46 VanDerWaalsContact C-N 3.32Å; S44-Y46 PolarHBondContact O-N 3.49Å; S44-Y48 VanDerWaalsContact O-CB 3.29Å; S44-Y48 WeakPolarHBondContact O-CB 3.48Å; S44-Y48 PolarHBondContact O-N 3.12Å
45A97.4Very high95.4Very high0 Ų060.7 Ų60.70%030%0.303CS..Hα-helixtrans-61.5-44177.300000111.3M40 P41 L42 G49 Y64 L71M40-A45 HydrophobicContact CG-CB 4.05Å; M40-A45 HydrophobicContact SD-CB 3.77Å; P41-A45 PolarHBondContact O-N 2.88Å; L42-A45 PolarHBondContact O-N 3.48Å; A45-G49 PolarHBondContact O-N 3.04Å; A45-Y64 HydrophobicContact CB-CD1 4.37Å; A45-L71 HydrophobicContact CB-CD1 3.89Å
46Y98.1Very high95.8Very high6 Ų665.1 Ų65.12%0.02432%0.32CS..Hα-helixtrans-66.4-51.4-178.9-177.7-130.8000112.4L42 S44 Y48 G49 L50 L65 T135 E138 F139 P144L42-Y46 WeakPolarHBondContact O-CB 3.43Å; L42-Y46 PolarHBondContact O-N 3.49Å; S44-Y46 VanDerWaalsContact C-N 3.32Å; S44-Y46 PolarHBondContact O-N 3.49Å; Y46-Y48 VanDerWaalsContact C-N 3.32Å; Y46-Y48 PolarHBondContact O-N 3.42Å; Y46-G49 PolarHBondContact O-N 2.84Å; Y46-G49 VanDerWaalsContact O-N 3.11Å; Y46-L50 HydrophobicContact CD1-CD1 4.39Å; Y46-L50 HydrophobicContact CD2-CG 4.37Å; Y46-L50 HydrophobicContact CE1-CD1 3.88Å; Y46-L50 HydrophobicContact CE2-CD1 4.08Å; Y46-L50 HydrophobicContact CE2-CD2 4Å; Y46-L50 HydrophobicContact CE2-CG 4.01Å; Y46-L50 PolarHBondContact O-N 3.06Å; Y46-L65 HydrophobicContact CD2-CD2 3.64Å; Y46-L65 HydrophobicContact CE2-CD2 3.76Å; Y46-T135 HydrophobicContact CD1-CG2 4.13Å; Y46-E138 WeakPolarHBondContact CE1-OE2 3.38Å; Y46-E138 PolarHBondContact OH-OE2 3.2Å; Y46-F139 AromaticContact CD1-CE2 3.81Å; Y46-F139 HydrophobicContact CD1-CE2 3.81Å; Y46-F139 AromaticContact CD2-CE2 3.92Å; Y46-F139 HydrophobicContact CD2-CE2 3.92Å; Y46-F139 AromaticContact CD2-CZ 3.94Å; Y46-F139 HydrophobicContact CD2-CZ 3.94Å; Y46-F139 HydrophobicContact CE1-CE2 4.13Å; Y46-F139 HydrophobicContact CE2-CE2 4.25Å; Y46-F139 HydrophobicContact CE2-CZ 4.49Å; Y46-F139 AromaticContact CG-CE2 3.69Å; Y46-F139 HydrophobicContact CG-CE2 3.69Å; Y46-F139 AromaticContact CG-CZ 3.97Å; Y46-F139 HydrophobicContact CG-CZ 3.97Å; Y46-P144 HydrophobicContact CE2-CB 4.39Å; Y46-P144 HydrophobicContact CE2-CG 4.03Å
47K97.9Very high96.4Very high107 Ų10759.2 Ų59.247%0.46530%0.301SS..Hα-helixtrans-57.9-44.1177.4-74.6178.9177.71730111.9E43 G49 L50 D51E43-K47 HydrophobicContact CG-CD 4.03Å; E43-K47 HydrophobicContact CG-CG 4.46Å; E43-K47 WeakPolarHBondContact O-CB 3.3Å; E43-K47 WeakPolarHBondContact O-CG 3.5Å; E43-K47 PolarHBondContact O-N 3.06Å; E43-K47 VanDerWaalsContact OE1-CE 3.27Å; E43-K47 WeakPolarHBondContact OE1-CE 3.37Å; E43-K47 IonicContact OE1-NZ 3.56Å; E43-K47 PolarHBondContact OE1-NZ 3.3Å; K47-G49 VanDerWaalsContact C-N 3.33Å; K47-G49 PolarHBondContact O-N 3.45Å; K47-L50 PolarHBondContact O-N 3.25Å; K47-D51 VanDerWaalsContact O-CG 3.31Å; K47-D51 PolarHBondContact O-N 3.05Å
48Y98.2Very high96.8Very high93 Ų9354 Ų5437%0.36528%0.275SS..Hα-helixtrans-61.1-41176.7-176.1-90.9000112.4S44 Y46 L50 D51 Q52 Y64S44-Y48 VanDerWaalsContact O-CB 3.29Å; S44-Y48 WeakPolarHBondContact O-CB 3.48Å; S44-Y48 PolarHBondContact O-N 3.12Å; Y46-Y48 VanDerWaalsContact C-N 3.32Å; Y46-Y48 PolarHBondContact O-N 3.42Å; Y48-L50 VanDerWaalsContact C-N 3.33Å; Y48-L50 PolarHBondContact O-N 2.94Å; Y48-D51 PolarHBondContact O-N 3.12Å; Y48-Q52 HydrophobicContact CD1-CG 4Å; Y48-Q52 HydrophobicContact CE1-CG 3.55Å; Y48-Q52 WeakPolarHBondContact O-CG 3.41Å; Y48-Q52 PolarHBondContact O-N 3.13Å; Y48-Y64 AromaticContact CD1-CD1 3.46Å; Y48-Y64 HydrophobicContact CD1-CD1 3.46Å; Y48-Y64 VanDerWaalsContact CD1-CD1 3.46Å; Y48-Y64 AromaticContact CD1-CD2 3.48Å; Y48-Y64 HydrophobicContact CD1-CD2 3.48Å; Y48-Y64 VanDerWaalsContact CD1-CD2 3.48Å; Y48-Y64 AromaticContact CD1-CE1 3.48Å; Y48-Y64 HydrophobicContact CD1-CE1 3.48Å; Y48-Y64 VanDerWaalsContact CD1-CE1 3.48Å; Y48-Y64 AromaticContact CD1-CE2 3.52Å; Y48-Y64 HydrophobicContact CD1-CE2 3.52Å; Y48-Y64 AromaticContact CD1-CG 3.44Å; Y48-Y64 HydrophobicContact CD1-CG 3.44Å; Y48-Y64 VanDerWaalsContact CD1-CG 3.44Å; Y48-Y64 AromaticContact CD1-CZ 3.49Å; Y48-Y64 VanDerWaalsContact CD1-CZ 3.49Å; Y48-Y64 HydrophobicContact CE1-CD1 4.23Å; Y48-Y64 AromaticContact CE1-CD2 3.49Å; Y48-Y64 HydrophobicContact CE1-CD2 3.49Å; Y48-Y64 VanDerWaalsContact CE1-CD2 3.49Å; Y48-Y64 AromaticContact CE1-CE1 3.99Å; Y48-Y64 HydrophobicContact CE1-CE1 3.99Å; Y48-Y64 AromaticContact CE1-CE2 3.22Å; Y48-Y64 HydrophobicContact CE1-CE2 3.22Å; Y48-Y64 AromaticContact CE1-CG 3.98Å; Y48-Y64 HydrophobicContact CE1-CG 3.98Å; Y48-Y64 AromaticContact CE1-CZ 3.47Å; Y48-Y64 VanDerWaalsContact CE1-CZ 3.47Å; Y48-Y64 HydrophobicContact CG-CD1 4.18Å; Y48-Y64 HydrophobicContact CG-CE1 4.08Å; Y48-Y64 HydrophobicContact CG-CG 4.5Å
49G98Very high97Very high0 Ų059.3 Ų59.30%030%0.299CS..Hα-helixtrans-61.2-39.1175.100000113.1A45 Y46 K47 Y53 T61A45-G49 PolarHBondContact O-N 3.04Å; Y46-G49 PolarHBondContact O-N 2.84Å; Y46-G49 VanDerWaalsContact O-N 3.11Å; K47-G49 VanDerWaalsContact C-N 3.33Å; K47-G49 PolarHBondContact O-N 3.45Å; G49-Y53 PolarHBondContact O-N 3.24Å; G49-T61 PolarHBondContact O-OG1 3.44Å
50L98.3Very high97.2Very high37 Ų3760.8 Ų60.819%0.19431%0.305CS..Hα-helixtrans-69-41174.4-63.7-178.7000112.2Y46 K47 Y48 Q52 Y53 T54 L65 Y147Y46-L50 HydrophobicContact CD1-CD1 4.39Å; Y46-L50 HydrophobicContact CD2-CG 4.37Å; Y46-L50 HydrophobicContact CE1-CD1 3.88Å; Y46-L50 HydrophobicContact CE2-CD1 4.08Å; Y46-L50 HydrophobicContact CE2-CD2 4Å; Y46-L50 HydrophobicContact CE2-CG 4.01Å; Y46-L50 PolarHBondContact O-N 3.06Å; K47-L50 PolarHBondContact O-N 3.25Å; Y48-L50 VanDerWaalsContact C-N 3.33Å; Y48-L50 PolarHBondContact O-N 2.94Å; L50-Q52 VanDerWaalsContact C-N 3.31Å; L50-Q52 PolarHBondContact O-N 3.47Å; L50-Y53 WeakPolarHBondContact O-CA 3.32Å; L50-Y53 VanDerWaalsContact O-CB 3.31Å; L50-Y53 WeakPolarHBondContact O-CB 3.38Å; L50-Y53 PolarHBondContact O-N 3.03Å; L50-T54 WeakPolarHBondContact O-CG2 3.19Å; L50-T54 PolarHBondContact O-N 2.66Å; L50-L65 HydrophobicContact CD2-CD2 4.48Å; L50-Y147 HydrophobicContact CD2-CD1 3.98Å; L50-Y147 HydrophobicContact CD2-CD2 3.68Å; L50-Y147 HydrophobicContact CD2-CE1 4.02Å; L50-Y147 HydrophobicContact CD2-CE2 3.72Å; L50-Y147 HydrophobicContact CD2-CG 3.81Å
51D98.3Very high97.4Very high93 Ų9358.2 Ų58.250%0.49729%0.293SS..Hα-helixtrans-59.4-44.6174.7-67.7-22.7000110.5K47 Y48 Y53 T54 A55K47-D51 VanDerWaalsContact O-CG 3.31Å; K47-D51 PolarHBondContact O-N 3.05Å; Y48-D51 PolarHBondContact O-N 3.12Å; D51-Y53 VanDerWaalsContact C-N 3.29Å; D51-Y53 PolarHBondContact O-N 3.23Å; D51-T54 PolarHBondContact O-N 2.73Å; D51-T54 PolarHBondContact O-OG1 3.24Å; D51-A55 PolarHBondContact O-N 3.05Å
52Q98.2Very high97.4Very high18 Ų1857.9 Ų57.98%0.08429%0.29CS..Hα-helixtrans-65.4-33175.4-62.7-29.3-72.400112.2Y48 L50 A55 E56 K57 E60Y48-Q52 HydrophobicContact CD1-CG 4Å; Y48-Q52 HydrophobicContact CE1-CG 3.55Å; Y48-Q52 WeakPolarHBondContact O-CG 3.41Å; Y48-Q52 PolarHBondContact O-N 3.13Å; L50-Q52 VanDerWaalsContact C-N 3.31Å; L50-Q52 PolarHBondContact O-N 3.47Å; Q52-A55 CarbonylContact O-C 3.44Å; Q52-A55 PolarHBondContact O-N 3.41Å; Q52-E56 PolarHBondContact O-N 2.98Å; Q52-E56 VanDerWaalsContact O-N 3.13Å; Q52-K57 HydrophobicContact CB-CB 4.13Å; Q52-K57 PolarHBondContact O-N 2.94Å; Q52-K57 VanDerWaalsContact OE1-NZ 3.15Å; Q52-E60 HydrophobicContact CB-CB 4.23Å; Q52-E60 HydrophobicContact CG-CB 3.9Å
53Y97.9Very high97.4Very high55 Ų5563.1 Ų63.122%0.21631%0.314CS..Hα-helixtrans-63-44.8175.3-179.3-80.8000110.4G49 L50 D51 A55 E56 W58 T61 Y147 Y150G49-Y53 PolarHBondContact O-N 3.24Å; L50-Y53 WeakPolarHBondContact O-CA 3.32Å; L50-Y53 VanDerWaalsContact O-CB 3.31Å; L50-Y53 WeakPolarHBondContact O-CB 3.38Å; L50-Y53 PolarHBondContact O-N 3.03Å; D51-Y53 VanDerWaalsContact C-N 3.29Å; D51-Y53 PolarHBondContact O-N 3.23Å; Y53-A55 VanDerWaalsContact C-N 3.27Å; Y53-A55 PolarHBondContact O-N 2.95Å; Y53-E56 PolarHBondContact O-N 2.99Å; Y53-E56 VanDerWaalsContact O-N 3.12Å; Y53-W58 HydrophobicContact CD2-CZ3 4.04Å; Y53-W58 HydrophobicContact CE2-CZ3 4.03Å; Y53-W58 HydrophobicContact CG-CZ3 4.44Å; Y53-T61 WeakPolarHBondContact CA-OG1 3.5Å; Y53-T61 HydrophobicContact CD2-CG2 3.88Å; Y53-T61 HydrophobicContact CG-CG2 4.41Å; Y53-T61 PolarHBondContact N-OG1 3.36Å; Y53-Y147 HydrophobicContact CD1-CD1 4.13Å; Y53-Y147 HydrophobicContact CD2-CD1 4.11Å; Y53-Y147 HydrophobicContact CE1-CD1 4.05Å; Y53-Y147 HydrophobicContact CE2-CD1 4.04Å; Y53-Y147 HydrophobicContact CG-CD1 4.18Å; Y53-Y150 AromaticContact CE2-CD1 3.89Å; Y53-Y150 HydrophobicContact CE2-CD1 3.89Å; Y53-Y150 AromaticContact CZ-CD1 3.8Å; Y53-Y150 VanDerWaalsContact OH-CD1 3.24Å; Y53-Y150 WeakPolarHBondContact OH-CD1 3.25Å
54T97.8Very high97.4Very high112 Ų11264 Ų6469%0.68732%0.316SS*.Hα-helixtrans-66.9-29.2176.764.60000112.9L50 D51 E56L50-T54 WeakPolarHBondContact O-CG2 3.19Å; L50-T54 PolarHBondContact O-N 2.66Å; D51-T54 PolarHBondContact O-N 2.73Å; D51-T54 PolarHBondContact O-OG1 3.24Å; T54-E56 VanDerWaalsContact C-N 3.26Å; T54-E56 PolarHBondContact O-N 3.05Å
55A97.8Very high97.4Very high55 Ų5560.8 Ų60.846%0.45529%0.294SS..THydrogen-bonded Turntrans-846174.600000113.8D51 Q52 Y53 K57D51-A55 PolarHBondContact O-N 3.05Å; Q52-A55 CarbonylContact O-C 3.44Å; Q52-A55 PolarHBondContact O-N 3.41Å; Y53-A55 VanDerWaalsContact C-N 3.27Å; Y53-A55 PolarHBondContact O-N 2.95Å; A55-K57 HydrophobicContact CB-CD 4.27Å; A55-K57 HydrophobicContact CB-CG 4.48Å; A55-K57 PolarHBondContact O-N 3.5Å
56E96.9Very high97.3Very high136 Ų13662.3 Ų62.364%0.63630%0.301SS*.THydrogen-bonded Turntrans57.827.3-179-55.8-169.3171.500114.8Q52 Y53 T54 W58Q52-E56 PolarHBondContact O-N 2.98Å; Q52-E56 VanDerWaalsContact O-N 3.13Å; Y53-E56 PolarHBondContact O-N 2.99Å; Y53-E56 VanDerWaalsContact O-N 3.12Å; T54-E56 VanDerWaalsContact C-N 3.26Å; T54-E56 PolarHBondContact O-N 3.05Å; E56-W58 HydrophobicContact CB-CH2 4.09Å; E56-W58 HydrophobicContact CB-CZ2 3.55Å; E56-W58 HydrophobicContact CG-CH2 4Å; E56-W58 HydrophobicContact CG-CZ2 3.73Å; E56-W58 PolarHBondContact O-N 3.45Å; E56-W58 PolarHBondContact O-NE1 3.06Å
57K98Very high97.2Very high99 Ų9962.6 Ų62.643%0.4330%0.303SS..  trans-91.777.7176.8-74.6169.9176.3-178.80110.6Q52 A55 Q59 E60 T61Q52-K57 HydrophobicContact CB-CB 4.13Å; Q52-K57 PolarHBondContact O-N 2.94Å; Q52-K57 VanDerWaalsContact OE1-NZ 3.15Å; A55-K57 HydrophobicContact CB-CD 4.27Å; A55-K57 HydrophobicContact CB-CG 4.48Å; A55-K57 PolarHBondContact O-N 3.5Å; K57-Q59 PolarHBondContact O-N 2.99Å; K57-E60 HydrophobicContact CB-CB 4.45Å; K57-E60 PolarHBondContact O-N 3.41Å; K57-T61 WeakPolarHBondContact O-CB 3.38Å; K57-T61 PolarHBondContact O-N 2.98Å; K57-T61 PolarHBondContact O-OG1 3.24Å; K57-T61 VanDerWaalsContact O-OG1 3.05Å
58W97.3Very high97.1Very high47 Ų4757.5 Ų57.518%0.17828%0.281CS..Hα-helixtrans-62.8-35.2-166.6-49.6114.7000114.8Y53 E56 V62 Y150 A151 K154 S155Y53-W58 HydrophobicContact CD2-CZ3 4.04Å; Y53-W58 HydrophobicContact CE2-CZ3 4.03Å; Y53-W58 HydrophobicContact CG-CZ3 4.44Å; E56-W58 HydrophobicContact CB-CH2 4.09Å; E56-W58 HydrophobicContact CB-CZ2 3.55Å; E56-W58 HydrophobicContact CG-CH2 4Å; E56-W58 HydrophobicContact CG-CZ2 3.73Å; E56-W58 PolarHBondContact O-N 3.45Å; E56-W58 PolarHBondContact O-NE1 3.06Å; W58-V62 WeakPolarHBondContact O-CG2 3.46Å; W58-V62 PolarHBondContact O-N 3.2Å; W58-Y150 AromaticContact CH2-CD1 3.96Å; W58-Y150 HydrophobicContact CH2-CD1 3.96Å; W58-Y150 AromaticContact CH2-CE1 3.58Å; W58-Y150 HydrophobicContact CH2-CE1 3.58Å; W58-Y150 HydrophobicContact CZ2-CE1 4.24Å; W58-Y150 AromaticContact CZ3-CD1 3.81Å; W58-Y150 HydrophobicContact CZ3-CD1 3.81Å; W58-Y150 AromaticContact CZ3-CE1 3.94Å; W58-Y150 HydrophobicContact CZ3-CE1 3.94Å; W58-A151 HydrophobicContact CE3-CB 4.21Å; W58-K154 HydrophobicContact CB-CB 4.21Å; W58-K154 HydrophobicContact CD2-CB 3.55Å; W58-K154 HydrophobicContact CD2-CG 3.87Å; W58-K154 HydrophobicContact CE3-CB 4.2Å; W58-K154 HydrophobicContact CE3-CG 4.27Å; W58-K154 HydrophobicContact CG-CB 3.51Å; W58-K154 HydrophobicContact CG-CG 4.34Å; W58-K154 HydrophobicContact CH2-CG 4.4Å; W58-K154 HydrophobicContact CZ2-CD 4.35Å; W58-K154 HydrophobicContact CZ2-CG 3.99Å; W58-S155 WeakPolarHBondContact CB-OG 3.35Å
59Q96Very high97Very high147 Ų14753.3 Ų53.369%0.68727%0.265SS*.Hα-helixtrans-68.6-46.9-179.2-69.3-174.1-9.700110.9K57 V62 E63K57-Q59 PolarHBondContact O-N 2.99Å; Q59-V62 PolarHBondContact O-N 3.47Å; Q59-E63 PolarHBondContact O-N 3.4Å
60E96.4Very high96.8Very high73 Ų7355.2 Ų55.234%0.34127%0.272SS..Hα-helixtrans-67.1-38.2178.6-63.487.1158.600111.5Q52 K57 V62 E63 Y64Q52-E60 HydrophobicContact CB-CB 4.23Å; Q52-E60 HydrophobicContact CG-CB 3.9Å; K57-E60 HydrophobicContact CB-CB 4.45Å; K57-E60 PolarHBondContact O-N 3.41Å; E60-V62 PolarHBondContact O-N 3.25Å; E60-E63 PolarHBondContact O-N 3.49Å; E60-Y64 WeakPolarHBondContact O-CD2 3.37Å; E60-Y64 PolarHBondContact O-N 3.34Å
61T97.8Very high96.6Very high0 Ų053.9 Ų53.90%027%0.265CS..Hα-helixtrans-55.9-50.1170.3-67.70000111.6G49 Y53 K57 E63 L65 A151G49-T61 PolarHBondContact O-OG1 3.44Å; Y53-T61 WeakPolarHBondContact CA-OG1 3.5Å; Y53-T61 HydrophobicContact CD2-CG2 3.88Å; Y53-T61 HydrophobicContact CG-CG2 4.41Å; Y53-T61 PolarHBondContact N-OG1 3.36Å; K57-T61 WeakPolarHBondContact O-CB 3.38Å; K57-T61 PolarHBondContact O-N 2.98Å; K57-T61 PolarHBondContact O-OG1 3.24Å; K57-T61 VanDerWaalsContact O-OG1 3.05Å; T61-E63 PolarHBondContact O-N 2.74Å; T61-L65 HydrophobicContact CG2-CD1 3.63Å; T61-L65 HydrophobicContact CG2-CG 4.26Å; T61-L65 VanDerWaalsContact O-CB 3.26Å; T61-L65 WeakPolarHBondContact O-CB 3.38Å; T61-L65 VanDerWaalsContact O-CG 3.24Å; T61-L65 WeakPolarHBondContact O-CG 3.36Å; T61-L65 PolarHBondContact O-N 3.01Å; T61-A151 HydrophobicContact CG2-CB 3.63Å
62V96.6Very high96.4Very high20 Ų2050.9 Ų50.912%0.12125%0.247CC..Hα-helixtrans-59.3-48.8178.8166.10000110.2W58 Q59 E60 Y64 L65 E66 A151 Y152W58-V62 WeakPolarHBondContact O-CG2 3.46Å; W58-V62 PolarHBondContact O-N 3.2Å; Q59-V62 PolarHBondContact O-N 3.47Å; E60-V62 PolarHBondContact O-N 3.25Å; V62-Y64 PolarHBondContact O-N 3.49Å; V62-L65 PolarHBondContact O-N 2.99Å; V62-E66 HydrophobicContact CG1-CG 4.23Å; V62-E66 WeakPolarHBondContact O-CB 3.32Å; V62-E66 VanDerWaalsContact O-CG 3.3Å; V62-E66 WeakPolarHBondContact O-CG 3.24Å; V62-E66 PolarHBondContact O-N 3.45Å; V62-A151 HydrophobicContact CG2-CB 3.76Å; V62-Y152 HydrophobicContact CB-CE1 4.32Å; V62-Y152 HydrophobicContact CG1-CD1 4.08Å; V62-Y152 HydrophobicContact CG1-CE1 3.41Å; V62-Y152 VanDerWaalsContact CG1-CE1 3.41Å; V62-Y152 HydrophobicContact CG2-CD1 3.79Å; V62-Y152 HydrophobicContact CG2-CE1 3.9Å; V62-Y152 HydrophobicContact CG2-CG 4.47Å
63E95.1Very high96.2Very high117 Ų11753.1 Ų53.155%0.54726%0.255SS..Hα-helixtrans-56.6-52-178.6-176.8175.6-176.200112Q59 E60 T61 E66 V67Q59-E63 PolarHBondContact O-N 3.4Å; E60-E63 PolarHBondContact O-N 3.49Å; T61-E63 PolarHBondContact O-N 2.74Å; E63-E66 PolarHBondContact O-N 3.22Å; E63-V67 WeakPolarHBondContact O-CB 3.44Å; E63-V67 VanDerWaalsContact O-CG2 3.26Å; E63-V67 WeakPolarHBondContact O-CG2 3.34Å; E63-V67 PolarHBondContact O-N 3.38Å
64Y97.1Very high96Very high61 Ų6150.6 Ų50.624%0.23925%0.245CC..Hα-helixtrans-74.2-33-175.5-86.1-94.5000113.6M40 A45 Y48 E60 V62 S68M40-Y64 HydrophobicContact CE-CE1 4.45Å; M40-Y64 HydrophobicContact SD-CE1 4.02Å; A45-Y64 HydrophobicContact CB-CD1 4.37Å; Y48-Y64 AromaticContact CD1-CD1 3.46Å; Y48-Y64 HydrophobicContact CD1-CD1 3.46Å; Y48-Y64 VanDerWaalsContact CD1-CD1 3.46Å; Y48-Y64 AromaticContact CD1-CD2 3.48Å; Y48-Y64 HydrophobicContact CD1-CD2 3.48Å; Y48-Y64 VanDerWaalsContact CD1-CD2 3.48Å; Y48-Y64 AromaticContact CD1-CE1 3.48Å; Y48-Y64 HydrophobicContact CD1-CE1 3.48Å; Y48-Y64 VanDerWaalsContact CD1-CE1 3.48Å; Y48-Y64 AromaticContact CD1-CE2 3.52Å; Y48-Y64 HydrophobicContact CD1-CE2 3.52Å; Y48-Y64 AromaticContact CD1-CG 3.44Å; Y48-Y64 HydrophobicContact CD1-CG 3.44Å; Y48-Y64 VanDerWaalsContact CD1-CG 3.44Å; Y48-Y64 AromaticContact CD1-CZ 3.49Å; Y48-Y64 VanDerWaalsContact CD1-CZ 3.49Å; Y48-Y64 HydrophobicContact CE1-CD1 4.23Å; Y48-Y64 AromaticContact CE1-CD2 3.49Å; Y48-Y64 HydrophobicContact CE1-CD2 3.49Å; Y48-Y64 VanDerWaalsContact CE1-CD2 3.49Å; Y48-Y64 AromaticContact CE1-CE1 3.99Å; Y48-Y64 HydrophobicContact CE1-CE1 3.99Å; Y48-Y64 AromaticContact CE1-CE2 3.22Å; Y48-Y64 HydrophobicContact CE1-CE2 3.22Å; Y48-Y64 AromaticContact CE1-CG 3.98Å; Y48-Y64 HydrophobicContact CE1-CG 3.98Å; Y48-Y64 AromaticContact CE1-CZ 3.47Å; Y48-Y64 VanDerWaalsContact CE1-CZ 3.47Å; Y48-Y64 HydrophobicContact CG-CD1 4.18Å; Y48-Y64 HydrophobicContact CG-CE1 4.08Å; Y48-Y64 HydrophobicContact CG-CG 4.5Å; E60-Y64 WeakPolarHBondContact O-CD2 3.37Å; E60-Y64 PolarHBondContact O-N 3.34Å; V62-Y64 PolarHBondContact O-N 3.49Å; Y64-S68 VanDerWaalsContact O-CB 3.31Å; Y64-S68 WeakPolarHBondContact O-CB 3.45Å; Y64-S68 PolarHBondContact O-N 3.32Å; Y64-S68 PolarHBondContact O-OG 2.88Å
65L97.1Very high95.8Very high0 Ų045.9 Ų45.90%022%0.216CC..Hα-helixtrans-71.5-36.3173.5-69.1-178.9000112.1Y46 L50 T61 V62 S68 L69 L148Y46-L65 HydrophobicContact CD2-CD2 3.64Å; Y46-L65 HydrophobicContact CE2-CD2 3.76Å; L50-L65 HydrophobicContact CD2-CD2 4.48Å; T61-L65 HydrophobicContact CG2-CD1 3.63Å; T61-L65 HydrophobicContact CG2-CG 4.26Å; T61-L65 VanDerWaalsContact O-CB 3.26Å; T61-L65 WeakPolarHBondContact O-CB 3.38Å; T61-L65 VanDerWaalsContact O-CG 3.24Å; T61-L65 WeakPolarHBondContact O-CG 3.36Å; T61-L65 PolarHBondContact O-N 3.01Å; V62-L65 PolarHBondContact O-N 2.99Å; L65-S68 WeakPolarHBondContact CA-OG 3.36Å; L65-S68 PolarHBondContact O-OG 3.26Å; L65-L69 WeakPolarHBondContact O-CG 3.48Å; L65-L69 PolarHBondContact O-N 2.86Å; L65-L69 VanDerWaalsContact O-N 3.14Å; L65-L148 HydrophobicContact CB-CD1 4.16Å; L65-L148 HydrophobicContact CB-CD2 3.52Å; L65-L148 HydrophobicContact CB-CG 3.7Å; L65-L148 HydrophobicContact CD1-CD2 4.05Å; L65-L148 HydrophobicContact CD1-CG 3.86Å; L65-L148 HydrophobicContact CG-CD2 4.44Å; L65-L148 HydrophobicContact CG-CG 4.45Å
66E95.1Very high95.5Very high32 Ų3245.2 Ų45.215%0.1520%0.201CC..Hα-helixtrans-66.8-41.7172.6-73.7-168.5168.400111.7V62 E63 L69 R70 L148 Y152 K160V62-E66 HydrophobicContact CG1-CG 4.23Å; V62-E66 WeakPolarHBondContact O-CB 3.32Å; V62-E66 VanDerWaalsContact O-CG 3.3Å; V62-E66 WeakPolarHBondContact O-CG 3.24Å; V62-E66 PolarHBondContact O-N 3.45Å; E63-E66 PolarHBondContact O-N 3.22Å; E66-L69 PolarHBondContact O-N 3.05Å; E66-R70 PolarHBondContact O-N 3.24Å; E66-R70 PolarHBondContact O-NH1 3.19Å; E66-R70 IonicContact OE2-NH1 2.78Å; E66-L148 HydrophobicContact CG-CD2 4.44Å; E66-Y152 WeakPolarHBondContact CG-OH 3.33Å; E66-Y152 PolarHBondContact OE1-OH 2.9Å; E66-K160 IonicContact OE1-NZ 2.66Å; E66-K160 PolarHBondContact OE1-NZ 3.49Å
67V94.8Very high95.3Very high13 Ų1341.1 Ų41.18%0.07918%0.184CC..Hα-helixtrans-62.7-43.4175.4167.70000110.7E38 E63 L69 R70 L71E38-V67 HydrophobicContact CB-CG1 4.49Å; E63-V67 WeakPolarHBondContact O-CB 3.44Å; E63-V67 VanDerWaalsContact O-CG2 3.26Å; E63-V67 WeakPolarHBondContact O-CG2 3.34Å; E63-V67 PolarHBondContact O-N 3.38Å; V67-L69 PolarHBondContact O-N 2.6Å; V67-R70 PolarHBondContact O-N 3.1Å; V67-R70 VanDerWaalsContact O-N 3.15Å; V67-L71 HydrophobicContact CG1-CD1 3.74Å; V67-L71 HydrophobicContact CG1-CG 4.18Å; V67-L71 WeakPolarHBondContact O-CG 3.5Å; V67-L71 PolarHBondContact O-N 3.44Å
68S96.6Very high95.1Very high0 Ų036.4 Ų36.40%016%0.163CC..Hα-helixtrans-63.2-40.5179.774.50000111.8L42 Y64 L65 R70 L71 Y72 F139L42-S68 WeakPolarHBondContact CD1-O 3.31Å; Y64-S68 VanDerWaalsContact O-CB 3.31Å; Y64-S68 WeakPolarHBondContact O-CB 3.45Å; Y64-S68 PolarHBondContact O-N 3.32Å; Y64-S68 PolarHBondContact O-OG 2.88Å; L65-S68 WeakPolarHBondContact CA-OG 3.36Å; L65-S68 PolarHBondContact O-OG 3.26Å; S68-R70 VanDerWaalsContact C-N 3.33Å; S68-R70 PolarHBondContact O-N 3.48Å; S68-L71 PolarHBondContact O-N 2.95Å; S68-Y72 WeakPolarHBondContact O-CB 3.05Å; S68-Y72 PolarHBondContact O-N 3.42Å; S68-F139 WeakPolarHBondContact OG-CZ 3.38Å
69L95.7Very high95Very high4 Ų434.6 Ų34.62%0.02116%0.157CC..Hα-helixtrans-58.2-43.5172.2-75.1170.7000112.1Q25 L65 E66 V67 Y72 R73 F139 P144 Y145 L148Q25-L69 HydrophobicContact CG-CD1 4.47Å; L65-L69 WeakPolarHBondContact O-CG 3.48Å; L65-L69 PolarHBondContact O-N 2.86Å; L65-L69 VanDerWaalsContact O-N 3.14Å; E66-L69 PolarHBondContact O-N 3.05Å; V67-L69 PolarHBondContact O-N 2.6Å; L69-Y72 PolarHBondContact O-N 3.28Å; L69-R73 PolarHBondContact O-N 3.25Å; L69-F139 HydrophobicContact CD2-CD1 4.09Å; L69-F139 HydrophobicContact CD2-CE1 4.08Å; L69-F139 HydrophobicContact CG-CE1 4.45Å; L69-P144 HydrophobicContact CD2-CB 4.07Å; L69-P144 HydrophobicContact CD2-CG 4.25Å; L69-P144 HydrophobicContact CG-CB 4.33Å; L69-Y145 HydrophobicContact CD1-CE1 3.93Å; L69-Y145 HydrophobicContact CD1-CE2 4.29Å; L69-Y145 HydrophobicContact CD2-CE2 3.86Å; L69-L148 HydrophobicContact CD1-CD1 3.48Å; L69-L148 VanDerWaalsContact CD1-CD1 3.48Å
70R94Very high94.9Very high40 Ų4027.9 Ų27.915%0.15113%0.126CC..Hα-helixtrans-65.9-39.1176.1-69.1-167.4-63.9-85.57.2112.6Y26 F34 E38 E66 V67 S68 R73 L74Y26-R70 HydrophobicContact CD1-CG 4.33Å; Y26-R70 HydrophobicContact CE1-CG 4.32Å; F34-R70 HydrophobicContact CE2-CB 3.99Å; F34-R70 HydrophobicContact CZ-CB 4.26Å; E38-R70 VanDerWaalsContact CD-NH2 3.32Å; E38-R70 IonicContact OE1-NH2 2.99Å; E38-R70 IonicContact OE2-CZ 3.76Å; E38-R70 VanDerWaalsContact OE2-CZ 3.23Å; E38-R70 IonicContact OE2-NE 3.23Å; E38-R70 PolarHBondContact OE2-NE 2.88Å; E38-R70 IonicContact OE2-NH2 3.53Å; E38-R70 PolarHBondContact OE2-NH2 3.2Å; E66-R70 PolarHBondContact O-N 3.24Å; E66-R70 PolarHBondContact O-NH1 3.19Å; E66-R70 IonicContact OE2-NH1 2.78Å; V67-R70 PolarHBondContact O-N 3.1Å; V67-R70 VanDerWaalsContact O-N 3.15Å; S68-R70 VanDerWaalsContact C-N 3.33Å; S68-R70 PolarHBondContact O-N 3.48Å; R70-R73 PolarHBondContact O-N 2.69Å; R70-L74 WeakPolarHBondContact O-CB 3.44Å; R70-L74 PolarHBondContact O-N 3.47Å
71L94.6Very high94.8Very high10 Ų1028.4 Ų28.45%0.05213%0.128CC..Hα-helixtrans-66.6-40.7176.1-73.2169.2000112F34 L39 M40 L42 A45 V67 S68 L74 L75F34-L71 HydrophobicContact CE1-CD2 3.93Å; F34-L71 HydrophobicContact CZ-CD2 3.72Å; F34-L71 HydrophobicContact CZ-CG 4.19Å; L39-L71 HydrophobicContact CD2-CD2 4.49Å; M40-L71 HydrophobicContact CG-CD1 3.74Å; M40-L71 WeakPolarHBondContact O-CD1 3.49Å; L42-L71 HydrophobicContact CB-CB 4.43Å; L42-L71 HydrophobicContact CD1-CB 3.94Å; A45-L71 HydrophobicContact CB-CD1 3.89Å; V67-L71 HydrophobicContact CG1-CD1 3.74Å; V67-L71 HydrophobicContact CG1-CG 4.18Å; V67-L71 WeakPolarHBondContact O-CG 3.5Å; V67-L71 PolarHBondContact O-N 3.44Å; S68-L71 PolarHBondContact O-N 2.95Å; L71-L74 WeakPolarHBondContact O-CB 3.31Å; L71-L74 PolarHBondContact O-N 3.26Å; L71-L75 PolarHBondContact O-N 2.91Å
72Y94.7Very high94.7Very high29 Ų2928.4 Ų28.411%0.11413%0.128CC..Hα-helixtrans-62-46.2174.7169.5-99.5000110.9L42 S68 L69 L74 L75 R76 I136 F139 D140L42-Y72 HydrophobicContact CD2-CD2 4.06Å; L42-Y72 HydrophobicContact CD2-CG 4.48Å; S68-Y72 WeakPolarHBondContact O-CB 3.05Å; S68-Y72 PolarHBondContact O-N 3.42Å; L69-Y72 PolarHBondContact O-N 3.28Å; Y72-L74 PolarHBondContact O-N 2.73Å; Y72-L75 PolarHBondContact O-N 3.01Å; Y72-R76 HydrophobicContact CD1-CG 4.48Å; Y72-R76 HydrophobicContact CD2-CG 4.33Å; Y72-R76 HydrophobicContact CE1-CG 3.96Å; Y72-R76 HydrophobicContact CE2-CG 3.82Å; Y72-R76 WeakPolarHBondContact O-CG 3.2Å; Y72-R76 PolarHBondContact O-N 3.37Å; Y72-I136 HydrophobicContact CD2-CD1 4.03Å; Y72-I136 HydrophobicContact CE2-CD1 4.02Å; Y72-I136 HydrophobicContact CE2-CG2 4.49Å; Y72-F139 HydrophobicContact CD1-CB 4.04Å; Y72-F139 AromaticContact CD1-CD1 3.8Å; Y72-F139 HydrophobicContact CD1-CD1 3.8Å; Y72-F139 HydrophobicContact CD1-CG 4.33Å; Y72-F139 HydrophobicContact CD2-CB 3.55Å; Y72-F139 AromaticContact CD2-CD1 3.91Å; Y72-F139 HydrophobicContact CD2-CD1 3.91Å; Y72-F139 AromaticContact CD2-CG 3.83Å; Y72-F139 HydrophobicContact CD2-CG 3.83Å; Y72-F139 HydrophobicContact CE1-CB 4.09Å; Y72-F139 HydrophobicContact CE2-CB 3.58Å; Y72-F139 HydrophobicContact CE2-CG 4.38Å; Y72-F139 HydrophobicContact CG-CB 3.8Å; Y72-F139 AromaticContact CG-CD1 3.39Å; Y72-F139 HydrophobicContact CG-CD1 3.39Å; Y72-F139 HydrophobicContact CG-CE1 4.23Å; Y72-F139 AromaticContact CG-CG 3.82Å; Y72-F139 HydrophobicContact CG-CG 3.82Å; Y72-D140 PolarHBondContact OH-OD1 3.33Å
73R92.6Very high94.7Very high65 Ų6527.6 Ų27.625%0.24512%0.123CC..Hα-helixtrans-60.8-43.5174-171.6171.3-175140.50.2112.4Y26 Y29 L69 R70 L75 R76 D77Y26-R73 HydrophobicContact CE1-CB 3.86Å; Y26-R73 HydrophobicContact CE1-CG 4.26Å; Y26-R73 VanDerWaalsContact CE2-NH1 3.31Å; Y29-R73 HydrophobicContact CE1-CG 4.06Å; Y29-R73 HydrophobicContact CE2-CB 4.32Å; Y29-R73 HydrophobicContact CE2-CG 4.18Å; L69-R73 PolarHBondContact O-N 3.25Å; R70-R73 PolarHBondContact O-N 2.69Å; R73-L75 VanDerWaalsContact C-N 3.3Å; R73-L75 PolarHBondContact O-N 3.5Å; R73-R76 PolarHBondContact O-N 2.96Å; R73-D77 WeakPolarHBondContact O-CB 3.5Å; R73-D77 PolarHBondContact O-N 2.96Å
74L93.6Very high94.7Very high3 Ų325.1 Ų25.12%0.01611%0.113CC..Hα-helixtrans-56.9-44.2175.5178.867.2000111.7Y29 F31 F34 L39 R70 L71 Y72 S78 A125Y29-L74 HydrophobicContact CE2-CB 4.21Å; Y29-L74 WeakPolarHBondContact OH-CA 3.5Å; F31-L74 HydrophobicContact CD2-CD1 4.29Å; F34-L74 HydrophobicContact CB-CD1 4.09Å; F34-L74 HydrophobicContact CB-CD2 4.22Å; F34-L74 HydrophobicContact CD1-CD2 3.98Å; F34-L74 HydrophobicContact CD2-CB 4Å; F34-L74 HydrophobicContact CD2-CD1 3.95Å; F34-L74 HydrophobicContact CD2-CD2 3.74Å; F34-L74 HydrophobicContact CD2-CG 4.09Å; F34-L74 HydrophobicContact CE1-CD2 4.26Å; F34-L74 HydrophobicContact CE2-CB 3.98Å; F34-L74 HydrophobicContact CE2-CD2 4.02Å; F34-L74 HydrophobicContact CE2-CG 4.44Å; F34-L74 HydrophobicContact CG-CD1 4.19Å; F34-L74 HydrophobicContact CG-CD2 3.7Å; F34-L74 HydrophobicContact CG-CG 4.42Å; F34-L74 HydrophobicContact CZ-CD2 4.28Å; L39-L74 HydrophobicContact CD2-CD2 3.64Å; R70-L74 WeakPolarHBondContact O-CB 3.44Å; R70-L74 PolarHBondContact O-N 3.47Å; L71-L74 WeakPolarHBondContact O-CB 3.31Å; L71-L74 PolarHBondContact O-N 3.26Å; Y72-L74 PolarHBondContact O-N 2.73Å; L74-S78 VanDerWaalsContact O-CB 3.25Å; L74-S78 WeakPolarHBondContact O-CB 3.25Å; L74-S78 PolarHBondContact O-N 2.98Å; L74-S78 PolarHBondContact O-OG 3.31Å; L74-A125 HydrophobicContact CD2-CB 4.27Å; L74-A125 HydrophobicContact CG-CB 4.02Å
75L93.4Very high94.6Very high13 Ų1326.7 Ų26.77%0.06813%0.125CC..Hα-helixtrans-62.3-53177.217861.6000111L71 Y72 R73 D77 S78 E79 F126 L130 P131 I136L71-L75 PolarHBondContact O-N 2.91Å; Y72-L75 PolarHBondContact O-N 3.01Å; R73-L75 VanDerWaalsContact C-N 3.3Å; R73-L75 PolarHBondContact O-N 3.5Å; L75-D77 PolarHBondContact O-N 3.17Å; L75-S78 WeakPolarHBondContact O-CB 3.24Å; L75-S78 PolarHBondContact O-N 3.47Å; L75-S78 VanDerWaalsContact O-N 3.13Å; L75-E79 HydrophobicContact CD1-CG 4.38Å; L75-E79 WeakPolarHBondContact O-CG 3.32Å; L75-E79 PolarHBondContact O-N 3.06Å; L75-F126 HydrophobicContact CD1-CD1 4.21Å; L75-F126 HydrophobicContact CD1-CE1 3.73Å; L75-F126 HydrophobicContact CD1-CZ 4.48Å; L75-L130 HydrophobicContact CD1-CD2 4.34Å; L75-P131 HydrophobicContact CD2-CG 3.72Å; L75-I136 HydrophobicContact CD2-CD1 4.03Å
76R93Very high94.6Very high41 Ų4126.7 Ų26.716%0.15513%0.126CC..Hα-helixtrans-58.7-46.7-179.2-69-74.5-70.7165.4-2.1112.3Y72 R73 S78 E79 A80 A243Y72-R76 HydrophobicContact CD1-CG 4.48Å; Y72-R76 HydrophobicContact CD2-CG 4.33Å; Y72-R76 HydrophobicContact CE1-CG 3.96Å; Y72-R76 HydrophobicContact CE2-CG 3.82Å; Y72-R76 WeakPolarHBondContact O-CG 3.2Å; Y72-R76 PolarHBondContact O-N 3.37Å; R73-R76 PolarHBondContact O-N 2.96Å; R76-S78 VanDerWaalsContact C-N 3.31Å; R76-S78 PolarHBondContact O-N 3.4Å; R76-E79 PolarHBondContact O-N 3.49Å; R76-A80 PolarHBondContact O-N 3.4Å; R76-A243 PolarHBondContact NH1-O 3.38Å
77D93.1Very high94.6Very high49 Ų4927.5 Ų27.526%0.26213%0.134SC..Hα-helixtrans-65.1-36.3178.2-70.5-3.8000111.4Y29 F31 R73 L75 F81Y29-D77 WeakPolarHBondContact CE1-OD2 2.93Å; Y29-D77 VanDerWaalsContact CZ-OD2 3.23Å; Y29-D77 WeakPolarHBondContact OH-CB 3.32Å; Y29-D77 PolarHBondContact OH-OD2 3.04Å; F31-D77 HydrophobicContact CD2-CB 3.92Å; R73-D77 WeakPolarHBondContact O-CB 3.5Å; R73-D77 PolarHBondContact O-N 2.96Å; L75-D77 PolarHBondContact O-N 3.17Å; D77-F81 VanDerWaalsContact O-CB 3.23Å; D77-F81 WeakPolarHBondContact O-CB 3.45Å; D77-F81 PolarHBondContact O-N 2.91Å
78S93.4Very high94.5Very high0 Ų031.2 Ų31.20%016%0.161CC..Hα-helixtrans-66.2-38.3175.5-59.50000112.6F31 L74 L75 R76 C82 A125F31-S78 WeakPolarHBondContact CE2-OG 3.26Å; L74-S78 VanDerWaalsContact O-CB 3.25Å; L74-S78 WeakPolarHBondContact O-CB 3.25Å; L74-S78 PolarHBondContact O-N 2.98Å; L74-S78 PolarHBondContact O-OG 3.31Å; L75-S78 WeakPolarHBondContact O-CB 3.24Å; L75-S78 PolarHBondContact O-N 3.47Å; L75-S78 VanDerWaalsContact O-N 3.13Å; R76-S78 VanDerWaalsContact C-N 3.31Å; R76-S78 PolarHBondContact O-N 3.4Å; S78-C82 PolarHBondContact O-N 2.88Å; S78-C82 VanDerWaalsContact O-N 3.17Å; S78-A125 VanDerWaalsContact OG-CB 3.25Å; S78-A125 WeakPolarHBondContact OG-CB 3.33Å
79E93.8Very high94.5Very high9 Ų933 Ų334%0.04217%0.172CC..Hα-helixtrans-67-50.8175.4-70.3179.3144.400111.3L75 R76 F81 C82 N83 F126 G246 P247L75-E79 HydrophobicContact CD1-CG 4.38Å; L75-E79 WeakPolarHBondContact O-CG 3.32Å; L75-E79 PolarHBondContact O-N 3.06Å; R76-E79 PolarHBondContact O-N 3.49Å; E79-F81 VanDerWaalsContact C-N 3.32Å; E79-F81 PolarHBondContact O-N 3.45Å; E79-C82 PolarHBondContact O-N 2.83Å; E79-N83 WeakPolarHBondContact O-CB 3.26Å; E79-N83 PolarHBondContact O-N 3.11Å; E79-N83 PolarHBondContact O-ND2 3.4Å; E79-F126 HydrophobicContact CG-CE1 3.88Å; E79-F126 HydrophobicContact CG-CZ 3.68Å; E79-G246 VanDerWaalsContact OE1-CA 3.25Å; E79-G246 WeakPolarHBondContact OE1-CA 3.3Å; E79-P247 WeakPolarHBondContact OE1-CD 3.36Å
80A94.7Very high94.4Very high6 Ų638.2 Ų38.25%0.0519%0.191CC..Hα-helixtrans-54.9-48.617600000111.1R76 C82 N83 L84 E239 A242 A243R76-A80 PolarHBondContact O-N 3.4Å; A80-C82 PolarHBondContact O-N 2.97Å; A80-N83 PolarHBondContact O-N 3.48Å; A80-L84 VanDerWaalsContact O-CB 3.31Å; A80-L84 WeakPolarHBondContact O-CB 3.42Å; A80-L84 VanDerWaalsContact O-CG 3.24Å; A80-L84 WeakPolarHBondContact O-CG 3.45Å; A80-L84 PolarHBondContact O-N 3.2Å; A80-E239 HydrophobicContact CB-CB 4.18Å; A80-E239 HydrophobicContact CB-CG 4.45Å; A80-A242 HydrophobicContact CB-CB 4.36Å; A80-A243 HydrophobicContact CB-CB 4.26Å
81F95.1Very high94.3Very high85 Ų8538.3 Ų38.337%0.37320%0.195SC..Hα-helixtrans-56.7-49.3179.6177.2-94.3000112.5F31 D77 E79 N85 L123F31-F81 HydrophobicContact CE1-CB 4.4Å; F31-F81 HydrophobicContact CE1-CD2 4.02Å; F31-F81 HydrophobicContact CE1-CE2 4.43Å; F31-F81 HydrophobicContact CE1-CG 4.05Å; F31-F81 HydrophobicContact CZ-CB 3.92Å; F31-F81 HydrophobicContact CZ-CD1 4.08Å; F31-F81 HydrophobicContact CZ-CD2 4.28Å; F31-F81 AromaticContact CZ-CG 3.83Å; F31-F81 HydrophobicContact CZ-CG 3.83Å; D77-F81 VanDerWaalsContact O-CB 3.23Å; D77-F81 WeakPolarHBondContact O-CB 3.45Å; D77-F81 PolarHBondContact O-N 2.91Å; E79-F81 VanDerWaalsContact C-N 3.32Å; E79-F81 PolarHBondContact O-N 3.45Å; F81-N85 VanDerWaalsContact CE1-ND2 3.33Å; F81-N85 WeakPolarHBondContact CE1-ND2 3.31Å; F81-N85 WeakPolarHBondContact CE2-ND2 3.47Å; F81-N85 WeakPolarHBondContact CZ-ND2 3.39Å; F81-N85 WeakPolarHBondContact O-CB 3.48Å; F81-N85 VanDerWaalsContact O-CG 3.29Å; F81-N85 PolarHBondContact O-N 3.11Å; F81-N85 PolarHBondContact O-ND2 3.37Å; F81-L123 HydrophobicContact CD1-CD1 4.04Å
82C95.2Very high94.1Very high0 Ų043.2 Ų43.20%022%0.221CC..Hα-helixtrans-70.1-42.1-179.4-750000112.6S78 E79 A80 N85 C86 L116 C119 K120 L123S78-C82 PolarHBondContact O-N 2.88Å; S78-C82 VanDerWaalsContact O-N 3.17Å; E79-C82 PolarHBondContact O-N 2.83Å; A80-C82 PolarHBondContact O-N 2.97Å; C82-N85 PolarHBondContact O-N 3.04Å; C82-C86 WeakPolarHBondContact O-CB 3.39Å; C82-C86 PolarHBondContact O-N 3.14Å; C82-C86 PolarHBondContact O-SG 2.91Å; C82-C86 VanDerWaalsContact O-SG 3.4Å; C82-L116 HydrophobicContact CB-CD2 4.08Å; C82-L116 WeakPolarHBondContact O-CD2 3.31Å; C82-C119 WeakPolarHBondContact CA-SG 3.26Å; C82-C119 HydrophobicContact CB-CB 3.8Å; C82-C119 WeakPolarHBondContact CB-SG 3.29Å; C82-C119 VanDerWaalsContact SG-C 3.5Å; C82-C119 WeakPolarHBondContact SG-CB 3.28Å; C82-C119 CovalentContact SG-SG 2.05Å; C82-C119 PolarHBondContact SG-SG 3.48Å; C82-K120 HydrophobicContact CB-CG 4.45Å; C82-L123 VanDerWaalsContact SG-CD1 3.57Å
83N95.9Very high93.8Very high3 Ų346 Ų462%0.01624%0.238CC..Hα-helixtrans-67.3-38.8-178.9-76.9-43.1000112.3E79 A80 S87 L116 A242 E245E79-N83 WeakPolarHBondContact O-CB 3.26Å; E79-N83 PolarHBondContact O-N 3.11Å; E79-N83 PolarHBondContact O-ND2 3.4Å; A80-N83 PolarHBondContact O-N 3.48Å; N83-S87 WeakPolarHBondContact O-CB 3.44Å; N83-S87 PolarHBondContact O-N 2.76Å; N83-L116 WeakPolarHBondContact OD1-CD2 3.45Å; N83-A242 HydrophobicContact CB-CB 3.83Å; N83-A242 WeakPolarHBondContact CB-O 3.39Å; N83-A242 PolarHBondContact ND2-O 3.41Å; N83-E245 PolarHBondContact OD1-OE2 2.97Å
84L95.4Very high93.7Very high65 Ų6545.4 Ų45.434%0.3424%0.238SC..Hα-helixtrans-64.2-49.1173.8-71.6171.1000111.6A80 C86 S87 D238 E239 A242A80-L84 VanDerWaalsContact O-CB 3.31Å; A80-L84 WeakPolarHBondContact O-CB 3.42Å; A80-L84 VanDerWaalsContact O-CG 3.24Å; A80-L84 WeakPolarHBondContact O-CG 3.45Å; A80-L84 PolarHBondContact O-N 3.2Å; L84-C86 VanDerWaalsContact C-N 3.25Å; L84-C86 PolarHBondContact O-N 2.88Å; L84-S87 WeakPolarHBondContact O-CB 3.4Å; L84-S87 PolarHBondContact O-N 3.05Å; L84-S87 PolarHBondContact O-OG 3.11Å; L84-D238 HydrophobicContact CD2-CB 4.33Å; L84-E239 HydrophobicContact CD1-CG 3.98Å; L84-A242 HydrophobicContact CD1-CB 4.45Å; L84-A242 HydrophobicContact CD2-CB 3.9Å; L84-A242 HydrophobicContact CG-CB 3.66Å
85N96Very high93.5Very high93 Ų9352 Ų5250%0.49727%0.269SS..Hα-helixtrans-67.1-24.6-178.1-73.5-31.3000113.7F81 C82F81-N85 VanDerWaalsContact CE1-ND2 3.33Å; F81-N85 WeakPolarHBondContact CE1-ND2 3.31Å; F81-N85 WeakPolarHBondContact CE2-ND2 3.47Å; F81-N85 WeakPolarHBondContact CZ-ND2 3.39Å; F81-N85 WeakPolarHBondContact O-CB 3.48Å; F81-N85 VanDerWaalsContact O-CG 3.29Å; F81-N85 PolarHBondContact O-N 3.11Å; F81-N85 PolarHBondContact O-ND2 3.37Å; C82-N85 PolarHBondContact O-N 3.04Å
86C96.4Very high93.5Very high1 Ų158.2 Ų58.21%0.00730%0.295CS..Hα-helixtrans-97.9-1.4177.6-65.60000113.7C82 L84 S88 V89 R112 C115 L116C82-C86 WeakPolarHBondContact O-CB 3.39Å; C82-C86 PolarHBondContact O-N 3.14Å; C82-C86 PolarHBondContact O-SG 2.91Å; C82-C86 VanDerWaalsContact O-SG 3.4Å; L84-C86 VanDerWaalsContact C-N 3.25Å; L84-C86 PolarHBondContact O-N 2.88Å; C86-S88 PolarHBondContact O-N 3.23Å; C86-V89 PolarHBondContact O-N 3.48Å; C86-R112 HydrophobicContact CB-CG 4.43Å; C86-C115 VanDerWaalsContact CA-SG 3.55Å; C86-C115 HydrophobicContact CB-CB 3.74Å; C86-C115 WeakPolarHBondContact CB-SG 3.34Å; C86-C115 WeakPolarHBondContact SG-CB 3.38Å; C86-C115 CovalentContact SG-SG 2.04Å; C86-C115 PolarHBondContact SG-SG 2.93Å; C86-L116 HydrophobicContact CB-CD2 3.81Å; C86-L116 HydrophobicContact CB-CG 4.06Å; C86-L116 PolarHBondContact SG-N 3.07Å
87S94.3Very high93.5Very high48 Ų4859.4 Ų59.434%0.33630%0.302SS..THydrogen-bonded Turntrans-63.5-35.9-171.662.60000114.1N83 L84 R90N83-S87 WeakPolarHBondContact O-CB 3.44Å; N83-S87 PolarHBondContact O-N 2.76Å; L84-S87 WeakPolarHBondContact O-CB 3.4Å; L84-S87 PolarHBondContact O-N 3.05Å; L84-S87 PolarHBondContact O-OG 3.11Å; S87-R90 PolarHBondContact O-NH1 2.84Å; S87-R90 PolarHBondContact O-NH2 3.21Å
88S93.6Very high93.5Very high92 Ų9259.3 Ų59.364%0.64331%0.308SS*.THydrogen-bonded Turntrans-93.7-4-177.259.20000114C86 R90C86-S88 PolarHBondContact O-N 3.23Å; S88-R90 VanDerWaalsContact C-NH1 3.35Å; S88-R90 PolarHBondContact O-N 3.47Å
89V95.3Very high93.6Very high38 Ų3866 Ų6623%0.2334%0.344CS..  trans-67.1129.5-178.8175.70000110.1C86 K111 C115C86-V89 PolarHBondContact O-N 3.48Å; V89-K111 HydrophobicContact CG1-CB 4.46Å; V89-K111 HydrophobicContact CG1-CD 4.43Å; V89-K111 HydrophobicContact CG1-CG 3.45Å; V89-K111 VanDerWaalsContact CG1-CG 3.45Å; V89-C115 HydrophobicContact CG1-CB 4.44Å; V89-C115 HydrophobicContact CG2-CB 4.31Å
90R94.1Very high93.7Very high112 Ų11271.2 Ų71.242%0.42337%0.366SS..  trans-129.4163.5178-60.5-62.9175.6-89.9-2.5110.5S87 S88 N108 K111S87-R90 PolarHBondContact O-NH1 2.84Å; S87-R90 PolarHBondContact O-NH2 3.21Å; S88-R90 VanDerWaalsContact C-NH1 3.35Å; S88-R90 PolarHBondContact O-N 3.47Å; R90-N108 WeakPolarHBondContact CA-OD1 3.17Å; R90-K111 WeakPolarHBondContact O-CG 3.49Å
91L92.8Very high93.7Very high43 Ų4375.5 Ų75.523%0.22539%0.394CS..  trans-55.9145.5173.1-81.8176.9000111.5F97 G107 N108 K111L91-F97 HydrophobicContact CD1-CD2 4.22Å; L91-F97 HydrophobicContact CD1-CE2 3.99Å; L91-G107 VanDerWaalsContact CD1-C 3.45Å; L91-G107 VanDerWaalsContact CG-C 3.44Å; L91-G107 WeakPolarHBondContact CG-O 3.14Å; L91-N108 PolarHBondContact N-OD1 3.45Å; L91-K111 HydrophobicContact CD2-CB 4.14Å; L91-K111 HydrophobicContact CD2-CD 4.48Å; L91-K111 HydrophobicContact CG-CB 4.45Å
92D89.4Confident93.7Very high113 Ų11376.8 Ų76.860%0.60440%0.401SS*.THydrogen-bonded Turntrans-69.7133.4167.1-48.2-52.8000107.5K111D92-K111 IonicContact OD1-NZ 3.84Å; D92-K111 PolarHBondContact OD1-NZ 3.44Å; D92-K111 IonicContact OD2-NZ 3.4Å; D92-K111 PolarHBondContact OD2-NZ 3.45Å
93D89.1Confident93.7Very high88 Ų8881.7 Ų81.747%0.47143%0.427SS..THydrogen-bonded Turntrans58.440.4-174.6-53-37.2000115.6Q95 K96D93-Q95 PolarHBondContact O-N 3.39Å; D93-K96 HydrophobicContact CB-CD 3.63Å; D93-K96 HydrophobicContact CB-CG 3.98Å; D93-K96 WeakPolarHBondContact O-CB 3.36Å; D93-K96 PolarHBondContact O-N 3.45Å; D93-K96 WeakPolarHBondContact OD2-CE 3.44Å; D93-K96 IonicContact OD2-NZ 2.68Å; D93-K96 PolarHBondContact OD2-NZ 3.4Å
94E89.6Confident93.6Very high52 Ų5285 Ų8524%0.24344%0.439CS..G310 helixtrans-47.6-28.8176-174.5179-164.500114K96 F97 R104 N108E94-K96 VanDerWaalsContact C-N 3.26Å; E94-K96 PolarHBondContact O-N 2.79Å; E94-F97 PolarHBondContact O-N 3.26Å; E94-F97 VanDerWaalsContact O-N 3.16Å; E94-R104 HydrophobicContact CG-CG 3.82Å; E94-R104 PolarHBondContact O-NE 3.44Å; E94-R104 PolarHBondContact O-NH2 2.87Å; E94-N108 PolarHBondContact OE1-ND2 3.42Å
95Q91Very high93.5Very high141 Ų14184.5 Ų84.566%0.65944%0.444SS*.G310 helixtrans-62.4-29.6177.7-62.678.711.900112.8D93 F97 A98D93-Q95 PolarHBondContact O-N 3.39Å; Q95-F97 PolarHBondContact O-N 3.32Å; Q95-F97 VanDerWaalsContact O-N 3.16Å; Q95-A98 VanDerWaalsContact O-CB 3.23Å; Q95-A98 WeakPolarHBondContact O-CB 3.06Å; Q95-A98 PolarHBondContact O-N 3.12Å
96K93.3Very high93.5Very high143 Ų14382.6 Ų82.662%0.62243%0.431SS*.G310 helixtrans-61.8-23.4176.5-70.3176.5179.5164.20112.9D93 E94D93-K96 HydrophobicContact CB-CD 3.63Å; D93-K96 HydrophobicContact CB-CG 3.98Å; D93-K96 WeakPolarHBondContact O-CB 3.36Å; D93-K96 PolarHBondContact O-N 3.45Å; D93-K96 WeakPolarHBondContact OD2-CE 3.44Å; D93-K96 IonicContact OD2-NZ 2.68Å; D93-K96 PolarHBondContact OD2-NZ 3.4Å; E94-K96 VanDerWaalsContact C-N 3.26Å; E94-K96 PolarHBondContact O-N 2.79Å
97F92.5Very high93.4Very high66 Ų6682.7 Ų82.729%0.28943%0.432SS..G310 helixtrans-9719.3178.3-55-84000112.4L91 E94 Q95 D99 F100 L103 R104L91-F97 HydrophobicContact CD1-CD2 4.22Å; L91-F97 HydrophobicContact CD1-CE2 3.99Å; E94-F97 PolarHBondContact O-N 3.26Å; E94-F97 VanDerWaalsContact O-N 3.16Å; Q95-F97 PolarHBondContact O-N 3.32Å; Q95-F97 VanDerWaalsContact O-N 3.16Å; F97-D99 VanDerWaalsContact C-N 3.3Å; F97-D99 PolarHBondContact O-N 3.29Å; F97-F100 CarbonylContact O-C 3.37Å; F97-F100 PolarHBondContact O-N 3.02Å; F97-F100 VanDerWaalsContact O-N 3.07Å; F97-L103 HydrophobicContact CD1-CB 3.91Å; F97-L103 HydrophobicContact CE1-CB 4.5Å; F97-R104 HydrophobicContact CB-CB 3.79Å
98A92Very high93.5Very high48 Ų4881.5 Ų81.540%0.39742%0.423SS..THydrogen-bonded Turntrans-57.9-41.9-179.200000113.6Q95 F100 R104Q95-A98 VanDerWaalsContact O-CB 3.23Å; Q95-A98 WeakPolarHBondContact O-CB 3.06Å; Q95-A98 PolarHBondContact O-N 3.12Å; A98-F100 PolarHBondContact O-N 2.81Å; A98-R104 VanDerWaalsContact CA-CZ 3.46Å; A98-R104 VanDerWaalsContact CB-NH2 3.33Å; A98-R104 VanDerWaalsContact N-NH2 3.17Å
99D96.6Very high93.5Very high141 Ų14181.4 Ų81.475%0.75442%0.418SS*.THydrogen-bonded Turntrans-82.3-1.9-179.9-54.1-39.7000112.5F97F97-D99 VanDerWaalsContact C-N 3.3Å; F97-D99 PolarHBondContact O-N 3.29Å
100F96.1Very high93.5Very high117 Ų11785.7 Ų85.751%0.51344%0.437SS..  trans-129.476-176-53.1-76.6000111.6F97 A98 E102 L103 R104F97-F100 CarbonylContact O-C 3.37Å; F97-F100 PolarHBondContact O-N 3.02Å; F97-F100 VanDerWaalsContact O-N 3.07Å; A98-F100 PolarHBondContact O-N 2.81Å; F100-E102 VanDerWaalsContact C-N 3.32Å; F100-E102 PolarHBondContact O-N 2.93Å; F100-L103 HydrophobicContact CB-CB 4Å; F100-L103 HydrophobicContact CB-CD1 3.89Å; F100-L103 HydrophobicContact CB-CG 4.15Å; F100-L103 HydrophobicContact CG-CD1 4.17Å; F100-L103 PolarHBondContact O-N 2.75Å; F100-R104 PolarHBondContact O-N 3.24Å
101P94.7Very high93.6Very high97 Ų9782.4 Ų82.463%0.6343%0.426SS*.Hα-helixtrans-57.1-39.1-173.2-26.735.3000114.5R104 A105P101-R104 WeakPolarHBondContact O-CB 3.47Å; P101-R104 PolarHBondContact O-N 3.48Å; P101-A105 WeakPolarHBondContact O-CB 3.4Å; P101-A105 PolarHBondContact O-N 3.49Å
102E94.2Very high93.8Very high112 Ų11283.4 Ų83.452%0.52343%0.426SS..Hα-helixtrans-66.2-47.7179.1-175.7175.5179.100111.8F100 R104 A105 F106 Y257F100-E102 VanDerWaalsContact C-N 3.32Å; F100-E102 PolarHBondContact O-N 2.93Å; E102-R104 VanDerWaalsContact C-N 3.27Å; E102-R104 PolarHBondContact O-N 3.34Å; E102-A105 PolarHBondContact O-N 3.47Å; E102-F106 HydrophobicContact CG-CD2 3.69Å; E102-F106 HydrophobicContact CG-CE2 3.86Å; E102-F106 WeakPolarHBondContact O-CD2 3.33Å; E102-F106 PolarHBondContact O-N 2.68Å; E102-Y257 PolarHBondContact OE1-OH 2.59Å
103L94.9Very high94Very high102 Ų10280.6 Ų80.653%0.53442%0.419SS..Hα-helixtrans-61-38.7176.1-66-178.5000111.5F97 F100 G107F97-L103 HydrophobicContact CD1-CB 3.91Å; F97-L103 HydrophobicContact CE1-CB 4.5Å; F100-L103 HydrophobicContact CB-CB 4Å; F100-L103 HydrophobicContact CB-CD1 3.89Å; F100-L103 HydrophobicContact CB-CG 4.15Å; F100-L103 HydrophobicContact CG-CD1 4.17Å; F100-L103 PolarHBondContact O-N 2.75Å; L103-G107 VanDerWaalsContact O-CA 3.31Å; L103-G107 WeakPolarHBondContact O-CA 3.29Å; L103-G107 PolarHBondContact O-N 2.81Å
104R95.4Very high94.4Very high73 Ų7382.4 Ų82.428%0.27542%0.424SS..Hα-helixtrans-61.5-50.4173.3178.2179-76176.8-13.3111.4E94 F97 A98 F100 P101 E102 G107 N108E94-R104 HydrophobicContact CG-CG 3.82Å; E94-R104 PolarHBondContact O-NE 3.44Å; E94-R104 PolarHBondContact O-NH2 2.87Å; F97-R104 HydrophobicContact CB-CB 3.79Å; A98-R104 VanDerWaalsContact CA-CZ 3.46Å; A98-R104 VanDerWaalsContact CB-NH2 3.33Å; A98-R104 VanDerWaalsContact N-NH2 3.17Å; F100-R104 PolarHBondContact O-N 3.24Å; P101-R104 WeakPolarHBondContact O-CB 3.47Å; P101-R104 PolarHBondContact O-N 3.48Å; E102-R104 VanDerWaalsContact C-N 3.27Å; E102-R104 PolarHBondContact O-N 3.34Å; R104-G107 PolarHBondContact O-N 3.05Å; R104-N108 PolarHBondContact O-N 3.37Å; R104-N108 PolarHBondContact O-ND2 2.95Å
105A93.1Very high94.8Very high54 Ų5481.5 Ų81.545%0.44642%0.424SS..Hα-helixtrans-61.6-55.6-176.900000111.6P101 E102 G107 N108 V109P101-A105 WeakPolarHBondContact O-CB 3.4Å; P101-A105 PolarHBondContact O-N 3.49Å; E102-A105 PolarHBondContact O-N 3.47Å; A105-G107 VanDerWaalsContact C-N 3.3Å; A105-G107 PolarHBondContact O-N 3.19Å; A105-N108 PolarHBondContact O-N 2.88Å; A105-V109 WeakPolarHBondContact O-CG2 3.38Å; A105-V109 PolarHBondContact O-N 3.08Å; A105-V109 VanDerWaalsContact O-N 3.09Å
106F94.4Very high95Very high53 Ų5376.1 Ų76.123%0.23240%0.399CS..Hα-helixtrans-68.4-31.5179.2-76.7-71.7000112.8E102 N108 V109 M110 F256 Y257 I260E102-F106 HydrophobicContact CG-CD2 3.69Å; E102-F106 HydrophobicContact CG-CE2 3.86Å; E102-F106 WeakPolarHBondContact O-CD2 3.33Å; E102-F106 PolarHBondContact O-N 2.68Å; F106-N108 PolarHBondContact O-N 3.04Å; F106-V109 WeakPolarHBondContact O-CB 3.4Å; F106-V109 PolarHBondContact O-N 3.04Å; F106-M110 WeakPolarHBondContact O-CG 3.47Å; F106-M110 PolarHBondContact O-N 3.46Å; F106-F256 HydrophobicContact CD1-CZ 4.41Å; F106-F256 HydrophobicContact CE1-CE1 4.05Å; F106-F256 AromaticContact CE1-CZ 3.71Å; F106-F256 HydrophobicContact CE1-CZ 3.71Å; F106-F256 HydrophobicContact CE2-CE1 4.18Å; F106-F256 AromaticContact CZ-CE1 3.6Å; F106-F256 HydrophobicContact CZ-CE1 3.6Å; F106-F256 AromaticContact CZ-CZ 3.76Å; F106-F256 HydrophobicContact CZ-CZ 3.76Å; F106-Y257 HydrophobicContact CE2-CE1 4.1Å; F106-Y257 WeakPolarHBondContact CE2-OH 3.35Å; F106-Y257 AromaticContact CZ-CE1 3.93Å; F106-Y257 HydrophobicContact CZ-CE1 3.93Å; F106-I260 HydrophobicContact CE1-CD1 3.74Å; F106-I260 HydrophobicContact CZ-CD1 4Å
107G95.3Very high95.1Very high3 Ų376.1 Ų76.13%0.03140%0.399CS..Hα-helixtrans-55.9-48.5170.300000113L91 L103 R104 A105 V109 M110 K111L91-G107 VanDerWaalsContact CD1-C 3.45Å; L91-G107 VanDerWaalsContact CG-C 3.44Å; L91-G107 WeakPolarHBondContact CG-O 3.14Å; L103-G107 VanDerWaalsContact O-CA 3.31Å; L103-G107 WeakPolarHBondContact O-CA 3.29Å; L103-G107 PolarHBondContact O-N 2.81Å; R104-G107 PolarHBondContact O-N 3.05Å; A105-G107 VanDerWaalsContact C-N 3.3Å; A105-G107 PolarHBondContact O-N 3.19Å; G107-V109 VanDerWaalsContact C-N 3.34Å; G107-V109 PolarHBondContact O-N 3.33Å; G107-M110 PolarHBondContact O-N 3.4Å; G107-K111 PolarHBondContact O-N 3.03Å
108N95.6Very high95.2Very high24 Ų2482.6 Ų82.613%0.12842%0.422CS..Hα-helixtrans-64.2-38.1175-75.8-33.2000112.4R90 L91 E94 R104 A105 F106 K111 R112R90-N108 WeakPolarHBondContact CA-OD1 3.17Å; L91-N108 PolarHBondContact N-OD1 3.45Å; E94-N108 PolarHBondContact OE1-ND2 3.42Å; R104-N108 PolarHBondContact O-N 3.37Å; R104-N108 PolarHBondContact O-ND2 2.95Å; A105-N108 PolarHBondContact O-N 2.88Å; F106-N108 PolarHBondContact O-N 3.04Å; N108-K111 PolarHBondContact O-N 2.57Å; N108-R112 WeakPolarHBondContact O-CB 3.46Å; N108-R112 PolarHBondContact O-N 2.85Å
109V94.3Very high95.4Very high90 Ų9081.6 Ų81.655%0.54541%0.412SS..Hα-helixtrans-59.6-47.6173.1173.40000110.8A105 F106 G107 K111 R112 A113A105-V109 WeakPolarHBondContact O-CG2 3.38Å; A105-V109 PolarHBondContact O-N 3.08Å; A105-V109 VanDerWaalsContact O-N 3.09Å; F106-V109 WeakPolarHBondContact O-CB 3.4Å; F106-V109 PolarHBondContact O-N 3.04Å; G107-V109 VanDerWaalsContact C-N 3.34Å; G107-V109 PolarHBondContact O-N 3.33Å; V109-K111 PolarHBondContact O-N 2.72Å; V109-R112 PolarHBondContact O-N 3.21Å; V109-A113 WeakPolarHBondContact O-CB 3.3Å; V109-A113 PolarHBondContact O-N 2.87Å
110M95.3Very high95.3Very high128 Ų12877.1 Ų77.163%0.63139%0.385SS*.Hα-helixtrans-61.5-43178.1-73.6-173.2-75.500112.2F106 G107 A113 Q114F106-M110 WeakPolarHBondContact O-CG 3.47Å; F106-M110 PolarHBondContact O-N 3.46Å; G107-M110 PolarHBondContact O-N 3.4Å; M110-A113 PolarHBondContact O-N 2.9Å; M110-Q114 PolarHBondContact O-N 3.47Å
111K96.4Very high95.1Very high42 Ų4277.8 Ų77.818%0.18339%0.39CS..Hα-helixtrans-64.1-43.4177.3-170.984.9171.3-173.10111.7V89 R90 L91 D92 G107 N108 V109 Q114 C115V89-K111 HydrophobicContact CG1-CB 4.46Å; V89-K111 HydrophobicContact CG1-CD 4.43Å; V89-K111 HydrophobicContact CG1-CG 3.45Å; V89-K111 VanDerWaalsContact CG1-CG 3.45Å; R90-K111 WeakPolarHBondContact O-CG 3.49Å; L91-K111 HydrophobicContact CD2-CB 4.14Å; L91-K111 HydrophobicContact CD2-CD 4.48Å; L91-K111 HydrophobicContact CG-CB 4.45Å; D92-K111 IonicContact OD1-NZ 3.84Å; D92-K111 PolarHBondContact OD1-NZ 3.44Å; D92-K111 IonicContact OD2-NZ 3.4Å; D92-K111 PolarHBondContact OD2-NZ 3.45Å; G107-K111 PolarHBondContact O-N 3.03Å; N108-K111 PolarHBondContact O-N 2.57Å; V109-K111 PolarHBondContact O-N 2.72Å; K111-Q114 WeakPolarHBondContact O-CB 3.09Å; K111-Q114 PolarHBondContact O-N 3Å; K111-C115 PolarHBondContact O-N 3.04Å; K111-C115 VanDerWaalsContact O-N 3.07Å
112R95.9Very high94.9Very high65 Ų6575.5 Ų75.525%0.24538%0.384CS..Hα-helixtrans-62.4-43.8174.5-177.4170.9174.6170.3-2.7111.2C86 N108 V109 Q114 C115 L116 E245C86-R112 HydrophobicContact CB-CG 4.43Å; N108-R112 WeakPolarHBondContact O-CB 3.46Å; N108-R112 PolarHBondContact O-N 2.85Å; V109-R112 PolarHBondContact O-N 3.21Å; R112-Q114 VanDerWaalsContact C-N 3.32Å; R112-Q114 PolarHBondContact O-N 3.41Å; R112-C115 WeakPolarHBondContact O-CB 3.45Å; R112-C115 PolarHBondContact O-N 3.39Å; R112-C115 VanDerWaalsContact O-N 3.16Å; R112-L116 HydrophobicContact CG-CD1 4.14Å; R112-L116 HydrophobicContact CG-CG 4.45Å; R112-L116 WeakPolarHBondContact O-CG 3.46Å; R112-L116 PolarHBondContact O-N 3.36Å; R112-E245 IonicContact CZ-OE2 3.71Å; R112-E245 VanDerWaalsContact NH2-CD 3.26Å; R112-E245 IonicContact NH2-OE1 3.83Å; R112-E245 PolarHBondContact NH2-OE1 2.95Å; R112-E245 VanDerWaalsContact NH2-OE1 3.14Å; R112-E245 IonicContact NH2-OE2 2.77Å; R112-E245 PolarHBondContact NH2-OE2 2.93Å
113A95.2Very high94.8Very high54 Ų5471.4 Ų71.445%0.44637%0.366SS..Hα-helixtrans-60.1-39.7176.100000112.4V109 M110 L116 K117V109-A113 WeakPolarHBondContact O-CB 3.3Å; V109-A113 PolarHBondContact O-N 2.87Å; M110-A113 PolarHBondContact O-N 2.9Å; A113-L116 PolarHBondContact O-N 3.06Å; A113-K117 WeakPolarHBondContact O-CB 3.42Å; A113-K117 PolarHBondContact O-N 3.21Å
114Q96.8Very high94.6Very high125 Ų12568.5 Ų68.558%0.58435%0.353SS*.Hα-helixtrans-60.9-46173.6-174.3-170.942.200111.8M110 K111 R112 K117 R118M110-Q114 PolarHBondContact O-N 3.47Å; K111-Q114 WeakPolarHBondContact O-CB 3.09Å; K111-Q114 PolarHBondContact O-N 3Å; R112-Q114 VanDerWaalsContact C-N 3.32Å; R112-Q114 PolarHBondContact O-N 3.41Å; Q114-K117 PolarHBondContact O-N 3.15Å; Q114-R118 PolarHBondContact O-N 3.26Å; Q114-R118 VanDerWaalsContact O-N 3.16Å
115C97.1Very high94.3Very high34 Ų3465.5 Ų65.523%0.2334%0.344CS..Hα-helixtrans-59-48.5175.6179.50000111.3C86 V89 K111 R112 K117 R118 C119C86-C115 VanDerWaalsContact CA-SG 3.55Å; C86-C115 HydrophobicContact CB-CB 3.74Å; C86-C115 WeakPolarHBondContact CB-SG 3.34Å; C86-C115 WeakPolarHBondContact SG-CB 3.38Å; C86-C115 CovalentContact SG-SG 2.04Å; C86-C115 PolarHBondContact SG-SG 2.93Å; V89-C115 HydrophobicContact CG1-CB 4.44Å; V89-C115 HydrophobicContact CG2-CB 4.31Å; K111-C115 PolarHBondContact O-N 3.04Å; K111-C115 VanDerWaalsContact O-N 3.07Å; R112-C115 WeakPolarHBondContact O-CB 3.45Å; R112-C115 PolarHBondContact O-N 3.39Å; R112-C115 VanDerWaalsContact O-N 3.16Å; C115-K117 PolarHBondContact O-N 3.16Å; C115-R118 PolarHBondContact O-N 3.34Å; C115-C119 WeakPolarHBondContact O-CB 3.32Å; C115-C119 PolarHBondContact O-N 3.15Å
116L95.6Very high94.2Very high27 Ų2764.9 Ų64.914%0.14133%0.331CS..Hα-helixtrans-61.2-44.9179.7-70.3172.6000111.7C82 N83 C86 R112 A113 R118 C119 K120C82-L116 HydrophobicContact CB-CD2 4.08Å; C82-L116 WeakPolarHBondContact O-CD2 3.31Å; N83-L116 WeakPolarHBondContact OD1-CD2 3.45Å; C86-L116 HydrophobicContact CB-CD2 3.81Å; C86-L116 HydrophobicContact CB-CG 4.06Å; C86-L116 PolarHBondContact SG-N 3.07Å; R112-L116 HydrophobicContact CG-CD1 4.14Å; R112-L116 HydrophobicContact CG-CG 4.45Å; R112-L116 WeakPolarHBondContact O-CG 3.46Å; R112-L116 PolarHBondContact O-N 3.36Å; A113-L116 PolarHBondContact O-N 3.06Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 3.13Å; L116-C119 PolarHBondContact O-N 3.41Å; L116-K120 WeakPolarHBondContact O-CB 3.49Å; L116-K120 VanDerWaalsContact O-CG 3.31Å; L116-K120 WeakPolarHBondContact O-CG 3.25Å; L116-K120 PolarHBondContact O-N 3.33Å
117K94.8Very high94Very high143 Ų14370.5 Ų70.562%0.62235%0.351SS*.Hα-helixtrans-55.2-47.5176.6-176.2177.7-178.9177.40111.3A113 Q114 C115 Q121A113-K117 WeakPolarHBondContact O-CB 3.42Å; A113-K117 PolarHBondContact O-N 3.21Å; Q114-K117 PolarHBondContact O-N 3.15Å; C115-K117 PolarHBondContact O-N 3.16Å; K117-Q121 VanDerWaalsContact O-CG 3.24Å; K117-Q121 WeakPolarHBondContact O-CG 3.29Å; K117-Q121 PolarHBondContact O-N 2.72Å
118R96.2Very high93.7Very high203 Ų20373.1 Ų73.177%0.76636%0.362SS*.Hα-helixtrans-65.7-43178.1-176.4179177.1-175.6-0.6112.2Q114 C115 L116Q114-R118 PolarHBondContact O-N 3.26Å; Q114-R118 VanDerWaalsContact O-N 3.16Å; C115-R118 PolarHBondContact O-N 3.34Å; L116-R118 VanDerWaalsContact C-N 3.31Å; L116-R118 PolarHBondContact O-N 3.13Å
119C95.5Very high93.5Very high27 Ų2775.6 Ų75.618%0.18238%0.381CS..Hα-helixtrans-63.1-49.4179.3-177.70000111.5C82 C115 L116 Q121 G122C82-C119 WeakPolarHBondContact CA-SG 3.26Å; C82-C119 HydrophobicContact CB-CB 3.8Å; C82-C119 WeakPolarHBondContact CB-SG 3.29Å; C82-C119 VanDerWaalsContact SG-C 3.5Å; C82-C119 WeakPolarHBondContact SG-CB 3.28Å; C82-C119 CovalentContact SG-SG 2.05Å; C82-C119 PolarHBondContact SG-SG 3.48Å; C115-C119 WeakPolarHBondContact O-CB 3.32Å; C115-C119 PolarHBondContact O-N 3.15Å; L116-C119 PolarHBondContact O-N 3.41Å; C119-Q121 VanDerWaalsContact C-N 3.33Å; C119-Q121 PolarHBondContact O-N 3.14Å; C119-G122 PolarHBondContact O-N 2.99Å
120K93.4Very high93.2Very high46 Ų4675.2 Ų75.220%0.238%0.375CS..Hα-helixtrans-62.3-37.6-177.9-68.2-171.4178.5-172.60112.3C82 L116 G122 L123 F126C82-K120 HydrophobicContact CB-CG 4.45Å; L116-K120 WeakPolarHBondContact O-CB 3.49Å; L116-K120 VanDerWaalsContact O-CG 3.31Å; L116-K120 WeakPolarHBondContact O-CG 3.25Å; L116-K120 PolarHBondContact O-N 3.33Å; K120-G122 PolarHBondContact O-N 3.28Å; K120-G122 VanDerWaalsContact O-N 3.15Å; K120-L123 PolarHBondContact O-N 3.22Å; K120-L123 VanDerWaalsContact O-N 3.16Å; K120-F126 HydrophobicContact CB-CB 4.26Å; K120-F126 HydrophobicContact CB-CD2 3.56Å; K120-F126 HydrophobicContact CB-CE2 3.99Å; K120-F126 HydrophobicContact CB-CG 3.88Å; K120-F126 HydrophobicContact CD-CD1 4.24Å; K120-F126 HydrophobicContact CD-CD2 4.37Å; K120-F126 HydrophobicContact CD-CE1 4.08Å; K120-F126 HydrophobicContact CD-CE2 4.2Å; K120-F126 HydrophobicContact CD-CG 4.39Å; K120-F126 HydrophobicContact CD-CZ 4.06Å; K120-F126 HydrophobicContact CG-CD1 4.47Å; K120-F126 HydrophobicContact CG-CD2 3.72Å; K120-F126 HydrophobicContact CG-CE1 4.37Å; K120-F126 HydrophobicContact CG-CE2 3.59Å; K120-F126 HydrophobicContact CG-CG 4.16Å; K120-F126 HydrophobicContact CG-CZ 3.95Å; K120-F126 WeakPolarHBondContact O-CD2 3.23Å
121Q92.8Very high93Very high132 Ų13270 Ų7062%0.61735%0.352SS*.Hα-helixtrans-57.7-27.4174.2-76.3172.4-1100113.7K117 C119K117-Q121 VanDerWaalsContact O-CG 3.24Å; K117-Q121 WeakPolarHBondContact O-CG 3.29Å; K117-Q121 PolarHBondContact O-N 2.72Å; C119-Q121 VanDerWaalsContact C-N 3.33Å; C119-Q121 PolarHBondContact O-N 3.14Å
122G90.4Very high92.7Very high49 Ų4969.2 Ų69.251%0.50535%0.351SS..THydrogen-bonded Turntrans-79-18.1-179.400000114.7C119 K120C119-G122 PolarHBondContact O-N 2.99Å; K120-G122 PolarHBondContact O-N 3.28Å; K120-G122 VanDerWaalsContact O-N 3.15Å
123L91.8Very high92.2Very high26 Ų2670.5 Ų70.514%0.13636%0.356CS..SBendtrans-105139.2-167.8-62.5176.3000112.8F31 F81 C82 K120 A125 F126F31-L123 HydrophobicContact CE2-CD1 4.37Å; F31-L123 HydrophobicContact CE2-CD2 4.41Å; F31-L123 HydrophobicContact CZ-CD1 4.06Å; F31-L123 HydrophobicContact CZ-CD2 3.83Å; F81-L123 HydrophobicContact CD1-CD1 4.04Å; C82-L123 VanDerWaalsContact SG-CD1 3.57Å; K120-L123 PolarHBondContact O-N 3.22Å; K120-L123 VanDerWaalsContact O-N 3.16Å; L123-A125 VanDerWaalsContact C-N 3.28Å; L123-A125 PolarHBondContact O-N 3.37Å; L123-F126 HydrophobicContact CB-CD2 3.99Å; L123-F126 HydrophobicContact CB-CE2 4.37Å; L123-F126 HydrophobicContact CD1-CD2 4.44Å; L123-F126 HydrophobicContact CD1-CE2 4.04Å; L123-F126 PolarHBondContact O-N 3.03Å
124P90.3Very high92Very high40 Ų4073 Ų7326%0.2636%0.362SS..G310 helixtrans-60-32.1-178.8-24.634000114.9L39 F126 R127L39-P124 HydrophobicContact CD1-CB 3.83Å; L39-P124 HydrophobicContact CD2-CB 4.05Å; P124-F126 VanDerWaalsContact C-N 3.28Å; P124-F126 PolarHBondContact O-N 3.13Å; P124-R127 WeakPolarHBondContact O-CB 3.34Å; P124-R127 PolarHBondContact O-N 3.21Å; P124-R127 VanDerWaalsContact O-N 3.14Å
125A89.9Confident91.9Very high10 Ų1067.5 Ų67.58%0.08334%0.336CS..G310 helixtrans-57-41.6-17900000112.4L74 S78 L123 R127 Q128L74-A125 HydrophobicContact CD2-CB 4.27Å; L74-A125 HydrophobicContact CG-CB 4.02Å; S78-A125 VanDerWaalsContact OG-CB 3.25Å; S78-A125 WeakPolarHBondContact OG-CB 3.33Å; L123-A125 VanDerWaalsContact C-N 3.28Å; L123-A125 PolarHBondContact O-N 3.37Å; A125-R127 VanDerWaalsContact C-N 3.29Å; A125-R127 PolarHBondContact O-N 3.37Å; A125-Q128 PolarHBondContact O-N 3.22Å
126F90.6Very high91.6Very high41 Ų4166.9 Ų66.918%0.1833%0.331CS..G310 helixtrans-87.96.3-176.9-54.4-65.5000113.7L75 E79 K120 L123 P124 Q128 L130L75-F126 HydrophobicContact CD1-CD1 4.21Å; L75-F126 HydrophobicContact CD1-CE1 3.73Å; L75-F126 HydrophobicContact CD1-CZ 4.48Å; E79-F126 HydrophobicContact CG-CE1 3.88Å; E79-F126 HydrophobicContact CG-CZ 3.68Å; K120-F126 HydrophobicContact CB-CB 4.26Å; K120-F126 HydrophobicContact CB-CD2 3.56Å; K120-F126 HydrophobicContact CB-CE2 3.99Å; K120-F126 HydrophobicContact CB-CG 3.88Å; K120-F126 HydrophobicContact CD-CD1 4.24Å; K120-F126 HydrophobicContact CD-CD2 4.37Å; K120-F126 HydrophobicContact CD-CE1 4.08Å; K120-F126 HydrophobicContact CD-CE2 4.2Å; K120-F126 HydrophobicContact CD-CG 4.39Å; K120-F126 HydrophobicContact CD-CZ 4.06Å; K120-F126 HydrophobicContact CG-CD1 4.47Å; K120-F126 HydrophobicContact CG-CD2 3.72Å; K120-F126 HydrophobicContact CG-CE1 4.37Å; K120-F126 HydrophobicContact CG-CE2 3.59Å; K120-F126 HydrophobicContact CG-CG 4.16Å; K120-F126 HydrophobicContact CG-CZ 3.95Å; K120-F126 WeakPolarHBondContact O-CD2 3.23Å; L123-F126 HydrophobicContact CB-CD2 3.99Å; L123-F126 HydrophobicContact CB-CE2 4.37Å; L123-F126 HydrophobicContact CD1-CD2 4.44Å; L123-F126 HydrophobicContact CD1-CE2 4.04Å; L123-F126 PolarHBondContact O-N 3.03Å; P124-F126 VanDerWaalsContact C-N 3.28Å; P124-F126 PolarHBondContact O-N 3.13Å; F126-Q128 VanDerWaalsContact C-N 3.34Å; F126-L130 HydrophobicContact CD1-CD2 4.39Å
127R89.9Confident91.4Very high172 Ų17267.2 Ų67.265%0.64933%0.333SS*.G310 helixtrans-84.2-16.3167.8-60.4-179.7-174.6166.31.8112P124 A125P124-R127 WeakPolarHBondContact O-CB 3.34Å; P124-R127 PolarHBondContact O-N 3.21Å; P124-R127 VanDerWaalsContact O-N 3.14Å; A125-R127 VanDerWaalsContact C-N 3.29Å; A125-R127 PolarHBondContact O-N 3.37Å
128Q90.2Very high91.5Very high58 Ų5863.8 Ų63.827%0.27132%0.319SS..SBendtrans-89.4161.3176.4-50.1-51.4-41.900110.4P41 A125 F126P41-Q128 HydrophobicContact CG-CB 4.46Å; A125-Q128 PolarHBondContact O-N 3.22Å; F126-Q128 VanDerWaalsContact C-N 3.34Å
129S90.6Very high91.4Very high75 Ų7554.6 Ų54.652%0.52428%0.284SS..PPolyproline II helixtrans-64.3137.6169.857.10000110P41P41-S129 VanDerWaalsContact CB-OG 3.3Å; P41-S129 WeakPolarHBondContact CB-OG 3.44Å; P41-S129 WeakPolarHBondContact CG-OG 3.34Å
130L88.9Confident91.2Very high82 Ų8255.2 Ų55.243%0.42929%0.286SS..PPolyproline II helixtrans-68.1139.2177.5-68.4168000110L75 F126 P247L75-L130 HydrophobicContact CD1-CD2 4.34Å; F126-L130 HydrophobicContact CD1-CD2 4.39Å; L130-P247 HydrophobicContact CB-CG 4.47Å; L130-P247 HydrophobicContact CD1-CB 3.56Å; L130-P247 HydrophobicContact CD1-CG 3.48Å; L130-P247 VanDerWaalsContact CD1-CG 3.48Å; L130-P247 HydrophobicContact CD2-CG 3.67Å; L130-P247 HydrophobicContact CG-CG 4.05Å
131P91.3Very high91.2Very high20 Ų2060.4 Ų60.413%0.1330%0.304CS..PPolyproline II helixtrans-70.1156.9176.531.6-36.7000111.5L42 E43 L75 T135 I136L42-P131 HydrophobicContact CB-CB 4.36Å; L42-P131 HydrophobicContact CD2-CB 4.07Å; L42-P131 HydrophobicContact CD2-CG 3.99Å; L42-P131 HydrophobicContact CG-CB 4.44Å; E43-P131 HydrophobicContact CB-CB 4.32Å; L75-P131 HydrophobicContact CD2-CG 3.72Å; P131-T135 HydrophobicContact CB-CG2 4.12Å; P131-I136 HydrophobicContact CB-CD1 4.34Å; P131-I136 HydrophobicContact CB-CG1 4.47Å; P131-I136 HydrophobicContact CG-CD1 3.5Å; P131-I136 VanDerWaalsContact CG-CD1 3.5Å; P131-I136 HydrophobicContact CG-CG1 3.85Å
132S90.2Very high91.4Very high24 Ų2456 Ų5617%0.16828%0.282CS..PPolyproline II helixtrans-62158.716970.10000112.7E43 D134 T135 I136E43-S132 PolarHBondContact OE2-N 3.4Å; S132-D134 VanDerWaalsContact C-N 3.28Å; S132-D134 PolarHBondContact O-N 3.11Å; S132-T135 PolarHBondContact O-N 3.21Å; S132-T135 PolarHBondContact OG-N 2.98Å; S132-T135 PolarHBondContact OG-OG1 2.98Å; S132-I136 PolarHBondContact O-N 3.27Å; S132-I136 VanDerWaalsContact O-N 3.17Å
133R85.4Confident91.7Very high93 Ų9355.2 Ų55.235%0.35127%0.265SS..Hα-helixtrans-58.5-43.1174.7-161.6-171100.5172.7-2.3111.4T135 I136 D137 E267R133-T135 VanDerWaalsContact C-N 3.29Å; R133-T135 PolarHBondContact O-N 2.95Å; R133-I136 PolarHBondContact O-N 2.89Å; R133-I136 VanDerWaalsContact O-N 3.07Å; R133-D137 IonicContact CZ-OD2 3.14Å; R133-D137 IonicContact NE-OD2 2.64Å; R133-D137 PolarHBondContact NE-OD2 3.39Å; R133-D137 IonicContact NH2-OD2 3.53Å; R133-D137 VanDerWaalsContact O-CG 3.24Å; R133-D137 PolarHBondContact O-N 3.43Å; R133-E267 IonicContact CZ-OE1 3.95Å; R133-E267 IonicContact NH1-OE1 2.74Å; R133-E267 PolarHBondContact NH1-OE1 2.81Å
134D90.3Very high92Very high107 Ų10754 Ų5457%0.57226%0.259SS*.Hα-helixtrans-60.2-41.3-179.9-56.1-25.6000111.3S132 I136 D137 E138S132-D134 VanDerWaalsContact C-N 3.28Å; S132-D134 PolarHBondContact O-N 3.11Å; D134-I136 PolarHBondContact O-N 3.48Å; D134-D137 PolarHBondContact O-N 3.3Å; D134-E138 WeakPolarHBondContact O-CG 3.5Å; D134-E138 PolarHBondContact O-N 2.95Å
135T94.3Very high92.3Very high8 Ų852.2 Ų52.25%0.04925%0.247CC..Hα-helixtrans-60.7-46.5174.5-56.20000110.7L42 Y46 P131 S132 R133 D137 E138 F139L42-T135 HydrophobicContact CD2-CG2 4.28Å; L42-T135 HydrophobicContact CG-CG2 4.27Å; Y46-T135 HydrophobicContact CD1-CG2 4.13Å; P131-T135 HydrophobicContact CB-CG2 4.12Å; S132-T135 PolarHBondContact O-N 3.21Å; S132-T135 PolarHBondContact OG-N 2.98Å; S132-T135 PolarHBondContact OG-OG1 2.98Å; R133-T135 VanDerWaalsContact C-N 3.29Å; R133-T135 PolarHBondContact O-N 2.95Å; T135-D137 VanDerWaalsContact C-N 3.34Å; T135-D137 PolarHBondContact O-N 3.18Å; T135-E138 PolarHBondContact O-N 3.27Å; T135-F139 HydrophobicContact CG2-CD2 4.12Å; T135-F139 HydrophobicContact CG2-CE2 3.9Å; T135-F139 WeakPolarHBondContact O-CD2 3.41Å; T135-F139 PolarHBondContact O-N 3.34Å
136I92.1Very high92.6Very high21 Ų2154.9 Ų54.911%0.10826%0.257CS..Hα-helixtrans-61.7-44.7177.6-65.3-61.2000111.2L42 Y72 L75 P131 S132 R133 D134 E138 F139 D140L42-I136 HydrophobicContact CD2-CD1 4.26Å; Y72-I136 HydrophobicContact CD2-CD1 4.03Å; Y72-I136 HydrophobicContact CE2-CD1 4.02Å; Y72-I136 HydrophobicContact CE2-CG2 4.49Å; L75-I136 HydrophobicContact CD2-CD1 4.03Å; P131-I136 HydrophobicContact CB-CD1 4.34Å; P131-I136 HydrophobicContact CB-CG1 4.47Å; P131-I136 HydrophobicContact CG-CD1 3.5Å; P131-I136 VanDerWaalsContact CG-CD1 3.5Å; P131-I136 HydrophobicContact CG-CG1 3.85Å; S132-I136 PolarHBondContact O-N 3.27Å; S132-I136 VanDerWaalsContact O-N 3.17Å; R133-I136 PolarHBondContact O-N 2.89Å; R133-I136 VanDerWaalsContact O-N 3.07Å; D134-I136 PolarHBondContact O-N 3.48Å; I136-E138 VanDerWaalsContact C-N 3.3Å; I136-E138 PolarHBondContact O-N 2.69Å; I136-F139 PolarHBondContact O-N 3.26Å; I136-F139 VanDerWaalsContact O-N 3.16Å; I136-D140 WeakPolarHBondContact O-CB 3.48Å; I136-D140 VanDerWaalsContact O-CG 3.29Å; I136-D140 PolarHBondContact O-N 3.5Å
137D91.1Very high93Very high35 Ų3555.8 Ų55.819%0.18726%0.259CS..Hα-helixtrans-63.6-35.8-178.4-66.2-10.8000111.2R133 D134 T135 R141 R271R133-D137 IonicContact CZ-OD2 3.14Å; R133-D137 IonicContact NE-OD2 2.64Å; R133-D137 PolarHBondContact NE-OD2 3.39Å; R133-D137 IonicContact NH2-OD2 3.53Å; R133-D137 VanDerWaalsContact O-CG 3.24Å; R133-D137 PolarHBondContact O-N 3.43Å; D134-D137 PolarHBondContact O-N 3.3Å; T135-D137 VanDerWaalsContact C-N 3.34Å; T135-D137 PolarHBondContact O-N 3.18Å; D137-R141 WeakPolarHBondContact O-CB 3.31Å; D137-R141 VanDerWaalsContact O-CG 3.24Å; D137-R141 WeakPolarHBondContact O-CG 3.46Å; D137-R141 PolarHBondContact O-N 3.38Å; D137-R271 IonicContact OD1-CZ 3.18Å; D137-R271 IonicContact OD1-NH2 3.43Å; D137-R271 PolarHBondContact OD1-NH2 3.34Å
138E95.9Very high93.3Very high70 Ų7047.6 Ų47.633%0.32723%0.229SC..Hα-helixtrans-65.2-40.8173.1-77.5-170.1-160.200112.7Y46 D134 T135 I136 R141 R142 E143Y46-E138 WeakPolarHBondContact CE1-OE2 3.38Å; Y46-E138 PolarHBondContact OH-OE2 3.2Å; D134-E138 WeakPolarHBondContact O-CG 3.5Å; D134-E138 PolarHBondContact O-N 2.95Å; T135-E138 PolarHBondContact O-N 3.27Å; I136-E138 VanDerWaalsContact C-N 3.3Å; I136-E138 PolarHBondContact O-N 2.69Å; E138-R141 CarbonylContact O-C 3.48Å; E138-R141 PolarHBondContact O-N 3.38Å; E138-R142 PolarHBondContact O-N 2.83Å; E138-R142 VanDerWaalsContact O-N 3.14Å; E138-E143 HydrophobicContact CB-CB 4Å; E138-E143 HydrophobicContact CB-CG 4.08Å; E138-E143 HydrophobicContact CG-CB 4.39Å; E138-E143 HydrophobicContact CG-CG 4.14Å; E138-E143 WeakPolarHBondContact O-CB 3.39Å; E138-E143 PolarHBondContact O-N 2.94Å
139F95.3Very high93.6Very high10 Ų1045.2 Ų45.24%0.04422%0.217CC..Hα-helixtrans-70.7-40.4176.5-81.5-109.1000111.8L42 Y46 S68 L69 Y72 T135 I136 R141 R142 P144L42-F139 HydrophobicContact CD1-CE1 3.97Å; L42-F139 HydrophobicContact CD1-CE2 4.3Å; L42-F139 HydrophobicContact CD1-CZ 3.7Å; L42-F139 HydrophobicContact CG-CZ 4.48Å; Y46-F139 AromaticContact CD1-CE2 3.81Å; Y46-F139 HydrophobicContact CD1-CE2 3.81Å; Y46-F139 AromaticContact CD2-CE2 3.92Å; Y46-F139 HydrophobicContact CD2-CE2 3.92Å; Y46-F139 AromaticContact CD2-CZ 3.94Å; Y46-F139 HydrophobicContact CD2-CZ 3.94Å; Y46-F139 HydrophobicContact CE1-CE2 4.13Å; Y46-F139 HydrophobicContact CE2-CE2 4.25Å; Y46-F139 HydrophobicContact CE2-CZ 4.49Å; Y46-F139 AromaticContact CG-CE2 3.69Å; Y46-F139 HydrophobicContact CG-CE2 3.69Å; Y46-F139 AromaticContact CG-CZ 3.97Å; Y46-F139 HydrophobicContact CG-CZ 3.97Å; S68-F139 WeakPolarHBondContact OG-CZ 3.38Å; L69-F139 HydrophobicContact CD2-CD1 4.09Å; L69-F139 HydrophobicContact CD2-CE1 4.08Å; L69-F139 HydrophobicContact CG-CE1 4.45Å; Y72-F139 HydrophobicContact CD1-CB 4.04Å; Y72-F139 AromaticContact CD1-CD1 3.8Å; Y72-F139 HydrophobicContact CD1-CD1 3.8Å; Y72-F139 HydrophobicContact CD1-CG 4.33Å; Y72-F139 HydrophobicContact CD2-CB 3.55Å; Y72-F139 AromaticContact CD2-CD1 3.91Å; Y72-F139 HydrophobicContact CD2-CD1 3.91Å; Y72-F139 AromaticContact CD2-CG 3.83Å; Y72-F139 HydrophobicContact CD2-CG 3.83Å; Y72-F139 HydrophobicContact CE1-CB 4.09Å; Y72-F139 HydrophobicContact CE2-CB 3.58Å; Y72-F139 HydrophobicContact CE2-CG 4.38Å; Y72-F139 HydrophobicContact CG-CB 3.8Å; Y72-F139 AromaticContact CG-CD1 3.39Å; Y72-F139 HydrophobicContact CG-CD1 3.39Å; Y72-F139 HydrophobicContact CG-CE1 4.23Å; Y72-F139 AromaticContact CG-CG 3.82Å; Y72-F139 HydrophobicContact CG-CG 3.82Å; T135-F139 HydrophobicContact CG2-CD2 4.12Å; T135-F139 HydrophobicContact CG2-CE2 3.9Å; T135-F139 WeakPolarHBondContact O-CD2 3.41Å; T135-F139 PolarHBondContact O-N 3.34Å; I136-F139 PolarHBondContact O-N 3.26Å; I136-F139 VanDerWaalsContact O-N 3.16Å; F139-R141 PolarHBondContact O-N 3.05Å; F139-R142 PolarHBondContact O-N 3.34Å; F139-P144 HydrophobicContact CD1-CG 3.93Å; F139-P144 HydrophobicContact CD2-CG 4.01Å; F139-P144 HydrophobicContact CE1-CG 3.8Å; F139-P144 HydrophobicContact CE2-CG 3.93Å; F139-P144 HydrophobicContact CG-CG 4.05Å; F139-P144 HydrophobicContact CZ-CG 3.82Å
140D91.6Very high93.9Very high41 Ų4145.1 Ų45.122%0.21921%0.206CC..Hα-helixtrans-58.4-34.6173.4-71.1-15.9000110.8Y72 I136 R142 K171 R271Y72-D140 PolarHBondContact OH-OD1 3.33Å; I136-D140 WeakPolarHBondContact O-CB 3.48Å; I136-D140 VanDerWaalsContact O-CG 3.29Å; I136-D140 PolarHBondContact O-N 3.5Å; D140-R142 VanDerWaalsContact C-N 3.35Å; D140-K171 WeakPolarHBondContact O-CD 3.33Å; D140-K171 WeakPolarHBondContact O-CE 3.28Å; D140-K171 PolarHBondContact O-NZ 2.78Å; D140-R271 IonicContact OD2-NH1 2.83Å; D140-R271 PolarHBondContact OD2-NH1 3.31Å
141R93.1Very high94.2Very high155 Ų15541.2 Ų41.259%0.58519%0.186SC*.THydrogen-bonded Turntrans-84.72.2174.8-71.2173.9-176.1-110.4-0.3114.5D137 E138 F139 E143 H172D137-R141 WeakPolarHBondContact O-CB 3.31Å; D137-R141 VanDerWaalsContact O-CG 3.24Å; D137-R141 WeakPolarHBondContact O-CG 3.46Å; D137-R141 PolarHBondContact O-N 3.38Å; E138-R141 CarbonylContact O-C 3.48Å; E138-R141 PolarHBondContact O-N 3.38Å; F139-R141 PolarHBondContact O-N 3.05Å; R141-E143 HydrophobicContact CB-CG 4.18Å; R141-E143 PolarHBondContact O-N 3.14Å; R141-H172 PolarHBondContact O-NE2 2.86Å
142R95.3Very high94.5Very high39 Ų3940.5 Ų40.515%0.14718%0.18CC..THydrogen-bonded Turntrans61.522.9-178.6-60.4179.5-178.6-161.9-3.1113.9E138 F139 D140 P144 Y145 T167 F168 K171 D197E138-R142 PolarHBondContact O-N 2.83Å; E138-R142 VanDerWaalsContact O-N 3.14Å; F139-R142 PolarHBondContact O-N 3.34Å; D140-R142 VanDerWaalsContact C-N 3.35Å; R142-P144 VanDerWaalsContact C-N 3.34Å; R142-Y145 HydrophobicContact CB-CD2 3.79Å; R142-Y145 HydrophobicContact CB-CE2 4.43Å; R142-Y145 HydrophobicContact CG-CD2 4.31Å; R142-Y145 HydrophobicContact CG-CE2 4.49Å; R142-Y145 WeakPolarHBondContact O-CB 3.05Å; R142-Y145 PolarHBondContact O-N 3.2Å; R142-Y145 VanDerWaalsContact O-N 3.08Å; R142-T167 VanDerWaalsContact CD-O 3.23Å; R142-T167 WeakPolarHBondContact CD-O 3.39Å; R142-T167 PolarHBondContact NH1-O 3.41Å; R142-F168 WeakPolarHBondContact O-CD2 3.5Å; R142-K171 HydrophobicContact CG-CD 4.16Å; R142-K171 HydrophobicContact CG-CG 4.44Å; R142-D197 IonicContact CZ-OD1 2.74Å; R142-D197 IonicContact CZ-OD2 2.9Å; R142-D197 IonicContact NH1-OD1 2.74Å; R142-D197 PolarHBondContact NH1-OD1 3.06Å; R142-D197 IonicContact NH1-OD2 3.75Å; R142-D197 PolarHBondContact NH1-OD2 3.35Å; R142-D197 IonicContact NH2-OD2 3.79Å; R142-D197 PolarHBondContact NH2-OD2 2.79Å
143E97.3Very high94.7Very high33 Ų3342.3 Ų42.315%0.15419%0.185CC..Hα-helixtrans-54.7-36.8178.1-69-60.2141.600114.6E138 R141 Y145 K146 Y147 H172E138-E143 HydrophobicContact CB-CB 4Å; E138-E143 HydrophobicContact CB-CG 4.08Å; E138-E143 HydrophobicContact CG-CB 4.39Å; E138-E143 HydrophobicContact CG-CG 4.14Å; E138-E143 WeakPolarHBondContact O-CB 3.39Å; E138-E143 PolarHBondContact O-N 2.94Å; R141-E143 HydrophobicContact CB-CG 4.18Å; R141-E143 PolarHBondContact O-N 3.14Å; E143-Y145 PolarHBondContact O-N 3.34Å; E143-K146 WeakPolarHBondContact O-CB 3.13Å; E143-K146 PolarHBondContact O-N 3.32Å; E143-Y147 WeakPolarHBondContact O-CD2 3.27Å; E143-H172 IonicContact OE1-CE1 3.55Å; E143-H172 PolarHBondContact OE1-CE1 3.28Å; E143-H172 IonicContact OE1-NE2 2.79Å; E143-H172 PolarHBondContact OE1-NE2 3.16Å
144P97.8Very high95.2Very high0 Ų042.5 Ų42.50%019%0.189CC..Hα-helixtrans-55.1-29.9176.8-28.535.9000114Y46 L69 F139 R142 K146 Y147 L148Y46-P144 HydrophobicContact CE2-CB 4.39Å; Y46-P144 HydrophobicContact CE2-CG 4.03Å; L69-P144 HydrophobicContact CD2-CB 4.07Å; L69-P144 HydrophobicContact CD2-CG 4.25Å; L69-P144 HydrophobicContact CG-CB 4.33Å; F139-P144 HydrophobicContact CD1-CG 3.93Å; F139-P144 HydrophobicContact CD2-CG 4.01Å; F139-P144 HydrophobicContact CE1-CG 3.8Å; F139-P144 HydrophobicContact CE2-CG 3.93Å; F139-P144 HydrophobicContact CG-CG 4.05Å; F139-P144 HydrophobicContact CZ-CG 3.82Å; R142-P144 VanDerWaalsContact C-N 3.34Å; P144-K146 VanDerWaalsContact C-N 3.3Å; P144-K146 PolarHBondContact O-N 3.47Å; P144-Y147 PolarHBondContact O-N 2.85Å; P144-L148 WeakPolarHBondContact O-CB 3.4Å; P144-L148 WeakPolarHBondContact O-CG 3.4Å; P144-L148 PolarHBondContact O-N 2.69Å
145Y97.5Very high95.3Very high2 Ų239.6 Ų39.61%0.00818%0.177CC..Hα-helixtrans-68.6-27.3178.7-68.8-76.3000113.3L69 R142 E143 Y147 L148 Q149 A164 T167 L198 E199L69-Y145 HydrophobicContact CD1-CE1 3.93Å; L69-Y145 HydrophobicContact CD1-CE2 4.29Å; L69-Y145 HydrophobicContact CD2-CE2 3.86Å; R142-Y145 HydrophobicContact CB-CD2 3.79Å; R142-Y145 HydrophobicContact CB-CE2 4.43Å; R142-Y145 HydrophobicContact CG-CD2 4.31Å; R142-Y145 HydrophobicContact CG-CE2 4.49Å; R142-Y145 WeakPolarHBondContact O-CB 3.05Å; R142-Y145 PolarHBondContact O-N 3.2Å; R142-Y145 VanDerWaalsContact O-N 3.08Å; E143-Y145 PolarHBondContact O-N 3.34Å; Y145-Y147 VanDerWaalsContact C-N 3.31Å; Y145-Y147 PolarHBondContact O-N 2.52Å; Y145-L148 HydrophobicContact CD1-CD1 4.3Å; Y145-L148 PolarHBondContact O-N 2.89Å; Y145-Q149 WeakPolarHBondContact O-CG 3.46Å; Y145-Q149 PolarHBondContact O-N 3.32Å; Y145-A164 HydrophobicContact CD1-CB 4.03Å; Y145-T167 HydrophobicContact CD1-CG2 3.84Å; Y145-T167 HydrophobicContact CD2-CG2 3.59Å; Y145-T167 HydrophobicContact CE1-CG2 3.87Å; Y145-T167 HydrophobicContact CE2-CG2 3.59Å; Y145-T167 HydrophobicContact CG-CG2 3.7Å; Y145-L198 HydrophobicContact CD1-CD1 4.05Å; Y145-L198 HydrophobicContact CE1-CB 3.89Å; Y145-L198 HydrophobicContact CE1-CD1 3.59Å; Y145-L198 HydrophobicContact CE1-CG 4.36Å; Y145-E199 HydrophobicContact CE2-CG 3.87Å; Y145-E199 WeakPolarHBondContact OH-CG 3.43Å; Y145-E199 PolarHBondContact OH-OE1 2.66Å
146K96.8Very high95.2Very high66 Ų6646.5 Ų46.529%0.28721%0.213SC..Hα-helixtrans-61-40.1174.1-176.4178.1176.61700112.3E143 P144 Q149 F168 M178E143-K146 WeakPolarHBondContact O-CB 3.13Å; E143-K146 PolarHBondContact O-N 3.32Å; P144-K146 VanDerWaalsContact C-N 3.3Å; P144-K146 PolarHBondContact O-N 3.47Å; K146-Q149 VanDerWaalsContact O-CG 3.32Å; K146-Q149 WeakPolarHBondContact O-CG 3.49Å; K146-Q149 PolarHBondContact O-NE2 3.45Å; K146-Q149 VanDerWaalsContact O-NE2 3.1Å; K146-F168 HydrophobicContact CB-CD2 3.85Å; K146-F168 HydrophobicContact CB-CE2 3.71Å; K146-F168 HydrophobicContact CB-CG 4.49Å; K146-F168 HydrophobicContact CB-CZ 4.22Å; K146-F168 HydrophobicContact CD-CE2 4.18Å; K146-F168 HydrophobicContact CD-CZ 4.07Å; K146-F168 HydrophobicContact CG-CE2 4.32Å; K146-F168 HydrophobicContact CG-CZ 4.34Å; K146-M178 HydrophobicContact CB-CE 4.29Å; K146-M178 HydrophobicContact CG-CE 4.06Å
147Y97.4Very high95.2Very high61 Ų6148.1 Ų48.124%0.23922%0.222CC..Hα-helixtrans-82-43.3178.1-58.1-78.2000111.3L50 Y53 E143 P144 Y145 Q149 Y150 A151L50-Y147 HydrophobicContact CD2-CD1 3.98Å; L50-Y147 HydrophobicContact CD2-CD2 3.68Å; L50-Y147 HydrophobicContact CD2-CE1 4.02Å; L50-Y147 HydrophobicContact CD2-CE2 3.72Å; L50-Y147 HydrophobicContact CD2-CG 3.81Å; Y53-Y147 HydrophobicContact CD1-CD1 4.13Å; Y53-Y147 HydrophobicContact CD2-CD1 4.11Å; Y53-Y147 HydrophobicContact CE1-CD1 4.05Å; Y53-Y147 HydrophobicContact CE2-CD1 4.04Å; Y53-Y147 HydrophobicContact CG-CD1 4.18Å; E143-Y147 WeakPolarHBondContact O-CD2 3.27Å; P144-Y147 PolarHBondContact O-N 2.85Å; Y145-Y147 VanDerWaalsContact C-N 3.31Å; Y145-Y147 PolarHBondContact O-N 2.52Å; Y147-Q149 VanDerWaalsContact C-N 3.34Å; Y147-Q149 PolarHBondContact O-N 3.39Å; Y147-Y150 PolarHBondContact O-N 3.31Å; Y147-A151 PolarHBondContact O-N 2.94Å
148L96.9Very high95.2Very high0 Ų048.6 Ų48.60%022%0.224CC..Hα-helixtrans-57.9-43.3179.5-84.7171.9000112.6L65 E66 L69 P144 Y145 Y150 A151 Y152 A164L65-L148 HydrophobicContact CB-CD1 4.16Å; L65-L148 HydrophobicContact CB-CD2 3.52Å; L65-L148 HydrophobicContact CB-CG 3.7Å; L65-L148 HydrophobicContact CD1-CD2 4.05Å; L65-L148 HydrophobicContact CD1-CG 3.86Å; L65-L148 HydrophobicContact CG-CD2 4.44Å; L65-L148 HydrophobicContact CG-CG 4.45Å; E66-L148 HydrophobicContact CG-CD2 4.44Å; L69-L148 HydrophobicContact CD1-CD1 3.48Å; L69-L148 VanDerWaalsContact CD1-CD1 3.48Å; P144-L148 WeakPolarHBondContact O-CB 3.4Å; P144-L148 WeakPolarHBondContact O-CG 3.4Å; P144-L148 PolarHBondContact O-N 2.69Å; Y145-L148 HydrophobicContact CD1-CD1 4.3Å; Y145-L148 PolarHBondContact O-N 2.89Å; L148-Y150 VanDerWaalsContact C-N 3.26Å; L148-Y150 PolarHBondContact O-N 2.98Å; L148-A151 PolarHBondContact O-N 3.2Å; L148-Y152 HydrophobicContact CB-CD2 4.18Å; L148-Y152 HydrophobicContact CB-CE2 3.87Å; L148-Y152 HydrophobicContact CD2-CE2 3.93Å; L148-Y152 HydrophobicContact CG-CE2 4.35Å; L148-Y152 WeakPolarHBondContact O-CB 3.25Å; L148-Y152 WeakPolarHBondContact O-CD2 3.46Å; L148-Y152 PolarHBondContact O-N 2.59Å; L148-A164 HydrophobicContact CB-CB 4.33Å
149Q96.3Very high95Very high7 Ų745.8 Ų45.83%0.03321%0.213CC..Hα-helixtrans-58.2-40.7-178.965.28026.100112.3Y145 K146 Y147 F153 A161 A164 A165 M178 Y185Y145-Q149 WeakPolarHBondContact O-CG 3.46Å; Y145-Q149 PolarHBondContact O-N 3.32Å; K146-Q149 VanDerWaalsContact O-CG 3.32Å; K146-Q149 WeakPolarHBondContact O-CG 3.49Å; K146-Q149 PolarHBondContact O-NE2 3.45Å; K146-Q149 VanDerWaalsContact O-NE2 3.1Å; Y147-Q149 VanDerWaalsContact C-N 3.34Å; Y147-Q149 PolarHBondContact O-N 3.39Å; Q149-F153 WeakPolarHBondContact O-CB 3.37Å; Q149-F153 PolarHBondContact O-N 2.62Å; Q149-A161 WeakPolarHBondContact CB-O 3.24Å; Q149-A161 WeakPolarHBondContact O-CB 3.37Å; Q149-A164 HydrophobicContact CB-CB 3.77Å; Q149-A165 HydrophobicContact CB-CB 3.97Å; Q149-A165 HydrophobicContact CG-CB 4.26Å; Q149-M178 HydrophobicContact CG-CE 3.62Å; Q149-M178 HydrophobicContact CG-SD 3.73Å; Q149-Y185 PolarHBondContact OE1-OH 3.43Å
150Y96.3Very high94.9Very high74 Ų7448.3 Ų48.329%0.2922%0.224SC..Hα-helixtrans-74-41.8179.7-170.4-111.8000111.3Y53 W58 Y147 L148 Y152 F153 K154Y53-Y150 AromaticContact CE2-CD1 3.89Å; Y53-Y150 HydrophobicContact CE2-CD1 3.89Å; Y53-Y150 AromaticContact CZ-CD1 3.8Å; Y53-Y150 VanDerWaalsContact OH-CD1 3.24Å; Y53-Y150 WeakPolarHBondContact OH-CD1 3.25Å; W58-Y150 AromaticContact CH2-CD1 3.96Å; W58-Y150 HydrophobicContact CH2-CD1 3.96Å; W58-Y150 AromaticContact CH2-CE1 3.58Å; W58-Y150 HydrophobicContact CH2-CE1 3.58Å; W58-Y150 HydrophobicContact CZ2-CE1 4.24Å; W58-Y150 AromaticContact CZ3-CD1 3.81Å; W58-Y150 HydrophobicContact CZ3-CD1 3.81Å; W58-Y150 AromaticContact CZ3-CE1 3.94Å; W58-Y150 HydrophobicContact CZ3-CE1 3.94Å; Y147-Y150 PolarHBondContact O-N 3.31Å; L148-Y150 VanDerWaalsContact C-N 3.26Å; L148-Y150 PolarHBondContact O-N 2.98Å; Y150-Y152 VanDerWaalsContact C-N 3.33Å; Y150-Y152 PolarHBondContact O-N 3.22Å; Y150-F153 WeakPolarHBondContact O-CB 3.49Å; Y150-F153 PolarHBondContact O-N 3.03Å; Y150-K154 HydrophobicContact CD1-CG 4.17Å; Y150-K154 HydrophobicContact CE1-CD 4.48Å; Y150-K154 HydrophobicContact CE1-CG 3.97Å; Y150-K154 WeakPolarHBondContact O-CG 3.41Å; Y150-K154 PolarHBondContact O-N 3.27Å; Y150-K154 WeakPolarHBondContact OH-CE 3.39Å; Y150-K154 PolarHBondContact OH-NZ 3.16Å
151A97.1Very high95.1Very high0 Ų046.3 Ų46.30%021%0.214CC..Hα-helixtrans-62.6-39.7177.300000112W58 T61 V62 Y147 L148 K154 S155W58-A151 HydrophobicContact CE3-CB 4.21Å; T61-A151 HydrophobicContact CG2-CB 3.63Å; V62-A151 HydrophobicContact CG2-CB 3.76Å; Y147-A151 PolarHBondContact O-N 2.94Å; L148-A151 PolarHBondContact O-N 3.2Å; A151-K154 PolarHBondContact O-N 3.37Å; A151-S155 VanDerWaalsContact O-CB 3.3Å; A151-S155 WeakPolarHBondContact O-CB 3.49Å; A151-S155 PolarHBondContact O-N 3.25Å; A151-S155 PolarHBondContact O-OG 3.11Å
152Y96.2Very high95.2Very high4 Ų439 Ų392%0.01619%0.186CC..Hα-helixtrans-63.5-44.6172.1-74.5-48.5000112.1V62 E66 L148 Y150 K154 S155 N156 N157 K160 A164V62-Y152 HydrophobicContact CB-CE1 4.32Å; V62-Y152 HydrophobicContact CG1-CD1 4.08Å; V62-Y152 HydrophobicContact CG1-CE1 3.41Å; V62-Y152 VanDerWaalsContact CG1-CE1 3.41Å; V62-Y152 HydrophobicContact CG2-CD1 3.79Å; V62-Y152 HydrophobicContact CG2-CE1 3.9Å; V62-Y152 HydrophobicContact CG2-CG 4.47Å; E66-Y152 WeakPolarHBondContact CG-OH 3.33Å; E66-Y152 PolarHBondContact OE1-OH 2.9Å; L148-Y152 HydrophobicContact CB-CD2 4.18Å; L148-Y152 HydrophobicContact CB-CE2 3.87Å; L148-Y152 HydrophobicContact CD2-CE2 3.93Å; L148-Y152 HydrophobicContact CG-CE2 4.35Å; L148-Y152 WeakPolarHBondContact O-CB 3.25Å; L148-Y152 WeakPolarHBondContact O-CD2 3.46Å; L148-Y152 PolarHBondContact O-N 2.59Å; Y150-Y152 VanDerWaalsContact C-N 3.33Å; Y150-Y152 PolarHBondContact O-N 3.22Å; Y152-K154 PolarHBondContact O-N 3.16Å; Y152-S155 CarbonylContact O-C 3.55Å; Y152-S155 PolarHBondContact O-N 3.22Å; Y152-S155 VanDerWaalsContact O-N 3.15Å; Y152-N156 PolarHBondContact O-N 3.25Å; Y152-N157 HydrophobicContact CD1-CB 4.33Å; Y152-N157 PolarHBondContact O-N 2.87Å; Y152-K160 HydrophobicContact CD1-CB 3.73Å; Y152-K160 HydrophobicContact CD1-CD 3.9Å; Y152-K160 HydrophobicContact CD1-CG 4.49Å; Y152-K160 HydrophobicContact CD2-CB 3.62Å; Y152-K160 HydrophobicContact CE1-CB 3.87Å; Y152-K160 HydrophobicContact CE1-CD 3.32Å; Y152-K160 HydrophobicContact CE1-CG 4.27Å; Y152-K160 HydrophobicContact CE2-CB 3.77Å; Y152-K160 HydrophobicContact CE2-CD 4.24Å; Y152-K160 HydrophobicContact CG-CB 3.62Å; Y152-A164 HydrophobicContact CD2-CB 4.18Å; Y152-A164 HydrophobicContact CE2-CB 4.27Å
153F94.4Very high95.1Very high63 Ų6337.1 Ų37.128%0.27618%0.179SC..Hα-helixtrans-60.1-46.4177.7177.8-107.3000111.3Q149 Y150 S155 N156 A161 Y184 Y185Q149-F153 WeakPolarHBondContact O-CB 3.37Å; Q149-F153 PolarHBondContact O-N 2.62Å; Y150-F153 WeakPolarHBondContact O-CB 3.49Å; Y150-F153 PolarHBondContact O-N 3.03Å; F153-S155 VanDerWaalsContact C-N 3.26Å; F153-S155 PolarHBondContact O-N 3.41Å; F153-N156 PolarHBondContact O-N 3.45Å; F153-A161 HydrophobicContact CB-CB 4.03Å; F153-Y184 AromaticContact CE2-CE1 3.73Å; F153-Y184 HydrophobicContact CE2-CE1 3.73Å; F153-Y184 AromaticContact CZ-CE1 3.6Å; F153-Y184 HydrophobicContact CZ-CE1 3.6Å; F153-Y185 HydrophobicContact CB-CE1 4.2Å; F153-Y185 HydrophobicContact CD2-CD1 4.2Å; F153-Y185 AromaticContact CD2-CE1 3.48Å; F153-Y185 HydrophobicContact CD2-CE1 3.48Å; F153-Y185 VanDerWaalsContact CD2-CE1 3.48Å; F153-Y185 HydrophobicContact CE2-CD1 4.45Å; F153-Y185 AromaticContact CE2-CE1 3.96Å; F153-Y185 HydrophobicContact CE2-CE1 3.96Å; F153-Y185 AromaticContact CG-CE1 3.82Å; F153-Y185 HydrophobicContact CG-CE1 3.82Å
154K95.5Very high95.1Very high97 Ų9735.6 Ų35.642%0.42217%0.172SC..Hα-helixtrans-64.9-27.7175.5-69.7-67.2-1721770113.7W58 Y150 A151 Y152 N156W58-K154 HydrophobicContact CB-CB 4.21Å; W58-K154 HydrophobicContact CD2-CB 3.55Å; W58-K154 HydrophobicContact CD2-CG 3.87Å; W58-K154 HydrophobicContact CE3-CB 4.2Å; W58-K154 HydrophobicContact CE3-CG 4.27Å; W58-K154 HydrophobicContact CG-CB 3.51Å; W58-K154 HydrophobicContact CG-CG 4.34Å; W58-K154 HydrophobicContact CH2-CG 4.4Å; W58-K154 HydrophobicContact CZ2-CD 4.35Å; W58-K154 HydrophobicContact CZ2-CG 3.99Å; Y150-K154 HydrophobicContact CD1-CG 4.17Å; Y150-K154 HydrophobicContact CE1-CD 4.48Å; Y150-K154 HydrophobicContact CE1-CG 3.97Å; Y150-K154 WeakPolarHBondContact O-CG 3.41Å; Y150-K154 PolarHBondContact O-N 3.27Å; Y150-K154 WeakPolarHBondContact OH-CE 3.39Å; Y150-K154 PolarHBondContact OH-NZ 3.16Å; A151-K154 PolarHBondContact O-N 3.37Å; Y152-K154 PolarHBondContact O-N 3.16Å; K154-N156 PolarHBondContact O-N 3.24Å
155S93.8Very high95Very high46 Ų4635.6 Ų35.632%0.32217%0.172SC..THydrogen-bonded Turntrans-86.413.2174.2-55.30000113.5W58 A151 Y152 F153 N157W58-S155 WeakPolarHBondContact CB-OG 3.35Å; A151-S155 VanDerWaalsContact O-CB 3.3Å; A151-S155 WeakPolarHBondContact O-CB 3.49Å; A151-S155 PolarHBondContact O-N 3.25Å; A151-S155 PolarHBondContact O-OG 3.11Å; Y152-S155 CarbonylContact O-C 3.55Å; Y152-S155 PolarHBondContact O-N 3.22Å; Y152-S155 VanDerWaalsContact O-N 3.15Å; F153-S155 VanDerWaalsContact C-N 3.26Å; F153-S155 PolarHBondContact O-N 3.41Å; S155-N157 PolarHBondContact O-N 3.48Å
156N90.9Very high94.8Very high153 Ų15337.9 Ų37.982%0.81818%0.183SC*.THydrogen-bonded Turntrans57.931.6-178.7-161.440000114.2Y152 F153 K154Y152-N156 PolarHBondContact O-N 3.25Å; F153-N156 PolarHBondContact O-N 3.45Å; K154-N156 PolarHBondContact O-N 3.24Å
157N92.2Very high94.7Very high55 Ų5534.8 Ų34.829%0.29417%0.169SC..  trans-109.473.3175-166.4-25.4000110.3Y152 S155 A159 K160 A161Y152-N157 HydrophobicContact CD1-CB 4.33Å; Y152-N157 PolarHBondContact O-N 2.87Å; S155-N157 PolarHBondContact O-N 3.48Å; N157-A159 VanDerWaalsContact C-N 3.26Å; N157-A159 PolarHBondContact O-N 3.09Å; N157-K160 PolarHBondContact O-N 3.07Å; N157-K160 WeakPolarHBondContact OD1-CB 3.45Å; N157-K160 PolarHBondContact OD1-N 3.31Å; N157-K160 VanDerWaalsContact OD1-N 3.12Å; N157-A161 WeakPolarHBondContact O-CB 3.38Å; N157-A161 PolarHBondContact O-N 3.15Å
158L91.8Very high94.6Very high44 Ų4431.9 Ų31.923%0.2316%0.158CC..Hα-helixtrans-57.3-40.4-178.2179.761.9000112.2K160 A161 V162 Y185 L188L158-K160 PolarHBondContact O-N 3.19Å; L158-A161 WeakPolarHBondContact O-CB 3.4Å; L158-A161 PolarHBondContact O-N 3.01Å; L158-V162 HydrophobicContact CD1-CG2 4.02Å; L158-V162 HydrophobicContact CG-CG2 4.27Å; L158-V162 VanDerWaalsContact O-CG2 3.3Å; L158-V162 WeakPolarHBondContact O-CG2 3.44Å; L158-V162 PolarHBondContact O-N 2.87Å; L158-Y185 HydrophobicContact CD1-CD1 4.05Å; L158-Y185 HydrophobicContact CD1-CG 4.41Å; L158-L188 HydrophobicContact CD1-CD1 3.57Å; L158-L188 HydrophobicContact CD2-CB 3.83Å; L158-L188 HydrophobicContact CD2-CD1 3.86Å; L158-L188 HydrophobicContact CG-CD1 4.37Å
159A92Very high94.5Very high11 Ų1133.3 Ų33.39%0.09117%0.165CC..Hα-helixtrans-60.1-50.1-176.800000112.1V22 N157 S163 H194V22-A159 HydrophobicContact CG2-CB 3.51Å; N157-A159 VanDerWaalsContact C-N 3.26Å; N157-A159 PolarHBondContact O-N 3.09Å; A159-S163 PolarHBondContact O-N 3.33Å; A159-S163 PolarHBondContact O-OG 3.03Å; A159-H194 HydrophobicContact CB-CB 4.41Å; A159-H194 WeakPolarHBondContact CB-NE2 3.13Å
160K93.3Very high94.3Very high63 Ų6335.2 Ų35.227%0.27418%0.175SC..Hα-helixtrans-69.5-31.9175.5-71.1-166.6174.9-1750112.8E66 Y152 N157 L158 S163 A164E66-K160 IonicContact OE1-NZ 2.66Å; E66-K160 PolarHBondContact OE1-NZ 3.49Å; Y152-K160 HydrophobicContact CD1-CB 3.73Å; Y152-K160 HydrophobicContact CD1-CD 3.9Å; Y152-K160 HydrophobicContact CD1-CG 4.49Å; Y152-K160 HydrophobicContact CD2-CB 3.62Å; Y152-K160 HydrophobicContact CE1-CB 3.87Å; Y152-K160 HydrophobicContact CE1-CD 3.32Å; Y152-K160 HydrophobicContact CE1-CG 4.27Å; Y152-K160 HydrophobicContact CE2-CB 3.77Å; Y152-K160 HydrophobicContact CE2-CD 4.24Å; Y152-K160 HydrophobicContact CG-CB 3.62Å; N157-K160 PolarHBondContact O-N 3.07Å; N157-K160 WeakPolarHBondContact OD1-CB 3.45Å; N157-K160 PolarHBondContact OD1-N 3.31Å; N157-K160 VanDerWaalsContact OD1-N 3.12Å; L158-K160 PolarHBondContact O-N 3.19Å; K160-S163 PolarHBondContact O-N 3.46Å; K160-A164 VanDerWaalsContact O-CB 3.31Å; K160-A164 WeakPolarHBondContact O-CB 3.5Å; K160-A164 PolarHBondContact O-N 3.38Å
161A94.8Very high94Very high0 Ų035.2 Ų35.20%018%0.177CC..Hα-helixtrans-61.6-47.3175.700000111.7Q149 F153 N157 L158 A164 A165 Y185Q149-A161 WeakPolarHBondContact CB-O 3.24Å; Q149-A161 WeakPolarHBondContact O-CB 3.37Å; F153-A161 HydrophobicContact CB-CB 4.03Å; N157-A161 WeakPolarHBondContact O-CB 3.38Å; N157-A161 PolarHBondContact O-N 3.15Å; L158-A161 WeakPolarHBondContact O-CB 3.4Å; L158-A161 PolarHBondContact O-N 3.01Å; A161-A164 PolarHBondContact O-N 2.99Å; A161-A165 WeakPolarHBondContact O-CB 3.36Å; A161-A165 PolarHBondContact O-N 3.37Å; A161-Y185 HydrophobicContact CB-CE2 4.43Å
162V95.2Very high93.8Very high1 Ų137.1 Ų37.11%0.00619%0.186CC..Hα-helixtrans-59.9-49176.11750000110.8L158 A164 A165 H166 Y185 A191 H194 L195L158-V162 HydrophobicContact CD1-CG2 4.02Å; L158-V162 HydrophobicContact CG-CG2 4.27Å; L158-V162 VanDerWaalsContact O-CG2 3.3Å; L158-V162 WeakPolarHBondContact O-CG2 3.44Å; L158-V162 PolarHBondContact O-N 2.87Å; V162-A164 PolarHBondContact O-N 2.83Å; V162-A165 PolarHBondContact O-N 3.18Å; V162-H166 WeakPolarHBondContact O-CB 3.12Å; V162-H166 PolarHBondContact O-N 2.94Å; V162-Y185 HydrophobicContact CG2-CD2 4.46Å; V162-Y185 HydrophobicContact CG2-CG 4.29Å; V162-A191 HydrophobicContact CG2-CB 4.07Å; V162-H194 HydrophobicContact CB-CB 3.92Å; V162-H194 HydrophobicContact CG1-CB 3.97Å; V162-L195 HydrophobicContact CG1-CD2 3.7Å; V162-L195 HydrophobicContact CG1-CG 4.13Å
163S94.4Very high93.6Very high0 Ų040.6 Ų40.60%021%0.209CC..Hα-helixtrans-63.3-42.2-179.6-54.30000112.2A159 K160 H166 T167 H194A159-S163 PolarHBondContact O-N 3.33Å; A159-S163 PolarHBondContact O-OG 3.03Å; K160-S163 PolarHBondContact O-N 3.46Å; S163-H166 PolarHBondContact O-N 3.3Å; S163-T167 WeakPolarHBondContact O-CB 3.37Å; S163-T167 PolarHBondContact O-N 2.92Å; S163-T167 PolarHBondContact O-OG1 2.94Å; S163-H194 WeakPolarHBondContact CA-O 3.15Å; S163-H194 PolarHBondContact N-O 2.88Å; S163-H194 PolarHBondContact OG-O 3.07Å
164A95.9Very high93.6Very high0 Ų044.1 Ų44.10%023%0.23CC..Hα-helixtrans-64.4-43.417700000112.3Y145 L148 Q149 Y152 K160 A161 V162 H166 T167 F168 L198Y145-A164 HydrophobicContact CD1-CB 4.03Å; L148-A164 HydrophobicContact CB-CB 4.33Å; Q149-A164 HydrophobicContact CB-CB 3.77Å; Y152-A164 HydrophobicContact CD2-CB 4.18Å; Y152-A164 HydrophobicContact CE2-CB 4.27Å; K160-A164 VanDerWaalsContact O-CB 3.31Å; K160-A164 WeakPolarHBondContact O-CB 3.5Å; K160-A164 PolarHBondContact O-N 3.38Å; A161-A164 PolarHBondContact O-N 2.99Å; V162-A164 PolarHBondContact O-N 2.83Å; A164-H166 VanDerWaalsContact C-N 3.34Å; A164-H166 PolarHBondContact O-N 3.29Å; A164-T167 PolarHBondContact O-N 3.37Å; A164-F168 PolarHBondContact O-N 2.91Å; A164-L198 HydrophobicContact CB-CD1 4.25Å
165A96.3Very high93.6Very high0 Ų041.5 Ų41.50%022%0.221CC..Hα-helixtrans-63.6-40175.800000111.8Q149 A161 V162 F168 L169 M178 M182 Y185Q149-A165 HydrophobicContact CB-CB 3.97Å; Q149-A165 HydrophobicContact CG-CB 4.26Å; A161-A165 WeakPolarHBondContact O-CB 3.36Å; A161-A165 PolarHBondContact O-N 3.37Å; V162-A165 PolarHBondContact O-N 3.18Å; A165-F168 PolarHBondContact O-N 2.75Å; A165-L169 WeakPolarHBondContact O-CG 3.41Å; A165-L169 PolarHBondContact O-N 3.15Å; A165-M178 HydrophobicContact CB-CG 4.39Å; A165-M178 HydrophobicContact CB-SD 3.65Å; A165-M182 HydrophobicContact CB-CE 3.54Å; A165-Y185 HydrophobicContact CB-CD2 4.2Å; A165-Y185 HydrophobicContact CB-CE2 4.01Å
166H94.2Very high93.7Very high51 Ų5145.7 Ų45.724%0.23624%0.235CC..Hα-helixtrans-62.7-49174.8177.8-97.2000111.2V162 S163 A164 F168 L169 L170 M182 L195 K196 D197V162-H166 WeakPolarHBondContact O-CB 3.12Å; V162-H166 PolarHBondContact O-N 2.94Å; S163-H166 PolarHBondContact O-N 3.3Å; A164-H166 VanDerWaalsContact C-N 3.34Å; A164-H166 PolarHBondContact O-N 3.29Å; H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 2.98Å; H166-L169 PolarHBondContact O-N 2.79Å; H166-L170 WeakPolarHBondContact O-CG 3.43Å; H166-L170 PolarHBondContact O-N 2.76Å; H166-M182 HydrophobicContact CB-CE 3.85Å; H166-L195 HydrophobicContact CB-CD2 4.31Å; H166-K196 PolarHBondContact ND1-O 2.91Å; H166-D197 PolarHBondContact ND1-N 3.06Å
167T94.1Very high93.9Very high0 Ų044.5 Ų44.50%023%0.226CC..Hα-helixtrans-56.4-39.2176.8-72.70000113.2R142 Y145 S163 A164 D197 L198 E199R142-T167 VanDerWaalsContact CD-O 3.23Å; R142-T167 WeakPolarHBondContact CD-O 3.39Å; R142-T167 PolarHBondContact NH1-O 3.41Å; Y145-T167 HydrophobicContact CD1-CG2 3.84Å; Y145-T167 HydrophobicContact CD2-CG2 3.59Å; Y145-T167 HydrophobicContact CE1-CG2 3.87Å; Y145-T167 HydrophobicContact CE2-CG2 3.59Å; Y145-T167 HydrophobicContact CG-CG2 3.7Å; S163-T167 WeakPolarHBondContact O-CB 3.37Å; S163-T167 PolarHBondContact O-N 2.92Å; S163-T167 PolarHBondContact O-OG1 2.94Å; A164-T167 PolarHBondContact O-N 3.37Å; T167-D197 WeakPolarHBondContact CB-OD1 3.27Å; T167-D197 VanDerWaalsContact CG2-OD1 3.29Å; T167-D197 WeakPolarHBondContact CG2-OD1 3.21Å; T167-D197 WeakPolarHBondContact OG1-CA 3.34Å; T167-D197 PolarHBondContact OG1-OD1 3.29Å; T167-L198 HydrophobicContact CG2-CB 4.44Å; T167-L198 PolarHBondContact OG1-N 3.15Å; T167-E199 HydrophobicContact CG2-CG 4.06Å
168F95.8Very high94.1Very high1 Ų142 Ų420%0.00421%0.213CC..Hα-helixtrans-67.7-48.9175.9-179.1-94000112.1R142 K146 A164 A165 H166 L170 K171 H172 D175 M178R142-F168 WeakPolarHBondContact O-CD2 3.5Å; K146-F168 HydrophobicContact CB-CD2 3.85Å; K146-F168 HydrophobicContact CB-CE2 3.71Å; K146-F168 HydrophobicContact CB-CG 4.49Å; K146-F168 HydrophobicContact CB-CZ 4.22Å; K146-F168 HydrophobicContact CD-CE2 4.18Å; K146-F168 HydrophobicContact CD-CZ 4.07Å; K146-F168 HydrophobicContact CG-CE2 4.32Å; K146-F168 HydrophobicContact CG-CZ 4.34Å; A164-F168 PolarHBondContact O-N 2.91Å; A165-F168 PolarHBondContact O-N 2.75Å; H166-F168 VanDerWaalsContact C-N 3.28Å; H166-F168 PolarHBondContact O-N 2.98Å; F168-L170 PolarHBondContact O-N 2.77Å; F168-L170 VanDerWaalsContact O-N 3.13Å; F168-K171 PolarHBondContact O-N 2.83Å; F168-H172 HydrophobicContact CD1-CB 4.13Å; F168-H172 AromaticContact CD2-CD2 3.74Å; F168-H172 HydrophobicContact CE1-CB 3.63Å; F168-H172 AromaticContact CE1-CD2 3.86Å; F168-H172 AromaticContact CE1-CG 3.88Å; F168-H172 AromaticContact CE2-CD2 3.34Å; F168-H172 WeakPolarHBondContact CE2-CD2 3.45Å; F168-H172 AromaticContact CE2-NE2 3.62Å; F168-H172 HydrophobicContact CZ-CB 3.92Å; F168-H172 AromaticContact CZ-CD2 3.42Å; F168-H172 VanDerWaalsContact CZ-CD2 3.42Å; F168-H172 WeakPolarHBondContact CZ-CD2 3.22Å; F168-H172 AromaticContact CZ-CG 3.64Å; F168-H172 AromaticContact CZ-NE2 3.92Å; F168-H172 PolarHBondContact O-CD2 3.35Å; F168-H172 PolarHBondContact O-N 2.94Å; F168-H172 VanDerWaalsContact O-N 3.11Å; F168-D175 HydrophobicContact CE1-CB 3.91Å; F168-M178 HydrophobicContact CD1-CB 4.04Å; F168-M178 HydrophobicContact CD1-CE 3.78Å; F168-M178 HydrophobicContact CD1-CG 3.79Å; F168-M178 HydrophobicContact CE1-CB 4.17Å; F168-M178 HydrophobicContact CE1-CE 4.2Å; F168-M178 HydrophobicContact CE1-CG 4.42Å; F168-M178 HydrophobicContact CG-CE 4.16Å
169L94.3Very high94.3Very high30 Ų3044.3 Ų44.316%0.15722%0.223CC..Hα-helixtrans-61.1-23.4-178.3-77.1171000113.7A165 H166 K171 H172 P173 M178 Q179 M182A165-L169 WeakPolarHBondContact O-CG 3.41Å; A165-L169 PolarHBondContact O-N 3.15Å; H166-L169 PolarHBondContact O-N 2.79Å; L169-K171 VanDerWaalsContact C-N 3.25Å; L169-K171 PolarHBondContact O-N 3.2Å; L169-H172 WeakPolarHBondContact CD2-O 3.38Å; L169-H172 CarbonylContact O-C 3.36Å; L169-H172 PolarHBondContact O-N 3.35Å; L169-P173 WeakPolarHBondContact O-CA 3.37Å; L169-P173 VanDerWaalsContact O-N 3.14Å; L169-M178 HydrophobicContact CD1-CG 4.05Å; L169-M178 HydrophobicContact CD2-CB 3.77Å; L169-M178 HydrophobicContact CD2-CG 3.8Å; L169-M178 HydrophobicContact CG-CB 4.19Å; L169-M178 HydrophobicContact CG-CG 3.61Å; L169-Q179 HydrophobicContact CD2-CG 4.12Å; L169-M182 HydrophobicContact CD1-CB 3.77Å; L169-M182 HydrophobicContact CD1-CE 4.1Å; L169-M182 HydrophobicContact CD1-CG 3.92Å
170L91.3Very high94.4Very high46 Ų4650.3 Ų50.324%0.24125%0.247CC..THydrogen-bonded Turntrans-63.8-28.4174.6-69.8178000113.6H166 F168 D197 V282H166-L170 WeakPolarHBondContact O-CG 3.43Å; H166-L170 PolarHBondContact O-N 2.76Å; F168-L170 PolarHBondContact O-N 2.77Å; F168-L170 VanDerWaalsContact O-N 3.13Å; L170-D197 HydrophobicContact CD1-CB 3.56Å; L170-D197 VanDerWaalsContact CD1-CG 3.42Å; L170-D197 VanDerWaalsContact CD1-OD2 3.25Å; L170-D197 WeakPolarHBondContact CD1-OD2 3.43Å; L170-V282 HydrophobicContact CD2-CB 3.87Å; L170-V282 HydrophobicContact CD2-CG1 3.83Å; L170-V282 HydrophobicContact CD2-CG2 4.37Å
171K90.8Very high94.5Very high75 Ų7549.5 Ų49.533%0.32625%0.245SC..THydrogen-bonded Turntrans-100.1-19.3172.9-80.4-152.5166.7-157.80113.6D140 R142 F168 L169 P173 D278D140-K171 WeakPolarHBondContact O-CD 3.33Å; D140-K171 WeakPolarHBondContact O-CE 3.28Å; D140-K171 PolarHBondContact O-NZ 2.78Å; R142-K171 HydrophobicContact CG-CD 4.16Å; R142-K171 HydrophobicContact CG-CG 4.44Å; F168-K171 PolarHBondContact O-N 2.83Å; L169-K171 VanDerWaalsContact C-N 3.25Å; L169-K171 PolarHBondContact O-N 3.2Å; K171-P173 VanDerWaalsContact C-CD 3.46Å; K171-P173 WeakPolarHBondContact O-CD 3.12Å; K171-D278 IonicContact NZ-OD1 3.21Å; K171-D278 PolarHBondContact NZ-OD1 3.03Å
172H93.8Very high94.5Very high40 Ų4049.9 Ų49.919%0.18525%0.247CC..  trans-127.864.8-178.1-56.4-87.4000110.5R141 E143 F168 L169 D174 D175R141-H172 PolarHBondContact O-NE2 2.86Å; E143-H172 IonicContact OE1-CE1 3.55Å; E143-H172 PolarHBondContact OE1-CE1 3.28Å; E143-H172 IonicContact OE1-NE2 2.79Å; E143-H172 PolarHBondContact OE1-NE2 3.16Å; F168-H172 HydrophobicContact CD1-CB 4.13Å; F168-H172 AromaticContact CD2-CD2 3.74Å; F168-H172 HydrophobicContact CE1-CB 3.63Å; F168-H172 AromaticContact CE1-CD2 3.86Å; F168-H172 AromaticContact CE1-CG 3.88Å; F168-H172 AromaticContact CE2-CD2 3.34Å; F168-H172 WeakPolarHBondContact CE2-CD2 3.45Å; F168-H172 AromaticContact CE2-NE2 3.62Å; F168-H172 HydrophobicContact CZ-CB 3.92Å; F168-H172 AromaticContact CZ-CD2 3.42Å; F168-H172 VanDerWaalsContact CZ-CD2 3.42Å; F168-H172 WeakPolarHBondContact CZ-CD2 3.22Å; F168-H172 AromaticContact CZ-CG 3.64Å; F168-H172 AromaticContact CZ-NE2 3.92Å; F168-H172 PolarHBondContact O-CD2 3.35Å; F168-H172 PolarHBondContact O-N 2.94Å; F168-H172 VanDerWaalsContact O-N 3.11Å; L169-H172 WeakPolarHBondContact CD2-O 3.38Å; L169-H172 CarbonylContact O-C 3.36Å; L169-H172 PolarHBondContact O-N 3.35Å; H172-D174 PolarHBondContact O-N 3.39Å; H172-D174 VanDerWaalsContact O-N 3.16Å; H172-D175 HydrophobicContact CB-CB 4.1Å; H172-D175 PolarHBondContact O-N 3.39Å
173P91.9Very high94.4Very high77 Ų7752.8 Ų52.850%0.527%0.271SS..THydrogen-bonded Turntrans-61.5-27.5-174.424.8-34.5000112.4L169 K171 Q179L169-P173 WeakPolarHBondContact O-CA 3.37Å; L169-P173 VanDerWaalsContact O-N 3.14Å; K171-P173 VanDerWaalsContact C-CD 3.46Å; K171-P173 WeakPolarHBondContact O-CD 3.12Å; P173-Q179 PolarHBondContact O-NE2 3.31Å
174D93.7Very high94.4Very high136 Ų13658.5 Ų58.573%0.72729%0.293SS*.THydrogen-bonded Turntrans-95.56.1-175.4-55.9-43.2000114.1H172 E176H172-D174 PolarHBondContact O-N 3.39Å; H172-D174 VanDerWaalsContact O-N 3.16Å; D174-E176 PolarHBondContact O-N 3.47Å
175D96.3Very high94.3Very high42 Ų4258.7 Ų58.723%0.22529%0.294CS..  trans-70.6100.2178.1-173.3-76.6000111F168 H172 M177 M178 Q179F168-D175 HydrophobicContact CE1-CB 3.91Å; H172-D175 HydrophobicContact CB-CB 4.1Å; H172-D175 PolarHBondContact O-N 3.39Å; D175-M177 VanDerWaalsContact C-N 3.25Å; D175-M177 PolarHBondContact O-N 2.92Å; D175-M177 PolarHBondContact OD1-N 3.28Å; D175-M178 HydrophobicContact CB-CB 4.18Å; D175-M178 PolarHBondContact O-N 3.11Å; D175-M178 VanDerWaalsContact OD1-CB 3.26Å; D175-M178 WeakPolarHBondContact OD1-CB 3.23Å; D175-M178 PolarHBondContact OD1-N 3.28Å; D175-Q179 WeakPolarHBondContact O-CG 3.4Å; D175-Q179 PolarHBondContact O-N 3.43Å
176E95.8Very high94.1Very high134 Ų13464 Ų6463%0.62632%0.317SS*.Hα-helixtrans-57.5-36-175.6-65.4-171.4-174.900113.5D174 K180D174-E176 PolarHBondContact O-N 3.47Å; E176-K180 VanDerWaalsContact O-CG 3.31Å; E176-K180 WeakPolarHBondContact O-CG 3.4Å; E176-K180 PolarHBondContact O-N 3.38Å; E176-K180 VanDerWaalsContact O-N 3.12Å; E176-K180 IonicContact OE2-NZ 2.76Å
177M94.6Very high94Very high128 Ų12865.5 Ų65.563%0.63133%0.334SS*.Hα-helixtrans-69.4-45.8-177.8-175.3-176.3-6600110.1D175 K180 N181D175-M177 VanDerWaalsContact C-N 3.25Å; D175-M177 PolarHBondContact O-N 2.92Å; D175-M177 PolarHBondContact OD1-N 3.28Å; M177-K180 PolarHBondContact O-N 3.07Å; M177-N181 PolarHBondContact O-N 3.17Å
178M95.9Very high93.8Very high4 Ų467.7 Ų67.72%0.0235%0.345CS..Hα-helixtrans-69.1-36.1178.4-16562.966.300111.7K146 Q149 A165 F168 L169 D175 K180 N181 M182K146-M178 HydrophobicContact CB-CE 4.29Å; K146-M178 HydrophobicContact CG-CE 4.06Å; Q149-M178 HydrophobicContact CG-CE 3.62Å; Q149-M178 HydrophobicContact CG-SD 3.73Å; A165-M178 HydrophobicContact CB-CG 4.39Å; A165-M178 HydrophobicContact CB-SD 3.65Å; F168-M178 HydrophobicContact CD1-CB 4.04Å; F168-M178 HydrophobicContact CD1-CE 3.78Å; F168-M178 HydrophobicContact CD1-CG 3.79Å; F168-M178 HydrophobicContact CE1-CB 4.17Å; F168-M178 HydrophobicContact CE1-CE 4.2Å; F168-M178 HydrophobicContact CE1-CG 4.42Å; F168-M178 HydrophobicContact CG-CE 4.16Å; L169-M178 HydrophobicContact CD1-CG 4.05Å; L169-M178 HydrophobicContact CD2-CB 3.77Å; L169-M178 HydrophobicContact CD2-CG 3.8Å; L169-M178 HydrophobicContact CG-CB 4.19Å; L169-M178 HydrophobicContact CG-CG 3.61Å; D175-M178 HydrophobicContact CB-CB 4.18Å; D175-M178 PolarHBondContact O-N 3.11Å; D175-M178 VanDerWaalsContact OD1-CB 3.26Å; D175-M178 WeakPolarHBondContact OD1-CB 3.23Å; D175-M178 PolarHBondContact OD1-N 3.28Å; M178-K180 VanDerWaalsContact C-N 3.33Å; M178-K180 PolarHBondContact O-N 2.49Å; M178-N181 PolarHBondContact O-N 3.36Å; M178-N181 HydrophobicContact SD-CB 4.35Å; M178-M182 VanDerWaalsContact O-CB 3.28Å; M178-M182 WeakPolarHBondContact O-CB 3.25Å; M178-M182 PolarHBondContact O-N 3.21Å
179Q95.4Very high93.5Very high92 Ų9273.6 Ų73.643%0.4338%0.384SS..Hα-helixtrans-58.6-44.2172.3-74.1-179.80.400111.7L169 P173 D175 M182 A183L169-Q179 HydrophobicContact CD2-CG 4.12Å; P173-Q179 PolarHBondContact O-NE2 3.31Å; D175-Q179 WeakPolarHBondContact O-CG 3.4Å; D175-Q179 PolarHBondContact O-N 3.43Å; Q179-M182 PolarHBondContact O-N 2.85Å; Q179-A183 WeakPolarHBondContact O-CB 3.23Å; Q179-A183 PolarHBondContact O-N 3.26Å
180K95.5Very high92.9Very high137 Ų13774.1 Ų74.160%0.59640%0.397SS*.Hα-helixtrans-63.2-44.9175.6-72.4167.8-172.71620111.8E176 M177 M178 M182 A183 Y184E176-K180 VanDerWaalsContact O-CG 3.31Å; E176-K180 WeakPolarHBondContact O-CG 3.4Å; E176-K180 PolarHBondContact O-N 3.38Å; E176-K180 VanDerWaalsContact O-N 3.12Å; E176-K180 IonicContact OE2-NZ 2.76Å; M177-K180 PolarHBondContact O-N 3.07Å; M178-K180 VanDerWaalsContact C-N 3.33Å; M178-K180 PolarHBondContact O-N 2.49Å; K180-M182 VanDerWaalsContact C-N 3.35Å; K180-M182 PolarHBondContact O-N 2.85Å; K180-A183 PolarHBondContact O-N 3.07Å; K180-Y184 PolarHBondContact O-N 3.41Å
181N94.6Very high92.6Very high45 Ų4572 Ų7224%0.24139%0.386CS..Hα-helixtrans-60.6-45176-69.3-15.5000111.4M177 M178 Y184 Y185M177-N181 PolarHBondContact O-N 3.17Å; M178-N181 PolarHBondContact O-N 3.36Å; M178-N181 HydrophobicContact SD-CB 4.35Å; N181-Y184 WeakPolarHBondContact O-CB 3.33Å; N181-Y184 PolarHBondContact O-N 2.93Å; N181-Y185 HydrophobicContact CB-CE2 4.21Å; N181-Y185 WeakPolarHBondContact O-CD2 2.94Å; N181-Y185 VanDerWaalsContact O-CG 3.23Å; N181-Y185 PolarHBondContact O-N 3.42Å
182M94.3Very high92.2Very high9 Ų975.8 Ų75.84%0.04441%0.405CS..Hα-helixtrans-64.7-40.6177.9-179.85774.300112A165 H166 L169 M178 Q179 K180 Y184 Y185 K186 L195A165-M182 HydrophobicContact CB-CE 3.54Å; H166-M182 HydrophobicContact CB-CE 3.85Å; L169-M182 HydrophobicContact CD1-CB 3.77Å; L169-M182 HydrophobicContact CD1-CE 4.1Å; L169-M182 HydrophobicContact CD1-CG 3.92Å; M178-M182 VanDerWaalsContact O-CB 3.28Å; M178-M182 WeakPolarHBondContact O-CB 3.25Å; M178-M182 PolarHBondContact O-N 3.21Å; Q179-M182 PolarHBondContact O-N 2.85Å; K180-M182 VanDerWaalsContact C-N 3.35Å; K180-M182 PolarHBondContact O-N 2.85Å; M182-Y184 VanDerWaalsContact C-N 3.31Å; M182-Y184 PolarHBondContact O-N 2.92Å; M182-Y185 PolarHBondContact O-N 3.13Å; M182-K186 HydrophobicContact CG-CD 4.29Å; M182-K186 WeakPolarHBondContact O-CB 3.45Å; M182-K186 WeakPolarHBondContact O-CG 3.07Å; M182-K186 PolarHBondContact O-N 3.25Å; M182-K186 HydrophobicContact SD-CD 4.45Å; M182-K186 HydrophobicContact SD-CG 4.18Å; M182-L195 HydrophobicContact CE-CD2 4.12Å; M182-L195 HydrophobicContact SD-CD2 3.82Å
183A94.4Very high91.8Very high61 Ų6179.5 Ų79.550%0.50442%0.422SS..Hα-helixtrans-61.3-41.6174.400000111.4Q179 K180 K186 S187Q179-A183 WeakPolarHBondContact O-CB 3.23Å; Q179-A183 PolarHBondContact O-N 3.26Å; K180-A183 PolarHBondContact O-N 3.07Å; A183-K186 PolarHBondContact O-N 3.25Å; A183-S187 PolarHBondContact O-N 2.94Å
184Y93.7Very high91.6Very high120 Ų12077 Ų7747%0.47140%0.404SS..Hα-helixtrans-62.6-47.3172.6174.9-102.5000111.7F153 K180 N181 M182 K186 S187 L188F153-Y184 AromaticContact CE2-CE1 3.73Å; F153-Y184 HydrophobicContact CE2-CE1 3.73Å; F153-Y184 AromaticContact CZ-CE1 3.6Å; F153-Y184 HydrophobicContact CZ-CE1 3.6Å; K180-Y184 PolarHBondContact O-N 3.41Å; N181-Y184 WeakPolarHBondContact O-CB 3.33Å; N181-Y184 PolarHBondContact O-N 2.93Å; M182-Y184 VanDerWaalsContact C-N 3.31Å; M182-Y184 PolarHBondContact O-N 2.92Å; Y184-K186 VanDerWaalsContact C-N 3.34Å; Y184-K186 PolarHBondContact O-N 3.38Å; Y184-S187 WeakPolarHBondContact O-CB 3.31Å; Y184-S187 PolarHBondContact O-N 2.95Å; Y184-S187 PolarHBondContact O-OG 3.17Å; Y184-L188 HydrophobicContact CE1-CD1 4.05Å
185Y93.6Very high91.3Very high4 Ų473.2 Ų73.22%0.01638%0.383CS..Hα-helixtrans-60.7-42.2178.1-59.7-30.6000112.5Q149 F153 L158 A161 V162 A165 N181 M182 S187 L188 A191Q149-Y185 PolarHBondContact OE1-OH 3.43Å; F153-Y185 HydrophobicContact CB-CE1 4.2Å; F153-Y185 HydrophobicContact CD2-CD1 4.2Å; F153-Y185 AromaticContact CD2-CE1 3.48Å; F153-Y185 HydrophobicContact CD2-CE1 3.48Å; F153-Y185 VanDerWaalsContact CD2-CE1 3.48Å; F153-Y185 HydrophobicContact CE2-CD1 4.45Å; F153-Y185 AromaticContact CE2-CE1 3.96Å; F153-Y185 HydrophobicContact CE2-CE1 3.96Å; F153-Y185 AromaticContact CG-CE1 3.82Å; F153-Y185 HydrophobicContact CG-CE1 3.82Å; L158-Y185 HydrophobicContact CD1-CD1 4.05Å; L158-Y185 HydrophobicContact CD1-CG 4.41Å; A161-Y185 HydrophobicContact CB-CE2 4.43Å; V162-Y185 HydrophobicContact CG2-CD2 4.46Å; V162-Y185 HydrophobicContact CG2-CG 4.29Å; A165-Y185 HydrophobicContact CB-CD2 4.2Å; A165-Y185 HydrophobicContact CB-CE2 4.01Å; N181-Y185 HydrophobicContact CB-CE2 4.21Å; N181-Y185 WeakPolarHBondContact O-CD2 2.94Å; N181-Y185 VanDerWaalsContact O-CG 3.23Å; N181-Y185 PolarHBondContact O-N 3.42Å; M182-Y185 PolarHBondContact O-N 3.13Å; Y185-S187 PolarHBondContact O-N 2.05Å; Y185-L188 WeakPolarHBondContact O-CB 3.41Å; Y185-L188 PolarHBondContact O-N 3.02Å; Y185-A191 WeakPolarHBondContact O-CB 3.24Å
186K91.4Very high90.9Very high111 Ų11175.8 Ų75.848%0.48339%0.392SS..Hα-helixtrans-62.2-24.3175.3-74.2177.9177.9-177.70113.5M182 A183 Y184 L188M182-K186 HydrophobicContact CG-CD 4.29Å; M182-K186 WeakPolarHBondContact O-CB 3.45Å; M182-K186 WeakPolarHBondContact O-CG 3.07Å; M182-K186 PolarHBondContact O-N 3.25Å; M182-K186 HydrophobicContact SD-CD 4.45Å; M182-K186 HydrophobicContact SD-CG 4.18Å; A183-K186 PolarHBondContact O-N 3.25Å; Y184-K186 VanDerWaalsContact C-N 3.34Å; Y184-K186 PolarHBondContact O-N 3.38Å; K186-L188 PolarHBondContact O-N 3.15Å
187S92.8Very high90.6Very high83 Ų8370.4 Ų70.458%0.5837%0.368SS*.THydrogen-bonded Turntrans-72.8-15.2174.180.10000113.4A183 Y184 Y185A183-S187 PolarHBondContact O-N 2.94Å; Y184-S187 WeakPolarHBondContact O-CB 3.31Å; Y184-S187 PolarHBondContact O-N 2.95Å; Y184-S187 PolarHBondContact O-OG 3.17Å; Y185-S187 PolarHBondContact O-N 2.05Å
188L90.9Very high90.5Very high46 Ų4664.8 Ų64.824%0.24134%0.34CS..SBendtrans-86138.5179.7-59.3172.9000110.7L158 Y184 Y185 K186 G190 A191L158-L188 HydrophobicContact CD1-CD1 3.57Å; L158-L188 HydrophobicContact CD2-CB 3.83Å; L158-L188 HydrophobicContact CD2-CD1 3.86Å; L158-L188 HydrophobicContact CG-CD1 4.37Å; Y184-L188 HydrophobicContact CE1-CD1 4.05Å; Y185-L188 WeakPolarHBondContact O-CB 3.41Å; Y185-L188 PolarHBondContact O-N 3.02Å; K186-L188 PolarHBondContact O-N 3.15Å; L188-G190 PolarHBondContact O-N 2.86Å; L188-A191 WeakPolarHBondContact O-CB 3.34Å; L188-A191 PolarHBondContact O-N 3.05Å
189P88.6Confident90.2Very high125 Ų12565.8 Ų65.881%0.81235%0.345SS*.THydrogen-bonded Turntrans-57133.3179.5-2533.8000112.9A191P189-A191 VanDerWaalsContact C-N 3.32Å; P189-A191 PolarHBondContact O-N 3.22Å
190G82.4Confident89.9Confident42 Ų4264.1 Ų64.143%0.43334%0.341SS..THydrogen-bonded Turntrans82.5-1.6176.300000115.5L188 E192 E193 H194L188-G190 PolarHBondContact O-N 2.86Å; G190-E192 VanDerWaalsContact C-N 3.3Å; G190-E192 PolarHBondContact O-N 3.27Å; G190-E193 PolarHBondContact O-N 3.36Å; G190-H194 PolarHBondContact O-CD2 3.22Å
191A85.1Confident89.6Confident2 Ų260.4 Ų60.42%0.01733%0.325CS..G310 helixtrans-63.6-31.8-178.300000113.9V162 Y185 L188 P189 E193 H194V162-A191 HydrophobicContact CG2-CB 4.07Å; Y185-A191 WeakPolarHBondContact O-CB 3.24Å; L188-A191 WeakPolarHBondContact O-CB 3.34Å; L188-A191 PolarHBondContact O-N 3.05Å; P189-A191 VanDerWaalsContact C-N 3.32Å; P189-A191 PolarHBondContact O-N 3.22Å; A191-E193 PolarHBondContact O-N 3.38Å; A191-H194 PolarHBondContact O-N 3.31Å
192E82.1Confident89.3Confident154 Ų15461.4 Ų61.472%0.7234%0.336SS*.G310 helixtrans-60.4-31-179.2-66.7-174.8169.300113.1G190 H194 L195G190-E192 VanDerWaalsContact C-N 3.3Å; G190-E192 PolarHBondContact O-N 3.27Å; E192-H194 PolarHBondContact O-N 3.11Å; E192-L195 PolarHBondContact O-N 3.36Å
193E85.3Confident89.3Confident118 Ų11861.1 Ų61.155%0.55133%0.334SS*.G310 helixtrans-71-12.5179-59.5-175.1179.800113.1G190 A191G190-E193 PolarHBondContact O-N 3.36Å; A191-E193 PolarHBondContact O-N 3.38Å
194H86.9Confident89.3Confident24 Ų2459.6 Ų59.611%0.11132%0.316CS..G310 helixtrans-106.95.4-175.4-56.7-43.9000113.6A159 V162 S163 G190 A191 E192 K196A159-H194 HydrophobicContact CB-CB 4.41Å; A159-H194 WeakPolarHBondContact CB-NE2 3.13Å; V162-H194 HydrophobicContact CB-CB 3.92Å; V162-H194 HydrophobicContact CG1-CB 3.97Å; S163-H194 WeakPolarHBondContact CA-O 3.15Å; S163-H194 PolarHBondContact N-O 2.88Å; S163-H194 PolarHBondContact OG-O 3.07Å; G190-H194 PolarHBondContact O-CD2 3.22Å; A191-H194 PolarHBondContact O-N 3.31Å; E192-H194 PolarHBondContact O-N 3.11Å; H194-K196 PolarHBondContact O-N 3.09Å
195L87.3Confident89.2Confident57 Ų5758.1 Ų58.130%0.29832%0.32SS..  trans-73.876172.9-67.4170.6000110.8V162 H166 M182 E192V162-L195 HydrophobicContact CG1-CD2 3.7Å; V162-L195 HydrophobicContact CG1-CG 4.13Å; H166-L195 HydrophobicContact CB-CD2 4.31Å; M182-L195 HydrophobicContact CE-CD2 4.12Å; M182-L195 HydrophobicContact SD-CD2 3.82Å; E192-L195 PolarHBondContact O-N 3.36Å
196K88Confident89.4Confident96 Ų9659.1 Ų59.142%0.41733%0.325SS..  trans-123.6138.5179.1-62.5-175.8-176.1-178.80109.5H166 H194H166-K196 PolarHBondContact ND1-O 2.91Å; H194-K196 PolarHBondContact O-N 3.09Å
197D90.3Very high89.6Confident20 Ų2054.2 Ų54.211%0.10730%0.304CS..  trans-79.4119.8167.4-176.915000110.1R142 H166 T167 L170 E199 T200R142-D197 IonicContact CZ-OD1 2.74Å; R142-D197 IonicContact CZ-OD2 2.9Å; R142-D197 IonicContact NH1-OD1 2.74Å; R142-D197 PolarHBondContact NH1-OD1 3.06Å; R142-D197 IonicContact NH1-OD2 3.75Å; R142-D197 PolarHBondContact NH1-OD2 3.35Å; R142-D197 IonicContact NH2-OD2 3.79Å; R142-D197 PolarHBondContact NH2-OD2 2.79Å; H166-D197 PolarHBondContact ND1-N 3.06Å; T167-D197 WeakPolarHBondContact CB-OD1 3.27Å; T167-D197 VanDerWaalsContact CG2-OD1 3.29Å; T167-D197 WeakPolarHBondContact CG2-OD1 3.21Å; T167-D197 WeakPolarHBondContact OG1-CA 3.34Å; T167-D197 PolarHBondContact OG1-OD1 3.29Å; L170-D197 HydrophobicContact CD1-CB 3.56Å; L170-D197 VanDerWaalsContact CD1-CG 3.42Å; L170-D197 VanDerWaalsContact CD1-OD2 3.25Å; L170-D197 WeakPolarHBondContact CD1-OD2 3.43Å; D197-E199 PolarHBondContact O-N 2.95Å; D197-E199 PolarHBondContact OD1-N 3.38Å; D197-T200 WeakPolarHBondContact CB-OG1 3.37Å; D197-T200 PolarHBondContact O-N 3.47Å; D197-T200 PolarHBondContact O-OG1 2.87Å
198L91.1Very high89.7Confident11 Ų1152.5 Ų52.56%0.05829%0.29CS..THydrogen-bonded Turntrans-69.4-15.9176.2-62177.2000113.1V22 Q25 Y145 A164 T167V22-L198 HydrophobicContact CG1-CD2 4.31Å; Q25-L198 HydrophobicContact CB-CB 4.1Å; Q25-L198 HydrophobicContact CB-CD2 4.48Å; Y145-L198 HydrophobicContact CD1-CD1 4.05Å; Y145-L198 HydrophobicContact CE1-CB 3.89Å; Y145-L198 HydrophobicContact CE1-CD1 3.59Å; Y145-L198 HydrophobicContact CE1-CG 4.36Å; A164-L198 HydrophobicContact CB-CD1 4.25Å; T167-L198 HydrophobicContact CG2-CB 4.44Å; T167-L198 PolarHBondContact OG1-N 3.15Å
199E90.3Very high90Very high24 Ų2456.4 Ų56.411%0.11230%0.301CS..THydrogen-bonded Turntrans-103.94.1178.1-70.2-62.1157.600114.4Y26 Y145 T167 D197 K201Y26-E199 WeakPolarHBondContact CE2-OE1 3.01Å; Y26-E199 PolarHBondContact OH-OE1 2.8Å; Y145-E199 HydrophobicContact CE2-CG 3.87Å; Y145-E199 WeakPolarHBondContact OH-CG 3.43Å; Y145-E199 PolarHBondContact OH-OE1 2.66Å; T167-E199 HydrophobicContact CG2-CG 4.06Å; D197-E199 PolarHBondContact O-N 2.95Å; D197-E199 PolarHBondContact OD1-N 3.38Å; E199-K201 PolarHBondContact O-N 3.09Å; E199-K201 IonicContact OE2-NZ 3.88Å
200T89.5Confident90.4Very high57 Ų5750.4 Ų50.435%0.3526%0.263SS..  trans-50.2129.1-179.5-660000112D197 E204D197-T200 WeakPolarHBondContact CB-OG1 3.37Å; D197-T200 PolarHBondContact O-N 3.47Å; D197-T200 PolarHBondContact O-OG1 2.87Å; T200-E204 HydrophobicContact CG2-CB 4.01Å
201K89.8Confident91.1Very high60 Ų6049.6 Ų49.626%0.26125%0.249SC..  trans-85.2159174.3-52.6-54.6179.9-164.10111.5E199 Y203 E204E199-K201 PolarHBondContact O-N 3.09Å; E199-K201 IonicContact OE2-NZ 3.88Å; K201-Y203 VanDerWaalsContact C-N 3.31Å; K201-Y203 HydrophobicContact CB-CD1 3.68Å; K201-Y203 HydrophobicContact CB-CE1 3.27Å; K201-Y203 HydrophobicContact CG-CE1 3.71Å; K201-Y203 PolarHBondContact O-N 2.81Å; K201-E204 HydrophobicContact CB-CG 4.29Å; K201-E204 PolarHBondContact N-OE1 3.26Å; K201-E204 PolarHBondContact O-N 2.81Å
202S88.3Confident91.7Very high66 Ų6656.7 Ų56.746%0.46228%0.28SS..Hα-helixtrans-59.9-40.2-176.459.70000112.9E204 T205 L206 D232S202-E204 VanDerWaalsContact C-N 3.28Å; S202-E204 PolarHBondContact O-N 3.12Å; S202-T205 PolarHBondContact O-N 3.15Å; S202-L206 PolarHBondContact O-N 3.46Å; S202-D232 PolarHBondContact OG-OD2 2.05Å; S202-D232 VanDerWaalsContact OG-OD2 3.07Å
203Y94Very high92.4Very high2 Ų250 Ų501%0.00825%0.25CS..Hα-helixtrans-64.4-30.3-179.466.7-97.8000112.7K201 L206 F207 A229 F233 V236 L279 F291K201-Y203 VanDerWaalsContact C-N 3.31Å; K201-Y203 HydrophobicContact CB-CD1 3.68Å; K201-Y203 HydrophobicContact CB-CE1 3.27Å; K201-Y203 HydrophobicContact CG-CE1 3.71Å; K201-Y203 PolarHBondContact O-N 2.81Å; Y203-L206 PolarHBondContact O-N 2.98Å; Y203-F207 VanDerWaalsContact O-CB 3.27Å; Y203-F207 WeakPolarHBondContact O-CB 3.48Å; Y203-F207 PolarHBondContact O-N 2.97Å; Y203-A229 WeakPolarHBondContact CB-O 3.27Å; Y203-F233 HydrophobicContact CD1-CB 4.31Å; Y203-F233 HydrophobicContact CD2-CB 4.2Å; Y203-F233 HydrophobicContact CD2-CD2 4.13Å; Y203-F233 HydrophobicContact CE1-CD2 4.29Å; Y203-F233 AromaticContact CE2-CD2 3.9Å; Y203-F233 HydrophobicContact CE2-CD2 3.9Å; Y203-F233 HydrophobicContact CG-CB 3.99Å; Y203-F233 HydrophobicContact CG-CD2 4.48Å; Y203-V236 HydrophobicContact CD1-CB 4.27Å; Y203-V236 HydrophobicContact CD1-CG2 4.09Å; Y203-V236 HydrophobicContact CE1-CB 4.04Å; Y203-V236 HydrophobicContact CE1-CG1 4.02Å; Y203-V236 HydrophobicContact CE1-CG2 4.21Å; Y203-L279 PolarHBondContact OH-O 3.4Å; Y203-F291 AromaticContact CD2-CE1 3.98Å; Y203-F291 HydrophobicContact CD2-CE1 3.98Å; Y203-F291 HydrophobicContact CD2-CZ 4.01Å; Y203-F291 AromaticContact CE2-CE1 3.79Å; Y203-F291 HydrophobicContact CE2-CE1 3.79Å; Y203-F291 HydrophobicContact CE2-CZ 4.08Å
204E93.9Very high93Very high30 Ų3046 Ų4614%0.1423%0.231CC..Hα-helixtrans-66.6-42.3-179.4-59.1179.1-12500111.2T200 K201 S202 L206 F207 V208 P281T200-E204 HydrophobicContact CG2-CB 4.01Å; K201-E204 HydrophobicContact CB-CG 4.29Å; K201-E204 PolarHBondContact N-OE1 3.26Å; K201-E204 PolarHBondContact O-N 2.81Å; S202-E204 VanDerWaalsContact C-N 3.28Å; S202-E204 PolarHBondContact O-N 3.12Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 3.37Å; E204-F207 PolarHBondContact O-N 3.48Å; E204-V208 WeakPolarHBondContact O-CG2 3.18Å; E204-V208 PolarHBondContact O-N 3.4Å; E204-P281 HydrophobicContact CG-CB 4.03Å
205T92.6Very high93.5Very high88 Ų8850.2 Ų50.254%0.5425%0.254SS..Hα-helixtrans-65.4-40.5176.9-60.40000110.9S202 R209S202-T205 PolarHBondContact O-N 3.15Å; T205-R209 WeakPolarHBondContact O-CB 3.32Å; T205-R209 PolarHBondContact O-N 2.98Å
206L96Very high94Very high25 Ų2550.1 Ų50.113%0.13127%0.267CS..Hα-helixtrans-64-45.1175.1-70.8167.2000111.4S202 Y203 E204 R209 A210 L228 A229S202-L206 PolarHBondContact O-N 3.46Å; Y203-L206 PolarHBondContact O-N 2.98Å; E204-L206 VanDerWaalsContact C-N 3.34Å; E204-L206 PolarHBondContact O-N 3.37Å; L206-R209 PolarHBondContact O-N 3.39Å; L206-A210 WeakPolarHBondContact O-CB 3.37Å; L206-A210 PolarHBondContact O-N 3.29Å; L206-L228 HydrophobicContact CD1-CB 3.82Å; L206-L228 HydrophobicContact CD2-CB 4.33Å; L206-L228 HydrophobicContact CD2-CD1 4.45Å; L206-A229 HydrophobicContact CB-CB 3.73Å
207F96.9Very high94.5Very high8 Ų851.4 Ų51.44%0.03528%0.278CS..Hα-helixtrans-58.5-51.3177.3175.2-100.6000111.4Y203 E204 R209 A210 V211 M226 A229 V283 V288 F291 T294 M295 Y298Y203-F207 VanDerWaalsContact O-CB 3.27Å; Y203-F207 WeakPolarHBondContact O-CB 3.48Å; Y203-F207 PolarHBondContact O-N 2.97Å; E204-F207 PolarHBondContact O-N 3.48Å; F207-R209 VanDerWaalsContact C-N 3.29Å; F207-R209 PolarHBondContact O-N 3.04Å; F207-A210 WeakPolarHBondContact O-CB 3.46Å; F207-A210 PolarHBondContact O-N 3.44Å; F207-A210 VanDerWaalsContact O-N 3.15Å; F207-V211 HydrophobicContact CD1-CG2 4.4Å; F207-V211 HydrophobicContact CD2-CG2 4.37Å; F207-V211 HydrophobicContact CE1-CG2 4Å; F207-V211 HydrophobicContact CE2-CG2 3.97Å; F207-V211 HydrophobicContact CZ-CG2 3.76Å; F207-V211 WeakPolarHBondContact O-CG2 3.3Å; F207-V211 PolarHBondContact O-N 2.91Å; F207-M226 HydrophobicContact CD2-CE 3.73Å; F207-M226 HydrophobicContact CD2-SD 3.66Å; F207-M226 HydrophobicContact CE2-CE 3.86Å; F207-M226 HydrophobicContact CE2-SD 4.14Å; F207-A229 HydrophobicContact CB-CB 4.28Å; F207-V283 HydrophobicContact CD1-CG2 4.5Å; F207-V283 HydrophobicContact CE1-CG2 4.28Å; F207-V288 HydrophobicContact CE1-CG2 4.22Å; F207-V288 HydrophobicContact CZ-CG1 4.25Å; F207-F291 HydrophobicContact CD1-CE2 4.02Å; F207-F291 AromaticContact CD2-CE2 3.71Å; F207-F291 HydrophobicContact CD2-CE2 3.71Å; F207-F291 HydrophobicContact CD2-CZ 4.22Å; F207-F291 HydrophobicContact CE1-CE2 4.05Å; F207-F291 HydrophobicContact CE2-CD2 4.41Å; F207-F291 AromaticContact CE2-CE2 3.75Å; F207-F291 HydrophobicContact CE2-CE2 3.75Å; F207-F291 AromaticContact CG-CE2 3.85Å; F207-F291 HydrophobicContact CG-CE2 3.85Å; F207-F291 HydrophobicContact CG-CZ 4.21Å; F207-F291 HydrophobicContact CZ-CD2 4.43Å; F207-F291 AromaticContact CZ-CE2 3.92Å; F207-F291 HydrophobicContact CZ-CE2 3.92Å; F207-T294 HydrophobicContact CE2-CG2 4.32Å; F207-T294 HydrophobicContact CZ-CG2 4.17Å; F207-M295 HydrophobicContact CD2-CG 3.92Å; F207-M295 HydrophobicContact CE2-CG 3.99Å; F207-Y298 HydrophobicContact CE2-CD2 4.34Å; F207-Y298 HydrophobicContact CE2-CE2 4.34Å; F207-Y298 HydrophobicContact CZ-CE2 4.31Å
208V95.4Very high94.9Very high47 Ų4754 Ų5429%0.28529%0.292SS..Hα-helixtrans-61.2-39.4178.5171.90000111.3E204 K212 V283E204-V208 WeakPolarHBondContact O-CG2 3.18Å; E204-V208 PolarHBondContact O-N 3.4Å; V208-K212 HydrophobicContact CG1-CD 4.25Å; V208-K212 WeakPolarHBondContact O-CB 3.4Å; V208-K212 WeakPolarHBondContact O-CG 3.02Å; V208-K212 PolarHBondContact O-N 3.33Å; V208-V283 HydrophobicContact CG2-CG1 4.44Å; V208-V283 HydrophobicContact CG2-CG2 4.16Å
209R96.2Very high95.2Very high128 Ų12854.7 Ų54.748%0.48330%0.295SS..Hα-helixtrans-65.4-41.9176-166172.271.8-1660.9111.7T205 L206 F207 K212 A213 D225T205-R209 WeakPolarHBondContact O-CB 3.32Å; T205-R209 PolarHBondContact O-N 2.98Å; L206-R209 PolarHBondContact O-N 3.39Å; F207-R209 VanDerWaalsContact C-N 3.29Å; F207-R209 PolarHBondContact O-N 3.04Å; R209-K212 PolarHBondContact O-N 3.11Å; R209-A213 WeakPolarHBondContact O-CB 3.48Å; R209-A213 PolarHBondContact O-N 3.07Å; R209-D225 WeakPolarHBondContact CD-OD2 3.35Å; R209-D225 VanDerWaalsContact CG-OD2 3.31Å; R209-D225 WeakPolarHBondContact CG-OD2 3.5Å; R209-D225 IonicContact CZ-OD1 2.95Å; R209-D225 IonicContact CZ-OD2 3.89Å; R209-D225 VanDerWaalsContact NE-CG 3.26Å; R209-D225 IonicContact NE-OD1 2.84Å; R209-D225 PolarHBondContact NE-OD1 3.49Å; R209-D225 IonicContact NE-OD2 3.37Å; R209-D225 PolarHBondContact NE-OD2 3.13Å; R209-D225 IonicContact NH2-OD1 2.61Å; R209-D225 PolarHBondContact NH2-OD1 3.25Å; R209-D225 IonicContact NH2-OD2 3.48Å
210A97.7Very high95.6Very high0 Ų063 Ų630%033%0.325CS..Hα-helixtrans-61.9-47.3176.700000111.9L206 F207 K212 A213 Y214 S222 D225 M226L206-A210 WeakPolarHBondContact O-CB 3.37Å; L206-A210 PolarHBondContact O-N 3.29Å; F207-A210 WeakPolarHBondContact O-CB 3.46Å; F207-A210 PolarHBondContact O-N 3.44Å; F207-A210 VanDerWaalsContact O-N 3.15Å; A210-K212 PolarHBondContact O-N 2.88Å; A210-A213 PolarHBondContact O-N 3.13Å; A210-Y214 WeakPolarHBondContact O-CB 3.36Å; A210-Y214 PolarHBondContact O-N 3.37Å; A210-S222 PolarHBondContact O-OG 3.16Å; A210-D225 HydrophobicContact CB-CB 3.67Å; A210-M226 HydrophobicContact CB-CB 3.9Å; A210-M226 HydrophobicContact CB-CE 3.58Å; A210-M226 HydrophobicContact CB-SD 4.25Å
211V96.8Very high96Very high24 Ų2462.7 Ų62.715%0.14532%0.323CS..Hα-helixtrans-63.1-40.5177.5174.60000111.6F207 Y214 N215 M226 Y298F207-V211 HydrophobicContact CD1-CG2 4.4Å; F207-V211 HydrophobicContact CD2-CG2 4.37Å; F207-V211 HydrophobicContact CE1-CG2 4Å; F207-V211 HydrophobicContact CE2-CG2 3.97Å; F207-V211 HydrophobicContact CZ-CG2 3.76Å; F207-V211 WeakPolarHBondContact O-CG2 3.3Å; F207-V211 PolarHBondContact O-N 2.91Å; V211-Y214 WeakPolarHBondContact O-CB 3.33Å; V211-Y214 PolarHBondContact O-N 3.45Å; V211-N215 PolarHBondContact O-N 3.41Å; V211-N215 PolarHBondContact O-ND2 3.24Å; V211-M226 HydrophobicContact CG2-CE 4.06Å; V211-Y298 HydrophobicContact CG1-CE1 4.33Å; V211-Y298 HydrophobicContact CG2-CD2 4.15Å; V211-Y298 HydrophobicContact CG2-CE1 4.21Å; V211-Y298 HydrophobicContact CG2-CE2 3.67Å
212K97.1Very high96.4Very high151 Ų15159.9 Ų59.966%0.65731%0.311SS*.Hα-helixtrans-62.4-42173.7-75.3176.7-179.3-179.50112V208 R209 A210 N215 G216V208-K212 HydrophobicContact CG1-CD 4.25Å; V208-K212 WeakPolarHBondContact O-CB 3.4Å; V208-K212 WeakPolarHBondContact O-CG 3.02Å; V208-K212 PolarHBondContact O-N 3.33Å; R209-K212 PolarHBondContact O-N 3.11Å; A210-K212 PolarHBondContact O-N 2.88Å; K212-N215 PolarHBondContact O-N 2.92Å; K212-G216 PolarHBondContact O-N 2.9Å; K212-G216 VanDerWaalsContact O-N 3.11Å
213A98Very high96.9Very high13 Ų1357.5 Ų57.511%0.10729%0.294CS..Hα-helixtrans-66-40.5176.800000111.9R209 A210 G216 D217 N218 T221R209-A213 WeakPolarHBondContact O-CB 3.48Å; R209-A213 PolarHBondContact O-N 3.07Å; A210-A213 PolarHBondContact O-N 3.13Å; A213-G216 CarbonylContact O-C 3.46Å; A213-G216 PolarHBondContact O-N 3.38Å; A213-D217 PolarHBondContact O-N 2.77Å; A213-N218 HydrophobicContact CB-CB 4.34Å; A213-N218 WeakPolarHBondContact O-CA 3.49Å; A213-N218 PolarHBondContact O-N 3.29Å; A213-T221 HydrophobicContact CB-CG2 3.86Å
214Y98Very high97.1Very high35 Ų3560.4 Ų60.414%0.13732%0.315CS..Hα-helixtrans-57.3-51.1173.8178.5-87.4000111.8A210 V211 G216 D217 F219 Y298 F301A210-Y214 WeakPolarHBondContact O-CB 3.36Å; A210-Y214 PolarHBondContact O-N 3.37Å; V211-Y214 WeakPolarHBondContact O-CB 3.33Å; V211-Y214 PolarHBondContact O-N 3.45Å; Y214-G216 PolarHBondContact O-N 3.41Å; Y214-D217 PolarHBondContact O-N 3.19Å; Y214-F219 HydrophobicContact CD2-CD1 4.37Å; Y214-F219 HydrophobicContact CD2-CE1 4.26Å; Y214-F219 HydrophobicContact CE2-CE1 4.39Å; Y214-Y298 AromaticContact CD1-CD1 3.85Å; Y214-Y298 HydrophobicContact CD1-CD1 3.85Å; Y214-Y298 AromaticContact CD1-CE1 3.65Å; Y214-Y298 HydrophobicContact CD1-CE1 3.65Å; Y214-Y298 AromaticContact CD2-CD1 3.62Å; Y214-Y298 HydrophobicContact CD2-CD1 3.62Å; Y214-Y298 HydrophobicContact CD2-CE1 4.29Å; Y214-Y298 HydrophobicContact CE1-CD1 4.11Å; Y214-Y298 AromaticContact CE1-CE1 3.92Å; Y214-Y298 HydrophobicContact CE1-CE1 3.92Å; Y214-Y298 AromaticContact CE2-CD1 3.84Å; Y214-Y298 HydrophobicContact CE2-CD1 3.84Å; Y214-Y298 HydrophobicContact CE2-CE1 4.47Å; Y214-Y298 AromaticContact CG-CD1 3.6Å; Y214-Y298 HydrophobicContact CG-CD1 3.6Å; Y214-Y298 AromaticContact CG-CE1 3.86Å; Y214-Y298 HydrophobicContact CG-CE1 3.86Å; Y214-F301 HydrophobicContact CD2-CD1 4.35Å; Y214-F301 HydrophobicContact CE2-CB 3.97Å; Y214-F301 AromaticContact CE2-CD1 3.26Å; Y214-F301 HydrophobicContact CE2-CD1 3.26Å; Y214-F301 AromaticContact CE2-CE1 3.93Å; Y214-F301 HydrophobicContact CE2-CE1 3.93Å; Y214-F301 AromaticContact CE2-CG 3.89Å; Y214-F301 HydrophobicContact CE2-CG 3.89Å; Y214-F301 AromaticContact CZ-CD1 3.52Å; Y214-F301 AromaticContact CZ-CE1 3.82Å; Y214-F301 WeakPolarHBondContact OH-CD1 3.49Å; Y214-F301 WeakPolarHBondContact OH-CE1 3.44Å; Y214-F301 WeakPolarHBondContact OH-CG 3.41Å
215N97.3Very high97.3Very high113 Ų11359.3 Ų59.360%0.60431%0.309SS*.Hα-helixtrans-67.3-20.4179.7-70.3-30.4000113.1V211 K212V211-N215 PolarHBondContact O-N 3.41Å; V211-N215 PolarHBondContact O-ND2 3.24Å; K212-N215 PolarHBondContact O-N 2.92Å
216G97.6Very high97.6Very high55 Ų5555.1 Ų55.157%0.56728%0.284SS*.THydrogen-bonded Turntrans-94.616.4173.400000114.2K212 A213 Y214 N218K212-G216 PolarHBondContact O-N 2.9Å; K212-G216 VanDerWaalsContact O-N 3.11Å; A213-G216 CarbonylContact O-C 3.46Å; A213-G216 PolarHBondContact O-N 3.38Å; Y214-G216 PolarHBondContact O-N 3.41Å; G216-N218 PolarHBondContact O-N 3.05Å
217D97.6Very high97.7Very high122 Ų12256.1 Ų56.165%0.65229%0.288SS*.THydrogen-bonded Turntrans5714.6-177.7-66-44.4000115.2A213 Y214 F219A213-D217 PolarHBondContact O-N 2.77Å; Y214-D217 PolarHBondContact O-N 3.19Å; D217-F219 VanDerWaalsContact C-N 3.28Å; D217-F219 HydrophobicContact CB-CE2 4.08Å; D217-F219 HydrophobicContact CB-CZ 4.21Å; D217-F219 WeakPolarHBondContact O-CD2 3.09Å; D217-F219 PolarHBondContact O-N 2.91Å; D217-F219 VanDerWaalsContact O-N 3.09Å; D217-F219 WeakPolarHBondContact OD1-CZ 3.4Å
218N98.1Very high97.8Very high75 Ų7558.3 Ų58.340%0.40130%0.299SS..  trans-87.571.4173.3-174.4-5.2000110.1A213 G216 R220 T221 S222A213-N218 HydrophobicContact CB-CB 4.34Å; A213-N218 WeakPolarHBondContact O-CA 3.49Å; A213-N218 PolarHBondContact O-N 3.29Å; G216-N218 PolarHBondContact O-N 3.05Å; N218-R220 VanDerWaalsContact C-N 3.27Å; N218-R220 PolarHBondContact O-N 3.03Å; N218-T221 WeakPolarHBondContact ND2-CB 3.44Å; N218-T221 PolarHBondContact ND2-OG1 2.92Å; N218-T221 PolarHBondContact O-N 2.04Å; N218-T221 PolarHBondContact OD1-N 3.48Å; N218-T221 VanDerWaalsContact OD1-N 3.15Å; N218-T221 PolarHBondContact OD1-OG1 3.38Å; N218-S222 PolarHBondContact O-N 3.45Å
219F98.3Very high97.9Very high25 Ų2556 Ų5611%0.1129%0.286CS..Hα-helixtrans-62.5-31.5-176.3-58.4-63000113.2Y214 D217 S222 V223 F301 A302 K305 L306Y214-F219 HydrophobicContact CD2-CD1 4.37Å; Y214-F219 HydrophobicContact CD2-CE1 4.26Å; Y214-F219 HydrophobicContact CE2-CE1 4.39Å; D217-F219 VanDerWaalsContact C-N 3.28Å; D217-F219 HydrophobicContact CB-CE2 4.08Å; D217-F219 HydrophobicContact CB-CZ 4.21Å; D217-F219 WeakPolarHBondContact O-CD2 3.09Å; D217-F219 PolarHBondContact O-N 2.91Å; D217-F219 VanDerWaalsContact O-N 3.09Å; D217-F219 WeakPolarHBondContact OD1-CZ 3.4Å; F219-S222 WeakPolarHBondContact O-CB 3.35Å; F219-S222 PolarHBondContact O-N 3.25Å; F219-V223 WeakPolarHBondContact O-CG2 3.32Å; F219-V223 PolarHBondContact O-N 3.18Å; F219-F301 HydrophobicContact CE1-CD1 4.03Å; F219-F301 AromaticContact CE1-CE1 3.78Å; F219-F301 HydrophobicContact CE1-CE1 3.78Å; F219-F301 HydrophobicContact CZ-CE1 4.09Å; F219-A302 HydrophobicContact CB-CB 4.23Å; F219-A302 HydrophobicContact CD1-CB 4.08Å; F219-K305 HydrophobicContact CB-CB 4.4Å; F219-K305 HydrophobicContact CD1-CB 4.06Å; F219-K305 HydrophobicContact CD1-CG 4.17Å; F219-K305 HydrophobicContact CD2-CB 3.51Å; F219-K305 HydrophobicContact CD2-CG 4.07Å; F219-K305 HydrophobicContact CE1-CB 4.26Å; F219-K305 HydrophobicContact CE1-CG 3.91Å; F219-K305 HydrophobicContact CE2-CB 3.72Å; F219-K305 HydrophobicContact CE2-CD 4.17Å; F219-K305 HydrophobicContact CE2-CG 3.78Å; F219-K305 HydrophobicContact CG-CB 3.7Å; F219-K305 HydrophobicContact CG-CG 4.27Å; F219-K305 HydrophobicContact CZ-CB 4.11Å; F219-K305 HydrophobicContact CZ-CD 4.21Å; F219-K305 HydrophobicContact CZ-CG 3.71Å; F219-L306 HydrophobicContact CB-CD1 4.21Å; F219-L306 HydrophobicContact CB-CD2 4.02Å; F219-L306 HydrophobicContact CB-CG 3.89Å
220R98.1Very high98Very high198 Ų19850.1 Ų50.175%0.74726%0.264SS*.Hα-helixtrans-64.8-46.3177.7178.2177.1-96.6-132.1-2.6111.7N218 S224N218-R220 VanDerWaalsContact C-N 3.27Å; N218-R220 PolarHBondContact O-N 3.03Å; R220-S224 PolarHBondContact O-N 3.4Å; R220-S224 VanDerWaalsContact O-N 3.11Å
221T98.1Very high98Very high52 Ų5257.1 Ų57.132%0.31929%0.29SS..Hα-helixtrans-67.8-40.5175-63.30000111A213 N218 V223 S224 D225A213-T221 HydrophobicContact CB-CG2 3.86Å; N218-T221 WeakPolarHBondContact ND2-CB 3.44Å; N218-T221 PolarHBondContact ND2-OG1 2.92Å; N218-T221 PolarHBondContact O-N 2.04Å; N218-T221 PolarHBondContact OD1-N 3.48Å; N218-T221 VanDerWaalsContact OD1-N 3.15Å; N218-T221 PolarHBondContact OD1-OG1 3.38Å; T221-V223 PolarHBondContact O-N 3.22Å; T221-S224 PolarHBondContact O-N 2.9Å; T221-D225 WeakPolarHBondContact CG2-OD2 3.39Å; T221-D225 WeakPolarHBondContact O-CB 3.39Å; T221-D225 PolarHBondContact O-N 3.37Å
222S98.4Very high98Very high0 Ų057.3 Ų57.30%029%0.291CS..Hα-helixtrans-54.8-49.2174.8-177.20000112A210 N218 F219 M226A210-S222 PolarHBondContact O-OG 3.16Å; N218-S222 PolarHBondContact O-N 3.45Å; F219-S222 WeakPolarHBondContact O-CB 3.35Å; F219-S222 PolarHBondContact O-N 3.25Å; S222-M226 WeakPolarHBondContact O-CB 3.24Å; S222-M226 PolarHBondContact O-N 3.46Å
223V98.7Very high98.1Very high16 Ų1650.2 Ų50.210%0.09726%0.259CS..Hα-helixtrans-60.3-52.7177.4166.10000110.8F219 T221 D225 M226 E227 A302 Y303 L306F219-V223 WeakPolarHBondContact O-CG2 3.32Å; F219-V223 PolarHBondContact O-N 3.18Å; T221-V223 PolarHBondContact O-N 3.22Å; V223-D225 VanDerWaalsContact C-N 3.28Å; V223-D225 PolarHBondContact O-N 2.89Å; V223-M226 PolarHBondContact O-N 3.37Å; V223-E227 HydrophobicContact CG1-CG 4.23Å; V223-E227 WeakPolarHBondContact O-CB 3.35Å; V223-E227 WeakPolarHBondContact O-CG 3.08Å; V223-E227 PolarHBondContact O-N 3.16Å; V223-A302 HydrophobicContact CG2-CB 3.6Å; V223-Y303 HydrophobicContact CB-CE1 4.47Å; V223-Y303 HydrophobicContact CG1-CD1 4.25Å; V223-Y303 HydrophobicContact CG1-CE1 3.47Å; V223-Y303 VanDerWaalsContact CG1-CE1 3.47Å; V223-Y303 HydrophobicContact CG1-CE2 4.19Å; V223-Y303 VanDerWaalsContact CG1-CZ 3.41Å; V223-Y303 WeakPolarHBondContact CG1-OH 3.35Å; V223-Y303 HydrophobicContact CG2-CD1 4.07Å; V223-Y303 HydrophobicContact CG2-CE1 4.11Å; V223-Y303 HydrophobicContact CG2-CG 4.27Å; V223-L306 HydrophobicContact CG2-CD1 3.97Å
224S98.4Very high98.1Very high64 Ų6450.1 Ų50.145%0.44826%0.257SS..Hα-helixtrans-57.1-42.6-177.3-176.30000112.2R220 T221 L228R220-S224 PolarHBondContact O-N 3.4Å; R220-S224 VanDerWaalsContact O-N 3.11Å; T221-S224 PolarHBondContact O-N 2.9Å; S224-L228 WeakPolarHBondContact O-CD1 3.11Å; S224-L228 VanDerWaalsContact O-CG 3.22Å; S224-L228 WeakPolarHBondContact O-CG 3.31Å; S224-L228 PolarHBondContact O-N 3.44Å
225D98.4Very high98Very high6 Ų654.5 Ų54.53%0.03228%0.276CS..Hα-helixtrans-77.4-37.9-177.6-69.5-17.5000112.3R209 A210 T221 V223 L228 A229R209-D225 WeakPolarHBondContact CD-OD2 3.35Å; R209-D225 VanDerWaalsContact CG-OD2 3.31Å; R209-D225 WeakPolarHBondContact CG-OD2 3.5Å; R209-D225 IonicContact CZ-OD1 2.95Å; R209-D225 IonicContact CZ-OD2 3.89Å; R209-D225 VanDerWaalsContact NE-CG 3.26Å; R209-D225 IonicContact NE-OD1 2.84Å; R209-D225 PolarHBondContact NE-OD1 3.49Å; R209-D225 IonicContact NE-OD2 3.37Å; R209-D225 PolarHBondContact NE-OD2 3.13Å; R209-D225 IonicContact NH2-OD1 2.61Å; R209-D225 PolarHBondContact NH2-OD1 3.25Å; R209-D225 IonicContact NH2-OD2 3.48Å; A210-D225 HydrophobicContact CB-CB 3.67Å; T221-D225 WeakPolarHBondContact CG2-OD2 3.39Å; T221-D225 WeakPolarHBondContact O-CB 3.39Å; T221-D225 PolarHBondContact O-N 3.37Å; V223-D225 VanDerWaalsContact C-N 3.28Å; V223-D225 PolarHBondContact O-N 2.89Å; D225-L228 PolarHBondContact O-N 2.92Å; D225-A229 WeakPolarHBondContact O-CB 3.33Å; D225-A229 PolarHBondContact O-N 3.37Å
226M98.4Very high97.9Very high0 Ų050.1 Ų50.10%025%0.254CS..Hα-helixtrans-70.6-38.5-179.7-165.463.377.500111.9F207 A210 V211 S222 V223 L228 A229 L230 M295 Y298 L299F207-M226 HydrophobicContact CD2-CE 3.73Å; F207-M226 HydrophobicContact CD2-SD 3.66Å; F207-M226 HydrophobicContact CE2-CE 3.86Å; F207-M226 HydrophobicContact CE2-SD 4.14Å; A210-M226 HydrophobicContact CB-CB 3.9Å; A210-M226 HydrophobicContact CB-CE 3.58Å; A210-M226 HydrophobicContact CB-SD 4.25Å; V211-M226 HydrophobicContact CG2-CE 4.06Å; S222-M226 WeakPolarHBondContact O-CB 3.24Å; S222-M226 PolarHBondContact O-N 3.46Å; V223-M226 PolarHBondContact O-N 3.37Å; M226-L228 VanDerWaalsContact C-N 3.32Å; M226-L228 PolarHBondContact O-N 3.3Å; M226-A229 PolarHBondContact O-N 2.94Å; M226-L230 WeakPolarHBondContact O-CB 3.14Å; M226-L230 PolarHBondContact O-N 3.44Å; M226-M295 HydrophobicContact CG-CB 4.38Å; M226-M295 HydrophobicContact SD-CB 3.92Å; M226-M295 HydrophobicContact SD-CG 3.71Å; M226-M295 HydrophobicContact SD-SD 4.4Å; M226-Y298 HydrophobicContact CE-CD2 3.71Å; M226-Y298 HydrophobicContact CE-CG 3.78Å; M226-L299 HydrophobicContact CB-CD2 3.69Å; M226-L299 HydrophobicContact CB-CG 4.06Å; M226-L299 HydrophobicContact CG-CD1 4.21Å; M226-L299 HydrophobicContact CG-CD2 3.87Å; M226-L299 HydrophobicContact CG-CG 3.63Å
227E98.6Very high97.9Very high47 Ų4747.6 Ų47.622%0.2223%0.227CC..Hα-helixtrans-62.2-40.5173.2-71.2-69.1-179.900111.4V223 R231 L299 Y303 R353V223-E227 HydrophobicContact CG1-CG 4.23Å; V223-E227 WeakPolarHBondContact O-CB 3.35Å; V223-E227 WeakPolarHBondContact O-CG 3.08Å; V223-E227 PolarHBondContact O-N 3.16Å; E227-R231 WeakPolarHBondContact O-CB 3.05Å; E227-R231 PolarHBondContact O-N 3.14Å; E227-R231 VanDerWaalsContact O-N 3.12Å; E227-L299 HydrophobicContact CG-CD2 3.77Å; E227-Y303 WeakPolarHBondContact CG-OH 3.49Å; E227-Y303 VanDerWaalsContact OE1-CE2 3.22Å; E227-Y303 WeakPolarHBondContact OE1-CE2 3.23Å; E227-Y303 VanDerWaalsContact OE1-CZ 3.32Å; E227-Y303 PolarHBondContact OE1-OH 3.36Å; E227-R353 IonicContact OE1-CZ 3.39Å; E227-R353 IonicContact OE1-NH1 3.63Å; E227-R353 PolarHBondContact OE1-NH1 3.39Å; E227-R353 IonicContact OE1-NH2 3.59Å; E227-R353 PolarHBondContact OE1-NH2 2.87Å; E227-R353 IonicContact OE2-CZ 3.54Å; E227-R353 IonicContact OE2-NH1 2.69Å; E227-R353 PolarHBondContact OE2-NH1 3.45Å
228L98.3Very high97.8Very high53 Ų5343.5 Ų43.528%0.27721%0.205SC..Hα-helixtrans-66.6-42.3174.4-68.1172.3000111.5L206 S224 D225 M226 R231 D232L206-L228 HydrophobicContact CD1-CB 3.82Å; L206-L228 HydrophobicContact CD2-CB 4.33Å; L206-L228 HydrophobicContact CD2-CD1 4.45Å; S224-L228 WeakPolarHBondContact O-CD1 3.11Å; S224-L228 VanDerWaalsContact O-CG 3.22Å; S224-L228 WeakPolarHBondContact O-CG 3.31Å; S224-L228 PolarHBondContact O-N 3.44Å; D225-L228 PolarHBondContact O-N 2.92Å; M226-L228 VanDerWaalsContact C-N 3.32Å; M226-L228 PolarHBondContact O-N 3.3Å; L228-R231 VanDerWaalsContact CD2-NH2 3.31Å; L228-D232 VanDerWaalsContact O-CB 3.28Å; L228-D232 WeakPolarHBondContact O-CB 3.4Å; L228-D232 PolarHBondContact O-N 3.48Å
229A98.1Very high97.7Very high0 Ų042.8 Ų42.80%020%0.199CC..Hα-helixtrans-60.5-47.2177.200000111.3Y203 L206 F207 D225 M226 D232 F233Y203-A229 WeakPolarHBondContact CB-O 3.27Å; L206-A229 HydrophobicContact CB-CB 3.73Å; F207-A229 HydrophobicContact CB-CB 4.28Å; D225-A229 WeakPolarHBondContact O-CB 3.33Å; D225-A229 PolarHBondContact O-N 3.37Å; M226-A229 PolarHBondContact O-N 2.94Å; A229-D232 PolarHBondContact O-N 2.86Å; A229-F233 VanDerWaalsContact O-CB 3.3Å; A229-F233 WeakPolarHBondContact O-CB 3.39Å; A229-F233 PolarHBondContact O-N 3.49Å
230L98.2Very high97.5Very high3 Ų342.4 Ų42.42%0.01620%0.2CC..Hα-helixtrans-61.4-47.3-179.8-175.267.9000111.8M226 F233 F234 V292 M295 Y296 L299M226-L230 WeakPolarHBondContact O-CB 3.14Å; M226-L230 PolarHBondContact O-N 3.44Å; L230-F233 PolarHBondContact O-N 3.33Å; L230-F234 HydrophobicContact CD1-CD2 4.43Å; L230-F234 HydrophobicContact CD1-CE2 3.64Å; L230-F234 HydrophobicContact CD1-CZ 3.75Å; L230-F234 HydrophobicContact CD2-CE2 4.26Å; L230-F234 HydrophobicContact CG-CD2 4.2Å; L230-F234 HydrophobicContact CG-CE2 3.64Å; L230-F234 HydrophobicContact CG-CZ 4.28Å; L230-F234 WeakPolarHBondContact O-CD2 3.37Å; L230-F234 PolarHBondContact O-N 2.96Å; L230-V292 HydrophobicContact CD1-CG1 4.33Å; L230-M295 HydrophobicContact CB-SD 4.25Å; L230-M295 HydrophobicContact CD1-CB 4.16Å; L230-M295 HydrophobicContact CD1-CE 3.6Å; L230-M295 HydrophobicContact CD1-SD 3.98Å; L230-Y296 HydrophobicContact CD1-CE2 4.25Å; L230-Y296 HydrophobicContact CD2-CE1 3.77Å; L230-Y296 HydrophobicContact CD2-CE2 4.46Å; L230-L299 HydrophobicContact CD2-CD1 3.97Å
231R97.9Very high97.4Very high147 Ų14733.3 Ų33.356%0.55517%0.166SC*.Hα-helixtrans-61.8-46.7176.6-175.5-162.767.3-157-4.9111.7E227 L228 F233 F234 K235E227-R231 WeakPolarHBondContact O-CB 3.05Å; E227-R231 PolarHBondContact O-N 3.14Å; E227-R231 VanDerWaalsContact O-N 3.12Å; L228-R231 VanDerWaalsContact CD2-NH2 3.31Å; R231-F233 VanDerWaalsContact C-N 3.33Å; R231-F234 PolarHBondContact O-N 3.12Å; R231-K235 PolarHBondContact O-N 3.2Å; R231-K235 VanDerWaalsContact O-N 3.15Å
232D97.4Very high97.3Very high29 Ų2931.2 Ų31.216%0.15515%0.154CC..Hα-helixtrans-66.3-36.9179.8-80.822.1000111.2S202 L228 A229 K235 V236S202-D232 PolarHBondContact OG-OD2 2.05Å; S202-D232 VanDerWaalsContact OG-OD2 3.07Å; L228-D232 VanDerWaalsContact O-CB 3.28Å; L228-D232 WeakPolarHBondContact O-CB 3.4Å; L228-D232 PolarHBondContact O-N 3.48Å; A229-D232 PolarHBondContact O-N 2.86Å; D232-K235 PolarHBondContact O-N 3Å; D232-V236 WeakPolarHBondContact O-CG2 3.48Å; D232-V236 PolarHBondContact O-N 2.91Å
233F97.8Very high97Very high1 Ų131.4 Ų31.40%0.00416%0.156CC..Hα-helixtrans-60.1-52173.9171.4-97.6000111.4Y203 A229 L230 R231 K235 V236 Y237 L279 F291 V292 M295 Y359Y203-F233 HydrophobicContact CD1-CB 4.31Å; Y203-F233 HydrophobicContact CD2-CB 4.2Å; Y203-F233 HydrophobicContact CD2-CD2 4.13Å; Y203-F233 HydrophobicContact CE1-CD2 4.29Å; Y203-F233 AromaticContact CE2-CD2 3.9Å; Y203-F233 HydrophobicContact CE2-CD2 3.9Å; Y203-F233 HydrophobicContact CG-CB 3.99Å; Y203-F233 HydrophobicContact CG-CD2 4.48Å; A229-F233 VanDerWaalsContact O-CB 3.3Å; A229-F233 WeakPolarHBondContact O-CB 3.39Å; A229-F233 PolarHBondContact O-N 3.49Å; L230-F233 PolarHBondContact O-N 3.33Å; R231-F233 VanDerWaalsContact C-N 3.33Å; F233-K235 PolarHBondContact O-N 2.98Å; F233-V236 PolarHBondContact O-N 3.15Å; F233-V236 VanDerWaalsContact O-N 3.09Å; F233-Y237 WeakPolarHBondContact O-CB 3.16Å; F233-Y237 PolarHBondContact O-N 3.32Å; F233-L279 HydrophobicContact CE2-CB 3.96Å; F233-F291 AromaticContact CD2-CD1 3.96Å; F233-F291 HydrophobicContact CD2-CD1 3.96Å; F233-F291 AromaticContact CD2-CE1 3.57Å; F233-F291 HydrophobicContact CD2-CE1 3.57Å; F233-F291 AromaticContact CE2-CD1 3.73Å; F233-F291 HydrophobicContact CE2-CD1 3.73Å; F233-F291 AromaticContact CE2-CE1 3.83Å; F233-F291 HydrophobicContact CE2-CE1 3.83Å; F233-F291 HydrophobicContact CG-CE1 4.15Å; F233-F291 HydrophobicContact CZ-CD1 4.22Å; F233-V292 HydrophobicContact CD1-CG2 4.09Å; F233-V292 HydrophobicContact CE1-CG2 3.35Å; F233-V292 HydrophobicContact CZ-CG2 3.85Å; F233-M295 HydrophobicContact CB-CE 4.21Å; F233-M295 HydrophobicContact CD1-CE 3.95Å; F233-M295 HydrophobicContact CG-CE 4.02Å; F233-Y359 HydrophobicContact CE1-CE2 4.08Å
234F97.8Very high96.6Very high12 Ų1231 Ų315%0.05315%0.153CC..Hα-helixtrans-60.6-35.2179.3-70.3-42.3000112.7L230 R231 Y237 D238 V292 E355 Y359L230-F234 HydrophobicContact CD1-CD2 4.43Å; L230-F234 HydrophobicContact CD1-CE2 3.64Å; L230-F234 HydrophobicContact CD1-CZ 3.75Å; L230-F234 HydrophobicContact CD2-CE2 4.26Å; L230-F234 HydrophobicContact CG-CD2 4.2Å; L230-F234 HydrophobicContact CG-CE2 3.64Å; L230-F234 HydrophobicContact CG-CZ 4.28Å; L230-F234 WeakPolarHBondContact O-CD2 3.37Å; L230-F234 PolarHBondContact O-N 2.96Å; R231-F234 PolarHBondContact O-N 3.12Å; F234-Y237 PolarHBondContact O-N 3.11Å; F234-D238 PolarHBondContact O-N 3.42Å; F234-V292 HydrophobicContact CE1-CG1 4.1Å; F234-V292 HydrophobicContact CZ-CG1 3.95Å; F234-E355 HydrophobicContact CD2-CB 4.12Å; F234-E355 HydrophobicContact CD2-CG 4.02Å; F234-E355 HydrophobicContact CE2-CB 3.93Å; F234-E355 HydrophobicContact CE2-CG 3.51Å; F234-E355 HydrophobicContact CZ-CG 4.43Å; F234-Y359 AromaticContact CD1-CD2 3.86Å; F234-Y359 HydrophobicContact CD1-CD2 3.86Å; F234-Y359 HydrophobicContact CD1-CE2 4.46Å; F234-Y359 HydrophobicContact CD1-CG 4.12Å; F234-Y359 HydrophobicContact CE1-CD1 4.08Å; F234-Y359 AromaticContact CE1-CD2 3.75Å; F234-Y359 HydrophobicContact CE1-CD2 3.75Å; F234-Y359 HydrophobicContact CE1-CE2 4.37Å; F234-Y359 AromaticContact CE1-CG 3.56Å; F234-Y359 HydrophobicContact CE1-CG 3.56Å
235K96.3Very high96Very high126 Ų12630.1 Ų30.155%0.54814%0.142SC..Hα-helixtrans-63.1-49.4173.4-178.3-171.3168.7-1610111.6R231 D232 F233 Y237 D238 E239R231-K235 PolarHBondContact O-N 3.2Å; R231-K235 VanDerWaalsContact O-N 3.15Å; D232-K235 PolarHBondContact O-N 3Å; F233-K235 PolarHBondContact O-N 2.98Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; K235-Y237 PolarHBondContact O-N 3.28Å; K235-D238 PolarHBondContact O-N 2.85Å; K235-E239 WeakPolarHBondContact CE-OE1 3.42Å; K235-E239 IonicContact NZ-OE1 2.98Å; K235-E239 WeakPolarHBondContact O-CG 3.33Å; K235-E239 PolarHBondContact O-N 2.96Å
236V95.7Very high94.9Very high21 Ų2130.6 Ų30.613%0.12715%0.148CC..Hα-helixtrans-66.3-32.9179.5176.10000111.3Y203 D232 F233 E239 C240 L279Y203-V236 HydrophobicContact CD1-CB 4.27Å; Y203-V236 HydrophobicContact CD1-CG2 4.09Å; Y203-V236 HydrophobicContact CE1-CB 4.04Å; Y203-V236 HydrophobicContact CE1-CG1 4.02Å; Y203-V236 HydrophobicContact CE1-CG2 4.21Å; D232-V236 WeakPolarHBondContact O-CG2 3.48Å; D232-V236 PolarHBondContact O-N 2.91Å; F233-V236 PolarHBondContact O-N 3.15Å; F233-V236 VanDerWaalsContact O-N 3.09Å; V236-E239 PolarHBondContact O-N 3.22Å; V236-C240 WeakPolarHBondContact O-CB 3.45Å; V236-C240 PolarHBondContact O-N 2.88Å; V236-L279 HydrophobicContact CG1-CD1 4.08Å; V236-L279 HydrophobicContact CG1-CD2 3.63Å
237Y96.9Very high93.5Very high3 Ų333.7 Ų33.71%0.01217%0.168CC..Hα-helixtrans-63.2-47.9172.6178.7-98.1000111.8F233 F234 K235 E239 C240 L241 C275 E276 L279 Y359 T363 Q366F233-Y237 WeakPolarHBondContact O-CB 3.16Å; F233-Y237 PolarHBondContact O-N 3.32Å; F234-Y237 PolarHBondContact O-N 3.11Å; K235-Y237 VanDerWaalsContact C-N 3.27Å; K235-Y237 PolarHBondContact O-N 3.28Å; Y237-E239 VanDerWaalsContact C-N 3.3Å; Y237-E239 PolarHBondContact O-N 3.25Å; Y237-C240 WeakPolarHBondContact O-CB 3.35Å; Y237-C240 PolarHBondContact O-N 3.07Å; Y237-C240 VanDerWaalsContact O-N 3.13Å; Y237-L241 HydrophobicContact CD1-CD1 4.03Å; Y237-L241 HydrophobicContact CD1-CG 4.36Å; Y237-L241 HydrophobicContact CE1-CD1 3.4Å; Y237-L241 HydrophobicContact CE1-CD2 4.46Å; Y237-L241 HydrophobicContact CE1-CG 3.93Å; Y237-L241 WeakPolarHBondContact O-CG 3.45Å; Y237-L241 PolarHBondContact O-N 3Å; Y237-C275 HydrophobicContact CD2-CB 4.13Å; Y237-C275 HydrophobicContact CE2-CB 3.89Å; Y237-E276 HydrophobicContact CE2-CB 4.4Å; Y237-L279 HydrophobicContact CD2-CD1 4.29Å; Y237-Y359 AromaticContact CD1-CD2 3.76Å; Y237-Y359 HydrophobicContact CD1-CD2 3.76Å; Y237-Y359 AromaticContact CD1-CE2 3.62Å; Y237-Y359 HydrophobicContact CD1-CE2 3.62Å; Y237-Y359 AromaticContact CD2-CE2 3.78Å; Y237-Y359 HydrophobicContact CD2-CE2 3.78Å; Y237-Y359 AromaticContact CE1-CD2 3.67Å; Y237-Y359 HydrophobicContact CE1-CD2 3.67Å; Y237-Y359 AromaticContact CE1-CE2 3.53Å; Y237-Y359 HydrophobicContact CE1-CE2 3.53Å; Y237-Y359 AromaticContact CE2-CE2 3.72Å; Y237-Y359 HydrophobicContact CE2-CE2 3.72Å; Y237-Y359 HydrophobicContact CG-CD2 4.29Å; Y237-Y359 AromaticContact CG-CE2 3.74Å; Y237-Y359 HydrophobicContact CG-CE2 3.74Å; Y237-Y359 AromaticContact CZ-CE2 3.61Å; Y237-T363 HydrophobicContact CE2-CG2 4.5Å; Y237-T363 WeakPolarHBondContact OH-CG2 3.5Å; Y237-Q366 PolarHBondContact OH-OE1 3.38Å
238D96.5Very high92.2Very high35 Ų3534.2 Ų34.219%0.18717%0.168CC..Hα-helixtrans-61.2-38.4175.3-76-23.9000111.7L84 F234 K235 L241 A242 R358L84-D238 HydrophobicContact CD2-CB 4.33Å; F234-D238 PolarHBondContact O-N 3.42Å; K235-D238 PolarHBondContact O-N 2.85Å; D238-L241 PolarHBondContact O-N 3.42Å; D238-A242 WeakPolarHBondContact O-CB 3.36Å; D238-A242 PolarHBondContact O-N 3.03Å; D238-R358 IonicContact OD1-CZ 2.69Å; D238-R358 IonicContact OD1-NH1 3.41Å; D238-R358 PolarHBondContact OD1-NH1 2.88Å; D238-R358 IonicContact OD1-NH2 2.66Å; D238-R358 IonicContact OD2-CZ 3.93Å; D238-R358 IonicContact OD2-NH1 2.69Å; D238-R358 PolarHBondContact OD2-NH1 3.26Å; D238-R358 IonicContact OD2-NH2 3.41Å; D238-R358 PolarHBondContact OD2-NH2 3.27Å
239E95.1Very high90.5Very high60 Ų6037.6 Ų37.628%0.2818%0.182SC..Hα-helixtrans-63.4-41.5173-72.2170.4174.900112A80 L84 K235 V236 Y237 A242 A243A80-E239 HydrophobicContact CB-CB 4.18Å; A80-E239 HydrophobicContact CB-CG 4.45Å; L84-E239 HydrophobicContact CD1-CG 3.98Å; K235-E239 WeakPolarHBondContact CE-OE1 3.42Å; K235-E239 IonicContact NZ-OE1 2.98Å; K235-E239 WeakPolarHBondContact O-CG 3.33Å; K235-E239 PolarHBondContact O-N 2.96Å; V236-E239 PolarHBondContact O-N 3.22Å; Y237-E239 VanDerWaalsContact C-N 3.3Å; Y237-E239 PolarHBondContact O-N 3.25Å; E239-A242 PolarHBondContact O-N 3.29Å; E239-A243 WeakPolarHBondContact O-CB 3.44Å; E239-A243 PolarHBondContact O-N 3.48Å
240C95Very high88.9Confident17 Ų1742.5 Ų42.512%0.11521%0.212CC..Hα-helixtrans-61-49.6175.5-177.40000111.4V236 Y237 A242 A243 S244 C275 L279V236-C240 WeakPolarHBondContact O-CB 3.45Å; V236-C240 PolarHBondContact O-N 2.88Å; Y237-C240 WeakPolarHBondContact O-CB 3.35Å; Y237-C240 PolarHBondContact O-N 3.07Å; Y237-C240 VanDerWaalsContact O-N 3.13Å; C240-A242 VanDerWaalsContact C-N 3.27Å; C240-A242 PolarHBondContact O-N 2.77Å; C240-A243 PolarHBondContact O-N 3.11Å; C240-A243 VanDerWaalsContact O-N 3.16Å; C240-S244 PolarHBondContact O-N 3.06Å; C240-S244 PolarHBondContact O-OG 3.15Å; C240-S244 VanDerWaalsContact O-OG 3.11Å; C240-C275 HydrophobicContact CB-CB 3.85Å; C240-C275 WeakPolarHBondContact CB-SG 3.13Å; C240-C275 VanDerWaalsContact SG-CA 3.57Å; C240-C275 WeakPolarHBondContact SG-CB 3.4Å; C240-C275 CovalentContact SG-SG 2.05Å; C240-C275 PolarHBondContact SG-SG 2.75Å; C240-L279 HydrophobicContact CB-CD1 4Å
241L95.6Very high87.4Confident8 Ų849 Ų494%0.04224%0.24CC..Hα-helixtrans-58.1-41.5177.9-69.6-175.9000112.3Y237 D238 S244 K272 C275 Q362Y237-L241 HydrophobicContact CD1-CD1 4.03Å; Y237-L241 HydrophobicContact CD1-CG 4.36Å; Y237-L241 HydrophobicContact CE1-CD1 3.4Å; Y237-L241 HydrophobicContact CE1-CD2 4.46Å; Y237-L241 HydrophobicContact CE1-CG 3.93Å; Y237-L241 WeakPolarHBondContact O-CG 3.45Å; Y237-L241 PolarHBondContact O-N 3Å; D238-L241 PolarHBondContact O-N 3.42Å; L241-S244 PolarHBondContact O-N 3.47Å; L241-K272 HydrophobicContact CD2-CB 3.59Å; L241-K272 HydrophobicContact CD2-CD 4.29Å; L241-K272 HydrophobicContact CD2-CG 3.7Å; L241-K272 WeakPolarHBondContact O-CE 3.23Å; L241-C275 HydrophobicContact CD2-CB 4.35Å; L241-Q362 HydrophobicContact CD1-CG 4.47Å
242A94.8Very high86Confident7 Ų747.5 Ų47.56%0.05824%0.24CC..Hα-helixtrans-69.2-37178.800000112.1A80 N83 L84 D238 E239 C240 S244A80-A242 HydrophobicContact CB-CB 4.36Å; N83-A242 HydrophobicContact CB-CB 3.83Å; N83-A242 WeakPolarHBondContact CB-O 3.39Å; N83-A242 PolarHBondContact ND2-O 3.41Å; L84-A242 HydrophobicContact CD1-CB 4.45Å; L84-A242 HydrophobicContact CD2-CB 3.9Å; L84-A242 HydrophobicContact CG-CB 3.66Å; D238-A242 WeakPolarHBondContact O-CB 3.36Å; D238-A242 PolarHBondContact O-N 3.03Å; E239-A242 PolarHBondContact O-N 3.29Å; C240-A242 VanDerWaalsContact C-N 3.27Å; C240-A242 PolarHBondContact O-N 2.77Å; A242-S244 VanDerWaalsContact C-N 3.28Å; A242-S244 PolarHBondContact O-N 2.77Å
243A92.3Very high84.7Confident5 Ų556.2 Ų56.24%0.04128%0.277CS..Hα-helixtrans-74.2-17.3177.200000112.9R76 A80 E239 C240 E245R76-A243 PolarHBondContact NH1-O 3.38Å; A80-A243 HydrophobicContact CB-CB 4.26Å; E239-A243 WeakPolarHBondContact O-CB 3.44Å; E239-A243 PolarHBondContact O-N 3.48Å; C240-A243 PolarHBondContact O-N 3.11Å; C240-A243 VanDerWaalsContact O-N 3.16Å; A243-E245 PolarHBondContact O-N 3.3Å
244S90.4Very high83.8Confident6 Ų659.2 Ų59.24%0.04229%0.29CS..THydrogen-bonded Turntrans-69.3-10.6175.9-65.70000114.4C240 L241 A242 G246 R248C240-S244 PolarHBondContact O-N 3.06Å; C240-S244 PolarHBondContact O-OG 3.15Å; C240-S244 VanDerWaalsContact O-OG 3.11Å; L241-S244 PolarHBondContact O-N 3.47Å; A242-S244 VanDerWaalsContact C-N 3.28Å; A242-S244 PolarHBondContact O-N 2.77Å; S244-G246 VanDerWaalsContact C-N 3.32Å; S244-G246 PolarHBondContact O-N 3.31Å; S244-R248 PolarHBondContact O-NH2 3.22Å
245E85.6Confident83.1Confident46 Ų4665.2 Ų65.222%0.21532%0.322CS..THydrogen-bonded Turntrans-95.227.1179.7-57.1178.3-178.600113N83 R112 A243 V268 K272N83-E245 PolarHBondContact OD1-OE2 2.97Å; R112-E245 IonicContact CZ-OE2 3.71Å; R112-E245 VanDerWaalsContact NH2-CD 3.26Å; R112-E245 IonicContact NH2-OE1 3.83Å; R112-E245 PolarHBondContact NH2-OE1 2.95Å; R112-E245 VanDerWaalsContact NH2-OE1 3.14Å; R112-E245 IonicContact NH2-OE2 2.77Å; R112-E245 PolarHBondContact NH2-OE2 2.93Å; A243-E245 PolarHBondContact O-N 3.3Å; E245-V268 HydrophobicContact CG-CG1 4.04Å; E245-K272 IonicContact OE1-NZ 3.73Å; E245-K272 PolarHBondContact OE1-NZ 2.87Å
246G75.6Confident82.7Confident16 Ų1664.8 Ų64.817%0.16532%0.32CS..  trans-64.5172.7176.800000114.3E79 S244E79-G246 VanDerWaalsContact OE1-CA 3.25Å; E79-G246 WeakPolarHBondContact OE1-CA 3.3Å; S244-G246 VanDerWaalsContact C-N 3.32Å; S244-G246 PolarHBondContact O-N 3.31Å
247P69.9Low82.3Confident65 Ų6569.7 Ų69.742%0.42234%0.338SS..  trans-65.3146.417926.2-28.3000111.9E79 L130E79-P247 WeakPolarHBondContact OE1-CD 3.36Å; L130-P247 HydrophobicContact CB-CG 4.47Å; L130-P247 HydrophobicContact CD1-CB 3.56Å; L130-P247 HydrophobicContact CD1-CG 3.48Å; L130-P247 VanDerWaalsContact CD1-CG 3.48Å; L130-P247 HydrophobicContact CD2-CG 3.67Å; L130-P247 HydrophobicContact CG-CG 4.05Å
248R70.1Confident81.8Confident58 Ų5871.2 Ų71.222%0.21935%0.351CS..  trans-138.4151.8-174.3-63.9179.2-175.2-114.74111.4S244 E267S244-R248 PolarHBondContact O-NH2 3.22Å; R248-E267 WeakPolarHBondContact CD-OE2 3.47Å; R248-E267 IonicContact CZ-OE2 2.67Å; R248-E267 VanDerWaalsContact NH1-C 3.28Å; R248-E267 VanDerWaalsContact NH1-CB 3.32Å; R248-E267 PolarHBondContact NH1-O 2.97Å; R248-E267 IonicContact NH1-OE2 3.19Å; R248-E267 PolarHBondContact NH1-OE2 3.43Å; R248-E267 PolarHBondContact NH2-O 3.48Å
249H62.8Low81.2Confident124 Ų12470.8 Ų70.857%0.57435%0.35SS*.  trans-78131.4172.9-70.5-78.4000110.2K251H249-K251 PolarHBondContact O-N 3.32Å
250V66.1Low80.9Confident103 Ų10370.8 Ų70.862%0.62435%0.352SS*.  trans-78.2113.3166.4-176.70000106.8
251K64.9Low80.4Confident139 Ų13971.4 Ų71.460%0.60436%0.358SS*.  trans-89.7-36.4-173.1-65.7-177.4-177.6175.30112.9H249H249-K251 PolarHBondContact O-N 3.32Å
252E69.1Low79.7Confident116 Ų11672.5 Ų72.554%0.54237%0.365SS..SBendtrans-134.9155.5-168.6-71.6171.4-15900112K254E252-K254 HydrophobicContact CB-CG 4.11Å; E252-K254 PolarHBondContact O-N 3.43Å; E252-K254 WeakPolarHBondContact OE2-CE 3.44Å; E252-K254 IonicContact OE2-NZ 3.6Å; E252-K254 PolarHBondContact OE2-NZ 3.15Å
253F71.4Confident78.9Confident213 Ų21373.7 Ų73.793%0.93437%0.37SS*.  trans-89.195.2171.5-170.4-95.2000108.5
254K77.1Confident78.5Confident64 Ų6476.2 Ų76.228%0.27838%0.381SS..  trans-110.7159.7177.8-59-164.9-174.7179.40111.4E252 A258 D263E252-K254 HydrophobicContact CB-CG 4.11Å; E252-K254 PolarHBondContact O-N 3.43Å; E252-K254 WeakPolarHBondContact OE2-CE 3.44Å; E252-K254 IonicContact OE2-NZ 3.6Å; E252-K254 PolarHBondContact OE2-NZ 3.15Å; K254-A258 HydrophobicContact CB-CB 4.08Å; K254-A258 HydrophobicContact CD-CB 4.37Å; K254-D263 WeakPolarHBondContact CD-OD2 3.1Å; K254-D263 VanDerWaalsContact CE-OD1 3.23Å; K254-D263 WeakPolarHBondContact CE-OD1 3.44Å; K254-D263 VanDerWaalsContact CE-OD2 3.28Å; K254-D263 WeakPolarHBondContact CE-OD2 3.44Å; K254-D263 IonicContact NZ-OD1 2.72Å; K254-D263 PolarHBondContact NZ-OD1 3.38Å; K254-D263 IonicContact NZ-OD2 2.81Å
255D84.3Confident78.4Confident137 Ų13781.2 Ų81.273%0.73340%0.4SS*.  trans-57.1153.2167.9-71-29.5000111.3Y257 A258 S259D255-Y257 PolarHBondContact O-N 2.78Å; D255-A258 PolarHBondContact O-N 2.99Å; D255-S259 PolarHBondContact O-N 3.2Å
256F87.1Confident78.6Confident117 Ų11779.3 Ų79.351%0.51339%0.392SS..Hα-helixtrans-49.1-53.2-168.8176.1-109.2000114.3F106 S259 I260F106-F256 HydrophobicContact CD1-CZ 4.41Å; F106-F256 HydrophobicContact CE1-CE1 4.05Å; F106-F256 AromaticContact CE1-CZ 3.71Å; F106-F256 HydrophobicContact CE1-CZ 3.71Å; F106-F256 HydrophobicContact CE2-CE1 4.18Å; F106-F256 AromaticContact CZ-CE1 3.6Å; F106-F256 HydrophobicContact CZ-CE1 3.6Å; F106-F256 AromaticContact CZ-CZ 3.76Å; F106-F256 HydrophobicContact CZ-CZ 3.76Å; F256-S259 PolarHBondContact O-N 3.45Å; F256-I260 HydrophobicContact CD1-CD1 4.04Å; F256-I260 HydrophobicContact CD2-CD1 3.92Å; F256-I260 HydrophobicContact CE1-CD1 3.59Å; F256-I260 HydrophobicContact CE2-CD1 3.45Å; F256-I260 VanDerWaalsContact CE2-CD1 3.45Å; F256-I260 HydrophobicContact CG-CD1 4.2Å; F256-I260 HydrophobicContact CZ-CD1 3.28Å; F256-I260 WeakPolarHBondContact O-CG1 3.26Å; F256-I260 PolarHBondContact O-N 2.99Å; F256-I260 VanDerWaalsContact O-N 3.11Å
257Y88.1Confident79.2Confident125 Ų12580.2 Ų80.249%0.4939%0.391SS..Hα-helixtrans-72.2-33-178.9-81.6-73.1000113.2E102 F106 D255 I260 A261E102-Y257 PolarHBondContact OE1-OH 2.59Å; F106-Y257 HydrophobicContact CE2-CE1 4.1Å; F106-Y257 WeakPolarHBondContact CE2-OH 3.35Å; F106-Y257 AromaticContact CZ-CE1 3.93Å; F106-Y257 HydrophobicContact CZ-CE1 3.93Å; D255-Y257 PolarHBondContact O-N 2.78Å; Y257-I260 PolarHBondContact O-N 3.26Å; Y257-A261 VanDerWaalsContact O-CB 3.24Å; Y257-A261 WeakPolarHBondContact O-CB 3.32Å; Y257-A261 PolarHBondContact O-N 3.07Å
258A85.3Confident80.1Confident35 Ų3578 Ų7829%0.28938%0.377SS..Hα-helixtrans-65.6-43.4174.400000110.9K254 D255 I260 V262 D263K254-A258 HydrophobicContact CB-CB 4.08Å; K254-A258 HydrophobicContact CD-CB 4.37Å; D255-A258 PolarHBondContact O-N 2.99Å; A258-I260 PolarHBondContact O-N 2.9Å; A258-V262 HydrophobicContact CB-CG2 4.42Å; A258-V262 WeakPolarHBondContact O-CA 3.31Å; A258-V262 WeakPolarHBondContact O-CB 3.29Å; A258-V262 WeakPolarHBondContact O-CG2 3.32Å; A258-V262 PolarHBondContact O-N 3.35Å; A258-D263 PolarHBondContact O-N 3.4Å
259S84.9Confident81.2Confident25 Ų2575.4 Ų75.418%0.17537%0.367CS..Iπ-helixtrans-60.2-44.2174.4177.40000111.9D255 F256 D263 H264D255-S259 PolarHBondContact O-N 3.2Å; F256-S259 PolarHBondContact O-N 3.45Å; S259-D263 WeakPolarHBondContact O-CB 3.37Å; S259-H264 PolarHBondContact O-CD2 3.38Å; S259-H264 PolarHBondContact O-N 3.23Å; S259-H264 VanDerWaalsContact O-N 3.15Å
260I87.7Confident82.6Confident60 Ų6072.7 Ų72.731%0.30836%0.355SS..Iπ-helixtrans-69.2-51.8179.3-67.5162.6000111.7F106 F256 Y257 A258 Y265F106-I260 HydrophobicContact CE1-CD1 3.74Å; F106-I260 HydrophobicContact CZ-CD1 4Å; F256-I260 HydrophobicContact CD1-CD1 4.04Å; F256-I260 HydrophobicContact CD2-CD1 3.92Å; F256-I260 HydrophobicContact CE1-CD1 3.59Å; F256-I260 HydrophobicContact CE2-CD1 3.45Å; F256-I260 VanDerWaalsContact CE2-CD1 3.45Å; F256-I260 HydrophobicContact CG-CD1 4.2Å; F256-I260 HydrophobicContact CZ-CD1 3.28Å; F256-I260 WeakPolarHBondContact O-CG1 3.26Å; F256-I260 PolarHBondContact O-N 2.99Å; F256-I260 VanDerWaalsContact O-N 3.11Å; Y257-I260 PolarHBondContact O-N 3.26Å; A258-I260 PolarHBondContact O-N 2.9Å; I260-Y265 VanDerWaalsContact O-CB 3.29Å; I260-Y265 WeakPolarHBondContact O-CB 3.48Å; I260-Y265 PolarHBondContact O-N 3.03Å
261A86.3Confident83.8Confident30 Ų3070.4 Ų70.425%0.24834%0.335CS..Iπ-helixtrans-79.8-52.1-170.300000112.2Y257 T266 L377Y257-A261 VanDerWaalsContact O-CB 3.24Å; Y257-A261 WeakPolarHBondContact O-CB 3.32Å; Y257-A261 PolarHBondContact O-N 3.07Å; A261-T266 PolarHBondContact O-N 2.74Å; A261-T266 PolarHBondContact O-OG1 2.79Å; A261-L377 HydrophobicContact CB-CD1 4Å
262V79.9Confident85.2Confident31 Ų3164.9 Ų64.919%0.18831%0.311CS..Iπ-helixtrans-76.8-52.7-173.7-173.90000110.2A258 T266 L377A258-V262 HydrophobicContact CB-CG2 4.42Å; A258-V262 WeakPolarHBondContact O-CA 3.31Å; A258-V262 WeakPolarHBondContact O-CB 3.29Å; A258-V262 WeakPolarHBondContact O-CG2 3.32Å; A258-V262 PolarHBondContact O-N 3.35Å; V262-T266 VanDerWaalsContact O-CB 3.3Å; V262-T266 WeakPolarHBondContact O-CB 3.22Å; V262-L377 HydrophobicContact CG2-CB 3.86Å
263D77.3Confident86.5Confident32 Ų3261.3 Ų61.317%0.17130%0.297CS..Iπ-helixtrans-81.6-44.4-171.3-66.4-15.3000112.8K254 A258 S259K254-D263 WeakPolarHBondContact CD-OD2 3.1Å; K254-D263 VanDerWaalsContact CE-OD1 3.23Å; K254-D263 WeakPolarHBondContact CE-OD1 3.44Å; K254-D263 VanDerWaalsContact CE-OD2 3.28Å; K254-D263 WeakPolarHBondContact CE-OD2 3.44Å; K254-D263 IonicContact NZ-OD1 2.72Å; K254-D263 PolarHBondContact NZ-OD1 3.38Å; K254-D263 IonicContact NZ-OD2 2.81Å; A258-D263 PolarHBondContact O-N 3.4Å; S259-D263 WeakPolarHBondContact O-CB 3.37Å
264H85.3Confident87.5Confident58 Ų5855.8 Ų55.827%0.26928%0.275SS..Iπ-helixtrans-94-51.7-171.4-65.5-41.7000113S259 V268S259-H264 PolarHBondContact O-CD2 3.38Å; S259-H264 PolarHBondContact O-N 3.23Å; S259-H264 VanDerWaalsContact O-N 3.15Å; H264-V268 VanDerWaalsContact O-CG2 3.24Å; H264-V268 WeakPolarHBondContact O-CG2 3.35Å; H264-V268 PolarHBondContact O-N 2.95Å
265Y88.7Confident88.4Confident112 Ų11252.8 Ų52.844%0.43926%0.262SS..Iπ-helixtrans-77.1-40.7-172.1-168.4-122.3000112.7I260 E267 V268 L269 M369I260-Y265 VanDerWaalsContact O-CB 3.29Å; I260-Y265 WeakPolarHBondContact O-CB 3.48Å; I260-Y265 PolarHBondContact O-N 3.03Å; Y265-E267 PolarHBondContact O-N 3.48Å; Y265-V268 WeakPolarHBondContact O-CB 3.37Å; Y265-V268 PolarHBondContact O-N 2.61Å; Y265-V268 VanDerWaalsContact O-N 3.15Å; Y265-L269 HydrophobicContact CD1-CD1 3.68Å; Y265-L269 HydrophobicContact CD1-CG 4.18Å; Y265-L269 HydrophobicContact CE1-CD1 3.48Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.48Å; Y265-L269 HydrophobicContact CE1-CD2 4.25Å; Y265-L269 HydrophobicContact CE1-CG 3.92Å; Y265-L269 HydrophobicContact CE2-CG 4.37Å; Y265-L269 HydrophobicContact CG-CD1 4.43Å; Y265-L269 WeakPolarHBondContact O-CG 3.36Å; Y265-L269 PolarHBondContact O-N 3.14Å; Y265-M369 HydrophobicContact CE1-CG 4Å
266T89.8Confident88.8Confident6 Ų649.4 Ų49.44%0.03724%0.242CC..Hα-helixtrans-60-47.2177.2-56.20000111.2A261 V262 V268 L269 E270 L370 A373A261-T266 PolarHBondContact O-N 2.74Å; A261-T266 PolarHBondContact O-OG1 2.79Å; V262-T266 VanDerWaalsContact O-CB 3.3Å; V262-T266 WeakPolarHBondContact O-CB 3.22Å; T266-V268 PolarHBondContact O-N 2.74Å; T266-L269 WeakPolarHBondContact O-CB 3.42Å; T266-L269 PolarHBondContact O-N 3.42Å; T266-E270 WeakPolarHBondContact O-CG 3.06Å; T266-E270 PolarHBondContact O-N 2.72Å; T266-L370 HydrophobicContact CG2-CD1 3.94Å; T266-A373 HydrophobicContact CG2-CB 3.93Å; T266-A373 WeakPolarHBondContact OG1-CB 3.49Å
267E86.3Confident89Confident35 Ų3546.9 Ų46.916%0.16424%0.239CC..Hα-helixtrans-67.1-24.4178.5-153-163.3-159.300112.6R133 R248 Y265R133-E267 IonicContact CZ-OE1 3.95Å; R133-E267 IonicContact NH1-OE1 2.74Å; R133-E267 PolarHBondContact NH1-OE1 2.81Å; R248-E267 WeakPolarHBondContact CD-OE2 3.47Å; R248-E267 IonicContact CZ-OE2 2.67Å; R248-E267 VanDerWaalsContact NH1-C 3.28Å; R248-E267 VanDerWaalsContact NH1-CB 3.32Å; R248-E267 PolarHBondContact NH1-O 2.97Å; R248-E267 IonicContact NH1-OE2 3.19Å; R248-E267 PolarHBondContact NH1-OE2 3.43Å; R248-E267 PolarHBondContact NH2-O 3.48Å; Y265-E267 PolarHBondContact O-N 3.48Å
268V90.8Very high89.1Confident19 Ų1944.7 Ų44.712%0.11524%0.235CC..Hα-helixtrans-73.9-43.9169.1170.10000111E245 H264 Y265 T266 R271 K272E245-V268 HydrophobicContact CG-CG1 4.04Å; H264-V268 VanDerWaalsContact O-CG2 3.24Å; H264-V268 WeakPolarHBondContact O-CG2 3.35Å; H264-V268 PolarHBondContact O-N 2.95Å; Y265-V268 WeakPolarHBondContact O-CB 3.37Å; Y265-V268 PolarHBondContact O-N 2.61Å; Y265-V268 VanDerWaalsContact O-N 3.15Å; T266-V268 PolarHBondContact O-N 2.74Å; V268-R271 PolarHBondContact O-N 3.28Å; V268-K272 HydrophobicContact CG1-CD 4.05Å; V268-K272 HydrophobicContact CG1-CG 4.4Å; V268-K272 WeakPolarHBondContact O-CG 3.24Å; V268-K272 PolarHBondContact O-N 3.16Å
269L92.8Very high89.5Confident2 Ų243.7 Ų43.71%0.0123%0.225CC..Hα-helixtrans-62-42.3177.4-77.2173.4000111.8Y265 T266 R271 K272 V273 M369 L370Y265-L269 HydrophobicContact CD1-CD1 3.68Å; Y265-L269 HydrophobicContact CD1-CG 4.18Å; Y265-L269 HydrophobicContact CE1-CD1 3.48Å; Y265-L269 VanDerWaalsContact CE1-CD1 3.48Å; Y265-L269 HydrophobicContact CE1-CD2 4.25Å; Y265-L269 HydrophobicContact CE1-CG 3.92Å; Y265-L269 HydrophobicContact CE2-CG 4.37Å; Y265-L269 HydrophobicContact CG-CD1 4.43Å; Y265-L269 WeakPolarHBondContact O-CG 3.36Å; Y265-L269 PolarHBondContact O-N 3.14Å; T266-L269 WeakPolarHBondContact O-CB 3.42Å; T266-L269 PolarHBondContact O-N 3.42Å; L269-R271 VanDerWaalsContact C-N 3.34Å; L269-R271 PolarHBondContact O-N 3.07Å; L269-K272 WeakPolarHBondContact O-CB 3.46Å; L269-K272 PolarHBondContact O-N 3.07Å; L269-V273 WeakPolarHBondContact O-CG2 3.39Å; L269-V273 PolarHBondContact O-N 3.39Å; L269-M369 HydrophobicContact CD1-CB 4Å; L269-M369 HydrophobicContact CD1-CG 3.52Å; L269-L370 HydrophobicContact CB-CB 4.35Å; L269-L370 HydrophobicContact CB-CD1 4.14Å
270E91.7Very high89.9Confident68 Ų6843.7 Ų43.732%0.31822%0.224SC..Hα-helixtrans-54.4-50.4175-73.3-175.7147.600111.3T266 K272 V273 M274 L370 K374T266-E270 WeakPolarHBondContact O-CG 3.06Å; T266-E270 PolarHBondContact O-N 2.72Å; E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.32Å; E270-V273 PolarHBondContact O-N 3.2Å; E270-M274 VanDerWaalsContact O-CG 3.29Å; E270-M274 WeakPolarHBondContact O-CG 3.41Å; E270-M274 PolarHBondContact O-N 2.9Å; E270-M274 VanDerWaalsContact O-N 3.11Å; E270-L370 HydrophobicContact CG-CD1 3.49Å; E270-L370 VanDerWaalsContact CG-CD1 3.49Å; E270-L370 HydrophobicContact CG-CD2 4.12Å; E270-L370 HydrophobicContact CG-CG 4.45Å; E270-K374 WeakPolarHBondContact OE1-CE 3.41Å; E270-K374 IonicContact OE1-NZ 3.06Å
271R91.3Very high90.1Very high55 Ų5541 Ų4121%0.20821%0.211CC..Hα-helixtrans-63.4-35.5176.4-69.3-164.5-174.7-141.5-7.6113D137 D140 V268 L269 M274 C275D137-R271 IonicContact OD1-CZ 3.18Å; D137-R271 IonicContact OD1-NH2 3.43Å; D137-R271 PolarHBondContact OD1-NH2 3.34Å; D140-R271 IonicContact OD2-NH1 2.83Å; D140-R271 PolarHBondContact OD2-NH1 3.31Å; V268-R271 PolarHBondContact O-N 3.28Å; L269-R271 VanDerWaalsContact C-N 3.34Å; L269-R271 PolarHBondContact O-N 3.07Å; R271-M274 PolarHBondContact O-N 2.63Å; R271-C275 PolarHBondContact O-N 2.83Å
272K94.9Very high90.2Very high23 Ų2341.9 Ų41.910%0.121%0.213CC..Hα-helixtrans-67.3-44178.2-76.7-178.4176.1-178.70112L241 E245 V268 L269 E270 M274 C275L241-K272 HydrophobicContact CD2-CB 3.59Å; L241-K272 HydrophobicContact CD2-CD 4.29Å; L241-K272 HydrophobicContact CD2-CG 3.7Å; L241-K272 WeakPolarHBondContact O-CE 3.23Å; E245-K272 IonicContact OE1-NZ 3.73Å; E245-K272 PolarHBondContact OE1-NZ 2.87Å; V268-K272 HydrophobicContact CG1-CD 4.05Å; V268-K272 HydrophobicContact CG1-CG 4.4Å; V268-K272 WeakPolarHBondContact O-CG 3.24Å; V268-K272 PolarHBondContact O-N 3.16Å; L269-K272 WeakPolarHBondContact O-CB 3.46Å; L269-K272 PolarHBondContact O-N 3.07Å; E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.32Å; K272-M274 VanDerWaalsContact C-N 3.26Å; K272-M274 PolarHBondContact O-N 2.64Å; K272-C275 VanDerWaalsContact O-CB 3.32Å; K272-C275 WeakPolarHBondContact O-CB 3.14Å; K272-C275 PolarHBondContact O-N 2.8Å
273V95.4Very high90.4Very high41 Ų4143.2 Ų43.225%0.24822%0.221CC..Hα-helixtrans-64.9-32.9177.61720000111.1L269 E270 C275 Q366 L367 L370L269-V273 WeakPolarHBondContact O-CG2 3.39Å; L269-V273 PolarHBondContact O-N 3.39Å; E270-V273 PolarHBondContact O-N 3.2Å; V273-C275 VanDerWaalsContact C-N 3.3Å; V273-C275 PolarHBondContact O-N 3.31Å; V273-Q366 HydrophobicContact CG2-CB 4.1Å; V273-L367 HydrophobicContact CG1-CD1 4.01Å; V273-L370 HydrophobicContact CB-CD2 4.04Å; V273-L370 HydrophobicContact CG1-CD2 4.29Å; V273-L370 HydrophobicContact CG2-CB 4.35Å; V273-L370 HydrophobicContact CG2-CD2 3.84Å
274M93.6Very high90.4Very high97 Ų9745.3 Ų45.348%0.47825%0.25SC..Hα-helixtrans-69.5-21176-68.8-56.8-64.500114.5E270 R271 K272 E276 S277 D278E270-M274 VanDerWaalsContact O-CG 3.29Å; E270-M274 WeakPolarHBondContact O-CG 3.41Å; E270-M274 PolarHBondContact O-N 2.9Å; E270-M274 VanDerWaalsContact O-N 3.11Å; R271-M274 PolarHBondContact O-N 2.63Å; K272-M274 VanDerWaalsContact C-N 3.26Å; K272-M274 PolarHBondContact O-N 2.64Å; M274-E276 VanDerWaalsContact C-N 3.26Å; M274-E276 PolarHBondContact O-N 3.01Å; M274-E276 VanDerWaalsContact O-N 3.15Å; M274-S277 VanDerWaalsContact CE-OG 3.31Å; M274-S277 WeakPolarHBondContact CE-OG 3.41Å; M274-S277 PolarHBondContact O-N 3.31Å; M274-S277 PolarHBondContact O-OG 3.34Å; M274-D278 PolarHBondContact O-N 3.48Å
275C94.8Very high90.1Very high0 Ų045.5 Ų45.50%027%0.268CS..Hα-helixtrans-55-37.2-176-79.30000113.8Y237 C240 L241 R271 K272 V273 L279Y237-C275 HydrophobicContact CD2-CB 4.13Å; Y237-C275 HydrophobicContact CE2-CB 3.89Å; C240-C275 HydrophobicContact CB-CB 3.85Å; C240-C275 WeakPolarHBondContact CB-SG 3.13Å; C240-C275 VanDerWaalsContact SG-CA 3.57Å; C240-C275 WeakPolarHBondContact SG-CB 3.4Å; C240-C275 CovalentContact SG-SG 2.05Å; C240-C275 PolarHBondContact SG-SG 2.75Å; L241-C275 HydrophobicContact CD2-CB 4.35Å; R271-C275 PolarHBondContact O-N 2.83Å; K272-C275 VanDerWaalsContact O-CB 3.32Å; K272-C275 WeakPolarHBondContact O-CB 3.14Å; K272-C275 PolarHBondContact O-N 2.8Å; V273-C275 VanDerWaalsContact C-N 3.3Å; V273-C275 PolarHBondContact O-N 3.31Å; C275-L279 VanDerWaalsContact O-CB 3.27Å; C275-L279 WeakPolarHBondContact O-CB 3.05Å; C275-L279 WeakPolarHBondContact O-CD1 3.43Å; C275-L279 WeakPolarHBondContact O-CG 3.38Å; C275-L279 PolarHBondContact O-N 3.45Å; C275-L279 VanDerWaalsContact O-N 3.09Å
276E92.9Very high89.9Confident66 Ų6647.9 Ų47.931%0.30828%0.281SS..Hα-helixtrans-64.9-47.7177.6176.2163.3-140.200111.4Y237 M274 L279 T280 Y359Y237-E276 HydrophobicContact CE2-CB 4.4Å; M274-E276 VanDerWaalsContact C-N 3.26Å; M274-E276 PolarHBondContact O-N 3.01Å; M274-E276 VanDerWaalsContact O-N 3.15Å; E276-L279 PolarHBondContact O-N 2.69Å; E276-T280 PolarHBondContact O-N 3.01Å; E276-T280 VanDerWaalsContact O-N 3.07Å; E276-T280 PolarHBondContact O-OG1 3.27Å; E276-Y359 VanDerWaalsContact CG-OH 3.32Å; E276-Y359 WeakPolarHBondContact CG-OH 3.46Å; E276-Y359 PolarHBondContact OE1-OH 3.04Å
277S91.6Very high89.8Confident64 Ų6452.4 Ų52.445%0.44831%0.308SS..Hα-helixtrans-65.2-40.617866.60000112.6M274 L279 T280M274-S277 VanDerWaalsContact CE-OG 3.31Å; M274-S277 WeakPolarHBondContact CE-OG 3.41Å; M274-S277 PolarHBondContact O-N 3.31Å; M274-S277 PolarHBondContact O-OG 3.34Å; S277-L279 VanDerWaalsContact C-N 3.28Å; S277-L279 PolarHBondContact O-N 2.91Å; S277-T280 PolarHBondContact O-N 3.28Å
278D91.1Very high90.1Very high79 Ų7951.9 Ų51.942%0.42231%0.307SS..Hα-helixtrans-68.1-26.3179.2-85-44000113.2K171 M274K171-D278 IonicContact NZ-OD1 3.21Å; K171-D278 PolarHBondContact NZ-OD1 3.03Å; M274-D278 PolarHBondContact O-N 3.48Å
279L93.3Very high90Very high14 Ų1456.7 Ų56.77%0.07333%0.332CS..THydrogen-bonded Turntrans-98.91178.5-64.7174.7000112.8Y203 F233 V236 Y237 C240 C275 E276 S277 P281Y203-L279 PolarHBondContact OH-O 3.4Å; F233-L279 HydrophobicContact CE2-CB 3.96Å; V236-L279 HydrophobicContact CG1-CD1 4.08Å; V236-L279 HydrophobicContact CG1-CD2 3.63Å; Y237-L279 HydrophobicContact CD2-CD1 4.29Å; C240-L279 HydrophobicContact CB-CD1 4Å; C275-L279 VanDerWaalsContact O-CB 3.27Å; C275-L279 WeakPolarHBondContact O-CB 3.05Å; C275-L279 WeakPolarHBondContact O-CD1 3.43Å; C275-L279 WeakPolarHBondContact O-CG 3.38Å; C275-L279 PolarHBondContact O-N 3.45Å; C275-L279 VanDerWaalsContact O-N 3.09Å; E276-L279 PolarHBondContact O-N 2.69Å; S277-L279 VanDerWaalsContact C-N 3.28Å; S277-L279 PolarHBondContact O-N 2.91Å; L279-P281 WeakPolarHBondContact O-CD 3.42Å
280T92.9Very high90Very high26 Ų2660.8 Ų60.816%0.1635%0.35CS..  trans-76.4121.9175.5-65.30000109.2E276 S277 V287 V288 F291E276-T280 PolarHBondContact O-N 3.01Å; E276-T280 VanDerWaalsContact O-N 3.07Å; E276-T280 PolarHBondContact O-OG1 3.27Å; S277-T280 PolarHBondContact O-N 3.28Å; T280-V287 HydrophobicContact CG2-CG1 3.5Å; T280-V287 VanDerWaalsContact CG2-CG1 3.5Å; T280-V288 WeakPolarHBondContact CG2-O 3.37Å; T280-F291 HydrophobicContact CG2-CB 4.17Å
281P91.4Very high90.2Very high4 Ų457.8 Ų57.83%0.02634%0.336CS..  trans-72.2152.8-176.227.7-33.1000112.3E204 L279 V283 V288 F291E204-P281 HydrophobicContact CG-CB 4.03Å; L279-P281 WeakPolarHBondContact O-CD 3.42Å; P281-V283 HydrophobicContact CB-CG2 4.39Å; P281-V288 HydrophobicContact CG-CB 4.4Å; P281-V288 HydrophobicContact CG-CG2 4.08Å; P281-V288 PolarHBondContact O-N 2.88Å; P281-F291 HydrophobicContact CG-CD1 4.5Å; P281-F291 HydrophobicContact CG-CD2 3.8Å; P281-F291 HydrophobicContact CG-CE1 4.14Å; P281-F291 HydrophobicContact CG-CE2 3.39Å; P281-F291 HydrophobicContact CG-CG 4.35Å; P281-F291 HydrophobicContact CG-CZ 3.59Å
282V88.1Confident90.5Very high48 Ų4855.2 Ų55.229%0.29133%0.326SS..EExtended strand (participates in β ladder)trans-103112.5168.6-1800000108.4L170 F286 V287L170-V282 HydrophobicContact CD2-CB 3.87Å; L170-V282 HydrophobicContact CD2-CG1 3.83Å; L170-V282 HydrophobicContact CD2-CG2 4.37Å; V282-F286 CarbonylContact C-O 3.33Å; V282-F286 WeakPolarHBondContact CA-O 3.32Å; V282-V287 HydrophobicContact CG2-CG2 4.09Å
283V84.4Confident90.6Very high58 Ų5854.2 Ų54.235%0.35232%0.322SS..EExtended strand (participates in β ladder)trans-112.8121.5-178.5-178.60000109F207 V208 P281 G285 F286 V288F207-V283 HydrophobicContact CD1-CG2 4.5Å; F207-V283 HydrophobicContact CE1-CG2 4.28Å; V208-V283 HydrophobicContact CG2-CG1 4.44Å; V208-V283 HydrophobicContact CG2-CG2 4.16Å; P281-V283 HydrophobicContact CB-CG2 4.39Å; V283-G285 PolarHBondContact O-N 3.3Å; V283-F286 PolarHBondContact N-O 3.25Å; V283-F286 PolarHBondContact O-N 3.45Å; V283-F286 VanDerWaalsContact O-N 3.15Å; V283-V288 HydrophobicContact CB-CG2 4.18Å; V283-V288 HydrophobicContact CG2-CG2 3.78Å
284G77.3Confident90.7Very high76 Ų7653.8 Ų53.878%0.78432%0.32SS*.THydrogen-bonded Turntrans62.822.6-179.900000114.2F286G284-F286 WeakPolarHBondContact O-CD2 3.42Å
285G78.3Confident90.9Very high63 Ų6349.2 Ų49.265%0.64930%0.297SS*.THydrogen-bonded Turntrans91.61.5-177.800000115V283V283-G285 PolarHBondContact O-N 3.3Å
286F84.5Confident91.1Very high162 Ų16249.2 Ų49.271%0.71130%0.297SS*.EExtended strand (participates in β ladder)trans-118134.7179.1-59.6-84.4000110.9V282 V283 G284 V288V282-F286 CarbonylContact C-O 3.33Å; V282-F286 WeakPolarHBondContact CA-O 3.32Å; V283-F286 PolarHBondContact N-O 3.25Å; V283-F286 PolarHBondContact O-N 3.45Å; V283-F286 VanDerWaalsContact O-N 3.15Å; G284-F286 WeakPolarHBondContact O-CD2 3.42Å; F286-V288 PolarHBondContact O-N 2.99Å
287V88.8Confident91.3Very high101 Ų10149.1 Ų49.161%0.61230%0.297SS*.EExtended strand (participates in β ladder)trans-63.9130.9170.6-178.70000108.1T280 V282 D289T280-V287 HydrophobicContact CG2-CG1 3.5Å; T280-V287 VanDerWaalsContact CG2-CG1 3.5Å; V282-V287 HydrophobicContact CG2-CG2 4.09Å; V287-D289 PolarHBondContact O-N 2.91Å
288V91.5Very high91.7Very high23 Ų2348.1 Ų48.114%0.13928%0.284CS..  trans-74.6111178.2-177.80000109.6F207 T280 P281 V283 F286 F291 T294F207-V288 HydrophobicContact CE1-CG2 4.22Å; F207-V288 HydrophobicContact CZ-CG1 4.25Å; T280-V288 WeakPolarHBondContact CG2-O 3.37Å; P281-V288 HydrophobicContact CG-CB 4.4Å; P281-V288 HydrophobicContact CG-CG2 4.08Å; P281-V288 PolarHBondContact O-N 2.88Å; V283-V288 HydrophobicContact CB-CG2 4.18Å; V283-V288 HydrophobicContact CG2-CG2 3.78Å; F286-V288 PolarHBondContact O-N 2.99Å; V288-F291 HydrophobicContact CB-CD2 4.07Å; V288-F291 HydrophobicContact CG1-CD2 3.8Å; V288-T294 HydrophobicContact CG1-CG2 4.09Å
289D89.7Confident92Very high120 Ų12044.4 Ų44.464%0.64226%0.264SS*.THydrogen-bonded Turntrans-66.3144.7179.1-16722.8000111.9V287 F291 T294V287-D289 PolarHBondContact O-N 2.91Å; D289-F291 VanDerWaalsContact C-N 3.3Å; D289-F291 PolarHBondContact O-N 3.41Å; D289-T294 PolarHBondContact O-OG1 2.86Å
290K92.8Very high92.2Very high89 Ų8944 Ų4439%0.38726%0.261SS..THydrogen-bonded Turntrans41.354.5-178.9-54.5-179-168.4176.80112.5V292 A293 T294 D323K290-V292 VanDerWaalsContact C-N 3.33Å; K290-V292 PolarHBondContact O-N 3.02Å; K290-V292 VanDerWaalsContact O-N 3.12Å; K290-A293 HydrophobicContact CB-CB 3.93Å; K290-A293 WeakPolarHBondContact O-CA 3.28Å; K290-A293 WeakPolarHBondContact O-CB 3.28Å; K290-A293 PolarHBondContact O-N 3.49Å; K290-T294 PolarHBondContact O-N 3.08Å; K290-T294 PolarHBondContact O-OG1 2.83Å; K290-D323 HydrophobicContact CD-CB 4.13Å; K290-D323 IonicContact NZ-OD1 3.56Å; K290-D323 PolarHBondContact NZ-OD1 3.3Å; K290-D323 IonicContact NZ-OD2 3.72Å; K290-D323 PolarHBondContact NZ-OD2 2.86Å
291F96Very high92.5Very high4 Ų445.6 Ų45.62%0.01827%0.266CS..Hα-helixtrans-49.9-46.2-164.3-177.4-130.2000114.8Y203 F207 F233 T280 P281 V288 D289 T294 M295Y203-F291 AromaticContact CD2-CE1 3.98Å; Y203-F291 HydrophobicContact CD2-CE1 3.98Å; Y203-F291 HydrophobicContact CD2-CZ 4.01Å; Y203-F291 AromaticContact CE2-CE1 3.79Å; Y203-F291 HydrophobicContact CE2-CE1 3.79Å; Y203-F291 HydrophobicContact CE2-CZ 4.08Å; F207-F291 HydrophobicContact CD1-CE2 4.02Å; F207-F291 AromaticContact CD2-CE2 3.71Å; F207-F291 HydrophobicContact CD2-CE2 3.71Å; F207-F291 HydrophobicContact CD2-CZ 4.22Å; F207-F291 HydrophobicContact CE1-CE2 4.05Å; F207-F291 HydrophobicContact CE2-CD2 4.41Å; F207-F291 AromaticContact CE2-CE2 3.75Å; F207-F291 HydrophobicContact CE2-CE2 3.75Å; F207-F291 AromaticContact CG-CE2 3.85Å; F207-F291 HydrophobicContact CG-CE2 3.85Å; F207-F291 HydrophobicContact CG-CZ 4.21Å; F207-F291 HydrophobicContact CZ-CD2 4.43Å; F207-F291 AromaticContact CZ-CE2 3.92Å; F207-F291 HydrophobicContact CZ-CE2 3.92Å; F233-F291 AromaticContact CD2-CD1 3.96Å; F233-F291 HydrophobicContact CD2-CD1 3.96Å; F233-F291 AromaticContact CD2-CE1 3.57Å; F233-F291 HydrophobicContact CD2-CE1 3.57Å; F233-F291 AromaticContact CE2-CD1 3.73Å; F233-F291 HydrophobicContact CE2-CD1 3.73Å; F233-F291 AromaticContact CE2-CE1 3.83Å; F233-F291 HydrophobicContact CE2-CE1 3.83Å; F233-F291 HydrophobicContact CG-CE1 4.15Å; F233-F291 HydrophobicContact CZ-CD1 4.22Å; T280-F291 HydrophobicContact CG2-CB 4.17Å; P281-F291 HydrophobicContact CG-CD1 4.5Å; P281-F291 HydrophobicContact CG-CD2 3.8Å; P281-F291 HydrophobicContact CG-CE1 4.14Å; P281-F291 HydrophobicContact CG-CE2 3.39Å; P281-F291 HydrophobicContact CG-CG 4.35Å; P281-F291 HydrophobicContact CG-CZ 3.59Å; V288-F291 HydrophobicContact CB-CD2 4.07Å; V288-F291 HydrophobicContact CG1-CD2 3.8Å; D289-F291 VanDerWaalsContact C-N 3.3Å; D289-F291 PolarHBondContact O-N 3.41Å; F291-T294 WeakPolarHBondContact O-CB 3.24Å; F291-T294 PolarHBondContact O-N 2.92Å; F291-M295 HydrophobicContact CD1-CE 4.01Å; F291-M295 HydrophobicContact CE1-CE 3.81Å; F291-M295 HydrophobicContact CE1-SD 4.28Å; F291-M295 HydrophobicContact CE2-CG 4.33Å; F291-M295 HydrophobicContact CE2-SD 4.45Å; F291-M295 HydrophobicContact CZ-CE 4.13Å; F291-M295 HydrophobicContact CZ-CG 4.49Å; F291-M295 HydrophobicContact CZ-SD 4.02Å; F291-M295 PolarHBondContact O-N 3.07Å
292V97.1Very high92.8Very high1 Ų145.4 Ų45.41%0.00627%0.265CS..Hα-helixtrans-66.5-42.7178.8-175.10000111.9L230 F233 F234 K290 T294 M295 Y296 F322 Y359L230-V292 HydrophobicContact CD1-CG1 4.33Å; F233-V292 HydrophobicContact CD1-CG2 4.09Å; F233-V292 HydrophobicContact CE1-CG2 3.35Å; F233-V292 HydrophobicContact CZ-CG2 3.85Å; F234-V292 HydrophobicContact CE1-CG1 4.1Å; F234-V292 HydrophobicContact CZ-CG1 3.95Å; K290-V292 VanDerWaalsContact C-N 3.33Å; K290-V292 PolarHBondContact O-N 3.02Å; K290-V292 VanDerWaalsContact O-N 3.12Å; V292-T294 VanDerWaalsContact C-N 3.33Å; V292-T294 PolarHBondContact O-N 3.07Å; V292-M295 HydrophobicContact CB-CE 4.41Å; V292-M295 HydrophobicContact CG2-CE 4.21Å; V292-M295 PolarHBondContact O-N 3.49Å; V292-Y296 HydrophobicContact CG1-CD2 4.09Å; V292-Y296 HydrophobicContact CG1-CE2 3.78Å; V292-Y296 VanDerWaalsContact O-CD2 3.26Å; V292-Y296 WeakPolarHBondContact O-CD2 3.09Å; V292-Y296 PolarHBondContact O-N 3.27Å; V292-F322 HydrophobicContact CG1-CD2 4.35Å; V292-F322 HydrophobicContact CG1-CE2 3.75Å; V292-F322 HydrophobicContact CG1-CZ 3.86Å; V292-Y359 HydrophobicContact CB-CE1 4.29Å; V292-Y359 HydrophobicContact CG1-CD1 4.43Å; V292-Y359 HydrophobicContact CG1-CE1 4.46Å; V292-Y359 HydrophobicContact CG2-CD1 4.38Å; V292-Y359 HydrophobicContact CG2-CE1 3.69Å
293A97.3Very high93.3Very high2 Ų244.2 Ų44.22%0.01726%0.255CS..Hα-helixtrans-59.8-46.717400000110.2K290 M295 Y296 H297 Y319 F322K290-A293 HydrophobicContact CB-CB 3.93Å; K290-A293 WeakPolarHBondContact O-CA 3.28Å; K290-A293 WeakPolarHBondContact O-CB 3.28Å; K290-A293 PolarHBondContact O-N 3.49Å; A293-M295 VanDerWaalsContact C-N 3.29Å; A293-M295 PolarHBondContact O-N 3.18Å; A293-Y296 CarbonylContact O-C 3.58Å; A293-Y296 WeakPolarHBondContact O-CA 3.34Å; A293-Y296 WeakPolarHBondContact O-CB 3.35Å; A293-Y296 PolarHBondContact O-N 2.67Å; A293-H297 PolarHBondContact O-N 3.19Å; A293-Y319 HydrophobicContact CB-CD2 3.9Å; A293-Y319 HydrophobicContact CB-CE2 3.89Å; A293-Y319 WeakPolarHBondContact O-CD2 3.4Å; A293-F322 HydrophobicContact CB-CB 3.79Å; A293-F322 HydrophobicContact CB-CD2 4.44Å; A293-F322 HydrophobicContact CB-CG 4.43Å
294T97.1Very high93.9Very high33 Ų3345.3 Ų45.320%0.20225%0.254CS..Hα-helixtrans-54.8-42177.2-68.70000112.4F207 V288 D289 K290 F291 V292 Y296 H297 Y298F207-T294 HydrophobicContact CE2-CG2 4.32Å; F207-T294 HydrophobicContact CZ-CG2 4.17Å; V288-T294 HydrophobicContact CG1-CG2 4.09Å; D289-T294 PolarHBondContact O-OG1 2.86Å; K290-T294 PolarHBondContact O-N 3.08Å; K290-T294 PolarHBondContact O-OG1 2.83Å; F291-T294 WeakPolarHBondContact O-CB 3.24Å; F291-T294 PolarHBondContact O-N 2.92Å; V292-T294 VanDerWaalsContact C-N 3.33Å; V292-T294 PolarHBondContact O-N 3.07Å; T294-Y296 PolarHBondContact O-N 3.42Å; T294-H297 WeakPolarHBondContact O-CB 3.41Å; T294-H297 PolarHBondContact O-N 2.86Å; T294-Y298 HydrophobicContact CG2-CD2 3.9Å; T294-Y298 HydrophobicContact CG2-CE2 3.55Å; T294-Y298 WeakPolarHBondContact O-CD2 3.3Å; T294-Y298 PolarHBondContact O-N 3.4Å; T294-Y298 VanDerWaalsContact O-N 3.14Å
295M98.3Very high94.9Very high0 Ų046.9 Ų46.90%024%0.239CC..Hα-helixtrans-61.2-42.9173.9-68.7-171-79.600112.4F207 M226 L230 F233 F291 V292 A293 Y298 L299F207-M295 HydrophobicContact CD2-CG 3.92Å; F207-M295 HydrophobicContact CE2-CG 3.99Å; M226-M295 HydrophobicContact CG-CB 4.38Å; M226-M295 HydrophobicContact SD-CB 3.92Å; M226-M295 HydrophobicContact SD-CG 3.71Å; M226-M295 HydrophobicContact SD-SD 4.4Å; L230-M295 HydrophobicContact CB-SD 4.25Å; L230-M295 HydrophobicContact CD1-CB 4.16Å; L230-M295 HydrophobicContact CD1-CE 3.6Å; L230-M295 HydrophobicContact CD1-SD 3.98Å; F233-M295 HydrophobicContact CB-CE 4.21Å; F233-M295 HydrophobicContact CD1-CE 3.95Å; F233-M295 HydrophobicContact CG-CE 4.02Å; F291-M295 HydrophobicContact CD1-CE 4.01Å; F291-M295 HydrophobicContact CE1-CE 3.81Å; F291-M295 HydrophobicContact CE1-SD 4.28Å; F291-M295 HydrophobicContact CE2-CG 4.33Å; F291-M295 HydrophobicContact CE2-SD 4.45Å; F291-M295 HydrophobicContact CZ-CE 4.13Å; F291-M295 HydrophobicContact CZ-CG 4.49Å; F291-M295 HydrophobicContact CZ-SD 4.02Å; F291-M295 PolarHBondContact O-N 3.07Å; V292-M295 HydrophobicContact CB-CE 4.41Å; V292-M295 HydrophobicContact CG2-CE 4.21Å; V292-M295 PolarHBondContact O-N 3.49Å; A293-M295 VanDerWaalsContact C-N 3.29Å; A293-M295 PolarHBondContact O-N 3.18Å; M295-Y298 PolarHBondContact O-N 2.94Å; M295-L299 WeakPolarHBondContact O-CG 3.35Å; M295-L299 PolarHBondContact O-N 3.07Å
296Y98.6Very high95.8Very high0 Ų047.6 Ų47.60%023%0.228CC..Hα-helixtrans-66-35.1175.9-78.2-63.2000113.4L230 V292 A293 T294 L299 Q300 C315 F322 R353 A356L230-Y296 HydrophobicContact CD1-CE2 4.25Å; L230-Y296 HydrophobicContact CD2-CE1 3.77Å; L230-Y296 HydrophobicContact CD2-CE2 4.46Å; V292-Y296 HydrophobicContact CG1-CD2 4.09Å; V292-Y296 HydrophobicContact CG1-CE2 3.78Å; V292-Y296 VanDerWaalsContact O-CD2 3.26Å; V292-Y296 WeakPolarHBondContact O-CD2 3.09Å; V292-Y296 PolarHBondContact O-N 3.27Å; A293-Y296 CarbonylContact O-C 3.58Å; A293-Y296 WeakPolarHBondContact O-CA 3.34Å; A293-Y296 WeakPolarHBondContact O-CB 3.35Å; A293-Y296 PolarHBondContact O-N 2.67Å; T294-Y296 PolarHBondContact O-N 3.42Å; Y296-L299 HydrophobicContact CD1-CD1 4.45Å; Y296-L299 PolarHBondContact O-N 3.49Å; Y296-Q300 VanDerWaalsContact O-CB 3.23Å; Y296-Q300 WeakPolarHBondContact O-CB 3.33Å; Y296-Q300 PolarHBondContact O-N 3.01Å; Y296-C315 HydrophobicContact CD1-CB 4.15Å; Y296-F322 HydrophobicContact CD2-CD2 4.26Å; Y296-F322 AromaticContact CD2-CE2 3.9Å; Y296-F322 HydrophobicContact CD2-CE2 3.9Å; Y296-F322 AromaticContact CE2-CE2 3.74Å; Y296-F322 HydrophobicContact CE2-CE2 3.74Å; Y296-R353 HydrophobicContact CE1-CG 4.48Å; Y296-A356 HydrophobicContact CE2-CB 3.87Å; Y296-A356 WeakPolarHBondContact OH-CB 3.43Å
297H98Very high96.4Very high65 Ų6546 Ų4630%0.30123%0.227SC..Hα-helixtrans-60.2-50173.3170.8-93.3000111.3A293 T294 L299 Q300 F301 Y319 M329A293-H297 PolarHBondContact O-N 3.19Å; T294-H297 WeakPolarHBondContact O-CB 3.41Å; T294-H297 PolarHBondContact O-N 2.86Å; H297-L299 PolarHBondContact O-N 3Å; H297-Q300 PolarHBondContact O-N 3.04Å; H297-F301 PolarHBondContact O-N 3.24Å; H297-F301 VanDerWaalsContact O-N 3.13Å; H297-Y319 HydrophobicContact CB-CD2 3.71Å; H297-Y319 HydrophobicContact CB-CE2 3.71Å; H297-M329 HydrophobicContact CB-CE 4.26Å
298Y98.2Very high96.8Very high43 Ų4343.7 Ų43.717%0.16921%0.211CC..Hα-helixtrans-60.9-43.2176.9-77.7-67.5000112.4F207 V211 Y214 M226 T294 M295 A302F207-Y298 HydrophobicContact CE2-CD2 4.34Å; F207-Y298 HydrophobicContact CE2-CE2 4.34Å; F207-Y298 HydrophobicContact CZ-CE2 4.31Å; V211-Y298 HydrophobicContact CG1-CE1 4.33Å; V211-Y298 HydrophobicContact CG2-CD2 4.15Å; V211-Y298 HydrophobicContact CG2-CE1 4.21Å; V211-Y298 HydrophobicContact CG2-CE2 3.67Å; Y214-Y298 AromaticContact CD1-CD1 3.85Å; Y214-Y298 HydrophobicContact CD1-CD1 3.85Å; Y214-Y298 AromaticContact CD1-CE1 3.65Å; Y214-Y298 HydrophobicContact CD1-CE1 3.65Å; Y214-Y298 AromaticContact CD2-CD1 3.62Å; Y214-Y298 HydrophobicContact CD2-CD1 3.62Å; Y214-Y298 HydrophobicContact CD2-CE1 4.29Å; Y214-Y298 HydrophobicContact CE1-CD1 4.11Å; Y214-Y298 AromaticContact CE1-CE1 3.92Å; Y214-Y298 HydrophobicContact CE1-CE1 3.92Å; Y214-Y298 AromaticContact CE2-CD1 3.84Å; Y214-Y298 HydrophobicContact CE2-CD1 3.84Å; Y214-Y298 HydrophobicContact CE2-CE1 4.47Å; Y214-Y298 AromaticContact CG-CD1 3.6Å; Y214-Y298 HydrophobicContact CG-CD1 3.6Å; Y214-Y298 AromaticContact CG-CE1 3.86Å; Y214-Y298 HydrophobicContact CG-CE1 3.86Å; M226-Y298 HydrophobicContact CE-CD2 3.71Å; M226-Y298 HydrophobicContact CE-CG 3.78Å; T294-Y298 HydrophobicContact CG2-CD2 3.9Å; T294-Y298 HydrophobicContact CG2-CE2 3.55Å; T294-Y298 WeakPolarHBondContact O-CD2 3.3Å; T294-Y298 PolarHBondContact O-N 3.4Å; T294-Y298 VanDerWaalsContact O-N 3.14Å; M295-Y298 PolarHBondContact O-N 2.94Å; Y298-A302 WeakPolarHBondContact O-CB 3.3Å; Y298-A302 PolarHBondContact O-N 2.86Å
299L98.6Very high97.1Very high0 Ų043.3 Ų43.30%021%0.208CC..Hα-helixtrans-62-49.7176.8-75.5171.7000111.7M226 E227 L230 M295 Y296 H297 F301 A302 Y303 C315M226-L299 HydrophobicContact CB-CD2 3.69Å; M226-L299 HydrophobicContact CB-CG 4.06Å; M226-L299 HydrophobicContact CG-CD1 4.21Å; M226-L299 HydrophobicContact CG-CD2 3.87Å; M226-L299 HydrophobicContact CG-CG 3.63Å; E227-L299 HydrophobicContact CG-CD2 3.77Å; L230-L299 HydrophobicContact CD2-CD1 3.97Å; M295-L299 WeakPolarHBondContact O-CG 3.35Å; M295-L299 PolarHBondContact O-N 3.07Å; Y296-L299 HydrophobicContact CD1-CD1 4.45Å; Y296-L299 PolarHBondContact O-N 3.49Å; H297-L299 PolarHBondContact O-N 3Å; L299-F301 PolarHBondContact O-N 3.15Å; L299-A302 PolarHBondContact O-N 3.15Å; L299-Y303 HydrophobicContact CB-CD2 4.22Å; L299-Y303 HydrophobicContact CB-CE2 4.22Å; L299-Y303 HydrophobicContact CD2-CE2 3.93Å; L299-Y303 WeakPolarHBondContact O-CB 3.33Å; L299-Y303 WeakPolarHBondContact O-CD2 3.2Å; L299-Y303 PolarHBondContact O-N 3.42Å; L299-C315 HydrophobicContact CB-CB 4.27Å
300Q98Very high97.4Very high5 Ų541.4 Ų41.42%0.02319%0.194CC..Hα-helixtrans-53.7-51.6-179.8173.3-84.5-4400111.3Y296 H297 Y304 C315 A316 M329 Y336Y296-Q300 VanDerWaalsContact O-CB 3.23Å; Y296-Q300 WeakPolarHBondContact O-CB 3.33Å; Y296-Q300 PolarHBondContact O-N 3.01Å; H297-Q300 PolarHBondContact O-N 3.04Å; Q300-Y304 WeakPolarHBondContact O-CB 2.77Å; Q300-Y304 PolarHBondContact O-N 2.83Å; Q300-C315 HydrophobicContact CB-CB 3.73Å; Q300-A316 HydrophobicContact CG-CB 3.69Å; Q300-M329 HydrophobicContact CG-SD 4.22Å; Q300-Y336 PolarHBondContact NE2-OH 2.74Å
301F97.9Very high97.6Very high61 Ų6140.1 Ų40.127%0.26819%0.191SC..Hα-helixtrans-68.6-42-178.8-175.7-84.5000112.2Y214 F219 H297 L299 Y304 K305Y214-F301 HydrophobicContact CD2-CD1 4.35Å; Y214-F301 HydrophobicContact CE2-CB 3.97Å; Y214-F301 AromaticContact CE2-CD1 3.26Å; Y214-F301 HydrophobicContact CE2-CD1 3.26Å; Y214-F301 AromaticContact CE2-CE1 3.93Å; Y214-F301 HydrophobicContact CE2-CE1 3.93Å; Y214-F301 AromaticContact CE2-CG 3.89Å; Y214-F301 HydrophobicContact CE2-CG 3.89Å; Y214-F301 AromaticContact CZ-CD1 3.52Å; Y214-F301 AromaticContact CZ-CE1 3.82Å; Y214-F301 WeakPolarHBondContact OH-CD1 3.49Å; Y214-F301 WeakPolarHBondContact OH-CE1 3.44Å; Y214-F301 WeakPolarHBondContact OH-CG 3.41Å; F219-F301 HydrophobicContact CE1-CD1 4.03Å; F219-F301 AromaticContact CE1-CE1 3.78Å; F219-F301 HydrophobicContact CE1-CE1 3.78Å; F219-F301 HydrophobicContact CZ-CE1 4.09Å; H297-F301 PolarHBondContact O-N 3.24Å; H297-F301 VanDerWaalsContact O-N 3.13Å; L299-F301 PolarHBondContact O-N 3.15Å; F301-Y304 WeakPolarHBondContact O-CB 3.35Å; F301-Y304 PolarHBondContact O-N 3.28Å; F301-K305 HydrophobicContact CD1-CG 3.78Å; F301-K305 HydrophobicContact CE1-CD 4.08Å; F301-K305 HydrophobicContact CE1-CG 3.56Å; F301-K305 HydrophobicContact CZ-CD 4.26Å; F301-K305 HydrophobicContact CZ-CG 4.18Å; F301-K305 WeakPolarHBondContact O-CG 3.3Å; F301-K305 PolarHBondContact O-N 3.03Å
302A98.4Very high97.7Very high0 Ų039.9 Ų39.90%019%0.19CC..Hα-helixtrans-64.7-42.7-179.700000111.8F219 V223 Y298 L299 K305 L306F219-A302 HydrophobicContact CB-CB 4.23Å; F219-A302 HydrophobicContact CD1-CB 4.08Å; V223-A302 HydrophobicContact CG2-CB 3.6Å; Y298-A302 WeakPolarHBondContact O-CB 3.3Å; Y298-A302 PolarHBondContact O-N 2.86Å; L299-A302 PolarHBondContact O-N 3.15Å; A302-K305 PolarHBondContact O-N 3.36Å; A302-L306 WeakPolarHBondContact O-CG 3.45Å; A302-L306 PolarHBondContact O-N 3.09Å; A302-L306 VanDerWaalsContact O-N 3.11Å
303Y98.6Very high97.7Very high22 Ų2239.9 Ų39.99%0.08619%0.19CC..Hα-helixtrans-62.3-41.7172.6-80.1-58.2000112.2V223 E227 L299 K305 L306 N307 D308 N311V223-Y303 HydrophobicContact CB-CE1 4.47Å; V223-Y303 HydrophobicContact CG1-CD1 4.25Å; V223-Y303 HydrophobicContact CG1-CE1 3.47Å; V223-Y303 VanDerWaalsContact CG1-CE1 3.47Å; V223-Y303 HydrophobicContact CG1-CE2 4.19Å; V223-Y303 VanDerWaalsContact CG1-CZ 3.41Å; V223-Y303 WeakPolarHBondContact CG1-OH 3.35Å; V223-Y303 HydrophobicContact CG2-CD1 4.07Å; V223-Y303 HydrophobicContact CG2-CE1 4.11Å; V223-Y303 HydrophobicContact CG2-CG 4.27Å; E227-Y303 WeakPolarHBondContact CG-OH 3.49Å; E227-Y303 VanDerWaalsContact OE1-CE2 3.22Å; E227-Y303 WeakPolarHBondContact OE1-CE2 3.23Å; E227-Y303 VanDerWaalsContact OE1-CZ 3.32Å; E227-Y303 PolarHBondContact OE1-OH 3.36Å; L299-Y303 HydrophobicContact CB-CD2 4.22Å; L299-Y303 HydrophobicContact CB-CE2 4.22Å; L299-Y303 HydrophobicContact CD2-CE2 3.93Å; L299-Y303 WeakPolarHBondContact O-CB 3.33Å; L299-Y303 WeakPolarHBondContact O-CD2 3.2Å; L299-Y303 PolarHBondContact O-N 3.42Å; Y303-K305 VanDerWaalsContact C-N 3.34Å; Y303-K305 PolarHBondContact O-N 3.4Å; Y303-L306 CarbonylContact O-C 3.46Å; Y303-L306 PolarHBondContact O-N 2.96Å; Y303-L306 VanDerWaalsContact O-N 3.11Å; Y303-N307 PolarHBondContact O-N 3.39Å; Y303-N307 VanDerWaalsContact O-N 3.15Å; Y303-D308 HydrophobicContact CD1-CB 3.92Å; Y303-D308 PolarHBondContact O-N 3.43Å; Y303-N311 HydrophobicContact CD1-CB 3.61Å; Y303-N311 HydrophobicContact CD2-CB 3.75Å; Y303-N311 HydrophobicContact CE1-CB 3.6Å; Y303-N311 HydrophobicContact CE2-CB 3.78Å; Y303-N311 HydrophobicContact CG-CB 3.69Å
304Y97.8Very high97.8Very high82 Ų8240.6 Ų40.632%0.32219%0.194SC..Hα-helixtrans-58.3-44.9174.8174.2-101.7000112.1Q300 F301 L306 N307 L309 Y335 Y336Q300-Y304 WeakPolarHBondContact O-CB 2.77Å; Q300-Y304 PolarHBondContact O-N 2.83Å; F301-Y304 WeakPolarHBondContact O-CB 3.35Å; F301-Y304 PolarHBondContact O-N 3.28Å; Y304-L306 PolarHBondContact O-N 3.31Å; Y304-N307 PolarHBondContact O-N 2.99Å; Y304-L309 HydrophobicContact CD2-CD2 3.66Å; Y304-L309 HydrophobicContact CE2-CD2 4.25Å; Y304-Y335 HydrophobicContact CE2-CE1 4.4Å; Y304-Y336 AromaticContact CD2-CE1 3.89Å; Y304-Y336 HydrophobicContact CD2-CE1 3.89Å; Y304-Y336 WeakPolarHBondContact CD2-OH 3.47Å; Y304-Y336 HydrophobicContact CE2-CE1 4.28Å
305K97.9Very high97.9Very high108 Ų10839 Ų3947%0.4719%0.185SC..Hα-helixtrans-64.7-26.6176.6-70.1-67.9-174.7179.10113.6F219 F301 A302 Y303 N307F219-K305 HydrophobicContact CB-CB 4.4Å; F219-K305 HydrophobicContact CD1-CB 4.06Å; F219-K305 HydrophobicContact CD1-CG 4.17Å; F219-K305 HydrophobicContact CD2-CB 3.51Å; F219-K305 HydrophobicContact CD2-CG 4.07Å; F219-K305 HydrophobicContact CE1-CB 4.26Å; F219-K305 HydrophobicContact CE1-CG 3.91Å; F219-K305 HydrophobicContact CE2-CB 3.72Å; F219-K305 HydrophobicContact CE2-CD 4.17Å; F219-K305 HydrophobicContact CE2-CG 3.78Å; F219-K305 HydrophobicContact CG-CB 3.7Å; F219-K305 HydrophobicContact CG-CG 4.27Å; F219-K305 HydrophobicContact CZ-CB 4.11Å; F219-K305 HydrophobicContact CZ-CD 4.21Å; F219-K305 HydrophobicContact CZ-CG 3.71Å; F301-K305 HydrophobicContact CD1-CG 3.78Å; F301-K305 HydrophobicContact CE1-CD 4.08Å; F301-K305 HydrophobicContact CE1-CG 3.56Å; F301-K305 HydrophobicContact CZ-CD 4.26Å; F301-K305 HydrophobicContact CZ-CG 4.18Å; F301-K305 WeakPolarHBondContact O-CG 3.3Å; F301-K305 PolarHBondContact O-N 3.03Å; A302-K305 PolarHBondContact O-N 3.36Å; Y303-K305 VanDerWaalsContact C-N 3.34Å; Y303-K305 PolarHBondContact O-N 3.4Å; K305-N307 VanDerWaalsContact C-N 3.29Å
306L97.8Very high97.9Very high79 Ų7939 Ų3941%0.41419%0.185SC..THydrogen-bonded Turntrans-874173.4-64174.2000113.3F219 V223 A302 Y303 Y304 D308F219-L306 HydrophobicContact CB-CD1 4.21Å; F219-L306 HydrophobicContact CB-CD2 4.02Å; F219-L306 HydrophobicContact CB-CG 3.89Å; V223-L306 HydrophobicContact CG2-CD1 3.97Å; A302-L306 WeakPolarHBondContact O-CG 3.45Å; A302-L306 PolarHBondContact O-N 3.09Å; A302-L306 VanDerWaalsContact O-N 3.11Å; Y303-L306 CarbonylContact O-C 3.46Å; Y303-L306 PolarHBondContact O-N 2.96Å; Y303-L306 VanDerWaalsContact O-N 3.11Å; Y304-L306 PolarHBondContact O-N 3.31Å; L306-D308 PolarHBondContact O-N 2.86Å
307N96.5Very high97.8Very high128 Ų12839.7 Ų39.768%0.68419%0.189SC*.THydrogen-bonded Turntrans58.827.4-175.5-165.157.2000113.8Y303 Y304 K305 L309Y303-N307 PolarHBondContact O-N 3.39Å; Y303-N307 VanDerWaalsContact O-N 3.15Å; Y304-N307 PolarHBondContact O-N 2.99Å; K305-N307 VanDerWaalsContact C-N 3.29Å; N307-L309 PolarHBondContact O-N 3.46Å
308D97.2Very high97.9Very high53 Ų5336.6 Ų36.628%0.28318%0.175SC..  trans-100.174.5176.6-174.1-4.2000110.1Y303 L306 K310 N311 A312Y303-D308 HydrophobicContact CD1-CB 3.92Å; Y303-D308 PolarHBondContact O-N 3.43Å; L306-D308 PolarHBondContact O-N 2.86Å; D308-K310 VanDerWaalsContact C-N 3.28Å; D308-K310 PolarHBondContact O-N 3.29Å; D308-N311 VanDerWaalsContact CG-ND2 3.32Å; D308-N311 PolarHBondContact O-N 2.69Å; D308-N311 PolarHBondContact OD1-N 2.9Å; D308-N311 PolarHBondContact OD1-ND2 3.33Å; D308-N311 PolarHBondContact OD2-ND2 3.01Å; D308-A312 WeakPolarHBondContact O-CB 3.48Å; D308-A312 PolarHBondContact O-N 3.41Å
309L96.8Very high97.9Very high14 Ų1435.5 Ų35.57%0.07317%0.17CC..Hα-helixtrans-70.9-26.8-175.2-62.9173.8000112.9Y304 N307 N311 A312 V313 Y336 W343 L345Y304-L309 HydrophobicContact CD2-CD2 3.66Å; Y304-L309 HydrophobicContact CE2-CD2 4.25Å; N307-L309 PolarHBondContact O-N 3.46Å; L309-N311 PolarHBondContact O-N 2.92Å; L309-A312 HydrophobicContact CD2-CB 4.47Å; L309-A312 PolarHBondContact O-N 2.88Å; L309-V313 VanDerWaalsContact O-CG2 3.28Å; L309-V313 WeakPolarHBondContact O-CG2 3.3Å; L309-V313 PolarHBondContact O-N 3.18Å; L309-Y336 HydrophobicContact CD2-CD1 4.26Å; L309-Y336 HydrophobicContact CD2-CE1 3.69Å; L309-W343 HydrophobicContact CD1-CB 3.53Å; L309-W343 HydrophobicContact CD1-CD2 3.21Å; L309-W343 HydrophobicContact CD1-CE3 3.61Å; L309-W343 HydrophobicContact CD1-CG 3.17Å; L309-W343 HydrophobicContact CD1-CZ3 4.44Å; L309-L345 HydrophobicContact CB-CD2 4.17Å
310K96Very high97.9Very high81 Ų8137 Ų3735%0.35218%0.179SC..Hα-helixtrans-61-30.9175.6-71.3-71.6-179-179.70112D308 P314 D344 L345 D349D308-K310 VanDerWaalsContact C-N 3.28Å; D308-K310 PolarHBondContact O-N 3.29Å; K310-P314 WeakPolarHBondContact O-CD 3.49Å; K310-P314 VanDerWaalsContact O-CG 3.24Å; K310-P314 WeakPolarHBondContact O-CG 3.44Å; K310-D344 VanDerWaalsContact CE-O 3.23Å; K310-D344 WeakPolarHBondContact CE-O 3.42Å; K310-D344 PolarHBondContact NZ-O 3.42Å; K310-L345 HydrophobicContact CD-CD2 4.36Å; K310-D349 VanDerWaalsContact CD-OD1 3.3Å; K310-D349 WeakPolarHBondContact CD-OD1 3.17Å; K310-D349 WeakPolarHBondContact CD-OD2 3.44Å; K310-D349 IonicContact NZ-OD1 3.96Å; K310-D349 IonicContact NZ-OD2 3.35Å; K310-D349 PolarHBondContact NZ-OD2 2.99Å
311N97.4Very high97.8Very high61 Ų6138.7 Ų38.733%0.32619%0.189SC..Hα-helixtrans-95.6-30.2172.7-71.5-55.5000113.4Y303 D308 L309 C315Y303-N311 HydrophobicContact CD1-CB 3.61Å; Y303-N311 HydrophobicContact CD2-CB 3.75Å; Y303-N311 HydrophobicContact CE1-CB 3.6Å; Y303-N311 HydrophobicContact CE2-CB 3.78Å; Y303-N311 HydrophobicContact CG-CB 3.69Å; D308-N311 VanDerWaalsContact CG-ND2 3.32Å; D308-N311 PolarHBondContact O-N 2.69Å; D308-N311 PolarHBondContact OD1-N 2.9Å; D308-N311 PolarHBondContact OD1-ND2 3.33Å; D308-N311 PolarHBondContact OD2-ND2 3.01Å; L309-N311 PolarHBondContact O-N 2.92Å; N311-C315 PolarHBondContact O-N 3.32Å; N311-C315 PolarHBondContact O-SG 3.49Å
312A98.1Very high97.7Very high0 Ų037.9 Ų37.90%019%0.185CC..Hα-helixtrans-65.2-43.1179.600000113D308 L309 C315 A316D308-A312 WeakPolarHBondContact O-CB 3.48Å; D308-A312 PolarHBondContact O-N 3.41Å; L309-A312 HydrophobicContact CD2-CB 4.47Å; L309-A312 PolarHBondContact O-N 2.88Å; A312-C315 WeakPolarHBondContact O-CB 3.42Å; A312-C315 PolarHBondContact O-N 3.36Å; A312-A316 PolarHBondContact O-N 2.85Å
313V98.3Very high97.6Very high0 Ų038.7 Ų38.70%019%0.189CC..Hα-helixtrans-67-47.6-175.1-178.50000112L309 C315 A316 T317 Y336 L345 D349 F350L309-V313 VanDerWaalsContact O-CG2 3.28Å; L309-V313 WeakPolarHBondContact O-CG2 3.3Å; L309-V313 PolarHBondContact O-N 3.18Å; V313-C315 PolarHBondContact O-N 3.43Å; V313-A316 WeakPolarHBondContact O-CB 3.33Å; V313-A316 PolarHBondContact O-N 3.32Å; V313-T317 PolarHBondContact O-N 2.93Å; V313-T317 PolarHBondContact O-OG1 3.11Å; V313-Y336 HydrophobicContact CG2-CD1 3.9Å; V313-Y336 HydrophobicContact CG2-CD2 3.82Å; V313-Y336 HydrophobicContact CG2-CE1 4.48Å; V313-Y336 HydrophobicContact CG2-CE2 4.37Å; V313-Y336 HydrophobicContact CG2-CG 3.59Å; V313-L345 HydrophobicContact CG2-CD1 3.83Å; V313-L345 HydrophobicContact CG2-CD2 4.06Å; V313-D349 VanDerWaalsContact CG1-O 3.22Å; V313-D349 WeakPolarHBondContact CG1-O 3.44Å; V313-F350 HydrophobicContact CG1-CD1 3.37Å; V313-F350 HydrophobicContact CG1-CD2 4.45Å; V313-F350 HydrophobicContact CG1-CE1 3.41Å; V313-F350 VanDerWaalsContact CG1-CE1 3.41Å; V313-F350 HydrophobicContact CG1-CE2 4.47Å; V313-F350 HydrophobicContact CG1-CG 3.93Å; V313-F350 HydrophobicContact CG1-CZ 3.98Å
314P98.4Very high97.5Very high17 Ų1741.3 Ų41.311%0.1121%0.209CC..Hα-helixtrans-58.3-34.3173.8-26.934.6000113.4K310 T317 S318 D349 R353K310-P314 WeakPolarHBondContact O-CD 3.49Å; K310-P314 VanDerWaalsContact O-CG 3.24Å; K310-P314 WeakPolarHBondContact O-CG 3.44Å; P314-T317 WeakPolarHBondContact CA-OG1 3.19Å; P314-T317 PolarHBondContact O-OG1 2.86Å; P314-S318 WeakPolarHBondContact O-CB 3.4Å; P314-S318 PolarHBondContact O-N 3.07Å; P314-S318 PolarHBondContact O-OG 3.19Å; P314-D349 VanDerWaalsContact CD-O 3.28Å; P314-D349 WeakPolarHBondContact CD-O 3.39Å; P314-D349 WeakPolarHBondContact CG-O 3.48Å; P314-R353 HydrophobicContact CB-CG 3.92Å
315C98.5Very high97.5Very high0 Ų044.1 Ų44.10%023%0.229CC..Hα-helixtrans-66.7-41.7174-68.80000112Y296 L299 Q300 N311 A312 V313 T317 S318 Y319 R353Y296-C315 HydrophobicContact CD1-CB 4.15Å; L299-C315 HydrophobicContact CB-CB 4.27Å; Q300-C315 HydrophobicContact CB-CB 3.73Å; N311-C315 PolarHBondContact O-N 3.32Å; N311-C315 PolarHBondContact O-SG 3.49Å; A312-C315 WeakPolarHBondContact O-CB 3.42Å; A312-C315 PolarHBondContact O-N 3.36Å; V313-C315 PolarHBondContact O-N 3.43Å; C315-T317 VanDerWaalsContact C-N 3.33Å; C315-T317 PolarHBondContact O-N 3.27Å; C315-S318 PolarHBondContact O-N 2.99Å; C315-Y319 PolarHBondContact O-N 3.27Å; C315-R353 PolarHBondContact SG-NH2 2.94Å
316A98.3Very high97.4Very high0 Ų040.8 Ų40.80%022%0.217CC..Hα-helixtrans-60.2-44.5176.100000111.2Q300 A312 V313 Y319 V320 M329 V333 Y336Q300-A316 HydrophobicContact CG-CB 3.69Å; A312-A316 PolarHBondContact O-N 2.85Å; V313-A316 WeakPolarHBondContact O-CB 3.33Å; V313-A316 PolarHBondContact O-N 3.32Å; A316-Y319 WeakPolarHBondContact O-CB 3.46Å; A316-Y319 PolarHBondContact O-N 3.01Å; A316-V320 WeakPolarHBondContact O-CG2 3.42Å; A316-V320 PolarHBondContact O-N 3.42Å; A316-V320 VanDerWaalsContact O-N 3.13Å; A316-M329 HydrophobicContact CB-SD 3.87Å; A316-V333 HydrophobicContact CB-CG2 3.72Å; A316-Y336 HydrophobicContact CB-CD2 4.36Å; A316-Y336 HydrophobicContact CB-CE2 4.12Å
317T98.1Very high97.3Very high14 Ų1444.3 Ų44.39%0.08623%0.231CC..Hα-helixtrans-72.4-33.9178.851.50000112.4V313 P314 C315 Y319 V320 L321 V333 F350 L351V313-T317 PolarHBondContact O-N 2.93Å; V313-T317 PolarHBondContact O-OG1 3.11Å; P314-T317 WeakPolarHBondContact CA-OG1 3.19Å; P314-T317 PolarHBondContact O-OG1 2.86Å; C315-T317 VanDerWaalsContact C-N 3.33Å; C315-T317 PolarHBondContact O-N 3.27Å; T317-Y319 VanDerWaalsContact C-N 3.33Å; T317-V320 PolarHBondContact O-N 3.13Å; T317-L321 PolarHBondContact O-N 3.33Å; T317-L321 VanDerWaalsContact O-N 3.15Å; T317-V333 HydrophobicContact CG2-CG1 4.18Å; T317-V333 HydrophobicContact CG2-CG2 4.17Å; T317-F350 HydrophobicContact CG2-CB 4.47Å; T317-F350 WeakPolarHBondContact CG2-O 3.35Å; T317-L351 PolarHBondContact OG1-O 3.49Å
318S98.5Very high97.3Very high0 Ų043 Ų430%023%0.227CC..Hα-helixtrans-61.8-38168.7-700000112.6P314 C315 L321 F322 R353P314-S318 WeakPolarHBondContact O-CB 3.4Å; P314-S318 PolarHBondContact O-N 3.07Å; P314-S318 PolarHBondContact O-OG 3.19Å; C315-S318 PolarHBondContact O-N 2.99Å; S318-L321 WeakPolarHBondContact O-CB 3.39Å; S318-L321 PolarHBondContact O-N 3.4Å; S318-F322 WeakPolarHBondContact O-CD2 3.05Å; S318-F322 WeakPolarHBondContact O-CE2 3.31Å; S318-R353 PolarHBondContact OG-N 2.97Å
319Y98.6Very high97.3Very high21 Ų2140.5 Ų40.58%0.08221%0.214CC..Hα-helixtrans-62.4-50.5174.5-179.9-78.3000111.4A293 H297 C315 A316 T317 L321 F322 D323 D326 M329A293-Y319 HydrophobicContact CB-CD2 3.9Å; A293-Y319 HydrophobicContact CB-CE2 3.89Å; A293-Y319 WeakPolarHBondContact O-CD2 3.4Å; H297-Y319 HydrophobicContact CB-CD2 3.71Å; H297-Y319 HydrophobicContact CB-CE2 3.71Å; C315-Y319 PolarHBondContact O-N 3.27Å; A316-Y319 WeakPolarHBondContact O-CB 3.46Å; A316-Y319 PolarHBondContact O-N 3.01Å; T317-Y319 VanDerWaalsContact C-N 3.33Å; Y319-L321 PolarHBondContact O-N 3.15Å; Y319-L321 VanDerWaalsContact O-N 3.16Å; Y319-F322 PolarHBondContact O-N 3.43Å; Y319-D323 HydrophobicContact CD1-CB 4.4Å; Y319-D323 HydrophobicContact CE1-CB 3.86Å; Y319-D323 PolarHBondContact O-N 3.16Å; Y319-D326 HydrophobicContact CE1-CB 3.69Å; Y319-D326 WeakPolarHBondContact CE1-OD2 3.34Å; Y319-D326 PolarHBondContact OH-OD2 3.23Å; Y319-M329 HydrophobicContact CD1-CB 3.52Å; Y319-M329 HydrophobicContact CD1-CE 4.05Å; Y319-M329 HydrophobicContact CD1-CG 3.42Å; Y319-M329 VanDerWaalsContact CD1-CG 3.42Å; Y319-M329 HydrophobicContact CD2-CE 3.98Å; Y319-M329 HydrophobicContact CE1-CB 3.67Å; Y319-M329 HydrophobicContact CE1-CE 4.45Å; Y319-M329 HydrophobicContact CE1-CG 4.09Å; Y319-M329 HydrophobicContact CE2-CE 4.43Å; Y319-M329 HydrophobicContact CG-CB 4.38Å; Y319-M329 HydrophobicContact CG-CE 3.78Å; Y319-M329 HydrophobicContact CG-CG 3.88Å
320V98.1Very high97.3Very high31 Ų3142.7 Ų42.719%0.18823%0.226CC..Hα-helixtrans-60.4-27.6-178.5173.20000111.9A316 T317 F322 D323 P324 M329 V333A316-V320 WeakPolarHBondContact O-CG2 3.42Å; A316-V320 PolarHBondContact O-N 3.42Å; A316-V320 VanDerWaalsContact O-N 3.13Å; T317-V320 PolarHBondContact O-N 3.13Å; V320-F322 VanDerWaalsContact C-N 3.29Å; V320-F322 PolarHBondContact O-N 2.91Å; V320-D323 CarbonylContact O-C 3.44Å; V320-P324 VanDerWaalsContact O-CA 3.3Å; V320-P324 WeakPolarHBondContact O-CA 3.39Å; V320-P324 VanDerWaalsContact O-N 3.17Å; V320-M329 HydrophobicContact CG2-CB 4.16Å; V320-M329 HydrophobicContact CG2-CG 3.68Å; V320-V333 HydrophobicContact CG2-CG2 4.07Å
321L97Very high97.3Very high41 Ų4143.8 Ų43.822%0.21524%0.236CC..Hα-helixtrans-59.6-38.8172.3-177.664.5000112.5T317 S318 Y319 P352 A356 V357 Y360T317-L321 PolarHBondContact O-N 3.33Å; T317-L321 VanDerWaalsContact O-N 3.15Å; S318-L321 WeakPolarHBondContact O-CB 3.39Å; S318-L321 PolarHBondContact O-N 3.4Å; Y319-L321 PolarHBondContact O-N 3.15Å; Y319-L321 VanDerWaalsContact O-N 3.16Å; L321-P352 HydrophobicContact CD2-CB 4.23Å; L321-A356 HydrophobicContact CD2-CB 4.38Å; L321-V357 HydrophobicContact CD2-CG2 4.19Å; L321-Y360 HydrophobicContact CD1-CD1 3.78Å; L321-Y360 HydrophobicContact CD1-CD2 4.3Å; L321-Y360 HydrophobicContact CD1-CE1 3.97Å; L321-Y360 HydrophobicContact CD1-CE2 4.46Å; L321-Y360 HydrophobicContact CD1-CG 3.96Å; L321-Y360 HydrophobicContact CD2-CD1 4.35Å; L321-Y360 HydrophobicContact CD2-CG 3.95Å; L321-Y360 HydrophobicContact CG-CD1 4.09Å; L321-Y360 HydrophobicContact CG-CD2 3.92Å; L321-Y360 HydrophobicContact CG-CE2 4.42Å; L321-Y360 HydrophobicContact CG-CG 3.73Å; L321-Y360 VanDerWaalsContact O-CE2 3.22Å; L321-Y360 WeakPolarHBondContact O-CE2 3.34Å
322F96.4Very high97.3Very high43 Ų4343.2 Ų43.219%0.18923%0.232CC..Hα-helixtrans-88.2-30.3-180-62.7-66.2000113.2V292 A293 Y296 S318 Y319 V320 A356 Y359 Y360V292-F322 HydrophobicContact CG1-CD2 4.35Å; V292-F322 HydrophobicContact CG1-CE2 3.75Å; V292-F322 HydrophobicContact CG1-CZ 3.86Å; A293-F322 HydrophobicContact CB-CB 3.79Å; A293-F322 HydrophobicContact CB-CD2 4.44Å; A293-F322 HydrophobicContact CB-CG 4.43Å; Y296-F322 HydrophobicContact CD2-CD2 4.26Å; Y296-F322 AromaticContact CD2-CE2 3.9Å; Y296-F322 HydrophobicContact CD2-CE2 3.9Å; Y296-F322 AromaticContact CE2-CE2 3.74Å; Y296-F322 HydrophobicContact CE2-CE2 3.74Å; S318-F322 WeakPolarHBondContact O-CD2 3.05Å; S318-F322 WeakPolarHBondContact O-CE2 3.31Å; Y319-F322 PolarHBondContact O-N 3.43Å; V320-F322 VanDerWaalsContact C-N 3.29Å; V320-F322 PolarHBondContact O-N 2.91Å; F322-A356 HydrophobicContact CE2-CB 3.98Å; F322-A356 HydrophobicContact CZ-CB 4.11Å; F322-Y359 AromaticContact CE1-CD1 3.6Å; F322-Y359 HydrophobicContact CE1-CD1 3.6Å; F322-Y359 HydrophobicContact CE1-CE1 4.02Å; F322-Y359 AromaticContact CZ-CD1 3.8Å; F322-Y359 HydrophobicContact CZ-CD1 3.8Å; F322-Y359 HydrophobicContact CZ-CE1 4.48Å; F322-Y360 AromaticContact CD1-CD2 3.94Å; F322-Y360 HydrophobicContact CD1-CD2 3.94Å; F322-Y360 HydrophobicContact CE1-CD2 4.02Å; F322-Y360 HydrophobicContact CE1-CG 4.4Å
323D96.6Very high97.2Very high18 Ų1843.8 Ų43.810%0.09624%0.236CC..  trans-134.575.6-179.3-163.916.7000111.8K290 Y319 V320 N325 D326K290-D323 HydrophobicContact CD-CB 4.13Å; K290-D323 IonicContact NZ-OD1 3.56Å; K290-D323 PolarHBondContact NZ-OD1 3.3Å; K290-D323 IonicContact NZ-OD2 3.72Å; K290-D323 PolarHBondContact NZ-OD2 2.86Å; Y319-D323 HydrophobicContact CD1-CB 4.4Å; Y319-D323 HydrophobicContact CE1-CB 3.86Å; Y319-D323 PolarHBondContact O-N 3.16Å; V320-D323 CarbonylContact O-C 3.44Å; D323-N325 PolarHBondContact O-N 3.38Å; D323-D326 HydrophobicContact CB-CB 4.46Å; D323-D326 PolarHBondContact O-N 3.17Å
324P96.3Very high97.2Very high76 Ų7646.3 Ų46.349%0.49426%0.257SS..THydrogen-bonded Turntrans-68.2-17.8-174.827.1-35.4000113.3V320 N330V320-P324 VanDerWaalsContact O-CA 3.3Å; V320-P324 WeakPolarHBondContact O-CA 3.39Å; V320-P324 VanDerWaalsContact O-N 3.17Å; P324-N330 PolarHBondContact O-ND2 3.11Å
325N96.3Very high97.1Very high141 Ų14150 Ų5075%0.75427%0.269SS*.THydrogen-bonded Turntrans-89.4-3-177.1-62.4-36.2000113.2D323 E327D323-N325 PolarHBondContact O-N 3.38Å; N325-E327 PolarHBondContact O-N 2.94Å
326D96.7Very high97Very high38 Ų3850.2 Ų50.220%0.20327%0.27CS..  trans-74.9104.3177.9-171.8-46.8000111Y319 D323 V328 M329 N330Y319-D326 HydrophobicContact CE1-CB 3.69Å; Y319-D326 WeakPolarHBondContact CE1-OD2 3.34Å; Y319-D326 PolarHBondContact OH-OD2 3.23Å; D323-D326 HydrophobicContact CB-CB 4.46Å; D323-D326 PolarHBondContact O-N 3.17Å; D326-V328 VanDerWaalsContact C-N 3.27Å; D326-V328 PolarHBondContact O-N 3.12Å; D326-V328 WeakPolarHBondContact OD1-CA 3.44Å; D326-V328 WeakPolarHBondContact OD1-CB 3.22Å; D326-V328 PolarHBondContact OD1-N 3.2Å; D326-M329 HydrophobicContact CB-CB 4.41Å; D326-M329 PolarHBondContact OD1-N 3.32Å; D326-N330 WeakPolarHBondContact O-CB 3.33Å; D326-N330 PolarHBondContact O-N 2.87Å; D326-N330 PolarHBondContact O-ND2 3.46Å
327E96.3Very high96.9Very high154 Ų15456.1 Ų56.172%0.7230%0.296SS*.Hα-helixtrans-62.9-32.7-179.8-65.7-172174.300112.9N325 N331N325-E327 PolarHBondContact O-N 2.94Å; E327-N331 WeakPolarHBondContact O-CB 3.47Å; E327-N331 PolarHBondContact O-N 3.48Å; E327-N331 PolarHBondContact O-ND2 3.25Å
328V95.8Very high96.8Very high99 Ų9964.6 Ų64.660%0.633%0.327SS*.Hα-helixtrans-68.3-48.2-177.4178.60000109.8D326 N331 N332D326-V328 VanDerWaalsContact C-N 3.27Å; D326-V328 PolarHBondContact O-N 3.12Å; D326-V328 WeakPolarHBondContact OD1-CA 3.44Å; D326-V328 WeakPolarHBondContact OD1-CB 3.22Å; D326-V328 PolarHBondContact OD1-N 3.2Å; V328-N331 PolarHBondContact O-N 3.21Å; V328-N332 PolarHBondContact O-N 3.05Å
329M96.6Very high96.6Very high2 Ų266.9 Ų66.91%0.0134%0.338CS..Hα-helixtrans-68.8-37.7177.9-166.862.36900111.9H297 Q300 A316 Y319 V320 D326 N331 N332 V333H297-M329 HydrophobicContact CB-CE 4.26Å; Q300-M329 HydrophobicContact CG-SD 4.22Å; A316-M329 HydrophobicContact CB-SD 3.87Å; Y319-M329 HydrophobicContact CD1-CB 3.52Å; Y319-M329 HydrophobicContact CD1-CE 4.05Å; Y319-M329 HydrophobicContact CD1-CG 3.42Å; Y319-M329 VanDerWaalsContact CD1-CG 3.42Å; Y319-M329 HydrophobicContact CD2-CE 3.98Å; Y319-M329 HydrophobicContact CE1-CB 3.67Å; Y319-M329 HydrophobicContact CE1-CE 4.45Å; Y319-M329 HydrophobicContact CE1-CG 4.09Å; Y319-M329 HydrophobicContact CE2-CE 4.43Å; Y319-M329 HydrophobicContact CG-CB 4.38Å; Y319-M329 HydrophobicContact CG-CE 3.78Å; Y319-M329 HydrophobicContact CG-CG 3.88Å; V320-M329 HydrophobicContact CG2-CB 4.16Å; V320-M329 HydrophobicContact CG2-CG 3.68Å; D326-M329 HydrophobicContact CB-CB 4.41Å; D326-M329 PolarHBondContact OD1-N 3.32Å; M329-N331 VanDerWaalsContact C-N 3.3Å; M329-N331 PolarHBondContact O-N 3.16Å; M329-N332 WeakPolarHBondContact O-CB 3.48Å; M329-N332 PolarHBondContact O-N 2.95Å; M329-N332 VanDerWaalsContact O-N 3.11Å; M329-N332 HydrophobicContact SD-CB 4.11Å; M329-V333 PolarHBondContact O-N 2.96Å
330N97.3Very high96.4Very high60 Ų6069.3 Ų69.332%0.32135%0.347SS..Hα-helixtrans-58.8-42.2173.8-80.6-50000111.9P324 D326 V333 A334P324-N330 PolarHBondContact O-ND2 3.11Å; D326-N330 WeakPolarHBondContact O-CB 3.33Å; D326-N330 PolarHBondContact O-N 2.87Å; D326-N330 PolarHBondContact O-ND2 3.46Å; N330-V333 PolarHBondContact O-N 2.98Å; N330-A334 WeakPolarHBondContact O-CB 3.27Å; N330-A334 PolarHBondContact O-N 3.37Å
331N97.1Very high96.2Very high104 Ų10475.1 Ų75.156%0.55638%0.377SS*.Hα-helixtrans-64-38.5173.9-73.9-33.6000112.2E327 V328 M329 A334 Y335E327-N331 WeakPolarHBondContact O-CB 3.47Å; E327-N331 PolarHBondContact O-N 3.48Å; E327-N331 PolarHBondContact O-ND2 3.25Å; V328-N331 PolarHBondContact O-N 3.21Å; M329-N331 VanDerWaalsContact C-N 3.3Å; M329-N331 PolarHBondContact O-N 3.16Å; N331-A334 PolarHBondContact O-N 3.24Å; N331-Y335 WeakPolarHBondContact O-CB 3.22Å; N331-Y335 PolarHBondContact O-N 3.22Å
332N96.4Very high96Very high48 Ų4880.5 Ų80.526%0.25740%0.399SS..Hα-helixtrans-61.9-45.2174.3-68.8-17.2000111.6V328 M329 A334 Y335 Y336V328-N332 PolarHBondContact O-N 3.05Å; M329-N332 WeakPolarHBondContact O-CB 3.48Å; M329-N332 PolarHBondContact O-N 2.95Å; M329-N332 VanDerWaalsContact O-N 3.11Å; M329-N332 HydrophobicContact SD-CB 4.11Å; N332-A334 PolarHBondContact O-N 3.46Å; N332-Y335 WeakPolarHBondContact O-CB 3.45Å; N332-Y335 PolarHBondContact O-N 2.72Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.4Å; N332-Y336 PolarHBondContact O-N 2.97Å
333V97.1Very high95.8Very high13 Ų1380.9 Ų80.98%0.07940%0.399CS..Hα-helixtrans-62-43.3175.6174.50000110.9A316 T317 V320 M329 N330 Y335 Y336 K337 F350A316-V333 HydrophobicContact CB-CG2 3.72Å; T317-V333 HydrophobicContact CG2-CG1 4.18Å; T317-V333 HydrophobicContact CG2-CG2 4.17Å; V320-V333 HydrophobicContact CG2-CG2 4.07Å; M329-V333 PolarHBondContact O-N 2.96Å; N330-V333 PolarHBondContact O-N 2.98Å; V333-Y335 VanDerWaalsContact C-N 3.32Å; V333-Y335 PolarHBondContact O-N 3.42Å; V333-Y336 PolarHBondContact O-N 3.01Å; V333-K337 HydrophobicContact CG1-CD 4.32Å; V333-K337 WeakPolarHBondContact O-CG 3.3Å; V333-K337 PolarHBondContact O-N 3.02Å; V333-F350 HydrophobicContact CG1-CD1 4.4Å
334A97.2Very high95.7Very high52 Ų5286.1 Ų86.143%0.4343%0.427SS..Hα-helixtrans-61.7-40.2176.200000112.2N330 N331 N332 K337 Y338N330-A334 WeakPolarHBondContact O-CB 3.27Å; N330-A334 PolarHBondContact O-N 3.37Å; N331-A334 PolarHBondContact O-N 3.24Å; N332-A334 PolarHBondContact O-N 3.46Å; A334-K337 PolarHBondContact O-N 2.95Å; A334-Y338 WeakPolarHBondContact O-CB 3.37Å; A334-Y338 PolarHBondContact O-N 3.31Å
335Y95.7Very high95.7Very high96 Ų9682.9 Ų82.938%0.37641%0.405SS..Hα-helixtrans-61.4-44.3174.6173.7-104.7000112Y304 N331 N332 V333 Y338 H339 W343Y304-Y335 HydrophobicContact CE2-CE1 4.4Å; N331-Y335 WeakPolarHBondContact O-CB 3.22Å; N331-Y335 PolarHBondContact O-N 3.22Å; N332-Y335 WeakPolarHBondContact O-CB 3.45Å; N332-Y335 PolarHBondContact O-N 2.72Å; V333-Y335 VanDerWaalsContact C-N 3.32Å; V333-Y335 PolarHBondContact O-N 3.42Å; Y335-Y338 PolarHBondContact O-N 2.97Å; Y335-H339 AromaticContact CD2-CD2 3.6Å; Y335-H339 AromaticContact CD2-NE2 3.88Å; Y335-H339 AromaticContact CE2-CD2 3.31Å; Y335-H339 WeakPolarHBondContact CE2-CD2 3.18Å; Y335-H339 AromaticContact CE2-NE2 3.4Å; Y335-H339 WeakPolarHBondContact CE2-NE2 3.18Å; Y335-H339 AromaticContact CZ-CD2 3.8Å; Y335-H339 PolarHBondContact O-CD2 2.78Å; Y335-H339 PolarHBondContact O-N 3.47Å; Y335-H339 VanDerWaalsContact O-N 3.15Å; Y335-W343 AromaticContact CD1-CH2 3.98Å; Y335-W343 HydrophobicContact CD1-CH2 3.98Å; Y335-W343 HydrophobicContact CD1-CZ3 4.18Å; Y335-W343 AromaticContact CE1-CH2 3.27Å; Y335-W343 HydrophobicContact CE1-CH2 3.27Å; Y335-W343 HydrophobicContact CE1-CZ2 4.27Å; Y335-W343 AromaticContact CE1-CZ3 3.9Å; Y335-W343 HydrophobicContact CE1-CZ3 3.9Å; Y335-W343 HydrophobicContact CE2-CH2 4.33Å; Y335-W343 AromaticContact CZ-CH2 3.47Å; Y335-W343 VanDerWaalsContact CZ-CH2 3.47Å; Y335-W343 WeakPolarHBondContact OH-CH2 3.46Å
336Y96.9Very high95.6Very high4 Ų478.7 Ų78.72%0.01639%0.385CS..Hα-helixtrans-61.5-43.5173.1-64.8-49.5000112.7Q300 Y304 L309 V313 A316 N332 V333 H339 R340 W343Q300-Y336 PolarHBondContact NE2-OH 2.74Å; Y304-Y336 AromaticContact CD2-CE1 3.89Å; Y304-Y336 HydrophobicContact CD2-CE1 3.89Å; Y304-Y336 WeakPolarHBondContact CD2-OH 3.47Å; Y304-Y336 HydrophobicContact CE2-CE1 4.28Å; L309-Y336 HydrophobicContact CD2-CD1 4.26Å; L309-Y336 HydrophobicContact CD2-CE1 3.69Å; V313-Y336 HydrophobicContact CG2-CD1 3.9Å; V313-Y336 HydrophobicContact CG2-CD2 3.82Å; V313-Y336 HydrophobicContact CG2-CE1 4.48Å; V313-Y336 HydrophobicContact CG2-CE2 4.37Å; V313-Y336 HydrophobicContact CG2-CG 3.59Å; A316-Y336 HydrophobicContact CB-CD2 4.36Å; A316-Y336 HydrophobicContact CB-CE2 4.12Å; N332-Y336 HydrophobicContact CB-CE2 4.38Å; N332-Y336 WeakPolarHBondContact O-CD2 3.4Å; N332-Y336 PolarHBondContact O-N 2.97Å; V333-Y336 PolarHBondContact O-N 3.01Å; Y336-H339 CarbonylContact O-C 3.55Å; Y336-H339 PolarHBondContact O-N 3.07Å; Y336-R340 PolarHBondContact O-N 3.29Å; Y336-W343 HydrophobicContact CD1-CE3 4.1Å; Y336-W343 AromaticContact CD1-CZ3 3.6Å; Y336-W343 HydrophobicContact CD1-CZ3 3.6Å; Y336-W343 HydrophobicContact CE1-CZ3 4.23Å
337K96.3Very high95.5Very high124 Ų12482.8 Ų82.854%0.53940%0.403SS..Hα-helixtrans-61.6-44.4176.6-73.3179.8178.1178.10112V333 A334 H339 R340 F350V333-K337 HydrophobicContact CG1-CD 4.32Å; V333-K337 WeakPolarHBondContact O-CG 3.3Å; V333-K337 PolarHBondContact O-N 3.02Å; A334-K337 PolarHBondContact O-N 2.95Å; K337-H339 VanDerWaalsContact C-N 3.31Å; K337-H339 PolarHBondContact O-N 2.73Å; K337-R340 WeakPolarHBondContact O-CB 3.33Å; K337-R340 PolarHBondContact O-N 3.37Å; K337-F350 HydrophobicContact CB-CE1 4.19Å; K337-F350 HydrophobicContact CB-CZ 4.33Å; K337-F350 HydrophobicContact CD-CD1 4.41Å; K337-F350 HydrophobicContact CD-CE1 4.43Å; K337-F350 HydrophobicContact CG-CD1 3.67Å; K337-F350 HydrophobicContact CG-CE1 3.28Å; K337-F350 HydrophobicContact CG-CE2 4.46Å; K337-F350 HydrophobicContact CG-CG 4.4Å; K337-F350 HydrophobicContact CG-CZ 3.75Å
338Y96.4Very high95.5Very high192 Ų19282.7 Ų82.775%0.75340%0.402SS*.Hα-helixtrans-62.2-39.3179.9-179.1-99.6000112.3A334 Y335A334-Y338 WeakPolarHBondContact O-CB 3.37Å; A334-Y338 PolarHBondContact O-N 3.31Å; Y335-Y338 PolarHBondContact O-N 2.97Å
339H94.5Very high95.5Very high47 Ų4779 Ų7922%0.21838%0.379CS..THydrogen-bonded Turntrans-95.113.2-180-69.5-59.5000114.4Y335 Y336 K337 N341 K342 W343Y335-H339 AromaticContact CD2-CD2 3.6Å; Y335-H339 AromaticContact CD2-NE2 3.88Å; Y335-H339 AromaticContact CE2-CD2 3.31Å; Y335-H339 WeakPolarHBondContact CE2-CD2 3.18Å; Y335-H339 AromaticContact CE2-NE2 3.4Å; Y335-H339 WeakPolarHBondContact CE2-NE2 3.18Å; Y335-H339 AromaticContact CZ-CD2 3.8Å; Y335-H339 PolarHBondContact O-CD2 2.78Å; Y335-H339 PolarHBondContact O-N 3.47Å; Y335-H339 VanDerWaalsContact O-N 3.15Å; Y336-H339 CarbonylContact O-C 3.55Å; Y336-H339 PolarHBondContact O-N 3.07Å; K337-H339 VanDerWaalsContact C-N 3.31Å; K337-H339 PolarHBondContact O-N 2.73Å; H339-N341 VanDerWaalsContact C-N 3.33Å; H339-N341 PolarHBondContact O-N 2.76Å; H339-K342 WeakPolarHBondContact O-CA 3.5Å; H339-K342 WeakPolarHBondContact O-CB 3.23Å; H339-K342 PolarHBondContact O-N 2.72Å; H339-W343 HydrophobicContact CB-CD2 3.92Å; H339-W343 HydrophobicContact CB-CE3 3.55Å; H339-W343 HydrophobicContact CB-CH2 3.52Å; H339-W343 HydrophobicContact CB-CZ2 3.98Å; H339-W343 HydrophobicContact CB-CZ3 3.35Å; H339-W343 AromaticContact CD2-CH2 3.71Å; H339-W343 AromaticContact CG-CH2 3.82Å; H339-W343 PolarHBondContact O-N 3.36Å
340R94.6Very high95.5Very high73 Ų7380 Ų8028%0.27538%0.383SS..G310 helixtrans-46.2-51.7-176.8176.5-171.8173.2-1783.2113.6Y336 K337 K342 W343 D344 L345 E347 F350Y336-R340 PolarHBondContact O-N 3.29Å; K337-R340 WeakPolarHBondContact O-CB 3.33Å; K337-R340 PolarHBondContact O-N 3.37Å; R340-K342 VanDerWaalsContact C-N 3.28Å; R340-K342 PolarHBondContact O-N 2.88Å; R340-W343 CarbonylContact O-C 3.59Å; R340-W343 PolarHBondContact O-N 2.85Å; R340-D344 PolarHBondContact O-N 3.46Å; R340-D344 VanDerWaalsContact O-N 3.12Å; R340-L345 HydrophobicContact CB-CB 4.4Å; R340-L345 HydrophobicContact CG-CB 3.83Å; R340-L345 WeakPolarHBondContact CG-O 3.28Å; R340-L345 PolarHBondContact NE-O 3.36Å; R340-L345 PolarHBondContact O-N 2.87Å; R340-E347 IonicContact CZ-OE1 3.45Å; R340-E347 IonicContact NH1-OE1 2.58Å; R340-E347 PolarHBondContact NH1-OE1 3.11Å; R340-E347 IonicContact NH2-OE1 3.82Å; R340-F350 HydrophobicContact CG-CE2 4.31Å
341N93.3Very high95.5Very high152 Ų15282.2 Ų82.281%0.81340%0.395SS*.G310 helixtrans-66.3-30.6-177.7-64.3-21.6000112.8H339 W343H339-N341 VanDerWaalsContact C-N 3.33Å; H339-N341 PolarHBondContact O-N 2.76Å; N341-W343 VanDerWaalsContact C-N 3.28Å
342K93.6Very high95.6Very high155 Ų15579.2 Ų79.267%0.67438%0.381SS*.G310 helixtrans-71-28.4178.5-177.9-178.4174.9-1770111.6H339 R340H339-K342 WeakPolarHBondContact O-CA 3.5Å; H339-K342 WeakPolarHBondContact O-CB 3.23Å; H339-K342 PolarHBondContact O-N 2.72Å; R340-K342 VanDerWaalsContact C-N 3.28Å; R340-K342 PolarHBondContact O-N 2.88Å
343W91.4Very high95.7Very high51 Ų5178.5 Ų78.519%0.19338%0.375CS..G310 helixtrans-11212.5-173-64-32.8000114.1L309 Y335 Y336 H339 R340 N341 L345L309-W343 HydrophobicContact CD1-CB 3.53Å; L309-W343 HydrophobicContact CD1-CD2 3.21Å; L309-W343 HydrophobicContact CD1-CE3 3.61Å; L309-W343 HydrophobicContact CD1-CG 3.17Å; L309-W343 HydrophobicContact CD1-CZ3 4.44Å; Y335-W343 AromaticContact CD1-CH2 3.98Å; Y335-W343 HydrophobicContact CD1-CH2 3.98Å; Y335-W343 HydrophobicContact CD1-CZ3 4.18Å; Y335-W343 AromaticContact CE1-CH2 3.27Å; Y335-W343 HydrophobicContact CE1-CH2 3.27Å; Y335-W343 HydrophobicContact CE1-CZ2 4.27Å; Y335-W343 AromaticContact CE1-CZ3 3.9Å; Y335-W343 HydrophobicContact CE1-CZ3 3.9Å; Y335-W343 HydrophobicContact CE2-CH2 4.33Å; Y335-W343 AromaticContact CZ-CH2 3.47Å; Y335-W343 VanDerWaalsContact CZ-CH2 3.47Å; Y335-W343 WeakPolarHBondContact OH-CH2 3.46Å; Y336-W343 HydrophobicContact CD1-CE3 4.1Å; Y336-W343 AromaticContact CD1-CZ3 3.6Å; Y336-W343 HydrophobicContact CD1-CZ3 3.6Å; Y336-W343 HydrophobicContact CE1-CZ3 4.23Å; H339-W343 HydrophobicContact CB-CD2 3.92Å; H339-W343 HydrophobicContact CB-CE3 3.55Å; H339-W343 HydrophobicContact CB-CH2 3.52Å; H339-W343 HydrophobicContact CB-CZ2 3.98Å; H339-W343 HydrophobicContact CB-CZ3 3.35Å; H339-W343 AromaticContact CD2-CH2 3.71Å; H339-W343 AromaticContact CG-CH2 3.82Å; H339-W343 PolarHBondContact O-N 3.36Å; R340-W343 CarbonylContact O-C 3.59Å; R340-W343 PolarHBondContact O-N 2.85Å; N341-W343 VanDerWaalsContact C-N 3.28Å; W343-L345 HydrophobicContact CB-CD1 4.06Å; W343-L345 HydrophobicContact CB-CG 3.97Å; W343-L345 HydrophobicContact CE3-CD1 4.1Å; W343-L345 PolarHBondContact O-N 3.46Å
344D93.8Very high95.7Very high128 Ų12881.6 Ų81.668%0.68440%0.402SS*.THydrogen-bonded Turntrans53.537179.4-164.236.4000112.9K310 R340K310-D344 VanDerWaalsContact CE-O 3.23Å; K310-D344 WeakPolarHBondContact CE-O 3.42Å; K310-D344 PolarHBondContact NZ-O 3.42Å; R340-D344 PolarHBondContact O-N 3.46Å; R340-D344 VanDerWaalsContact O-N 3.12Å
345L96.4Very high95.7Very high7 Ų782.3 Ų82.34%0.03740%0.396CS..  trans-84.3140.1178.8-64.9169.9000110.4L309 K310 V313 R340 W343 D349 F350L309-L345 HydrophobicContact CB-CD2 4.17Å; K310-L345 HydrophobicContact CD-CD2 4.36Å; V313-L345 HydrophobicContact CG2-CD1 3.83Å; V313-L345 HydrophobicContact CG2-CD2 4.06Å; R340-L345 HydrophobicContact CB-CB 4.4Å; R340-L345 HydrophobicContact CG-CB 3.83Å; R340-L345 WeakPolarHBondContact CG-O 3.28Å; R340-L345 PolarHBondContact NE-O 3.36Å; R340-L345 PolarHBondContact O-N 2.87Å; W343-L345 HydrophobicContact CB-CD1 4.06Å; W343-L345 HydrophobicContact CB-CG 3.97Å; W343-L345 HydrophobicContact CE3-CD1 4.1Å; W343-L345 PolarHBondContact O-N 3.46Å; L345-D349 VanDerWaalsContact CA-OD2 3.27Å; L345-D349 WeakPolarHBondContact CA-OD2 3.48Å; L345-D349 HydrophobicContact CD2-CB 4.13Å; L345-F350 HydrophobicContact CB-CE2 4.09Å; L345-F350 HydrophobicContact CB-CZ 4.46Å; L345-F350 HydrophobicContact CD1-CZ 4.12Å
346T95.5Very high95.9Very high53 Ų5377.7 Ų77.733%0.32538%0.378SS..  trans-104.8170.9176.366.30000110.3E348 D349 F350T346-E348 PolarHBondContact O-N 3.24Å; T346-E348 PolarHBondContact OG1-N 3.49Å; T346-D349 PolarHBondContact N-OD2 2.97Å; T346-D349 PolarHBondContact O-N 3.09Å; T346-D349 PolarHBondContact OG1-OD2 3.33Å; T346-F350 WeakPolarHBondContact O-CD2 3.26Å
347E94.4Very high95.9Very high124 Ų12479.9 Ų79.958%0.57939%0.392SS*.SBendtrans-61.1-31.5172.7-69.2-61.5155.900112R340 D349 F350R340-E347 IonicContact CZ-OE1 3.45Å; R340-E347 IonicContact NH1-OE1 2.58Å; R340-E347 PolarHBondContact NH1-OE1 3.11Å; R340-E347 IonicContact NH2-OE1 3.82Å; E347-D349 VanDerWaalsContact C-N 3.27Å; E347-D349 PolarHBondContact O-N 3.22Å; E347-F350 PolarHBondContact O-N 2.74Å; E347-F350 VanDerWaalsContact O-N 3.11Å
348E94.9Very high96Very high153 Ų15379.2 Ų79.272%0.71539%0.386SS*.G310 helixtrans-64.6-31.8179.5-62.3179.717400112.1T346 F350 L351T346-E348 PolarHBondContact O-N 3.24Å; T346-E348 PolarHBondContact OG1-N 3.49Å; E348-F350 PolarHBondContact O-N 3.23Å; E348-L351 WeakPolarHBondContact O-CB 3.31Å; E348-L351 PolarHBondContact O-N 3Å; E348-L351 VanDerWaalsContact O-N 3.16Å
349D96.4Very high96.1Very high21 Ų2170.1 Ų70.111%0.11235%0.35CS..G310 helixtrans-66.7-19.2176.8-61.2-44.5000112.4K310 V313 P314 L345 T346 E347 L351K310-D349 VanDerWaalsContact CD-OD1 3.3Å; K310-D349 WeakPolarHBondContact CD-OD1 3.17Å; K310-D349 WeakPolarHBondContact CD-OD2 3.44Å; K310-D349 IonicContact NZ-OD1 3.96Å; K310-D349 IonicContact NZ-OD2 3.35Å; K310-D349 PolarHBondContact NZ-OD2 2.99Å; V313-D349 VanDerWaalsContact CG1-O 3.22Å; V313-D349 WeakPolarHBondContact CG1-O 3.44Å; P314-D349 VanDerWaalsContact CD-O 3.28Å; P314-D349 WeakPolarHBondContact CD-O 3.39Å; P314-D349 WeakPolarHBondContact CG-O 3.48Å; L345-D349 VanDerWaalsContact CA-OD2 3.27Å; L345-D349 WeakPolarHBondContact CA-OD2 3.48Å; L345-D349 HydrophobicContact CD2-CB 4.13Å; T346-D349 PolarHBondContact N-OD2 2.97Å; T346-D349 PolarHBondContact O-N 3.09Å; T346-D349 PolarHBondContact OG1-OD2 3.33Å; E347-D349 VanDerWaalsContact C-N 3.27Å; E347-D349 PolarHBondContact O-N 3.22Å; D349-L351 VanDerWaalsContact C-N 3.33Å
350F97.4Very high96.2Very high22 Ų2271.8 Ų71.810%0.09636%0.355CS..G310 helixtrans-94.112.6177.5-65.6-85.1000113.2V313 T317 V333 K337 R340 L345 T346 E347 E348V313-F350 HydrophobicContact CG1-CD1 3.37Å; V313-F350 HydrophobicContact CG1-CD2 4.45Å; V313-F350 HydrophobicContact CG1-CE1 3.41Å; V313-F350 VanDerWaalsContact CG1-CE1 3.41Å; V313-F350 HydrophobicContact CG1-CE2 4.47Å; V313-F350 HydrophobicContact CG1-CG 3.93Å; V313-F350 HydrophobicContact CG1-CZ 3.98Å; T317-F350 HydrophobicContact CG2-CB 4.47Å; T317-F350 WeakPolarHBondContact CG2-O 3.35Å; V333-F350 HydrophobicContact CG1-CD1 4.4Å; K337-F350 HydrophobicContact CB-CE1 4.19Å; K337-F350 HydrophobicContact CB-CZ 4.33Å; K337-F350 HydrophobicContact CD-CD1 4.41Å; K337-F350 HydrophobicContact CD-CE1 4.43Å; K337-F350 HydrophobicContact CG-CD1 3.67Å; K337-F350 HydrophobicContact CG-CE1 3.28Å; K337-F350 HydrophobicContact CG-CE2 4.46Å; K337-F350 HydrophobicContact CG-CG 4.4Å; K337-F350 HydrophobicContact CG-CZ 3.75Å; R340-F350 HydrophobicContact CG-CE2 4.31Å; L345-F350 HydrophobicContact CB-CE2 4.09Å; L345-F350 HydrophobicContact CB-CZ 4.46Å; L345-F350 HydrophobicContact CD1-CZ 4.12Å; T346-F350 WeakPolarHBondContact O-CD2 3.26Å; E347-F350 PolarHBondContact O-N 2.74Å; E347-F350 VanDerWaalsContact O-N 3.11Å; E348-F350 PolarHBondContact O-N 3.23Å
351L97.3Very high96.4Very high108 Ų10872 Ų7257%0.56536%0.362SS*.SBendtrans-89.3136170.7-60.7177000109.7T317 E348 D349T317-L351 PolarHBondContact OG1-O 3.49Å; E348-L351 WeakPolarHBondContact O-CB 3.31Å; E348-L351 PolarHBondContact O-N 3Å; E348-L351 VanDerWaalsContact O-N 3.16Å; D349-L351 VanDerWaalsContact C-N 3.33Å
352P97.9Very high96.5Very high41 Ų4167.7 Ų67.727%0.26634%0.337SS..PPolyproline II helixtrans-55.2147.6167.8-2333.5000111.1L321 V357L321-P352 HydrophobicContact CD2-CB 4.23Å; P352-V357 HydrophobicContact CB-CG2 3.76Å; P352-V357 HydrophobicContact CG-CG2 4.47Å
353R98.3Very high96.6Very high32 Ų3261.4 Ų61.412%0.12131%0.312CS..PPolyproline II helixtrans-60.6145.1177.6-62.2-165.9-176.6179.2-6.6111.2E227 Y296 P314 C315 S318 E355 A356 V357E227-R353 IonicContact OE1-CZ 3.39Å; E227-R353 IonicContact OE1-NH1 3.63Å; E227-R353 PolarHBondContact OE1-NH1 3.39Å; E227-R353 IonicContact OE1-NH2 3.59Å; E227-R353 PolarHBondContact OE1-NH2 2.87Å; E227-R353 IonicContact OE2-CZ 3.54Å; E227-R353 IonicContact OE2-NH1 2.69Å; E227-R353 PolarHBondContact OE2-NH1 3.45Å; Y296-R353 HydrophobicContact CE1-CG 4.48Å; P314-R353 HydrophobicContact CB-CG 3.92Å; C315-R353 PolarHBondContact SG-NH2 2.94Å; S318-R353 PolarHBondContact OG-N 2.97Å; R353-E355 VanDerWaalsContact C-N 3.28Å; R353-E355 WeakPolarHBondContact CB-OE1 3.14Å; R353-E355 WeakPolarHBondContact CD-OE1 3.29Å; R353-E355 IonicContact NH1-OE1 3.38Å; R353-E355 PolarHBondContact O-N 3.4Å; R353-A356 VanDerWaalsContact O-CB 3.3Å; R353-A356 WeakPolarHBondContact O-CB 3.24Å; R353-A356 PolarHBondContact O-N 3.28Å; R353-V357 PolarHBondContact O-N 3.42Å
354A98.1Very high96.8Very high79 Ų7960.8 Ų60.865%0.65331%0.313SS*.Hα-helixtrans-58.9-38.6-173.600000112.9V357 R358A354-V357 PolarHBondContact O-N 2.68Å; A354-R358 WeakPolarHBondContact O-CB 3.42Å; A354-R358 PolarHBondContact O-N 3.15Å
355E97.8Very high97Very high66 Ų6659.9 Ų59.931%0.30831%0.308SS..Hα-helixtrans-66.6-34.7176.466.9-80.8-168.900112.8F234 R353 Y359F234-E355 HydrophobicContact CD2-CB 4.12Å; F234-E355 HydrophobicContact CD2-CG 4.02Å; F234-E355 HydrophobicContact CE2-CB 3.93Å; F234-E355 HydrophobicContact CE2-CG 3.51Å; F234-E355 HydrophobicContact CZ-CG 4.43Å; R353-E355 VanDerWaalsContact C-N 3.28Å; R353-E355 WeakPolarHBondContact CB-OE1 3.14Å; R353-E355 WeakPolarHBondContact CD-OE1 3.29Å; R353-E355 IonicContact NH1-OE1 3.38Å; R353-E355 PolarHBondContact O-N 3.4Å; E355-Y359 WeakPolarHBondContact O-CB 3.31Å; E355-Y359 PolarHBondContact O-N 3.45Å
356A98.2Very high96.9Very high0 Ų060.5 Ų60.50%031%0.311CS..Hα-helixtrans-65.1-48173.300000110.9Y296 L321 F322 R353 R358 Y359 Y360Y296-A356 HydrophobicContact CE2-CB 3.87Å; Y296-A356 WeakPolarHBondContact OH-CB 3.43Å; L321-A356 HydrophobicContact CD2-CB 4.38Å; F322-A356 HydrophobicContact CE2-CB 3.98Å; F322-A356 HydrophobicContact CZ-CB 4.11Å; R353-A356 VanDerWaalsContact O-CB 3.3Å; R353-A356 WeakPolarHBondContact O-CB 3.24Å; R353-A356 PolarHBondContact O-N 3.28Å; A356-R358 PolarHBondContact O-N 2.89Å; A356-Y359 PolarHBondContact O-N 2.93Å; A356-Y360 WeakPolarHBondContact O-CB 3.42Å; A356-Y360 PolarHBondContact O-N 2.87Å
357V98.4Very high96.9Very high49 Ų4962.5 Ų62.530%0.29732%0.319SS..Hα-helixtrans-61.4-45.4179.3178.10000110.9L321 P352 R353 A354 Y359 N361L321-V357 HydrophobicContact CD2-CG2 4.19Å; P352-V357 HydrophobicContact CB-CG2 3.76Å; P352-V357 HydrophobicContact CG-CG2 4.47Å; R353-V357 PolarHBondContact O-N 3.42Å; A354-V357 PolarHBondContact O-N 2.68Å; V357-Y359 PolarHBondContact O-N 3.04Å; V357-N361 WeakPolarHBondContact CG1-ND2 3.46Å; V357-N361 VanDerWaalsContact O-CB 3.31Å; V357-N361 WeakPolarHBondContact O-CB 3.44Å; V357-N361 PolarHBondContact O-N 3.41Å; V357-N361 PolarHBondContact O-ND2 2.93Å
358R97.6Very high97Very high111 Ų11161.8 Ų61.842%0.41932%0.315SS..Hα-helixtrans-57.5-50.9176.4-175.5-172.273.7126.8-1.7110.7D238 A354 A356 Q362D238-R358 IonicContact OD1-CZ 2.69Å; D238-R358 IonicContact OD1-NH1 3.41Å; D238-R358 PolarHBondContact OD1-NH1 2.88Å; D238-R358 IonicContact OD1-NH2 2.66Å; D238-R358 IonicContact OD2-CZ 3.93Å; D238-R358 IonicContact OD2-NH1 2.69Å; D238-R358 PolarHBondContact OD2-NH1 3.26Å; D238-R358 IonicContact OD2-NH2 3.41Å; D238-R358 PolarHBondContact OD2-NH2 3.27Å; A354-R358 WeakPolarHBondContact O-CB 3.42Å; A354-R358 PolarHBondContact O-N 3.15Å; A356-R358 PolarHBondContact O-N 2.89Å; R358-Q362 VanDerWaalsContact O-CB 3.3Å; R358-Q362 WeakPolarHBondContact O-CB 3.42Å; R358-Q362 PolarHBondContact O-N 2.85Å
359Y97.8Very high97Very high1 Ų158.9 Ų58.90%0.00430%0.303CS..Hα-helixtrans-61.2-51.7-178.9177.8-99.7000111.5F233 F234 Y237 E276 V292 F322 E355 A356 V357 N361 Q362 T363F233-Y359 HydrophobicContact CE1-CE2 4.08Å; F234-Y359 AromaticContact CD1-CD2 3.86Å; F234-Y359 HydrophobicContact CD1-CD2 3.86Å; F234-Y359 HydrophobicContact CD1-CE2 4.46Å; F234-Y359 HydrophobicContact CD1-CG 4.12Å; F234-Y359 HydrophobicContact CE1-CD1 4.08Å; F234-Y359 AromaticContact CE1-CD2 3.75Å; F234-Y359 HydrophobicContact CE1-CD2 3.75Å; F234-Y359 HydrophobicContact CE1-CE2 4.37Å; F234-Y359 AromaticContact CE1-CG 3.56Å; F234-Y359 HydrophobicContact CE1-CG 3.56Å; Y237-Y359 AromaticContact CD1-CD2 3.76Å; Y237-Y359 HydrophobicContact CD1-CD2 3.76Å; Y237-Y359 AromaticContact CD1-CE2 3.62Å; Y237-Y359 HydrophobicContact CD1-CE2 3.62Å; Y237-Y359 AromaticContact CD2-CE2 3.78Å; Y237-Y359 HydrophobicContact CD2-CE2 3.78Å; Y237-Y359 AromaticContact CE1-CD2 3.67Å; Y237-Y359 HydrophobicContact CE1-CD2 3.67Å; Y237-Y359 AromaticContact CE1-CE2 3.53Å; Y237-Y359 HydrophobicContact CE1-CE2 3.53Å; Y237-Y359 AromaticContact CE2-CE2 3.72Å; Y237-Y359 HydrophobicContact CE2-CE2 3.72Å; Y237-Y359 HydrophobicContact CG-CD2 4.29Å; Y237-Y359 AromaticContact CG-CE2 3.74Å; Y237-Y359 HydrophobicContact CG-CE2 3.74Å; Y237-Y359 AromaticContact CZ-CE2 3.61Å; E276-Y359 VanDerWaalsContact CG-OH 3.32Å; E276-Y359 WeakPolarHBondContact CG-OH 3.46Å; E276-Y359 PolarHBondContact OE1-OH 3.04Å; V292-Y359 HydrophobicContact CB-CE1 4.29Å; V292-Y359 HydrophobicContact CG1-CD1 4.43Å; V292-Y359 HydrophobicContact CG1-CE1 4.46Å; V292-Y359 HydrophobicContact CG2-CD1 4.38Å; V292-Y359 HydrophobicContact CG2-CE1 3.69Å; F322-Y359 AromaticContact CE1-CD1 3.6Å; F322-Y359 HydrophobicContact CE1-CD1 3.6Å; F322-Y359 HydrophobicContact CE1-CE1 4.02Å; F322-Y359 AromaticContact CZ-CD1 3.8Å; F322-Y359 HydrophobicContact CZ-CD1 3.8Å; F322-Y359 HydrophobicContact CZ-CE1 4.48Å; E355-Y359 WeakPolarHBondContact O-CB 3.31Å; E355-Y359 PolarHBondContact O-N 3.45Å; A356-Y359 PolarHBondContact O-N 2.93Å; V357-Y359 PolarHBondContact O-N 3.04Å; Y359-N361 PolarHBondContact O-N 3.19Å; Y359-Q362 PolarHBondContact O-N 2.93Å; Y359-T363 HydrophobicContact CD1-CG2 4.41Å; Y359-T363 HydrophobicContact CD2-CG2 4.26Å; Y359-T363 HydrophobicContact CE1-CG2 4Å; Y359-T363 HydrophobicContact CE2-CG2 3.87Å; Y359-T363 PolarHBondContact O-N 3.24Å; Y359-T363 PolarHBondContact O-OG1 3.4Å; Y359-T363 VanDerWaalsContact O-OG1 3.08Å
360Y97.8Very high96.9Very high81 Ų8158.4 Ų58.432%0.31830%0.3SS..Hα-helixtrans-56.5-47.7178.2178.1-95.1000112.7L321 F322 A356 Q362 T363 T364L321-Y360 HydrophobicContact CD1-CD1 3.78Å; L321-Y360 HydrophobicContact CD1-CD2 4.3Å; L321-Y360 HydrophobicContact CD1-CE1 3.97Å; L321-Y360 HydrophobicContact CD1-CE2 4.46Å; L321-Y360 HydrophobicContact CD1-CG 3.96Å; L321-Y360 HydrophobicContact CD2-CD1 4.35Å; L321-Y360 HydrophobicContact CD2-CG 3.95Å; L321-Y360 HydrophobicContact CG-CD1 4.09Å; L321-Y360 HydrophobicContact CG-CD2 3.92Å; L321-Y360 HydrophobicContact CG-CE2 4.42Å; L321-Y360 HydrophobicContact CG-CG 3.73Å; L321-Y360 VanDerWaalsContact O-CE2 3.22Å; L321-Y360 WeakPolarHBondContact O-CE2 3.34Å; F322-Y360 AromaticContact CD1-CD2 3.94Å; F322-Y360 HydrophobicContact CD1-CD2 3.94Å; F322-Y360 HydrophobicContact CE1-CD2 4.02Å; F322-Y360 HydrophobicContact CE1-CG 4.4Å; A356-Y360 WeakPolarHBondContact O-CB 3.42Å; A356-Y360 PolarHBondContact O-N 2.87Å; Y360-Q362 VanDerWaalsContact C-N 3.33Å; Y360-Q362 PolarHBondContact O-N 3.38Å; Y360-T363 PolarHBondContact O-OG1 3.37Å; Y360-T363 VanDerWaalsContact O-OG1 3.07Å; Y360-T364 WeakPolarHBondContact O-CB 3.43Å; Y360-T364 PolarHBondContact O-N 2.94Å; Y360-T364 PolarHBondContact O-OG1 2.9Å
361N97.6Very high96.7Very high79 Ų7962.1 Ų62.142%0.42232%0.318SS..Hα-helixtrans-63.6-42.1179.3-72.4-16.4000111V357 Y359 L365V357-N361 WeakPolarHBondContact CG1-ND2 3.46Å; V357-N361 VanDerWaalsContact O-CB 3.31Å; V357-N361 WeakPolarHBondContact O-CB 3.44Å; V357-N361 PolarHBondContact O-N 3.41Å; V357-N361 PolarHBondContact O-ND2 2.93Å; Y359-N361 PolarHBondContact O-N 3.19Å; N361-L365 VanDerWaalsContact O-CB 3.26Å; N361-L365 WeakPolarHBondContact O-CB 3.4Å; N361-L365 WeakPolarHBondContact O-CD1 3.3Å; N361-L365 WeakPolarHBondContact O-CG 3.47Å; N361-L365 PolarHBondContact O-N 3.14Å
362Q95.8Very high96.4Very high61 Ų6162.2 Ų62.229%0.28531%0.314SS..Hα-helixtrans-66.8-46.5-179-175.4169.69.600112.3L241 R358 Y359 Y360 Q366L241-Q362 HydrophobicContact CD1-CG 4.47Å; R358-Q362 VanDerWaalsContact O-CB 3.3Å; R358-Q362 WeakPolarHBondContact O-CB 3.42Å; R358-Q362 PolarHBondContact O-N 2.85Å; Y359-Q362 PolarHBondContact O-N 2.93Å; Y360-Q362 VanDerWaalsContact C-N 3.33Å; Y360-Q362 PolarHBondContact O-N 3.38Å; Q362-Q366 WeakPolarHBondContact O-CB 3.43Å; Q362-Q366 WeakPolarHBondContact O-CG 3.19Å; Q362-Q366 PolarHBondContact O-N 3.36Å
363T95.7Very high96.1Very high23 Ų2360.4 Ų60.414%0.14130%0.303CS..Hα-helixtrans-64.3-44.6177.751.40000111.2Y237 Y359 Y360 Q366 L367Y237-T363 HydrophobicContact CE2-CG2 4.5Å; Y237-T363 WeakPolarHBondContact OH-CG2 3.5Å; Y359-T363 HydrophobicContact CD1-CG2 4.41Å; Y359-T363 HydrophobicContact CD2-CG2 4.26Å; Y359-T363 HydrophobicContact CE1-CG2 4Å; Y359-T363 HydrophobicContact CE2-CG2 3.87Å; Y359-T363 PolarHBondContact O-N 3.24Å; Y359-T363 PolarHBondContact O-OG1 3.4Å; Y359-T363 VanDerWaalsContact O-OG1 3.08Å; Y360-T363 PolarHBondContact O-OG1 3.37Å; Y360-T363 VanDerWaalsContact O-OG1 3.07Å; T363-Q366 PolarHBondContact O-N 2.98Å; T363-L367 WeakPolarHBondContact O-CB 3.43Å; T363-L367 PolarHBondContact O-N 3.46Å
364T96.1Very high95.6Very high38 Ų3863.8 Ų63.823%0.23332%0.318CS..Hα-helixtrans-61-49.3178.7-59.30000111.5Y360 Q366 L367 Q368Y360-T364 WeakPolarHBondContact O-CB 3.43Å; Y360-T364 PolarHBondContact O-N 2.94Å; Y360-T364 PolarHBondContact O-OG1 2.9Å; T364-Q366 PolarHBondContact O-N 2.86Å; T364-L367 PolarHBondContact O-N 2.94Å; T364-Q368 HydrophobicContact CG2-CG 4.48Å; T364-Q368 VanDerWaalsContact O-CG 3.3Å; T364-Q368 WeakPolarHBondContact O-CG 3.21Å; T364-Q368 PolarHBondContact O-N 2.68Å
365L96.8Very high95.2Very high109 Ų10965.7 Ų65.757%0.57131%0.314SS*.Hα-helixtrans-66.8-35.8-179.6-70.8170.2000112.3N361 M369N361-L365 VanDerWaalsContact O-CB 3.26Å; N361-L365 WeakPolarHBondContact O-CB 3.4Å; N361-L365 WeakPolarHBondContact O-CD1 3.3Å; N361-L365 WeakPolarHBondContact O-CG 3.47Å; N361-L365 PolarHBondContact O-N 3.14Å; L365-M369 WeakPolarHBondContact O-CB 3.35Å; L365-M369 PolarHBondContact O-N 3.35Å
366Q95.7Very high94.6Very high20 Ų2071.4 Ų71.49%0.09333%0.333CS..Hα-helixtrans-63.8-44174.2-76.8172.5-100111.7Y237 V273 Q362 T363 T364 M369 L370Y237-Q366 PolarHBondContact OH-OE1 3.38Å; V273-Q366 HydrophobicContact CG2-CB 4.1Å; Q362-Q366 WeakPolarHBondContact O-CB 3.43Å; Q362-Q366 WeakPolarHBondContact O-CG 3.19Å; Q362-Q366 PolarHBondContact O-N 3.36Å; T363-Q366 PolarHBondContact O-N 2.98Å; T364-Q366 PolarHBondContact O-N 2.86Å; Q366-M369 PolarHBondContact O-N 2.96Å; Q366-L370 WeakPolarHBondContact O-CB 2.99Å; Q366-L370 PolarHBondContact O-N 3.1Å
367L95.7Very high93.8Very high94 Ų9474.5 Ų74.549%0.49235%0.349SS..Hα-helixtrans-65.1-46.3178.2-176.862.5000111.6V273 T363 T364 M369 L370 E371V273-L367 HydrophobicContact CG1-CD1 4.01Å; T363-L367 WeakPolarHBondContact O-CB 3.43Å; T363-L367 PolarHBondContact O-N 3.46Å; T364-L367 PolarHBondContact O-N 2.94Å; L367-M369 VanDerWaalsContact C-N 3.3Å; L367-M369 PolarHBondContact O-N 3.45Å; L367-L370 PolarHBondContact O-N 3.36Å; L367-E371 WeakPolarHBondContact O-CB 3.3Å; L367-E371 PolarHBondContact O-N 3.06Å
368Q95.6Very high92.4Very high109 Ų10976.6 Ų76.651%0.50936%0.356SS..Hα-helixtrans-58.1-42.4176.1-73.7174.3-6.500112T364 E371 F372T364-Q368 HydrophobicContact CG2-CG 4.48Å; T364-Q368 VanDerWaalsContact O-CG 3.3Å; T364-Q368 WeakPolarHBondContact O-CG 3.21Å; T364-Q368 PolarHBondContact O-N 2.68Å; Q368-E371 PolarHBondContact O-N 3.41Å; Q368-F372 WeakPolarHBondContact O-CB 3.38Å; Q368-F372 PolarHBondContact O-N 3.23Å
369M94.3Very high90.6Very high92 Ų9276.1 Ų76.145%0.45337%0.37SS..Hα-helixtrans-66.8-39.2177.7-168.467.467.300112Y265 L269 L365 Q366 L367 A373Y265-M369 HydrophobicContact CE1-CG 4Å; L269-M369 HydrophobicContact CD1-CB 4Å; L269-M369 HydrophobicContact CD1-CG 3.52Å; L365-M369 WeakPolarHBondContact O-CB 3.35Å; L365-M369 PolarHBondContact O-N 3.35Å; Q366-M369 PolarHBondContact O-N 2.96Å; L367-M369 VanDerWaalsContact C-N 3.3Å; L367-M369 PolarHBondContact O-N 3.45Å; M369-A373 PolarHBondContact O-N 3.22Å
370L94.2Very high88.4Confident11 Ų1183 Ų836%0.05841%0.407CS..Hα-helixtrans-66.1-43.7176.3178.959.4000111.5T266 L269 E270 V273 Q366 L367 F372 A373 K374T266-L370 HydrophobicContact CG2-CD1 3.94Å; L269-L370 HydrophobicContact CB-CB 4.35Å; L269-L370 HydrophobicContact CB-CD1 4.14Å; E270-L370 HydrophobicContact CG-CD1 3.49Å; E270-L370 VanDerWaalsContact CG-CD1 3.49Å; E270-L370 HydrophobicContact CG-CD2 4.12Å; E270-L370 HydrophobicContact CG-CG 4.45Å; V273-L370 HydrophobicContact CB-CD2 4.04Å; V273-L370 HydrophobicContact CG1-CD2 4.29Å; V273-L370 HydrophobicContact CG2-CB 4.35Å; V273-L370 HydrophobicContact CG2-CD2 3.84Å; Q366-L370 WeakPolarHBondContact O-CB 2.99Å; Q366-L370 PolarHBondContact O-N 3.1Å; L367-L370 PolarHBondContact O-N 3.36Å; L370-F372 VanDerWaalsContact C-N 3.34Å; L370-A373 PolarHBondContact O-N 2.9Å; L370-K374 HydrophobicContact CD1-CD 4.48Å; L370-K374 HydrophobicContact CD1-CG 4.38Å; L370-K374 HydrophobicContact CG-CD 4.37Å; L370-K374 WeakPolarHBondContact O-CG 3.42Å; L370-K374 PolarHBondContact O-N 3.18Å
371E93.4Very high86.2Confident100 Ų10087 Ų8747%0.46743%0.433SS..Hα-helixtrans-61.8-43.6176.9-176.2174.8-174.500111.3L367 Q368 A373 K374 Q375L367-E371 WeakPolarHBondContact O-CB 3.3Å; L367-E371 PolarHBondContact O-N 3.06Å; Q368-E371 PolarHBondContact O-N 3.41Å; E371-A373 VanDerWaalsContact C-N 3.33Å; E371-A373 PolarHBondContact O-N 3Å; E371-K374 PolarHBondContact O-N 3.34Å; E371-Q375 HydrophobicContact CG-CG 4.36Å; E371-Q375 VanDerWaalsContact CG-NE2 3.29Å; E371-Q375 WeakPolarHBondContact O-CB 3.5Å; E371-Q375 WeakPolarHBondContact O-CG 3.3Å; E371-Q375 PolarHBondContact O-N 3.36Å; E371-Q375 PolarHBondContact OE1-NE2 2.97Å
372F92.3Very high83.6Confident110 Ų11091.3 Ų91.348%0.48245%0.451SS..Hα-helixtrans-55.7-48172.8175.8-90.7000111.8Q368 L370 K374 Q375 R376 L377Q368-F372 WeakPolarHBondContact O-CB 3.38Å; Q368-F372 PolarHBondContact O-N 3.23Å; L370-F372 VanDerWaalsContact C-N 3.34Å; F372-K374 PolarHBondContact O-N 3.16Å; F372-Q375 PolarHBondContact O-N 3.16Å; F372-R376 HydrophobicContact CD2-CG 4.08Å; F372-R376 HydrophobicContact CE2-CB 4.39Å; F372-R376 HydrophobicContact CE2-CG 3.93Å; F372-R376 HydrophobicContact CZ-CB 4.29Å; F372-R376 HydrophobicContact CZ-CG 4.33Å; F372-R376 VanDerWaalsContact O-CB 3.3Å; F372-R376 WeakPolarHBondContact O-CB 3.5Å; F372-R376 WeakPolarHBondContact O-CG 3.44Å; F372-R376 PolarHBondContact O-N 3.35Å; F372-L377 HydrophobicContact CE1-CD1 4.32Å; F372-L377 HydrophobicContact CE1-CG 4.44Å
373A90.4Very high81.3Confident4 Ų492.2 Ų92.23%0.03348%0.477CS..Hα-helixtrans-62.3-43.3178.900000112.2T266 M369 L370 E371 Q375 L377 M378T266-A373 HydrophobicContact CG2-CB 3.93Å; T266-A373 WeakPolarHBondContact OG1-CB 3.49Å; M369-A373 PolarHBondContact O-N 3.22Å; L370-A373 PolarHBondContact O-N 2.9Å; E371-A373 VanDerWaalsContact C-N 3.33Å; E371-A373 PolarHBondContact O-N 3Å; A373-Q375 PolarHBondContact O-N 2.89Å; A373-L377 HydrophobicContact CB-CD1 4.16Å; A373-L377 WeakPolarHBondContact O-CA 3.38Å; A373-L377 VanDerWaalsContact O-CB 3.3Å; A373-L377 WeakPolarHBondContact O-CB 3.23Å; A373-L377 PolarHBondContact O-N 2.93Å; A373-M378 PolarHBondContact O-N 2.97Å; A373-M378 VanDerWaalsContact O-N 3.1Å
374K89.1Confident78.7Confident102 Ų10299.6 Ų99.644%0.44351%0.51SS..Hα-helixtrans-63.5-38.7177.8-72.6-174.1173.2-173.80113E270 L370 E371 F372 M378E270-K374 WeakPolarHBondContact OE1-CE 3.41Å; E270-K374 IonicContact OE1-NZ 3.06Å; L370-K374 HydrophobicContact CD1-CD 4.48Å; L370-K374 HydrophobicContact CD1-CG 4.38Å; L370-K374 HydrophobicContact CG-CD 4.37Å; L370-K374 WeakPolarHBondContact O-CG 3.42Å; L370-K374 PolarHBondContact O-N 3.18Å; E371-K374 PolarHBondContact O-N 3.34Å; F372-K374 PolarHBondContact O-N 3.16Å; K374-M378 HydrophobicContact CB-SD 4.28Å; K374-M378 HydrophobicContact CG-SD 3.78Å
375Q89Confident76.3Confident119 Ų119103.9 Ų103.956%0.55654%0.536SS*.Hα-helixtrans-82.9-26-177.1-71.3174.90.400114.1E371 F372 A373E371-Q375 HydrophobicContact CG-CG 4.36Å; E371-Q375 VanDerWaalsContact CG-NE2 3.29Å; E371-Q375 WeakPolarHBondContact O-CB 3.5Å; E371-Q375 WeakPolarHBondContact O-CG 3.3Å; E371-Q375 PolarHBondContact O-N 3.36Å; E371-Q375 PolarHBondContact OE1-NE2 2.97Å; F372-Q375 PolarHBondContact O-N 3.16Å; A373-Q375 PolarHBondContact O-N 2.89Å
376R85.7Confident74Confident187 Ų187103.9 Ų103.971%0.70654%0.54SS*.Hα-helixtrans-121.2-19.4-167.7-58.7-62.6-169.5136.20.4114.7F372F372-R376 HydrophobicContact CD2-CG 4.08Å; F372-R376 HydrophobicContact CE2-CB 4.39Å; F372-R376 HydrophobicContact CE2-CG 3.93Å; F372-R376 HydrophobicContact CZ-CB 4.29Å; F372-R376 HydrophobicContact CZ-CG 4.33Å; F372-R376 VanDerWaalsContact O-CB 3.3Å; F372-R376 WeakPolarHBondContact O-CB 3.5Å; F372-R376 WeakPolarHBondContact O-CG 3.44Å; F372-R376 PolarHBondContact O-N 3.35Å
377L80.7Confident71.7Confident65 Ų65111.1 Ų111.134%0.3457%0.574SS.*THydrogen-bonded Turntrans-122.7-26.7-169.9-55.9-179.5000113.3A261 V262 F372 A373 S379A261-L377 HydrophobicContact CB-CD1 4Å; V262-L377 HydrophobicContact CG2-CB 3.86Å; F372-L377 HydrophobicContact CE1-CD1 4.32Å; F372-L377 HydrophobicContact CE1-CG 4.44Å; A373-L377 HydrophobicContact CB-CD1 4.16Å; A373-L377 WeakPolarHBondContact O-CA 3.38Å; A373-L377 VanDerWaalsContact O-CB 3.3Å; A373-L377 WeakPolarHBondContact O-CB 3.23Å; A373-L377 PolarHBondContact O-N 2.93Å; L377-S379 PolarHBondContact O-N 3.25Å
378M69.5Low69.6Low93 Ų93114.2 Ų114.246%0.45858%0.584SS.*SBendtrans-71.9120.8170.1-64.9-170.370.300107.8A373 K374 D380A373-M378 PolarHBondContact O-N 2.97Å; A373-M378 VanDerWaalsContact O-N 3.1Å; K374-M378 HydrophobicContact CB-SD 4.28Å; K374-M378 HydrophobicContact CG-SD 3.78Å; M378-D380 PolarHBondContact O-N 2.58Å; M378-D380 VanDerWaalsContact O-N 3.14Å
379S60.6Low67.4Low100 Ų100114.9 Ų114.970%0.69959%0.59SS**PPolyproline II helixtrans-57.6116.4179.146.20000109.6L377 D381L377-S379 PolarHBondContact O-N 3.25Å; S379-D381 PolarHBondContact O-N 3.39Å
380D51.2Low65.4Low146 Ų146116.4 Ų116.478%0.78160%0.599SS**PPolyproline II helixtrans-61119.1153.6-73.8-31.7000106.1M378 E382M378-D380 PolarHBondContact O-N 2.58Å; M378-D380 VanDerWaalsContact O-N 3.14Å; D380-E382 PolarHBondContact O-N 3.03Å
381D50.2Low63.3Low164 Ų164124.5 Ų124.588%0.87764%0.637SS**SBendtrans-66.328.7169.4-97-26.1000111.9S379S379-D381 PolarHBondContact O-N 3.39Å
382E44.3Very low61.4Low170 Ų170128 Ų12879%0.79465%0.651SS**SBendtrans-132.4115170-69.5-153.1173.400110.7D380 E384D380-E382 PolarHBondContact O-N 3.03Å; E382-E384 PolarHBondContact O-N 3.07Å
383G47Very low59.6Low81 Ų81128.8 Ų128.884%0.83566%0.659SS**  trans-64.297-178.100000113V385G383-V385 PolarHBondContact O-N 3.38Å
384E41.1Very low57.9Low178 Ų178135.6 Ų135.683%0.83270%0.696SS**  trans-81.494.5144.9-80.2-168.1165.800107.8E382 V386E382-E384 PolarHBondContact O-N 3.07Å; E384-V386 VanDerWaalsContact C-N 3.28Å; E384-V386 PolarHBondContact O-N 2.91Å
385V45.2Very low56.2Low128 Ų128139.2 Ų139.278%0.77671%0.714SS**  trans-58.9101.4159.21790000105.6G383 E387G383-V385 PolarHBondContact O-N 3.38Å; V385-E387 VanDerWaalsContact C-N 3.28Å; V385-E387 PolarHBondContact O-N 2.92Å
386V48.9Very low54.3Low108 Ų108141.2 Ų141.266%0.65573%0.729SS**  trans-69.396.4170-169.60000106E384 F388E384-V386 VanDerWaalsContact C-N 3.28Å; E384-V386 PolarHBondContact O-N 2.91Å; V386-F388 HydrophobicContact CG1-CB 3.94Å; V386-F388 HydrophobicContact CG1-CD2 3.7Å; V386-F388 HydrophobicContact CG1-CG 4.21Å; V386-F388 PolarHBondContact O-N 2.79Å
387E47.9Very low52.2Low172 Ų172145.1 Ų145.180%0.80476%0.755SS**  trans-61.778.5167.2-74-178.2169.500108.4V385V385-E387 VanDerWaalsContact C-N 3.28Å; V385-E387 PolarHBondContact O-N 2.92Å
388F51.8Low50.8Low160 Ų160149.1 Ų149.170%0.70278%0.775SS**  trans-121.11.8178.7-123.5-89.4000114V386V386-F388 HydrophobicContact CG1-CB 3.94Å; V386-F388 HydrophobicContact CG1-CD2 3.7Å; V386-F388 HydrophobicContact CG1-CG 4.21Å; V386-F388 PolarHBondContact O-N 2.79Å
389I49.7Very low49.8Very low123 Ų123152.1 Ų152.163%0.63179%0.792SS**SBendtrans-120.5-19.7-173.2-58.7-178.3000113.3E391 F392 L393I389-E391 VanDerWaalsContact C-N 3.32Å; I389-E391 PolarHBondContact O-N 3.39Å; I389-F392 PolarHBondContact O-N 3.48Å; I389-L393 HydrophobicContact CG2-CD1 4.33Å
390D50.6Low49.2Very low123 Ų123154.9 Ų154.966%0.65880%0.797SS**G310 helixtrans-76.1-18.5-179.1-70.4-11.8000113.2F392D390-F392 VanDerWaalsContact C-N 3.3Å; D390-F392 PolarHBondContact O-N 3.4Å
391E51.4Low49.1Very low181 Ų181155.5 Ų155.585%0.84680%0.798SS**G310 helixtrans-77-9.9177.3-108.9-177.5177.200114.5I389I389-E391 VanDerWaalsContact C-N 3.32Å; I389-E391 PolarHBondContact O-N 3.39Å
392F53.8Low49Very low173 Ų173154.9 Ų154.976%0.75979%0.793SS**G310 helixtrans-109.22.3-179.3-82.1-77.3000114.5I389 D390I389-F392 PolarHBondContact O-N 3.48Å; D390-F392 VanDerWaalsContact C-N 3.3Å; D390-F392 PolarHBondContact O-N 3.4Å
393L53.9Low49.3Very low127 Ų127153.9 Ų153.967%0.66579%0.793SS**SBendtrans-105-2.5-177.6-68.8175.2000114.4I389I389-L393 HydrophobicContact CG2-CD1 4.33Å
394D54.3Low49.5Very low148 Ų148159.1 Ų159.179%0.79179%0.79SS**SBendtrans-108.316.7-176.3-76.9-15.3000114.9
395E52.7Low50.1Low177 Ų177157.7 Ų157.783%0.82779%0.787SS**SBendtrans-96.111.4176.4-80.3-160.5161.800116.1
396D50.9Low50.6Low162 Ų162160.2 Ų160.287%0.86679%0.788SS**  trans-127.177170.4-79-38000112
397Q40.8Very low50.7Low268 Ų268164.9 Ų164.9100%1.25280%0.8SS**  trans-146.40155.3-153.4160.690.100114.1

Retrieved 397 of 397 residues in 210 ms (Link to these results)

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