A0A096NF36_PAPAN Loading...

Potassium two pore domain channel subfamily K member 12

AlphaFold DB (A0A5F8AE23), UniProt , Accession A0A096NF36, Species PAPAN (Papio anubis, Olive baboon), Gene KCNK12, Length 430 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M39.8Very low38.8Very low249 Ų249165.5 Ų165.5100%1.22787%0.874SS**  0105.10-75.3158108.600108.2
2S34.1Very low38.8Very low120 Ų120171.8 Ų171.884%0.83988%0.877SS**  trans-98.3113.7-178.9173.60000108.3
3S36Very low38.6Very low122 Ų122167.3 Ų167.385%0.85387%0.871SS**  trans-93.1112176.146.60000110.1
4R37.3Very low38.4Very low240 Ų240172.5 Ų172.591%0.90687%0.873SS**PPolyproline II helixtrans-71.4132.1174.4-71.4174.9172.3-179.3-2.7110.4
5S38Very low38.2Very low113 Ų113176.8 Ų176.879%0.7988%0.875SS**PPolyproline II helixtrans-100.7145.3161.460.80000110.5
6P43Very low38Very low127 Ų127181.1 Ų181.183%0.82588%0.878SS**PPolyproline II helixtrans-86.4147.4-168.332.9-33.9000113.7
7R39.7Very low38Very low241 Ų241179.8 Ų179.891%0.90988%0.875SS**PPolyproline II helixtrans-69.4145.8174.5-67.7-179-179-169.40.1111.8
8P40.2Very low37.8Very low117 Ų117176.5 Ų176.576%0.7687%0.87SS**PPolyproline II helixtrans-79.8154.1172.732.6-32.5000112.2
9P42.9Very low37.7Very low116 Ų116179.1 Ų179.175%0.75387%0.869SS**PPolyproline II helixtrans-78.2158.9-178.832-34.1000112.8
10P38.1Very low37.6Very low124 Ų124176.4 Ų176.481%0.80587%0.866SS**PPolyproline II helixtrans-73.4140.3-174.129.3-33.1000112.6R12P10-R12 PolarHBondContact O-N 3.41Å
11R37.2Very low37.6Very low251 Ų251173.6 Ų173.695%0.94786%0.864SS**  trans-62.9114.2175.9-74.3179.8172.4-173.6-1.2110.7S13R11-S13 PolarHBondContact O-N 3.39Å
12R38.8Very low37.4Very low242 Ų242167.4 Ų167.491%0.91384%0.844SS**  trans-69.6117.5165.1-82.7-177173.6-177.7-2110P10 R14P10-R12 PolarHBondContact O-N 3.41Å; R12-R14 PolarHBondContact O-N 3.27Å; R12-R14 VanDerWaalsContact O-N 3.14Å
13S36.3Very low37.6Very low113 Ų113166.2 Ų166.279%0.7983%0.834SS**  trans-62.9104.4170.854.20000111R11 R15R11-S13 PolarHBondContact O-N 3.39Å; S13-R15 PolarHBondContact O-N 3.23Å; S13-R15 VanDerWaalsContact O-N 3.17Å
14R36.8Very low37.9Very low240 Ų240165.8 Ų165.891%0.90683%0.83SS**  trans-71.6104.8165-80.3-175.2176.1-171.3-0.8108.5R12 R16R12-R14 PolarHBondContact O-N 3.27Å; R12-R14 VanDerWaalsContact O-N 3.14Å; R14-R16 PolarHBondContact O-N 3.28Å
15R35Very low37.9Very low237 Ų237159.8 Ų159.889%0.89482%0.824SS**  trans-52.6118.2164.1-77.2-177.8173.4-161.9-1.4108.1S13 L17S13-R15 PolarHBondContact O-N 3.23Å; S13-R15 VanDerWaalsContact O-N 3.17Å; R15-L17 PolarHBondContact O-N 3.26Å
16R34.3Very low38.2Very low246 Ų246158.3 Ų158.393%0.92881%0.813SS**  trans-69.6109.5169-71.2-176.4-177.2-1421.9107.3R14R14-R16 PolarHBondContact O-N 3.28Å
17L38Very low38.3Very low159 Ų159156.7 Ų156.783%0.83280%0.803SS**PPolyproline II helixtrans-63.6134.4161.9-79.3151.3000108.1R15 R19R15-L17 PolarHBondContact O-N 3.26Å; L17-R19 PolarHBondContact O-N 3.05Å
18P35.3Very low38.3Very low120 Ų120156.2 Ų156.278%0.77980%0.802SS**PPolyproline II helixtrans-66.3128.2176.526.5-30000109.1
19R35.5Very low38.3Very low225 Ų225160.4 Ų160.485%0.84980%0.802SS**PPolyproline II helixtrans-62.7138.1167-72.3179.5169.7178.7-4.7107.9L17 S21L17-R19 PolarHBondContact O-N 3.05Å; R19-S21 PolarHBondContact O-N 3.4Å; R19-S21 VanDerWaalsContact O-N 3.17Å
20P36.5Very low38.8Very low125 Ų125157.8 Ų157.881%0.81279%0.786SS**PPolyproline II helixtrans-62.3123.8175.226.3-31.2000108.5C22P20-C22 PolarHBondContact O-N 3.41Å; P20-C22 VanDerWaalsContact O-N 3.1Å
21S36Very low39.4Very low118 Ų118157.5 Ų157.583%0.82577%0.774SS**  trans-65.4104.9175.1-40.10000108.1R19 C23R19-S21 PolarHBondContact O-N 3.4Å; R19-S21 VanDerWaalsContact O-N 3.17Å; S21-C23 PolarHBondContact O-N 3.49Å
22C37.3Very low40.1Very low119 Ų119151.6 Ų151.680%0.80476%0.761SS**  trans-60.9127.6165-101.90000108.6P20 C24P20-C22 PolarHBondContact O-N 3.41Å; P20-C22 VanDerWaalsContact O-N 3.1Å; C22-C24 PolarHBondContact O-N 3.34Å
23C38.3Very low41.6Very low95 Ų95145.7 Ų145.764%0.64275%0.747SS**  trans-70.391.1-173.2-156.50000110.9S21 C25S21-C23 PolarHBondContact O-N 3.49Å; C23-C25 PolarHBondContact O-N 3.45Å
24C40.6Very low43.5Very low113 Ų113143.8 Ų143.876%0.76473%0.726SS**THydrogen-bonded Turntrans-74-5.5177.9-75.40000114.4C22C22-C24 PolarHBondContact O-N 3.34Å
25C38.9Very low45.5Very low115 Ų115135.6 Ų135.678%0.77770%0.7SS**THydrogen-bonded Turntrans-80.7-13-179.3-74.10000114.7C23C23-C25 PolarHBondContact O-N 3.45Å
26C42.6Very low47.9Very low81 Ų81128 Ų12855%0.54768%0.68SS.*Hα-helixtrans-78.7-20.7-179.3-69.90000113.9R28 S30C26-R28 PolarHBondContact O-N 2.85Å; C26-S30 VanDerWaalsContact O-CB 3.28Å; C26-S30 WeakPolarHBondContact O-CB 3.5Å; C26-S30 PolarHBondContact O-N 3.01Å; C26-S30 VanDerWaalsContact O-N 3.16Å; C26-S30 PolarHBondContact O-OG 3Å; C26-S30 VanDerWaalsContact O-OG 3.14Å
27C45.8Very low50.3Low94 Ų94117.4 Ų117.464%0.63565%0.648SS**Hα-helixtrans-79.2-21.7-165.7-60.50000115.3S30C27-S30 WeakPolarHBondContact CA-OG 3.44Å; C27-S30 PolarHBondContact O-OG 2.96Å
28R39Very low52.7Low230 Ų230113.2 Ų113.287%0.86862%0.621SS**Hα-helixtrans-93.1-27.3179.4-149.4175.1-165.8-160.22.8113.3C26C26-R28 PolarHBondContact O-N 2.85Å
29R41.2Very low55.2Low206 Ų206114.6 Ų114.678%0.77762%0.615SS**Hα-helixtrans-79.5-23.9170.1-93.5-179.3174.2175.5-2112.8
30S53.9Low57.9Low60 Ų60108.1 Ų108.142%0.4260%0.6SS.*Hα-helixtrans-71.1-31.6179.957.90000114C26 C27 N33 E34C26-S30 VanDerWaalsContact O-CB 3.28Å; C26-S30 WeakPolarHBondContact O-CB 3.5Å; C26-S30 PolarHBondContact O-N 3.01Å; C26-S30 VanDerWaalsContact O-N 3.16Å; C26-S30 PolarHBondContact O-OG 3Å; C26-S30 VanDerWaalsContact O-OG 3.14Å; C27-S30 WeakPolarHBondContact CA-OG 3.44Å; C27-S30 PolarHBondContact O-OG 2.96Å; S30-N33 PolarHBondContact O-N 3.01Å; S30-E34 PolarHBondContact O-N 2.81Å
31H49.2Very low60.4Low119 Ų119104.1 Ų104.155%0.55157%0.571SS**Hα-helixtrans-70.5-41.8-176.1-164.6-70.4000113N33 E34 D35H31-N33 VanDerWaalsContact C-N 3.32Å; H31-N33 PolarHBondContact O-N 3.42Å; H31-E34 PolarHBondContact O-N 3.38Å; H31-D35 IonicContact CE1-OD2 3.65Å; H31-D35 PolarHBondContact CE1-OD2 3.35Å; H31-D35 IonicContact ND1-OD2 2.76Å; H31-D35 PolarHBondContact ND1-OD2 3.05Å; H31-D35 VanDerWaalsContact ND1-OD2 3.16Å; H31-D35 PolarHBondContact O-N 3.33Å
32L53.8Low63.1Low126 Ų126101.4 Ų101.466%0.6655%0.547SS*.Hα-helixtrans-62.6-39.8172.3-89.8123000111.4E34 T36L32-E34 VanDerWaalsContact C-N 3.29Å; L32-E34 PolarHBondContact O-N 3.44Å; L32-T36 WeakPolarHBondContact O-CB 3.32Å; L32-T36 PolarHBondContact O-N 2.58Å; L32-T36 PolarHBondContact O-OG1 2.99Å
33N69.3Low65.8Low118 Ų11898.2 Ų98.263%0.63153%0.529SS*.Hα-helixtrans-66.4-29.4176.5-73.5-9.1000113S30 H31 G37S30-N33 PolarHBondContact O-N 3.01Å; H31-N33 VanDerWaalsContact C-N 3.32Å; H31-N33 PolarHBondContact O-N 3.42Å; N33-G37 WeakPolarHBondContact O-CA 3.45Å; N33-G37 PolarHBondContact O-N 3.48Å
34E76.1Confident68.5Low74 Ų7496.6 Ų96.635%0.34652%0.523SS..Hα-helixtrans-75.9-43179.5-161.1178.4158.700111.8S30 H31 L32 G37 R38S30-E34 PolarHBondContact O-N 2.81Å; H31-E34 PolarHBondContact O-N 3.38Å; L32-E34 VanDerWaalsContact C-N 3.29Å; L32-E34 PolarHBondContact O-N 3.44Å; E34-G37 CarbonylContact O-C 3.59Å; E34-G37 PolarHBondContact O-N 3.5Å; E34-R38 WeakPolarHBondContact O-CG 3.37Å; E34-R38 PolarHBondContact O-N 3.27Å; E34-R38 IonicContact OE1-CZ 3.7Å; E34-R38 IonicContact OE1-NE 3.98Å; E34-R38 IonicContact OE1-NH2 2.77Å; E34-R38 PolarHBondContact OE1-NH2 3.03Å
35D78.6Confident71Confident67 Ų6794.5 Ų94.536%0.35850%0.504SS..Hα-helixtrans-69.8-42.3176.9-68.2-36.2000111.9H31 G37 R38 F39H31-D35 IonicContact CE1-OD2 3.65Å; H31-D35 PolarHBondContact CE1-OD2 3.35Å; H31-D35 IonicContact ND1-OD2 2.76Å; H31-D35 PolarHBondContact ND1-OD2 3.05Å; H31-D35 VanDerWaalsContact ND1-OD2 3.16Å; H31-D35 PolarHBondContact O-N 3.33Å; D35-G37 VanDerWaalsContact C-N 3.28Å; D35-G37 PolarHBondContact O-N 3.38Å; D35-R38 WeakPolarHBondContact O-CB 3.46Å; D35-R38 PolarHBondContact O-N 3.38Å; D35-R38 IonicContact OD1-CZ 3.27Å; D35-R38 IonicContact OD1-NH1 2.65Å; D35-R38 PolarHBondContact OD1-NH1 3.15Å; D35-F39 PolarHBondContact O-N 3.12Å; D35-F39 VanDerWaalsContact O-N 3.08Å
36T85.9Confident73.7Confident79 Ų7993.1 Ų93.149%0.48549%0.488SS..Hα-helixtrans-63-37.2170.1-55.30000111.1L32 F39 V40L32-T36 WeakPolarHBondContact O-CB 3.32Å; L32-T36 PolarHBondContact O-N 2.58Å; L32-T36 PolarHBondContact O-OG1 2.99Å; T36-F39 PolarHBondContact O-N 3.35Å; T36-V40 HydrophobicContact CG2-CG2 4.32Å; T36-V40 VanDerWaalsContact O-CG2 3.31Å; T36-V40 WeakPolarHBondContact O-CG2 3.47Å; T36-V40 PolarHBondContact O-N 3.26Å
37G85Confident76.3Confident23 Ų2390.8 Ų90.824%0.23748%0.477CS..Hα-helixtrans-62.9-41.6174.800000113.3N33 E34 D35 L41N33-G37 WeakPolarHBondContact O-CA 3.45Å; N33-G37 PolarHBondContact O-N 3.48Å; E34-G37 CarbonylContact O-C 3.59Å; E34-G37 PolarHBondContact O-N 3.5Å; D35-G37 VanDerWaalsContact C-N 3.28Å; D35-G37 PolarHBondContact O-N 3.38Å; G37-L41 WeakPolarHBondContact O-CB 3.47Å; G37-L41 PolarHBondContact O-N 2.95Å
38R87Confident78.7Confident70 Ų7092 Ų9226%0.26448%0.477SS..Hα-helixtrans-58.1-49.6172-73.3167.6-168.6161.51111E34 D35 L41 L42 L306 N307 L310E34-R38 WeakPolarHBondContact O-CG 3.37Å; E34-R38 PolarHBondContact O-N 3.27Å; E34-R38 IonicContact OE1-CZ 3.7Å; E34-R38 IonicContact OE1-NE 3.98Å; E34-R38 IonicContact OE1-NH2 2.77Å; E34-R38 PolarHBondContact OE1-NH2 3.03Å; D35-R38 WeakPolarHBondContact O-CB 3.46Å; D35-R38 PolarHBondContact O-N 3.38Å; D35-R38 IonicContact OD1-CZ 3.27Å; D35-R38 IonicContact OD1-NH1 2.65Å; D35-R38 PolarHBondContact OD1-NH1 3.15Å; R38-L41 PolarHBondContact O-N 3.44Å; R38-L42 WeakPolarHBondContact O-CB 3.42Å; R38-L42 PolarHBondContact O-N 3.29Å; R38-L306 HydrophobicContact CB-CD2 3.89Å; R38-L306 HydrophobicContact CG-CD2 4.23Å; R38-N307 PolarHBondContact NE-OD1 2.92Å; R38-L310 HydrophobicContact CB-CD1 4.01Å; R38-L310 HydrophobicContact CG-CD1 3.08Å
39F89.6Confident81.5Confident150 Ų15089.8 Ų89.866%0.65847%0.47SS*.Hα-helixtrans-61.8-49-179-179.6-100.1000112.1D35 T36 L41 L42 A43D35-F39 PolarHBondContact O-N 3.12Å; D35-F39 VanDerWaalsContact O-N 3.08Å; T36-F39 PolarHBondContact O-N 3.35Å; F39-L41 PolarHBondContact O-N 3.25Å; F39-L42 PolarHBondContact O-N 3.06Å; F39-A43 WeakPolarHBondContact O-CB 3.49Å; F39-A43 PolarHBondContact O-N 3.21Å
40V90.7Very high84.2Confident89 Ų8985.2 Ų85.254%0.53946%0.46SS..Hα-helixtrans-64.2-42.2178.9172.80000111.5T36 A43 A44T36-V40 HydrophobicContact CG2-CG2 4.32Å; T36-V40 VanDerWaalsContact O-CG2 3.31Å; T36-V40 WeakPolarHBondContact O-CG2 3.47Å; T36-V40 PolarHBondContact O-N 3.26Å; V40-A43 PolarHBondContact O-N 2.88Å; V40-A44 WeakPolarHBondContact O-CB 3.37Å; V40-A44 PolarHBondContact O-N 3.14Å
41L90.4Very high86.3Confident40 Ų4086.7 Ų86.721%0.20947%0.467CS..Hα-helixtrans-63.6-43.117717960.9000111.5G37 R38 F39 A44 L45 L306 M309 L310 L313G37-L41 WeakPolarHBondContact O-CB 3.47Å; G37-L41 PolarHBondContact O-N 2.95Å; R38-L41 PolarHBondContact O-N 3.44Å; F39-L41 PolarHBondContact O-N 3.25Å; L41-A44 PolarHBondContact O-N 3.49Å; L41-L45 HydrophobicContact CD1-CD1 4.39Å; L41-L45 HydrophobicContact CD1-CG 4.44Å; L41-L45 HydrophobicContact CG-CD1 4.19Å; L41-L45 VanDerWaalsContact O-CG 3.29Å; L41-L45 WeakPolarHBondContact O-CG 3.3Å; L41-L45 PolarHBondContact O-N 3.44Å; L41-L306 HydrophobicContact CB-CD1 4.03Å; L41-L306 HydrophobicContact CD2-CD1 3.54Å; L41-L306 HydrophobicContact CG-CD1 3.64Å; L41-M309 HydrophobicContact CD2-CB 4.26Å; L41-M309 HydrophobicContact CD2-CE 4.41Å; L41-L310 HydrophobicContact CD2-CD2 3.7Å; L41-L310 HydrophobicContact CD2-CG 3.81Å; L41-L313 HydrophobicContact CD2-CD1 4.34Å
42L92.4Very high88.6Confident61 Ų6183.3 Ų83.332%0.31946%0.459SS..Hα-helixtrans-62.7-44.4175.7-178.661.9000111.3R38 F39 A44 L45 I46 I302 L306R38-L42 WeakPolarHBondContact O-CB 3.42Å; R38-L42 PolarHBondContact O-N 3.29Å; F39-L42 PolarHBondContact O-N 3.06Å; L42-A44 VanDerWaalsContact C-N 3.33Å; L42-A44 PolarHBondContact O-N 3.05Å; L42-L45 PolarHBondContact O-N 3.02Å; L42-I46 HydrophobicContact CD1-CD1 4.22Å; L42-I46 HydrophobicContact CD1-CG1 4.43Å; L42-I46 HydrophobicContact CG-CD1 3.98Å; L42-I46 VanDerWaalsContact O-CG1 3.31Å; L42-I46 WeakPolarHBondContact O-CG1 3.35Å; L42-I46 PolarHBondContact O-N 2.87Å; L42-I302 HydrophobicContact CD1-CG2 4.28Å; L42-L306 HydrophobicContact CB-CD1 4.42Å; L42-L306 HydrophobicContact CB-CD2 4.25Å
43A93.8Very high90.7Very high52 Ų5278.5 Ų78.543%0.4344%0.44SS..Hα-helixtrans-60.6-41.8176.300000112F39 V40 I46 G47F39-A43 WeakPolarHBondContact O-CB 3.49Å; F39-A43 PolarHBondContact O-N 3.21Å; V40-A43 PolarHBondContact O-N 2.88Å; A43-I46 PolarHBondContact O-N 2.86Å; A43-G47 PolarHBondContact O-N 2.92Å
44A94Very high92.1Very high62 Ų6275.9 Ų75.951%0.51244%0.435SS..Hα-helixtrans-64.5-41.917600000112.3V40 L41 L42 G47 L48V40-A44 WeakPolarHBondContact O-CB 3.37Å; V40-A44 PolarHBondContact O-N 3.14Å; L41-A44 PolarHBondContact O-N 3.49Å; L42-A44 VanDerWaalsContact C-N 3.33Å; L42-A44 PolarHBondContact O-N 3.05Å; A44-G47 PolarHBondContact O-N 3.44Å; A44-L48 PolarHBondContact O-N 2.83Å
45L94.2Very high93.1Very high69 Ų6976.5 Ų76.536%0.36144%0.444SS..Hα-helixtrans-64.6-40.8175.9-71.2168.3000112L41 L42 L48 Y49 L306 M309L41-L45 HydrophobicContact CD1-CD1 4.39Å; L41-L45 HydrophobicContact CD1-CG 4.44Å; L41-L45 HydrophobicContact CG-CD1 4.19Å; L41-L45 VanDerWaalsContact O-CG 3.29Å; L41-L45 WeakPolarHBondContact O-CG 3.3Å; L41-L45 PolarHBondContact O-N 3.44Å; L42-L45 PolarHBondContact O-N 3.02Å; L45-L48 PolarHBondContact O-N 2.91Å; L45-Y49 WeakPolarHBondContact O-CB 3.49Å; L45-Y49 PolarHBondContact O-N 3.36Å; L45-L306 HydrophobicContact CD1-CD1 4.3Å; L45-M309 HydrophobicContact CD1-CE 3.5Å; L45-M309 VanDerWaalsContact CD1-CE 3.5Å
46I95.2Very high94Very high86 Ų8677 Ų7744%0.44145%0.449SS..Hα-helixtrans-63.2-45.6173.7-69168000110.1L42 A43 L48 Y49 L50L42-I46 HydrophobicContact CD1-CD1 4.22Å; L42-I46 HydrophobicContact CD1-CG1 4.43Å; L42-I46 HydrophobicContact CG-CD1 3.98Å; L42-I46 VanDerWaalsContact O-CG1 3.31Å; L42-I46 WeakPolarHBondContact O-CG1 3.35Å; L42-I46 PolarHBondContact O-N 2.87Å; A43-I46 PolarHBondContact O-N 2.86Å; I46-L48 VanDerWaalsContact C-N 3.34Å; I46-L48 PolarHBondContact O-N 2.7Å; I46-Y49 WeakPolarHBondContact O-CB 3.4Å; I46-Y49 PolarHBondContact O-N 3.23Å; I46-Y49 VanDerWaalsContact O-N 3.17Å; I46-L50 HydrophobicContact CG2-CD1 4.09Å; I46-L50 HydrophobicContact CG2-CG 4.32Å; I46-L50 WeakPolarHBondContact O-CG 3.24Å; I46-L50 PolarHBondContact O-N 2.81Å
47G97.4Very high94.6Very high31 Ų3179.8 Ų79.832%0.3246%0.455SS..Hα-helixtrans-57.4-45.6176.400000112.5A43 A44 L50 V51A43-G47 PolarHBondContact O-N 2.92Å; A44-G47 PolarHBondContact O-N 3.44Å; G47-L50 PolarHBondContact O-N 3.16Å; G47-V51 WeakPolarHBondContact O-CG2 3.17Å; G47-V51 PolarHBondContact O-N 3.49Å
48L96.8Very high95.2Very high121 Ų12182.4 Ų82.463%0.63447%0.47SS*.Hα-helixtrans-63.2-42.1175.4-178.564.3000112.1A44 L45 I46 L50 V51 A52A44-L48 PolarHBondContact O-N 2.83Å; L45-L48 PolarHBondContact O-N 2.91Å; I46-L48 VanDerWaalsContact C-N 3.34Å; I46-L48 PolarHBondContact O-N 2.7Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 2.83Å; L48-V51 PolarHBondContact O-N 3.1Å; L48-A52 WeakPolarHBondContact O-CB 3.37Å; L48-A52 PolarHBondContact O-N 3.5Å
49Y96.8Very high95.7Very high182 Ų18282.4 Ų82.471%0.71449%0.485SS*.Hα-helixtrans-61.4-41.7176.7-179.9-98.7000111.8L45 I46 A52 G53L45-Y49 WeakPolarHBondContact O-CB 3.49Å; L45-Y49 PolarHBondContact O-N 3.36Å; I46-Y49 WeakPolarHBondContact O-CB 3.4Å; I46-Y49 PolarHBondContact O-N 3.23Å; I46-Y49 VanDerWaalsContact O-N 3.17Å; Y49-A52 PolarHBondContact O-N 3.01Å; Y49-G53 PolarHBondContact O-N 3.06Å
50L97.9Very high96.1Very high111 Ų11180.8 Ų80.858%0.58148%0.482SS*.Hα-helixtrans-65.5-42.9176.1-69.4175.4000112.2I46 G47 L48 G53 A54I46-L50 HydrophobicContact CG2-CD1 4.09Å; I46-L50 HydrophobicContact CG2-CG 4.32Å; I46-L50 WeakPolarHBondContact O-CG 3.24Å; I46-L50 PolarHBondContact O-N 2.81Å; G47-L50 PolarHBondContact O-N 3.16Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 2.83Å; L50-G53 PolarHBondContact O-N 3.04Å; L50-A54 WeakPolarHBondContact O-CB 3.32Å; L50-A54 PolarHBondContact O-N 3.38Å
51V98.3Very high96.3Very high91 Ų9182.2 Ų82.255%0.55248%0.483SS*.Hα-helixtrans-62.9-46.3176.2172.20000110.6G47 L48 G53 A54 T55G47-V51 WeakPolarHBondContact O-CG2 3.17Å; G47-V51 PolarHBondContact O-N 3.49Å; L48-V51 PolarHBondContact O-N 3.1Å; V51-G53 PolarHBondContact O-N 3.36Å; V51-A54 PolarHBondContact O-N 2.95Å; V51-T55 WeakPolarHBondContact O-CG2 3.44Å; V51-T55 PolarHBondContact O-N 3.38Å; V51-T55 PolarHBondContact O-OG1 3.33Å
52A97.9Very high96.6Very high47 Ų4783.3 Ų83.339%0.38849%0.494SS..Hα-helixtrans-58.9-47.817600000111.3L48 Y49 A54 T55 V56L48-A52 WeakPolarHBondContact O-CB 3.37Å; L48-A52 PolarHBondContact O-N 3.5Å; Y49-A52 PolarHBondContact O-N 3.01Å; A52-A54 PolarHBondContact O-N 3.41Å; A52-T55 PolarHBondContact O-N 3.34Å; A52-T55 PolarHBondContact O-OG1 3.37Å; A52-V56 WeakPolarHBondContact O-CG2 3.49Å; A52-V56 PolarHBondContact O-N 2.91Å
53G97.7Very high96.8Very high26 Ų2683.5 Ų83.527%0.26850%0.499SS..Hα-helixtrans-57.8-47175.600000112.8Y49 L50 V51 T55 V56 F57Y49-G53 PolarHBondContact O-N 3.06Å; L50-G53 PolarHBondContact O-N 3.04Å; V51-G53 PolarHBondContact O-N 3.36Å; G53-T55 PolarHBondContact O-N 3.49Å; G53-V56 PolarHBondContact O-N 3.44Å; G53-F57 VanDerWaalsContact O-CD2 3.28Å; G53-F57 WeakPolarHBondContact O-CD2 3.41Å; G53-F57 PolarHBondContact O-N 3.24Å
54A97.9Very high96.9Very high62 Ų6282.6 Ų82.651%0.51250%0.495SS..Hα-helixtrans-60.6-42.5178.200000112.2L50 V51 A52 S58L50-A54 WeakPolarHBondContact O-CB 3.32Å; L50-A54 PolarHBondContact O-N 3.38Å; V51-A54 PolarHBondContact O-N 2.95Å; A52-A54 PolarHBondContact O-N 3.41Å; A54-S58 WeakPolarHBondContact O-CB 3.4Å; A54-S58 PolarHBondContact O-N 2.65Å
55T97.9Very high97Very high87 Ų8785.1 Ų85.153%0.53450%0.496SS..Hα-helixtrans-64.2-40.9176.856.80000112.3V51 A52 G53 A59V51-T55 WeakPolarHBondContact O-CG2 3.44Å; V51-T55 PolarHBondContact O-N 3.38Å; V51-T55 PolarHBondContact O-OG1 3.33Å; A52-T55 PolarHBondContact O-N 3.34Å; A52-T55 PolarHBondContact O-OG1 3.37Å; G53-T55 PolarHBondContact O-N 3.49Å; T55-A59 WeakPolarHBondContact O-CB 3.04Å; T55-A59 PolarHBondContact O-N 2.97Å
56V98.1Very high97.1Very high79 Ų7984.8 Ų84.848%0.47950%0.503SS..Hα-helixtrans-68-50.7179.2172.40000110.7A52 G53 S58 A59 L60A52-V56 WeakPolarHBondContact O-CG2 3.49Å; A52-V56 PolarHBondContact O-N 2.91Å; G53-V56 PolarHBondContact O-N 3.44Å; V56-S58 PolarHBondContact O-N 3.49Å; V56-A59 PolarHBondContact O-N 3.22Å; V56-L60 HydrophobicContact CG1-CD1 3.68Å; V56-L60 HydrophobicContact CG1-CG 4.35Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 3.09Å
57F97.6Very high97.2Very high137 Ų13786.4 Ų86.460%0.60151%0.508SS*.Hα-helixtrans-63.3-40.5178.5-78.9-64000112.3G53 A59 L60 E61G53-F57 VanDerWaalsContact O-CD2 3.28Å; G53-F57 WeakPolarHBondContact O-CD2 3.41Å; G53-F57 PolarHBondContact O-N 3.24Å; F57-A59 VanDerWaalsContact C-N 3.28Å; F57-A59 PolarHBondContact O-N 3.12Å; F57-L60 PolarHBondContact O-N 3.34Å; F57-E61 HydrophobicContact CD1-CG 4.43Å; F57-E61 VanDerWaalsContact O-CB 3.31Å; F57-E61 WeakPolarHBondContact O-CB 3.4Å; F57-E61 PolarHBondContact O-N 2.96Å
58S97.7Very high97Very high78 Ų7887.1 Ų87.155%0.54551%0.511SS..Hα-helixtrans-61.6-37.5175.2-175.60000112A54 V56 S62A54-S58 WeakPolarHBondContact O-CB 3.4Å; A54-S58 PolarHBondContact O-N 2.65Å; V56-S58 PolarHBondContact O-N 3.49Å; S58-S62 WeakPolarHBondContact O-CB 3.31Å; S58-S62 PolarHBondContact O-N 3.49Å
59A97.3Very high96.9Very high70 Ų7089.7 Ų89.758%0.57951%0.512SS*.Hα-helixtrans-72.7-35178.500000112.6T55 V56 F57T55-A59 WeakPolarHBondContact O-CB 3.04Å; T55-A59 PolarHBondContact O-N 2.97Å; V56-A59 PolarHBondContact O-N 3.22Å; F57-A59 VanDerWaalsContact C-N 3.28Å; F57-A59 PolarHBondContact O-N 3.12Å
60L97.1Very high96.9Very high115 Ų11584 Ų8460%0.60250%0.503SS*.Hα-helixtrans-80.2-43.1-178.9-67.8174.5000112.8V56 F57V56-L60 HydrophobicContact CG1-CD1 3.68Å; V56-L60 HydrophobicContact CG1-CG 4.35Å; V56-L60 WeakPolarHBondContact O-CG 3.46Å; V56-L60 PolarHBondContact O-N 3.09Å; F57-L60 PolarHBondContact O-N 3.34Å
61E96.7Very high96.8Very high120 Ų12086.4 Ų86.456%0.56151%0.505SS*.Hα-helixtrans-96.1-29.9-168.7-61.7-60.4147.700113.8F57 G64 E65F57-E61 HydrophobicContact CD1-CG 4.43Å; F57-E61 VanDerWaalsContact O-CB 3.31Å; F57-E61 WeakPolarHBondContact O-CB 3.4Å; F57-E61 PolarHBondContact O-N 2.96Å; E61-G64 PolarHBondContact O-N 2.94Å; E61-G64 VanDerWaalsContact O-N 3.16Å; E61-E65 PolarHBondContact O-N 3.35Å
62S96.6Very high96.6Very high63 Ų6389 Ų8944%0.44151%0.505SS..Hα-helixtrans-55.3-43.4-180-177.70000114.6S58 E65 A66S58-S62 WeakPolarHBondContact O-CB 3.31Å; S58-S62 PolarHBondContact O-N 3.49Å; S62-E65 PolarHBondContact O-N 3.21Å; S62-A66 PolarHBondContact O-N 2.82Å; S62-A66 VanDerWaalsContact O-N 3.08Å
63P96.8Very high96.4Very high65 Ų6587.5 Ų87.542%0.42249%0.493SS..Hα-helixtrans-65.9-41.7176.724.8-33000111.9E65 A66 E67P63-E65 VanDerWaalsContact C-N 3.34Å; P63-E65 PolarHBondContact O-N 3.35Å; P63-A66 PolarHBondContact O-N 3.43Å; P63-E67 WeakPolarHBondContact O-CG 3.4Å; P63-E67 PolarHBondContact O-N 2.84Å
64G95.7Very high96.3Very high33 Ų3387.9 Ų87.934%0.3449%0.494SS..Hα-helixtrans-62.2-39.7177.100000112.7E61 E67 A68E61-G64 PolarHBondContact O-N 2.94Å; E61-G64 VanDerWaalsContact O-N 3.16Å; G64-E67 PolarHBondContact O-N 2.76Å; G64-A68 VanDerWaalsContact O-CB 3.32Å; G64-A68 WeakPolarHBondContact O-CB 3.44Å; G64-A68 PolarHBondContact O-N 3.17Å
65E95.6Very high96.1Very high115 Ų11588.8 Ų88.854%0.53749%0.493SS..Hα-helixtrans-62.8-45.4174.2-169.5-166170.500111.4E61 S62 P63 E67 A68 R69E61-E65 PolarHBondContact O-N 3.35Å; S62-E65 PolarHBondContact O-N 3.21Å; P63-E65 VanDerWaalsContact C-N 3.34Å; P63-E65 PolarHBondContact O-N 3.35Å; E65-E67 VanDerWaalsContact C-N 3.35Å; E65-E67 PolarHBondContact O-N 3.47Å; E65-A68 PolarHBondContact O-N 2.74Å; E65-R69 WeakPolarHBondContact O-CB 3.35Å; E65-R69 PolarHBondContact O-N 2.8Å; E65-R69 IonicContact OE1-NH1 2.74Å; E65-R69 PolarHBondContact OE1-NH1 3.42Å
66A96.1Very high95.9Very high61 Ų6185.1 Ų85.150%0.50447%0.47SS..Hα-helixtrans-61.6-43.5179.100000111.6S62 P63 R69 A70S62-A66 PolarHBondContact O-N 2.82Å; S62-A66 VanDerWaalsContact O-N 3.08Å; P63-A66 PolarHBondContact O-N 3.43Å; A66-R69 PolarHBondContact O-N 3.49Å; A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 3.23Å
67E96.6Very high95.7Very high121 Ų12188 Ų8857%0.56547%0.472SS*.Hα-helixtrans-65.3-42.7175.4-72178.2-169.200112.5P63 G64 E65 R69 A70 R71P63-E67 WeakPolarHBondContact O-CG 3.4Å; P63-E67 PolarHBondContact O-N 2.84Å; G64-E67 PolarHBondContact O-N 2.76Å; E65-E67 VanDerWaalsContact C-N 3.35Å; E65-E67 PolarHBondContact O-N 3.47Å; E67-R69 VanDerWaalsContact C-N 3.33Å; E67-R69 PolarHBondContact O-N 2.9Å; E67-A70 PolarHBondContact O-N 3.39Å; E67-R71 WeakPolarHBondContact O-CB 3.39Å; E67-R71 WeakPolarHBondContact O-CG 3.33Å; E67-R71 PolarHBondContact O-N 3.33Å; E67-R71 PolarHBondContact O-NE 2.93Å
68A94.4Very high95.6Very high45 Ų4586.9 Ų86.937%0.37247%0.473SS..Hα-helixtrans-61.8-42.2175.600000111.5G64 E65 R71 W72G64-A68 VanDerWaalsContact O-CB 3.32Å; G64-A68 WeakPolarHBondContact O-CB 3.44Å; G64-A68 PolarHBondContact O-N 3.17Å; E65-A68 PolarHBondContact O-N 2.74Å; A68-R71 PolarHBondContact O-N 3.14Å; A68-W72 WeakPolarHBondContact O-CB 3.48Å; A68-W72 PolarHBondContact O-N 3.31Å
69R95.1Very high95.5Very high175 Ų17587.7 Ų87.766%0.6647%0.467SS*.Hα-helixtrans-64.4-41.4176.6-162.5-178.7-14397.71.9111.9E65 A66 E67 G73E65-R69 WeakPolarHBondContact O-CB 3.35Å; E65-R69 PolarHBondContact O-N 2.8Å; E65-R69 IonicContact OE1-NH1 2.74Å; E65-R69 PolarHBondContact OE1-NH1 3.42Å; A66-R69 PolarHBondContact O-N 3.49Å; E67-R69 VanDerWaalsContact C-N 3.33Å; E67-R69 PolarHBondContact O-N 2.9Å; R69-G73 PolarHBondContact O-N 3.21Å
70A95.8Very high95.3Very high63 Ų6385.4 Ų85.452%0.52145%0.447SS..Hα-helixtrans-63.9-45.5175.900000111.6A66 E67 G73 A74A66-A70 WeakPolarHBondContact O-CB 3.49Å; A66-A70 PolarHBondContact O-N 3.23Å; E67-A70 PolarHBondContact O-N 3.39Å; A70-G73 PolarHBondContact O-N 3.33Å; A70-A74 PolarHBondContact O-N 2.91Å
71R96.5Very high95.1Very high162 Ų16284 Ų8461%0.61145%0.451SS*.Hα-helixtrans-59.3-49.2175.2-76.2-175.9-72178.1-3.1111.7E67 A68 G73 A74 T75E67-R71 WeakPolarHBondContact O-CB 3.39Å; E67-R71 WeakPolarHBondContact O-CG 3.33Å; E67-R71 PolarHBondContact O-N 3.33Å; E67-R71 PolarHBondContact O-NE 2.93Å; A68-R71 PolarHBondContact O-N 3.14Å; R71-G73 VanDerWaalsContact C-N 3.35Å; R71-G73 PolarHBondContact O-N 2.93Å; R71-A74 WeakPolarHBondContact O-CB 3.39Å; R71-A74 PolarHBondContact O-N 3.2Å; R71-A74 VanDerWaalsContact O-N 3.14Å; R71-T75 PolarHBondContact O-N 2.98Å; R71-T75 PolarHBondContact O-OG1 3.39Å
72W94.1Very high95.1Very high146 Ų14681.9 Ų81.955%0.55345%0.454SS*.Hα-helixtrans-59.9-44177.9178.1-119.1000112.5A68 A74 T75 L76 L94A68-W72 WeakPolarHBondContact O-CB 3.48Å; A68-W72 PolarHBondContact O-N 3.31Å; W72-A74 VanDerWaalsContact C-N 3.3Å; W72-A74 PolarHBondContact O-N 3.33Å; W72-T75 PolarHBondContact O-N 2.98Å; W72-L76 PolarHBondContact O-N 3.16Å; W72-L94 HydrophobicContact CZ2-CD1 3.92Å
73G94.1Very high95Very high15 Ų1584.6 Ų84.616%0.15546%0.46CS..Hα-helixtrans-61.2-37.5175.400000112.9R69 A70 R71 R77R69-G73 PolarHBondContact O-N 3.21Å; A70-G73 PolarHBondContact O-N 3.33Å; R71-G73 VanDerWaalsContact C-N 3.35Å; R71-G73 PolarHBondContact O-N 2.93Å; G73-R77 WeakPolarHBondContact O-CG 3.3Å; G73-R77 PolarHBondContact O-N 2.81Å; G73-R77 VanDerWaalsContact O-N 3.16Å
74A94.7Very high94.8Very high34 Ų3485 Ų8528%0.28148%0.476SS..Hα-helixtrans-67-44.3174.400000111.9A70 R71 W72 L76 R77 N78A70-A74 PolarHBondContact O-N 2.91Å; R71-A74 WeakPolarHBondContact O-CB 3.39Å; R71-A74 PolarHBondContact O-N 3.2Å; R71-A74 VanDerWaalsContact O-N 3.14Å; W72-A74 VanDerWaalsContact C-N 3.3Å; W72-A74 PolarHBondContact O-N 3.33Å; A74-L76 VanDerWaalsContact C-N 3.32Å; A74-L76 PolarHBondContact O-N 3.42Å; A74-R77 PolarHBondContact O-N 3.24Å; A74-N78 WeakPolarHBondContact O-CB 3.45Å; A74-N78 PolarHBondContact O-N 3.39Å; A74-N78 PolarHBondContact O-OD1 3.45Å
75T94.5Very high94.7Very high81 Ų8185.7 Ų85.750%0.49747%0.473SS..Hα-helixtrans-58-44.6175.7-580000111.8R71 W72 N78 F79R71-T75 PolarHBondContact O-N 2.98Å; R71-T75 PolarHBondContact O-OG1 3.39Å; W72-T75 PolarHBondContact O-N 2.98Å; T75-N78 PolarHBondContact O-N 2.91Å; T75-F79 WeakPolarHBondContact O-CB 3.49Å; T75-F79 PolarHBondContact O-N 3.14Å
76L93.4Very high94.6Very high10 Ų1082.2 Ų82.25%0.05246%0.464CS..Hα-helixtrans-63.1-45.4179.9-165.574.5000112W72 A74 F79 S80 E87 L90 R91 L94W72-L76 PolarHBondContact O-N 3.16Å; A74-L76 VanDerWaalsContact C-N 3.32Å; A74-L76 PolarHBondContact O-N 3.42Å; L76-F79 PolarHBondContact O-N 2.96Å; L76-S80 VanDerWaalsContact O-CB 3.31Å; L76-S80 WeakPolarHBondContact O-CB 3.36Å; L76-S80 PolarHBondContact O-N 3.41Å; L76-E87 HydrophobicContact CD2-CG 3.85Å; L76-E87 HydrophobicContact CG-CG 4.17Å; L76-L90 HydrophobicContact CD1-CD2 3.38Å; L76-L90 HydrophobicContact CD1-CG 3.76Å; L76-L90 HydrophobicContact CG-CD2 4.02Å; L76-R91 HydrophobicContact CD2-CG 3.93Å; L76-L94 HydrophobicContact CD1-CD1 3.71Å
77R93.1Very high94.3Very high138 Ų13881.6 Ų81.652%0.52145%0.451SS..Hα-helixtrans-64.6-42.7176.9-73.4-171.6-62.2-941.3112.1G73 A74 F79 S80 A81G73-R77 WeakPolarHBondContact O-CG 3.3Å; G73-R77 PolarHBondContact O-N 2.81Å; G73-R77 VanDerWaalsContact O-N 3.16Å; A74-R77 PolarHBondContact O-N 3.24Å; R77-F79 VanDerWaalsContact C-N 3.34Å; R77-F79 PolarHBondContact O-N 2.94Å; R77-S80 PolarHBondContact O-N 3.43Å; R77-A81 WeakPolarHBondContact O-CB 2.87Å; R77-A81 PolarHBondContact O-N 2.95Å
78N95.1Very high94Very high114 Ų11480.2 Ų80.261%0.6145%0.452SS*.Hα-helixtrans-62.9-42.6178-72.3-3.4000111.3A74 T75 A81 A82A74-N78 WeakPolarHBondContact O-CB 3.45Å; A74-N78 PolarHBondContact O-N 3.39Å; A74-N78 PolarHBondContact O-OD1 3.45Å; T75-N78 PolarHBondContact O-N 2.91Å; N78-A81 PolarHBondContact O-N 2.79Å; N78-A82 VanDerWaalsContact O-CB 3.25Å; N78-A82 WeakPolarHBondContact O-CB 3.05Å; N78-A82 PolarHBondContact O-N 2.95Å
79F95.2Very high94Very high95 Ų9584.2 Ų84.242%0.41746%0.463SS..Hα-helixtrans-65.2-44.6177.1-173.9-86.8000112T75 L76 R77 A82 H83 L90T75-F79 WeakPolarHBondContact O-CB 3.49Å; T75-F79 PolarHBondContact O-N 3.14Å; L76-F79 PolarHBondContact O-N 2.96Å; R77-F79 VanDerWaalsContact C-N 3.34Å; R77-F79 PolarHBondContact O-N 2.94Å; F79-A82 PolarHBondContact O-N 2.85Å; F79-H83 AromaticContact CD2-CE1 3.82Å; F79-H83 AromaticContact CD2-ND1 3.73Å; F79-H83 AromaticContact CE2-CE1 3.6Å; F79-H83 AromaticContact CE2-ND1 3.66Å; F79-H83 AromaticContact CG-ND1 4Å; F79-H83 AromaticContact CZ-ND1 3.85Å; F79-H83 PolarHBondContact O-N 3.41Å; F79-H83 VanDerWaalsContact O-N 3.09Å; F79-H83 PolarHBondContact O-ND1 2.86Å; F79-H83 VanDerWaalsContact O-ND1 3.12Å; F79-L90 HydrophobicContact CD1-CD1 4.24Å; F79-L90 HydrophobicContact CD1-CD2 3.65Å; F79-L90 HydrophobicContact CE1-CD1 4.11Å; F79-L90 HydrophobicContact CE1-CD2 4.33Å
80S94.7Very high93.9Very high23 Ų2376.8 Ų76.816%0.16144%0.437CS..Hα-helixtrans-57.5-47.4175.91710000111.6L76 R77 G84 V85L76-S80 VanDerWaalsContact O-CB 3.31Å; L76-S80 WeakPolarHBondContact O-CB 3.36Å; L76-S80 PolarHBondContact O-N 3.41Å; R77-S80 PolarHBondContact O-N 3.43Å; S80-G84 WeakPolarHBondContact O-CA 3.31Å; S80-G84 PolarHBondContact O-N 3.41Å; S80-V85 WeakPolarHBondContact CA-O 3.39Å; S80-V85 VanDerWaalsContact CB-O 3.32Å; S80-V85 WeakPolarHBondContact CB-O 3.44Å; S80-V85 PolarHBondContact O-N 2.83Å; S80-V85 PolarHBondContact OG-O 3.49Å
81A93.4Very high93.7Very high84 Ų8478.6 Ų78.669%0.69443%0.43SS*.Hα-helixtrans-66.6-40.7177.900000112.7R77 N78 H83R77-A81 WeakPolarHBondContact O-CB 2.87Å; R77-A81 PolarHBondContact O-N 2.95Å; N78-A81 PolarHBondContact O-N 2.79Å; A81-H83 PolarHBondContact O-N 3.43Å
82A96Very high93.6Very high76 Ų7672.9 Ų72.963%0.62842%0.417SS*.Hα-helixtrans-68.5-32.3-178.100000113.5N78 F79N78-A82 VanDerWaalsContact O-CB 3.25Å; N78-A82 WeakPolarHBondContact O-CB 3.05Å; N78-A82 PolarHBondContact O-N 2.95Å; F79-A82 PolarHBondContact O-N 2.85Å
83H94.1Very high93.6Very high121 Ų12172.4 Ų72.456%0.5642%0.419SS*.Hα-helixtrans-112.13-174.6-60.186.3000113.8F79 A81 V85F79-H83 AromaticContact CD2-CE1 3.82Å; F79-H83 AromaticContact CD2-ND1 3.73Å; F79-H83 AromaticContact CE2-CE1 3.6Å; F79-H83 AromaticContact CE2-ND1 3.66Å; F79-H83 AromaticContact CG-ND1 4Å; F79-H83 AromaticContact CZ-ND1 3.85Å; F79-H83 PolarHBondContact O-N 3.41Å; F79-H83 VanDerWaalsContact O-N 3.09Å; F79-H83 PolarHBondContact O-ND1 2.86Å; F79-H83 VanDerWaalsContact O-ND1 3.12Å; A81-H83 PolarHBondContact O-N 3.43Å; H83-V85 HydrophobicContact CB-CG2 4.11Å; H83-V85 PolarHBondContact O-N 2.63Å
84G93.5Very high93.5Very high73 Ų7373.7 Ų73.775%0.75342%0.422SS*.THydrogen-bonded Turntrans64.421.2-179.700000114.5S80S80-G84 WeakPolarHBondContact O-CA 3.31Å; S80-G84 PolarHBondContact O-N 3.41Å
85V93.6Very high93.4Very high47 Ų4780.2 Ų80.229%0.28544%0.44SS..  trans-90129.7-179.9-179.40000109.1S80 H83 E87 L90S80-V85 WeakPolarHBondContact CA-O 3.39Å; S80-V85 VanDerWaalsContact CB-O 3.32Å; S80-V85 WeakPolarHBondContact CB-O 3.44Å; S80-V85 PolarHBondContact O-N 2.83Å; S80-V85 PolarHBondContact OG-O 3.49Å; H83-V85 HydrophobicContact CB-CG2 4.11Å; H83-V85 PolarHBondContact O-N 2.63Å; V85-E87 PolarHBondContact O-N 3.47Å; V85-L90 HydrophobicContact CG1-CB 4.16Å
86A92.9Very high93.3Very high42 Ų4283 Ų8335%0.34745%0.447SS..  trans-62.5129.9177.100000110.8P88 E89 L90A86-P88 VanDerWaalsContact C-N 3.32Å; A86-P88 HydrophobicContact CB-CG 4.2Å; A86-E89 HydrophobicContact CB-CB 4.43Å; A86-E89 HydrophobicContact CB-CG 4.1Å; A86-E89 WeakPolarHBondContact O-CB 3.4Å; A86-E89 PolarHBondContact O-N 2.78Å; A86-L90 PolarHBondContact O-N 3.45Å
87E89.2Confident93.1Very high49 Ų4986.6 Ų86.623%0.22946%0.46CS..Hα-helixtrans-50.8-39.3178.3-149.4-168.3-172.600114.7L76 V85 R91L76-E87 HydrophobicContact CD2-CG 3.85Å; L76-E87 HydrophobicContact CG-CG 4.17Å; V85-E87 PolarHBondContact O-N 3.47Å; E87-R91 WeakPolarHBondContact O-CG 3.25Å; E87-R91 PolarHBondContact O-N 3.4Å; E87-R91 IonicContact OE1-CZ 3.41Å; E87-R91 IonicContact OE1-NH1 2.81Å; E87-R91 PolarHBondContact OE1-NH1 3.14Å; E87-R91 IonicContact OE1-NH2 3.44Å; E87-R91 PolarHBondContact OE1-NH2 3.46Å; E87-R91 IonicContact OE2-CZ 3.32Å; E87-R91 IonicContact OE2-NH1 3.47Å; E87-R91 PolarHBondContact OE2-NH1 2.97Å; E87-R91 IonicContact OE2-NH2 3.33Å; E87-R91 PolarHBondContact OE2-NH2 2.86Å
88P91.6Very high92.8Very high91 Ų9186 Ų8659%0.59146%0.463SS*.Hα-helixtrans-65.8-36.2174.824.4-34.8000113.8A86 R91 A92A86-P88 VanDerWaalsContact C-N 3.32Å; A86-P88 HydrophobicContact CB-CG 4.2Å; P88-R91 PolarHBondContact O-N 3.5Å; P88-A92 PolarHBondContact O-N 2.84Å
89E92.8Very high92.4Very high129 Ų12983.4 Ų83.460%0.60346%0.458SS*.Hα-helixtrans-68.2-42.2177.3-66.2176.5177.600110.8A86 R91 A92 F93A86-E89 HydrophobicContact CB-CB 4.43Å; A86-E89 HydrophobicContact CB-CG 4.1Å; A86-E89 WeakPolarHBondContact O-CB 3.4Å; A86-E89 PolarHBondContact O-N 2.78Å; E89-R91 VanDerWaalsContact C-N 3.33Å; E89-R91 PolarHBondContact O-N 2.81Å; E89-A92 WeakPolarHBondContact O-CB 3.21Å; E89-A92 PolarHBondContact O-N 3.46Å; E89-A92 VanDerWaalsContact O-N 3.14Å; E89-F93 PolarHBondContact O-N 2.87Å
90L92.8Very high91.9Very high20 Ų2080.4 Ų80.411%0.10545%0.451CS..Hα-helixtrans-61.7-41.8175.3-174.658.8000111.6L76 F79 V85 A86 F93 L94L76-L90 HydrophobicContact CD1-CD2 3.38Å; L76-L90 HydrophobicContact CD1-CG 3.76Å; L76-L90 HydrophobicContact CG-CD2 4.02Å; F79-L90 HydrophobicContact CD1-CD1 4.24Å; F79-L90 HydrophobicContact CD1-CD2 3.65Å; F79-L90 HydrophobicContact CE1-CD1 4.11Å; F79-L90 HydrophobicContact CE1-CD2 4.33Å; V85-L90 HydrophobicContact CG1-CB 4.16Å; A86-L90 PolarHBondContact O-N 3.45Å; L90-F93 PolarHBondContact O-N 3.31Å; L90-L94 HydrophobicContact CG-CD1 4.46Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.41Å; L90-L94 PolarHBondContact O-N 2.92Å
91R93.1Very high91.2Very high101 Ų10183 Ų8338%0.38146%0.463SS..Hα-helixtrans-64-38.4173.2-73.5-176.7-178.6104.20.4112.5L76 E87 P88 E89 L94 R95L76-R91 HydrophobicContact CD2-CG 3.93Å; E87-R91 WeakPolarHBondContact O-CG 3.25Å; E87-R91 PolarHBondContact O-N 3.4Å; E87-R91 IonicContact OE1-CZ 3.41Å; E87-R91 IonicContact OE1-NH1 2.81Å; E87-R91 PolarHBondContact OE1-NH1 3.14Å; E87-R91 IonicContact OE1-NH2 3.44Å; E87-R91 PolarHBondContact OE1-NH2 3.46Å; E87-R91 IonicContact OE2-CZ 3.32Å; E87-R91 IonicContact OE2-NH1 3.47Å; E87-R91 PolarHBondContact OE2-NH1 2.97Å; E87-R91 IonicContact OE2-NH2 3.33Å; E87-R91 PolarHBondContact OE2-NH2 2.86Å; P88-R91 PolarHBondContact O-N 3.5Å; E89-R91 VanDerWaalsContact C-N 3.33Å; E89-R91 PolarHBondContact O-N 2.81Å; R91-L94 PolarHBondContact O-N 3.38Å; R91-R95 WeakPolarHBondContact O-CG 3.44Å; R91-R95 PolarHBondContact O-N 3.49Å
92A94Very high90.4Very high41 Ų4183.3 Ų83.334%0.33947%0.465SS..Hα-helixtrans-63.6-44176.100000111.2P88 E89 L94 R95 H96P88-A92 PolarHBondContact O-N 2.84Å; E89-A92 WeakPolarHBondContact O-CB 3.21Å; E89-A92 PolarHBondContact O-N 3.46Å; E89-A92 VanDerWaalsContact O-N 3.14Å; A92-L94 PolarHBondContact O-N 3.36Å; A92-R95 WeakPolarHBondContact O-CB 3.34Å; A92-R95 PolarHBondContact O-N 3.41Å; A92-H96 PolarHBondContact O-CD2 3.23Å; A92-H96 PolarHBondContact O-N 3Å; A92-H96 VanDerWaalsContact O-N 3.12Å
93F92.9Very high89.4Confident136 Ų13683 Ų8360%0.59646%0.462SS*.Hα-helixtrans-59.9-45.8173.5176.6-103.2000112.2E89 L90 R95 H96 Y97E89-F93 PolarHBondContact O-N 2.87Å; L90-F93 PolarHBondContact O-N 3.31Å; F93-R95 VanDerWaalsContact C-N 3.29Å; F93-R95 PolarHBondContact O-N 2.89Å; F93-H96 WeakPolarHBondContact O-CA 3.25Å; F93-H96 WeakPolarHBondContact O-CB 3.39Å; F93-H96 PolarHBondContact O-N 3.37Å; F93-Y97 PolarHBondContact O-N 2.82Å
94L92.3Very high88.2Confident42 Ų4279.9 Ų79.922%0.2246%0.463CS..Hα-helixtrans-61-36.6177.3-71.6169.8000112.4W72 L76 L90 R91 A92 H96 Y97 E98W72-L94 HydrophobicContact CZ2-CD1 3.92Å; L76-L94 HydrophobicContact CD1-CD1 3.71Å; L90-L94 HydrophobicContact CG-CD1 4.46Å; L90-L94 VanDerWaalsContact O-CG 3.3Å; L90-L94 WeakPolarHBondContact O-CG 3.41Å; L90-L94 PolarHBondContact O-N 2.92Å; R91-L94 PolarHBondContact O-N 3.38Å; A92-L94 PolarHBondContact O-N 3.36Å; L94-H96 VanDerWaalsContact C-N 3.35Å; L94-H96 PolarHBondContact O-N 2.9Å; L94-Y97 CarbonylContact O-C 3.6Å; L94-Y97 WeakPolarHBondContact O-CB 3.32Å; L94-Y97 PolarHBondContact O-N 3.28Å; L94-E98 WeakPolarHBondContact O-CG 3.34Å; L94-E98 PolarHBondContact O-N 2.94Å
95R92.6Very high87.4Confident172 Ų17280.7 Ų80.765%0.64945%0.453SS*.Hα-helixtrans-63.6-38.3172.3-72.8173.6-179.8170.30.3112.5R91 A92 F93 E98 A99R91-R95 WeakPolarHBondContact O-CG 3.44Å; R91-R95 PolarHBondContact O-N 3.49Å; A92-R95 WeakPolarHBondContact O-CB 3.34Å; A92-R95 PolarHBondContact O-N 3.41Å; F93-R95 VanDerWaalsContact C-N 3.29Å; F93-R95 PolarHBondContact O-N 2.89Å; R95-E98 PolarHBondContact O-N 3.5Å; R95-A99 PolarHBondContact O-N 2.92Å
96H92.6Very high86.1Confident138 Ų13882.8 Ų82.864%0.63946%0.456SS*.Hα-helixtrans-67.1-38.2173-71-60.5000111.9A92 F93 L94 A99 A100A92-H96 PolarHBondContact O-CD2 3.23Å; A92-H96 PolarHBondContact O-N 3Å; A92-H96 VanDerWaalsContact O-N 3.12Å; F93-H96 WeakPolarHBondContact O-CA 3.25Å; F93-H96 WeakPolarHBondContact O-CB 3.39Å; F93-H96 PolarHBondContact O-N 3.37Å; L94-H96 VanDerWaalsContact C-N 3.35Å; L94-H96 PolarHBondContact O-N 2.9Å; H96-A99 PolarHBondContact O-N 3.44Å; H96-A100 PolarHBondContact O-N 3.15Å
97Y89.8Confident84.9Confident87 Ų8784.5 Ų84.534%0.34147%0.47SS..Hα-helixtrans-64.9-40.1173.8-176.5-112.1000112.1F93 L94 A99 A100 L101 A107F93-Y97 PolarHBondContact O-N 2.82Å; L94-Y97 CarbonylContact O-C 3.6Å; L94-Y97 WeakPolarHBondContact O-CB 3.32Å; L94-Y97 PolarHBondContact O-N 3.28Å; Y97-A99 VanDerWaalsContact C-N 3.32Å; Y97-A99 PolarHBondContact O-N 2.94Å; Y97-A100 WeakPolarHBondContact O-CB 3.43Å; Y97-A100 PolarHBondContact O-N 2.8Å; Y97-L101 WeakPolarHBondContact O-CB 3.22Å; Y97-L101 PolarHBondContact O-N 3.45Å; Y97-A107 HydrophobicContact CE2-CB 4.18Å; Y97-A107 WeakPolarHBondContact OH-CB 3.35Å; Y97-A107 PolarHBondContact OH-N 3.16Å
98E87.4Confident83.7Confident124 Ų12487 Ų8758%0.57949%0.485SS*.Hα-helixtrans-59.6-41.5172-75.2171.7-177.500111.8L94 R95 L101 A102L94-E98 WeakPolarHBondContact O-CG 3.34Å; L94-E98 PolarHBondContact O-N 2.94Å; R95-E98 PolarHBondContact O-N 3.5Å; E98-L101 WeakPolarHBondContact O-CB 3.24Å; E98-L101 PolarHBondContact O-N 2.87Å; E98-A102 WeakPolarHBondContact O-CB 3.3Å; E98-A102 PolarHBondContact O-N 2.85Å
99A86.9Confident81.8Confident60 Ų6087.6 Ų87.650%0.49650%0.498SS..Hα-helixtrans-65.7-40.1174.900000112.3R95 H96 Y97 A102 A103R95-A99 PolarHBondContact O-N 2.92Å; H96-A99 PolarHBondContact O-N 3.44Å; Y97-A99 VanDerWaalsContact C-N 3.32Å; Y97-A99 PolarHBondContact O-N 2.94Å; A99-A102 PolarHBondContact O-N 3.21Å; A99-A103 PolarHBondContact O-N 3.45Å
100A84.3Confident80.4Confident32 Ų3284.6 Ų84.626%0.26449%0.485SS..Hα-helixtrans-64.1-41174.400000111.4H96 Y97 A102 A103 G104 V105H96-A100 PolarHBondContact O-N 3.15Å; Y97-A100 WeakPolarHBondContact O-CB 3.43Å; Y97-A100 PolarHBondContact O-N 2.8Å; A100-A102 PolarHBondContact O-N 3.49Å; A100-A103 CarbonylContact O-C 3.4Å; A100-A103 WeakPolarHBondContact O-CA 3.39Å; A100-A103 WeakPolarHBondContact O-CB 3.3Å; A100-A103 PolarHBondContact O-N 3.26Å; A100-A103 VanDerWaalsContact O-N 3.1Å; A100-G104 PolarHBondContact O-N 3.34Å; A100-G104 VanDerWaalsContact O-N 3.17Å; A100-V105 HydrophobicContact CB-CB 4.15Å; A100-V105 WeakPolarHBondContact O-CB 3.15Å; A100-V105 PolarHBondContact O-N 2.93Å
101L80.7Confident79Confident79 Ų7986.5 Ų86.541%0.41449%0.491SS..Hα-helixtrans-61.6-42.9175.1-170.670.7000111.4Y97 E98 A103 G104 V105 R106Y97-L101 WeakPolarHBondContact O-CB 3.22Å; Y97-L101 PolarHBondContact O-N 3.45Å; E98-L101 WeakPolarHBondContact O-CB 3.24Å; E98-L101 PolarHBondContact O-N 2.87Å; L101-A103 VanDerWaalsContact C-N 3.25Å; L101-A103 PolarHBondContact O-N 2.96Å; L101-G104 WeakPolarHBondContact O-CA 3.23Å; L101-G104 PolarHBondContact O-N 3.49Å; L101-V105 WeakPolarHBondContact CA-O 3.33Å; L101-R106 HydrophobicContact CD1-CG 3.78Å
102A75.9Confident77.6Confident90 Ų9086.4 Ų86.474%0.74450%0.504SS*.Hα-helixtrans-63.9-29.6174.400000112.8E98 A99 A100 G104E98-A102 WeakPolarHBondContact O-CB 3.3Å; E98-A102 PolarHBondContact O-N 2.85Å; A99-A102 PolarHBondContact O-N 3.21Å; A100-A102 PolarHBondContact O-N 3.49Å; A102-G104 PolarHBondContact O-N 3.42Å
103A74.9Confident76.6Confident68 Ų6887.1 Ų87.156%0.56250%0.498SS*.THydrogen-bonded Turntrans-79.1-2.8171.200000113.6A99 A100 L101A99-A103 PolarHBondContact O-N 3.45Å; A100-A103 CarbonylContact O-C 3.4Å; A100-A103 WeakPolarHBondContact O-CA 3.39Å; A100-A103 WeakPolarHBondContact O-CB 3.3Å; A100-A103 PolarHBondContact O-N 3.26Å; A100-A103 VanDerWaalsContact O-N 3.1Å; L101-A103 VanDerWaalsContact C-N 3.25Å; L101-A103 PolarHBondContact O-N 2.96Å
104G68.9Low76.1Confident57 Ų5787.4 Ų87.459%0.58850%0.495SS*.THydrogen-bonded Turntrans89.67.8178.900000114.9A100 L101 A102A100-G104 PolarHBondContact O-N 3.34Å; A100-G104 VanDerWaalsContact O-N 3.17Å; L101-G104 WeakPolarHBondContact O-CA 3.23Å; L101-G104 PolarHBondContact O-N 3.49Å; A102-G104 PolarHBondContact O-N 3.42Å
105V75.6Confident75.8Confident90 Ų9087.5 Ų87.555%0.54550%0.496SS..  trans-83.5119.5175.2-176.50000108.8A100 L101A100-V105 HydrophobicContact CB-CB 4.15Å; A100-V105 WeakPolarHBondContact O-CB 3.15Å; A100-V105 PolarHBondContact O-N 2.93Å; L101-V105 WeakPolarHBondContact CA-O 3.33Å
106R68.2Low75.5Confident91 Ų9187.3 Ų87.334%0.34350%0.5SS..  trans-118.8144.2179.4-64.2-174.468.7138.4-1.2110L101 D108L101-R106 HydrophobicContact CD1-CG 3.78Å; R106-D108 VanDerWaalsContact C-N 3.29Å
107A66.1Low75Confident78 Ų7883.1 Ų83.165%0.64549%0.485SS*.SBendtrans-69.7-28.717300000112.5Y97Y97-A107 HydrophobicContact CE2-CB 4.18Å; Y97-A107 WeakPolarHBondContact OH-CB 3.35Å; Y97-A107 PolarHBondContact OH-N 3.16Å
108D63.6Low74.7Confident100 Ų10079.7 Ų79.754%0.53548%0.476SS..SBendtrans-83.2138.9-178.3-57.2-41.2000112.2R106 L110R106-D108 VanDerWaalsContact C-N 3.29Å; D108-L110 HydrophobicContact CB-CD1 3.54Å; D108-L110 PolarHBondContact O-N 3.04Å
109A53.5Low74.8Confident105 Ų10575.1 Ų75.187%0.86846%0.459SS*.  trans-73.255.5177.200000113.1
110L62Low74.9Confident65 Ų6577.3 Ų77.334%0.3446%0.458SS..PPolyproline II helixtrans-72.7151.7170-81.698.8000111.1D108 Q266D108-L110 HydrophobicContact CB-CD1 3.54Å; D108-L110 PolarHBondContact O-N 3.04Å; L110-Q266 HydrophobicContact CD2-CB 4.19Å
111R63.5Low75Confident60 Ų6077.8 Ų77.823%0.22645%0.453CS..PPolyproline II helixtrans-51.5143.3176.7-171.7175.5-170.9-90-4.2111.7R113 D115R111-R113 PolarHBondContact O-N 3.34Å; R111-R113 VanDerWaalsContact O-N 3.14Å; R111-D115 IonicContact CZ-OD1 3.16Å; R111-D115 IonicContact CZ-OD2 3.67Å; R111-D115 IonicContact NH1-OD1 3.15Å; R111-D115 PolarHBondContact NH1-OD1 3.12Å; R111-D115 IonicContact NH1-OD2 2.73Å; R111-D115 PolarHBondContact NH1-OD2 2.99Å; R111-D115 IonicContact NH2-OD2 2.93Å; R111-D115 PolarHBondContact NH2-OD2 3.38Å
112P64.8Low75.5Confident100 Ų10075.1 Ų75.165%0.64944%0.438SS*.PPolyproline II helixtrans-54.7121.5171.2-22.932.2000110.6W114P112-W114 VanDerWaalsContact C-N 3.35Å
113R71.3Confident76.2Confident56 Ų5672.5 Ų72.521%0.21141%0.413CS..THydrogen-bonded Turntrans-76.6-19-174-81.4163.1160.3-160-8.5114.4R111 G118 M134 T135R111-R113 PolarHBondContact O-N 3.34Å; R111-R113 VanDerWaalsContact O-N 3.14Å; R113-G118 CarbonylContact O-C 3.49Å; R113-G118 WeakPolarHBondContact O-CA 3.45Å; R113-M134 PolarHBondContact NH1-O 3.4Å; R113-T135 HydrophobicContact CB-CG2 3.57Å; R113-T135 HydrophobicContact CG-CG2 3.61Å
114W83.9Confident77Confident142 Ų14270.6 Ų70.654%0.53840%0.4SS..THydrogen-bonded Turntrans-105.919.2-174.8-68.9112.2000114P112 A119 F122P112-W114 VanDerWaalsContact C-N 3.35Å; W114-A119 HydrophobicContact CE3-CB 4.49Å; W114-F122 AromaticContact CH2-CD1 3.95Å; W114-F122 HydrophobicContact CH2-CD1 3.95Å; W114-F122 HydrophobicContact CH2-CD2 4.35Å; W114-F122 AromaticContact CH2-CE1 3.97Å; W114-F122 HydrophobicContact CH2-CE1 3.97Å; W114-F122 HydrophobicContact CH2-CE2 4.36Å; W114-F122 HydrophobicContact CH2-CG 4.15Å; W114-F122 HydrophobicContact CH2-CZ 4.18Å; W114-F122 AromaticContact CZ3-CD1 3.81Å; W114-F122 HydrophobicContact CZ3-CD1 3.81Å; W114-F122 HydrophobicContact CZ3-CE1 4.14Å; W114-F122 HydrophobicContact CZ3-CG 4.18Å
115D85Confident78.1Confident43 Ų4368.4 Ų68.423%0.2338%0.375CS..SBendtrans-74.5167165.379.9-43.8000110.4R111 P117 G118 A119R111-D115 IonicContact CZ-OD1 3.16Å; R111-D115 IonicContact CZ-OD2 3.67Å; R111-D115 IonicContact NH1-OD1 3.15Å; R111-D115 PolarHBondContact NH1-OD1 3.12Å; R111-D115 IonicContact NH1-OD2 2.73Å; R111-D115 PolarHBondContact NH1-OD2 2.99Å; R111-D115 IonicContact NH2-OD2 2.93Å; R111-D115 PolarHBondContact NH2-OD2 3.38Å; D115-P117 VanDerWaalsContact OD2-CD 3.32Å; D115-P117 WeakPolarHBondContact OD2-CD 3.39Å; D115-G118 PolarHBondContact O-N 3.33Å; D115-G118 WeakPolarHBondContact OD1-CA 3.4Å; D115-G118 PolarHBondContact OD1-N 3.26Å; D115-A119 WeakPolarHBondContact O-CB 3.44Å; D115-A119 PolarHBondContact O-N 3Å
116F86Confident79Confident169 Ų16965.3 Ų65.374%0.74136%0.356SS*.Hα-helixtrans-56.4-48-171.1179.6-90.6000114.3G118 A119 F120F116-G118 PolarHBondContact O-N 2.93Å; F116-A119 PolarHBondContact O-N 2.86Å; F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 PolarHBondContact O-N 2.99Å
117P82.8Confident80.2Confident50 Ų5062.4 Ų62.433%0.32535%0.348SS..Hα-helixtrans-57.9-41.2171.8-27.533000115D115 F120 Y121 R277D115-P117 VanDerWaalsContact OD2-CD 3.32Å; D115-P117 WeakPolarHBondContact OD2-CD 3.39Å; P117-F120 PolarHBondContact O-N 3.29Å; P117-Y121 WeakPolarHBondContact O-CB 3.41Å; P117-Y121 PolarHBondContact O-N 3.09Å; P117-R277 VanDerWaalsContact CB-NH1 3.33Å
118G84.1Confident81.5Confident15 Ų1559.4 Ų59.416%0.15532%0.323CS..Hα-helixtrans-68.1-40.8177.500000112.2R113 D115 F116 Y121 F122R113-G118 CarbonylContact O-C 3.49Å; R113-G118 WeakPolarHBondContact O-CA 3.45Å; D115-G118 PolarHBondContact O-N 3.33Å; D115-G118 WeakPolarHBondContact OD1-CA 3.4Å; D115-G118 PolarHBondContact OD1-N 3.26Å; F116-G118 PolarHBondContact O-N 2.93Å; G118-Y121 PolarHBondContact O-N 3.16Å; G118-F122 WeakPolarHBondContact O-CB 3.34Å; G118-F122 PolarHBondContact O-N 3.33Å
119A89.5Confident82.9Confident27 Ų2758.5 Ų58.522%0.22332%0.321CS..Hα-helixtrans-64.9-40.7173.300000111.8W114 D115 F116 F122 V123W114-A119 HydrophobicContact CE3-CB 4.49Å; D115-A119 WeakPolarHBondContact O-CB 3.44Å; D115-A119 PolarHBondContact O-N 3Å; F116-A119 PolarHBondContact O-N 2.86Å; A119-F122 WeakPolarHBondContact O-CB 3.46Å; A119-F122 PolarHBondContact O-N 2.95Å; A119-V123 WeakPolarHBondContact O-CG2 3.36Å; A119-V123 PolarHBondContact O-N 2.85Å
120F88.1Confident84.9Confident106 Ų10653.8 Ų53.847%0.46528%0.281SS..Hα-helixtrans-62.1-43.4174.8-176-99.9000111.6F116 P117 V123 G124 F281F116-F120 WeakPolarHBondContact O-CB 3.31Å; F116-F120 PolarHBondContact O-N 2.99Å; P117-F120 PolarHBondContact O-N 3.29Å; F120-V123 VanDerWaalsContact O-CG2 3.27Å; F120-V123 WeakPolarHBondContact O-CG2 3.5Å; F120-V123 PolarHBondContact O-N 3.27Å; F120-G124 PolarHBondContact O-N 2.91Å; F120-F281 HydrophobicContact CE1-CD2 4.01Å; F120-F281 AromaticContact CE1-CE2 3.87Å; F120-F281 HydrophobicContact CE1-CE2 3.87Å; F120-F281 HydrophobicContact CZ-CE2 4.09Å
121Y86.9Confident86.3Confident43 Ų4352.8 Ų52.817%0.16929%0.287CS..Hα-helixtrans-60.6-47.1173.2-175.3-96.4000111.4P117 G118 G124 T125 F132 V263 S264 I284P117-Y121 WeakPolarHBondContact O-CB 3.41Å; P117-Y121 PolarHBondContact O-N 3.09Å; G118-Y121 PolarHBondContact O-N 3.16Å; Y121-G124 WeakPolarHBondContact O-CA 3.42Å; Y121-G124 PolarHBondContact O-N 3.5Å; Y121-T125 HydrophobicContact CD1-CG2 4.22Å; Y121-T125 HydrophobicContact CE1-CG2 3.93Å; Y121-T125 WeakPolarHBondContact O-CG2 3.44Å; Y121-T125 PolarHBondContact O-N 3.37Å; Y121-F132 HydrophobicContact CE1-CD2 4.15Å; Y121-F132 HydrophobicContact CE1-CE2 4.3Å; Y121-F132 AromaticContact CZ-CE2 3.92Å; Y121-F132 WeakPolarHBondContact OH-CE2 3.33Å; Y121-V263 HydrophobicContact CE1-CG1 4.02Å; Y121-V263 WeakPolarHBondContact OH-CG1 3.48Å; Y121-S264 PolarHBondContact OH-OG 2.97Å; Y121-I284 HydrophobicContact CE2-CD1 4.23Å
122F90.1Very high87.4Confident22 Ų2250.5 Ų50.510%0.09628%0.279CS..Hα-helixtrans-57.3-50.6176.3166.4-99.7000112.5W114 G118 A119 G124 T125 V126 T135 L146W114-F122 AromaticContact CH2-CD1 3.95Å; W114-F122 HydrophobicContact CH2-CD1 3.95Å; W114-F122 HydrophobicContact CH2-CD2 4.35Å; W114-F122 AromaticContact CH2-CE1 3.97Å; W114-F122 HydrophobicContact CH2-CE1 3.97Å; W114-F122 HydrophobicContact CH2-CE2 4.36Å; W114-F122 HydrophobicContact CH2-CG 4.15Å; W114-F122 HydrophobicContact CH2-CZ 4.18Å; W114-F122 AromaticContact CZ3-CD1 3.81Å; W114-F122 HydrophobicContact CZ3-CD1 3.81Å; W114-F122 HydrophobicContact CZ3-CE1 4.14Å; W114-F122 HydrophobicContact CZ3-CG 4.18Å; G118-F122 WeakPolarHBondContact O-CB 3.34Å; G118-F122 PolarHBondContact O-N 3.33Å; A119-F122 WeakPolarHBondContact O-CB 3.46Å; A119-F122 PolarHBondContact O-N 2.95Å; F122-G124 PolarHBondContact O-N 2.88Å; F122-T125 PolarHBondContact O-N 2.97Å; F122-T125 VanDerWaalsContact O-N 3.16Å; F122-T125 PolarHBondContact O-OG1 3.2Å; F122-V126 HydrophobicContact CD2-CG2 4.48Å; F122-V126 HydrophobicContact CE1-CG2 4.17Å; F122-V126 HydrophobicContact CE2-CG2 4.01Å; F122-V126 HydrophobicContact CZ-CG2 3.83Å; F122-V126 WeakPolarHBondContact O-CG2 3.32Å; F122-V126 PolarHBondContact O-N 2.79Å; F122-V126 VanDerWaalsContact O-N 3.09Å; F122-T135 VanDerWaalsContact CD2-O 3.3Å; F122-T135 WeakPolarHBondContact CD2-O 3.47Å; F122-T135 VanDerWaalsContact CE2-O 3.23Å; F122-T135 WeakPolarHBondContact CE2-O 3.19Å; F122-L146 HydrophobicContact CE1-CD1 4.47Å; F122-L146 HydrophobicContact CZ-CD1 4.05Å; F122-L146 HydrophobicContact CZ-CD2 4.38Å
123V92.5Very high88.3Confident36 Ų3648.3 Ų48.322%0.21827%0.274CS..Hα-helixtrans-66.2-31.8179.2-60.90000111.6A119 F120 V126 V127 Y149A119-V123 WeakPolarHBondContact O-CG2 3.36Å; A119-V123 PolarHBondContact O-N 2.85Å; F120-V123 VanDerWaalsContact O-CG2 3.27Å; F120-V123 WeakPolarHBondContact O-CG2 3.5Å; F120-V123 PolarHBondContact O-N 3.27Å; V123-V126 PolarHBondContact O-N 3.05Å; V123-V127 WeakPolarHBondContact O-CG2 3.44Å; V123-V127 PolarHBondContact O-N 2.58Å; V123-Y149 HydrophobicContact CB-CE1 3.77Å; V123-Y149 WeakPolarHBondContact CB-OH 3.48Å; V123-Y149 HydrophobicContact CG1-CE1 4.07Å
124G91.4Very high88.6Confident28 Ų2848.8 Ų48.829%0.28928%0.279SS..Hα-helixtrans-58.9-44.4170.900000113F120 Y121 F122 V126 V127 S128F120-G124 PolarHBondContact O-N 2.91Å; Y121-G124 WeakPolarHBondContact O-CA 3.42Å; Y121-G124 PolarHBondContact O-N 3.5Å; F122-G124 PolarHBondContact O-N 2.88Å; G124-V126 VanDerWaalsContact C-N 3.33Å; G124-V127 WeakPolarHBondContact O-CG2 3.49Å; G124-S128 VanDerWaalsContact O-CB 3.31Å; G124-S128 WeakPolarHBondContact O-CB 3.3Å; G124-S128 PolarHBondContact O-N 2.74Å; G124-S128 VanDerWaalsContact O-N 3.13Å; G124-S128 PolarHBondContact O-OG 3.21Å
125T92.1Very high88.4Confident10 Ų1043.2 Ų43.26%0.06126%0.261CS..Hα-helixtrans-71.4-27.7177.963.80000112.7Y121 F122 S128 T129 I130 G131 F132Y121-T125 HydrophobicContact CD1-CG2 4.22Å; Y121-T125 HydrophobicContact CE1-CG2 3.93Å; Y121-T125 WeakPolarHBondContact O-CG2 3.44Å; Y121-T125 PolarHBondContact O-N 3.37Å; F122-T125 PolarHBondContact O-N 2.97Å; F122-T125 VanDerWaalsContact O-N 3.16Å; F122-T125 PolarHBondContact O-OG1 3.2Å; T125-S128 WeakPolarHBondContact CA-OG 3.15Å; T125-S128 PolarHBondContact O-OG 3.46Å; T125-T129 PolarHBondContact O-N 2.81Å; T125-I130 PolarHBondContact O-N 3.37Å; T125-G131 PolarHBondContact O-N 3.24Å; T125-G131 VanDerWaalsContact O-N 3.12Å; T125-F132 HydrophobicContact CG2-CD2 3.7Å; T125-F132 HydrophobicContact CG2-CE2 3.88Å
126V94.1Very high88.4Confident25 Ų2545.3 Ų45.315%0.15228%0.276CS..Hα-helixtrans-68.2-55.3172.7171.70000110.8F122 V123 G124 S128 T129 L146 Y149F122-V126 HydrophobicContact CD2-CG2 4.48Å; F122-V126 HydrophobicContact CE1-CG2 4.17Å; F122-V126 HydrophobicContact CE2-CG2 4.01Å; F122-V126 HydrophobicContact CZ-CG2 3.83Å; F122-V126 WeakPolarHBondContact O-CG2 3.32Å; F122-V126 PolarHBondContact O-N 2.79Å; F122-V126 VanDerWaalsContact O-N 3.09Å; V123-V126 PolarHBondContact O-N 3.05Å; G124-V126 VanDerWaalsContact C-N 3.33Å; V126-S128 VanDerWaalsContact C-N 3.28Å; V126-S128 PolarHBondContact O-N 3.45Å; V126-T129 PolarHBondContact O-N 3.04Å; V126-L146 HydrophobicContact CB-CD1 4.24Å; V126-L146 HydrophobicContact CG1-CD1 3.61Å; V126-L146 HydrophobicContact CG2-CD1 3.57Å; V126-Y149 HydrophobicContact CB-CE1 4.38Å; V126-Y149 HydrophobicContact CG1-CD1 4.03Å; V126-Y149 HydrophobicContact CG1-CE1 4.1Å
127V94Very high88.6Confident30 Ų3038 Ų3818%0.18225%0.245CC..Hα-helixtrans-69.1-27.4-174.7-59.80000113.1V123 G124 T129 Y149 T157V123-V127 WeakPolarHBondContact O-CG2 3.44Å; V123-V127 PolarHBondContact O-N 2.58Å; G124-V127 WeakPolarHBondContact O-CG2 3.49Å; V127-T129 VanDerWaalsContact C-N 3.29Å; V127-Y149 HydrophobicContact CG1-CE1 3.55Å; V127-Y149 WeakPolarHBondContact CG1-OH 3.38Å; V127-T157 WeakPolarHBondContact O-CB 3.43Å; V127-T157 VanDerWaalsContact O-CG2 3.27Å; V127-T157 WeakPolarHBondContact O-CG2 3.4Å; V127-T157 PolarHBondContact O-OG1 3.17Å
128S91.9Very high88.7Confident16 Ų1639.1 Ų39.111%0.11226%0.258CS..THydrogen-bonded Turntrans-84.2-1.2173.858.30000113.7G124 T125 V126 I130 T256G124-S128 VanDerWaalsContact O-CB 3.31Å; G124-S128 WeakPolarHBondContact O-CB 3.3Å; G124-S128 PolarHBondContact O-N 2.74Å; G124-S128 VanDerWaalsContact O-N 3.13Å; G124-S128 PolarHBondContact O-OG 3.21Å; T125-S128 WeakPolarHBondContact CA-OG 3.15Å; T125-S128 PolarHBondContact O-OG 3.46Å; V126-S128 VanDerWaalsContact C-N 3.28Å; V126-S128 PolarHBondContact O-N 3.45Å; S128-I130 PolarHBondContact O-N 2.73Å; S128-I130 VanDerWaalsContact O-N 3.12Å; S128-I130 VanDerWaalsContact OG-CD1 3.24Å; S128-I130 WeakPolarHBondContact OG-CD1 3.28Å; S128-I130 VanDerWaalsContact OG-CG1 3.3Å; S128-I130 WeakPolarHBondContact OG-CG1 3.36Å; S128-T256 VanDerWaalsContact O-CG2 3.25Å; S128-T256 WeakPolarHBondContact O-CG2 3.44Å
129T93.9Very high89Confident81 Ų8142.9 Ų42.950%0.49728%0.278SS..THydrogen-bonded Turntrans5622.6-176.764.30000114.6T125 V126 V127 C154T125-T129 PolarHBondContact O-N 2.81Å; V126-T129 PolarHBondContact O-N 3.04Å; V127-T129 VanDerWaalsContact C-N 3.29Å; T129-C154 HydrophobicContact CG2-CB 4.33Å; T129-C154 VanDerWaalsContact CG2-SG 3.58Å
130I94.1Very high89.2Confident6 Ų647.6 Ų47.63%0.03130%0.304CS..  trans-73.5-52.5175.5-60.3166.7000109.8T125 S128 F132 T253 T256 G258 I284 V288T125-I130 PolarHBondContact O-N 3.37Å; S128-I130 PolarHBondContact O-N 2.73Å; S128-I130 VanDerWaalsContact O-N 3.12Å; S128-I130 VanDerWaalsContact OG-CD1 3.24Å; S128-I130 WeakPolarHBondContact OG-CD1 3.28Å; S128-I130 VanDerWaalsContact OG-CG1 3.3Å; S128-I130 WeakPolarHBondContact OG-CG1 3.36Å; I130-F132 HydrophobicContact CG2-CD1 4.06Å; I130-F132 HydrophobicContact CG2-CD2 4.15Å; I130-F132 HydrophobicContact CG2-CE1 3.75Å; I130-F132 HydrophobicContact CG2-CE2 3.79Å; I130-F132 HydrophobicContact CG2-CG 4.26Å; I130-F132 HydrophobicContact CG2-CZ 3.61Å; I130-T253 HydrophobicContact CD1-CG2 4.03Å; I130-T256 HydrophobicContact CG1-CG2 3.97Å; I130-G258 WeakPolarHBondContact O-CA 3.27Å; I130-I284 HydrophobicContact CD1-CG2 3.98Å; I130-V288 HydrophobicContact CD1-CG2 4.06Å
131G91.3Very high89.5Confident44 Ų4445 Ų4545%0.45431%0.308SS..  trans54.555.8171.800000117T125 G133T125-G131 PolarHBondContact O-N 3.24Å; T125-G131 VanDerWaalsContact O-N 3.12Å; G131-G133 PolarHBondContact O-N 3.48Å
132F88.6Confident89.9Confident12 Ų1244 Ų445%0.05331%0.311CS..  trans-51.2-12.6179.2-65.7-62.5000117Y121 T125 I130 M134 F249 T253 G258 G260 V263Y121-F132 HydrophobicContact CE1-CD2 4.15Å; Y121-F132 HydrophobicContact CE1-CE2 4.3Å; Y121-F132 AromaticContact CZ-CE2 3.92Å; Y121-F132 WeakPolarHBondContact OH-CE2 3.33Å; T125-F132 HydrophobicContact CG2-CD2 3.7Å; T125-F132 HydrophobicContact CG2-CE2 3.88Å; I130-F132 HydrophobicContact CG2-CD1 4.06Å; I130-F132 HydrophobicContact CG2-CD2 4.15Å; I130-F132 HydrophobicContact CG2-CE1 3.75Å; I130-F132 HydrophobicContact CG2-CE2 3.79Å; I130-F132 HydrophobicContact CG2-CG 4.26Å; I130-F132 HydrophobicContact CG2-CZ 3.61Å; F132-M134 PolarHBondContact O-N 3.02Å; F132-F249 HydrophobicContact CE1-CE2 4.12Å; F132-F249 AromaticContact CZ-CE2 3.92Å; F132-F249 HydrophobicContact CZ-CE2 3.92Å; F132-F249 HydrophobicContact CZ-CZ 4.36Å; F132-T253 HydrophobicContact CZ-CG2 3.75Å; F132-T253 WeakPolarHBondContact CZ-OG1 3.41Å; F132-G258 WeakPolarHBondContact CA-O 3.42Å; F132-G260 WeakPolarHBondContact O-CA 3.22Å; F132-V263 HydrophobicContact CB-CG2 4.1Å; F132-V263 HydrophobicContact CD1-CG2 4.22Å; F132-V263 HydrophobicContact CD2-CG1 4.35Å; F132-V263 HydrophobicContact CD2-CG2 4.47Å; F132-V263 HydrophobicContact CG-CG2 4.04Å
133G82.1Confident90.1Very high53 Ų5348.4 Ų48.455%0.54633%0.329SS..SBendtrans70.3-8.7178.700000115.5G131 T135G131-G133 PolarHBondContact O-N 3.48Å; G133-T135 VanDerWaalsContact C-N 3.34Å; G133-T135 PolarHBondContact O-N 2.99Å
134M77.6Confident90.3Very high66 Ų6649.5 Ų49.533%0.32534%0.342SS..SBendtrans-66-34.7179.7-77.1-61.8-113.400113.1R113 F132 G260 V263R113-M134 PolarHBondContact NH1-O 3.4Å; F132-M134 PolarHBondContact O-N 3.02Å; M134-G260 WeakPolarHBondContact CG-O 3.46Å; M134-V263 HydrophobicContact CB-CG2 4.48Å; M134-V263 HydrophobicContact CG-CG2 3.74Å
135T80.3Confident90.6Very high25 Ų2554.4 Ų54.415%0.15336%0.356CS..SBendtrans-121.2118.5175.142.40000109.5R113 F122 G133R113-T135 HydrophobicContact CB-CG2 3.57Å; R113-T135 HydrophobicContact CG-CG2 3.61Å; F122-T135 VanDerWaalsContact CD2-O 3.3Å; F122-T135 WeakPolarHBondContact CD2-O 3.47Å; F122-T135 VanDerWaalsContact CE2-O 3.23Å; F122-T135 WeakPolarHBondContact CE2-O 3.19Å; G133-T135 VanDerWaalsContact C-N 3.34Å; G133-T135 PolarHBondContact O-N 2.99Å
136T86.2Confident90.8Very high88 Ų8856.2 Ų56.254%0.5437%0.365SS..  trans-132.8144.8179.257.50000110.4A138T136-A138 PolarHBondContact O-N 2.84Å
137P88.8Confident90.8Very high15 Ų1561.2 Ų61.210%0.09739%0.39CS..  trans-67.9117.317826.7-32.6000110K143 L146P137-K143 HydrophobicContact CB-CG 4.32Å; P137-K143 HydrophobicContact CG-CG 4.08Å; P137-K143 WeakPolarHBondContact O-CE 3.43Å; P137-K143 WeakPolarHBondContact O-CG 3.47Å; P137-L146 HydrophobicContact CG-CB 4.33Å; P137-L146 HydrophobicContact CG-CD2 3.73Å
138A84.8Confident91Very high73 Ų7362.2 Ų62.260%0.60340%0.401SS*.  trans-79.4-33.4175.900000112.2T136T136-A138 PolarHBondContact O-N 2.84Å
139T89.8Confident91.2Very high94 Ų9465 Ų6558%0.57741%0.409SS*.SBendtrans-76.6148.7-175.564.90000112.3G141 G142 K143T139-G141 VanDerWaalsContact C-N 3.3Å; T139-G141 PolarHBondContact O-N 3.36Å; T139-G142 PolarHBondContact O-N 2.91Å; T139-G142 PolarHBondContact OG1-N 3.45Å; T139-K143 WeakPolarHBondContact O-CG 3.48Å; T139-K143 PolarHBondContact O-N 3.26Å
140V93.8Very high91.2Very high126 Ų12661.7 Ų61.776%0.76439%0.392SS*.Hα-helixtrans-58.5-43.7175.5179.60000110.9K143 A144V140-K143 PolarHBondContact O-N 3.33Å; V140-A144 WeakPolarHBondContact O-CB 3.48Å; V140-A144 PolarHBondContact O-N 3.34Å
141G96.3Very high91.3Very high53 Ų5367.1 Ų67.155%0.54642%0.42SS..Hα-helixtrans-61.8-42.8176.600000113.1T139 K143 A144 F145T139-G141 VanDerWaalsContact C-N 3.3Å; T139-G141 PolarHBondContact O-N 3.36Å; G141-K143 PolarHBondContact O-N 2.92Å; G141-A144 PolarHBondContact O-N 2.91Å; G141-F145 WeakPolarHBondContact O-CB 3.45Å; G141-F145 PolarHBondContact O-N 3.46Å
142G94Very high91.5Very high22 Ų2272.6 Ų72.623%0.22743%0.432CS..Hα-helixtrans-64-39.8176.500000112.8T139 L146T139-G142 PolarHBondContact O-N 2.91Å; T139-G142 PolarHBondContact OG1-N 3.45Å; G142-L146 VanDerWaalsContact O-CB 3.32Å; G142-L146 WeakPolarHBondContact O-CB 3.27Å; G142-L146 PolarHBondContact O-N 2.91Å
143K94.8Very high91.8Very high113 Ų11372.7 Ų72.749%0.49144%0.436SS..Hα-helixtrans-65.1-45.2174.9-69174.3-176.3178.20111.8P137 T139 V140 G141 L146 I147P137-K143 HydrophobicContact CB-CG 4.32Å; P137-K143 HydrophobicContact CG-CG 4.08Å; P137-K143 WeakPolarHBondContact O-CE 3.43Å; P137-K143 WeakPolarHBondContact O-CG 3.47Å; T139-K143 WeakPolarHBondContact O-CG 3.48Å; T139-K143 PolarHBondContact O-N 3.26Å; V140-K143 PolarHBondContact O-N 3.33Å; G141-K143 PolarHBondContact O-N 2.92Å; K143-L146 PolarHBondContact O-N 3.4Å; K143-I147 WeakPolarHBondContact O-CG1 3.47Å; K143-I147 PolarHBondContact O-N 2.91Å; K143-I147 VanDerWaalsContact O-N 3.14Å
144A96.9Very high92.4Very high59 Ų5971.7 Ų71.749%0.48842%0.421SS..Hα-helixtrans-62.7-43.8177.200000112V140 G141 I147 A148V140-A144 WeakPolarHBondContact O-CB 3.48Å; V140-A144 PolarHBondContact O-N 3.34Å; G141-A144 PolarHBondContact O-N 2.91Å; A144-I147 PolarHBondContact O-N 2.94Å; A144-A148 PolarHBondContact O-N 3.36Å
145F96.8Very high93.2Very high132 Ų13271.4 Ų71.458%0.57943%0.429SS*.Hα-helixtrans-61.7-43.6174.8-179.8-100.8000111.8G141 I147 A148 Y149G141-F145 WeakPolarHBondContact O-CB 3.45Å; G141-F145 PolarHBondContact O-N 3.46Å; F145-I147 VanDerWaalsContact C-N 3.28Å; F145-I147 PolarHBondContact O-N 3.32Å; F145-A148 PolarHBondContact O-N 2.87Å; F145-Y149 HydrophobicContact CE1-CD2 4.23Å; F145-Y149 HydrophobicContact CE1-CG 4.09Å; F145-Y149 HydrophobicContact CZ-CD2 4.15Å; F145-Y149 HydrophobicContact CZ-CG 4.38Å; F145-Y149 WeakPolarHBondContact O-CB 3.43Å; F145-Y149 PolarHBondContact O-N 3.5Å
146L95.7Very high93.9Very high47 Ų4772.1 Ų72.125%0.24644%0.441CS..Hα-helixtrans-58.3-38.9177.9177.462.8000112.4F122 V126 P137 G142 K143 G150F122-L146 HydrophobicContact CE1-CD1 4.47Å; F122-L146 HydrophobicContact CZ-CD1 4.05Å; F122-L146 HydrophobicContact CZ-CD2 4.38Å; V126-L146 HydrophobicContact CB-CD1 4.24Å; V126-L146 HydrophobicContact CG1-CD1 3.61Å; V126-L146 HydrophobicContact CG2-CD1 3.57Å; P137-L146 HydrophobicContact CG-CB 4.33Å; P137-L146 HydrophobicContact CG-CD2 3.73Å; G142-L146 VanDerWaalsContact O-CB 3.32Å; G142-L146 WeakPolarHBondContact O-CB 3.27Å; G142-L146 PolarHBondContact O-N 2.91Å; K143-L146 PolarHBondContact O-N 3.4Å; L146-G150 WeakPolarHBondContact O-CA 3.34Å; L146-G150 PolarHBondContact O-N 3.41Å
147I96.1Very high94.2Very high131 Ų13169 Ų6967%0.67242%0.422SS*.Hα-helixtrans-61.3-49.2177.7-67.4164.7000110.6K143 A144 F145 L151K143-I147 WeakPolarHBondContact O-CG1 3.47Å; K143-I147 PolarHBondContact O-N 2.91Å; K143-I147 VanDerWaalsContact O-N 3.14Å; A144-I147 PolarHBondContact O-N 2.94Å; F145-I147 VanDerWaalsContact C-N 3.28Å; F145-I147 PolarHBondContact O-N 3.32Å; I147-L151 PolarHBondContact O-N 3.45Å
148A96.3Very high94.4Very high51 Ų5172.6 Ų72.642%0.42144%0.44SS..Hα-helixtrans-68.7-47.5179.800000112A144 F145 L151 F152A144-A148 PolarHBondContact O-N 3.36Å; F145-A148 PolarHBondContact O-N 2.87Å; A148-L151 PolarHBondContact O-N 3.47Å; A148-F152 VanDerWaalsContact O-CD2 3.3Å; A148-F152 WeakPolarHBondContact O-CD2 3.32Å; A148-F152 PolarHBondContact O-N 3.47Å
149Y96.2Very high94.8Very high73 Ų7372.7 Ų72.729%0.28643%0.429SS..Hα-helixtrans-60.4-46.2178.6176.8-98.5000111.9V123 V126 V127 F145 L151 G153V123-Y149 HydrophobicContact CB-CE1 3.77Å; V123-Y149 WeakPolarHBondContact CB-OH 3.48Å; V123-Y149 HydrophobicContact CG1-CE1 4.07Å; V126-Y149 HydrophobicContact CB-CE1 4.38Å; V126-Y149 HydrophobicContact CG1-CD1 4.03Å; V126-Y149 HydrophobicContact CG1-CE1 4.1Å; V127-Y149 HydrophobicContact CG1-CE1 3.55Å; V127-Y149 WeakPolarHBondContact CG1-OH 3.38Å; F145-Y149 HydrophobicContact CE1-CD2 4.23Å; F145-Y149 HydrophobicContact CE1-CG 4.09Å; F145-Y149 HydrophobicContact CZ-CD2 4.15Å; F145-Y149 HydrophobicContact CZ-CG 4.38Å; F145-Y149 WeakPolarHBondContact O-CB 3.43Å; F145-Y149 PolarHBondContact O-N 3.5Å; Y149-L151 PolarHBondContact O-N 2.93Å; Y149-G153 WeakPolarHBondContact O-CA 3.49Å; Y149-G153 PolarHBondContact O-N 3.43Å
150G95.1Very high95Very high12 Ų1272.8 Ų72.812%0.12442%0.422CS..Hα-helixtrans-62.8-39.5179.700000112.6L146 G153 C154L146-G150 WeakPolarHBondContact O-CA 3.34Å; L146-G150 PolarHBondContact O-N 3.41Å; G150-G153 PolarHBondContact O-N 3.01Å; G150-C154 WeakPolarHBondContact O-CB 3.34Å; G150-C154 PolarHBondContact O-N 3.34Å; G150-C154 PolarHBondContact O-SG 2.85Å
151L94.9Very high94.8Very high120 Ų12067.5 Ų67.563%0.62839%0.389SS*.Hα-helixtrans-59.6-54178.7179.263.5000112.2I147 A148 Y149 A155I147-L151 PolarHBondContact O-N 3.45Å; A148-L151 PolarHBondContact O-N 3.47Å; Y149-L151 PolarHBondContact O-N 2.93Å; L151-A155 WeakPolarHBondContact O-CB 3.18Å; L151-A155 PolarHBondContact O-N 3.49Å
152F95.6Very high94.6Very high159 Ų15968.4 Ų68.470%0.69738%0.381SS*.Hα-helixtrans-71.7-37.6179.9-67-69.6000112.1A148 G156A148-F152 VanDerWaalsContact O-CD2 3.3Å; A148-F152 WeakPolarHBondContact O-CD2 3.32Å; A148-F152 PolarHBondContact O-N 3.47Å; F152-G156 PolarHBondContact O-N 3.29Å
153G95.4Very high94.5Very high15 Ų1571.5 Ų71.516%0.15539%0.392CS..Hα-helixtrans-61.5-54.3178.300000112.2Y149 G150 A155 G156 T157Y149-G153 WeakPolarHBondContact O-CA 3.49Å; Y149-G153 PolarHBondContact O-N 3.43Å; G150-G153 PolarHBondContact O-N 3.01Å; G153-A155 PolarHBondContact O-N 2.87Å; G153-G156 PolarHBondContact O-N 3.43Å; G153-T157 WeakPolarHBondContact O-CB 3.37Å; G153-T157 PolarHBondContact O-N 3.31Å; G153-T157 PolarHBondContact O-OG1 2.95Å
154C94.4Very high94.3Very high32 Ų3268.6 Ų68.622%0.21638%0.38CS..Hα-helixtrans-62.6-42.4179.8-64.80000111.9T129 G150 G156 T157 I158T129-C154 HydrophobicContact CG2-CB 4.33Å; T129-C154 VanDerWaalsContact CG2-SG 3.58Å; G150-C154 WeakPolarHBondContact O-CB 3.34Å; G150-C154 PolarHBondContact O-N 3.34Å; G150-C154 PolarHBondContact O-SG 2.85Å; C154-G156 PolarHBondContact O-N 3.3Å; C154-T157 PolarHBondContact O-N 3.36Å; C154-I158 VanDerWaalsContact O-CG1 3.28Å; C154-I158 WeakPolarHBondContact O-CG1 3.37Å; C154-I158 PolarHBondContact O-N 3.37Å
155A95.1Very high93.9Very high60 Ų6066.5 Ų66.550%0.49636%0.36SS..Hα-helixtrans-61.3-44.317600000112.1L151 G153 I158 L159L151-A155 WeakPolarHBondContact O-CB 3.18Å; L151-A155 PolarHBondContact O-N 3.49Å; G153-A155 PolarHBondContact O-N 2.87Å; A155-I158 PolarHBondContact O-N 3.37Å; A155-L159 PolarHBondContact O-N 3.45Å; A155-L159 VanDerWaalsContact O-N 3.16Å
156G94.8Very high93.5Very high40 Ų4066.1 Ų66.141%0.41236%0.36SS..Hα-helixtrans-63.1-42.5175.700000112.7F152 G153 C154 L159 F160F152-G156 PolarHBondContact O-N 3.29Å; G153-G156 PolarHBondContact O-N 3.43Å; C154-G156 PolarHBondContact O-N 3.3Å; G156-L159 WeakPolarHBondContact O-CB 3.34Å; G156-L159 PolarHBondContact O-N 3.46Å; G156-F160 PolarHBondContact O-N 2.9Å
157T93.1Very high93.3Very high23 Ų2373 Ų7314%0.14138%0.382CS..Hα-helixtrans-64.4-42.5177.6-61.30000112.3V127 G153 C154 L159 F160 F161V127-T157 WeakPolarHBondContact O-CB 3.43Å; V127-T157 VanDerWaalsContact O-CG2 3.27Å; V127-T157 WeakPolarHBondContact O-CG2 3.4Å; V127-T157 PolarHBondContact O-OG1 3.17Å; G153-T157 WeakPolarHBondContact O-CB 3.37Å; G153-T157 PolarHBondContact O-N 3.31Å; G153-T157 PolarHBondContact O-OG1 2.95Å; C154-T157 PolarHBondContact O-N 3.36Å; T157-L159 VanDerWaalsContact C-N 3.31Å; T157-L159 PolarHBondContact O-N 3.08Å; T157-F160 WeakPolarHBondContact O-CB 3.44Å; T157-F160 PolarHBondContact O-N 3.45Å; T157-F161 HydrophobicContact CG2-CD2 3.71Å; T157-F161 HydrophobicContact CG2-CE1 4.33Å; T157-F161 HydrophobicContact CG2-CE2 3.22Å; T157-F161 HydrophobicContact CG2-CG 4.43Å; T157-F161 HydrophobicContact CG2-CZ 3.54Å; T157-F161 WeakPolarHBondContact O-CD2 3.48Å; T157-F161 WeakPolarHBondContact O-CG 3.36Å; T157-F161 PolarHBondContact O-N 3.07Å
158I92.1Very high92.9Very high90 Ų9068.6 Ų68.646%0.46236%0.36SS..Hα-helixtrans-60.7-42.9175.7-68.6164.3000110.5C154 A155 F161 N162C154-I158 VanDerWaalsContact O-CG1 3.28Å; C154-I158 WeakPolarHBondContact O-CG1 3.37Å; C154-I158 PolarHBondContact O-N 3.37Å; A155-I158 PolarHBondContact O-N 3.37Å; I158-F161 PolarHBondContact O-N 3.28Å; I158-N162 VanDerWaalsContact O-CG 3.31Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.44Å
159L93.1Very high92.3Very high74 Ų7469.2 Ų69.239%0.38736%0.356SS..Hα-helixtrans-61.2-46.1174.6177.263.2000111.4A155 G156 T157 F161 N162 L163 M371A155-L159 PolarHBondContact O-N 3.45Å; A155-L159 VanDerWaalsContact O-N 3.16Å; G156-L159 WeakPolarHBondContact O-CB 3.34Å; G156-L159 PolarHBondContact O-N 3.46Å; T157-L159 VanDerWaalsContact C-N 3.31Å; T157-L159 PolarHBondContact O-N 3.08Å; L159-F161 VanDerWaalsContact C-N 3.35Å; L159-F161 PolarHBondContact O-N 3.15Å; L159-N162 PolarHBondContact O-N 2.88Å; L159-L163 HydrophobicContact CD1-CD1 4.4Å; L159-L163 HydrophobicContact CD1-CG 4.37Å; L159-L163 HydrophobicContact CG-CD1 4.28Å; L159-L163 WeakPolarHBondContact O-CG 3.31Å; L159-L163 PolarHBondContact O-N 2.63Å; L159-M371 HydrophobicContact CD1-SD 4.35Å
160F93.6Very high91.8Very high97 Ų9768.9 Ų68.943%0.42536%0.364SS..Hα-helixtrans-56.7-47.9175.9169.6-99000111.6G156 T157 N162 L163 F164G156-F160 PolarHBondContact O-N 2.9Å; T157-F160 WeakPolarHBondContact O-CB 3.44Å; T157-F160 PolarHBondContact O-N 3.45Å; F160-N162 VanDerWaalsContact C-N 3.34Å; F160-N162 PolarHBondContact O-N 3.16Å; F160-L163 PolarHBondContact O-N 3.3Å; F160-F164 WeakPolarHBondContact O-CB 3.18Å; F160-F164 PolarHBondContact O-N 3.16Å
161F91.4Very high91.5Very high15 Ų1572.9 Ų72.97%0.06638%0.382CS..Hα-helixtrans-65.2-35.7179.4-69.4-38.4000113.2T157 I158 L159 F164 L165 V288 Y292T157-F161 HydrophobicContact CG2-CD2 3.71Å; T157-F161 HydrophobicContact CG2-CE1 4.33Å; T157-F161 HydrophobicContact CG2-CE2 3.22Å; T157-F161 HydrophobicContact CG2-CG 4.43Å; T157-F161 HydrophobicContact CG2-CZ 3.54Å; T157-F161 WeakPolarHBondContact O-CD2 3.48Å; T157-F161 WeakPolarHBondContact O-CG 3.36Å; T157-F161 PolarHBondContact O-N 3.07Å; I158-F161 PolarHBondContact O-N 3.28Å; L159-F161 VanDerWaalsContact C-N 3.35Å; L159-F161 PolarHBondContact O-N 3.15Å; F161-F164 PolarHBondContact O-N 3.08Å; F161-L165 WeakPolarHBondContact O-CB 2.95Å; F161-L165 PolarHBondContact O-N 2.9Å; F161-V288 HydrophobicContact CE1-CG1 3.98Å; F161-V288 HydrophobicContact CE2-CG1 4.04Å; F161-V288 HydrophobicContact CZ-CB 4.4Å; F161-V288 HydrophobicContact CZ-CG1 3.36Å; F161-Y292 HydrophobicContact CB-CD1 3.46Å; F161-Y292 VanDerWaalsContact CB-CD1 3.46Å; F161-Y292 HydrophobicContact CB-CD2 4.1Å; F161-Y292 HydrophobicContact CB-CE1 3.32Å; F161-Y292 HydrophobicContact CB-CE2 4.01Å; F161-Y292 HydrophobicContact CB-CG 3.83Å; F161-Y292 AromaticContact CD2-CD2 3.78Å; F161-Y292 HydrophobicContact CD2-CD2 3.78Å; F161-Y292 HydrophobicContact CD2-CE2 4.02Å; F161-Y292 HydrophobicContact CD2-CG 4.05Å; F161-Y292 HydrophobicContact CE2-CD2 4.47Å; F161-Y292 HydrophobicContact CG-CD1 4.08Å; F161-Y292 HydrophobicContact CG-CD2 4.14Å; F161-Y292 HydrophobicContact CG-CE1 4.32Å; F161-Y292 HydrophobicContact CG-CE2 4.39Å; F161-Y292 AromaticContact CG-CG 3.96Å; F161-Y292 HydrophobicContact CG-CG 3.96Å
162N91.2Very high91Very high71 Ų7167.9 Ų67.938%0.3836%0.356SS..Hα-helixtrans-65-43.1174-74.1-27.4000112.2I158 L159 F160 L165 E166 Y292I158-N162 VanDerWaalsContact O-CG 3.31Å; I158-N162 PolarHBondContact O-N 2.83Å; I158-N162 PolarHBondContact O-ND2 3.44Å; L159-N162 PolarHBondContact O-N 2.88Å; F160-N162 VanDerWaalsContact C-N 3.34Å; F160-N162 PolarHBondContact O-N 3.16Å; N162-L165 PolarHBondContact O-N 2.95Å; N162-E166 PolarHBondContact O-N 3.16Å; N162-E166 VanDerWaalsContact O-N 3.11Å; N162-Y292 PolarHBondContact OD1-OH 2.94Å
163L91.9Very high90.4Very high88 Ų8861.2 Ų61.246%0.46133%0.331SS..Hα-helixtrans-65.4-40.7174.6-66.9174.9000111.3L159 F160 E166 R167L159-L163 HydrophobicContact CD1-CD1 4.4Å; L159-L163 HydrophobicContact CD1-CG 4.37Å; L159-L163 HydrophobicContact CG-CD1 4.28Å; L159-L163 WeakPolarHBondContact O-CG 3.31Å; L159-L163 PolarHBondContact O-N 2.63Å; F160-L163 PolarHBondContact O-N 3.3Å; L163-E166 PolarHBondContact O-N 3.31Å; L163-R167 WeakPolarHBondContact O-CG 3.31Å; L163-R167 PolarHBondContact O-N 3Å; L163-R167 VanDerWaalsContact O-N 3.11Å
164F90.7Very high89.9Confident52 Ų5267.3 Ų67.323%0.22835%0.353CS..Hα-helixtrans-61.4-44.5175.9-175.8-92.9000111.5F160 F161 E166 R167 I168 C289F160-F164 WeakPolarHBondContact O-CB 3.18Å; F160-F164 PolarHBondContact O-N 3.16Å; F161-F164 PolarHBondContact O-N 3.08Å; F164-E166 PolarHBondContact O-N 3.16Å; F164-R167 PolarHBondContact O-N 3.04Å; F164-I168 HydrophobicContact CD1-CG1 3.75Å; F164-I168 HydrophobicContact CE1-CD1 3.78Å; F164-I168 HydrophobicContact CE1-CG1 3.29Å; F164-I168 HydrophobicContact CE2-CG1 4.43Å; F164-I168 HydrophobicContact CG-CG1 4.48Å; F164-I168 HydrophobicContact CZ-CD1 3.72Å; F164-I168 HydrophobicContact CZ-CG1 3.7Å; F164-I168 WeakPolarHBondContact O-CG1 3.34Å; F164-I168 PolarHBondContact O-N 2.82Å; F164-C289 HydrophobicContact CD1-CB 3.77Å; F164-C289 HydrophobicContact CE1-CB 3.45Å; F164-C289 VanDerWaalsContact CE1-CB 3.45Å; F164-C289 HydrophobicContact CE2-CB 4.37Å; F164-C289 HydrophobicContact CG-CB 4.36Å; F164-C289 HydrophobicContact CZ-CB 3.78Å
165L88.4Confident89.5Confident15 Ų1569.4 Ų69.48%0.07936%0.361CS..Hα-helixtrans-57.6-46.1175.6175.364.1000111.6F161 N162 R167 I168 I169 N296F161-L165 WeakPolarHBondContact O-CB 2.95Å; F161-L165 PolarHBondContact O-N 2.9Å; N162-L165 PolarHBondContact O-N 2.95Å; L165-R167 VanDerWaalsContact C-N 3.29Å; L165-R167 PolarHBondContact O-N 3Å; L165-I168 PolarHBondContact O-N 3.15Å; L165-I169 HydrophobicContact CD1-CD1 3.7Å; L165-I169 HydrophobicContact CD1-CG1 3.99Å; L165-I169 HydrophobicContact CD2-CD1 4.48Å; L165-I169 HydrophobicContact CG-CD1 3.78Å; L165-I169 HydrophobicContact CG-CG1 4.42Å; L165-I169 WeakPolarHBondContact O-CB 3.32Å; L165-I169 VanDerWaalsContact O-CG1 3.31Å; L165-I169 WeakPolarHBondContact O-CG1 3.44Å; L165-I169 PolarHBondContact O-N 2.61Å; L165-N296 HydrophobicContact CD1-CB 4.47Å; L165-N296 HydrophobicContact CD2-CB 3.67Å
166E88.1Confident88.9Confident123 Ų12367.4 Ų67.458%0.57534%0.342SS*.Hα-helixtrans-59.4-42177.4-173.5179.9179.700111.6N162 L163 F164 S170N162-E166 PolarHBondContact O-N 3.16Å; N162-E166 VanDerWaalsContact O-N 3.11Å; L163-E166 PolarHBondContact O-N 3.31Å; F164-E166 PolarHBondContact O-N 3.16Å; E166-S170 VanDerWaalsContact O-CB 3.32Å; E166-S170 WeakPolarHBondContact O-CB 3.46Å; E166-S170 PolarHBondContact O-N 2.73Å; E166-S170 PolarHBondContact O-OG 3.42Å
167R91.1Very high88.3Confident191 Ų19172 Ų7272%0.72135%0.347SS*.Hα-helixtrans-66.1-43.2176-64.6-63.5-178.4-177.6-0.4112.2L163 F164 L165 S170 L171L163-R167 WeakPolarHBondContact O-CG 3.31Å; L163-R167 PolarHBondContact O-N 3Å; L163-R167 VanDerWaalsContact O-N 3.11Å; F164-R167 PolarHBondContact O-N 3.04Å; L165-R167 VanDerWaalsContact C-N 3.29Å; L165-R167 PolarHBondContact O-N 3Å; R167-S170 PolarHBondContact O-N 2.9Å; R167-L171 VanDerWaalsContact O-CB 3.27Å; R167-L171 WeakPolarHBondContact O-CB 3.28Å; R167-L171 PolarHBondContact O-N 3.49Å
168I87.7Confident87.8Confident39 Ų3971.9 Ų71.920%0.235%0.348CS..Hα-helixtrans-63.7-46.3177.2-73.1-71.4000111.3F164 L165 S170 L171 L172 L220F164-I168 HydrophobicContact CD1-CG1 3.75Å; F164-I168 HydrophobicContact CE1-CD1 3.78Å; F164-I168 HydrophobicContact CE1-CG1 3.29Å; F164-I168 HydrophobicContact CE2-CG1 4.43Å; F164-I168 HydrophobicContact CG-CG1 4.48Å; F164-I168 HydrophobicContact CZ-CD1 3.72Å; F164-I168 HydrophobicContact CZ-CG1 3.7Å; F164-I168 WeakPolarHBondContact O-CG1 3.34Å; F164-I168 PolarHBondContact O-N 2.82Å; L165-I168 PolarHBondContact O-N 3.15Å; I168-S170 VanDerWaalsContact C-N 3.3Å; I168-S170 PolarHBondContact O-N 2.81Å; I168-L171 PolarHBondContact O-N 3.12Å; I168-L172 VanDerWaalsContact O-CB 3.26Å; I168-L172 WeakPolarHBondContact O-CB 3.14Å; I168-L172 PolarHBondContact O-N 3.19Å; I168-L220 HydrophobicContact CG2-CD1 4.16Å
169I83.8Confident87.3Confident64 Ų6470.9 Ų70.933%0.32835%0.348SS..Hα-helixtrans-61.3-43.3178.1-68.7170.2000110L165 L172 A173L165-I169 HydrophobicContact CD1-CD1 3.7Å; L165-I169 HydrophobicContact CD1-CG1 3.99Å; L165-I169 HydrophobicContact CD2-CD1 4.48Å; L165-I169 HydrophobicContact CG-CD1 3.78Å; L165-I169 HydrophobicContact CG-CG1 4.42Å; L165-I169 WeakPolarHBondContact O-CB 3.32Å; L165-I169 VanDerWaalsContact O-CG1 3.31Å; L165-I169 WeakPolarHBondContact O-CG1 3.44Å; L165-I169 PolarHBondContact O-N 2.61Å; I169-L172 PolarHBondContact O-N 3.13Å; I169-A173 VanDerWaalsContact O-CB 3.29Å; I169-A173 WeakPolarHBondContact O-CB 3.25Å; I169-A173 PolarHBondContact O-N 3.1Å
170S86.6Confident86.7Confident67 Ų6771.9 Ų71.947%0.46935%0.347SS..Hα-helixtrans-63.9-45.5177.6-60.10000112.1E166 R167 I168 L172 A173 F174E166-S170 VanDerWaalsContact O-CB 3.32Å; E166-S170 WeakPolarHBondContact O-CB 3.46Å; E166-S170 PolarHBondContact O-N 2.73Å; E166-S170 PolarHBondContact O-OG 3.42Å; R167-S170 PolarHBondContact O-N 2.9Å; I168-S170 VanDerWaalsContact C-N 3.3Å; I168-S170 PolarHBondContact O-N 2.81Å; S170-L172 VanDerWaalsContact C-N 3.34Å; S170-L172 PolarHBondContact O-N 3.24Å; S170-A173 PolarHBondContact O-N 3.17Å; S170-F174 WeakPolarHBondContact O-CB 3.31Å; S170-F174 PolarHBondContact O-N 3.31Å
171L87.8Confident86.1Confident95 Ų9572.6 Ų72.650%0.49735%0.351SS..Hα-helixtrans-60.3-45.7176.2177.465.2000110.9R167 I168 F174 I175R167-L171 VanDerWaalsContact O-CB 3.27Å; R167-L171 WeakPolarHBondContact O-CB 3.28Å; R167-L171 PolarHBondContact O-N 3.49Å; I168-L171 PolarHBondContact O-N 3.12Å; L171-F174 WeakPolarHBondContact O-CB 3.24Å; L171-F174 PolarHBondContact O-N 2.98Å; L171-I175 HydrophobicContact CD1-CD1 4.14Å; L171-I175 HydrophobicContact CD1-CG1 4.45Å; L171-I175 HydrophobicContact CG-CD1 3.92Å; L171-I175 VanDerWaalsContact O-CG1 3.32Å; L171-I175 WeakPolarHBondContact O-CG1 3.11Å; L171-I175 PolarHBondContact O-N 2.86Å
172L85.9Confident85.5Confident15 Ų1580.2 Ų80.28%0.07938%0.38CS..Hα-helixtrans-68.3-39.3-178.8-16962.7000111.8I168 I169 S170 F174 I175 M176 V216 I219I168-L172 VanDerWaalsContact O-CB 3.26Å; I168-L172 WeakPolarHBondContact O-CB 3.14Å; I168-L172 PolarHBondContact O-N 3.19Å; I169-L172 PolarHBondContact O-N 3.13Å; S170-L172 VanDerWaalsContact C-N 3.34Å; S170-L172 PolarHBondContact O-N 3.24Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.35Å; L172-I175 PolarHBondContact O-N 3.34Å; L172-M176 HydrophobicContact CB-CE 4.47Å; L172-M176 HydrophobicContact CD2-CE 4.34Å; L172-M176 HydrophobicContact CG-CE 3.83Å; L172-M176 WeakPolarHBondContact O-CB 3.31Å; L172-M176 WeakPolarHBondContact O-CE 3.3Å; L172-M176 WeakPolarHBondContact O-CG 3.24Å; L172-M176 PolarHBondContact O-N 3.16Å; L172-V216 HydrophobicContact CD2-CB 3.96Å; L172-V216 HydrophobicContact CD2-CG1 3.78Å; L172-V216 HydrophobicContact CD2-CG2 4.02Å; L172-I219 HydrophobicContact CD1-CB 3.89Å; L172-I219 HydrophobicContact CD1-CD1 3.82Å; L172-I219 HydrophobicContact CD1-CG1 4.46Å; L172-I219 HydrophobicContact CD1-CG2 3.47Å; L172-I219 VanDerWaalsContact CD1-CG2 3.47Å; L172-I219 HydrophobicContact CD2-CB 4.34Å; L172-I219 HydrophobicContact CG-CD1 4.49Å
173A82.9Confident85Confident20 Ų2083 Ų8317%0.16539%0.391CS..Hα-helixtrans-59.9-41.7171.800000111.7I169 S170 R177 P211I169-A173 VanDerWaalsContact O-CB 3.29Å; I169-A173 WeakPolarHBondContact O-CB 3.25Å; I169-A173 PolarHBondContact O-N 3.1Å; S170-A173 PolarHBondContact O-N 3.17Å; A173-R177 VanDerWaalsContact O-CG 3.28Å; A173-R177 WeakPolarHBondContact O-CG 3.09Å; A173-R177 PolarHBondContact O-N 3.43Å; A173-P211 HydrophobicContact CB-CG 4.43Å
174F84.9Confident84.3Confident142 Ų14281.8 Ų81.862%0.62338%0.384SS*.Hα-helixtrans-63.5-48174.7178.7-97000112S170 L171 L172 M176 R177 A178S170-F174 WeakPolarHBondContact O-CB 3.31Å; S170-F174 PolarHBondContact O-N 3.31Å; L171-F174 WeakPolarHBondContact O-CB 3.24Å; L171-F174 PolarHBondContact O-N 2.98Å; L172-F174 VanDerWaalsContact C-N 3.31Å; L172-F174 PolarHBondContact O-N 3.35Å; F174-M176 PolarHBondContact O-N 2.98Å; F174-R177 PolarHBondContact O-N 2.83Å; F174-A178 WeakPolarHBondContact O-CB 3.17Å; F174-A178 PolarHBondContact O-N 3.32Å
175I85.6Confident83.5Confident76 Ų7688.3 Ų88.339%0.3941%0.407SS..Hα-helixtrans-59.9-45.8177.8-68.3167000110.7L171 L172 R177 A178 C179L171-I175 HydrophobicContact CD1-CD1 4.14Å; L171-I175 HydrophobicContact CD1-CG1 4.45Å; L171-I175 HydrophobicContact CG-CD1 3.92Å; L171-I175 VanDerWaalsContact O-CG1 3.32Å; L171-I175 WeakPolarHBondContact O-CG1 3.11Å; L171-I175 PolarHBondContact O-N 2.86Å; L172-I175 PolarHBondContact O-N 3.34Å; I175-R177 VanDerWaalsContact C-N 3.33Å; I175-R177 PolarHBondContact O-N 3.32Å; I175-A178 PolarHBondContact O-N 3.49Å; I175-C179 WeakPolarHBondContact O-CB 3.27Å; I175-C179 PolarHBondContact O-N 3.27Å; I175-C179 PolarHBondContact O-SG 3.14Å; I175-C179 VanDerWaalsContact O-SG 3.39Å
176M82.3Confident82.9Confident19 Ų1998.5 Ų98.59%0.09445%0.445CS..Hα-helixtrans-60.7-41.6177.4-78.6-173.3-83.300112.3L172 F174 R180 W209 P211 H215 V216 I219L172-M176 HydrophobicContact CB-CE 4.47Å; L172-M176 HydrophobicContact CD2-CE 4.34Å; L172-M176 HydrophobicContact CG-CE 3.83Å; L172-M176 WeakPolarHBondContact O-CB 3.31Å; L172-M176 WeakPolarHBondContact O-CE 3.3Å; L172-M176 WeakPolarHBondContact O-CG 3.24Å; L172-M176 PolarHBondContact O-N 3.16Å; F174-M176 PolarHBondContact O-N 2.98Å; M176-R180 WeakPolarHBondContact O-CB 3.41Å; M176-R180 PolarHBondContact O-N 2.92Å; M176-W209 HydrophobicContact CB-CH2 4.06Å; M176-W209 HydrophobicContact CB-CZ3 4.31Å; M176-W209 HydrophobicContact SD-CH2 4.04Å; M176-P211 HydrophobicContact CE-CB 3.49Å; M176-P211 VanDerWaalsContact CE-CB 3.49Å; M176-P211 HydrophobicContact CE-CG 4.26Å; M176-P211 HydrophobicContact SD-CB 3.95Å; M176-H215 HydrophobicContact SD-CB 4.08Å; M176-V216 HydrophobicContact CE-CG2 3.53Å; M176-I219 HydrophobicContact CG-CD1 4.09Å; M176-I219 HydrophobicContact SD-CD1 4.41Å
177R81.7Confident82.3Confident136 Ų13696.1 Ų96.151%0.51344%0.442SS..Hα-helixtrans-63.2-48175.3-74.3174.4-178.7-163.9-0.7111.3A173 F174 I175 C179 R180 E181A173-R177 VanDerWaalsContact O-CG 3.28Å; A173-R177 WeakPolarHBondContact O-CG 3.09Å; A173-R177 PolarHBondContact O-N 3.43Å; F174-R177 PolarHBondContact O-N 2.83Å; I175-R177 VanDerWaalsContact C-N 3.33Å; I175-R177 PolarHBondContact O-N 3.32Å; R177-C179 PolarHBondContact O-N 2.91Å; R177-R180 PolarHBondContact O-N 3.33Å; R177-E181 WeakPolarHBondContact O-CB 3.39Å; R177-E181 WeakPolarHBondContact O-CG 3.37Å; R177-E181 PolarHBondContact O-N 2.97Å
178A82.9Confident81Confident21 Ų2190.1 Ų90.117%0.17444%0.439CS..Hα-helixtrans-61.5-42178.500000112.4F174 I175 R182F174-A178 WeakPolarHBondContact O-CB 3.17Å; F174-A178 PolarHBondContact O-N 3.32Å; I175-A178 PolarHBondContact O-N 3.49Å; A178-R182 WeakPolarHBondContact O-CB 3.47Å; A178-R182 WeakPolarHBondContact O-CG 3.29Å; A178-R182 PolarHBondContact O-N 3.24Å
179C82.4Confident79.7Confident68 Ų6894.8 Ų94.846%0.45946%0.464SS..Hα-helixtrans-64-43.9175.3-74.40000111.8I175 R177 R182 Q183I175-C179 WeakPolarHBondContact O-CB 3.27Å; I175-C179 PolarHBondContact O-N 3.27Å; I175-C179 PolarHBondContact O-SG 3.14Å; I175-C179 VanDerWaalsContact O-SG 3.39Å; R177-C179 PolarHBondContact O-N 2.91Å; C179-R182 PolarHBondContact O-N 2.72Å; C179-Q183 WeakPolarHBondContact O-CB 3.27Å; C179-Q183 PolarHBondContact O-N 3.28Å
180R79.4Confident78.3Confident95 Ų9596.1 Ų96.136%0.35847%0.471SS..Hα-helixtrans-64.2-44.2177.7-174.6178.1-179.4-162.1-2.5111.9M176 R177 R182 Q183 L184 W209M176-R180 WeakPolarHBondContact O-CB 3.41Å; M176-R180 PolarHBondContact O-N 2.92Å; R177-R180 PolarHBondContact O-N 3.33Å; R180-R182 VanDerWaalsContact C-N 3.33Å; R180-R182 PolarHBondContact O-N 2.96Å; R180-Q183 PolarHBondContact O-N 2.76Å; R180-L184 HydrophobicContact CG-CD1 4.14Å; R180-L184 HydrophobicContact CG-CG 4.48Å; R180-L184 WeakPolarHBondContact O-CB 3.46Å; R180-L184 WeakPolarHBondContact O-CG 3.43Å; R180-L184 PolarHBondContact O-N 3.17Å; R180-W209 VanDerWaalsContact NH1-CG 3.33Å
181E80.5Confident76.6Confident112 Ų11297 Ų9752%0.52348%0.475SS..Hα-helixtrans-60.8-42.8175.4-76174.7-163.200111.5R177 L184 R185R177-E181 WeakPolarHBondContact O-CB 3.39Å; R177-E181 WeakPolarHBondContact O-CG 3.37Å; R177-E181 PolarHBondContact O-N 2.97Å; E181-L184 PolarHBondContact O-N 2.89Å; E181-R185 WeakPolarHBondContact O-CB 3.38Å; E181-R185 VanDerWaalsContact O-CG 3.29Å; E181-R185 WeakPolarHBondContact O-CG 3.27Å; E181-R185 PolarHBondContact O-N 3.05Å
182R80.4Confident74.9Confident175 Ų17597.8 Ų97.866%0.6650%0.496SS*.Hα-helixtrans-64.4-39.4174.7-72.8173.1-174.8-176.21.9112.2A178 C179 R180 R185 R186A178-R182 WeakPolarHBondContact O-CB 3.47Å; A178-R182 WeakPolarHBondContact O-CG 3.29Å; A178-R182 PolarHBondContact O-N 3.24Å; C179-R182 PolarHBondContact O-N 2.72Å; R180-R182 VanDerWaalsContact C-N 3.33Å; R180-R182 PolarHBondContact O-N 2.96Å; R182-R185 PolarHBondContact O-N 3.06Å; R182-R186 WeakPolarHBondContact O-CG 3.49Å; R182-R186 PolarHBondContact O-N 2.7Å
183Q79.5Confident73.2Confident130 Ų130102.8 Ų102.861%0.60753%0.527SS*.Hα-helixtrans-67.1-44.7177.8-168.7176.3-2.200111.3C179 R180 R185 R186 S187C179-Q183 WeakPolarHBondContact O-CB 3.27Å; C179-Q183 PolarHBondContact O-N 3.28Å; R180-Q183 PolarHBondContact O-N 2.76Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 2.8Å; Q183-R186 PolarHBondContact O-N 2.86Å; Q183-R186 VanDerWaalsContact O-N 3.13Å; Q183-S187 WeakPolarHBondContact O-CB 3.15Å; Q183-S187 PolarHBondContact O-N 3.48Å; Q183-S187 PolarHBondContact O-OG 2.59Å
184L76.8Confident71.5Confident63 Ų63107 Ų10733%0.3354%0.542SS..Hα-helixtrans-62.2-38.6175.3-72.5170.5000112.1R180 E181 L190R180-L184 HydrophobicContact CG-CD1 4.14Å; R180-L184 HydrophobicContact CG-CG 4.48Å; R180-L184 WeakPolarHBondContact O-CB 3.46Å; R180-L184 WeakPolarHBondContact O-CG 3.43Å; R180-L184 PolarHBondContact O-N 3.17Å; E181-L184 PolarHBondContact O-N 2.89Å; L184-L190 HydrophobicContact CB-CD1 3.93Å; L184-L190 HydrophobicContact CB-CG 4.38Å
185R75.4Confident69.5Low188 Ų188111 Ų11171%0.70955%0.553SS**Hα-helixtrans-64.8-37.8173.3-74.6-179-175.1-142.93.9112.3E181 R182 Q183 L190E181-R185 WeakPolarHBondContact O-CB 3.38Å; E181-R185 VanDerWaalsContact O-CG 3.29Å; E181-R185 WeakPolarHBondContact O-CG 3.27Å; E181-R185 PolarHBondContact O-N 3.05Å; R182-R185 PolarHBondContact O-N 3.06Å; Q183-R185 VanDerWaalsContact C-N 3.32Å; Q183-R185 PolarHBondContact O-N 2.8Å; R185-L190 HydrophobicContact CB-CD1 4.37Å; R185-L190 HydrophobicContact CG-CD1 3.54Å
186R75.9Confident67.6Low229 Ų229119.4 Ų119.486%0.86458%0.58SS**Hα-helixtrans-75.3-33177.7-79.1-175.8177178.1-1.3113.6R182 Q183 G188R182-R186 WeakPolarHBondContact O-CG 3.49Å; R182-R186 PolarHBondContact O-N 2.7Å; Q183-R186 PolarHBondContact O-N 2.86Å; Q183-R186 VanDerWaalsContact O-N 3.13Å; R186-G188 PolarHBondContact O-N 2.95Å
187S75.7Confident65.7Low74 Ų74121.8 Ų121.852%0.51761%0.609SS.*THydrogen-bonded Turntrans-77.64.7179.2-63.90000113.9Q183 L189Q183-S187 WeakPolarHBondContact O-CB 3.15Å; Q183-S187 PolarHBondContact O-N 3.48Å; Q183-S187 PolarHBondContact O-OG 2.59Å; S187-L189 PolarHBondContact O-N 3.11Å
188G63.4Low63.8Low64 Ų64119.1 Ų119.166%0.6661%0.611SS**THydrogen-bonded Turntrans66.86.5174.100000115.5R186 L190R186-G188 PolarHBondContact O-N 2.95Å; G188-L190 VanDerWaalsContact C-N 3.3Å; G188-L190 PolarHBondContact O-N 3.44Å
189L60.2Low62.1Low138 Ų138120 Ų12072%0.72362%0.618SS**  trans-84.70.7-178-83.8156.6000113.6S187S187-L189 PolarHBondContact O-N 3.11Å
190L55.2Low60.5Low92 Ų92124 Ų12448%0.48263%0.634SS.*SBendtrans-98.4111.5171.1-80.9165.8000109.1L184 R185 G188L184-L190 HydrophobicContact CB-CD1 3.93Å; L184-L190 HydrophobicContact CB-CG 4.38Å; R185-L190 HydrophobicContact CB-CD1 4.37Å; R185-L190 HydrophobicContact CG-CD1 3.54Å; G188-L190 VanDerWaalsContact C-N 3.3Å; G188-L190 PolarHBondContact O-N 3.44Å
191P49.7Very low58.7Low85 Ų85124 Ų12455%0.55265%0.649SS**  trans-63.3138.1179.5-17.529.4000111.4T193P191-T193 PolarHBondContact O-N 3.43Å
192A53Low57.1Low112 Ų112124.6 Ų124.693%0.92665%0.652SS**THydrogen-bonded Turntrans-66.84.9175.100000114.2
193T49Very low55.4Low120 Ų120119.1 Ų119.174%0.73664%0.643SS**THydrogen-bonded Turntrans-117.336.1-176.7510000112.8P191 R195P191-T193 PolarHBondContact O-N 3.43Å; T193-R195 PolarHBondContact O-N 2.85Å
194F47.8Very low53.7Low109 Ų109118.9 Ų118.948%0.47865%0.647SS.*  trans-75.673.3167.1-134.1-98.2000110R196 A199F194-R196 PolarHBondContact O-N 2.89Å; F194-A199 HydrophobicContact CD1-CB 4.28Å; F194-A199 HydrophobicContact CE1-CB 3.53Å; F194-A199 HydrophobicContact CZ-CB 4.46Å
195R42.6Very low52.1Low225 Ų225120.5 Ų120.585%0.84966%0.663SS**  trans-60.5131.8168.1-136.3-179.5-162.6-153.65.6107.2T193 G197T193-R195 PolarHBondContact O-N 2.85Å; R195-G197 PolarHBondContact O-N 3.31Å
196R46.8Very low50.9Low253 Ų253116.7 Ų116.796%0.95566%0.656SS**THydrogen-bonded Turntrans-50.312.6-170.9-144.6170.5-166.4160.91.7118.4F194F194-R196 PolarHBondContact O-N 2.89Å
197G41.1Very low49.6Very low69 Ų69109.3 Ų109.371%0.71164%0.644SS**THydrogen-bonded Turntrans-117.3-21.9-169.600000116.9R195R195-G197 PolarHBondContact O-N 3.31Å
198S42.9Very low48.2Very low79 Ų79108.8 Ų108.855%0.55265%0.651SS**SBendtrans-110.414.8-178.560.30000114L200S198-L200 VanDerWaalsContact C-N 3.34Å
199A47.3Very low47.8Very low39 Ų39109.8 Ų109.832%0.32264%0.635SS.*Hα-helixtrans-73.3-22.8179.800000114.1F194 S201 A203F194-A199 HydrophobicContact CD1-CB 4.28Å; F194-A199 HydrophobicContact CE1-CB 3.53Å; F194-A199 HydrophobicContact CZ-CB 4.46Å; A199-S201 VanDerWaalsContact C-N 3.33Å; A199-S201 PolarHBondContact O-N 3.47Å; A199-A203 WeakPolarHBondContact O-CB 3.48Å; A199-A203 PolarHBondContact O-N 2.85Å; A199-A203 VanDerWaalsContact O-N 3.14Å
200L48Very low47.8Very low152 Ų152111 Ų11180%0.79663%0.634SS**Hα-helixtrans-73.5-22.7-174-79.8155.6000113.2S198S198-L200 VanDerWaalsContact C-N 3.34Å
201S42.3Very low48.3Very low96 Ų96108.4 Ų108.467%0.67162%0.623SS**Hα-helixtrans-92.9-33.3-177.6-160.70000113.5A199A199-S201 VanDerWaalsContact C-N 3.33Å; A199-S201 PolarHBondContact O-N 3.47Å
202E45.8Very low49.6Very low125 Ų125106.4 Ų106.458%0.58461%0.611SS**Hα-helixtrans-90-23.4176.2-82-157.1131.600114.2D204 S205 L206E202-D204 PolarHBondContact O-N 3.46Å; E202-S205 PolarHBondContact O-N 2.75Å; E202-L206 PolarHBondContact O-N 3.39Å
203A45Very low51Low59 Ų59103 Ų10349%0.48858%0.578SS.*Hα-helixtrans-63.5-30.6171.100000112.1A199 S205 L206 A207A199-A203 WeakPolarHBondContact O-CB 3.48Å; A199-A203 PolarHBondContact O-N 2.85Å; A199-A203 VanDerWaalsContact O-N 3.14Å; A203-S205 VanDerWaalsContact C-N 3.31Å; A203-S205 PolarHBondContact O-N 3.17Å; A203-L206 PolarHBondContact O-N 2.8Å; A203-A207 PolarHBondContact O-N 2.8Å; A203-A207 VanDerWaalsContact O-N 3.12Å
204D43.6Very low52.6Low126 Ų126104.3 Ų104.367%0.67457%0.571SS**Hα-helixtrans-70.6-24.7172.6-98-7.7000113E202 A207E202-D204 PolarHBondContact O-N 3.46Å; D204-A207 WeakPolarHBondContact O-CB 3.1Å; D204-A207 PolarHBondContact O-N 3.43Å
205S44Very low54.4Low97 Ų97104.4 Ų104.468%0.67857%0.573SS**Hα-helixtrans-80.9-25.1175.1-62.70000112.7E202 A203E202-S205 PolarHBondContact O-N 2.75Å; A203-S205 VanDerWaalsContact C-N 3.31Å; A203-S205 PolarHBondContact O-N 3.17Å
206L48.9Very low56.5Low107 Ų10794.4 Ų94.456%0.5654%0.536SS*.Hα-helixtrans-82.9-15.4169.8-88.5155.7000113.3E202 A203 G208 W209E202-L206 PolarHBondContact O-N 3.39Å; A203-L206 PolarHBondContact O-N 2.8Å; L206-G208 PolarHBondContact O-N 2.92Å; L206-W209 PolarHBondContact O-N 3.26Å
207A48.7Very low58.6Low74 Ų7484.4 Ų84.461%0.61250%0.502SS*.THydrogen-bonded Turntrans-68.6-11176.200000113.9A203 D204A203-A207 PolarHBondContact O-N 2.8Å; A203-A207 VanDerWaalsContact O-N 3.12Å; D204-A207 WeakPolarHBondContact O-CB 3.1Å; D204-A207 PolarHBondContact O-N 3.43Å
208G47.9Very low61Low64 Ų6486.2 Ų86.266%0.6649%0.494SS*.THydrogen-bonded Turntrans-87.2-3176.900000115.9L206 K210L206-G208 PolarHBondContact O-N 2.92Å; G208-K210 PolarHBondContact O-N 2.98Å
209W53.9Low63.3Low85 Ų8585.7 Ų85.732%0.32249%0.485SS..  trans-75.5102.2-175.8-168.778.8000111.7M176 R180 L206 P211M176-W209 HydrophobicContact CB-CH2 4.06Å; M176-W209 HydrophobicContact CB-CZ3 4.31Å; M176-W209 HydrophobicContact SD-CH2 4.04Å; R180-W209 VanDerWaalsContact NH1-CG 3.33Å; L206-W209 PolarHBondContact O-N 3.26Å; W209-P211 HydrophobicContact CE3-CB 4.32Å; W209-P211 HydrophobicContact CH2-CB 3.66Å; W209-P211 HydrophobicContact CZ2-CB 4.5Å; W209-P211 HydrophobicContact CZ3-CB 3.55Å; W209-P211 HydrophobicContact CZ3-CG 4.17Å
210K60.6Low65.4Low163 Ų16384.4 Ų84.471%0.70947%0.472SS*.PPolyproline II helixtrans-80.2119.6164.3-77176.9175.4173.20108.4G208 S212G208-K210 PolarHBondContact O-N 2.98Å; K210-S212 PolarHBondContact O-N 3.27Å
211P65Low67.6Low38 Ų3878 Ų7825%0.24744%0.443CS..PPolyproline II helixtrans-54.5129.3169.218.3-26.8000108.8A173 M176 W209 V213 V216A173-P211 HydrophobicContact CB-CG 4.43Å; M176-P211 HydrophobicContact CE-CB 3.49Å; M176-P211 VanDerWaalsContact CE-CB 3.49Å; M176-P211 HydrophobicContact CE-CG 4.26Å; M176-P211 HydrophobicContact SD-CB 3.95Å; W209-P211 HydrophobicContact CE3-CB 4.32Å; W209-P211 HydrophobicContact CH2-CB 3.66Å; W209-P211 HydrophobicContact CZ2-CB 4.5Å; W209-P211 HydrophobicContact CZ3-CB 3.55Å; W209-P211 HydrophobicContact CZ3-CG 4.17Å; P211-V213 PolarHBondContact O-N 3.43Å; P211-V216 HydrophobicContact CB-CG2 4.38Å
212S78.1Confident70.1Confident43 Ų4378.7 Ų78.730%0.30144%0.439SS..PPolyproline II helixtrans-63.6137.2178.893.80000108.5K210 Y214 H215 V216K210-S212 PolarHBondContact O-N 3.27Å; S212-Y214 PolarHBondContact O-N 2.83Å; S212-Y214 VanDerWaalsContact O-N 3.14Å; S212-H215 PolarHBondContact O-N 2.85Å; S212-H215 PolarHBondContact OG-N 3.37Å; S212-H215 PolarHBondContact OG-ND1 3.45Å; S212-V216 PolarHBondContact O-N 3.39Å
213V80.8Confident72.4Confident40 Ų4077.1 Ų77.124%0.24243%0.43CS..Hα-helixtrans-55.8-32.7177.9-175.90000111.2P211 H215 V216 L217 V297 L301P211-V213 PolarHBondContact O-N 3.43Å; V213-H215 PolarHBondContact O-N 3.37Å; V213-V216 WeakPolarHBondContact O-CB 3.36Å; V213-V216 PolarHBondContact O-N 3.27Å; V213-L217 WeakPolarHBondContact O-CB 3.4Å; V213-L217 PolarHBondContact O-N 3Å; V213-V297 HydrophobicContact CG1-CG1 3.9Å; V213-L301 HydrophobicContact CB-CD2 4.24Å; V213-L301 HydrophobicContact CG1-CD2 3.74Å; V213-L301 HydrophobicContact CG1-CG 4.23Å
214Y84.6Confident74.8Confident147 Ų14774.5 Ų74.558%0.57641%0.409SS*.Hα-helixtrans-64.8-37.8178.2-58.8-74000113.7S212 L218 L301S212-Y214 PolarHBondContact O-N 2.83Å; S212-Y214 VanDerWaalsContact O-N 3.14Å; Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.77Å; Y214-L301 HydrophobicContact CD1-CD1 4.42Å; Y214-L301 HydrophobicContact CD1-CD2 4.35Å; Y214-L301 HydrophobicContact CE1-CD1 4.31Å; Y214-L301 HydrophobicContact CE1-CD2 3.87Å
215H85.4Confident77.3Confident112 Ų11272.8 Ų72.852%0.51940%0.403SS..Hα-helixtrans-70.7-39.2176.8-71.965.8000110.8M176 S212 V213 L218 I219M176-H215 HydrophobicContact SD-CB 4.08Å; S212-H215 PolarHBondContact O-N 2.85Å; S212-H215 PolarHBondContact OG-N 3.37Å; S212-H215 PolarHBondContact OG-ND1 3.45Å; V213-H215 PolarHBondContact O-N 3.37Å; H215-L218 PolarHBondContact O-N 3.32Å; H215-I219 WeakPolarHBondContact O-CG1 3.28Å; H215-I219 PolarHBondContact O-N 3.37Å
216V86.8Confident79.8Confident14 Ų1473.2 Ų73.29%0.08540%0.396CS..Hα-helixtrans-59.9-49.1174.1167.30000110.4L172 M176 P211 S212 V213 L218 L220 V297L172-V216 HydrophobicContact CD2-CB 3.96Å; L172-V216 HydrophobicContact CD2-CG1 3.78Å; L172-V216 HydrophobicContact CD2-CG2 4.02Å; M176-V216 HydrophobicContact CE-CG2 3.53Å; P211-V216 HydrophobicContact CB-CG2 4.38Å; S212-V216 PolarHBondContact O-N 3.39Å; V213-V216 WeakPolarHBondContact O-CB 3.36Å; V213-V216 PolarHBondContact O-N 3.27Å; V216-L218 PolarHBondContact O-N 3.01Å; V216-L220 VanDerWaalsContact O-CB 3.26Å; V216-L220 WeakPolarHBondContact O-CB 3.43Å; V216-L220 PolarHBondContact O-N 3.5Å; V216-V297 HydrophobicContact CG1-CG1 4.4Å; V216-V297 HydrophobicContact CG1-CG2 4.16Å
217L89.6Confident82Confident43 Ų4368.8 Ų68.823%0.22537%0.373CS..Hα-helixtrans-58.7-47.5176.6-17779.1000111.5V213 L220 G221 L294 V297 I298 L301V213-L217 WeakPolarHBondContact O-CB 3.4Å; V213-L217 PolarHBondContact O-N 3Å; L217-L220 PolarHBondContact O-N 2.9Å; L217-G221 WeakPolarHBondContact O-CA 3.35Å; L217-G221 PolarHBondContact O-N 3.4Å; L217-L294 HydrophobicContact CD1-CD1 3.64Å; L217-V297 HydrophobicContact CB-CG1 4Å; L217-V297 HydrophobicContact CD1-CB 4.34Å; L217-V297 HydrophobicContact CD1-CG1 3.85Å; L217-I298 HydrophobicContact CD1-CD1 4.38Å; L217-I298 HydrophobicContact CD1-CG1 3.58Å; L217-L301 HydrophobicContact CD2-CD1 3.66Å
218L91.4Very high84.3Confident107 Ų10766.1 Ų66.156%0.5635%0.35SS*.Hα-helixtrans-60.1-50-177.9-175.778.6000111.4Y214 H215 V216 G221 L222Y214-L218 WeakPolarHBondContact O-CB 3.39Å; Y214-L218 PolarHBondContact O-N 2.77Å; H215-L218 PolarHBondContact O-N 3.32Å; V216-L218 PolarHBondContact O-N 3.01Å; L218-G221 PolarHBondContact O-N 2.76Å; L218-L222 HydrophobicContact CG-CD1 4.08Å; L218-L222 WeakPolarHBondContact O-CB 3.32Å; L218-L222 VanDerWaalsContact O-CG 3.26Å; L218-L222 WeakPolarHBondContact O-CG 3.29Å; L218-L222 PolarHBondContact O-N 3.24Å
219I91.4Very high86.6Confident69 Ų6965.1 Ų65.135%0.35433%0.333SS..Hα-helixtrans-67.1-44.1-177.1-61.6164.2000110.6L172 M176 H215 G221 L222 F223L172-I219 HydrophobicContact CD1-CB 3.89Å; L172-I219 HydrophobicContact CD1-CD1 3.82Å; L172-I219 HydrophobicContact CD1-CG1 4.46Å; L172-I219 HydrophobicContact CD1-CG2 3.47Å; L172-I219 VanDerWaalsContact CD1-CG2 3.47Å; L172-I219 HydrophobicContact CD2-CB 4.34Å; L172-I219 HydrophobicContact CG-CD1 4.49Å; M176-I219 HydrophobicContact CG-CD1 4.09Å; M176-I219 HydrophobicContact SD-CD1 4.41Å; H215-I219 WeakPolarHBondContact O-CG1 3.28Å; H215-I219 PolarHBondContact O-N 3.37Å; I219-G221 VanDerWaalsContact C-N 3.34Å; I219-L222 PolarHBondContact O-N 2.79Å; I219-F223 WeakPolarHBondContact O-CB 3.36Å; I219-F223 PolarHBondContact O-N 2.86Å
220L92.1Very high88.6Confident11 Ų1164.1 Ų64.16%0.05834%0.338CS..Hα-helixtrans-64.7-40.3178.1-174.763.2000111.6I168 V216 L217 F223 A224 L294 V297I168-L220 HydrophobicContact CG2-CD1 4.16Å; V216-L220 VanDerWaalsContact O-CB 3.26Å; V216-L220 WeakPolarHBondContact O-CB 3.43Å; V216-L220 PolarHBondContact O-N 3.5Å; L217-L220 PolarHBondContact O-N 2.9Å; L220-F223 PolarHBondContact O-N 2.91Å; L220-A224 WeakPolarHBondContact O-CB 3.37Å; L220-A224 PolarHBondContact O-N 3.44Å; L220-L294 HydrophobicContact CD2-CB 4.25Å; L220-L294 HydrophobicContact CD2-CD1 4.41Å; L220-L294 HydrophobicContact CG-CD1 4.37Å; L220-V297 HydrophobicContact CD2-CG2 4.34Å
221G93.6Very high90.3Very high17 Ų1756.4 Ų56.418%0.17530%0.304CS..Hα-helixtrans-64.9-44.9176.200000112.5L217 L218 I219 F223 A224 V225L217-G221 WeakPolarHBondContact O-CA 3.35Å; L217-G221 PolarHBondContact O-N 3.4Å; L218-G221 PolarHBondContact O-N 2.76Å; I219-G221 VanDerWaalsContact C-N 3.34Å; G221-F223 VanDerWaalsContact C-N 3.32Å; G221-F223 PolarHBondContact O-N 2.76Å; G221-A224 PolarHBondContact O-N 3.25Å; G221-V225 WeakPolarHBondContact O-CG2 3.34Å; G221-V225 PolarHBondContact O-N 2.95Å
222L94.8Very high91.8Very high112 Ų11254.6 Ų54.659%0.58629%0.293SS*.Hα-helixtrans-60.9-41.6174.7-73.7170.7000111.7L218 I219 V225 L226L218-L222 HydrophobicContact CG-CD1 4.08Å; L218-L222 WeakPolarHBondContact O-CB 3.32Å; L218-L222 VanDerWaalsContact O-CG 3.26Å; L218-L222 WeakPolarHBondContact O-CG 3.29Å; L218-L222 PolarHBondContact O-N 3.24Å; I219-L222 PolarHBondContact O-N 2.79Å; L222-V225 PolarHBondContact O-N 3.48Å; L222-L226 WeakPolarHBondContact O-CB 3.33Å; L222-L226 PolarHBondContact O-N 3.03Å
223F94Very high92.6Very high91 Ų9154.9 Ų54.940%0.39930%0.298SS..Hα-helixtrans-64.8-42.2175.2179.9-105.4000112.2I219 L220 G221 V225 L226 L227 L286I219-F223 WeakPolarHBondContact O-CB 3.36Å; I219-F223 PolarHBondContact O-N 2.86Å; L220-F223 PolarHBondContact O-N 2.91Å; G221-F223 VanDerWaalsContact C-N 3.32Å; G221-F223 PolarHBondContact O-N 2.76Å; F223-V225 PolarHBondContact O-N 3.34Å; F223-L226 PolarHBondContact O-N 3.34Å; F223-L227 VanDerWaalsContact O-CB 3.28Å; F223-L227 WeakPolarHBondContact O-CB 2.94Å; F223-L227 PolarHBondContact O-N 3.17Å; F223-L286 HydrophobicContact CZ-CD2 4.28Å
224A95.1Very high93.3Very high5 Ų554.6 Ų54.64%0.04129%0.294CS..Hα-helixtrans-61.4-42.4176.400000112.3L220 G221 S228 C290 I291L220-A224 WeakPolarHBondContact O-CB 3.37Å; L220-A224 PolarHBondContact O-N 3.44Å; G221-A224 PolarHBondContact O-N 3.25Å; A224-S228 WeakPolarHBondContact O-CB 3.26Å; A224-S228 PolarHBondContact O-N 3.21Å; A224-S228 PolarHBondContact O-OG 2.75Å; A224-C290 VanDerWaalsContact CB-SG 3.54Å; A224-I291 HydrophobicContact CB-CD1 4.05Å
225V95.9Very high93.7Very high90 Ų9047.6 Ų47.655%0.54527%0.267SS..Hα-helixtrans-64.8-49176.2171.70000110.3G221 L222 F223 L227 S228 C229G221-V225 WeakPolarHBondContact O-CG2 3.34Å; G221-V225 PolarHBondContact O-N 2.95Å; L222-V225 PolarHBondContact O-N 3.48Å; F223-V225 PolarHBondContact O-N 3.34Å; V225-L227 VanDerWaalsContact C-N 3.32Å; V225-L227 PolarHBondContact O-N 3.34Å; V225-S228 PolarHBondContact O-N 3.11Å; V225-S228 VanDerWaalsContact O-N 3.16Å; V225-C229 PolarHBondContact O-N 3.43Å; V225-C229 PolarHBondContact O-SG 3.33Å
226L96.3Very high94.2Very high105 Ų10544.3 Ų44.355%0.5526%0.255SS..Hα-helixtrans-56.9-47.1177.4179.866.4000111.5L222 F223 S228 C229 C230L222-L226 WeakPolarHBondContact O-CB 3.33Å; L222-L226 PolarHBondContact O-N 3.03Å; F223-L226 PolarHBondContact O-N 3.34Å; L226-S228 VanDerWaalsContact C-N 3.33Å; L226-S228 PolarHBondContact O-N 3.36Å; L226-C229 PolarHBondContact O-N 3.06Å; L226-C230 PolarHBondContact O-N 3.3Å; L226-C230 PolarHBondContact O-SG 3.29Å
227L96.6Very high94.4Very high14 Ų1448.2 Ų48.27%0.07328%0.283CS..Hα-helixtrans-59.4-44177.7-179.565.4000111.8F223 V225 C230 A231 F283 L286 C290F223-L227 VanDerWaalsContact O-CB 3.28Å; F223-L227 WeakPolarHBondContact O-CB 2.94Å; F223-L227 PolarHBondContact O-N 3.17Å; V225-L227 VanDerWaalsContact C-N 3.32Å; V225-L227 PolarHBondContact O-N 3.34Å; L227-C230 PolarHBondContact O-N 2.98Å; L227-A231 WeakPolarHBondContact O-CB 3.21Å; L227-A231 PolarHBondContact O-N 3.12Å; L227-F283 HydrophobicContact CD1-CD1 3.8Å; L227-F283 HydrophobicContact CD1-CE1 3.98Å; L227-L286 HydrophobicContact CD1-CD2 3.65Å; L227-L286 HydrophobicContact CD1-CG 4.2Å; L227-L286 HydrophobicContact CD2-CB 4.21Å; L227-L286 HydrophobicContact CD2-CD2 4.06Å; L227-L286 HydrophobicContact CD2-CG 3.7Å; L227-C290 HydrophobicContact CD2-CB 4.33Å
228S96.6Very high94.4Very high19 Ų1949 Ų4913%0.13329%0.289CS..Hα-helixtrans-65.5-39.2177.6-56.40000111.8A224 V225 L226 A231 S232A224-S228 WeakPolarHBondContact O-CB 3.26Å; A224-S228 PolarHBondContact O-N 3.21Å; A224-S228 PolarHBondContact O-OG 2.75Å; V225-S228 PolarHBondContact O-N 3.11Å; V225-S228 VanDerWaalsContact O-N 3.16Å; L226-S228 VanDerWaalsContact C-N 3.33Å; L226-S228 PolarHBondContact O-N 3.36Å; S228-A231 PolarHBondContact O-N 3.36Å; S228-S232 VanDerWaalsContact O-CB 3.23Å; S228-S232 WeakPolarHBondContact O-CB 3.25Å; S228-S232 PolarHBondContact O-N 3.1Å
229C96.6Very high94.3Very high43 Ų4344.5 Ų44.529%0.29127%0.265SS..Hα-helixtrans-65.4-41.4175-68.70000112.3V225 L226 A233 Y243V225-C229 PolarHBondContact O-N 3.43Å; V225-C229 PolarHBondContact O-SG 3.33Å; L226-C229 PolarHBondContact O-N 3.06Å; C229-A233 PolarHBondContact O-N 3.4Å; C229-Y243 WeakPolarHBondContact CA-OH 3.17Å; C229-Y243 PolarHBondContact O-OH 3.43Å
230C96.1Very high94.2Very high64 Ų6444.4 Ų44.443%0.43228%0.281SS..Hα-helixtrans-65.4-45175.6-68.60000111.9L226 L227 A233 M234 F283L226-C230 PolarHBondContact O-N 3.3Å; L226-C230 PolarHBondContact O-SG 3.29Å; L227-C230 PolarHBondContact O-N 2.98Å; C230-A233 PolarHBondContact O-N 3.44Å; C230-M234 PolarHBondContact O-N 3Å; C230-F283 HydrophobicContact CB-CE1 4.32Å
231A96.1Very high94.3Very high0 Ų045.9 Ų45.90%029%0.286CS..Hα-helixtrans-63.4-43.6176.700000111.2L227 S228 A233 M234 Y235 F254 F283L227-A231 WeakPolarHBondContact O-CB 3.21Å; L227-A231 PolarHBondContact O-N 3.12Å; S228-A231 PolarHBondContact O-N 3.36Å; A231-A233 PolarHBondContact O-N 3.15Å; A231-M234 WeakPolarHBondContact O-CB 3.49Å; A231-M234 PolarHBondContact O-N 3.46Å; A231-M234 VanDerWaalsContact O-N 3.09Å; A231-Y235 HydrophobicContact CB-CD2 4.49Å; A231-Y235 HydrophobicContact CB-CE2 4.02Å; A231-Y235 WeakPolarHBondContact O-CD2 3.14Å; A231-Y235 PolarHBondContact O-N 3.26Å; A231-F254 HydrophobicContact CB-CE2 4.47Å; A231-F254 HydrophobicContact CB-CZ 4.05Å; A231-F283 HydrophobicContact CB-CB 4.28Å; A231-F283 HydrophobicContact CB-CD1 3.81Å; A231-F283 HydrophobicContact CB-CD2 4.47Å; A231-F283 HydrophobicContact CB-CE1 4.24Å; A231-F283 HydrophobicContact CB-CG 3.96Å
232S96.4Very high94.4Very high0 Ų050.6 Ų50.60%031%0.307CS..Hα-helixtrans-57.8-45.3175.9177.40000112.1S228 M234 Y235 T236 Y243 S246 L247S228-S232 VanDerWaalsContact O-CB 3.23Å; S228-S232 WeakPolarHBondContact O-CB 3.25Å; S228-S232 PolarHBondContact O-N 3.1Å; S232-M234 VanDerWaalsContact C-N 3.25Å; S232-M234 PolarHBondContact O-N 3.08Å; S232-Y235 PolarHBondContact O-N 3.2Å; S232-T236 PolarHBondContact O-N 2.83Å; S232-T236 PolarHBondContact O-OG1 3.14Å; S232-T236 VanDerWaalsContact O-OG1 3.05Å; S232-Y243 VanDerWaalsContact OG-CD2 3.31Å; S232-Y243 WeakPolarHBondContact OG-CD2 3.21Å; S232-Y243 VanDerWaalsContact OG-CE2 3.24Å; S232-Y243 WeakPolarHBondContact OG-CE2 3.4Å; S232-Y243 PolarHBondContact OG-O 2.9Å; S232-Y243 VanDerWaalsContact OG-O 3.08Å; S232-S246 WeakPolarHBondContact OG-CB 3.38Å; S232-L247 PolarHBondContact OG-N 2.86Å
233A95.4Very high94.4Very high50 Ų5049.9 Ų49.941%0.41330%0.298SS..Hα-helixtrans-59.5-35.5176.200000113C229 C230 A231 S237 Y243C229-A233 PolarHBondContact O-N 3.4Å; C230-A233 PolarHBondContact O-N 3.44Å; A231-A233 PolarHBondContact O-N 3.15Å; A233-S237 PolarHBondContact O-N 2.94Å; A233-S237 PolarHBondContact O-OG 3.5Å; A233-Y243 HydrophobicContact CB-CE2 4.37Å
234M94.4Very high94.5Very high33 Ų3350.7 Ų50.716%0.16331%0.31CS..Hα-helixtrans-66.7-46.8172.4-174.7-166.368.200111.4C230 A231 S232 S237 V238 Y276 F283C230-M234 PolarHBondContact O-N 3Å; A231-M234 WeakPolarHBondContact O-CB 3.49Å; A231-M234 PolarHBondContact O-N 3.46Å; A231-M234 VanDerWaalsContact O-N 3.09Å; S232-M234 VanDerWaalsContact C-N 3.25Å; S232-M234 PolarHBondContact O-N 3.08Å; M234-S237 PolarHBondContact O-N 3.44Å; M234-S237 PolarHBondContact O-OG 3.07Å; M234-V238 HydrophobicContact CG-CG2 4.45Å; M234-V238 WeakPolarHBondContact O-CB 3.47Å; M234-V238 WeakPolarHBondContact O-CG2 3.44Å; M234-V238 PolarHBondContact O-N 3.32Å; M234-V238 VanDerWaalsContact O-N 3.09Å; M234-Y276 HydrophobicContact CE-CD2 4.41Å; M234-Y276 HydrophobicContact CE-CE2 3.88Å; M234-Y276 HydrophobicContact SD-CD2 4.25Å; M234-Y276 HydrophobicContact SD-CE2 4.27Å; M234-F283 HydrophobicContact CB-CE2 4.32Å; M234-F283 HydrophobicContact CE-CD2 3.6Å; M234-F283 HydrophobicContact CE-CE2 4.06Å; M234-F283 HydrophobicContact SD-CD2 3.67Å; M234-F283 HydrophobicContact SD-CE2 3.57Å; M234-F283 VanDerWaalsContact SD-CE2 3.57Å
235Y94.3Very high94.5Very high0 Ų053.8 Ų53.80%033%0.325CS..Hα-helixtrans-66.8-41.9-179-65-58.1000112.8A231 S232 S237 V238 E239 W241 F249 Y276 N280A231-Y235 HydrophobicContact CB-CD2 4.49Å; A231-Y235 HydrophobicContact CB-CE2 4.02Å; A231-Y235 WeakPolarHBondContact O-CD2 3.14Å; A231-Y235 PolarHBondContact O-N 3.26Å; S232-Y235 PolarHBondContact O-N 3.2Å; Y235-S237 VanDerWaalsContact C-N 3.29Å; Y235-S237 PolarHBondContact O-N 3.44Å; Y235-V238 PolarHBondContact O-N 3.16Å; Y235-E239 HydrophobicContact CD1-CG 4.3Å; Y235-E239 WeakPolarHBondContact O-CA 3.32Å; Y235-E239 WeakPolarHBondContact O-CB 3.2Å; Y235-E239 PolarHBondContact O-N 3.48Å; Y235-W241 HydrophobicContact CD1-CZ3 4.32Å; Y235-W241 HydrophobicContact CG-CZ3 4.25Å; Y235-F249 HydrophobicContact CD1-CE1 4.3Å; Y235-F249 AromaticContact CD2-CD1 3.83Å; Y235-F249 HydrophobicContact CD2-CD1 3.83Å; Y235-F249 HydrophobicContact CD2-CE1 4.08Å; Y235-F249 AromaticContact CE1-CE1 3.87Å; Y235-F249 HydrophobicContact CE1-CE1 3.87Å; Y235-F249 AromaticContact CE2-CD1 3.74Å; Y235-F249 HydrophobicContact CE2-CD1 3.74Å; Y235-F249 AromaticContact CE2-CE1 3.6Å; Y235-F249 HydrophobicContact CE2-CE1 3.6Å; Y235-F249 HydrophobicContact CG-CD1 4.27Å; Y235-F249 HydrophobicContact CG-CE1 4.43Å; Y235-F249 AromaticContact CZ-CE1 3.51Å; Y235-Y276 HydrophobicContact CD1-CE2 4.47Å; Y235-Y276 HydrophobicContact CE1-CE2 4.47Å; Y235-Y276 WeakPolarHBondContact CE1-OH 3.48Å; Y235-N280 WeakPolarHBondContact CE1-OD1 3.34Å; Y235-N280 PolarHBondContact OH-OD1 2.92Å
236T94.6Very high94.6Very high44 Ų4449.5 Ų49.527%0.2730%0.299SS..Hα-helixtrans-56.8-44.2175.4-58.60000111.6S232 G240 W241 Y243 S246S232-T236 PolarHBondContact O-N 2.83Å; S232-T236 PolarHBondContact O-OG1 3.14Å; S232-T236 VanDerWaalsContact O-OG1 3.05Å; T236-G240 PolarHBondContact O-N 3.13Å; T236-W241 WeakPolarHBondContact CA-O 3.35Å; T236-W241 WeakPolarHBondContact CG2-O 3.43Å; T236-Y243 WeakPolarHBondContact OG1-CA 3.44Å; T236-S246 PolarHBondContact N-OG 3.47Å; T236-S246 WeakPolarHBondContact OG1-CB 3.35Å; T236-S246 PolarHBondContact OG1-OG 3.44Å; T236-S246 VanDerWaalsContact OG1-OG 3.05Å
237S90.9Very high94.6Very high95 Ų9547.1 Ų47.166%0.66429%0.287SS*.Hα-helixtrans-75.2-27.4-178.258.90000114.4A233 M234 Y235A233-S237 PolarHBondContact O-N 2.94Å; A233-S237 PolarHBondContact O-OG 3.5Å; M234-S237 PolarHBondContact O-N 3.44Å; M234-S237 PolarHBondContact O-OG 3.07Å; Y235-S237 VanDerWaalsContact C-N 3.29Å; Y235-S237 PolarHBondContact O-N 3.44Å
238V90.3Very high94.6Very high60 Ų6050.3 Ų50.336%0.36430%0.299SS..Hα-helixtrans-102.7-42.4-173.7-1800000113.3M234 Y235 Y270 Y276M234-V238 HydrophobicContact CG-CG2 4.45Å; M234-V238 WeakPolarHBondContact O-CB 3.47Å; M234-V238 WeakPolarHBondContact O-CG2 3.44Å; M234-V238 PolarHBondContact O-N 3.32Å; M234-V238 VanDerWaalsContact O-N 3.09Å; Y235-V238 PolarHBondContact O-N 3.16Å; V238-Y270 HydrophobicContact CG1-CD1 3.66Å; V238-Y270 HydrophobicContact CG1-CE1 3.86Å; V238-Y276 HydrophobicContact CB-CD2 4.1Å; V238-Y276 HydrophobicContact CB-CE2 3.93Å; V238-Y276 HydrophobicContact CG1-CD1 4.44Å; V238-Y276 HydrophobicContact CG1-CD2 3.6Å; V238-Y276 HydrophobicContact CG1-CE1 4.49Å; V238-Y276 HydrophobicContact CG1-CE2 3.63Å; V238-Y276 HydrophobicContact CG1-CG 4.03Å; V238-Y276 HydrophobicContact CG2-CD2 4.07Å; V238-Y276 HydrophobicContact CG2-CE2 4.29Å
239E88.7Confident94.6Very high13 Ų1349.5 Ų49.56%0.06129%0.293CS..Hα-helixtrans-92.5-10.5-178.1-60.7-71.5-177.600112.5Y235 W241 S264 S265 H267 Y270 Y276Y235-E239 HydrophobicContact CD1-CG 4.3Å; Y235-E239 WeakPolarHBondContact O-CA 3.32Å; Y235-E239 WeakPolarHBondContact O-CB 3.2Å; Y235-E239 PolarHBondContact O-N 3.48Å; E239-W241 HydrophobicContact CB-CD2 3.65Å; E239-W241 HydrophobicContact CB-CE3 4.07Å; E239-W241 HydrophobicContact CB-CG 4.03Å; E239-W241 HydrophobicContact CB-CH2 4.33Å; E239-W241 HydrophobicContact CB-CZ2 3.93Å; E239-W241 HydrophobicContact CB-CZ3 4.39Å; E239-W241 HydrophobicContact CG-CD2 4.39Å; E239-W241 HydrophobicContact CG-CE3 4.43Å; E239-W241 HydrophobicContact CG-CH2 4.06Å; E239-W241 HydrophobicContact CG-CZ2 4.01Å; E239-W241 HydrophobicContact CG-CZ3 4.26Å; E239-W241 PolarHBondContact O-N 2.77Å; E239-S264 WeakPolarHBondContact OE1-CA 3.4Å; E239-S265 PolarHBondContact OE1-N 3.34Å; E239-H267 IonicContact OE2-CE1 3.21Å; E239-H267 PolarHBondContact OE2-CE1 3.42Å; E239-H267 IonicContact OE2-ND1 2.75Å; E239-H267 PolarHBondContact OE2-ND1 3.09Å; E239-Y270 VanDerWaalsContact CD-OH 3.23Å; E239-Y270 PolarHBondContact OE1-OH 3.36Å; E239-Y270 PolarHBondContact OE2-OH 2.82Å; E239-Y276 PolarHBondContact OE1-OH 2.88Å
240G89.1Confident94.6Very high67 Ų6747.4 Ų47.469%0.69128%0.279SS*.  trans71.915.6178.800000114.2T236T236-G240 PolarHBondContact O-N 3.13Å
241W93.8Very high94.7Very high41 Ų4149.7 Ų49.716%0.15528%0.281CS..  trans-76.7154.4175.1-57-24.6000111.4Y235 T236 E239 D245 F249 L262Y235-W241 HydrophobicContact CD1-CZ3 4.32Å; Y235-W241 HydrophobicContact CG-CZ3 4.25Å; T236-W241 WeakPolarHBondContact CA-O 3.35Å; T236-W241 WeakPolarHBondContact CG2-O 3.43Å; E239-W241 HydrophobicContact CB-CD2 3.65Å; E239-W241 HydrophobicContact CB-CE3 4.07Å; E239-W241 HydrophobicContact CB-CG 4.03Å; E239-W241 HydrophobicContact CB-CH2 4.33Å; E239-W241 HydrophobicContact CB-CZ2 3.93Å; E239-W241 HydrophobicContact CB-CZ3 4.39Å; E239-W241 HydrophobicContact CG-CD2 4.39Å; E239-W241 HydrophobicContact CG-CE3 4.43Å; E239-W241 HydrophobicContact CG-CH2 4.06Å; E239-W241 HydrophobicContact CG-CZ2 4.01Å; E239-W241 HydrophobicContact CG-CZ3 4.26Å; E239-W241 PolarHBondContact O-N 2.77Å; W241-D245 HydrophobicContact CB-CB 4.33Å; W241-F249 HydrophobicContact CH2-CD1 4.43Å; W241-F249 HydrophobicContact CH2-CD2 4.27Å; W241-F249 HydrophobicContact CH2-CE2 4.44Å; W241-F249 HydrophobicContact CH2-CG 4.26Å; W241-F249 HydrophobicContact CZ3-CB 4.07Å; W241-F249 AromaticContact CZ3-CD1 3.74Å; W241-F249 HydrophobicContact CZ3-CD1 3.74Å; W241-F249 HydrophobicContact CZ3-CD2 4.16Å; W241-F249 HydrophobicContact CZ3-CE1 4.23Å; W241-F249 AromaticContact CZ3-CG 3.69Å; W241-F249 HydrophobicContact CZ3-CG 3.69Å; W241-L262 HydrophobicContact CD2-CD2 4.33Å; W241-L262 HydrophobicContact CH2-CB 4.27Å; W241-L262 HydrophobicContact CZ2-CB 4.39Å; W241-L262 HydrophobicContact CZ2-CD2 4.39Å
242D95.6Very high94.7Very high117 Ų11749.8 Ų49.863%0.62628%0.282SS*.  trans-60.6154168.7-74-34.7000111.1V244 D245 S246D242-V244 VanDerWaalsContact C-N 3.25Å; D242-V244 PolarHBondContact O-N 3.01Å; D242-D245 HydrophobicContact CB-CB 4.4Å; D242-D245 PolarHBondContact O-N 3.47Å; D242-S246 WeakPolarHBondContact O-CB 3.43Å; D242-S246 PolarHBondContact O-N 3.28Å; D242-S246 PolarHBondContact O-OG 3.24Å
243Y95.9Very high94.7Very high97 Ų9749.8 Ų49.838%0.3828%0.282SS..Hα-helixtrans-63.5-33.6-177.7-171-100.2000112.6C229 S232 A233 T236 L247C229-Y243 WeakPolarHBondContact CA-OH 3.17Å; C229-Y243 PolarHBondContact O-OH 3.43Å; S232-Y243 VanDerWaalsContact OG-CD2 3.31Å; S232-Y243 WeakPolarHBondContact OG-CD2 3.21Å; S232-Y243 VanDerWaalsContact OG-CE2 3.24Å; S232-Y243 WeakPolarHBondContact OG-CE2 3.4Å; S232-Y243 PolarHBondContact OG-O 2.9Å; S232-Y243 VanDerWaalsContact OG-O 3.08Å; A233-Y243 HydrophobicContact CB-CE2 4.37Å; T236-Y243 WeakPolarHBondContact OG1-CA 3.44Å; Y243-L247 HydrophobicContact CD1-CD1 3.87Å; Y243-L247 HydrophobicContact CD1-CG 4.29Å; Y243-L247 HydrophobicContact CE1-CD1 3.47Å; Y243-L247 VanDerWaalsContact CE1-CD1 3.47Å; Y243-L247 HydrophobicContact CE1-CG 3.91Å; Y243-L247 PolarHBondContact O-N 3.29Å
244V95.9Very high94.7Very high108 Ų10847.5 Ų47.566%0.65526%0.263SS*.Hα-helixtrans-68.6-45.7176.4179.40000110.4D242 S246 L247 Y248D242-V244 VanDerWaalsContact C-N 3.25Å; D242-V244 PolarHBondContact O-N 3.01Å; V244-S246 VanDerWaalsContact C-N 3.28Å; V244-S246 PolarHBondContact O-N 3.22Å; V244-L247 WeakPolarHBondContact O-CB 3.49Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.17Å; V244-Y248 WeakPolarHBondContact O-CB 3.44Å; V244-Y248 PolarHBondContact O-N 3.01Å
245D96.1Very high94.8Very high69 Ų6946.4 Ų46.437%0.36926%0.259SS..Hα-helixtrans-61.9-38.6175.8-69.3-5.2000111.6W241 D242 Y248 F249 L262W241-D245 HydrophobicContact CB-CB 4.33Å; D242-D245 HydrophobicContact CB-CB 4.4Å; D242-D245 PolarHBondContact O-N 3.47Å; D245-Y248 PolarHBondContact O-N 3.1Å; D245-F249 WeakPolarHBondContact O-CB 3.48Å; D245-F249 PolarHBondContact O-N 3.39Å; D245-L262 HydrophobicContact CB-CD1 3.94Å; D245-L262 WeakPolarHBondContact O-CD1 3.46Å
246S96.9Very high94.8Very high0 Ų048.6 Ų48.60%027%0.272CS..Hα-helixtrans-65.6-39.6175.4-620000112.1S232 T236 D242 V244 C250S232-S246 WeakPolarHBondContact OG-CB 3.38Å; T236-S246 PolarHBondContact N-OG 3.47Å; T236-S246 WeakPolarHBondContact OG1-CB 3.35Å; T236-S246 PolarHBondContact OG1-OG 3.44Å; T236-S246 VanDerWaalsContact OG1-OG 3.05Å; D242-S246 WeakPolarHBondContact O-CB 3.43Å; D242-S246 PolarHBondContact O-N 3.28Å; D242-S246 PolarHBondContact O-OG 3.24Å; V244-S246 VanDerWaalsContact C-N 3.28Å; V244-S246 PolarHBondContact O-N 3.22Å; S246-C250 PolarHBondContact O-N 2.99Å; S246-C250 PolarHBondContact O-SG 3.02Å
247L96.7Very high94.9Very high55 Ų5550.1 Ų50.129%0.28828%0.278SS..Hα-helixtrans-68.1-42.6172.9-83.8176.4000112S232 Y243 V244 F249 C250 F251S232-L247 PolarHBondContact OG-N 2.86Å; Y243-L247 HydrophobicContact CD1-CD1 3.87Å; Y243-L247 HydrophobicContact CD1-CG 4.29Å; Y243-L247 HydrophobicContact CE1-CD1 3.47Å; Y243-L247 VanDerWaalsContact CE1-CD1 3.47Å; Y243-L247 HydrophobicContact CE1-CG 3.91Å; Y243-L247 PolarHBondContact O-N 3.29Å; V244-L247 WeakPolarHBondContact O-CB 3.49Å; V244-L247 PolarHBondContact O-N 3.43Å; V244-L247 VanDerWaalsContact O-N 3.17Å; L247-F249 VanDerWaalsContact C-N 3.35Å; L247-C250 WeakPolarHBondContact O-CB 3.23Å; L247-C250 PolarHBondContact O-N 3.23Å; L247-F251 PolarHBondContact O-N 3.41Å
248Y96.9Very high95.1Very high81 Ų8145.9 Ų45.932%0.31825%0.249SC..Hα-helixtrans-59.6-46.3175163.5-98.5000110.7V244 D245 C250 F251 V252 F259 D261 L262V244-Y248 WeakPolarHBondContact O-CB 3.44Å; V244-Y248 PolarHBondContact O-N 3.01Å; D245-Y248 PolarHBondContact O-N 3.1Å; Y248-C250 VanDerWaalsContact C-N 3.34Å; Y248-C250 PolarHBondContact O-N 3.38Å; Y248-F251 PolarHBondContact O-N 3Å; Y248-V252 HydrophobicContact CD1-CG2 4.45Å; Y248-V252 HydrophobicContact CD2-CG2 3.86Å; Y248-V252 HydrophobicContact CE1-CG2 4.11Å; Y248-V252 HydrophobicContact CE2-CG2 3.47Å; Y248-V252 VanDerWaalsContact CE2-CG2 3.47Å; Y248-V252 HydrophobicContact CG-CG2 4.34Å; Y248-V252 WeakPolarHBondContact O-CB 3.48Å; Y248-V252 WeakPolarHBondContact O-CG2 3.39Å; Y248-V252 PolarHBondContact O-N 2.65Å; Y248-F259 VanDerWaalsContact OH-CD2 3.24Å; Y248-F259 WeakPolarHBondContact OH-CD2 3.47Å; Y248-D261 WeakPolarHBondContact CE1-OD2 3.34Å; Y248-D261 VanDerWaalsContact CZ-OD2 3.28Å; Y248-D261 PolarHBondContact OH-OD2 2.92Å; Y248-L262 HydrophobicContact CD1-CD1 3.89Å; Y248-L262 HydrophobicContact CE1-CD1 4.24Å
249F96.5Very high95.2Very high2 Ų249.2 Ų49.21%0.00926%0.259CS..Hα-helixtrans-56.4-45.8172.7171.5-102.3000112F132 Y235 W241 D245 L247 F251 V252 T253 L262F132-F249 HydrophobicContact CE1-CE2 4.12Å; F132-F249 AromaticContact CZ-CE2 3.92Å; F132-F249 HydrophobicContact CZ-CE2 3.92Å; F132-F249 HydrophobicContact CZ-CZ 4.36Å; Y235-F249 HydrophobicContact CD1-CE1 4.3Å; Y235-F249 AromaticContact CD2-CD1 3.83Å; Y235-F249 HydrophobicContact CD2-CD1 3.83Å; Y235-F249 HydrophobicContact CD2-CE1 4.08Å; Y235-F249 AromaticContact CE1-CE1 3.87Å; Y235-F249 HydrophobicContact CE1-CE1 3.87Å; Y235-F249 AromaticContact CE2-CD1 3.74Å; Y235-F249 HydrophobicContact CE2-CD1 3.74Å; Y235-F249 AromaticContact CE2-CE1 3.6Å; Y235-F249 HydrophobicContact CE2-CE1 3.6Å; Y235-F249 HydrophobicContact CG-CD1 4.27Å; Y235-F249 HydrophobicContact CG-CE1 4.43Å; Y235-F249 AromaticContact CZ-CE1 3.51Å; W241-F249 HydrophobicContact CH2-CD1 4.43Å; W241-F249 HydrophobicContact CH2-CD2 4.27Å; W241-F249 HydrophobicContact CH2-CE2 4.44Å; W241-F249 HydrophobicContact CH2-CG 4.26Å; W241-F249 HydrophobicContact CZ3-CB 4.07Å; W241-F249 AromaticContact CZ3-CD1 3.74Å; W241-F249 HydrophobicContact CZ3-CD1 3.74Å; W241-F249 HydrophobicContact CZ3-CD2 4.16Å; W241-F249 HydrophobicContact CZ3-CE1 4.23Å; W241-F249 AromaticContact CZ3-CG 3.69Å; W241-F249 HydrophobicContact CZ3-CG 3.69Å; D245-F249 WeakPolarHBondContact O-CB 3.48Å; D245-F249 PolarHBondContact O-N 3.39Å; L247-F249 VanDerWaalsContact C-N 3.35Å; F249-F251 PolarHBondContact O-N 3.43Å; F249-V252 PolarHBondContact O-N 3.29Å; F249-T253 WeakPolarHBondContact CD2-OG1 3.48Å; F249-T253 WeakPolarHBondContact CE2-OG1 3.37Å; F249-T253 HydrophobicContact CZ-CG2 4.44Å; F249-T253 WeakPolarHBondContact CZ-OG1 3.21Å; F249-T253 WeakPolarHBondContact O-CB 3.29Å; F249-T253 PolarHBondContact O-N 2.86Å; F249-T253 PolarHBondContact O-OG1 2.9Å; F249-L262 HydrophobicContact CB-CB 4.27Å; F249-L262 HydrophobicContact CB-CD1 4.19Å; F249-L262 HydrophobicContact CD2-CB 3.88Å; F249-L262 VanDerWaalsContact CD2-O 3.27Å; F249-L262 WeakPolarHBondContact CD2-O 3.34Å; F249-L262 VanDerWaalsContact CE2-O 3.29Å; F249-L262 WeakPolarHBondContact CE2-O 3.35Å; F249-L262 HydrophobicContact CG-CB 4.43Å
250C96.9Very high95.2Very high0 Ų048.9 Ų48.90%026%0.259CS..Hα-helixtrans-59.4-46.4176.7-68.70000111.3S246 L247 Y248 F254S246-C250 PolarHBondContact O-N 2.99Å; S246-C250 PolarHBondContact O-SG 3.02Å; L247-C250 WeakPolarHBondContact O-CB 3.23Å; L247-C250 PolarHBondContact O-N 3.23Å; Y248-C250 VanDerWaalsContact C-N 3.34Å; Y248-C250 PolarHBondContact O-N 3.38Å; C250-F254 HydrophobicContact CB-CD2 4.25Å; C250-F254 HydrophobicContact CB-CE2 3.89Å; C250-F254 HydrophobicContact CB-CZ 4.21Å; C250-F254 WeakPolarHBondContact O-CB 3.36Å; C250-F254 WeakPolarHBondContact O-CD2 3.46Å; C250-F254 WeakPolarHBondContact O-CG 3.44Å; C250-F254 PolarHBondContact O-N 3.39Å
251F96.6Very high95.3Very high111 Ų11150 Ų5049%0.48725%0.249SC..Hα-helixtrans-63-52.2178.1177.5-102.4000111.8L247 Y248 F249 T253 F254 S255 I257L247-F251 PolarHBondContact O-N 3.41Å; Y248-F251 PolarHBondContact O-N 3Å; F249-F251 PolarHBondContact O-N 3.43Å; F251-T253 VanDerWaalsContact C-N 3.26Å; F251-T253 PolarHBondContact O-N 3.16Å; F251-F254 PolarHBondContact O-N 3.35Å; F251-S255 WeakPolarHBondContact O-CB 3.47Å; F251-S255 PolarHBondContact O-N 2.86Å; F251-S255 PolarHBondContact O-OG 3.06Å; F251-I257 HydrophobicContact CE1-CD1 3.94Å
252V96.9Very high95.1Very high2 Ų249.6 Ų49.61%0.01225%0.25CC..Hα-helixtrans-59.1-38.1-179.5169.50000111.7Y248 F249 I257 G258 F259Y248-V252 HydrophobicContact CD1-CG2 4.45Å; Y248-V252 HydrophobicContact CD2-CG2 3.86Å; Y248-V252 HydrophobicContact CE1-CG2 4.11Å; Y248-V252 HydrophobicContact CE2-CG2 3.47Å; Y248-V252 VanDerWaalsContact CE2-CG2 3.47Å; Y248-V252 HydrophobicContact CG-CG2 4.34Å; Y248-V252 WeakPolarHBondContact O-CB 3.48Å; Y248-V252 WeakPolarHBondContact O-CG2 3.39Å; Y248-V252 PolarHBondContact O-N 2.65Å; F249-V252 PolarHBondContact O-N 3.29Å; V252-I257 HydrophobicContact CG1-CB 4.26Å; V252-I257 HydrophobicContact CG1-CG2 4.36Å; V252-I257 PolarHBondContact O-N 3.04Å; V252-G258 PolarHBondContact O-N 2.85Å; V252-F259 HydrophobicContact CG1-CB 4.28Å; V252-F259 HydrophobicContact CG1-CD2 3.87Å; V252-F259 HydrophobicContact CG1-CG 4.33Å; V252-F259 HydrophobicContact CG2-CD2 3.89Å; V252-F259 HydrophobicContact CG2-CE2 4.21Å
253T96.2Very high94.8Very high0 Ų044.6 Ų44.60%022%0.223CC..Hα-helixtrans-75.5-51179.4-58.10000111.9I130 F132 F249 F251 S255 T256 I284I130-T253 HydrophobicContact CD1-CG2 4.03Å; F132-T253 HydrophobicContact CZ-CG2 3.75Å; F132-T253 WeakPolarHBondContact CZ-OG1 3.41Å; F249-T253 WeakPolarHBondContact CD2-OG1 3.48Å; F249-T253 WeakPolarHBondContact CE2-OG1 3.37Å; F249-T253 HydrophobicContact CZ-CG2 4.44Å; F249-T253 WeakPolarHBondContact CZ-OG1 3.21Å; F249-T253 WeakPolarHBondContact O-CB 3.29Å; F249-T253 PolarHBondContact O-N 2.86Å; F249-T253 PolarHBondContact O-OG1 2.9Å; F251-T253 VanDerWaalsContact C-N 3.26Å; F251-T253 PolarHBondContact O-N 3.16Å; T253-S255 VanDerWaalsContact C-N 3.33Å; T253-S255 PolarHBondContact O-N 3.19Å; T253-T256 PolarHBondContact O-N 3.4Å; T253-T256 VanDerWaalsContact O-N 3.11Å; T253-I284 HydrophobicContact CG2-CD1 4.34Å; T253-I284 HydrophobicContact CG2-CG1 4.04Å; T253-I284 HydrophobicContact CG2-CG2 4.2Å
254F96.3Very high94.4Very high3 Ų340 Ų401%0.01321%0.205CC..Hα-helixtrans-71.9-28.2-174.6-60.4-13000112.8A231 C250 F251 T256 F283 I284 I291A231-F254 HydrophobicContact CB-CE2 4.47Å; A231-F254 HydrophobicContact CB-CZ 4.05Å; C250-F254 HydrophobicContact CB-CD2 4.25Å; C250-F254 HydrophobicContact CB-CE2 3.89Å; C250-F254 HydrophobicContact CB-CZ 4.21Å; C250-F254 WeakPolarHBondContact O-CB 3.36Å; C250-F254 WeakPolarHBondContact O-CD2 3.46Å; C250-F254 WeakPolarHBondContact O-CG 3.44Å; C250-F254 PolarHBondContact O-N 3.39Å; F251-F254 PolarHBondContact O-N 3.35Å; F254-T256 PolarHBondContact O-N 3.37Å; F254-F283 WeakPolarHBondContact CE1-O 3.38Å; F254-F283 WeakPolarHBondContact CZ-O 3.47Å; F254-I284 HydrophobicContact CE1-CG1 4.42Å; F254-I291 HydrophobicContact CB-CB 4.28Å; F254-I291 HydrophobicContact CB-CG1 3.65Å; F254-I291 WeakPolarHBondContact O-CB 3.16Å
255S95.8Very high93.8Very high10 Ų1035.7 Ų35.77%0.0718%0.18CC..THydrogen-bonded Turntrans-81.81172.964.60000113.9F251 T253 I257F251-S255 WeakPolarHBondContact O-CB 3.47Å; F251-S255 PolarHBondContact O-N 2.86Å; F251-S255 PolarHBondContact O-OG 3.06Å; T253-S255 VanDerWaalsContact C-N 3.33Å; T253-S255 PolarHBondContact O-N 3.19Å; S255-I257 PolarHBondContact O-N 3.43Å; S255-I257 VanDerWaalsContact OG-CD1 3.26Å; S255-I257 WeakPolarHBondContact OG-CD1 3.34Å; S255-I257 VanDerWaalsContact OG-CG1 3.31Å; S255-I257 WeakPolarHBondContact OG-CG1 3.42Å
256T95.3Very high92.8Very high45 Ų4534.3 Ų34.328%0.27617%0.171SC..THydrogen-bonded Turntrans57.133.2-179.175.60000113.2S128 I130 T253 F254 V288S128-T256 VanDerWaalsContact O-CG2 3.25Å; S128-T256 WeakPolarHBondContact O-CG2 3.44Å; I130-T256 HydrophobicContact CG1-CG2 3.97Å; T253-T256 PolarHBondContact O-N 3.4Å; T253-T256 VanDerWaalsContact O-N 3.11Å; F254-T256 PolarHBondContact O-N 3.37Å; T256-V288 HydrophobicContact CG2-CG1 3.81Å; T256-V288 HydrophobicContact CG2-CG2 4.45Å
257I96.2Very high91.7Very high77 Ų7738.8 Ų38.840%0.39519%0.192SC..  trans-78.3-48.8171.1-66.3169.7000109.4F251 V252 S255 F259F251-I257 HydrophobicContact CE1-CD1 3.94Å; V252-I257 HydrophobicContact CG1-CB 4.26Å; V252-I257 HydrophobicContact CG1-CG2 4.36Å; V252-I257 PolarHBondContact O-N 3.04Å; S255-I257 PolarHBondContact O-N 3.43Å; S255-I257 VanDerWaalsContact OG-CD1 3.26Å; S255-I257 WeakPolarHBondContact OG-CD1 3.34Å; S255-I257 VanDerWaalsContact OG-CG1 3.31Å; S255-I257 WeakPolarHBondContact OG-CG1 3.42Å; I257-F259 HydrophobicContact CG2-CD1 3.97Å; I257-F259 HydrophobicContact CG2-CD2 3.9Å; I257-F259 HydrophobicContact CG2-CE1 3.66Å; I257-F259 HydrophobicContact CG2-CE2 3.61Å; I257-F259 HydrophobicContact CG2-CG 4.09Å; I257-F259 HydrophobicContact CG2-CZ 3.48Å; I257-F259 VanDerWaalsContact CG2-CZ 3.48Å
258G94.8Very high90.2Very high6 Ų639.3 Ų39.36%0.06220%0.204CC..  trans56.556.6171.100000116I130 F132 V252 G260I130-G258 WeakPolarHBondContact O-CA 3.27Å; F132-G258 WeakPolarHBondContact CA-O 3.42Å; V252-G258 PolarHBondContact O-N 2.85Å; G258-G260 VanDerWaalsContact C-N 3.26Å; G258-G260 PolarHBondContact O-N 3.47Å
259F93Very high88.7Confident130 Ų13039.6 Ų39.657%0.5722%0.224SC*.  trans-60-32.6177.6-68.3-53.5000114.1Y248 V252 I257 D261Y248-F259 VanDerWaalsContact OH-CD2 3.24Å; Y248-F259 WeakPolarHBondContact OH-CD2 3.47Å; V252-F259 HydrophobicContact CG1-CB 4.28Å; V252-F259 HydrophobicContact CG1-CD2 3.87Å; V252-F259 HydrophobicContact CG1-CG 4.33Å; V252-F259 HydrophobicContact CG2-CD2 3.89Å; V252-F259 HydrophobicContact CG2-CE2 4.21Å; I257-F259 HydrophobicContact CG2-CD1 3.97Å; I257-F259 HydrophobicContact CG2-CD2 3.9Å; I257-F259 HydrophobicContact CG2-CE1 3.66Å; I257-F259 HydrophobicContact CG2-CE2 3.61Å; I257-F259 HydrophobicContact CG2-CG 4.09Å; I257-F259 HydrophobicContact CG2-CZ 3.48Å; I257-F259 VanDerWaalsContact CG2-CZ 3.48Å; F259-D261 VanDerWaalsContact C-N 3.28Å; F259-D261 PolarHBondContact O-N 3.11Å
260G88.9Confident87.8Confident6 Ų640.7 Ų40.76%0.06223%0.228CC..  trans80.17.1176.300000115.3F132 M134 G258F132-G260 WeakPolarHBondContact O-CA 3.22Å; M134-G260 WeakPolarHBondContact CG-O 3.46Å; G258-G260 VanDerWaalsContact C-N 3.26Å; G258-G260 PolarHBondContact O-N 3.47Å
261D89.5Confident86.7Confident91 Ų9152.5 Ų52.549%0.48727%0.272SS..SBendtrans-62-41.5166.653.1-14.2000112Y248 F259Y248-D261 WeakPolarHBondContact CE1-OD2 3.34Å; Y248-D261 VanDerWaalsContact CZ-OD2 3.28Å; Y248-D261 PolarHBondContact OH-OD2 2.92Å; F259-D261 VanDerWaalsContact C-N 3.28Å; F259-D261 PolarHBondContact O-N 3.11Å
262L90.4Very high85.9Confident31 Ų3152.4 Ų52.416%0.16228%0.277CS..SBendtrans-116.9129.2170.7-64.3172.6000110.2W241 D245 Y248 F249W241-L262 HydrophobicContact CD2-CD2 4.33Å; W241-L262 HydrophobicContact CH2-CB 4.27Å; W241-L262 HydrophobicContact CZ2-CB 4.39Å; W241-L262 HydrophobicContact CZ2-CD2 4.39Å; D245-L262 HydrophobicContact CB-CD1 3.94Å; D245-L262 WeakPolarHBondContact O-CD1 3.46Å; Y248-L262 HydrophobicContact CD1-CD1 3.89Å; Y248-L262 HydrophobicContact CE1-CD1 4.24Å; F249-L262 HydrophobicContact CB-CB 4.27Å; F249-L262 HydrophobicContact CB-CD1 4.19Å; F249-L262 HydrophobicContact CD2-CB 3.88Å; F249-L262 VanDerWaalsContact CD2-O 3.27Å; F249-L262 WeakPolarHBondContact CD2-O 3.34Å; F249-L262 VanDerWaalsContact CE2-O 3.29Å; F249-L262 WeakPolarHBondContact CE2-O 3.35Å; F249-L262 HydrophobicContact CG-CB 4.43Å
263V88.7Confident85.1Confident12 Ų1255.5 Ų55.57%0.07329%0.291CS..  trans-140.7123.2179.4-175.40000110.7Y121 F132 M134 Q266Y121-V263 HydrophobicContact CE1-CG1 4.02Å; Y121-V263 WeakPolarHBondContact OH-CG1 3.48Å; F132-V263 HydrophobicContact CB-CG2 4.1Å; F132-V263 HydrophobicContact CD1-CG2 4.22Å; F132-V263 HydrophobicContact CD2-CG1 4.35Å; F132-V263 HydrophobicContact CD2-CG2 4.47Å; F132-V263 HydrophobicContact CG-CG2 4.04Å; M134-V263 HydrophobicContact CB-CG2 4.48Å; M134-V263 HydrophobicContact CG-CG2 3.74Å; V263-Q266 HydrophobicContact CB-CG 3.94Å; V263-Q266 HydrophobicContact CG1-CG 3.86Å; V263-Q266 WeakPolarHBondContact O-CG 3.43Å
264S88.6Confident84.5Confident0 Ų058.1 Ų58.10%032%0.319CS..THydrogen-bonded Turntrans-65.5157175.762.50000112.7Y121 E239 Q266 Y276 N280Y121-S264 PolarHBondContact OH-OG 2.97Å; E239-S264 WeakPolarHBondContact OE1-CA 3.4Å; S264-Q266 VanDerWaalsContact C-N 3.29Å; S264-Q266 PolarHBondContact O-N 3.15Å; S264-Y276 WeakPolarHBondContact CB-OH 3.4Å; S264-N280 PolarHBondContact OG-ND2 3.35Å; S264-N280 PolarHBondContact OG-OD1 3.2Å
265S82.3Confident84.1Confident19 Ų1964 Ų6413%0.13335%0.349CS..THydrogen-bonded Turntrans64.424.8170.4-143.10000115.5E239 Y270E239-S265 PolarHBondContact OE1-N 3.34Å; S265-Y270 WeakPolarHBondContact CA-OH 3.45Å; S265-Y270 PolarHBondContact N-OH 3.2Å
266Q75.6Confident83.8Confident39 Ų3964.2 Ų64.218%0.18235%0.349CS..  trans-89.6-18.6178-63.5-61-62.400113.8L110 V263 S264 Y270L110-Q266 HydrophobicContact CD2-CB 4.19Å; V263-Q266 HydrophobicContact CB-CG 3.94Å; V263-Q266 HydrophobicContact CG1-CG 3.86Å; V263-Q266 WeakPolarHBondContact O-CG 3.43Å; S264-Q266 VanDerWaalsContact C-N 3.29Å; S264-Q266 PolarHBondContact O-N 3.15Å; Q266-Y270 PolarHBondContact N-OH 2.87Å
267H73.6Confident83.3Confident95 Ų9564.7 Ų64.744%0.4435%0.346SS..SBendtrans-69.1144.9-178.3-66.791.3000112.3E239 A269 Y270E239-H267 IonicContact OE2-CE1 3.21Å; E239-H267 PolarHBondContact OE2-CE1 3.42Å; E239-H267 IonicContact OE2-ND1 2.75Å; E239-H267 PolarHBondContact OE2-ND1 3.09Å; H267-A269 VanDerWaalsContact C-N 3.34Å; H267-A269 PolarHBondContact O-N 3.21Å; H267-Y270 HydrophobicContact CB-CD2 4.49Å; H267-Y270 HydrophobicContact CB-CE1 4.06Å; H267-Y270 HydrophobicContact CB-CE2 3.79Å; H267-Y270 PolarHBondContact N-OH 2.94Å; H267-Y270 VanDerWaalsContact N-OH 3.1Å; H267-Y270 AromaticContact ND1-CZ 3.93Å; H267-Y270 PolarHBondContact ND1-OH 3.17Å; H267-Y270 WeakPolarHBondContact O-CE2 3.48Å
268A64.5Low82.9Confident65 Ų6565.9 Ų65.954%0.53735%0.352SS..SBendtrans-64.9-35.4-176.700000112.9
269A66.6Low82.8Confident88 Ų8866.4 Ų66.473%0.72736%0.358SS*.  trans-135.9129.4179.200000110.9H267H267-A269 VanDerWaalsContact C-N 3.34Å; H267-A269 PolarHBondContact O-N 3.21Å
270Y76.6Confident82.8Confident24 Ų2460.5 Ų60.59%0.09433%0.332CS..  trans-117.7142.8169.1-68.8-84.6000108.2V238 E239 S265 Q266 H267 N272 Y276V238-Y270 HydrophobicContact CG1-CD1 3.66Å; V238-Y270 HydrophobicContact CG1-CE1 3.86Å; E239-Y270 VanDerWaalsContact CD-OH 3.23Å; E239-Y270 PolarHBondContact OE1-OH 3.36Å; E239-Y270 PolarHBondContact OE2-OH 2.82Å; S265-Y270 WeakPolarHBondContact CA-OH 3.45Å; S265-Y270 PolarHBondContact N-OH 3.2Å; Q266-Y270 PolarHBondContact N-OH 2.87Å; H267-Y270 HydrophobicContact CB-CD2 4.49Å; H267-Y270 HydrophobicContact CB-CE1 4.06Å; H267-Y270 HydrophobicContact CB-CE2 3.79Å; H267-Y270 PolarHBondContact N-OH 2.94Å; H267-Y270 VanDerWaalsContact N-OH 3.1Å; H267-Y270 AromaticContact ND1-CZ 3.93Å; H267-Y270 PolarHBondContact ND1-OH 3.17Å; H267-Y270 WeakPolarHBondContact O-CE2 3.48Å; Y270-N272 VanDerWaalsContact C-N 3.3Å; Y270-N272 PolarHBondContact O-N 3.04Å; Y270-Y276 HydrophobicContact CD1-CD1 4.23Å; Y270-Y276 HydrophobicContact CD1-CE1 4.45Å; Y270-Y276 HydrophobicContact CE1-CD1 4.27Å; Y270-Y276 HydrophobicContact CE1-CE1 4.03Å; Y270-Y276 HydrophobicContact CE2-CE1 4.5Å; Y270-Y276 HydrophobicContact CG-CD1 4.36Å
271R74.2Confident82.8Confident249 Ų24964.6 Ų64.694%0.9435%0.348SS*.THydrogen-bonded Turntrans-56.3-43.1-178.7-173.4142.664.1156.8-1.3112.7
272N80.1Confident83Confident108 Ų10864.6 Ų64.658%0.57835%0.348SS*.THydrogen-bonded Turntrans-12471.2176.1-69.9-22000110.9Y270 G274 L275 Y276Y270-N272 VanDerWaalsContact C-N 3.3Å; Y270-N272 PolarHBondContact O-N 3.04Å; N272-G274 PolarHBondContact O-N 3.34Å; N272-L275 HydrophobicContact CB-CB 4.37Å; N272-L275 PolarHBondContact O-N 2.96Å; N272-Y276 WeakPolarHBondContact O-CB 3.28Å; N272-Y276 PolarHBondContact O-N 3.15Å
273Q80.9Confident83.2Confident67 Ų6765.5 Ų65.531%0.31335%0.351SS..Hα-helixtrans-59.7-41.3-169.7-165.9171.128.700114.2R277Q273-R277 WeakPolarHBondContact O-CB 3.4Å; Q273-R277 WeakPolarHBondContact O-CD 3.44Å; Q273-R277 WeakPolarHBondContact O-CG 3.41Å; Q273-R277 PolarHBondContact O-N 3.25Å; Q273-R277 VanDerWaalsContact O-N 3.11Å
274G83Confident83.5Confident56 Ų5666 Ų6658%0.57735%0.353SS*.Hα-helixtrans-67.2-49-179.900000113.1N272 R277 L278N272-G274 PolarHBondContact O-N 3.34Å; G274-R277 PolarHBondContact O-N 3.32Å; G274-L278 PolarHBondContact O-N 2.89Å
275L87.2Confident83.7Confident126 Ų12669.4 Ų69.466%0.6637%0.37SS*.Hα-helixtrans-64.2-43.2-179.1-17269.9000111.5N272 L278 G279N272-L275 HydrophobicContact CB-CB 4.37Å; N272-L275 PolarHBondContact O-N 2.96Å; L275-L278 PolarHBondContact O-N 3.11Å; L275-G279 PolarHBondContact O-N 3.44Å
276Y88.9Confident84.2Confident15 Ų1571.7 Ų71.76%0.05938%0.381CS..Hα-helixtrans-62.4-44.2176.9174.9-107.4000111.8M234 Y235 V238 E239 S264 Y270 N272 L278 G279 N280M234-Y276 HydrophobicContact CE-CD2 4.41Å; M234-Y276 HydrophobicContact CE-CE2 3.88Å; M234-Y276 HydrophobicContact SD-CD2 4.25Å; M234-Y276 HydrophobicContact SD-CE2 4.27Å; Y235-Y276 HydrophobicContact CD1-CE2 4.47Å; Y235-Y276 HydrophobicContact CE1-CE2 4.47Å; Y235-Y276 WeakPolarHBondContact CE1-OH 3.48Å; V238-Y276 HydrophobicContact CB-CD2 4.1Å; V238-Y276 HydrophobicContact CB-CE2 3.93Å; V238-Y276 HydrophobicContact CG1-CD1 4.44Å; V238-Y276 HydrophobicContact CG1-CD2 3.6Å; V238-Y276 HydrophobicContact CG1-CE1 4.49Å; V238-Y276 HydrophobicContact CG1-CE2 3.63Å; V238-Y276 HydrophobicContact CG1-CG 4.03Å; V238-Y276 HydrophobicContact CG2-CD2 4.07Å; V238-Y276 HydrophobicContact CG2-CE2 4.29Å; E239-Y276 PolarHBondContact OE1-OH 2.88Å; S264-Y276 WeakPolarHBondContact CB-OH 3.4Å; Y270-Y276 HydrophobicContact CD1-CD1 4.23Å; Y270-Y276 HydrophobicContact CD1-CE1 4.45Å; Y270-Y276 HydrophobicContact CE1-CD1 4.27Å; Y270-Y276 HydrophobicContact CE1-CE1 4.03Å; Y270-Y276 HydrophobicContact CE2-CE1 4.5Å; Y270-Y276 HydrophobicContact CG-CD1 4.36Å; N272-Y276 WeakPolarHBondContact O-CB 3.28Å; N272-Y276 PolarHBondContact O-N 3.15Å; Y276-L278 PolarHBondContact O-N 3.4Å; Y276-G279 PolarHBondContact O-N 3.34Å; Y276-N280 WeakPolarHBondContact O-CB 3.5Å; Y276-N280 PolarHBondContact O-N 3.41Å
277R86.3Confident85.2Confident55 Ų5569.9 Ų69.921%0.20837%0.372CS..Hα-helixtrans-62.9-42.9178.4-76.4172.1176.3-163.2-5112.6P117 Q273 G274 F281P117-R277 VanDerWaalsContact CB-NH1 3.33Å; Q273-R277 WeakPolarHBondContact O-CB 3.4Å; Q273-R277 WeakPolarHBondContact O-CD 3.44Å; Q273-R277 WeakPolarHBondContact O-CG 3.41Å; Q273-R277 PolarHBondContact O-N 3.25Å; Q273-R277 VanDerWaalsContact O-N 3.11Å; G274-R277 PolarHBondContact O-N 3.32Å; R277-F281 WeakPolarHBondContact O-CB 3.04Å; R277-F281 PolarHBondContact O-N 3.48Å
278L88.3Confident86.2Confident101 Ų10165.6 Ų65.653%0.52935%0.353SS..Hα-helixtrans-63.7-46.9175.3-178.564.3000110.7G274 L275 Y276 F281 L282G274-L278 PolarHBondContact O-N 2.89Å; L275-L278 PolarHBondContact O-N 3.11Å; Y276-L278 PolarHBondContact O-N 3.4Å; L278-F281 PolarHBondContact O-N 3.07Å; L278-L282 HydrophobicContact CD1-CD1 4.36Å; L278-L282 HydrophobicContact CD1-CG 4.43Å; L278-L282 HydrophobicContact CG-CD1 4.12Å; L278-L282 WeakPolarHBondContact O-CB 3.2Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.44Å; L278-L282 PolarHBondContact O-N 2.91Å
279G91.6Very high87.6Confident18 Ų1862.6 Ų62.619%0.18633%0.328CS..Hα-helixtrans-58.9-47.4176.300000112.6L275 Y276 F281 L282 F283L275-G279 PolarHBondContact O-N 3.44Å; Y276-G279 PolarHBondContact O-N 3.34Å; G279-F281 PolarHBondContact O-N 3.46Å; G279-L282 PolarHBondContact O-N 3.37Å; G279-F283 WeakPolarHBondContact O-CB 3.49Å; G279-F283 VanDerWaalsContact O-CD2 3.23Å; G279-F283 WeakPolarHBondContact O-CD2 3.37Å; G279-F283 PolarHBondContact O-N 3.05Å
280N92.1Very high88.8Confident5 Ų558.6 Ų58.63%0.02729%0.294CS..Hα-helixtrans-57.2-49.2175.7-173.445.6000111.5Y235 S264 Y276 L282 F283 I284Y235-N280 WeakPolarHBondContact CE1-OD1 3.34Å; Y235-N280 PolarHBondContact OH-OD1 2.92Å; S264-N280 PolarHBondContact OG-ND2 3.35Å; S264-N280 PolarHBondContact OG-OD1 3.2Å; Y276-N280 WeakPolarHBondContact O-CB 3.5Å; Y276-N280 PolarHBondContact O-N 3.41Å; N280-L282 PolarHBondContact O-N 2.8Å; N280-F283 PolarHBondContact O-N 3.47Å; N280-I284 WeakPolarHBondContact O-CB 3.45Å; N280-I284 VanDerWaalsContact O-CG1 3.29Å; N280-I284 WeakPolarHBondContact O-CG1 3.23Å; N280-I284 PolarHBondContact O-N 2.91Å; N280-I284 WeakPolarHBondContact OD1-CD1 3.38Å
281F90.4Very high89.7Confident93 Ų9358.1 Ų58.141%0.40829%0.294SS..Hα-helixtrans-59-45.8176.7175.5-100000112F120 R277 L278 G279 L285F120-F281 HydrophobicContact CE1-CD2 4.01Å; F120-F281 AromaticContact CE1-CE2 3.87Å; F120-F281 HydrophobicContact CE1-CE2 3.87Å; F120-F281 HydrophobicContact CZ-CE2 4.09Å; R277-F281 WeakPolarHBondContact O-CB 3.04Å; R277-F281 PolarHBondContact O-N 3.48Å; L278-F281 PolarHBondContact O-N 3.07Å; G279-F281 PolarHBondContact O-N 3.46Å; F281-L285 HydrophobicContact CE1-CD2 4.13Å; F281-L285 HydrophobicContact CZ-CD2 4.28Å; F281-L285 VanDerWaalsContact O-CB 3.23Å; F281-L285 WeakPolarHBondContact O-CB 3.49Å; F281-L285 PolarHBondContact O-N 3.37Å
282L92.9Very high90.7Very high91 Ų9148.7 Ų48.748%0.47626%0.258SS..Hα-helixtrans-65.4-42.9179-70.3173.9000112.2L278 G279 N280 L285 L286L278-L282 HydrophobicContact CD1-CD1 4.36Å; L278-L282 HydrophobicContact CD1-CG 4.43Å; L278-L282 HydrophobicContact CG-CD1 4.12Å; L278-L282 WeakPolarHBondContact O-CB 3.2Å; L278-L282 VanDerWaalsContact O-CG 3.28Å; L278-L282 WeakPolarHBondContact O-CG 3.44Å; L278-L282 PolarHBondContact O-N 2.91Å; G279-L282 PolarHBondContact O-N 3.37Å; N280-L282 PolarHBondContact O-N 2.8Å; L282-L285 PolarHBondContact O-N 2.86Å; L282-L286 WeakPolarHBondContact O-CB 3.36Å; L282-L286 PolarHBondContact O-N 3.18Å
283F95.4Very high91.3Very high50 Ų5043.5 Ų43.522%0.21923%0.231CC..Hα-helixtrans-65.1-44.5177.3-82.5-56.2000112L227 C230 A231 M234 F254 G279 N280 G287L227-F283 HydrophobicContact CD1-CD1 3.8Å; L227-F283 HydrophobicContact CD1-CE1 3.98Å; C230-F283 HydrophobicContact CB-CE1 4.32Å; A231-F283 HydrophobicContact CB-CB 4.28Å; A231-F283 HydrophobicContact CB-CD1 3.81Å; A231-F283 HydrophobicContact CB-CD2 4.47Å; A231-F283 HydrophobicContact CB-CE1 4.24Å; A231-F283 HydrophobicContact CB-CG 3.96Å; M234-F283 HydrophobicContact CB-CE2 4.32Å; M234-F283 HydrophobicContact CE-CD2 3.6Å; M234-F283 HydrophobicContact CE-CE2 4.06Å; M234-F283 HydrophobicContact SD-CD2 3.67Å; M234-F283 HydrophobicContact SD-CE2 3.57Å; M234-F283 VanDerWaalsContact SD-CE2 3.57Å; F254-F283 WeakPolarHBondContact CE1-O 3.38Å; F254-F283 WeakPolarHBondContact CZ-O 3.47Å; G279-F283 WeakPolarHBondContact O-CB 3.49Å; G279-F283 VanDerWaalsContact O-CD2 3.23Å; G279-F283 WeakPolarHBondContact O-CD2 3.37Å; G279-F283 PolarHBondContact O-N 3.05Å; N280-F283 PolarHBondContact O-N 3.47Å; F283-G287 WeakPolarHBondContact O-CA 3.49Å; F283-G287 PolarHBondContact O-N 3.11Å
284I94.3Very high91.8Very high22 Ų2241.5 Ų41.511%0.11322%0.222CC..Hα-helixtrans-62.8-48.6176-67172.3000110.3Y121 I130 T253 F254 N280 G287 V288Y121-I284 HydrophobicContact CE2-CD1 4.23Å; I130-I284 HydrophobicContact CD1-CG2 3.98Å; T253-I284 HydrophobicContact CG2-CD1 4.34Å; T253-I284 HydrophobicContact CG2-CG1 4.04Å; T253-I284 HydrophobicContact CG2-CG2 4.2Å; F254-I284 HydrophobicContact CE1-CG1 4.42Å; N280-I284 WeakPolarHBondContact O-CB 3.45Å; N280-I284 VanDerWaalsContact O-CG1 3.29Å; N280-I284 WeakPolarHBondContact O-CG1 3.23Å; N280-I284 PolarHBondContact O-N 2.91Å; N280-I284 WeakPolarHBondContact OD1-CD1 3.38Å; I284-G287 PolarHBondContact O-N 2.86Å; I284-V288 HydrophobicContact CG2-CG2 4.22Å; I284-V288 WeakPolarHBondContact O-CB 3.1Å; I284-V288 WeakPolarHBondContact O-CG2 3.41Å; I284-V288 PolarHBondContact O-N 3.06Å
285L92.4Very high92.4Very high71 Ų7143.4 Ų43.437%0.37221%0.214SC..Hα-helixtrans-59.4-51.9179.9-18064.7000111.5F281 L282 C289F281-L285 HydrophobicContact CE1-CD2 4.13Å; F281-L285 HydrophobicContact CZ-CD2 4.28Å; F281-L285 VanDerWaalsContact O-CB 3.23Å; F281-L285 WeakPolarHBondContact O-CB 3.49Å; F281-L285 PolarHBondContact O-N 3.37Å; L282-L285 PolarHBondContact O-N 2.86Å; L285-C289 WeakPolarHBondContact O-CB 3.39Å; L285-C289 PolarHBondContact O-N 2.8Å; L285-C289 VanDerWaalsContact O-N 3.07Å; L285-C289 PolarHBondContact O-SG 2.79Å
286L93.9Very high92.6Very high68 Ų6839.5 Ų39.536%0.35619%0.194SC..Hα-helixtrans-66.6-39.2-179-175.461.2000111.7F223 L227 L282 C289 C290F223-L286 HydrophobicContact CZ-CD2 4.28Å; L227-L286 HydrophobicContact CD1-CD2 3.65Å; L227-L286 HydrophobicContact CD1-CG 4.2Å; L227-L286 HydrophobicContact CD2-CB 4.21Å; L227-L286 HydrophobicContact CD2-CD2 4.06Å; L227-L286 HydrophobicContact CD2-CG 3.7Å; L282-L286 WeakPolarHBondContact O-CB 3.36Å; L282-L286 PolarHBondContact O-N 3.18Å; L286-C289 PolarHBondContact O-N 2.9Å; L286-C290 VanDerWaalsContact O-CB 3.23Å; L286-C290 WeakPolarHBondContact O-CB 3.06Å; L286-C290 PolarHBondContact O-N 3.27Å
287G95.4Very high92.6Very high0 Ų039 Ų390%019%0.193CC..Hα-helixtrans-62.2-52.1178.500000112.1F283 I284 C289 C290 I291F283-G287 WeakPolarHBondContact O-CA 3.49Å; F283-G287 PolarHBondContact O-N 3.11Å; I284-G287 PolarHBondContact O-N 2.86Å; G287-C289 PolarHBondContact O-N 2.85Å; G287-C290 PolarHBondContact O-N 3.09Å; G287-I291 WeakPolarHBondContact O-CG1 3.38Å; G287-I291 PolarHBondContact O-N 2.99Å
288V95.3Very high92.8Very high5 Ų539.3 Ų39.33%0.0320%0.198CC..Hα-helixtrans-61.3-44.5177.3178.50000110.9I130 F161 T256 I284 C290 I291 Y292I130-V288 HydrophobicContact CD1-CG2 4.06Å; F161-V288 HydrophobicContact CE1-CG1 3.98Å; F161-V288 HydrophobicContact CE2-CG1 4.04Å; F161-V288 HydrophobicContact CZ-CB 4.4Å; F161-V288 HydrophobicContact CZ-CG1 3.36Å; T256-V288 HydrophobicContact CG2-CG1 3.81Å; T256-V288 HydrophobicContact CG2-CG2 4.45Å; I284-V288 HydrophobicContact CG2-CG2 4.22Å; I284-V288 WeakPolarHBondContact O-CB 3.1Å; I284-V288 WeakPolarHBondContact O-CG2 3.41Å; I284-V288 PolarHBondContact O-N 3.06Å; V288-C290 VanDerWaalsContact C-N 3.29Å; V288-C290 PolarHBondContact O-N 3.34Å; V288-I291 PolarHBondContact O-N 3.41Å; V288-Y292 WeakPolarHBondContact O-CB 3.21Å; V288-Y292 PolarHBondContact O-N 3.26Å
289C93.4Very high93Very high3 Ų336.5 Ų36.52%0.0219%0.187CC..Hα-helixtrans-59.4-41176.6-70.40000112.6F164 L285 L286 G287 S293F164-C289 HydrophobicContact CD1-CB 3.77Å; F164-C289 HydrophobicContact CE1-CB 3.45Å; F164-C289 VanDerWaalsContact CE1-CB 3.45Å; F164-C289 HydrophobicContact CE2-CB 4.37Å; F164-C289 HydrophobicContact CG-CB 4.36Å; F164-C289 HydrophobicContact CZ-CB 3.78Å; L285-C289 WeakPolarHBondContact O-CB 3.39Å; L285-C289 PolarHBondContact O-N 2.8Å; L285-C289 VanDerWaalsContact O-N 3.07Å; L285-C289 PolarHBondContact O-SG 2.79Å; L286-C289 PolarHBondContact O-N 2.9Å; G287-C289 PolarHBondContact O-N 2.85Å; C289-S293 WeakPolarHBondContact O-CB 3.23Å; C289-S293 PolarHBondContact O-N 2.77Å; C289-S293 VanDerWaalsContact O-N 3.15Å; C289-S293 PolarHBondContact O-OG 3.47Å
290C93.3Very high92.8Very high3 Ų339 Ų392%0.0220%0.195CC..Hα-helixtrans-69.8-48.9-179.2-1720000111.8A224 L227 L286 G287 V288 S293 L294A224-C290 VanDerWaalsContact CB-SG 3.54Å; L227-C290 HydrophobicContact CD2-CB 4.33Å; L286-C290 VanDerWaalsContact O-CB 3.23Å; L286-C290 WeakPolarHBondContact O-CB 3.06Å; L286-C290 PolarHBondContact O-N 3.27Å; G287-C290 PolarHBondContact O-N 3.09Å; V288-C290 VanDerWaalsContact C-N 3.29Å; V288-C290 PolarHBondContact O-N 3.34Å; C290-S293 WeakPolarHBondContact O-CB 3.34Å; C290-S293 PolarHBondContact O-N 2.88Å; C290-L294 PolarHBondContact O-N 3.06Å
291I94.8Very high92.7Very high15 Ų1540 Ų408%0.07720%0.201CC..Hα-helixtrans-66.5-39.9178.8-67.1-62.2000111.5A224 F254 G287 V288 S293 L294 F295A224-I291 HydrophobicContact CB-CD1 4.05Å; F254-I291 HydrophobicContact CB-CB 4.28Å; F254-I291 HydrophobicContact CB-CG1 3.65Å; F254-I291 WeakPolarHBondContact O-CB 3.16Å; G287-I291 WeakPolarHBondContact O-CG1 3.38Å; G287-I291 PolarHBondContact O-N 2.99Å; V288-I291 PolarHBondContact O-N 3.41Å; I291-S293 VanDerWaalsContact C-N 3.26Å; I291-S293 PolarHBondContact O-N 3.3Å; I291-L294 HydrophobicContact CD1-CD2 4.19Å; I291-L294 WeakPolarHBondContact O-CB 3.42Å; I291-L294 PolarHBondContact O-N 3.44Å; I291-L294 VanDerWaalsContact O-N 3.11Å; I291-F295 HydrophobicContact CG2-CD1 4.34Å; I291-F295 HydrophobicContact CG2-CD2 4Å; I291-F295 HydrophobicContact CG2-CE1 3.96Å; I291-F295 HydrophobicContact CG2-CE2 3.59Å; I291-F295 HydrophobicContact CG2-CG 4.36Å; I291-F295 HydrophobicContact CG2-CZ 3.58Å; I291-F295 WeakPolarHBondContact O-CG 3.34Å; I291-F295 PolarHBondContact O-N 3.17Å
292Y94Very high92.6Very high50 Ų5039.9 Ų39.920%0.19620%0.203CC..Hα-helixtrans-55.2-45.8171.8178.3-89000111.3F161 N162 V288 L294 F295 N296F161-Y292 HydrophobicContact CB-CD1 3.46Å; F161-Y292 VanDerWaalsContact CB-CD1 3.46Å; F161-Y292 HydrophobicContact CB-CD2 4.1Å; F161-Y292 HydrophobicContact CB-CE1 3.32Å; F161-Y292 HydrophobicContact CB-CE2 4.01Å; F161-Y292 HydrophobicContact CB-CG 3.83Å; F161-Y292 AromaticContact CD2-CD2 3.78Å; F161-Y292 HydrophobicContact CD2-CD2 3.78Å; F161-Y292 HydrophobicContact CD2-CE2 4.02Å; F161-Y292 HydrophobicContact CD2-CG 4.05Å; F161-Y292 HydrophobicContact CE2-CD2 4.47Å; F161-Y292 HydrophobicContact CG-CD1 4.08Å; F161-Y292 HydrophobicContact CG-CD2 4.14Å; F161-Y292 HydrophobicContact CG-CE1 4.32Å; F161-Y292 HydrophobicContact CG-CE2 4.39Å; F161-Y292 AromaticContact CG-CG 3.96Å; F161-Y292 HydrophobicContact CG-CG 3.96Å; N162-Y292 PolarHBondContact OD1-OH 2.94Å; V288-Y292 WeakPolarHBondContact O-CB 3.21Å; V288-Y292 PolarHBondContact O-N 3.26Å; Y292-L294 VanDerWaalsContact C-N 3.32Å; Y292-L294 PolarHBondContact O-N 3.36Å; Y292-F295 PolarHBondContact O-N 3.14Å; Y292-N296 VanDerWaalsContact CD1-ND2 3.25Å; Y292-N296 WeakPolarHBondContact CD1-ND2 3.28Å; Y292-N296 WeakPolarHBondContact CE1-ND2 3.49Å; Y292-N296 PolarHBondContact O-N 3.23Å; Y292-N296 PolarHBondContact O-ND2 3.11Å
293S92.6Very high92.4Very high0 Ų041.3 Ų41.30%021%0.205CC..Hα-helixtrans-64.2-40.2178.6-59.50000111.5C289 C290 I291 N296 V297C289-S293 WeakPolarHBondContact O-CB 3.23Å; C289-S293 PolarHBondContact O-N 2.77Å; C289-S293 VanDerWaalsContact O-N 3.15Å; C289-S293 PolarHBondContact O-OG 3.47Å; C290-S293 WeakPolarHBondContact O-CB 3.34Å; C290-S293 PolarHBondContact O-N 2.88Å; I291-S293 VanDerWaalsContact C-N 3.26Å; I291-S293 PolarHBondContact O-N 3.3Å; S293-N296 PolarHBondContact O-N 3.25Å; S293-V297 WeakPolarHBondContact O-CG2 3.48Å; S293-V297 PolarHBondContact O-N 3.01Å
294L93.4Very high92.1Very high25 Ų2542.8 Ų42.813%0.13121%0.213CC..Hα-helixtrans-62.7-47.8177.1-173.868.7000111.5L217 L220 C290 I291 Y292 N296 V297 I298L217-L294 HydrophobicContact CD1-CD1 3.64Å; L220-L294 HydrophobicContact CD2-CB 4.25Å; L220-L294 HydrophobicContact CD2-CD1 4.41Å; L220-L294 HydrophobicContact CG-CD1 4.37Å; C290-L294 PolarHBondContact O-N 3.06Å; I291-L294 HydrophobicContact CD1-CD2 4.19Å; I291-L294 WeakPolarHBondContact O-CB 3.42Å; I291-L294 PolarHBondContact O-N 3.44Å; I291-L294 VanDerWaalsContact O-N 3.11Å; Y292-L294 VanDerWaalsContact C-N 3.32Å; Y292-L294 PolarHBondContact O-N 3.36Å; L294-N296 VanDerWaalsContact C-N 3.31Å; L294-N296 PolarHBondContact O-N 3.18Å; L294-V297 PolarHBondContact O-N 2.89Å; L294-I298 HydrophobicContact CD1-CD1 4.43Å; L294-I298 HydrophobicContact CD2-CD1 4.45Å; L294-I298 HydrophobicContact CG-CD1 3.89Å; L294-I298 VanDerWaalsContact O-CG1 3.28Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 3.37Å
295F93.8Very high91.8Very high95 Ų9545.5 Ų45.542%0.41723%0.23SC..Hα-helixtrans-60-40.2176.3-71.2-14.9000112.3I291 Y292 I298 S299I291-F295 HydrophobicContact CG2-CD1 4.34Å; I291-F295 HydrophobicContact CG2-CD2 4Å; I291-F295 HydrophobicContact CG2-CE1 3.96Å; I291-F295 HydrophobicContact CG2-CE2 3.59Å; I291-F295 HydrophobicContact CG2-CG 4.36Å; I291-F295 HydrophobicContact CG2-CZ 3.58Å; I291-F295 WeakPolarHBondContact O-CG 3.34Å; I291-F295 PolarHBondContact O-N 3.17Å; Y292-F295 PolarHBondContact O-N 3.14Å; F295-I298 HydrophobicContact CD1-CD1 4.49Å; F295-I298 PolarHBondContact O-N 3.4Å; F295-S299 WeakPolarHBondContact O-CB 3.47Å; F295-S299 PolarHBondContact O-N 2.94Å
296N91.5Very high91.6Very high45 Ų4542.7 Ų42.724%0.24122%0.216CC..Hα-helixtrans-62.1-44.3174.8-84.8-76.4000112.2L165 Y292 S293 L294 S299 I300L165-N296 HydrophobicContact CD1-CB 4.47Å; L165-N296 HydrophobicContact CD2-CB 3.67Å; Y292-N296 VanDerWaalsContact CD1-ND2 3.25Å; Y292-N296 WeakPolarHBondContact CD1-ND2 3.28Å; Y292-N296 WeakPolarHBondContact CE1-ND2 3.49Å; Y292-N296 PolarHBondContact O-N 3.23Å; Y292-N296 PolarHBondContact O-ND2 3.11Å; S293-N296 PolarHBondContact O-N 3.25Å; L294-N296 VanDerWaalsContact C-N 3.31Å; L294-N296 PolarHBondContact O-N 3.18Å; N296-S299 WeakPolarHBondContact O-CB 3.37Å; N296-S299 PolarHBondContact O-N 3.29Å; N296-S299 PolarHBondContact O-OG 2.97Å; N296-I300 PolarHBondContact O-N 2.79Å
297V89.4Confident91.3Very high5 Ų542 Ų423%0.0321%0.212CC..Hα-helixtrans-65.5-42176.3176.60000111.3V213 V216 L217 L220 S293 L294 S299 I300 L301V213-V297 HydrophobicContact CG1-CG1 3.9Å; V216-V297 HydrophobicContact CG1-CG1 4.4Å; V216-V297 HydrophobicContact CG1-CG2 4.16Å; L217-V297 HydrophobicContact CB-CG1 4Å; L217-V297 HydrophobicContact CD1-CB 4.34Å; L217-V297 HydrophobicContact CD1-CG1 3.85Å; L220-V297 HydrophobicContact CD2-CG2 4.34Å; S293-V297 WeakPolarHBondContact O-CG2 3.48Å; S293-V297 PolarHBondContact O-N 3.01Å; L294-V297 PolarHBondContact O-N 2.89Å; V297-S299 VanDerWaalsContact C-N 3.28Å; V297-S299 PolarHBondContact O-N 3.48Å; V297-I300 WeakPolarHBondContact O-CB 3.45Å; V297-I300 PolarHBondContact O-N 3.24Å; V297-I300 VanDerWaalsContact O-N 3.16Å; V297-L301 PolarHBondContact O-N 3.08Å
298I91.6Very high90.9Very high60 Ų6049.4 Ų49.431%0.30824%0.241SC..Hα-helixtrans-60.2-39.6175.3-69.3169.3000110.7L217 L294 F295 I300 L301 I302L217-I298 HydrophobicContact CD1-CD1 4.38Å; L217-I298 HydrophobicContact CD1-CG1 3.58Å; L294-I298 HydrophobicContact CD1-CD1 4.43Å; L294-I298 HydrophobicContact CD2-CD1 4.45Å; L294-I298 HydrophobicContact CG-CD1 3.89Å; L294-I298 VanDerWaalsContact O-CG1 3.28Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 3.37Å; F295-I298 HydrophobicContact CD1-CD1 4.49Å; F295-I298 PolarHBondContact O-N 3.4Å; I298-I300 PolarHBondContact O-N 2.89Å; I298-L301 WeakPolarHBondContact O-CA 3.42Å; I298-L301 WeakPolarHBondContact O-CB 3.47Å; I298-L301 PolarHBondContact O-N 3.46Å; I298-I302 HydrophobicContact CG2-CD1 3.87Å; I298-I302 HydrophobicContact CG2-CG1 4.2Å; I298-I302 WeakPolarHBondContact O-CG1 3.43Å; I298-I302 PolarHBondContact O-N 3.02Å
299S90.8Very high90.4Very high43 Ų4351.5 Ų51.530%0.30125%0.25SS..Hα-helixtrans-58.6-34.6177.784.90000112.5F295 N296 V297 I302 K303F295-S299 WeakPolarHBondContact O-CB 3.47Å; F295-S299 PolarHBondContact O-N 2.94Å; N296-S299 WeakPolarHBondContact O-CB 3.37Å; N296-S299 PolarHBondContact O-N 3.29Å; N296-S299 PolarHBondContact O-OG 2.97Å; V297-S299 VanDerWaalsContact C-N 3.28Å; V297-S299 PolarHBondContact O-N 3.48Å; S299-I302 PolarHBondContact O-N 3.42Å; S299-K303 WeakPolarHBondContact O-CG 3.42Å; S299-K303 PolarHBondContact O-N 2.76Å
300I88.4Confident90Very high70 Ų7052.3 Ų52.336%0.35925%0.254SS..Hα-helixtrans-66.4-41.3175.7-60.7169000110N296 V297 I298 K303 Q304N296-I300 PolarHBondContact O-N 2.79Å; V297-I300 WeakPolarHBondContact O-CB 3.45Å; V297-I300 PolarHBondContact O-N 3.24Å; V297-I300 VanDerWaalsContact O-N 3.16Å; I298-I300 PolarHBondContact O-N 2.89Å; I300-K303 PolarHBondContact O-N 3.25Å; I300-Q304 WeakPolarHBondContact O-CG 3.26Å; I300-Q304 PolarHBondContact O-N 3.48Å
301L89.3Confident89.5Confident27 Ų2760.3 Ų60.314%0.14128%0.284CS..Hα-helixtrans-66.7-42.1176.3-63.9-175.2000111.9V213 Y214 L217 V297 I298 K303 Q304 V305V213-L301 HydrophobicContact CB-CD2 4.24Å; V213-L301 HydrophobicContact CG1-CD2 3.74Å; V213-L301 HydrophobicContact CG1-CG 4.23Å; Y214-L301 HydrophobicContact CD1-CD1 4.42Å; Y214-L301 HydrophobicContact CD1-CD2 4.35Å; Y214-L301 HydrophobicContact CE1-CD1 4.31Å; Y214-L301 HydrophobicContact CE1-CD2 3.87Å; L217-L301 HydrophobicContact CD2-CD1 3.66Å; V297-L301 PolarHBondContact O-N 3.08Å; I298-L301 WeakPolarHBondContact O-CA 3.42Å; I298-L301 WeakPolarHBondContact O-CB 3.47Å; I298-L301 PolarHBondContact O-N 3.46Å; L301-K303 VanDerWaalsContact C-N 3.29Å; L301-K303 PolarHBondContact O-N 3.39Å; L301-Q304 WeakPolarHBondContact O-CB 3.31Å; L301-Q304 PolarHBondContact O-N 2.9Å; L301-Q304 VanDerWaalsContact O-N 3.1Å; L301-V305 WeakPolarHBondContact O-CG2 3.31Å; L301-V305 PolarHBondContact O-N 3.38Å
302I89.6Confident88.9Confident90 Ų9064.8 Ų64.846%0.46230%0.303SS..Hα-helixtrans-57.8-45.1174.9-66.3170.5000110L42 I298 S299 Q304 V305 L306L42-I302 HydrophobicContact CD1-CG2 4.28Å; I298-I302 HydrophobicContact CG2-CD1 3.87Å; I298-I302 HydrophobicContact CG2-CG1 4.2Å; I298-I302 WeakPolarHBondContact O-CG1 3.43Å; I298-I302 PolarHBondContact O-N 3.02Å; S299-I302 PolarHBondContact O-N 3.42Å; I302-Q304 PolarHBondContact O-N 3.38Å; I302-V305 PolarHBondContact O-N 2.87Å; I302-L306 WeakPolarHBondContact O-CB 3.49Å; I302-L306 PolarHBondContact O-N 2.85Å
303K87.8Confident88.2Confident120 Ų12066.7 Ų66.752%0.52232%0.316SS..Hα-helixtrans-59.2-42.9174.6-72.6174.5-178-177.50112.3S299 I300 L301 L306 N307S299-K303 WeakPolarHBondContact O-CG 3.42Å; S299-K303 PolarHBondContact O-N 2.76Å; I300-K303 PolarHBondContact O-N 3.25Å; L301-K303 VanDerWaalsContact C-N 3.29Å; L301-K303 PolarHBondContact O-N 3.39Å; K303-L306 PolarHBondContact O-N 2.88Å; K303-N307 WeakPolarHBondContact O-CB 3.32Å; K303-N307 VanDerWaalsContact O-CG 3.28Å; K303-N307 PolarHBondContact O-N 3.42Å; K303-N307 PolarHBondContact O-ND2 3.4Å
304Q88.2Confident87.2Confident82 Ų8269.8 Ų69.838%0.38334%0.338SS..Hα-helixtrans-62.9-43.8177.4-72174.22.900112I300 L301 I302 N307 W308I300-Q304 WeakPolarHBondContact O-CG 3.26Å; I300-Q304 PolarHBondContact O-N 3.48Å; L301-Q304 WeakPolarHBondContact O-CB 3.31Å; L301-Q304 PolarHBondContact O-N 2.9Å; L301-Q304 VanDerWaalsContact O-N 3.1Å; I302-Q304 PolarHBondContact O-N 3.38Å; Q304-N307 PolarHBondContact O-N 3.07Å; Q304-W308 WeakPolarHBondContact O-CB 3.35Å; Q304-W308 PolarHBondContact O-N 3.25Å
305V88.2Confident85.5Confident78 Ų7873 Ų7347%0.47336%0.362SS..Hα-helixtrans-65.6-42.8177.4173.40000111L301 I302 N307 W308 M309L301-V305 WeakPolarHBondContact O-CG2 3.31Å; L301-V305 PolarHBondContact O-N 3.38Å; I302-V305 PolarHBondContact O-N 2.87Å; V305-N307 PolarHBondContact O-N 2.93Å; V305-W308 WeakPolarHBondContact O-CB 3.42Å; V305-W308 PolarHBondContact O-N 3.25Å; V305-M309 HydrophobicContact CG1-CE 4.09Å; V305-M309 WeakPolarHBondContact O-CG 3.35Å; V305-M309 PolarHBondContact O-N 3.06Å
306L88.6Confident83.8Confident13 Ų1377 Ų777%0.06837%0.374CS..Hα-helixtrans-58.9-47.5176.6-17370.5000111.7R38 L41 L42 L45 I302 K303 W308 M309 L310R38-L306 HydrophobicContact CB-CD2 3.89Å; R38-L306 HydrophobicContact CG-CD2 4.23Å; L41-L306 HydrophobicContact CB-CD1 4.03Å; L41-L306 HydrophobicContact CD2-CD1 3.54Å; L41-L306 HydrophobicContact CG-CD1 3.64Å; L42-L306 HydrophobicContact CB-CD1 4.42Å; L42-L306 HydrophobicContact CB-CD2 4.25Å; L45-L306 HydrophobicContact CD1-CD1 4.3Å; I302-L306 WeakPolarHBondContact O-CB 3.49Å; I302-L306 PolarHBondContact O-N 2.85Å; K303-L306 PolarHBondContact O-N 2.88Å; L306-W308 VanDerWaalsContact C-N 3.31Å; L306-W308 PolarHBondContact O-N 3.44Å; L306-M309 HydrophobicContact CD1-CE 4.11Å; L306-M309 PolarHBondContact O-N 3.05Å; L306-L310 PolarHBondContact O-N 2.84Å
307N87.6Confident82Confident53 Ų5378.6 Ų78.628%0.28339%0.388SS..Hα-helixtrans-63.3-38.4177.3-72.9-23.8000112.1R38 K303 Q304 V305 R311R38-N307 PolarHBondContact NE-OD1 2.92Å; K303-N307 WeakPolarHBondContact O-CB 3.32Å; K303-N307 VanDerWaalsContact O-CG 3.28Å; K303-N307 PolarHBondContact O-N 3.42Å; K303-N307 PolarHBondContact O-ND2 3.4Å; Q304-N307 PolarHBondContact O-N 3.07Å; V305-N307 PolarHBondContact O-N 2.93Å; N307-R311 WeakPolarHBondContact O-CG 3.28Å; N307-R311 PolarHBondContact O-N 2.98Å; N307-R311 VanDerWaalsContact O-N 3.09Å
308W87.1Confident80.2Confident156 Ų15682.6 Ų82.659%0.59142%0.415SS*.Hα-helixtrans-63.8-43.8174.5176.285.1000112.1Q304 V305 L306 R311 K312Q304-W308 WeakPolarHBondContact O-CB 3.35Å; Q304-W308 PolarHBondContact O-N 3.25Å; V305-W308 WeakPolarHBondContact O-CB 3.42Å; V305-W308 PolarHBondContact O-N 3.25Å; L306-W308 VanDerWaalsContact C-N 3.31Å; L306-W308 PolarHBondContact O-N 3.44Å; W308-R311 PolarHBondContact O-N 3.31Å; W308-K312 HydrophobicContact CH2-CD 4.04Å; W308-K312 HydrophobicContact CZ2-CD 4.04Å; W308-K312 PolarHBondContact O-N 3.25Å; W308-K312 VanDerWaalsContact O-N 3.11Å
309M86.1Confident78.3Confident48 Ų4883.2 Ų83.224%0.23643%0.429CS..Hα-helixtrans-61.2-46.2176.9-73.3-171.1-66.200111.8L41 L45 V305 L306 R311 K312 L313L41-M309 HydrophobicContact CD2-CB 4.26Å; L41-M309 HydrophobicContact CD2-CE 4.41Å; L45-M309 HydrophobicContact CD1-CE 3.5Å; L45-M309 VanDerWaalsContact CD1-CE 3.5Å; V305-M309 HydrophobicContact CG1-CE 4.09Å; V305-M309 WeakPolarHBondContact O-CG 3.35Å; V305-M309 PolarHBondContact O-N 3.06Å; L306-M309 HydrophobicContact CD1-CE 4.11Å; L306-M309 PolarHBondContact O-N 3.05Å; M309-R311 PolarHBondContact O-N 3.09Å; M309-K312 WeakPolarHBondContact O-CB 3.23Å; M309-K312 PolarHBondContact O-N 2.97Å; M309-K312 VanDerWaalsContact O-N 3.16Å; M309-L313 WeakPolarHBondContact O-CD1 3.24Å; M309-L313 WeakPolarHBondContact O-CG 3.27Å; M309-L313 PolarHBondContact O-N 3.34Å
310L84.5Confident76.3Confident20 Ų2092 Ų9211%0.10546%0.455CS..Hα-helixtrans-62.7-43.2178.9-74.8171.3000112.7R38 L41 L306 K312 L313 S314R38-L310 HydrophobicContact CB-CD1 4.01Å; R38-L310 HydrophobicContact CG-CD1 3.08Å; L41-L310 HydrophobicContact CD2-CD2 3.7Å; L41-L310 HydrophobicContact CD2-CG 3.81Å; L306-L310 PolarHBondContact O-N 2.84Å; L310-K312 PolarHBondContact O-N 3.25Å; L310-L313 PolarHBondContact O-N 3.32Å; L310-L313 VanDerWaalsContact O-N 3.13Å; L310-S314 PolarHBondContact O-N 3.36Å; L310-S314 PolarHBondContact O-OG 3.49Å; L310-S314 VanDerWaalsContact O-OG 3.07Å
311R81.9Confident74.6Confident172 Ų17293.6 Ų93.665%0.64947%0.472SS*.Hα-helixtrans-58-41.3174.6-73.5175.7-176.4-173.21.2111.4N307 W308 M309 L313 S314 C315N307-R311 WeakPolarHBondContact O-CG 3.28Å; N307-R311 PolarHBondContact O-N 2.98Å; N307-R311 VanDerWaalsContact O-N 3.09Å; W308-R311 PolarHBondContact O-N 3.31Å; M309-R311 PolarHBondContact O-N 3.09Å; R311-L313 VanDerWaalsContact C-N 3.34Å; R311-L313 PolarHBondContact O-N 3.36Å; R311-S314 PolarHBondContact O-N 3.14Å; R311-C315 WeakPolarHBondContact O-CB 3.48Å; R311-C315 PolarHBondContact O-N 3.33Å; R311-C315 PolarHBondContact O-SG 3.06Å
312K82.8Confident72.5Confident109 Ų10996.8 Ų96.847%0.47450%0.495SS..Hα-helixtrans-66.6-35.6178.2-160.8171.9-174.3179.20112.4W308 M309 L310 R316W308-K312 HydrophobicContact CH2-CD 4.04Å; W308-K312 HydrophobicContact CZ2-CD 4.04Å; W308-K312 PolarHBondContact O-N 3.25Å; W308-K312 VanDerWaalsContact O-N 3.11Å; M309-K312 WeakPolarHBondContact O-CB 3.23Å; M309-K312 PolarHBondContact O-N 2.97Å; M309-K312 VanDerWaalsContact O-N 3.16Å; L310-K312 PolarHBondContact O-N 3.25Å; K312-R316 PolarHBondContact O-N 3.32Å
313L78.5Confident70.3Confident89 Ų8997.8 Ų97.847%0.46651%0.508SS..Hα-helixtrans-69.6-46.8174.1-75.6151.6000111.6L41 M309 L310 R311 C315 R316 C317L41-L313 HydrophobicContact CD2-CD1 4.34Å; M309-L313 WeakPolarHBondContact O-CD1 3.24Å; M309-L313 WeakPolarHBondContact O-CG 3.27Å; M309-L313 PolarHBondContact O-N 3.34Å; L310-L313 PolarHBondContact O-N 3.32Å; L310-L313 VanDerWaalsContact O-N 3.13Å; R311-L313 VanDerWaalsContact C-N 3.34Å; R311-L313 PolarHBondContact O-N 3.36Å; L313-C315 PolarHBondContact O-N 2.88Å; L313-R316 WeakPolarHBondContact O-CB 3.5Å; L313-R316 PolarHBondContact O-N 2.91Å; L313-R316 VanDerWaalsContact O-N 3.15Å; L313-C317 PolarHBondContact O-N 3.37Å; L313-C317 VanDerWaalsContact O-N 3.14Å
314S71.3Confident68.4Low66 Ų6696.4 Ų96.446%0.46252%0.519SS..Hα-helixtrans-62.4-39.9178.1-590000112.9L310 R311 R316 C317 C318L310-S314 PolarHBondContact O-N 3.36Å; L310-S314 PolarHBondContact O-OG 3.49Å; L310-S314 VanDerWaalsContact O-OG 3.07Å; R311-S314 PolarHBondContact O-N 3.14Å; S314-R316 VanDerWaalsContact C-N 3.29Å; S314-R316 PolarHBondContact O-N 3.49Å; S314-C317 PolarHBondContact O-N 2.79Å; S314-C318 PolarHBondContact O-N 3.5Å; S314-C318 VanDerWaalsContact O-N 3.08Å
315C59Low66.2Low93 Ų9398.5 Ų98.563%0.62854%0.539SS*.Hα-helixtrans-64.2-32.2175.3-720000112.8R311 L313 A319R311-C315 WeakPolarHBondContact O-CB 3.48Å; R311-C315 PolarHBondContact O-N 3.33Å; R311-C315 PolarHBondContact O-SG 3.06Å; L313-C315 PolarHBondContact O-N 2.88Å; C315-A319 PolarHBondContact O-N 2.99Å
316R57.5Low64Low177 Ų17798.1 Ų98.167%0.66855%0.551SS**Hα-helixtrans-71.5-34173.6-77.6178171.6-175.7-3.5112.4K312 L313 S314 R320K312-R316 PolarHBondContact O-N 3.32Å; L313-R316 WeakPolarHBondContact O-CB 3.5Å; L313-R316 PolarHBondContact O-N 2.91Å; L313-R316 VanDerWaalsContact O-N 3.15Å; S314-R316 VanDerWaalsContact C-N 3.29Å; S314-R316 PolarHBondContact O-N 3.49Å; R316-R320 PolarHBondContact O-N 3.45Å
317C53.7Low61.7Low79 Ų79102.2 Ų102.253%0.53459%0.587SS.*Hα-helixtrans-67.2-43.2174.5-67.40000112L313 S314 A319 R320 C321L313-C317 PolarHBondContact O-N 3.37Å; L313-C317 VanDerWaalsContact O-N 3.14Å; S314-C317 PolarHBondContact O-N 2.79Å; C317-A319 PolarHBondContact O-N 3.44Å; C317-R320 PolarHBondContact O-N 2.89Å; C317-R320 VanDerWaalsContact O-N 3.12Å; C317-C321 PolarHBondContact O-N 3.41Å; C317-C321 PolarHBondContact O-SG 2.94Å
318C52.3Low59.4Low89 Ų89105.6 Ų105.660%0.60161%0.612SS**Hα-helixtrans-63.9-38176.6-78.70000113.4S314 R320 C321 C322S314-C318 PolarHBondContact O-N 3.5Å; S314-C318 VanDerWaalsContact O-N 3.08Å; C318-R320 PolarHBondContact O-N 3.04Å; C318-C321 PolarHBondContact O-N 3.03Å; C318-C322 PolarHBondContact O-N 3.37Å
319A51.3Low57.2Low73 Ų73106.1 Ų106.160%0.60363%0.625SS**Hα-helixtrans-64.6-24.4174.600000113.1C315 C317C315-A319 PolarHBondContact O-N 2.99Å; C317-A319 PolarHBondContact O-N 3.44Å
320R49.9Very low54.9Low227 Ų227108.9 Ų108.986%0.85765%0.649SS**Hα-helixtrans-88.2-30.1177.3-140.4175.2-163.2-178.33.4112.8R316 C317 C318R316-R320 PolarHBondContact O-N 3.45Å; C317-R320 PolarHBondContact O-N 2.89Å; C317-R320 VanDerWaalsContact O-N 3.12Å; C318-R320 PolarHBondContact O-N 3.04Å
321C50.9Low52.5Low104 Ų104120 Ų12070%0.70369%0.69SS**Hα-helixtrans-82.4-21.5177.8-64.70000113.7C317 C318C317-C321 PolarHBondContact O-N 3.41Å; C317-C321 PolarHBondContact O-SG 2.94Å; C318-C321 PolarHBondContact O-N 3.03Å
322C46.5Very low50.4Low94 Ų94122.1 Ų122.164%0.63570%0.698SS**SBendtrans-128.192.2174.6-64.20000110.1C318 A324C318-C322 PolarHBondContact O-N 3.37Å; C322-A324 PolarHBondContact O-N 3.31Å
323P43.3Very low48.3Very low112 Ų112124 Ų12473%0.72771%0.713SS**PPolyproline II helixtrans-61.2124.8164.2-619.2000107.6
324A46.9Very low46.1Very low90 Ų90124.9 Ų124.974%0.74473%0.733SS**PPolyproline II helixtrans-54.8128.8172.600000109.1C322 G326C322-A324 PolarHBondContact O-N 3.31Å; A324-G326 PolarHBondContact O-N 2.88Å
325P43.2Very low44.5Very low126 Ų126128.8 Ų128.882%0.81875%0.747SS**PPolyproline II helixtrans-61.1130.3166.4-12.726.5000107.3A327P325-A327 PolarHBondContact O-N 3.16Å
326G40.9Very low43.2Very low70 Ų70130.9 Ų130.972%0.72276%0.758SS**  trans-42.5130.5-175.100000113.1A324 P328A324-G326 PolarHBondContact O-N 2.88Å; G326-P328 WeakPolarHBondContact O-CD 3.43Å
327A40.3Very low42.4Very low99 Ų99128.1 Ų128.182%0.81876%0.762SS**PPolyproline II helixtrans-59.3133.7168.300000109.9P325P325-A327 PolarHBondContact O-N 3.16Å
328P39.9Very low41.2Very low124 Ų124127.8 Ų127.881%0.80577%0.773SS**PPolyproline II helixtrans-93132153.130.1-19.4000109.5G326G326-P328 WeakPolarHBondContact O-CD 3.43Å
329L41.3Very low40.3Very low167 Ų167129.3 Ų129.387%0.87478%0.784SS**PPolyproline II helixtrans-52.4144.1172.2-69.8145000112.6
330S36.6Very low39.5Very low106 Ų106137.6 Ų137.674%0.74180%0.8SS**  trans29.8111136.1-166.30000118
331R34.3Very low38.7Very low254 Ų254134.7 Ų134.796%0.95880%0.8SS**  trans-144.6113.8138.1-133177.6-164.6-163.63.6111.8
332R38.4Very low37.6Very low217 Ų217140.7 Ų140.782%0.81981%0.808SS**  trans-62.5159.7166.9-77.8175.8165.3166.9-5.2111.6
333N37.5Very low36.9Very low148 Ų148147.3 Ų147.379%0.79182%0.82SS**  trans90.9104.6155.7-58.2-16.5000118.4
334A34.3Very low36.2Very low107 Ų107152.4 Ų152.488%0.88483%0.825SS**  trans-146.5109.1133.700000108.9
335I35.7Very low35.3Very low149 Ų149156.5 Ų156.576%0.76483%0.833SS**  trans-93.2137.9167.3-66.3167.1000106.7
336T32.8Very low34.7Very low137 Ų137155.4 Ų155.484%0.8484%0.835SS**  trans-172.5155.2132.725.20000110.6
337P41Very low34.2Very low118 Ų118156.5 Ų156.577%0.76684%0.837SS**  trans-117.8167.4-141.740.2-29.3000115.1
338G28.2Very low33.6Very low73 Ų73160.4 Ų160.475%0.75384%0.843SS**  trans97.6105.7138.400000118.2
339S32.3Very low33Very low121 Ų121158.2 Ų158.285%0.84684%0.843SS**  -174.6112.1113.360.40000110.1
340R35Very low32.3Very low246 Ų246155 Ų15593%0.92884%0.84SS**  trans-72.1120.6161.6-68.7175.4179.1179.1-0.3107.4
341L33.1Very low31.8Very low166 Ų166157.4 Ų157.487%0.86985%0.845SS**  trans-161.3143.4145.1-133.986.7000110.6
342R29.3Very low31.7Very low230 Ų230151.5 Ų151.587%0.86884%0.84SS**  trans86.477160.5-118.5170.3-176.2-171.6-0.6118.5
343R30.7Very low31.2Very low234 Ų234145.7 Ų145.788%0.88384%0.838SS**  trans-78139.9143.3-155-175.1-94.5-170.7-7.3108
344R29.2Very low31.1Very low218 Ų218143.2 Ų143.282%0.82384%0.838SS**  trans75.5105.5168.3-62.4-177.1177-167.6-1.6118.2
345L28.4Very low30.7Very low177 Ų177149.5 Ų149.593%0.92784%0.839SS**  155.898125.5-95.5144.9000109.6
346A29Very low30.3Very low103 Ų103150.9 Ų150.985%0.85185%0.848SS**  trans-174.172.4148.100000107.8
347A30.4Very low30.1Very low93 Ų93149.1 Ų149.177%0.76984%0.841SS**  trans-80.4116.7147.600000105.7
348L28.9Very low29.6Very low181 Ų181151.4 Ų151.495%0.94885%0.847SS**  trans158.5118.6148-89.6152000109.5
349G25.7Very low29.6Very low77 Ų77152.7 Ų152.779%0.79485%0.851SS**  trans120.4112.115300000116.9
350A27.3Very low29.7Very low100 Ų100155.4 Ų155.483%0.82685%0.85SS**  trans85.4111144.900000120.1
351D27.2Very low29.5Very low157 Ų157147.2 Ų147.284%0.8484%0.842SS**  trans16.6130.8148.6-64.4-27.9000120.9
352P30.9Very low29.3Very low130 Ų130151 Ų15184%0.84484%0.844SS**  trans-101.7106.7157.433.5-20.6000110.8
353A28.5Very low29.5Very low94 Ų94150.6 Ų150.678%0.77784%0.843SS**  trans-69.1135.7152.100000109.9
354A35Very low29.6Very low97 Ų97147.2 Ų147.280%0.80284%0.842SS**  trans50.492.6153.700000118.3
355R26.5Very low30.1Very low239 Ų239142.7 Ų142.790%0.90284%0.843SS**  trans-143.8100.3146.1-77.5-164.1173.6150.10.5111S357R355-S357 PolarHBondContact O-N 3.38Å
356D27.6Very low30.7Very low177 Ų177137.5 Ų137.595%0.94783%0.832SS**  trans-53.5122.7163.1-80.5-40.7000110.1
357S27.1Very low31.5Very low100 Ų100140.6 Ų140.670%0.69983%0.829SS**  trans-129.8111170.6-46.90000107.5R355R355-S357 PolarHBondContact O-N 3.38Å
358D30.9Very low32Very low167 Ų167143.3 Ų143.389%0.89383%0.83SS**  trans43.686.5152.3-61.1-32.1000118
359A29.1Very low32.7Very low100 Ų100140.2 Ų140.283%0.82681%0.813SS**  trans-113.557.1161.600000111.3
360E33.9Very low33.5Very low177 Ų177139.5 Ų139.583%0.82780%0.796SS**  trans-119.369.1172-152.274.2-136.600110.3
361G30.1Very low34.3Very low74 Ų74140 Ų14076%0.76378%0.782SS**  trans-144.3-1.6178.100000115.4
362R30.5Very low35.2Very low245 Ų245142 Ų14293%0.92578%0.779SS**  trans-111.663.8-177.7-90-172.9-176.1162.42.3112.2
363R33.7Very low36Very low223 Ų223140.7 Ų140.784%0.84276%0.764SS**  trans-146.262.7164.4-72.6-166.6-179.5-113.6-0.2112.3
364L32.2Very low36.7Very low163 Ų163139.9 Ų139.985%0.85375%0.747SS**  trans-137.954.1161-77.4172.7000109.9
365S38.9Very low37.5Very low123 Ų123138.6 Ų138.686%0.8673%0.729SS**  trans-147.774.4161.1-73.20000106.5
366G41.3Very low38.6Very low67 Ų67129.4 Ų129.469%0.69170%0.704SS**  trans-132.7130.2167.200000106.8
367E46.3Very low39.7Very low169 Ų169124.2 Ų124.279%0.7968%0.682SS**  trans78.660.2176.5-59.8-177.1148.200117.5
368L40.7Very low40.7Very low149 Ų149123.7 Ų123.778%0.7867%0.671SS**SBend-107.7117.7116.7-82.4159.6000104.8S370L368-S370 PolarHBondContact O-N 3.24Å
369I43.8Very low42Very low116 Ų116123.1 Ų123.160%0.59566%0.661SS**  trans-66.495.5175.3-58.6173.8000106.3L374I369-L374 HydrophobicContact CB-CD1 4.44Å; I369-L374 HydrophobicContact CG2-CB 3.98Å; I369-L374 HydrophobicContact CG2-CD1 3.38Å; I369-L374 HydrophobicContact CG2-CG 3.43Å; I369-L374 VanDerWaalsContact CG2-CG 3.43Å
370S41.5Very low43.7Very low63 Ų63122.6 Ų122.644%0.44165%0.647SS.*  trans-59.4137.7166.6-179.20000107.2L368 R372 D373 L374L368-S370 PolarHBondContact O-N 3.24Å; S370-R372 PolarHBondContact O-N 2.88Å; S370-R372 PolarHBondContact OG-N 3.4Å; S370-D373 PolarHBondContact O-N 2.83Å; S370-L374 PolarHBondContact O-N 3.49Å; S370-L374 VanDerWaalsContact O-N 3.15Å
371M45.4Very low44.8Very low109 Ų109116.7 Ų116.754%0.53763%0.625SS.*Hα-helixtrans-49.9-23.5170.9-84.1-77.2-78.300112.4L159 T375L159-M371 HydrophobicContact CD1-SD 4.35Å; M371-T375 WeakPolarHBondContact O-CB 3.33Å; M371-T375 VanDerWaalsContact O-CG2 3.27Å; M371-T375 WeakPolarHBondContact O-CG2 3.49Å; M371-T375 PolarHBondContact O-N 3.28Å; M371-T375 PolarHBondContact O-OG1 2.87Å
372R46.1Very low46.1Very low201 Ų201118 Ų11876%0.75861%0.614SS**Hα-helixtrans-69.7-35.6173.7-155.3174.8-170.6150.61.6113.4S370 T375 A376S370-R372 PolarHBondContact O-N 2.88Å; S370-R372 PolarHBondContact OG-N 3.4Å; R372-T375 WeakPolarHBondContact CA-OG1 3.34Å; R372-T375 PolarHBondContact O-OG1 3.41Å; R372-A376 WeakPolarHBondContact O-CB 3.41Å; R372-A376 PolarHBondContact O-N 3.23Å
373D48Very low47.7Very low101 Ų101108.9 Ų108.954%0.5459%0.591SS.*Hα-helixtrans-80.5-33.2176.8-69.2-25.1000111.9S370 S377S370-D373 PolarHBondContact O-N 2.83Å; D373-S377 WeakPolarHBondContact O-CB 3.45Å; D373-S377 PolarHBondContact O-N 2.68Å
374L42.9Very low49.2Very low78 Ų78103 Ų10341%0.40858%0.576SS.*Hα-helixtrans-65-43.9170.6-111.2160.2000111.6I369 S370 N378I369-L374 HydrophobicContact CB-CD1 4.44Å; I369-L374 HydrophobicContact CG2-CB 3.98Å; I369-L374 HydrophobicContact CG2-CD1 3.38Å; I369-L374 HydrophobicContact CG2-CG 3.43Å; I369-L374 VanDerWaalsContact CG2-CG 3.43Å; S370-L374 PolarHBondContact O-N 3.49Å; S370-L374 VanDerWaalsContact O-N 3.15Å; L374-N378 VanDerWaalsContact O-CB 3.27Å; L374-N378 WeakPolarHBondContact O-CB 3.26Å; L374-N378 PolarHBondContact O-N 3.22Å; L374-N378 PolarHBondContact O-ND2 3.32Å
375T50.3Low50.8Low70 Ų7099.8 Ų99.843%0.42956%0.559SS.*Hα-helixtrans-72.8-32.3176.452.10000112.7M371 R372 K379M371-T375 WeakPolarHBondContact O-CB 3.33Å; M371-T375 VanDerWaalsContact O-CG2 3.27Å; M371-T375 WeakPolarHBondContact O-CG2 3.49Å; M371-T375 PolarHBondContact O-N 3.28Å; M371-T375 PolarHBondContact O-OG1 2.87Å; R372-T375 WeakPolarHBondContact CA-OG1 3.34Å; R372-T375 PolarHBondContact O-OG1 3.41Å; T375-K379 WeakPolarHBondContact O-CB 3.29Å; T375-K379 WeakPolarHBondContact O-CG 3.26Å; T375-K379 PolarHBondContact O-N 3.05Å
376A51.4Low52Low46 Ų46100.3 Ų100.338%0.3855%0.548SS..Hα-helixtrans-69.9-43.9172.400000112.2R372 N378 K379 V380R372-A376 WeakPolarHBondContact O-CB 3.41Å; R372-A376 PolarHBondContact O-N 3.23Å; A376-N378 VanDerWaalsContact C-N 3.34Å; A376-N378 PolarHBondContact O-N 3.23Å; A376-K379 PolarHBondContact O-N 3.41Å; A376-V380 WeakPolarHBondContact O-CG2 3.42Å; A376-V380 PolarHBondContact O-N 3.04Å
377S48.8Very low53.3Low68 Ų68102.7 Ų102.748%0.47654%0.539SS..Hα-helixtrans-63.4-39.5175.1-172.80000111.6D373 V380 S381D373-S377 WeakPolarHBondContact O-CB 3.45Å; D373-S377 PolarHBondContact O-N 2.68Å; S377-V380 PolarHBondContact O-N 2.88Å; S377-S381 VanDerWaalsContact O-CB 3.24Å; S377-S381 WeakPolarHBondContact O-CB 3.32Å; S377-S381 PolarHBondContact O-N 3.44Å; S377-S381 PolarHBondContact O-OG 3.47Å
378N49.7Very low54.1Low89 Ų89100.5 Ų100.548%0.47653%0.529SS..Hα-helixtrans-68.3-35.5173.3-75.2-13.1000112.6L374 A376 L382L374-N378 VanDerWaalsContact O-CB 3.27Å; L374-N378 WeakPolarHBondContact O-CB 3.26Å; L374-N378 PolarHBondContact O-N 3.22Å; L374-N378 PolarHBondContact O-ND2 3.32Å; A376-N378 VanDerWaalsContact C-N 3.34Å; A376-N378 PolarHBondContact O-N 3.23Å; N378-L382 WeakPolarHBondContact O-CB 3.34Å; N378-L382 WeakPolarHBondContact O-CD1 3.43Å; N378-L382 VanDerWaalsContact O-CG 3.3Å; N378-L382 WeakPolarHBondContact O-CG 3.38Å; N378-L382 PolarHBondContact O-N 3.22Å
379K57.7Low54.9Low155 Ų15599 Ų9967%0.67452%0.521SS*.Hα-helixtrans-67-41173.5-82.6180179.4-176.60112.4T375 A376 A383T375-K379 WeakPolarHBondContact O-CB 3.29Å; T375-K379 WeakPolarHBondContact O-CG 3.26Å; T375-K379 PolarHBondContact O-N 3.05Å; A376-K379 PolarHBondContact O-N 3.41Å; K379-A383 WeakPolarHBondContact O-CB 3.41Å; K379-A383 PolarHBondContact O-N 2.94Å
380V63.9Low55.8Low88 Ų8896.2 Ų96.253%0.53351%0.512SS..Hα-helixtrans-69.7-39.9176.9174.70000110.6A376 S377 A383 L384A376-V380 WeakPolarHBondContact O-CG2 3.42Å; A376-V380 PolarHBondContact O-N 3.04Å; S377-V380 PolarHBondContact O-N 2.88Å; V380-A383 PolarHBondContact O-N 3.34Å; V380-L384 HydrophobicContact CG1-CD1 4.03Å; V380-L384 WeakPolarHBondContact O-CB 3.28Å; V380-L384 WeakPolarHBondContact O-CG 3.43Å; V380-L384 PolarHBondContact O-N 2.9Å
381S57.1Low56.8Low53 Ų5398.7 Ų98.737%0.37152%0.516SS..Hα-helixtrans-68.8-39.2176.2-59.20000112.2S377 L384 L385S377-S381 VanDerWaalsContact O-CB 3.24Å; S377-S381 WeakPolarHBondContact O-CB 3.32Å; S377-S381 PolarHBondContact O-N 3.44Å; S377-S381 PolarHBondContact O-OG 3.47Å; S381-L384 PolarHBondContact O-N 3.5Å; S381-L385 VanDerWaalsContact O-CB 3.31Å; S381-L385 WeakPolarHBondContact O-CB 3.48Å; S381-L385 WeakPolarHBondContact O-CG 3.46Å; S381-L385 PolarHBondContact O-N 3.12Å
382L59Low57.6Low102 Ų10299 Ų9953%0.53452%0.524SS..Hα-helixtrans-67.5-39.6172.3-83.4164000111.8N378 L385 Q386N378-L382 WeakPolarHBondContact O-CB 3.34Å; N378-L382 WeakPolarHBondContact O-CD1 3.43Å; N378-L382 VanDerWaalsContact O-CG 3.3Å; N378-L382 WeakPolarHBondContact O-CG 3.38Å; N378-L382 PolarHBondContact O-N 3.22Å; L382-L385 PolarHBondContact O-N 3.2Å; L382-Q386 VanDerWaalsContact O-CB 3.22Å; L382-Q386 WeakPolarHBondContact O-CB 3.47Å; L382-Q386 WeakPolarHBondContact O-CG 3.42Å; L382-Q386 PolarHBondContact O-N 3.39Å
383A63.3Low57.7Low53 Ų5393.2 Ų93.244%0.43852%0.52SS..Hα-helixtrans-66.9-37.6175.400000111.5K379 V380 K387K379-A383 WeakPolarHBondContact O-CB 3.41Å; K379-A383 PolarHBondContact O-N 2.94Å; V380-A383 PolarHBondContact O-N 3.34Å; A383-K387 WeakPolarHBondContact O-CB 3.07Å; A383-K387 PolarHBondContact O-N 3.07Å
384L66.1Low57.9Low100 Ų10094.1 Ų94.152%0.52453%0.525SS..Hα-helixtrans-69.3-40.7174-79.9166.7000112V380 S381 K387 Q388V380-L384 HydrophobicContact CG1-CD1 4.03Å; V380-L384 WeakPolarHBondContact O-CB 3.28Å; V380-L384 WeakPolarHBondContact O-CG 3.43Å; V380-L384 PolarHBondContact O-N 2.9Å; S381-L384 PolarHBondContact O-N 3.5Å; L384-K387 PolarHBondContact O-N 3.5Å; L384-Q388 WeakPolarHBondContact O-CB 3.41Å; L384-Q388 WeakPolarHBondContact O-CG 3.5Å; L384-Q388 PolarHBondContact O-N 3.38Å
385L64.6Low58.4Low96 Ų9693.4 Ų93.450%0.50354%0.536SS..Hα-helixtrans-69-41.3175.6-80.4163.5000112.1S381 L382 K387 Q388 L389S381-L385 VanDerWaalsContact O-CB 3.31Å; S381-L385 WeakPolarHBondContact O-CB 3.48Å; S381-L385 WeakPolarHBondContact O-CG 3.46Å; S381-L385 PolarHBondContact O-N 3.12Å; L382-L385 PolarHBondContact O-N 3.2Å; L385-K387 VanDerWaalsContact C-N 3.34Å; L385-Q388 PolarHBondContact O-N 2.87Å; L385-L389 WeakPolarHBondContact O-CB 3.36Å; L385-L389 VanDerWaalsContact O-CG 3.24Å; L385-L389 WeakPolarHBondContact O-CG 3.21Å; L385-L389 PolarHBondContact O-N 3.23Å
386Q64.9Low57.8Low134 Ų13499.8 Ų99.863%0.62655%0.554SS**Hα-helixtrans-66.2-37.7173.1-79.5179.9-45.600111.4L382 S390L382-Q386 VanDerWaalsContact O-CB 3.22Å; L382-Q386 WeakPolarHBondContact O-CB 3.47Å; L382-Q386 WeakPolarHBondContact O-CG 3.42Å; L382-Q386 PolarHBondContact O-N 3.39Å; Q386-S390 VanDerWaalsContact O-CB 3.25Å; Q386-S390 WeakPolarHBondContact O-CB 3.4Å; Q386-S390 PolarHBondContact O-N 3.43Å; Q386-S390 PolarHBondContact O-OG 3.22Å
387K69.1Low57.2Low117 Ų117103.3 Ų103.351%0.50957%0.573SS.*Hα-helixtrans-65.3-47174-178.7172.7177.3175.10110.9A383 L384 L385 S390 E391A383-K387 WeakPolarHBondContact O-CB 3.07Å; A383-K387 PolarHBondContact O-N 3.07Å; L384-K387 PolarHBondContact O-N 3.5Å; L385-K387 VanDerWaalsContact C-N 3.34Å; K387-S390 WeakPolarHBondContact CA-OG 3.29Å; K387-S390 PolarHBondContact O-N 2.97Å; K387-S390 PolarHBondContact O-OG 3.29Å; K387-E391 WeakPolarHBondContact CE-OE1 3.47Å; K387-E391 HydrophobicContact CG-CG 4.42Å; K387-E391 IonicContact NZ-OE1 2.58Å; K387-E391 WeakPolarHBondContact O-CB 3.45Å; K387-E391 VanDerWaalsContact O-CG 3.3Å; K387-E391 WeakPolarHBondContact O-CG 3.36Å; K387-E391 PolarHBondContact O-N 3.39Å
388Q62.1Low56.7Low122 Ų122111.7 Ų111.757%0.5759%0.594SS**Hα-helixtrans-60.2-48.8175.3-78.7-168-40.300110.8L384 L385 S390 E391 T392L384-Q388 WeakPolarHBondContact O-CB 3.41Å; L384-Q388 WeakPolarHBondContact O-CG 3.5Å; L384-Q388 PolarHBondContact O-N 3.38Å; L385-Q388 PolarHBondContact O-N 2.87Å; Q388-S390 VanDerWaalsContact C-N 3.31Å; Q388-S390 PolarHBondContact O-N 2.86Å; Q388-E391 PolarHBondContact O-N 3.45Å; Q388-E391 VanDerWaalsContact O-N 3.16Å; Q388-T392 PolarHBondContact O-N 3.14Å; Q388-T392 PolarHBondContact O-OG1 2.98Å
389L57.4Low55.8Low119 Ų119113.1 Ų113.162%0.62361%0.611SS**Hα-helixtrans-61.6-36.4176.3-71.8166.9000112.7L385 A393L385-L389 WeakPolarHBondContact O-CB 3.36Å; L385-L389 VanDerWaalsContact O-CG 3.24Å; L385-L389 WeakPolarHBondContact O-CG 3.21Å; L385-L389 PolarHBondContact O-N 3.23Å; L389-A393 WeakPolarHBondContact O-CB 3.42Å; L389-A393 PolarHBondContact O-N 3.48Å
390S62.1Low54.5Low57 Ų57112 Ų11240%0.39962%0.616SS.*Hα-helixtrans-68.2-36.6174.876.20000112.8Q386 K387 Q388 A393 N394Q386-S390 VanDerWaalsContact O-CB 3.25Å; Q386-S390 WeakPolarHBondContact O-CB 3.4Å; Q386-S390 PolarHBondContact O-N 3.43Å; Q386-S390 PolarHBondContact O-OG 3.22Å; K387-S390 WeakPolarHBondContact CA-OG 3.29Å; K387-S390 PolarHBondContact O-N 2.97Å; K387-S390 PolarHBondContact O-OG 3.29Å; Q388-S390 VanDerWaalsContact C-N 3.31Å; Q388-S390 PolarHBondContact O-N 2.86Å; S390-A393 PolarHBondContact O-N 3.42Å; S390-N394 WeakPolarHBondContact O-CB 3.36Å; S390-N394 PolarHBondContact O-N 3.23Å
391E64.1Low52.7Low115 Ų115113.8 Ų113.854%0.53763%0.632SS.*Hα-helixtrans-74.3-33.9178.3-73.8173.6175.500110.9K387 Q388K387-E391 WeakPolarHBondContact CE-OE1 3.47Å; K387-E391 HydrophobicContact CG-CG 4.42Å; K387-E391 IonicContact NZ-OE1 2.58Å; K387-E391 WeakPolarHBondContact O-CB 3.45Å; K387-E391 VanDerWaalsContact O-CG 3.3Å; K387-E391 WeakPolarHBondContact O-CG 3.36Å; K387-E391 PolarHBondContact O-N 3.39Å; Q388-E391 PolarHBondContact O-N 3.45Å; Q388-E391 VanDerWaalsContact O-N 3.16Å
392T61.8Low51.3Low115 Ų115116.7 Ų116.771%0.70665%0.647SS**Hα-helixtrans-74.6-31.3172.7-27.30000112.6Q388Q388-T392 PolarHBondContact O-N 3.14Å; Q388-T392 PolarHBondContact O-OG1 2.98Å
393A48.9Very low49.8Very low80 Ų80119.1 Ų119.166%0.66166%0.661SS**Hα-helixtrans-78.8-31.4178.600000113.4L389 S390L389-A393 WeakPolarHBondContact O-CB 3.42Å; L389-A393 PolarHBondContact O-N 3.48Å; S390-A393 PolarHBondContact O-N 3.42Å
394N51.2Low48.2Very low120 Ų120122.3 Ų122.364%0.64268%0.675SS**THydrogen-bonded Turntrans-90.910.2-177.1-83-5.2000115.3S390 Y396S390-N394 WeakPolarHBondContact O-CB 3.36Å; S390-N394 PolarHBondContact O-N 3.23Å; N394-Y396 VanDerWaalsContact C-N 3.33Å; N394-Y396 HydrophobicContact CB-CD2 4.38Å; N394-Y396 HydrophobicContact CB-CE2 4.47Å; N394-Y396 WeakPolarHBondContact O-CD2 3.48Å; N394-Y396 PolarHBondContact O-N 2.83Å
395G52.9Low46.4Very low63 Ų63129.3 Ų129.365%0.64969%0.694SS**THydrogen-bonded Turntrans46.944.4160.200000116.6
396Y37.9Very low45Very low203 Ų203133.2 Ų133.280%0.79671%0.71SS**PPolyproline II helixtrans-76.3125.9175.6-89.3-88.8000110.8N394N394-Y396 VanDerWaalsContact C-N 3.33Å; N394-Y396 HydrophobicContact CB-CD2 4.38Å; N394-Y396 HydrophobicContact CB-CE2 4.47Å; N394-Y396 WeakPolarHBondContact O-CD2 3.48Å; N394-Y396 PolarHBondContact O-N 2.83Å
397P39.8Very low43.4Very low120 Ų120134.7 Ų134.778%0.77972%0.722SS**PPolyproline II helixtrans-74.3132-175.829.1-32000110.6S399P397-S399 PolarHBondContact O-N 3.48Å
398R37.2Very low41.9Very low245 Ų245132.5 Ų132.593%0.92573%0.733SS**PPolyproline II helixtrans-66.8119.4168.4-84.9-171.1156.4123.9-0.7109.3V400R398-V400 PolarHBondContact O-N 3.33Å
399S30.3Very low40.4Very low119 Ų119137 Ų13783%0.83275%0.751SS**PPolyproline II helixtrans-66.2125.1163.753.20000109.6P397P397-S399 PolarHBondContact O-N 3.48Å
400V30.8Very low39.6Very low130 Ų130137.6 Ų137.679%0.78877%0.765SS**PPolyproline II helixtrans-69.8123.5175.3173.80000108.6R398 V402R398-V400 PolarHBondContact O-N 3.33Å; V400-V402 HydrophobicContact CG1-CG2 4.02Å
401C26.6Very low38.4Very low126 Ų126137.8 Ų137.885%0.85178%0.776SS**  trans-132.1112.5151-162.10000108.3N403C401-N403 PolarHBondContact O-N 2.99Å
402V28.2Very low37.2Very low114 Ų114135.7 Ų135.769%0.69179%0.785SS**  trans-68.5118.5175.4171.80000108.2V400V400-V402 HydrophobicContact CG1-CG2 4.02Å
403N25.9Very low36Very low154 Ų154137.5 Ų137.582%0.82480%0.796SS**  trans-153.5125.5137.4-123.9-17.4000112C401C401-N403 PolarHBondContact O-N 2.99Å
404T30.9Very low36Very low120 Ų120135.9 Ų135.974%0.73679%0.787SS**  trans-57.7127.7-179.133.30000114.2
405R27.9Very low35.6Very low246 Ų246134.3 Ų134.393%0.92879%0.79SS**  -170.3132.2123.5-111.5175.7172.5167.6-1.6111.7
406Q35.8Very low35.1Very low178 Ų178138.6 Ų138.683%0.83280%0.797SS**  trans-47.8138.5175.4-68.1160-3500112.8
407N30.1Very low35.7Very low165 Ų165130.3 Ų130.388%0.88277%0.774SS**  -169.6120.8120.8-91.1-19000109.7
408G37.8Very low36.2Very low71 Ų71130.5 Ų130.573%0.73277%0.767SS**  trans-75144.1-169.300000113.9
409F30.8Very low36.8Very low216 Ų216125 Ų12595%0.94775%0.753SS**  trans-153.977.7149.1-112.8-83.7000106.8
410S39.8Very low37.5Very low133 Ų133124.9 Ų124.993%0.9374%0.744SS**  trans-130.989.8163.5-1680000107.2
411G36.8Very low38.4Very low60 Ų60124.1 Ų124.162%0.61974%0.735SS**  trans-146.898.1174.200000107V413G411-V413 PolarHBondContact O-N 2.85Å
412G39.7Very low39.4Very low71 Ų71126.4 Ų126.473%0.73273%0.726SS**  trans-60.5132.7176.400000110.4
413V37.4Very low40.3Very low154 Ų154126 Ų12693%0.93372%0.72SS**  trans-99.6122.4-179.9-159.90000108.4G411G411-V413 PolarHBondContact O-N 2.85Å
414G48.2Very low41.4Very low46 Ų46121.5 Ų121.547%0.47470%0.703SS.*SBendtrans138.4169.7173.900000113.8L416 G417G414-L416 PolarHBondContact O-N 3.19Å; G414-G417 PolarHBondContact O-N 2.85Å
415A41.7Very low42.3Very low87 Ų87121.7 Ų121.772%0.71970%0.696SS**Hα-helixtrans-55.5-23-176.900000114.2
416L43.7Very low43.3Very low152 Ų152114.8 Ų114.880%0.79668%0.681SS**Hα-helixtrans-73-26.6173-97140.8000114.2G414 I418G414-L416 PolarHBondContact O-N 3.19Å; L416-I418 VanDerWaalsContact C-N 3.29Å; L416-I418 PolarHBondContact O-N 3.13Å
417G50.9Low43.7Very low30 Ų30110.4 Ų110.431%0.30967%0.67SS.*Hα-helixtrans-71.1-25.2174.500000113.1G414G414-G417 PolarHBondContact O-N 2.85Å
418I50.2Low44.5Very low124 Ų124107 Ų10764%0.63667%0.665SS**Hα-helixtrans-78.1-32.8179.8-58.2176.3000111.1L416L416-I418 VanDerWaalsContact C-N 3.29Å; L416-I418 PolarHBondContact O-N 3.13Å
419M49Very low44.9Very low128 Ų128108.4 Ų108.463%0.63166%0.663SS**Hα-helixtrans-68.5-33.8176.2-103.1173.37300112.9R422 L423M419-R422 PolarHBondContact O-N 2.98Å; M419-L423 PolarHBondContact O-N 3.45Å
420N45.5Very low45.4Very low118 Ų118112.7 Ų112.763%0.63167%0.673SS**Hα-helixtrans-73.3-32.4-176.4-153.528.5000112.7A424N420-A424 PolarHBondContact O-N 3.46Å
421N48.7Very low45.6Very low113 Ų113111.7 Ų111.760%0.60466%0.661SS**Hα-helixtrans-71.2-30.6175-80.6-9.7000112.8E425N421-E425 WeakPolarHBondContact O-CG 3.47Å; N421-E425 PolarHBondContact O-N 3.48Å
422R48Very low46.1Very low174 Ų174114.4 Ų114.466%0.65766%0.663SS**Hα-helixtrans-75.5-25.6177.5-78.1-69.8-161.8-164.25.9113.9M419 E425 T426M419-R422 PolarHBondContact O-N 2.98Å; R422-E425 IonicContact NH1-OE2 3.95Å; R422-E425 PolarHBondContact NH1-OE2 3.26Å; R422-T426 PolarHBondContact O-OG1 3.42Å
423L47.1Very low46.5Very low107 Ų107116.8 Ų116.856%0.5666%0.659SS**Hα-helixtrans-82.3-28.1174.6-72167.6000112.4M419 T426 S427M419-L423 PolarHBondContact O-N 3.45Å; L423-T426 PolarHBondContact O-OG1 2.71Å; L423-S427 PolarHBondContact O-OG 2.98Å; L423-S427 VanDerWaalsContact O-OG 3.05Å
424A49.4Very low47Very low58 Ų58114.6 Ų114.648%0.47964%0.643SS.*Hα-helixtrans-71.9-35.517300000112.7N420 T426 S427N420-A424 PolarHBondContact O-N 3.46Å; A424-T426 VanDerWaalsContact C-N 3.31Å; A424-T426 PolarHBondContact O-N 2.83Å; A424-S427 PolarHBondContact O-OG 3.03Å
425E49.7Very low46.9Very low125 Ų125118.9 Ų118.958%0.58465%0.653SS**Hα-helixtrans-69.2-23.8178.7-76.7176.6171.500114N421 R422N421-E425 WeakPolarHBondContact O-CG 3.47Å; N421-E425 PolarHBondContact O-N 3.48Å; R422-E425 IonicContact NH1-OE2 3.95Å; R422-E425 PolarHBondContact NH1-OE2 3.26Å
426T48.8Very low47.3Very low100 Ų100121.1 Ų121.161%0.61365%0.649SS**THydrogen-bonded Turntrans-95.6-7.3-17845.60000114.3R422 L423 A424R422-T426 PolarHBondContact O-OG1 3.42Å; L423-T426 PolarHBondContact O-OG1 2.71Å; A424-T426 VanDerWaalsContact C-N 3.31Å; A424-T426 PolarHBondContact O-N 2.83Å
427S44Very low47.5Very low87 Ų87118.9 Ų118.961%0.60864%0.638SS**SBendtrans-98.9-4.4176.944.10000113.7L423 A424L423-S427 PolarHBondContact O-OG 2.98Å; L423-S427 VanDerWaalsContact O-OG 3.05Å; A424-S427 PolarHBondContact O-OG 3.03Å
428A46.4Very low47.3Very low92 Ų92125.7 Ų125.776%0.7666%0.664SS**SBendtrans-94.65.3177.800000114
429S47.9Very low47Very low101 Ų101125.8 Ų125.871%0.70667%0.666SS**  trans-122.838.1177.460.40000114
430R39.7Very low46.8Very low307 Ų307125.6 Ų125.6100%1.15867%0.669SS**  trans-137.30159.8-87.6-169.9173.5167.4-1.3111.6

Retrieved 430 of 430 residues in 72.2 ms (Link to these results)