A0A096MJE7_RAT Loading...

Thiamine transporter 1

High-affinity transporter for the intake of thiamine.

AlphaFold DB (F1LNC9), UniProt , Accession A0A096MJE7, Species RAT (Rattus norvegicus, Rat), Gene Slc19a2, Length 475 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
1M40.2Very low32.6Very low244 Ų244159 Ų159100%1.20286%0.863SS**  079.10-75.8173.9166.700106.1
2A32.5Very low32.1Very low91 Ų91164.5 Ų164.575%0.75286%0.862SS**  67.7122.267.400000112.8
3R35Very low31.6Very low229 Ų229163.2 Ų163.286%0.86486%0.864SS**  trans103.3124.8173.7-68.1-170.1-99.5170.6-7.4115
4D36.9Very low31.4Very low148 Ų148160.1 Ų160.179%0.79186%0.855SS**  cis-156.5148.37.9-89.4-36.4000110.9
5H33.5Very low31.1Very low184 Ų184163.1 Ų163.185%0.85285%0.85SS**  trans-91.1163170.6-116.9-88.9000109.9
6E32.6Very low31Very low195 Ų195164.2 Ų164.291%0.91184%0.839SS**  trans104.1124.5163.9-65.2-173.1142.800118.1
7G33.4Very low31.3Very low69 Ų69156.6 Ų156.671%0.71180%0.799SS**  trans159.568.3169.800000114.9
8T29.1Very low31.5Very low138 Ų138148.8 Ų148.885%0.84776%0.759SS**  trans9.8123.9142.717.50000119.3
9E31.8Very low31.8Very low192 Ų192141.3 Ų141.390%0.89772%0.721SS**  trans-162.2110.3135.2-113174.5-173.200114.2
10T26.7Very low31.8Very low137 Ų137134.7 Ų134.784%0.8469%0.687SS**  trans-41.3133.2159.620.90000116.1
11C26.6Very low31.9Very low122 Ų122131.4 Ų131.482%0.82467%0.67SS**  trans-147.4100.9153.4-143.50000114.3
12R27.3Very low31.6Very low225 Ų225121.7 Ų121.785%0.84962%0.624SS**  trans49.7100.7147.9-70.2-178.9-165.3162.27121.4
13V25.6Very low32Very low147 Ų147119.4 Ų119.489%0.89160%0.596SS**  trans-89.9123.1149.8172.10000109.1
14T28.7Very low32.2Very low120 Ų120108.9 Ų108.974%0.73656%0.556SS**  trans-14389171.2-33.20000107.4
15R27Very low32.4Very low206 Ų206102.3 Ų102.378%0.77752%0.521SS*.  54.1107.886.6-146.2-165.3-95.3-162.2-1.3113.4
16R29.1Very low32.7Very low180 Ų18094 Ų9468%0.67948%0.483SS*.  163.3117.2119.4-86.6-175.8-166.4-1592.3116.3
17H36.5Very low32.9Very low35 Ų3584.8 Ų84.816%0.16244%0.44CS..  trans71.9114.3135.6-54.7-47.3000124V157 S158 I309H17-V157 VanDerWaalsContact CA-CG1 3.41Å; H17-V157 HydrophobicContact CB-CG1 3.5Å; H17-V157 PolarHBondContact CE1-O 2.86Å; H17-V157 WeakPolarHBondContact ND1-CG1 3.29Å; H17-V157 PolarHBondContact ND1-O 3.37Å; H17-S158 WeakPolarHBondContact CE1-CA 3.5Å; H17-S158 PolarHBondContact CE1-O 3.34Å; H17-S158 VanDerWaalsContact CE1-O 3.25Å; H17-S158 WeakPolarHBondContact ND1-CA 3.48Å; H17-S158 PolarHBondContact NE2-O 3.48Å; H17-I309 VanDerWaalsContact O-CD1 3.3Å; H17-I309 WeakPolarHBondContact O-CD1 3.37Å
18Q34.6Very low33.1Very low16 Ų1681.9 Ų81.98%0.07541%0.408CS..  trans-155.4145.9151.9-125.8168.55.300114.2C27 V157 L164 I309Q18-C27 HydrophobicContact CB-CB 4.17Å; Q18-C27 HydrophobicContact CG-CB 4.23Å; Q18-C27 PolarHBondContact NE2-SG 3.25Å; Q18-C27 VanDerWaalsContact NE2-SG 3.38Å; Q18-C27 PolarHBondContact OE1-SG 3.28Å; Q18-V157 VanDerWaalsContact N-CG1 3.26Å; Q18-V157 WeakPolarHBondContact O-CG2 3.36Å; Q18-L164 HydrophobicContact CB-CD1 4.39Å; Q18-L164 WeakPolarHBondContact O-CD2 3.38Å; Q18-I309 HydrophobicContact CB-CD1 4.44Å; Q18-I309 VanDerWaalsContact CD-CD1 3.49Å; Q18-I309 HydrophobicContact CG-CB 3.58Å; Q18-I309 HydrophobicContact CG-CD1 3.57Å; Q18-I309 HydrophobicContact CG-CG1 3.82Å; Q18-I309 HydrophobicContact CG-CG2 3.47Å; Q18-I309 VanDerWaalsContact CG-CG2 3.47Å
19T36.6Very low33.6Very low7 Ų776.4 Ų76.44%0.04337%0.373CS..  trans-89.3153.4-161.8160000119.1Q154 G312T19-Q154 HydrophobicContact CG2-CB 3.53Å; T19-Q154 HydrophobicContact CG2-CG 3.99Å; T19-G312 PolarHBondContact OG1-N 2.83Å
20L32.3Very low34Very low8 Ų868.7 Ų68.74%0.04234%0.338CS..  trans-67155.9165-75.3126.8000111.9R24 L167 S171L20-R24 VanDerWaalsContact CD2-CZ 3.48Å; L20-R24 VanDerWaalsContact CG-NH1 3.33Å; L20-L167 HydrophobicContact CD1-CB 3.76Å; L20-L167 HydrophobicContact CD1-CD1 3.98Å; L20-L167 HydrophobicContact CD1-CD2 3.35Å; L20-L167 HydrophobicContact CD1-CG 3.85Å; L20-L167 HydrophobicContact CD2-CB 4.26Å; L20-L167 HydrophobicContact CG-CB 4.1Å; L20-S171 WeakPolarHBondContact CD2-OG 3.38Å
21E35Very low34.5Very low67 Ų6765 Ų6531%0.31332%0.318SS..SBendcis-157.3149.623.1-143.2140.3-167.900110.8R23 G149 S171E21-R23 PolarHBondContact O-N 3.25Å; E21-G149 VanDerWaalsContact OE2-C 3.3Å; E21-G149 WeakPolarHBondContact OE2-CA 3.36Å; E21-S171 PolarHBondContact OE1-OG 3.43Å
22T33.1Very low35Very low39 Ų3964.1 Ų64.124%0.23930%0.298CS..SBendtrans69.6-12.7170.37.90000121.7W89 Y108T22-W89 HydrophobicContact CG2-CH2 3.69Å; T22-W89 HydrophobicContact CG2-CZ2 3.78Å; T22-Y108 HydrophobicContact CG2-CE2 3.85Å; T22-Y108 WeakPolarHBondContact CG2-OH 3.3Å; T22-Y108 PolarHBondContact O-OH 3.49Å
23R40.5Very low35.5Very low43 Ų4355.3 Ų55.316%0.16227%0.269CS..  trans-110.425156-73.7-174.4-175-78.51.2112.7E21 T25 I26 V291 N292 Q295E21-R23 PolarHBondContact O-N 3.25Å; R23-T25 PolarHBondContact O-N 3.29Å; R23-I26 PolarHBondContact O-N 3.41Å; R23-V291 VanDerWaalsContact CD-O 3.25Å; R23-V291 WeakPolarHBondContact CD-O 3.46Å; R23-V291 PolarHBondContact NE-O 2.68Å; R23-N292 VanDerWaalsContact NH1-CA 3.27Å; R23-N292 PolarHBondContact NH1-OD1 2.95Å; R23-N292 PolarHBondContact NH2-OD1 2.82Å; R23-Q295 PolarHBondContact O-OE1 3.14Å; R23-Q295 VanDerWaalsContact O-OE1 3.08Å
24R39.9Very low36Very low9 Ų955 Ų553%0.03426%0.263CS..THydrogen-bonded Turntrans-65.3-1.1-177.7-60.2-171.993.7-175.96.9113.3L20 I26 W28 L164 L167 N168L20-R24 VanDerWaalsContact CD2-CZ 3.48Å; L20-R24 VanDerWaalsContact CG-NH1 3.33Å; R24-I26 VanDerWaalsContact C-N 3.3Å; R24-I26 PolarHBondContact O-N 3.31Å; R24-W28 WeakPolarHBondContact O-CA 3.36Å; R24-W28 WeakPolarHBondContact O-CB 3.49Å; R24-W28 PolarHBondContact O-N 2.86Å; R24-L164 VanDerWaalsContact NH2-CD2 3.26Å; R24-L167 VanDerWaalsContact NH1-C 3.27Å; R24-L167 PolarHBondContact NH1-O 3.44Å; R24-N168 PolarHBondContact NH1-ND2 2.88Å
25T40.1Very low36.3Very low10 Ų1058.3 Ų58.36%0.06127%0.27CS..Hα-helixtrans-58.2-45.5170.5-6.80000109.4R23 L29 L92 V101 L104 E105R23-T25 PolarHBondContact O-N 3.29Å; T25-L29 HydrophobicContact CG2-CD1 3.47Å; T25-L29 VanDerWaalsContact CG2-CD1 3.47Å; T25-L29 HydrophobicContact CG2-CD2 4.49Å; T25-L29 HydrophobicContact CG2-CG 3.86Å; T25-L29 WeakPolarHBondContact O-CA 3.49Å; T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 WeakPolarHBondContact O-CD1 3.4Å; T25-L29 WeakPolarHBondContact O-CG 3.5Å; T25-L29 PolarHBondContact O-N 3.05Å; T25-L92 HydrophobicContact CG2-CD2 4.12Å; T25-V101 HydrophobicContact CG2-CG1 4.01Å; T25-L104 HydrophobicContact CG2-CD2 4.02Å; T25-E105 WeakPolarHBondContact CB-OE1 3.34Å; T25-E105 VanDerWaalsContact CG2-OE1 3.26Å; T25-E105 WeakPolarHBondContact CG2-OE1 3.23Å; T25-E105 PolarHBondContact OG1-OE1 3.22Å
26I40.6Very low36.6Very low8 Ų856 Ų564%0.04126%0.261CS..Hα-helixtrans-63.9-62.8179.2-73.7153.7000112.8R23 R24 W28 L29 L30 V46 F47 Y51 Q295R23-I26 PolarHBondContact O-N 3.41Å; R24-I26 VanDerWaalsContact C-N 3.3Å; R24-I26 PolarHBondContact O-N 3.31Å; I26-W28 VanDerWaalsContact C-N 3.26Å; I26-W28 PolarHBondContact O-N 3.48Å; I26-L29 PolarHBondContact O-N 2.79Å; I26-L30 HydrophobicContact CG2-CD1 3.3Å; I26-L30 HydrophobicContact CG2-CG 3.88Å; I26-L30 WeakPolarHBondContact O-CA 3.49Å; I26-L30 WeakPolarHBondContact O-CB 3.38Å; I26-L30 WeakPolarHBondContact O-CG 3.27Å; I26-L30 PolarHBondContact O-N 2.81Å; I26-V46 HydrophobicContact CG1-CG1 4.08Å; I26-F47 HydrophobicContact CD1-CD1 4.33Å; I26-F47 HydrophobicContact CD1-CE1 3.24Å; I26-F47 HydrophobicContact CD1-CZ 3.42Å; I26-F47 VanDerWaalsContact CD1-CZ 3.42Å; I26-F47 HydrophobicContact CG1-CE1 4.16Å; I26-F47 HydrophobicContact CG1-CZ 4.15Å; I26-Y51 HydrophobicContact CD1-CD2 4.5Å; I26-Y51 HydrophobicContact CD1-CE1 4.22Å; I26-Y51 HydrophobicContact CD1-CE2 3.39Å; I26-Y51 WeakPolarHBondContact CD1-OH 3.44Å; I26-Y51 HydrophobicContact CG1-CE1 4.05Å; I26-Y51 HydrophobicContact CG1-CE2 4.13Å; I26-Y51 VanDerWaalsContact CG1-CZ 3.49Å; I26-Y51 WeakPolarHBondContact CG1-OH 3.49Å; I26-Y51 PolarHBondContact N-OH 3.13Å; I26-Q295 HydrophobicContact CD1-CB 4.02Å
27C36.8Very low36.8Very low3 Ų349.3 Ų49.32%0.0224%0.236CC..Hα-helixtrans-62.9-31.7-175.8-62.10000113.6Q18 S31 L164Q18-C27 HydrophobicContact CB-CB 4.17Å; Q18-C27 HydrophobicContact CG-CB 4.23Å; Q18-C27 PolarHBondContact NE2-SG 3.25Å; Q18-C27 VanDerWaalsContact NE2-SG 3.38Å; Q18-C27 PolarHBondContact OE1-SG 3.28Å; C27-S31 VanDerWaalsContact O-CB 3.29Å; C27-S31 WeakPolarHBondContact O-CB 3.39Å; C27-S31 PolarHBondContact O-N 2.69Å; C27-L164 HydrophobicContact CB-CD1 4.37Å; C27-L164 WeakPolarHBondContact O-CD1 3.18Å
28W36.6Very low37Very low8 Ų853.3 Ų53.33%0.0326%0.263CS..Hα-helixtrans-80.6-40.5178.2-146.192.1000112.8R24 I26 L30 S31 Y32 L92 L93 L164 F165 N168R24-W28 WeakPolarHBondContact O-CA 3.36Å; R24-W28 WeakPolarHBondContact O-CB 3.49Å; R24-W28 PolarHBondContact O-N 2.86Å; I26-W28 VanDerWaalsContact C-N 3.26Å; I26-W28 PolarHBondContact O-N 3.48Å; W28-L30 VanDerWaalsContact C-N 3.34Å; W28-S31 PolarHBondContact O-N 3.04Å; W28-Y32 HydrophobicContact CE3-CD2 4.17Å; W28-Y32 HydrophobicContact CE3-CG 4.1Å; W28-Y32 HydrophobicContact CH2-CD1 4.47Å; W28-Y32 AromaticContact CH2-CD2 3.34Å; W28-Y32 HydrophobicContact CH2-CD2 3.34Å; W28-Y32 AromaticContact CH2-CE2 3.44Å; W28-Y32 HydrophobicContact CH2-CE2 3.44Å; W28-Y32 VanDerWaalsContact CH2-CE2 3.44Å; W28-Y32 AromaticContact CH2-CG 3.9Å; W28-Y32 HydrophobicContact CH2-CG 3.9Å; W28-Y32 HydrophobicContact CZ2-CD2 4.17Å; W28-Y32 HydrophobicContact CZ2-CE2 4.32Å; W28-Y32 AromaticContact CZ3-CD1 3.91Å; W28-Y32 HydrophobicContact CZ3-CD1 3.91Å; W28-Y32 AromaticContact CZ3-CD2 3.29Å; W28-Y32 HydrophobicContact CZ3-CD2 3.29Å; W28-Y32 HydrophobicContact CZ3-CE1 4.35Å; W28-Y32 AromaticContact CZ3-CE2 3.82Å; W28-Y32 HydrophobicContact CZ3-CE2 3.82Å; W28-Y32 AromaticContact CZ3-CG 3.34Å; W28-Y32 HydrophobicContact CZ3-CG 3.34Å; W28-Y32 WeakPolarHBondContact O-CB 3.47Å; W28-Y32 PolarHBondContact O-N 3.04Å; W28-L92 WeakPolarHBondContact CH2-O 3.1Å; W28-L92 WeakPolarHBondContact CZ3-O 3.49Å; W28-L93 HydrophobicContact CH2-CD2 4.46Å; W28-L93 HydrophobicContact CZ2-CD2 3.82Å; W28-L164 VanDerWaalsContact CD1-CB 3.5Å; W28-L164 HydrophobicContact CG-CB 4.46Å; W28-L164 PolarHBondContact NE1-O 3.2Å; W28-F165 HydrophobicContact CH2-CD2 4.11Å; W28-F165 HydrophobicContact CZ2-CB 4.07Å; W28-F165 AromaticContact CZ2-CD2 3.73Å; W28-F165 HydrophobicContact CZ2-CD2 3.73Å; W28-F165 HydrophobicContact CZ2-CG 4.3Å; W28-N168 PolarHBondContact NE1-ND2 3.42Å
29L39.8Very low37.4Very low23 Ų2358.5 Ų58.512%0.1229%0.287CS..Hα-helixtrans-57.9-51.1167.6-68.8165.7000108.9T25 I26 S31 Y32 T33 V46 I50 V101T25-L29 HydrophobicContact CG2-CD1 3.47Å; T25-L29 VanDerWaalsContact CG2-CD1 3.47Å; T25-L29 HydrophobicContact CG2-CD2 4.49Å; T25-L29 HydrophobicContact CG2-CG 3.86Å; T25-L29 WeakPolarHBondContact O-CA 3.49Å; T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 WeakPolarHBondContact O-CD1 3.4Å; T25-L29 WeakPolarHBondContact O-CG 3.5Å; T25-L29 PolarHBondContact O-N 3.05Å; I26-L29 PolarHBondContact O-N 2.79Å; L29-S31 PolarHBondContact O-N 2.64Å; L29-Y32 PolarHBondContact O-N 2.84Å; L29-Y32 VanDerWaalsContact O-N 3.1Å; L29-T33 PolarHBondContact O-N 3.21Å; L29-T33 PolarHBondContact O-OG1 3.41Å; L29-V46 HydrophobicContact CD1-CG1 4.16Å; L29-I50 HydrophobicContact CD1-CD1 4.28Å; L29-V101 HydrophobicContact CD1-CG1 3.79Å; L29-V101 HydrophobicContact CD2-CB 4.24Å; L29-V101 HydrophobicContact CD2-CG1 3.66Å; L29-V101 HydrophobicContact CD2-CG2 3.48Å; L29-V101 VanDerWaalsContact CD2-CG2 3.48Å; L29-V101 HydrophobicContact CG-CG1 4.28Å
30L41Very low38Very low29 Ų2963.8 Ų63.815%0.15231%0.314CS..Hα-helixtrans-53.7-38.9178.5-73.9175.1000112.3I26 W28 W37 E299I26-L30 HydrophobicContact CG2-CD1 3.3Å; I26-L30 HydrophobicContact CG2-CG 3.88Å; I26-L30 WeakPolarHBondContact O-CA 3.49Å; I26-L30 WeakPolarHBondContact O-CB 3.38Å; I26-L30 WeakPolarHBondContact O-CG 3.27Å; I26-L30 PolarHBondContact O-N 2.81Å; W28-L30 VanDerWaalsContact C-N 3.34Å; L30-W37 HydrophobicContact CD2-CD2 4.04Å; L30-W37 HydrophobicContact CD2-CE3 4.27Å; L30-W37 HydrophobicContact CD2-CH2 3.96Å; L30-W37 HydrophobicContact CD2-CZ2 3.81Å; L30-W37 HydrophobicContact CD2-CZ3 4.21Å; L30-E299 HydrophobicContact CD1-CG 4.49Å
31S36.9Very low39Very low60 Ų6066.6 Ų66.642%0.4233%0.334SS..Hα-helixtrans-88.1-15.6-179.2-1680000114.8C27 W28 L29 L164C27-S31 VanDerWaalsContact O-CB 3.29Å; C27-S31 WeakPolarHBondContact O-CB 3.39Å; C27-S31 PolarHBondContact O-N 2.69Å; W28-S31 PolarHBondContact O-N 3.04Å; L29-S31 PolarHBondContact O-N 2.64Å; S31-L164 VanDerWaalsContact CB-CD1 3.41Å
32Y36.3Very low39.9Very low103 Ų10365.1 Ų65.140%0.40433%0.328SS..Hα-helixtrans-96.7-14.1178.1-144.8-106.9000112.7W28 L29 Q96W28-Y32 HydrophobicContact CE3-CD2 4.17Å; W28-Y32 HydrophobicContact CE3-CG 4.1Å; W28-Y32 HydrophobicContact CH2-CD1 4.47Å; W28-Y32 AromaticContact CH2-CD2 3.34Å; W28-Y32 HydrophobicContact CH2-CD2 3.34Å; W28-Y32 AromaticContact CH2-CE2 3.44Å; W28-Y32 HydrophobicContact CH2-CE2 3.44Å; W28-Y32 VanDerWaalsContact CH2-CE2 3.44Å; W28-Y32 AromaticContact CH2-CG 3.9Å; W28-Y32 HydrophobicContact CH2-CG 3.9Å; W28-Y32 HydrophobicContact CZ2-CD2 4.17Å; W28-Y32 HydrophobicContact CZ2-CE2 4.32Å; W28-Y32 AromaticContact CZ3-CD1 3.91Å; W28-Y32 HydrophobicContact CZ3-CD1 3.91Å; W28-Y32 AromaticContact CZ3-CD2 3.29Å; W28-Y32 HydrophobicContact CZ3-CD2 3.29Å; W28-Y32 HydrophobicContact CZ3-CE1 4.35Å; W28-Y32 AromaticContact CZ3-CE2 3.82Å; W28-Y32 HydrophobicContact CZ3-CE2 3.82Å; W28-Y32 AromaticContact CZ3-CG 3.34Å; W28-Y32 HydrophobicContact CZ3-CG 3.34Å; W28-Y32 WeakPolarHBondContact O-CB 3.47Å; W28-Y32 PolarHBondContact O-N 3.04Å; L29-Y32 PolarHBondContact O-N 2.84Å; L29-Y32 VanDerWaalsContact O-N 3.1Å; Y32-Q96 HydrophobicContact CE1-CG 4.48Å
33T37.9Very low41.3Very low41 Ų4164.9 Ų64.925%0.25233%0.326SS..  trans-10336.2176.153.70000112.5L29 E35 W36 W37L29-T33 PolarHBondContact O-N 3.21Å; L29-T33 PolarHBondContact O-OG1 3.41Å; T33-E35 PolarHBondContact O-N 3.03Å; T33-W36 PolarHBondContact O-N 3.31Å; T33-W37 VanDerWaalsContact O-CD1 3.29Å; T33-W37 PolarHBondContact OG1-NE1 3.22Å
34D37.8Very low42.4Very low141 Ų14166 Ų6675%0.75434%0.335SS*.THydrogen-bonded Turntrans-53.3-13.3-179.2-106.2-16.4000114.2
35E34.7Very low43.8Very low188 Ų18869.9 Ų69.988%0.87935%0.352SS*.THydrogen-bonded Turntrans-88.1-4.3172.3-77.6-177.9152.400115.8T33T33-E35 PolarHBondContact O-N 3.03Å
36W32.1Very low45.2Very low159 Ų15970.2 Ų70.260%0.60235%0.354SS*.THydrogen-bonded Turntrans-117.4-6.4-168-65.282.5000116T33T33-W36 PolarHBondContact O-N 3.31Å
37W34.5Very low46.9Very low38 Ų3870 Ų7014%0.14435%0.353CS..  trans-110.440.9-161.5-75.499.5000118.2L30 T33 H39 E42 T43 V46L30-W37 HydrophobicContact CD2-CD2 4.04Å; L30-W37 HydrophobicContact CD2-CE3 4.27Å; L30-W37 HydrophobicContact CD2-CH2 3.96Å; L30-W37 HydrophobicContact CD2-CZ2 3.81Å; L30-W37 HydrophobicContact CD2-CZ3 4.21Å; T33-W37 VanDerWaalsContact O-CD1 3.29Å; T33-W37 PolarHBondContact OG1-NE1 3.22Å; W37-H39 VanDerWaalsContact C-N 3.32Å; W37-E42 HydrophobicContact CD2-CB 3.88Å; W37-E42 HydrophobicContact CE3-CB 3.53Å; W37-E42 HydrophobicContact CH2-CB 3.42Å; W37-E42 VanDerWaalsContact CH2-CB 3.42Å; W37-E42 WeakPolarHBondContact CH2-O 3.47Å; W37-E42 HydrophobicContact CZ2-CB 3.71Å; W37-E42 HydrophobicContact CZ3-CB 3.29Å; W37-T43 VanDerWaalsContact CZ3-CA 3.42Å; W37-T43 WeakPolarHBondContact CZ3-OG1 3.03Å; W37-V46 HydrophobicContact CH2-CG2 4.03Å; W37-V46 HydrophobicContact CZ2-CG2 3.88Å
38T40.4Very low49Very low120 Ų12070.2 Ų70.274%0.73635%0.354SS*.SBendtrans-82.6-5.3167.344.90000113.9
39H43.3Very low51.1Low124 Ų12473 Ų7357%0.57437%0.367SS*.SBendtrans-137.9130.8-171.8-60.1-54.9000114.7W37 S41 E42W37-H39 VanDerWaalsContact C-N 3.32Å; H39-S41 WeakPolarHBondContact CB-OG 3.47Å; H39-S41 PolarHBondContact O-N 2.93Å; H39-E42 PolarHBondContact O-N 2.85Å
40L48.6Very low53.2Low119 Ų11972.3 Ų72.362%0.62336%0.364SS*.THydrogen-bonded Turntrans-47.1-21.8174-154.792.6000114.3E42 T43 K300L40-E42 VanDerWaalsContact C-N 3.28Å; L40-E42 PolarHBondContact O-N 3.38Å; L40-T43 PolarHBondContact O-N 3.22Å; L40-K300 HydrophobicContact CD1-CD 4.32Å
41S52.1Low55.2Low66 Ų6671.2 Ų71.246%0.46236%0.357SS..Hα-helixtrans-60.7-33177.450.20000113.6H39 T43 K45H39-S41 WeakPolarHBondContact CB-OG 3.47Å; H39-S41 PolarHBondContact O-N 2.93Å; S41-T43 VanDerWaalsContact C-N 3.35Å; S41-K45 PolarHBondContact O-N 3.16Å
42E55.7Low57.7Low36 Ų3668.5 Ų68.517%0.16834%0.338CS..Hα-helixtrans-75-29-178.6-66.3-84.6128.400110.6W37 H39 L40 L44 K45 V46W37-E42 HydrophobicContact CD2-CB 3.88Å; W37-E42 HydrophobicContact CE3-CB 3.53Å; W37-E42 HydrophobicContact CH2-CB 3.42Å; W37-E42 VanDerWaalsContact CH2-CB 3.42Å; W37-E42 WeakPolarHBondContact CH2-O 3.47Å; W37-E42 HydrophobicContact CZ2-CB 3.71Å; W37-E42 HydrophobicContact CZ3-CB 3.29Å; H39-E42 PolarHBondContact O-N 2.85Å; L40-E42 VanDerWaalsContact C-N 3.28Å; L40-E42 PolarHBondContact O-N 3.38Å; E42-L44 VanDerWaalsContact C-N 3.29Å; E42-L44 PolarHBondContact O-N 3.49Å; E42-K45 WeakPolarHBondContact O-CB 3.49Å; E42-K45 PolarHBondContact O-N 3.22Å; E42-K45 VanDerWaalsContact O-N 3.14Å; E42-K45 IonicContact OE1-NZ 3.97Å; E42-K45 PolarHBondContact OE1-NZ 3.06Å; E42-V46 PolarHBondContact O-N 3.22Å; E42-V46 VanDerWaalsContact O-N 3.13Å
43T61.2Low60.4Low34 Ų3465 Ų6521%0.20933%0.328CS..Hα-helixtrans-64-44.6-179.9-55.40000108.6W37 L40 S41 K45 V46 F47W37-T43 VanDerWaalsContact CZ3-CA 3.42Å; W37-T43 WeakPolarHBondContact CZ3-OG1 3.03Å; L40-T43 PolarHBondContact O-N 3.22Å; S41-T43 VanDerWaalsContact C-N 3.35Å; T43-K45 VanDerWaalsContact C-N 3.34Å; T43-K45 PolarHBondContact O-N 2.78Å; T43-V46 PolarHBondContact O-N 2.81Å; T43-F47 HydrophobicContact CG2-CD2 3.76Å; T43-F47 HydrophobicContact CG2-CE2 3.33Å; T43-F47 HydrophobicContact CG2-CZ 4.48Å; T43-F47 WeakPolarHBondContact O-CD2 3.24Å; T43-F47 PolarHBondContact O-N 3.38Å
44L64.1Low62.9Low66 Ų6663.7 Ų63.735%0.34632%0.318SS..Hα-helixtrans-63.3-39.4177.1-165.367.9000111.6E42 V46 F47 N48E42-L44 VanDerWaalsContact C-N 3.29Å; E42-L44 PolarHBondContact O-N 3.49Å; L44-V46 PolarHBondContact O-N 2.9Å; L44-F47 PolarHBondContact O-N 2.91Å; L44-N48 WeakPolarHBondContact CD1-ND2 3.24Å; L44-N48 VanDerWaalsContact CG-ND2 3.34Å; L44-N48 WeakPolarHBondContact CG-ND2 3.29Å; L44-N48 WeakPolarHBondContact O-CB 3.05Å; L44-N48 PolarHBondContact O-N 3.49Å; L44-N48 PolarHBondContact O-OD1 3.13Å
45K68.7Low65.4Low92 Ų9257 Ų5740%0.428%0.283SS..Hα-helixtrans-60.7-44.3176-70.8179.4-175.4169.40112.1S41 E42 T43 F47 N48 E49S41-K45 PolarHBondContact O-N 3.16Å; E42-K45 WeakPolarHBondContact O-CB 3.49Å; E42-K45 PolarHBondContact O-N 3.22Å; E42-K45 VanDerWaalsContact O-N 3.14Å; E42-K45 IonicContact OE1-NZ 3.97Å; E42-K45 PolarHBondContact OE1-NZ 3.06Å; T43-K45 VanDerWaalsContact C-N 3.34Å; T43-K45 PolarHBondContact O-N 2.78Å; K45-F47 VanDerWaalsContact C-N 3.34Å; K45-F47 PolarHBondContact O-N 3.17Å; K45-N48 PolarHBondContact O-N 3.28Å; K45-E49 WeakPolarHBondContact O-CA 3.47Å; K45-E49 VanDerWaalsContact O-CB 3.24Å; K45-E49 WeakPolarHBondContact O-CB 3.3Å; K45-E49 PolarHBondContact O-N 2.9Å
46V71Confident68.2Low16 Ų1650.9 Ų50.910%0.09725%0.252CS..Iπ-helixtrans-60.2-46.4178.3177.70000111I26 L29 W37 E42 T43 L44 I50 Y51I26-V46 HydrophobicContact CG1-CG1 4.08Å; L29-V46 HydrophobicContact CD1-CG1 4.16Å; W37-V46 HydrophobicContact CH2-CG2 4.03Å; W37-V46 HydrophobicContact CZ2-CG2 3.88Å; E42-V46 PolarHBondContact O-N 3.22Å; E42-V46 VanDerWaalsContact O-N 3.13Å; T43-V46 PolarHBondContact O-N 2.81Å; L44-V46 PolarHBondContact O-N 2.9Å; V46-I50 HydrophobicContact CB-CD1 4.48Å; V46-I50 HydrophobicContact CG1-CD1 4.37Å; V46-I50 HydrophobicContact CG2-CD1 4.29Å; V46-I50 WeakPolarHBondContact O-CB 3.27Å; V46-I50 PolarHBondContact O-N 3Å; V46-Y51 HydrophobicContact CG1-CD1 4.3Å; V46-Y51 HydrophobicContact CG1-CE1 4.17Å; V46-Y51 PolarHBondContact O-N 3.19Å
47F74.8Confident71.1Confident4 Ų443.7 Ų43.72%0.01823%0.226CC..Iπ-helixtrans-70.4-35.7-179.4-68.5-57.3000113.8I26 T43 L44 K45 Y51 P52 Y293 V421I26-F47 HydrophobicContact CD1-CD1 4.33Å; I26-F47 HydrophobicContact CD1-CE1 3.24Å; I26-F47 HydrophobicContact CD1-CZ 3.42Å; I26-F47 VanDerWaalsContact CD1-CZ 3.42Å; I26-F47 HydrophobicContact CG1-CE1 4.16Å; I26-F47 HydrophobicContact CG1-CZ 4.15Å; T43-F47 HydrophobicContact CG2-CD2 3.76Å; T43-F47 HydrophobicContact CG2-CE2 3.33Å; T43-F47 HydrophobicContact CG2-CZ 4.48Å; T43-F47 WeakPolarHBondContact O-CD2 3.24Å; T43-F47 PolarHBondContact O-N 3.38Å; L44-F47 PolarHBondContact O-N 2.91Å; K45-F47 VanDerWaalsContact C-N 3.34Å; K45-F47 PolarHBondContact O-N 3.17Å; F47-Y51 AromaticContact CD1-CD2 3.84Å; F47-Y51 HydrophobicContact CD1-CD2 3.84Å; F47-Y51 HydrophobicContact CD1-CE2 4.16Å; F47-Y51 HydrophobicContact CD1-CG 4.41Å; F47-Y51 HydrophobicContact CE1-CD2 4.09Å; F47-Y51 AromaticContact CE1-CE2 3.94Å; F47-Y51 HydrophobicContact CE1-CE2 3.94Å; F47-P52 VanDerWaalsContact O-CD 3.26Å; F47-P52 WeakPolarHBondContact O-CD 3.45Å; F47-Y293 HydrophobicContact CB-CD1 4.4Å; F47-Y293 HydrophobicContact CB-CE1 4.3Å; F47-Y293 AromaticContact CD1-CD1 3.51Å; F47-Y293 HydrophobicContact CD1-CD1 3.51Å; F47-Y293 AromaticContact CD1-CE1 3.89Å; F47-Y293 HydrophobicContact CD1-CE1 3.89Å; F47-Y293 HydrophobicContact CE1-CD1 4.11Å; F47-Y293 HydrophobicContact CG-CD1 4.24Å; F47-V421 WeakPolarHBondContact O-CG1 3.13Å
48N81.2Confident73.8Confident7 Ų742.8 Ų42.84%0.03722%0.222CC..Iπ-helixtrans-94.8-20.2-171-63.79.5000113.1L44 K45 V421 A423 G427L44-N48 WeakPolarHBondContact CD1-ND2 3.24Å; L44-N48 VanDerWaalsContact CG-ND2 3.34Å; L44-N48 WeakPolarHBondContact CG-ND2 3.29Å; L44-N48 WeakPolarHBondContact O-CB 3.05Å; L44-N48 PolarHBondContact O-N 3.49Å; L44-N48 PolarHBondContact O-OD1 3.13Å; K45-N48 PolarHBondContact O-N 3.28Å; N48-V421 WeakPolarHBondContact CA-O 3.19Å; N48-V421 VanDerWaalsContact CB-O 3.26Å; N48-V421 WeakPolarHBondContact CB-O 3.04Å; N48-V421 PolarHBondContact ND2-O 2.96Å; N48-V421 PolarHBondContact OD1-O 2.89Å; N48-A423 HydrophobicContact CB-CB 4.1Å; N48-A423 PolarHBondContact O-N 3.31Å; N48-G427 VanDerWaalsContact ND2-CA 3.31Å; N48-G427 WeakPolarHBondContact ND2-CA 3.35Å; N48-G427 PolarHBondContact ND2-O 3.33Å; N48-G427 VanDerWaalsContact ND2-O 3.12Å
49E81.4Confident76.4Confident66 Ų6638.9 Ų38.931%0.30820%0.197SC..Iπ-helixtrans-117.4-27.5-175.4-57.1-176.8-160.500114.2K45 L98 Q102 A423K45-E49 WeakPolarHBondContact O-CA 3.47Å; K45-E49 VanDerWaalsContact O-CB 3.24Å; K45-E49 WeakPolarHBondContact O-CB 3.3Å; K45-E49 PolarHBondContact O-N 2.9Å; E49-L98 HydrophobicContact CB-CD1 4.29Å; E49-L98 WeakPolarHBondContact OE2-CD2 3.42Å; E49-Q102 PolarHBondContact O-NE2 2.92Å; E49-A423 HydrophobicContact CG-CB 4.41Å
50I83.4Confident78.8Confident10 Ų1038.9 Ų38.95%0.05120%0.2CC..Iπ-helixtrans-98.9-56.7-176.6-66.5166.8000110.5L29 V46 P52 V53 L98 V101 Q102 E105L29-I50 HydrophobicContact CD1-CD1 4.28Å; V46-I50 HydrophobicContact CB-CD1 4.48Å; V46-I50 HydrophobicContact CG1-CD1 4.37Å; V46-I50 HydrophobicContact CG2-CD1 4.29Å; V46-I50 WeakPolarHBondContact O-CB 3.27Å; V46-I50 PolarHBondContact O-N 3Å; I50-P52 VanDerWaalsContact C-CD 3.44Å; I50-V53 VanDerWaalsContact O-CB 3.31Å; I50-V53 WeakPolarHBondContact O-CB 3.45Å; I50-V53 WeakPolarHBondContact O-CG2 3.36Å; I50-V53 PolarHBondContact O-N 2.67Å; I50-L98 HydrophobicContact CD1-CD1 3.84Å; I50-L98 HydrophobicContact CG1-CD1 3.56Å; I50-V101 HydrophobicContact CD1-CB 4.22Å; I50-V101 HydrophobicContact CD1-CG1 3.83Å; I50-V101 HydrophobicContact CG1-CG1 4.23Å; I50-V101 HydrophobicContact CG2-CG1 3.59Å; I50-Q102 HydrophobicContact CG1-CG 4.41Å; I50-E105 HydrophobicContact CG2-CG 3.54Å
51Y82.8Confident80.8Confident6 Ų634.7 Ų34.72%0.02418%0.178CC..Hα-helixtrans-60.8-34.8-173.3-82.624.2000115.3I26 V46 F47 V53 W54 N292 Y293I26-Y51 HydrophobicContact CD1-CD2 4.5Å; I26-Y51 HydrophobicContact CD1-CE1 4.22Å; I26-Y51 HydrophobicContact CD1-CE2 3.39Å; I26-Y51 WeakPolarHBondContact CD1-OH 3.44Å; I26-Y51 HydrophobicContact CG1-CE1 4.05Å; I26-Y51 HydrophobicContact CG1-CE2 4.13Å; I26-Y51 VanDerWaalsContact CG1-CZ 3.49Å; I26-Y51 WeakPolarHBondContact CG1-OH 3.49Å; I26-Y51 PolarHBondContact N-OH 3.13Å; V46-Y51 HydrophobicContact CG1-CD1 4.3Å; V46-Y51 HydrophobicContact CG1-CE1 4.17Å; V46-Y51 PolarHBondContact O-N 3.19Å; F47-Y51 AromaticContact CD1-CD2 3.84Å; F47-Y51 HydrophobicContact CD1-CD2 3.84Å; F47-Y51 HydrophobicContact CD1-CE2 4.16Å; F47-Y51 HydrophobicContact CD1-CG 4.41Å; F47-Y51 HydrophobicContact CE1-CD2 4.09Å; F47-Y51 AromaticContact CE1-CE2 3.94Å; F47-Y51 HydrophobicContact CE1-CE2 3.94Å; Y51-V53 PolarHBondContact O-N 3.31Å; Y51-W54 PolarHBondContact O-N 2.8Å; Y51-N292 WeakPolarHBondContact CE2-O 3.39Å; Y51-Y293 HydrophobicContact CD2-CD1 4.21Å; Y51-Y293 AromaticContact CD2-CE1 3.88Å; Y51-Y293 HydrophobicContact CD2-CE1 3.88Å; Y51-Y293 HydrophobicContact CG-CE1 4.42Å
52P90.6Very high82.5Confident2 Ų232.3 Ų32.31%0.01316%0.16CC..Hα-helixtrans-61.6-28.3176.3-27.438.6000112.8F47 I50 W54 T55 Y56 T417 V421 D422F47-P52 VanDerWaalsContact O-CD 3.26Å; F47-P52 WeakPolarHBondContact O-CD 3.45Å; I50-P52 VanDerWaalsContact C-CD 3.44Å; P52-W54 VanDerWaalsContact C-N 3.34Å; P52-W54 PolarHBondContact O-N 3.48Å; P52-T55 WeakPolarHBondContact O-CB 3.43Å; P52-T55 PolarHBondContact O-N 3.37Å; P52-T55 VanDerWaalsContact O-N 3.09Å; P52-Y56 HydrophobicContact CB-CD2 4.17Å; P52-Y56 HydrophobicContact CB-CE2 3.52Å; P52-Y56 WeakPolarHBondContact O-CD2 3.39Å; P52-Y56 PolarHBondContact O-N 3.4Å; P52-T417 HydrophobicContact CB-CG2 3.83Å; P52-T417 HydrophobicContact CG-CG2 3.99Å; P52-V421 HydrophobicContact CG-CG1 4.36Å; P52-D422 HydrophobicContact CG-CB 4.4Å
53V91.2Very high83.8Confident31 Ų3137.3 Ų37.319%0.18818%0.182CC..Hα-helixtrans-59.7-43.6-179.5-178.60000111.3I50 Y51 T55 Y56 S57 Q102 E105 F106I50-V53 VanDerWaalsContact O-CB 3.31Å; I50-V53 WeakPolarHBondContact O-CB 3.45Å; I50-V53 WeakPolarHBondContact O-CG2 3.36Å; I50-V53 PolarHBondContact O-N 2.67Å; Y51-V53 PolarHBondContact O-N 3.31Å; V53-T55 PolarHBondContact O-N 2.83Å; V53-Y56 PolarHBondContact O-N 2.91Å; V53-S57 WeakPolarHBondContact O-CB 3.28Å; V53-S57 PolarHBondContact O-N 3.2Å; V53-S57 PolarHBondContact O-OG 2.82Å; V53-Q102 WeakPolarHBondContact CG1-O 3.32Å; V53-Q102 HydrophobicContact CG2-CB 4.14Å; V53-Q102 HydrophobicContact CG2-CG 3.96Å; V53-E105 HydrophobicContact CB-CB 4.1Å; V53-E105 HydrophobicContact CG1-CB 4.27Å; V53-F106 HydrophobicContact CG1-CB 4.22Å
54W90.7Very high85.1Confident13 Ų1339 Ų395%0.04919%0.193CC..Hα-helixtrans-60.8-45.1174.8168.283.7000111.7Y51 P52 Y56 S57 Y58 E105 Y108 T112 N292Y51-W54 PolarHBondContact O-N 2.8Å; P52-W54 VanDerWaalsContact C-N 3.34Å; P52-W54 PolarHBondContact O-N 3.48Å; W54-Y56 PolarHBondContact O-N 3.31Å; W54-S57 PolarHBondContact O-N 3.29Å; W54-Y58 HydrophobicContact CH2-CD1 4.29Å; W54-Y58 AromaticContact CZ2-CD1 3.89Å; W54-Y58 HydrophobicContact CZ2-CD1 3.89Å; W54-Y58 HydrophobicContact CZ2-CE1 4.38Å; W54-Y58 VanDerWaalsContact O-CB 3.31Å; W54-Y58 WeakPolarHBondContact O-CB 3.36Å; W54-Y58 PolarHBondContact O-N 2.77Å; W54-E105 HydrophobicContact CB-CB 4.26Å; W54-E105 WeakPolarHBondContact CB-OE2 3.24Å; W54-Y108 AromaticContact CD1-CD1 3.35Å; W54-Y108 AromaticContact CD1-CE1 3.93Å; W54-Y108 HydrophobicContact CG-CD1 4.17Å; W54-Y108 AromaticContact NE1-CD1 3.66Å; W54-Y108 AromaticContact NE1-CE1 3.78Å; W54-T112 HydrophobicContact CZ2-CG2 4.08Å; W54-T112 PolarHBondContact NE1-OG1 3.23Å; W54-N292 WeakPolarHBondContact CZ3-OD1 3.32Å
55T90.7Very high86.2Confident1 Ų136.4 Ų36.41%0.00618%0.18CC..Hα-helixtrans-61-44.9179.8-61.50000111.5P52 V53 L59 Q413P52-T55 WeakPolarHBondContact O-CB 3.43Å; P52-T55 PolarHBondContact O-N 3.37Å; P52-T55 VanDerWaalsContact O-N 3.09Å; V53-T55 PolarHBondContact O-N 2.83Å; T55-L59 PolarHBondContact O-N 3.14Å; T55-Q413 HydrophobicContact CG2-CG 3.92Å; T55-Q413 PolarHBondContact OG1-NE2 3.18Å
56Y94.2Very high86.7Confident59 Ų5936.5 Ų36.523%0.23118%0.181CC..Hα-helixtrans-69.1-42.8179-58-32.1000112.4P52 V53 W54 Y58 L59 L60 T414 L418 D422P52-Y56 HydrophobicContact CB-CD2 4.17Å; P52-Y56 HydrophobicContact CB-CE2 3.52Å; P52-Y56 WeakPolarHBondContact O-CD2 3.39Å; P52-Y56 PolarHBondContact O-N 3.4Å; V53-Y56 PolarHBondContact O-N 2.91Å; W54-Y56 PolarHBondContact O-N 3.31Å; Y56-Y58 VanDerWaalsContact C-N 3.34Å; Y56-Y58 PolarHBondContact O-N 2.79Å; Y56-L59 PolarHBondContact O-N 3.39Å; Y56-L60 WeakPolarHBondContact O-CB 3.06Å; Y56-L60 PolarHBondContact O-N 3.36Å; Y56-T414 HydrophobicContact CD1-CG2 3.66Å; Y56-T414 HydrophobicContact CE1-CG2 3.84Å; Y56-L418 HydrophobicContact CE1-CB 4.42Å; Y56-L418 WeakPolarHBondContact OH-CA 3.38Å; Y56-D422 WeakPolarHBondContact CE2-OD2 3.47Å; Y56-D422 VanDerWaalsContact CZ-OD2 3.3Å; Y56-D422 WeakPolarHBondContact OH-CB 3.32Å; Y56-D422 PolarHBondContact OH-OD2 2.94Å
57S93.3Very high87.2Confident8 Ų840.1 Ų40.16%0.05620%0.199CC..Hα-helixtrans-62.5-43.9178.5-55.50000110.6V53 W54 L60 L61 F106V53-S57 WeakPolarHBondContact O-CB 3.28Å; V53-S57 PolarHBondContact O-N 3.2Å; V53-S57 PolarHBondContact O-OG 2.82Å; W54-S57 PolarHBondContact O-N 3.29Å; S57-L60 PolarHBondContact O-N 2.99Å; S57-L61 WeakPolarHBondContact O-CB 2.68Å; S57-L61 VanDerWaalsContact O-CD1 3.32Å; S57-L61 WeakPolarHBondContact O-CD1 3.27Å; S57-L61 WeakPolarHBondContact O-CG 3.35Å; S57-L61 PolarHBondContact O-N 3.43Å; S57-F106 VanDerWaalsContact OG-CD2 3.32Å; S57-F106 WeakPolarHBondContact OG-CD2 3.27Å
58Y91.4Very high87.7Confident19 Ų1941.4 Ų41.48%0.07521%0.21CC..Hα-helixtrans-61.3-49.5179.5-173.6-169.1000111.7W54 Y56 L60 L61 L62 T112 A113 L410W54-Y58 HydrophobicContact CH2-CD1 4.29Å; W54-Y58 AromaticContact CZ2-CD1 3.89Å; W54-Y58 HydrophobicContact CZ2-CD1 3.89Å; W54-Y58 HydrophobicContact CZ2-CE1 4.38Å; W54-Y58 VanDerWaalsContact O-CB 3.31Å; W54-Y58 WeakPolarHBondContact O-CB 3.36Å; W54-Y58 PolarHBondContact O-N 2.77Å; Y56-Y58 VanDerWaalsContact C-N 3.34Å; Y56-Y58 PolarHBondContact O-N 2.79Å; Y58-L60 PolarHBondContact O-N 2.96Å; Y58-L61 PolarHBondContact O-N 3.41Å; Y58-L62 HydrophobicContact CE2-CD1 4.34Å; Y58-L62 WeakPolarHBondContact O-CB 3.36Å; Y58-L62 PolarHBondContact O-N 3.19Å; Y58-T112 HydrophobicContact CD1-CG2 3.81Å; Y58-T112 HydrophobicContact CD2-CG2 4.34Å; Y58-T112 HydrophobicContact CE1-CG2 3.53Å; Y58-T112 HydrophobicContact CE2-CG2 4.15Å; Y58-T112 HydrophobicContact CG-CG2 4.22Å; Y58-A113 HydrophobicContact CD2-CB 3.92Å; Y58-A113 HydrophobicContact CE2-CB 4.25Å; Y58-L410 HydrophobicContact CD1-CD1 3.99Å; Y58-L410 HydrophobicContact CD1-CD2 3.61Å; Y58-L410 HydrophobicContact CD1-CG 4.48Å; Y58-L410 HydrophobicContact CD2-CD1 3.87Å; Y58-L410 HydrophobicContact CE1-CD1 3.88Å; Y58-L410 HydrophobicContact CE1-CD2 3.52Å; Y58-L410 HydrophobicContact CE1-CG 4.33Å; Y58-L410 HydrophobicContact CE2-CD1 3.7Å; Y58-L410 HydrophobicContact CG-CD1 3.99Å; Y58-L410 HydrophobicContact CG-CD2 4.34Å
59L93.1Very high87.9Confident38 Ų3841.4 Ų41.420%0.19921%0.211CC..Hα-helixtrans-60.1-46.2176.8178.364.9000112T55 Y56 L61 L62 F407 L410 A411 T414T55-L59 PolarHBondContact O-N 3.14Å; Y56-L59 PolarHBondContact O-N 3.39Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L59-L61 PolarHBondContact O-N 2.95Å; L59-L62 PolarHBondContact O-N 2.9Å; L59-F407 HydrophobicContact CD1-CD2 4.19Å; L59-F407 HydrophobicContact CD1-CE2 4.02Å; L59-L410 HydrophobicContact CB-CB 4.46Å; L59-L410 HydrophobicContact CD1-CB 3.83Å; L59-A411 HydrophobicContact CD1-CB 4.43Å; L59-T414 HydrophobicContact CD2-CG2 3.8Å; L59-T414 WeakPolarHBondContact CD2-OG1 3.4Å
60L93.6Very high87.6Confident124 Ų12438.8 Ų38.865%0.64920%0.199SC*.Hα-helixtrans-62.4-41.2-178.4179.764.7000112.1Y56 S57 Y58 P64Y56-L60 WeakPolarHBondContact O-CB 3.06Å; Y56-L60 PolarHBondContact O-N 3.36Å; S57-L60 PolarHBondContact O-N 2.99Å; Y58-L60 PolarHBondContact O-N 2.96Å; L60-P64 WeakPolarHBondContact O-CD 3.09Å
61L92.5Very high87.4Confident31 Ų3147 Ų4716%0.16223%0.231CC..Hα-helixtrans-83.3-19.4-175.2-67.2165.5000113.1S57 Y58 L59 F63 P64 V65 F106 I110 A113S57-L61 WeakPolarHBondContact O-CB 2.68Å; S57-L61 VanDerWaalsContact O-CD1 3.32Å; S57-L61 WeakPolarHBondContact O-CD1 3.27Å; S57-L61 WeakPolarHBondContact O-CG 3.35Å; S57-L61 PolarHBondContact O-N 3.43Å; Y58-L61 PolarHBondContact O-N 3.41Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L59-L61 PolarHBondContact O-N 2.95Å; L61-F63 VanDerWaalsContact C-N 3.35Å; L61-F63 PolarHBondContact O-N 3.44Å; L61-P64 WeakPolarHBondContact O-CD 3.03Å; L61-V65 HydrophobicContact CB-CG2 4.43Å; L61-V65 VanDerWaalsContact O-CB 3.25Å; L61-V65 WeakPolarHBondContact O-CB 2.92Å; L61-V65 WeakPolarHBondContact O-CG2 3.46Å; L61-V65 PolarHBondContact O-N 3Å; L61-F106 HydrophobicContact CD1-CE2 4.38Å; L61-I110 HydrophobicContact CD1-CB 4.16Å; L61-I110 HydrophobicContact CD1-CG1 3.43Å; L61-I110 VanDerWaalsContact CD1-CG1 3.43Å; L61-A113 HydrophobicContact CB-CB 3.78Å
62L87.3Confident87.4Confident16 Ų1650.3 Ų50.38%0.08425%0.248CC..Hα-helixtrans-53.7-49.1-178.7-179.366.5000112.2Y58 L59 F66 I116 T406 F407 L410Y58-L62 HydrophobicContact CE2-CD1 4.34Å; Y58-L62 WeakPolarHBondContact O-CB 3.36Å; Y58-L62 PolarHBondContact O-N 3.19Å; L59-L62 PolarHBondContact O-N 2.9Å; L62-F66 VanDerWaalsContact O-CB 3.27Å; L62-F66 WeakPolarHBondContact O-CB 3.42Å; L62-F66 PolarHBondContact O-N 2.98Å; L62-I116 HydrophobicContact CD1-CD1 3.3Å; L62-T406 HydrophobicContact CD2-CG2 4.36Å; L62-F407 HydrophobicContact CD2-CB 4.14Å; L62-F407 HydrophobicContact CD2-CD2 4.2Å; L62-L410 HydrophobicContact CB-CD1 4.45Å; L62-L410 HydrophobicContact CD2-CD1 3.76Å; L62-L410 HydrophobicContact CG-CD1 4.48Å
63F83.1Confident86.9Confident141 Ų14155.3 Ų55.362%0.61827%0.267SS*.Hα-helixtrans-70.2-48.9-177.2-177.3-89.5000113.2L61 V65 F66 L67L61-F63 VanDerWaalsContact C-N 3.35Å; L61-F63 PolarHBondContact O-N 3.44Å; F63-V65 VanDerWaalsContact C-N 3.33Å; F63-V65 PolarHBondContact O-N 2.98Å; F63-F66 PolarHBondContact O-N 3.13Å; F63-L67 PolarHBondContact O-N 3.39Å; F63-L67 VanDerWaalsContact O-N 3.09Å
64P87.9Confident86.7Confident68 Ų6853.8 Ų53.844%0.44226%0.258SS..Hα-helixtrans-56-44.1172.8-26.934000113.4L60 L61 L67 A68L60-P64 WeakPolarHBondContact O-CD 3.09Å; L61-P64 WeakPolarHBondContact O-CD 3.03Å; P64-L67 PolarHBondContact O-N 3.09Å; P64-A68 WeakPolarHBondContact O-CB 2.98Å; P64-A68 PolarHBondContact O-N 2.86Å
65V86.8Confident86.6Confident13 Ų1355.2 Ų55.28%0.07926%0.264CS..Hα-helixtrans-66.7-42.1-179.8170.90000111L61 F63 L67 A68 T69 V77 A113 T114L61-V65 HydrophobicContact CB-CG2 4.43Å; L61-V65 VanDerWaalsContact O-CB 3.25Å; L61-V65 WeakPolarHBondContact O-CB 2.92Å; L61-V65 WeakPolarHBondContact O-CG2 3.46Å; L61-V65 PolarHBondContact O-N 3Å; F63-V65 VanDerWaalsContact C-N 3.33Å; F63-V65 PolarHBondContact O-N 2.98Å; V65-L67 PolarHBondContact O-N 3.42Å; V65-A68 PolarHBondContact O-N 2.99Å; V65-T69 VanDerWaalsContact O-CB 3.3Å; V65-T69 WeakPolarHBondContact O-CB 3.07Å; V65-T69 PolarHBondContact O-N 2.81Å; V65-T69 PolarHBondContact O-OG1 3.2Å; V65-V77 HydrophobicContact CG1-CG1 3.92Å; V65-A113 HydrophobicContact CB-CB 4.46Å; V65-A113 WeakPolarHBondContact CG1-O 3.16Å; V65-A113 HydrophobicContact CG2-CB 4.03Å; V65-T114 HydrophobicContact CG1-CG2 3.88Å; V65-T114 HydrophobicContact CG2-CG2 3.92Å
66F80.3Confident86.7Confident94 Ų9457.8 Ų57.841%0.41228%0.281SS..Hα-helixtrans-57.2-48.4175.6-177.7-98.2000111.6L62 F63 T69L62-F66 VanDerWaalsContact O-CB 3.27Å; L62-F66 WeakPolarHBondContact O-CB 3.42Å; L62-F66 PolarHBondContact O-N 2.98Å; F63-F66 PolarHBondContact O-N 3.13Å; F66-T69 WeakPolarHBondContact O-CB 3.47Å; F66-T69 PolarHBondContact O-N 3.48Å
67L81.3Confident86.6Confident91 Ų9155.2 Ų55.248%0.47627%0.271SS..Hα-helixtrans-66.5-41.9178-17564.2000112.5F63 P64 V65 T69 Y71 F194F63-L67 PolarHBondContact O-N 3.39Å; F63-L67 VanDerWaalsContact O-N 3.09Å; P64-L67 PolarHBondContact O-N 3.09Å; V65-L67 PolarHBondContact O-N 3.42Å; L67-T69 VanDerWaalsContact C-N 3.28Å; L67-T69 PolarHBondContact O-N 2.79Å; L67-Y71 WeakPolarHBondContact O-CB 3.2Å; L67-Y71 PolarHBondContact O-N 2.84Å; L67-F194 HydrophobicContact CD1-CZ 4.43Å
68A85.1Confident86.5Confident31 Ų3155.3 Ų55.326%0.25627%0.271SS..Hα-helixtrans-66.5-30.117900000112.4P64 V65 Y71 L72P64-A68 WeakPolarHBondContact O-CB 2.98Å; P64-A68 PolarHBondContact O-N 2.86Å; V65-A68 PolarHBondContact O-N 2.99Å; A68-Y71 PolarHBondContact O-N 3.49Å; A68-L72 HydrophobicContact CB-CD1 4.24Å; A68-L72 WeakPolarHBondContact O-CB 3.44Å; A68-L72 WeakPolarHBondContact O-CG 3.36Å; A68-L72 PolarHBondContact O-N 3.44Å
69T84.3Confident86.6Confident7 Ų756.1 Ų56.14%0.04328%0.277CS..Hα-helixtrans-60.6-50.9-178.1-66.90000111.8V65 F66 L67 R73 Y74 A117V65-T69 VanDerWaalsContact O-CB 3.3Å; V65-T69 WeakPolarHBondContact O-CB 3.07Å; V65-T69 PolarHBondContact O-N 2.81Å; V65-T69 PolarHBondContact O-OG1 3.2Å; F66-T69 WeakPolarHBondContact O-CB 3.47Å; F66-T69 PolarHBondContact O-N 3.48Å; L67-T69 VanDerWaalsContact C-N 3.28Å; L67-T69 PolarHBondContact O-N 2.79Å; T69-R73 PolarHBondContact O-N 3.04Å; T69-Y74 HydrophobicContact CG2-CD1 3.18Å; T69-Y74 HydrophobicContact CG2-CE1 3.48Å; T69-Y74 VanDerWaalsContact CG2-CE1 3.48Å; T69-Y74 HydrophobicContact CG2-CG 4.11Å; T69-Y74 PolarHBondContact O-N 2.95Å; T69-A117 HydrophobicContact CG2-CB 3.6Å; T69-A117 WeakPolarHBondContact OG1-CB 3.46Å
70D75.6Confident86.7Confident12 Ų1258 Ų586%0.06429%0.286CS..Hα-helixtrans-73.3-37177.8-67.6-37.7000112.1R73 Y74 F193 F194D70-R73 PolarHBondContact O-N 3.2Å; D70-Y74 WeakPolarHBondContact OD1-CE1 3.4Å; D70-Y74 VanDerWaalsContact OD1-CZ 3.24Å; D70-Y74 PolarHBondContact OD1-OH 2.72Å; D70-F193 WeakPolarHBondContact OD2-CD2 3.47Å; D70-F194 HydrophobicContact CB-CD2 4.01Å; D70-F194 HydrophobicContact CB-CE2 4.06Å
71Y79.1Confident86.7Confident183 Ų18353.7 Ų53.772%0.71826%0.263SS*.Hα-helixtrans-65.1-43.5-179.4-178.1-104000112.3L67 A68 R73L67-Y71 WeakPolarHBondContact O-CB 3.2Å; L67-Y71 PolarHBondContact O-N 2.84Å; A68-Y71 PolarHBondContact O-N 3.49Å; Y71-R73 VanDerWaalsContact C-N 3.29Å; Y71-R73 PolarHBondContact O-N 2.97Å
72L82.8Confident86.8Confident74 Ų7452.7 Ų52.739%0.38726%0.26SS..THydrogen-bonded Turntrans-88.56.9-179.3-60.3177.7000113A68 Y74 P76 V77 M187A68-L72 HydrophobicContact CB-CD1 4.24Å; A68-L72 WeakPolarHBondContact O-CB 3.44Å; A68-L72 WeakPolarHBondContact O-CG 3.36Å; A68-L72 PolarHBondContact O-N 3.44Å; L72-Y74 VanDerWaalsContact C-N 3.33Å; L72-Y74 PolarHBondContact O-N 3.33Å; L72-P76 HydrophobicContact CB-CB 4.16Å; L72-P76 HydrophobicContact CB-CG 4.02Å; L72-P76 HydrophobicContact CD1-CB 4.24Å; L72-P76 WeakPolarHBondContact O-CD 3.33Å; L72-P76 WeakPolarHBondContact O-CG 3.42Å; L72-V77 HydrophobicContact CB-CG2 4.49Å; L72-V77 HydrophobicContact CD1-CG2 4.26Å; L72-M187 WeakPolarHBondContact O-CE 3.24Å
73R81.4Confident87.2Confident107 Ų10755.9 Ų55.940%0.40428%0.277SS..THydrogen-bonded Turntrans53.947.3-178.1-61.9176.4-176.8-178.4-1.5112.2T69 D70 Y71 K75 M187 P188T69-R73 PolarHBondContact O-N 3.04Å; D70-R73 PolarHBondContact O-N 3.2Å; Y71-R73 VanDerWaalsContact C-N 3.29Å; Y71-R73 PolarHBondContact O-N 2.97Å; R73-K75 VanDerWaalsContact C-N 3.26Å; R73-K75 PolarHBondContact O-N 3.2Å; R73-M187 HydrophobicContact CB-CE 3.23Å; R73-M187 HydrophobicContact CG-CE 4.35Å; R73-M187 WeakPolarHBondContact O-CE 3.31Å; R73-P188 HydrophobicContact CB-CG 4.36Å; R73-P188 WeakPolarHBondContact O-CD 3.43Å; R73-P188 VanDerWaalsContact O-CG 3.29Å; R73-P188 WeakPolarHBondContact O-CG 3.37Å
74Y85.9Confident87.7Confident0 Ų049.3 Ų49.30%025%0.248CC..SBendtrans63.8-49.8169.1-43.9-93.9000117.6T69 D70 L72 V77 I78 T124 P188 L192T69-Y74 HydrophobicContact CG2-CD1 3.18Å; T69-Y74 HydrophobicContact CG2-CE1 3.48Å; T69-Y74 VanDerWaalsContact CG2-CE1 3.48Å; T69-Y74 HydrophobicContact CG2-CG 4.11Å; T69-Y74 PolarHBondContact O-N 2.95Å; D70-Y74 WeakPolarHBondContact OD1-CE1 3.4Å; D70-Y74 VanDerWaalsContact OD1-CZ 3.24Å; D70-Y74 PolarHBondContact OD1-OH 2.72Å; L72-Y74 VanDerWaalsContact C-N 3.33Å; L72-Y74 PolarHBondContact O-N 3.33Å; Y74-V77 WeakPolarHBondContact O-CB 3.5Å; Y74-V77 PolarHBondContact O-N 3.1Å; Y74-I78 PolarHBondContact O-N 2.83Å; Y74-I78 VanDerWaalsContact O-N 3.11Å; Y74-T124 HydrophobicContact CD2-CG2 4.32Å; Y74-T124 HydrophobicContact CE1-CG2 4.26Å; Y74-T124 HydrophobicContact CE2-CG2 3.56Å; Y74-P188 HydrophobicContact CD2-CB 4.5Å; Y74-P188 HydrophobicContact CD2-CG 3.61Å; Y74-P188 HydrophobicContact CE2-CG 4.36Å; Y74-L192 PolarHBondContact OH-N 3.34Å
75K89.2Confident87.9Confident42 Ų4247.8 Ų47.818%0.18324%0.236CC..Hα-helixtrans-55.4-45.9-172.9-179.5178.2-178.91690113.8R73 V77 I78 L79 W183 L185 M187R73-K75 VanDerWaalsContact C-N 3.26Å; R73-K75 PolarHBondContact O-N 3.2Å; K75-V77 PolarHBondContact O-N 2.68Å; K75-I78 PolarHBondContact O-N 3.05Å; K75-I78 VanDerWaalsContact O-N 3.17Å; K75-L79 WeakPolarHBondContact O-CG 3.45Å; K75-L79 PolarHBondContact O-N 3.45Å; K75-W183 WeakPolarHBondContact CE-O 3.45Å; K75-W183 PolarHBondContact NZ-O 3.49Å; K75-L185 WeakPolarHBondContact CE-O 3.33Å; K75-L185 PolarHBondContact NZ-O 3.49Å; K75-M187 HydrophobicContact CB-CE 4.01Å; K75-M187 HydrophobicContact CB-SD 3.59Å; K75-M187 VanDerWaalsContact CB-SD 3.59Å; K75-M187 HydrophobicContact CD-SD 3.77Å; K75-M187 HydrophobicContact CG-SD 4.25Å
76P91.6Very high88.3Confident55 Ų5548.9 Ų48.936%0.35724%0.241SC..Hα-helixtrans-61-32.3176.8-26.337.9000113.3L72 L79 L80L72-P76 HydrophobicContact CB-CB 4.16Å; L72-P76 HydrophobicContact CB-CG 4.02Å; L72-P76 HydrophobicContact CD1-CB 4.24Å; L72-P76 WeakPolarHBondContact O-CD 3.33Å; L72-P76 WeakPolarHBondContact O-CG 3.42Å; P76-L79 PolarHBondContact O-N 2.95Å; P76-L80 WeakPolarHBondContact O-CB 3.2Å; P76-L80 PolarHBondContact O-N 3.38Å
77V92.3Very high89Confident5 Ų546.3 Ų46.33%0.0323%0.233CC..Hα-helixtrans-72-37177.5-175.60000111.1V65 L72 Y74 K75 L80 Q81 T114 A117V65-V77 HydrophobicContact CG1-CG1 3.92Å; L72-V77 HydrophobicContact CB-CG2 4.49Å; L72-V77 HydrophobicContact CD1-CG2 4.26Å; Y74-V77 WeakPolarHBondContact O-CB 3.5Å; Y74-V77 PolarHBondContact O-N 3.1Å; K75-V77 PolarHBondContact O-N 2.68Å; V77-L80 WeakPolarHBondContact O-CB 3.37Å; V77-L80 PolarHBondContact O-N 2.73Å; V77-Q81 PolarHBondContact O-N 2.96Å; V77-T114 HydrophobicContact CG1-CG2 3.64Å; V77-A117 HydrophobicContact CB-CB 3.96Å; V77-A117 HydrophobicContact CG1-CB 3.49Å; V77-A117 VanDerWaalsContact CG1-CB 3.49Å
78I91.6Very high89.4Confident11 Ų1142 Ų426%0.05621%0.211CC..Hα-helixtrans-64.9-40.9172.6-62.5168.1000110.9Y74 K75 Q81 G82 Y118 Y121 A182 L185Y74-I78 PolarHBondContact O-N 2.83Å; Y74-I78 VanDerWaalsContact O-N 3.11Å; K75-I78 PolarHBondContact O-N 3.05Å; K75-I78 VanDerWaalsContact O-N 3.17Å; I78-Q81 VanDerWaalsContact O-CB 3.31Å; I78-Q81 WeakPolarHBondContact O-CB 3.46Å; I78-Q81 PolarHBondContact O-N 2.83Å; I78-G82 PolarHBondContact O-N 2.77Å; I78-G82 VanDerWaalsContact O-N 3.16Å; I78-Y118 HydrophobicContact CD1-CD2 4.19Å; I78-Y118 HydrophobicContact CG1-CD2 4.5Å; I78-Y121 HydrophobicContact CD1-CD1 3.81Å; I78-Y121 HydrophobicContact CD1-CD2 4.18Å; I78-Y121 HydrophobicContact CD1-CG 3.61Å; I78-A182 HydrophobicContact CG2-CB 4.23Å; I78-L185 HydrophobicContact CD1-CD1 4.34Å; I78-L185 HydrophobicContact CG2-CD1 4.13Å
79L94.2Very high89.4Confident36 Ų3641.3 Ų41.319%0.18820%0.201CC..Hα-helixtrans-64.7-40.9174.5-66.4179.2000111.4K75 P76 Q81 G82 L83 F179 A182 W183K75-L79 WeakPolarHBondContact O-CG 3.45Å; K75-L79 PolarHBondContact O-N 3.45Å; P76-L79 PolarHBondContact O-N 2.95Å; L79-Q81 VanDerWaalsContact C-N 3.28Å; L79-Q81 PolarHBondContact O-N 2.7Å; L79-G82 PolarHBondContact O-N 2.97Å; L79-L83 WeakPolarHBondContact O-CB 3.24Å; L79-L83 PolarHBondContact O-N 3.39Å; L79-F179 HydrophobicContact CB-CE2 4.3Å; L79-F179 HydrophobicContact CD2-CE2 4.19Å; L79-F179 VanDerWaalsContact O-CE2 3.29Å; L79-F179 WeakPolarHBondContact O-CE2 3.34Å; L79-A182 HydrophobicContact CD2-CB 3.93Å; L79-W183 VanDerWaalsContact CD2-CD1 3.43Å; L79-W183 HydrophobicContact CD2-CG 4.19Å
80L94.8Very high89.7Confident77 Ų7746.3 Ų46.340%0.40322%0.223SC..Hα-helixtrans-59.4-39.5174179.862.9000111.7P76 V77 S84 I110 T114P76-L80 WeakPolarHBondContact O-CB 3.2Å; P76-L80 PolarHBondContact O-N 3.38Å; V77-L80 WeakPolarHBondContact O-CB 3.37Å; V77-L80 PolarHBondContact O-N 2.73Å; L80-S84 VanDerWaalsContact O-CB 3.3Å; L80-S84 WeakPolarHBondContact O-CB 3.29Å; L80-S84 PolarHBondContact O-N 2.96Å; L80-S84 PolarHBondContact O-OG 2.9Å; L80-I110 HydrophobicContact CD1-CG2 4.44Å; L80-I110 HydrophobicContact CD2-CG2 4.16Å; L80-I110 HydrophobicContact CG-CG2 4.06Å; L80-T114 HydrophobicContact CD2-CG2 4.13Å; L80-T114 HydrophobicContact CG-CG2 4.39Å
81Q93.8Very high90.2Very high33 Ų3347 Ų4715%0.15423%0.226CC..Hα-helixtrans-57.3-54.6174.4-172.3179.311.100111.5V77 I78 L79 L83 S84 L85 A111 T114V77-Q81 PolarHBondContact O-N 2.96Å; I78-Q81 VanDerWaalsContact O-CB 3.31Å; I78-Q81 WeakPolarHBondContact O-CB 3.46Å; I78-Q81 PolarHBondContact O-N 2.83Å; L79-Q81 VanDerWaalsContact C-N 3.28Å; L79-Q81 PolarHBondContact O-N 2.7Å; Q81-L83 PolarHBondContact O-N 3.29Å; Q81-S84 PolarHBondContact O-N 3.45Å; Q81-L85 PolarHBondContact O-N 3.41Å; Q81-A111 WeakPolarHBondContact CG-O 3.33Å; Q81-A111 PolarHBondContact NE2-O 3.17Å; Q81-T114 VanDerWaalsContact CA-OG1 3.3Å; Q81-T114 WeakPolarHBondContact CA-OG1 3.44Å; Q81-T114 WeakPolarHBondContact CB-OG1 3.26Å; Q81-T114 WeakPolarHBondContact CG-OG1 3.29Å
82G93.5Very high90.3Very high10 Ų1038.8 Ų38.810%0.10319%0.194CC..Hα-helixtrans-63.8-40.7-17800000112.6I78 L79 S84 L85 I86I78-G82 PolarHBondContact O-N 2.77Å; I78-G82 VanDerWaalsContact O-N 3.16Å; L79-G82 PolarHBondContact O-N 2.97Å; G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 2.78Å; G82-L85 PolarHBondContact O-N 2.89Å; G82-I86 WeakPolarHBondContact O-CG1 3.45Å; G82-I86 PolarHBondContact O-N 3.5Å
83L96.4Very high90.3Very high84 Ų8435.3 Ų35.344%0.4418%0.176SC..Hα-helixtrans-62-43174.218062.2000111.6L79 Q81 L85 I86 V87 F179L79-L83 WeakPolarHBondContact O-CB 3.24Å; L79-L83 PolarHBondContact O-N 3.39Å; Q81-L83 PolarHBondContact O-N 3.29Å; L83-L85 VanDerWaalsContact C-N 3.33Å; L83-L85 PolarHBondContact O-N 3.4Å; L83-I86 WeakPolarHBondContact O-CB 3.44Å; L83-I86 PolarHBondContact O-N 3.39Å; L83-V87 WeakPolarHBondContact O-CG2 3.32Å; L83-V87 PolarHBondContact O-N 2.98Å; L83-F179 HydrophobicContact CB-CE2 4.03Å; L83-F179 HydrophobicContact CB-CZ 4.48Å
84S94.7Very high90.4Very high2 Ų236.4 Ų36.41%0.01418%0.181CC..Hα-helixtrans-61.8-42.6179.5-58.60000111.2L80 Q81 G82 I86 V87 T88 I110L80-S84 VanDerWaalsContact O-CB 3.3Å; L80-S84 WeakPolarHBondContact O-CB 3.29Å; L80-S84 PolarHBondContact O-N 2.96Å; L80-S84 PolarHBondContact O-OG 2.9Å; Q81-S84 PolarHBondContact O-N 3.45Å; G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 2.78Å; S84-I86 PolarHBondContact O-N 3.01Å; S84-V87 PolarHBondContact O-N 3.07Å; S84-T88 PolarHBondContact O-N 3.34Å; S84-T88 PolarHBondContact O-OG1 3.5Å; S84-I110 VanDerWaalsContact OG-CG2 3.28Å; S84-I110 WeakPolarHBondContact OG-CG2 3.07Å
85L91.7Very high89.9Confident36 Ų3637.5 Ų37.519%0.18819%0.19CC..Hα-helixtrans-63.6-38.9174.6-70.1170.7000113Q81 G82 L83 T88 W89 Y108 A111 V175Q81-L85 PolarHBondContact O-N 3.41Å; G82-L85 PolarHBondContact O-N 2.89Å; L83-L85 VanDerWaalsContact C-N 3.33Å; L83-L85 PolarHBondContact O-N 3.4Å; L85-T88 PolarHBondContact O-N 2.85Å; L85-W89 HydrophobicContact CD2-CH2 4.02Å; L85-W89 HydrophobicContact CD2-CZ2 4.22Å; L85-W89 PolarHBondContact O-N 2.81Å; L85-Y108 HydrophobicContact CD2-CD2 4.26Å; L85-Y108 HydrophobicContact CD2-CE2 4.23Å; L85-A111 HydrophobicContact CD2-CB 3.61Å; L85-A111 HydrophobicContact CG-CB 3.69Å; L85-V175 HydrophobicContact CB-CG1 3.42Å; L85-V175 VanDerWaalsContact CB-CG1 3.42Å; L85-V175 HydrophobicContact CB-CG2 4.41Å; L85-V175 HydrophobicContact CD1-CG1 4.32Å
86I94.8Very high89.1Confident36 Ų3642.7 Ų42.719%0.18522%0.215CC..Hα-helixtrans-60.4-47.8174.3-69.5171.4000110G82 L83 S84 T88 W89 F90 L172 V175 F179G82-I86 WeakPolarHBondContact O-CG1 3.45Å; G82-I86 PolarHBondContact O-N 3.5Å; L83-I86 WeakPolarHBondContact O-CB 3.44Å; L83-I86 PolarHBondContact O-N 3.39Å; S84-I86 PolarHBondContact O-N 3.01Å; I86-T88 VanDerWaalsContact C-N 3.34Å; I86-T88 PolarHBondContact O-N 2.6Å; I86-W89 PolarHBondContact O-N 3.44Å; I86-F90 WeakPolarHBondContact O-CB 3.43Å; I86-F90 PolarHBondContact O-N 3.19Å; I86-L172 HydrophobicContact CB-CD1 4.46Å; I86-L172 HydrophobicContact CG2-CD1 4.08Å; I86-V175 HydrophobicContact CG1-CG1 3.81Å; I86-F179 HydrophobicContact CD1-CB 3.85Å; I86-F179 HydrophobicContact CD1-CD1 3.82Å; I86-F179 HydrophobicContact CD1-CG 3.83Å
87V94.2Very high88.3Confident41 Ų4142.6 Ų42.625%0.24822%0.224CC..Hα-helixtrans-59.5-47.4177.1173.50000110.1L83 S84 W89 F90 M91 F107L83-V87 WeakPolarHBondContact O-CG2 3.32Å; L83-V87 PolarHBondContact O-N 2.98Å; S84-V87 PolarHBondContact O-N 3.07Å; V87-W89 PolarHBondContact O-N 2.89Å; V87-F90 PolarHBondContact O-N 3.41Å; V87-M91 HydrophobicContact CG1-CG 4.27Å; V87-M91 HydrophobicContact CG1-SD 3.97Å; V87-M91 WeakPolarHBondContact O-CB 3.35Å; V87-M91 VanDerWaalsContact O-CG 3.23Å; V87-M91 WeakPolarHBondContact O-CG 3.49Å; V87-M91 PolarHBondContact O-N 3.3Å; V87-F107 HydrophobicContact CB-CD1 3.73Å; V87-F107 HydrophobicContact CB-CE1 4.07Å; V87-F107 HydrophobicContact CB-CG 4.27Å; V87-F107 HydrophobicContact CG1-CB 4.4Å; V87-F107 HydrophobicContact CG1-CD1 3.57Å; V87-F107 HydrophobicContact CG1-CD2 4.15Å; V87-F107 HydrophobicContact CG1-CE1 3.8Å; V87-F107 HydrophobicContact CG1-CE2 4.4Å; V87-F107 HydrophobicContact CG1-CG 3.74Å; V87-F107 HydrophobicContact CG1-CZ 4.22Å; V87-F107 HydrophobicContact CG2-CD1 4.22Å; V87-F107 HydrophobicContact CG2-CE1 4.1Å
88T89.5Confident87.6Confident0 Ų045.9 Ų45.90%024%0.241CC..Hα-helixtrans-59-45.3179.5-50.20000111.7S84 L85 I86 M91 L92 L104 Y108S84-T88 PolarHBondContact O-N 3.34Å; S84-T88 PolarHBondContact O-OG1 3.5Å; L85-T88 PolarHBondContact O-N 2.85Å; I86-T88 VanDerWaalsContact C-N 3.34Å; I86-T88 PolarHBondContact O-N 2.6Å; T88-M91 PolarHBondContact O-N 2.9Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 3.43Å; T88-L104 HydrophobicContact CG2-CD2 3.51Å; T88-L104 HydrophobicContact CG2-CG 3.64Å; T88-Y108 HydrophobicContact CG2-CD2 4.35Å; T88-Y108 HydrophobicContact CG2-CG 4.4Å; T88-Y108 PolarHBondContact OG1-N 2.87Å
89W86.1Confident87.3Confident17 Ų1751.9 Ų51.96%0.06427%0.273CS..Hα-helixtrans-76.9-31.5-176.9-75.3-162.5000112.3T22 L85 I86 V87 M91 L92 L93 Y108 L172T22-W89 HydrophobicContact CG2-CH2 3.69Å; T22-W89 HydrophobicContact CG2-CZ2 3.78Å; L85-W89 HydrophobicContact CD2-CH2 4.02Å; L85-W89 HydrophobicContact CD2-CZ2 4.22Å; L85-W89 PolarHBondContact O-N 2.81Å; I86-W89 PolarHBondContact O-N 3.44Å; V87-W89 PolarHBondContact O-N 2.89Å; W89-M91 VanDerWaalsContact C-N 3.34Å; W89-L92 HydrophobicContact CD2-CD1 4.02Å; W89-L92 HydrophobicContact CE3-CD1 3.49Å; W89-L92 VanDerWaalsContact CE3-CD1 3.49Å; W89-L92 HydrophobicContact CE3-CG 4.49Å; W89-L92 HydrophobicContact CZ3-CD1 4.04Å; W89-L92 WeakPolarHBondContact O-CB 3.38Å; W89-L92 PolarHBondContact O-N 2.89Å; W89-L93 WeakPolarHBondContact O-CG 3.47Å; W89-L93 PolarHBondContact O-N 2.88Å; W89-Y108 AromaticContact CH2-CD2 3.85Å; W89-Y108 HydrophobicContact CH2-CD2 3.85Å; W89-Y108 AromaticContact CH2-CE2 3.63Å; W89-Y108 HydrophobicContact CH2-CE2 3.63Å; W89-Y108 AromaticContact CZ3-CD2 3.9Å; W89-Y108 HydrophobicContact CZ3-CD2 3.9Å; W89-Y108 HydrophobicContact CZ3-CE2 4.16Å; W89-L172 HydrophobicContact CB-CB 4.1Å; W89-L172 HydrophobicContact CB-CD1 3.94Å
90F90.7Very high86.8Confident111 Ų11151.4 Ų51.449%0.48727%0.274SS..Hα-helixtrans-62.5-44.4169.5-176-92.2000110.8I86 V87 L93 Y94I86-F90 WeakPolarHBondContact O-CB 3.43Å; I86-F90 PolarHBondContact O-N 3.19Å; V87-F90 PolarHBondContact O-N 3.41Å; F90-L93 PolarHBondContact O-N 2.94Å; F90-Y94 HydrophobicContact CD1-CD2 4.18Å; F90-Y94 AromaticContact CD2-CD2 3.87Å; F90-Y94 HydrophobicContact CD2-CD2 3.87Å; F90-Y94 AromaticContact CD2-CE2 3.8Å; F90-Y94 HydrophobicContact CD2-CE2 3.8Å; F90-Y94 AromaticContact CE1-CD2 3.93Å; F90-Y94 HydrophobicContact CE1-CD2 3.93Å; F90-Y94 AromaticContact CE2-CD2 3.62Å; F90-Y94 HydrophobicContact CE2-CD2 3.62Å; F90-Y94 AromaticContact CE2-CE2 3.5Å; F90-Y94 HydrophobicContact CE2-CE2 3.5Å; F90-Y94 VanDerWaalsContact CE2-CE2 3.5Å; F90-Y94 HydrophobicContact CG-CD2 4.15Å; F90-Y94 HydrophobicContact CG-CE2 4.49Å; F90-Y94 AromaticContact CZ-CD2 3.65Å; F90-Y94 HydrophobicContact CZ-CD2 3.65Å; F90-Y94 AromaticContact CZ-CE2 3.96Å; F90-Y94 HydrophobicContact CZ-CE2 3.96Å; F90-Y94 VanDerWaalsContact O-CD2 3.27Å; F90-Y94 WeakPolarHBondContact O-CD2 3.48Å; F90-Y94 PolarHBondContact O-N 3.05Å
91M86.6Confident86.2Confident26 Ų2648.2 Ų48.213%0.12826%0.257CS..Hα-helixtrans-64.8-39.8174.5-72.2-173.477.200112V87 T88 W89 L93 Y94 A95 A100 F103 L104V87-M91 HydrophobicContact CG1-CG 4.27Å; V87-M91 HydrophobicContact CG1-SD 3.97Å; V87-M91 WeakPolarHBondContact O-CB 3.35Å; V87-M91 VanDerWaalsContact O-CG 3.23Å; V87-M91 WeakPolarHBondContact O-CG 3.49Å; V87-M91 PolarHBondContact O-N 3.3Å; T88-M91 PolarHBondContact O-N 2.9Å; W89-M91 VanDerWaalsContact C-N 3.34Å; M91-L93 PolarHBondContact O-N 3.11Å; M91-Y94 PolarHBondContact O-N 3.43Å; M91-A95 HydrophobicContact CB-CB 4.01Å; M91-A95 HydrophobicContact CE-CB 4.11Å; M91-A95 WeakPolarHBondContact O-CA 3.33Å; M91-A95 WeakPolarHBondContact O-CB 3.35Å; M91-A95 PolarHBondContact O-N 2.96Å; M91-A100 HydrophobicContact CE-CB 4.38Å; M91-A100 WeakPolarHBondContact CE-O 3.27Å; M91-F103 HydrophobicContact CE-CB 4.12Å; M91-F103 HydrophobicContact CE-CD1 3.71Å; M91-F103 HydrophobicContact CE-CG 4.41Å; M91-F103 HydrophobicContact SD-CD1 3.72Å; M91-F103 HydrophobicContact SD-CE1 4.4Å; M91-L104 HydrophobicContact CB-CB 4.1Å; M91-L104 HydrophobicContact CB-CD1 3.95Å; M91-L104 HydrophobicContact CB-CG 4.15Å; M91-L104 HydrophobicContact CE-CB 4.08Å; M91-L104 HydrophobicContact SD-CB 4.11Å
92L80.5Confident85.8Confident11 Ų1149 Ų496%0.05826%0.261CS..Hα-helixtrans-51.9-45172.3-81.2168.2000109.9T25 W28 T88 W89 L104 N168T25-L92 HydrophobicContact CG2-CD2 4.12Å; W28-L92 WeakPolarHBondContact CH2-O 3.1Å; W28-L92 WeakPolarHBondContact CZ3-O 3.49Å; T88-L92 WeakPolarHBondContact O-CG 3.24Å; T88-L92 PolarHBondContact O-N 3.43Å; W89-L92 HydrophobicContact CD2-CD1 4.02Å; W89-L92 HydrophobicContact CE3-CD1 3.49Å; W89-L92 VanDerWaalsContact CE3-CD1 3.49Å; W89-L92 HydrophobicContact CE3-CG 4.49Å; W89-L92 HydrophobicContact CZ3-CD1 4.04Å; W89-L92 WeakPolarHBondContact O-CB 3.38Å; W89-L92 PolarHBondContact O-N 2.89Å; L92-L104 HydrophobicContact CB-CD1 4.41Å; L92-L104 HydrophobicContact CD2-CD1 3.77Å; L92-L104 HydrophobicContact CG-CD1 3.75Å; L92-L104 HydrophobicContact CG-CG 4.49Å; L92-N168 WeakPolarHBondContact CD1-OD1 3.27Å
93L82.2Confident85.7Confident1 Ų153.7 Ų53.71%0.00528%0.279CS..Hα-helixtrans-70.7-33-177.1-67.3170.8000115.4W28 W89 F90 M91 F165 N168 V169 L172W28-L93 HydrophobicContact CH2-CD2 4.46Å; W28-L93 HydrophobicContact CZ2-CD2 3.82Å; W89-L93 WeakPolarHBondContact O-CG 3.47Å; W89-L93 PolarHBondContact O-N 2.88Å; F90-L93 PolarHBondContact O-N 2.94Å; M91-L93 PolarHBondContact O-N 3.11Å; L93-F165 HydrophobicContact CB-CE2 4.36Å; L93-F165 HydrophobicContact CD2-CD2 3.77Å; L93-F165 HydrophobicContact CD2-CE2 3.74Å; L93-F165 HydrophobicContact CD2-CG 4.22Å; L93-F165 HydrophobicContact CD2-CZ 4.19Å; L93-N168 HydrophobicContact CD2-CB 3.53Å; L93-N168 HydrophobicContact CG-CB 4.15Å; L93-V169 HydrophobicContact CD1-CG2 3.99Å; L93-V169 HydrophobicContact CD2-CG2 3.89Å; L93-L172 HydrophobicContact CD1-CD2 3.73Å
94Y83.8Confident85.4Confident130 Ų13049.9 Ų49.951%0.5126%0.259SS..Hα-helixtrans-128-17.4-165.5-58.7-67.6000115.4F90 M91F90-Y94 HydrophobicContact CD1-CD2 4.18Å; F90-Y94 AromaticContact CD2-CD2 3.87Å; F90-Y94 HydrophobicContact CD2-CD2 3.87Å; F90-Y94 AromaticContact CD2-CE2 3.8Å; F90-Y94 HydrophobicContact CD2-CE2 3.8Å; F90-Y94 AromaticContact CE1-CD2 3.93Å; F90-Y94 HydrophobicContact CE1-CD2 3.93Å; F90-Y94 AromaticContact CE2-CD2 3.62Å; F90-Y94 HydrophobicContact CE2-CD2 3.62Å; F90-Y94 AromaticContact CE2-CE2 3.5Å; F90-Y94 HydrophobicContact CE2-CE2 3.5Å; F90-Y94 VanDerWaalsContact CE2-CE2 3.5Å; F90-Y94 HydrophobicContact CG-CD2 4.15Å; F90-Y94 HydrophobicContact CG-CE2 4.49Å; F90-Y94 AromaticContact CZ-CD2 3.65Å; F90-Y94 HydrophobicContact CZ-CD2 3.65Å; F90-Y94 AromaticContact CZ-CE2 3.96Å; F90-Y94 HydrophobicContact CZ-CE2 3.96Å; F90-Y94 VanDerWaalsContact O-CD2 3.27Å; F90-Y94 WeakPolarHBondContact O-CD2 3.48Å; F90-Y94 PolarHBondContact O-N 3.05Å; M91-Y94 PolarHBondContact O-N 3.43Å
95A76.4Confident85Confident23 Ų2350.1 Ų50.119%0.1926%0.26CS..  trans-74136.7-176.100000111.1M91 A100M91-A95 HydrophobicContact CB-CB 4.01Å; M91-A95 HydrophobicContact CE-CB 4.11Å; M91-A95 WeakPolarHBondContact O-CA 3.33Å; M91-A95 WeakPolarHBondContact O-CB 3.35Å; M91-A95 PolarHBondContact O-N 2.96Å; A95-A100 HydrophobicContact CB-CB 3.84Å
96Q72.2Confident85.1Confident152 Ų15251.7 Ų51.771%0.7127%0.265SS*.  trans-127.4143.4175.6-66.6-178.6-1300110.1Y32 A100Y32-Q96 HydrophobicContact CE1-CG 4.48Å; Q96-A100 WeakPolarHBondContact O-CB 3.48Å
97G74.1Confident85.1Confident52 Ų5252 Ų5254%0.53627%0.265SS..SBendtrans91.6155.7177.800000114.5L99 A100 V101G97-L99 PolarHBondContact O-N 3.32Å; G97-A100 PolarHBondContact O-N 3.25Å; G97-V101 WeakPolarHBondContact O-CG2 3.23Å; G97-V101 PolarHBondContact O-N 2.95Å
98L78.6Confident84.8Confident75 Ų7552.1 Ų52.139%0.39326%0.261SS..Hα-helixtrans-54.8-50.1-173.1177.865.4000113.2E49 I50 A100 V101 Q102E49-L98 HydrophobicContact CB-CD1 4.29Å; E49-L98 WeakPolarHBondContact OE2-CD2 3.42Å; I50-L98 HydrophobicContact CD1-CD1 3.84Å; I50-L98 HydrophobicContact CG1-CD1 3.56Å; L98-A100 VanDerWaalsContact C-N 3.27Å; L98-A100 PolarHBondContact O-N 3.48Å; L98-V101 PolarHBondContact O-N 3.5Å; L98-V101 VanDerWaalsContact O-N 3.16Å; L98-Q102 HydrophobicContact CD1-CG 4.36Å; L98-Q102 HydrophobicContact CG-CG 4.49Å; L98-Q102 WeakPolarHBondContact O-CG 3.37Å; L98-Q102 PolarHBondContact O-N 3.31Å
99L85.3Confident84.8Confident137 Ų13752.1 Ų52.172%0.71726%0.261SS*.Hα-helixtrans-60.7-37.4-178.2-71.6177000112.4G97 Q102 F103G97-L99 PolarHBondContact O-N 3.32Å; L99-Q102 PolarHBondContact O-N 3.49Å; L99-F103 WeakPolarHBondContact O-CB 3.49Å; L99-F103 PolarHBondContact O-N 3.49Å
100A82.6Confident85.1Confident26 Ų2652.3 Ų52.322%0.21526%0.263CS..Hα-helixtrans-68.7-39.4179.500000110.7M91 A95 Q96 G97 L98 F103 L104M91-A100 HydrophobicContact CE-CB 4.38Å; M91-A100 WeakPolarHBondContact CE-O 3.27Å; A95-A100 HydrophobicContact CB-CB 3.84Å; Q96-A100 WeakPolarHBondContact O-CB 3.48Å; G97-A100 PolarHBondContact O-N 3.25Å; L98-A100 VanDerWaalsContact C-N 3.27Å; L98-A100 PolarHBondContact O-N 3.48Å; A100-F103 PolarHBondContact O-N 2.92Å; A100-L104 PolarHBondContact O-N 3.4Å
101V81.6Confident85.2Confident10 Ų1047.1 Ų47.16%0.06124%0.241CC..Hα-helixtrans-70.2-35.7175.9-174.70000111.8T25 L29 I50 G97 L98 F103 L104 E105T25-V101 HydrophobicContact CG2-CG1 4.01Å; L29-V101 HydrophobicContact CD1-CG1 3.79Å; L29-V101 HydrophobicContact CD2-CB 4.24Å; L29-V101 HydrophobicContact CD2-CG1 3.66Å; L29-V101 HydrophobicContact CD2-CG2 3.48Å; L29-V101 VanDerWaalsContact CD2-CG2 3.48Å; L29-V101 HydrophobicContact CG-CG1 4.28Å; I50-V101 HydrophobicContact CD1-CB 4.22Å; I50-V101 HydrophobicContact CD1-CG1 3.83Å; I50-V101 HydrophobicContact CG1-CG1 4.23Å; I50-V101 HydrophobicContact CG2-CG1 3.59Å; G97-V101 WeakPolarHBondContact O-CG2 3.23Å; G97-V101 PolarHBondContact O-N 2.95Å; L98-V101 PolarHBondContact O-N 3.5Å; L98-V101 VanDerWaalsContact O-N 3.16Å; V101-F103 VanDerWaalsContact C-N 3.33Å; V101-F103 PolarHBondContact O-N 3.5Å; V101-L104 WeakPolarHBondContact O-CB 2.9Å; V101-L104 PolarHBondContact O-N 3.03Å; V101-E105 PolarHBondContact O-N 3.48Å
102Q86.9Confident85.2Confident48 Ų4846.7 Ų46.722%0.22424%0.24CC..Hα-helixtrans-62.9-40.8171.5-72.5179.6-27.400111.7E49 I50 V53 L98 L99 L104 E105 F106E49-Q102 PolarHBondContact O-NE2 2.92Å; I50-Q102 HydrophobicContact CG1-CG 4.41Å; V53-Q102 WeakPolarHBondContact CG1-O 3.32Å; V53-Q102 HydrophobicContact CG2-CB 4.14Å; V53-Q102 HydrophobicContact CG2-CG 3.96Å; L98-Q102 HydrophobicContact CD1-CG 4.36Å; L98-Q102 HydrophobicContact CG-CG 4.49Å; L98-Q102 WeakPolarHBondContact O-CG 3.37Å; L98-Q102 PolarHBondContact O-N 3.31Å; L99-Q102 PolarHBondContact O-N 3.49Å; Q102-L104 VanDerWaalsContact C-N 3.34Å; Q102-E105 PolarHBondContact O-N 3.38Å; Q102-F106 PolarHBondContact O-N 3.08Å
103F90.7Very high85.7Confident110 Ų11046.2 Ų46.248%0.48224%0.238SC..Hα-helixtrans-66.7-36.3176.1-168.7-105.6000112M91 L99 A100 V101 F106 F107M91-F103 HydrophobicContact CE-CB 4.12Å; M91-F103 HydrophobicContact CE-CD1 3.71Å; M91-F103 HydrophobicContact CE-CG 4.41Å; M91-F103 HydrophobicContact SD-CD1 3.72Å; M91-F103 HydrophobicContact SD-CE1 4.4Å; L99-F103 WeakPolarHBondContact O-CB 3.49Å; L99-F103 PolarHBondContact O-N 3.49Å; A100-F103 PolarHBondContact O-N 2.92Å; V101-F103 VanDerWaalsContact C-N 3.33Å; V101-F103 PolarHBondContact O-N 3.5Å; F103-F106 WeakPolarHBondContact O-CB 2.88Å; F103-F106 PolarHBondContact O-N 3.06Å; F103-F107 AromaticContact CD1-CD2 3.91Å; F103-F107 HydrophobicContact CD1-CD2 3.91Å; F103-F107 AromaticContact CD1-CE2 3.83Å; F103-F107 HydrophobicContact CD1-CE2 3.83Å; F103-F107 HydrophobicContact CD2-CE2 4.43Å; F103-F107 AromaticContact CE1-CD2 3.76Å; F103-F107 HydrophobicContact CE1-CD2 3.76Å; F103-F107 AromaticContact CE1-CE2 3.21Å; F103-F107 HydrophobicContact CE1-CE2 3.21Å; F103-F107 HydrophobicContact CE1-CZ 4.09Å; F103-F107 AromaticContact CE2-CE2 3.89Å; F103-F107 HydrophobicContact CE2-CE2 3.89Å; F103-F107 HydrophobicContact CG-CD2 4.42Å; F103-F107 HydrophobicContact CG-CE2 4.44Å; F103-F107 HydrophobicContact CZ-CD2 4.15Å; F103-F107 AromaticContact CZ-CE2 3.29Å; F103-F107 HydrophobicContact CZ-CE2 3.29Å; F103-F107 HydrophobicContact CZ-CZ 4.09Å; F103-F107 WeakPolarHBondContact O-CD2 3.15Å; F103-F107 PolarHBondContact O-N 3.36Å
104L89.3Confident86Confident4 Ų446.2 Ų46.22%0.02124%0.238CC..Hα-helixtrans-57.6-48.6170.2173.7171.9000111.5T25 T88 M91 L92 A100 V101 Q102 F106 F107 Y108T25-L104 HydrophobicContact CG2-CD2 4.02Å; T88-L104 HydrophobicContact CG2-CD2 3.51Å; T88-L104 HydrophobicContact CG2-CG 3.64Å; M91-L104 HydrophobicContact CB-CB 4.1Å; M91-L104 HydrophobicContact CB-CD1 3.95Å; M91-L104 HydrophobicContact CB-CG 4.15Å; M91-L104 HydrophobicContact CE-CB 4.08Å; M91-L104 HydrophobicContact SD-CB 4.11Å; L92-L104 HydrophobicContact CB-CD1 4.41Å; L92-L104 HydrophobicContact CD2-CD1 3.77Å; L92-L104 HydrophobicContact CG-CD1 3.75Å; L92-L104 HydrophobicContact CG-CG 4.49Å; A100-L104 PolarHBondContact O-N 3.4Å; V101-L104 WeakPolarHBondContact O-CB 2.9Å; V101-L104 PolarHBondContact O-N 3.03Å; Q102-L104 VanDerWaalsContact C-N 3.34Å; L104-F106 VanDerWaalsContact C-N 3.28Å; L104-F106 PolarHBondContact O-N 3.3Å; L104-F107 PolarHBondContact O-N 2.95Å; L104-Y108 PolarHBondContact O-N 2.94Å
105E87.9Confident86.1Confident7 Ų743.6 Ų43.63%0.03323%0.23CC..Hα-helixtrans-63.5-33.3177.2-70.3-63.1160.200112.3T25 I50 V53 W54 V101 Q102 Y108 G109T25-E105 WeakPolarHBondContact CB-OE1 3.34Å; T25-E105 VanDerWaalsContact CG2-OE1 3.26Å; T25-E105 WeakPolarHBondContact CG2-OE1 3.23Å; T25-E105 PolarHBondContact OG1-OE1 3.22Å; I50-E105 HydrophobicContact CG2-CG 3.54Å; V53-E105 HydrophobicContact CB-CB 4.1Å; V53-E105 HydrophobicContact CG1-CB 4.27Å; W54-E105 HydrophobicContact CB-CB 4.26Å; W54-E105 WeakPolarHBondContact CB-OE2 3.24Å; V101-E105 PolarHBondContact O-N 3.48Å; Q102-E105 PolarHBondContact O-N 3.38Å; E105-Y108 PolarHBondContact O-N 3.49Å; E105-G109 PolarHBondContact O-N 2.85Å
106F93.8Very high86.2Confident69 Ų6944.4 Ų44.430%0.30323%0.231SC..Hα-helixtrans-62.5-47.9171.7171.7-96.7000112V53 S57 L61 Q102 F103 L104 Y108 G109 I110V53-F106 HydrophobicContact CG1-CB 4.22Å; S57-F106 VanDerWaalsContact OG-CD2 3.32Å; S57-F106 WeakPolarHBondContact OG-CD2 3.27Å; L61-F106 HydrophobicContact CD1-CE2 4.38Å; Q102-F106 PolarHBondContact O-N 3.08Å; F103-F106 WeakPolarHBondContact O-CB 2.88Å; F103-F106 PolarHBondContact O-N 3.06Å; L104-F106 VanDerWaalsContact C-N 3.28Å; L104-F106 PolarHBondContact O-N 3.3Å; F106-Y108 VanDerWaalsContact C-N 3.29Å; F106-Y108 PolarHBondContact O-N 3.3Å; F106-G109 WeakPolarHBondContact O-CA 2.94Å; F106-G109 PolarHBondContact O-N 2.83Å; F106-I110 HydrophobicContact CD1-CD1 4.16Å; F106-I110 HydrophobicContact CE1-CD1 3.62Å; F106-I110 HydrophobicContact CE1-CG1 4.27Å; F106-I110 HydrophobicContact CZ-CD1 4.09Å; F106-I110 HydrophobicContact CZ-CG1 4.4Å; F106-I110 PolarHBondContact O-N 3.37Å
107F93.2Very high86.6Confident42 Ų4237.2 Ų37.218%0.18420%0.198CC..Hα-helixtrans-62.9-36.9175.2-90-95.2000112.4V87 F103 L104 G109 I110 A111V87-F107 HydrophobicContact CB-CD1 3.73Å; V87-F107 HydrophobicContact CB-CE1 4.07Å; V87-F107 HydrophobicContact CB-CG 4.27Å; V87-F107 HydrophobicContact CG1-CB 4.4Å; V87-F107 HydrophobicContact CG1-CD1 3.57Å; V87-F107 HydrophobicContact CG1-CD2 4.15Å; V87-F107 HydrophobicContact CG1-CE1 3.8Å; V87-F107 HydrophobicContact CG1-CE2 4.4Å; V87-F107 HydrophobicContact CG1-CG 3.74Å; V87-F107 HydrophobicContact CG1-CZ 4.22Å; V87-F107 HydrophobicContact CG2-CD1 4.22Å; V87-F107 HydrophobicContact CG2-CE1 4.1Å; F103-F107 AromaticContact CD1-CD2 3.91Å; F103-F107 HydrophobicContact CD1-CD2 3.91Å; F103-F107 AromaticContact CD1-CE2 3.83Å; F103-F107 HydrophobicContact CD1-CE2 3.83Å; F103-F107 HydrophobicContact CD2-CE2 4.43Å; F103-F107 AromaticContact CE1-CD2 3.76Å; F103-F107 HydrophobicContact CE1-CD2 3.76Å; F103-F107 AromaticContact CE1-CE2 3.21Å; F103-F107 HydrophobicContact CE1-CE2 3.21Å; F103-F107 HydrophobicContact CE1-CZ 4.09Å; F103-F107 AromaticContact CE2-CE2 3.89Å; F103-F107 HydrophobicContact CE2-CE2 3.89Å; F103-F107 HydrophobicContact CG-CD2 4.42Å; F103-F107 HydrophobicContact CG-CE2 4.44Å; F103-F107 HydrophobicContact CZ-CD2 4.15Å; F103-F107 AromaticContact CZ-CE2 3.29Å; F103-F107 HydrophobicContact CZ-CE2 3.29Å; F103-F107 HydrophobicContact CZ-CZ 4.09Å; F103-F107 WeakPolarHBondContact O-CD2 3.15Å; F103-F107 PolarHBondContact O-N 3.36Å; L104-F107 PolarHBondContact O-N 2.95Å; F107-G109 VanDerWaalsContact C-N 3.28Å; F107-G109 PolarHBondContact O-N 3.47Å; F107-I110 HydrophobicContact CD1-CD1 4.29Å; F107-I110 HydrophobicContact CE1-CD1 4.45Å; F107-I110 WeakPolarHBondContact O-CB 3.41Å; F107-I110 PolarHBondContact O-N 3.33Å; F107-I110 VanDerWaalsContact O-N 3.16Å; F107-A111 PolarHBondContact O-N 2.94Å
108Y88.8Confident87Confident43 Ų4339.1 Ų39.117%0.16919%0.189CC..Hα-helixtrans-64.6-35.8173.2-167.2-126.5000111.8T22 W54 L85 T88 W89 L104 E105 F106 A111 T112T22-Y108 HydrophobicContact CG2-CE2 3.85Å; T22-Y108 WeakPolarHBondContact CG2-OH 3.3Å; T22-Y108 PolarHBondContact O-OH 3.49Å; W54-Y108 AromaticContact CD1-CD1 3.35Å; W54-Y108 AromaticContact CD1-CE1 3.93Å; W54-Y108 HydrophobicContact CG-CD1 4.17Å; W54-Y108 AromaticContact NE1-CD1 3.66Å; W54-Y108 AromaticContact NE1-CE1 3.78Å; L85-Y108 HydrophobicContact CD2-CD2 4.26Å; L85-Y108 HydrophobicContact CD2-CE2 4.23Å; T88-Y108 HydrophobicContact CG2-CD2 4.35Å; T88-Y108 HydrophobicContact CG2-CG 4.4Å; T88-Y108 PolarHBondContact OG1-N 2.87Å; W89-Y108 AromaticContact CH2-CD2 3.85Å; W89-Y108 HydrophobicContact CH2-CD2 3.85Å; W89-Y108 AromaticContact CH2-CE2 3.63Å; W89-Y108 HydrophobicContact CH2-CE2 3.63Å; W89-Y108 AromaticContact CZ3-CD2 3.9Å; W89-Y108 HydrophobicContact CZ3-CD2 3.9Å; W89-Y108 HydrophobicContact CZ3-CE2 4.16Å; L104-Y108 PolarHBondContact O-N 2.94Å; E105-Y108 PolarHBondContact O-N 3.49Å; F106-Y108 VanDerWaalsContact C-N 3.29Å; F106-Y108 PolarHBondContact O-N 3.3Å; Y108-A111 PolarHBondContact O-N 3.29Å; Y108-T112 PolarHBondContact O-N 3.2Å; Y108-T112 PolarHBondContact O-OG1 2.82Å
109G90.3Very high86.9Confident0 Ų037.8 Ų37.80%018%0.179CC..Hα-helixtrans-60-41.2169.700000113E105 F106 F107 T112 A113E105-G109 PolarHBondContact O-N 2.85Å; F106-G109 WeakPolarHBondContact O-CA 2.94Å; F106-G109 PolarHBondContact O-N 2.83Å; F107-G109 VanDerWaalsContact C-N 3.28Å; F107-G109 PolarHBondContact O-N 3.47Å; G109-T112 PolarHBondContact O-N 3.26Å; G109-A113 WeakPolarHBondContact O-CB 3.19Å; G109-A113 PolarHBondContact O-N 3.34Å
110I92.5Very high86.6Confident21 Ų2132.8 Ų32.811%0.10816%0.156CC..Hα-helixtrans-62-49172.8-58.6169.7000110.6L61 L80 S84 F106 F107 T112 A113 T114L61-I110 HydrophobicContact CD1-CB 4.16Å; L61-I110 HydrophobicContact CD1-CG1 3.43Å; L61-I110 VanDerWaalsContact CD1-CG1 3.43Å; L80-I110 HydrophobicContact CD1-CG2 4.44Å; L80-I110 HydrophobicContact CD2-CG2 4.16Å; L80-I110 HydrophobicContact CG-CG2 4.06Å; S84-I110 VanDerWaalsContact OG-CG2 3.28Å; S84-I110 WeakPolarHBondContact OG-CG2 3.07Å; F106-I110 HydrophobicContact CD1-CD1 4.16Å; F106-I110 HydrophobicContact CE1-CD1 3.62Å; F106-I110 HydrophobicContact CE1-CG1 4.27Å; F106-I110 HydrophobicContact CZ-CD1 4.09Å; F106-I110 HydrophobicContact CZ-CG1 4.4Å; F106-I110 PolarHBondContact O-N 3.37Å; F107-I110 HydrophobicContact CD1-CD1 4.29Å; F107-I110 HydrophobicContact CE1-CD1 4.45Å; F107-I110 WeakPolarHBondContact O-CB 3.41Å; F107-I110 PolarHBondContact O-N 3.33Å; F107-I110 VanDerWaalsContact O-N 3.16Å; I110-T112 VanDerWaalsContact C-N 3.25Å; I110-T112 PolarHBondContact O-N 3.17Å; I110-A113 PolarHBondContact O-N 3.49Å; I110-T114 HydrophobicContact CG2-CG2 4.27Å; I110-T114 WeakPolarHBondContact O-CB 3.26Å; I110-T114 WeakPolarHBondContact O-CG2 3.01Å; I110-T114 PolarHBondContact O-N 3.48Å; I110-T114 PolarHBondContact O-OG1 3Å
111A91Very high86.7Confident3 Ų331.9 Ų31.93%0.02515%0.147CC..Hα-helixtrans-58.4-39.1178.500000112.3Q81 L85 F107 Y108 T114 E115Q81-A111 WeakPolarHBondContact CG-O 3.33Å; Q81-A111 PolarHBondContact NE2-O 3.17Å; L85-A111 HydrophobicContact CD2-CB 3.61Å; L85-A111 HydrophobicContact CG-CB 3.69Å; F107-A111 PolarHBondContact O-N 2.94Å; Y108-A111 PolarHBondContact O-N 3.29Å; A111-T114 WeakPolarHBondContact CA-OG1 3.45Å; A111-T114 PolarHBondContact O-OG1 3.45Å; A111-T114 VanDerWaalsContact O-OG1 3.07Å; A111-E115 PolarHBondContact O-N 2.8Å
112T88.3Confident86.7Confident17 Ų1732.1 Ų32.110%0.10415%0.147CC..Hα-helixtrans-71.2-44.5178.6-49.60000111.3W54 Y58 Y108 G109 I110 T114 E115W54-T112 HydrophobicContact CZ2-CG2 4.08Å; W54-T112 PolarHBondContact NE1-OG1 3.23Å; Y58-T112 HydrophobicContact CD1-CG2 3.81Å; Y58-T112 HydrophobicContact CD2-CG2 4.34Å; Y58-T112 HydrophobicContact CE1-CG2 3.53Å; Y58-T112 HydrophobicContact CE2-CG2 4.15Å; Y58-T112 HydrophobicContact CG-CG2 4.22Å; Y108-T112 PolarHBondContact O-N 3.2Å; Y108-T112 PolarHBondContact O-OG1 2.82Å; G109-T112 PolarHBondContact O-N 3.26Å; I110-T112 VanDerWaalsContact C-N 3.25Å; I110-T112 PolarHBondContact O-N 3.17Å; T112-T114 VanDerWaalsContact C-N 3.25Å; T112-T114 PolarHBondContact O-N 3.43Å; T112-E115 WeakPolarHBondContact O-CB 3.27Å; T112-E115 PolarHBondContact O-N 2.72Å
113A89.3Confident86.2Confident1 Ų132.3 Ų32.31%0.00815%0.146CC..Hα-helixtrans-61.6-34.6178.600000112.8Y58 L61 V65 G109 I110Y58-A113 HydrophobicContact CD2-CB 3.92Å; Y58-A113 HydrophobicContact CE2-CB 4.25Å; L61-A113 HydrophobicContact CB-CB 3.78Å; V65-A113 HydrophobicContact CB-CB 4.46Å; V65-A113 WeakPolarHBondContact CG1-O 3.16Å; V65-A113 HydrophobicContact CG2-CB 4.03Å; G109-A113 WeakPolarHBondContact O-CB 3.19Å; G109-A113 PolarHBondContact O-N 3.34Å; I110-A113 PolarHBondContact O-N 3.49Å
114T90.2Very high85.5Confident0 Ų028.4 Ų28.40%013%0.132CC..Hα-helixtrans-80.7-13.6-179.151.10000114.4V65 V77 L80 Q81 I110 A111 T112 I116 A117V65-T114 HydrophobicContact CG1-CG2 3.88Å; V65-T114 HydrophobicContact CG2-CG2 3.92Å; V77-T114 HydrophobicContact CG1-CG2 3.64Å; L80-T114 HydrophobicContact CD2-CG2 4.13Å; L80-T114 HydrophobicContact CG-CG2 4.39Å; Q81-T114 VanDerWaalsContact CA-OG1 3.3Å; Q81-T114 WeakPolarHBondContact CA-OG1 3.44Å; Q81-T114 WeakPolarHBondContact CB-OG1 3.26Å; Q81-T114 WeakPolarHBondContact CG-OG1 3.29Å; I110-T114 HydrophobicContact CG2-CG2 4.27Å; I110-T114 WeakPolarHBondContact O-CB 3.26Å; I110-T114 WeakPolarHBondContact O-CG2 3.01Å; I110-T114 PolarHBondContact O-N 3.48Å; I110-T114 PolarHBondContact O-OG1 3Å; A111-T114 WeakPolarHBondContact CA-OG1 3.45Å; A111-T114 PolarHBondContact O-OG1 3.45Å; A111-T114 VanDerWaalsContact O-OG1 3.07Å; T112-T114 VanDerWaalsContact C-N 3.25Å; T112-T114 PolarHBondContact O-N 3.43Å; T114-I116 PolarHBondContact O-N 3.35Å; T114-A117 VanDerWaalsContact O-CB 3.26Å; T114-A117 WeakPolarHBondContact O-CB 3.34Å; T114-A117 PolarHBondContact O-N 3.46Å; T114-A117 VanDerWaalsContact O-N 3.08Å
115E84.2Confident85.2Confident76 Ų7631.3 Ų31.336%0.35515%0.15SC..Hα-helixtrans-59.1-35176.3-169.1-174.3166.900112.6A111 T112 A117 Y118 Y119A111-E115 PolarHBondContact O-N 2.8Å; T112-E115 WeakPolarHBondContact O-CB 3.27Å; T112-E115 PolarHBondContact O-N 2.72Å; E115-A117 PolarHBondContact O-N 3.27Å; E115-Y118 WeakPolarHBondContact O-CB 3.47Å; E115-Y118 PolarHBondContact O-N 2.91Å; E115-Y118 VanDerWaalsContact O-N 3.09Å; E115-Y119 HydrophobicContact CG-CE2 4.23Å
116I78.8Confident84.7Confident40 Ų4032.9 Ų32.921%0.20516%0.16CC..Hα-helixtrans-60.3-32.9179.5-59.6168.5000110.8L62 T114 Y118 Y119 S120L62-I116 HydrophobicContact CD1-CD1 3.3Å; T114-I116 PolarHBondContact O-N 3.35Å; I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 PolarHBondContact O-N 3.18Å; I116-Y119 PolarHBondContact O-N 3.45Å; I116-S120 PolarHBondContact O-N 3.4Å; I116-S120 PolarHBondContact O-OG 2.86Å
117A81.4Confident84Confident1 Ų135.9 Ų35.91%0.00818%0.179CC..Hα-helixtrans-65.7-31.917900000112.9T69 V77 T114 E115 S120 Y121T69-A117 HydrophobicContact CG2-CB 3.6Å; T69-A117 WeakPolarHBondContact OG1-CB 3.46Å; V77-A117 HydrophobicContact CB-CB 3.96Å; V77-A117 HydrophobicContact CG1-CB 3.49Å; V77-A117 VanDerWaalsContact CG1-CB 3.49Å; T114-A117 VanDerWaalsContact O-CB 3.26Å; T114-A117 WeakPolarHBondContact O-CB 3.34Å; T114-A117 PolarHBondContact O-N 3.46Å; T114-A117 VanDerWaalsContact O-N 3.08Å; E115-A117 PolarHBondContact O-N 3.27Å; A117-S120 PolarHBondContact O-N 2.74Å; A117-Y121 WeakPolarHBondContact O-CB 3.48Å; A117-Y121 PolarHBondContact O-N 3.01Å
118Y82.3Confident83Confident91 Ų9139.3 Ų39.336%0.35720%0.198SC..Hα-helixtrans-64.8-44.3178.3178.8-107.6000111.7I78 E115 I116 Y121 I122I78-Y118 HydrophobicContact CD1-CD2 4.19Å; I78-Y118 HydrophobicContact CG1-CD2 4.5Å; E115-Y118 WeakPolarHBondContact O-CB 3.47Å; E115-Y118 PolarHBondContact O-N 2.91Å; E115-Y118 VanDerWaalsContact O-N 3.09Å; I116-Y118 VanDerWaalsContact C-N 3.3Å; I116-Y118 PolarHBondContact O-N 3.18Å; Y118-Y121 WeakPolarHBondContact O-CB 3.21Å; Y118-Y121 PolarHBondContact O-N 3.08Å; Y118-I122 HydrophobicContact CD1-CD1 3.74Å; Y118-I122 HydrophobicContact CD2-CD1 4.5Å; Y118-I122 HydrophobicContact CE1-CD1 3.33Å; Y118-I122 HydrophobicContact CE1-CG1 4.47Å; Y118-I122 HydrophobicContact CE2-CD1 4.15Å; Y118-I122 HydrophobicContact CG-CD1 4.31Å; Y118-I122 WeakPolarHBondContact O-CD1 3.48Å; Y118-I122 WeakPolarHBondContact O-CG1 3.47Å; Y118-I122 PolarHBondContact O-N 3.24Å; Y118-I122 VanDerWaalsContact O-N 3.16Å
119Y77Confident82.2Confident48 Ų4841 Ų4119%0.18823%0.229CC..Hα-helixtrans-64.9-41.7176.1-68.7-75.4000111.8E115 I116 I122 Y123 C138E115-Y119 HydrophobicContact CG-CE2 4.23Å; I116-Y119 PolarHBondContact O-N 3.45Å; Y119-I122 PolarHBondContact O-N 2.64Å; Y119-Y123 WeakPolarHBondContact O-CD2 3.25Å; Y119-Y123 WeakPolarHBondContact O-CE2 3.38Å; Y119-Y123 PolarHBondContact O-N 3.27Å; Y119-C138 HydrophobicContact CE1-CB 4.27Å
120S79.3Confident81.6Confident31 Ų3145 Ų4522%0.21725%0.248CC..Hα-helixtrans-63-43.1176.4-58.60000112I116 A117 I122 Y123 T124I116-S120 PolarHBondContact O-N 3.4Å; I116-S120 PolarHBondContact O-OG 2.86Å; A117-S120 PolarHBondContact O-N 2.74Å; S120-I122 VanDerWaalsContact C-N 3.32Å; S120-I122 PolarHBondContact O-N 3.33Å; S120-Y123 PolarHBondContact O-N 3.42Å; S120-Y123 VanDerWaalsContact O-N 3.17Å; S120-T124 WeakPolarHBondContact O-CG2 3.49Å; S120-T124 PolarHBondContact O-N 3.23Å
121Y83.6Confident80.4Confident8 Ų845.9 Ų45.93%0.03125%0.251CS..Hα-helixtrans-53.4-49.2175.2169.6-105.6000111.9I78 A117 Y118 Y123 T124 V125 L185 P186 P188I78-Y121 HydrophobicContact CD1-CD1 3.81Å; I78-Y121 HydrophobicContact CD1-CD2 4.18Å; I78-Y121 HydrophobicContact CD1-CG 3.61Å; A117-Y121 WeakPolarHBondContact O-CB 3.48Å; A117-Y121 PolarHBondContact O-N 3.01Å; Y118-Y121 WeakPolarHBondContact O-CB 3.21Å; Y118-Y121 PolarHBondContact O-N 3.08Å; Y121-Y123 VanDerWaalsContact C-N 3.26Å; Y121-Y123 PolarHBondContact O-N 2.87Å; Y121-T124 PolarHBondContact O-N 3.45Å; Y121-T124 PolarHBondContact O-OG1 3.38Å; Y121-V125 HydrophobicContact CD2-CG1 4.24Å; Y121-V125 HydrophobicContact CE1-CG2 4.3Å; Y121-V125 HydrophobicContact CE2-CG1 3.71Å; Y121-V125 PolarHBondContact O-N 2.64Å; Y121-L185 HydrophobicContact CE1-CD1 4.29Å; Y121-L185 HydrophobicContact CE1-CD2 4.14Å; Y121-P186 VanDerWaalsContact CE2-O 3.27Å; Y121-P186 WeakPolarHBondContact CE2-O 3.42Å; Y121-P186 WeakPolarHBondContact OH-CD 3.35Å; Y121-P186 VanDerWaalsContact OH-CG 3.29Å; Y121-P186 WeakPolarHBondContact OH-CG 3.42Å; Y121-P186 PolarHBondContact OH-O 3.16Å; Y121-P188 HydrophobicContact CD2-CG 4.06Å; Y121-P188 HydrophobicContact CE2-CG 4.12Å
122I81.8Confident79.2Confident14 Ų1453.9 Ų53.97%0.07229%0.288CS..Hα-helixtrans-57.6-40.7-179.2-71.7160.6000111.4Y118 Y119 S120 T124 V125 V126 V134 C138Y118-I122 HydrophobicContact CD1-CD1 3.74Å; Y118-I122 HydrophobicContact CD2-CD1 4.5Å; Y118-I122 HydrophobicContact CE1-CD1 3.33Å; Y118-I122 HydrophobicContact CE1-CG1 4.47Å; Y118-I122 HydrophobicContact CE2-CD1 4.15Å; Y118-I122 HydrophobicContact CG-CD1 4.31Å; Y118-I122 WeakPolarHBondContact O-CD1 3.48Å; Y118-I122 WeakPolarHBondContact O-CG1 3.47Å; Y118-I122 PolarHBondContact O-N 3.24Å; Y118-I122 VanDerWaalsContact O-N 3.16Å; Y119-I122 PolarHBondContact O-N 2.64Å; S120-I122 VanDerWaalsContact C-N 3.32Å; S120-I122 PolarHBondContact O-N 3.33Å; I122-T124 VanDerWaalsContact C-N 3.29Å; I122-T124 PolarHBondContact O-N 2.99Å; I122-V125 PolarHBondContact O-N 3.34Å; I122-V126 WeakPolarHBondContact O-CB 3.47Å; I122-V126 VanDerWaalsContact O-CG2 3.3Å; I122-V126 WeakPolarHBondContact O-CG2 3.31Å; I122-V134 HydrophobicContact CG2-CB 4.43Å; I122-V134 HydrophobicContact CG2-CG1 3.1Å; I122-C138 HydrophobicContact CD1-CB 4.4Å; I122-C138 WeakPolarHBondContact CD1-SG 3.48Å
123Y76.2Confident78.4Confident52 Ų5258 Ų5820%0.20430%0.304CS..Hα-helixtrans-70.6-22.9177.1-59-44000113.4Y119 S120 Y121 Y131 T135Y119-Y123 WeakPolarHBondContact O-CD2 3.25Å; Y119-Y123 WeakPolarHBondContact O-CE2 3.38Å; Y119-Y123 PolarHBondContact O-N 3.27Å; S120-Y123 PolarHBondContact O-N 3.42Å; S120-Y123 VanDerWaalsContact O-N 3.17Å; Y121-Y123 VanDerWaalsContact C-N 3.26Å; Y121-Y123 PolarHBondContact O-N 2.87Å; Y123-Y131 HydrophobicContact CD1-CD1 4.31Å; Y123-Y131 HydrophobicContact CD1-CD2 4.01Å; Y123-Y131 HydrophobicContact CD1-CE2 4.32Å; Y123-Y131 HydrophobicContact CD1-CG 4.03Å; Y123-Y131 HydrophobicContact CG-CD2 4.45Å; Y123-Y131 HydrophobicContact CG-CE2 4.38Å; Y123-Y131 WeakPolarHBondContact O-CE1 3.44Å; Y123-Y131 VanDerWaalsContact O-CZ 3.3Å; Y123-Y131 PolarHBondContact O-OH 3.16Å; Y123-T135 WeakPolarHBondContact CE1-OG1 3.45Å; Y123-T135 WeakPolarHBondContact OH-CG2 3.3Å; Y123-T135 PolarHBondContact OH-OG1 3.37Å
124T76.7Confident77.7Confident29 Ų2959.3 Ų59.318%0.17831%0.312CS..Hα-helixtrans-80.9-19.817765.70000114.7Y74 S120 Y121 I122 P188 L192Y74-T124 HydrophobicContact CD2-CG2 4.32Å; Y74-T124 HydrophobicContact CE1-CG2 4.26Å; Y74-T124 HydrophobicContact CE2-CG2 3.56Å; S120-T124 WeakPolarHBondContact O-CG2 3.49Å; S120-T124 PolarHBondContact O-N 3.23Å; Y121-T124 PolarHBondContact O-N 3.45Å; Y121-T124 PolarHBondContact O-OG1 3.38Å; I122-T124 VanDerWaalsContact C-N 3.29Å; I122-T124 PolarHBondContact O-N 2.99Å; T124-P188 WeakPolarHBondContact OG1-CB 3.3Å; T124-L192 HydrophobicContact CG2-CD1 3.77Å; T124-L192 HydrophobicContact CG2-CG 3.78Å
125V81.9Confident76.8Confident65 Ų6561.2 Ų61.239%0.39432%0.323SS..SBendtrans-106.62.5-175.3-59.10000113.5Y121 I122 P188Y121-V125 HydrophobicContact CD2-CG1 4.24Å; Y121-V125 HydrophobicContact CE1-CG2 4.3Å; Y121-V125 HydrophobicContact CE2-CG1 3.71Å; Y121-V125 PolarHBondContact O-N 2.64Å; I122-V125 PolarHBondContact O-N 3.34Å; V125-P188 HydrophobicContact CG1-CB 3.95Å
126V79Confident76.3Confident40 Ų4060.7 Ų60.724%0.24233%0.328CS..SBendtrans-122.9150.8-177.1174.30000108.9I122 M130 Y131 V134I122-V126 WeakPolarHBondContact O-CB 3.47Å; I122-V126 VanDerWaalsContact O-CG2 3.3Å; I122-V126 WeakPolarHBondContact O-CG2 3.31Å; V126-M130 HydrophobicContact CG1-CB 3.52Å; V126-Y131 HydrophobicContact CG1-CD1 4.34Å; V126-Y131 WeakPolarHBondContact O-CE1 3.29Å; V126-V134 HydrophobicContact CG1-CG2 3.85Å; V126-V134 HydrophobicContact CG2-CG1 4.38Å; V126-V134 HydrophobicContact CG2-CG2 4.22Å
127D77.5Confident76.4Confident132 Ų13265.5 Ų65.571%0.70635%0.345SS*.  trans-71.8146173.4-62.5-52.1000112.6G129 M130 Y131D127-G129 PolarHBondContact O-N 3.48Å; D127-M130 PolarHBondContact O-N 3.13Å; D127-Y131 VanDerWaalsContact O-CD1 3.22Å; D127-Y131 WeakPolarHBondContact O-CD1 3.24Å
128L74Confident76.3Confident114 Ų11466.2 Ų66.260%0.59735%0.35SS*.G310 helixtrans-49.4-37.5-179-76.1158.3000113.8M130 Y131L128-M130 PolarHBondContact O-N 3.14Å; L128-Y131 VanDerWaalsContact CA-CE1 3.5Å; L128-Y131 HydrophobicContact CD2-CD2 4.27Å; L128-Y131 HydrophobicContact CD2-CE1 4.32Å; L128-Y131 HydrophobicContact CD2-CE2 3.6Å; L128-Y131 HydrophobicContact CG-CE1 4.44Å; L128-Y131 PolarHBondContact O-N 3.31Å
129G72Confident75.9Confident78 Ų7866.8 Ų66.880%0.80435%0.351SS*.G310 helixtrans-66.1-18.7179.100000114.5D127D127-G129 PolarHBondContact O-N 3.48Å
130M75.7Confident75.8Confident84 Ų8467.2 Ų67.241%0.41436%0.361SS..G310 helixtrans-102.3-3-176.9-65-64.6-81.900113.2V126 D127 L128 Q132 K133 V134V126-M130 HydrophobicContact CG1-CB 3.52Å; D127-M130 PolarHBondContact O-N 3.13Å; L128-M130 PolarHBondContact O-N 3.14Å; M130-Q132 PolarHBondContact O-N 3.41Å; M130-K133 HydrophobicContact CE-CD 3.8Å; M130-K133 PolarHBondContact O-N 3Å; M130-K133 VanDerWaalsContact O-N 3.13Å; M130-K133 HydrophobicContact SD-CD 4.43Å; M130-V134 HydrophobicContact CB-CG2 4.45Å; M130-V134 WeakPolarHBondContact O-CG2 3.48Å; M130-V134 PolarHBondContact O-N 3.35Å
131Y68.9Low76.1Confident39 Ų3968.8 Ų68.815%0.15338%0.376CS..Hα-helixtrans-55.2-50.3-175.1-80.221.3000111.9Y123 V126 D127 L128 K133 V134 T135 M395Y123-Y131 HydrophobicContact CD1-CD1 4.31Å; Y123-Y131 HydrophobicContact CD1-CD2 4.01Å; Y123-Y131 HydrophobicContact CD1-CE2 4.32Å; Y123-Y131 HydrophobicContact CD1-CG 4.03Å; Y123-Y131 HydrophobicContact CG-CD2 4.45Å; Y123-Y131 HydrophobicContact CG-CE2 4.38Å; Y123-Y131 WeakPolarHBondContact O-CE1 3.44Å; Y123-Y131 VanDerWaalsContact O-CZ 3.3Å; Y123-Y131 PolarHBondContact O-OH 3.16Å; V126-Y131 HydrophobicContact CG1-CD1 4.34Å; V126-Y131 WeakPolarHBondContact O-CE1 3.29Å; D127-Y131 VanDerWaalsContact O-CD1 3.22Å; D127-Y131 WeakPolarHBondContact O-CD1 3.24Å; L128-Y131 VanDerWaalsContact CA-CE1 3.5Å; L128-Y131 HydrophobicContact CD2-CD2 4.27Å; L128-Y131 HydrophobicContact CD2-CE1 4.32Å; L128-Y131 HydrophobicContact CD2-CE2 3.6Å; L128-Y131 HydrophobicContact CG-CE1 4.44Å; L128-Y131 PolarHBondContact O-N 3.31Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.5Å; Y131-V134 PolarHBondContact O-N 2.91Å; Y131-T135 WeakPolarHBondContact O-CB 3.47Å; Y131-T135 PolarHBondContact O-N 2.92Å; Y131-T135 PolarHBondContact O-OG1 3.33Å; Y131-M395 HydrophobicContact CD2-CE 3.97Å
132Q64.6Low76Confident172 Ų17270.8 Ų70.880%0.80439%0.389SS*.Hα-helixtrans-58.8-41.9-179.2-176.1178-12.200112.3M130 S136M130-Q132 PolarHBondContact O-N 3.41Å; Q132-S136 WeakPolarHBondContact O-CB 3.43Å; Q132-S136 PolarHBondContact O-N 3.36Å
133K71.9Confident75.6Confident104 Ų10472.1 Ų72.145%0.45240%0.396SS..Hα-helixtrans-67.5-44.6180-171.3175.6179.6-179.50110.8M130 Y131 S136 Y137M130-K133 HydrophobicContact CE-CD 3.8Å; M130-K133 PolarHBondContact O-N 3Å; M130-K133 VanDerWaalsContact O-N 3.13Å; M130-K133 HydrophobicContact SD-CD 4.43Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.5Å; K133-S136 WeakPolarHBondContact O-CB 3.42Å; K133-S136 PolarHBondContact O-N 3.21Å; K133-Y137 HydrophobicContact CD-CE2 4.14Å; K133-Y137 VanDerWaalsContact CE-CZ 3.48Å; K133-Y137 WeakPolarHBondContact CE-OH 3.38Å; K133-Y137 HydrophobicContact CG-CD2 4.25Å; K133-Y137 HydrophobicContact CG-CE1 4.41Å; K133-Y137 HydrophobicContact CG-CE2 3.65Å; K133-Y137 VanDerWaalsContact O-CG 3.31Å; K133-Y137 PolarHBondContact O-N 3.49Å
134V75.4Confident75.9Confident27 Ų2774 Ų7416%0.16441%0.413CS..Hα-helixtrans-70.4-41.3180173.80000112I122 V126 M130 Y131 S136 Y137 C138I122-V134 HydrophobicContact CG2-CB 4.43Å; I122-V134 HydrophobicContact CG2-CG1 3.1Å; V126-V134 HydrophobicContact CG1-CG2 3.85Å; V126-V134 HydrophobicContact CG2-CG1 4.38Å; V126-V134 HydrophobicContact CG2-CG2 4.22Å; M130-V134 HydrophobicContact CB-CG2 4.45Å; M130-V134 WeakPolarHBondContact O-CG2 3.48Å; M130-V134 PolarHBondContact O-N 3.35Å; Y131-V134 PolarHBondContact O-N 2.91Å; V134-S136 VanDerWaalsContact C-N 3.27Å; V134-S136 PolarHBondContact O-N 3.47Å; V134-Y137 PolarHBondContact O-N 3.34Å; V134-C138 PolarHBondContact O-N 3.47Å; V134-C138 PolarHBondContact O-SG 2.88Å
135T71.7Confident76.3Confident40 Ų4074.5 Ų74.525%0.24542%0.424CS..Hα-helixtrans-56.5-44.5170.8-55.40000110.8Y123 Y131 C138 R139Y123-T135 WeakPolarHBondContact CE1-OG1 3.45Å; Y123-T135 WeakPolarHBondContact OH-CG2 3.3Å; Y123-T135 PolarHBondContact OH-OG1 3.37Å; Y131-T135 WeakPolarHBondContact O-CB 3.47Å; Y131-T135 PolarHBondContact O-N 2.92Å; Y131-T135 PolarHBondContact O-OG1 3.33Å; T135-C138 PolarHBondContact O-N 3.16Å; T135-R139 HydrophobicContact CG2-CG 4.39Å; T135-R139 WeakPolarHBondContact O-CB 3.21Å; T135-R139 WeakPolarHBondContact O-CG 3.39Å; T135-R139 PolarHBondContact O-N 3.17Å
136S73.2Confident76.1Confident65 Ų6576.2 Ų76.246%0.45543%0.427SS..Hα-helixtrans-61.9-44.3177.2179.10000111.8Q132 K133 V134 S140Q132-S136 WeakPolarHBondContact O-CB 3.43Å; Q132-S136 PolarHBondContact O-N 3.36Å; K133-S136 WeakPolarHBondContact O-CB 3.42Å; K133-S136 PolarHBondContact O-N 3.21Å; V134-S136 VanDerWaalsContact C-N 3.27Å; V134-S136 PolarHBondContact O-N 3.47Å; S136-S140 VanDerWaalsContact O-CB 3.24Å; S136-S140 WeakPolarHBondContact O-CB 3.2Å; S136-S140 PolarHBondContact O-N 3.04Å; S136-S140 PolarHBondContact O-OG 3.05Å
137Y80.5Confident75.9Confident141 Ų14175.6 Ų75.655%0.55342%0.423SS*.Hα-helixtrans-63-44.7175.8-67.2-23.6000112.8K133 V134 S140 A141K133-Y137 HydrophobicContact CD-CE2 4.14Å; K133-Y137 VanDerWaalsContact CE-CZ 3.48Å; K133-Y137 WeakPolarHBondContact CE-OH 3.38Å; K133-Y137 HydrophobicContact CG-CD2 4.25Å; K133-Y137 HydrophobicContact CG-CE1 4.41Å; K133-Y137 HydrophobicContact CG-CE2 3.65Å; K133-Y137 VanDerWaalsContact O-CG 3.31Å; K133-Y137 PolarHBondContact O-N 3.49Å; V134-Y137 PolarHBondContact O-N 3.34Å; Y137-S140 PolarHBondContact O-N 2.89Å; Y137-A141 VanDerWaalsContact O-CB 3.31Å; Y137-A141 WeakPolarHBondContact O-CB 3.18Å; Y137-A141 PolarHBondContact O-N 2.93Å
138C80Confident76.3Confident17 Ų1773.3 Ų73.312%0.11541%0.413CS..Hα-helixtrans-63.5-48178.8-63.10000111.3Y119 I122 V134 T135 S140 A141 T142Y119-C138 HydrophobicContact CE1-CB 4.27Å; I122-C138 HydrophobicContact CD1-CB 4.4Å; I122-C138 WeakPolarHBondContact CD1-SG 3.48Å; V134-C138 PolarHBondContact O-N 3.47Å; V134-C138 PolarHBondContact O-SG 2.88Å; T135-C138 PolarHBondContact O-N 3.16Å; C138-S140 VanDerWaalsContact C-N 3.33Å; C138-S140 PolarHBondContact O-N 3.23Å; C138-A141 PolarHBondContact O-N 3.04Å; C138-T142 PolarHBondContact O-N 3.47Å; C138-T142 PolarHBondContact O-OG1 2.97Å; C138-T142 VanDerWaalsContact O-OG1 3.06Å
139R72.1Confident76.7Confident103 Ų10368.4 Ų68.439%0.38939%0.39SS..Hα-helixtrans-59.5-43.3175.6-75.4-85.3-178.3133.2-2.7111.8T135 T142 L143T135-R139 HydrophobicContact CG2-CG 4.39Å; T135-R139 WeakPolarHBondContact O-CB 3.21Å; T135-R139 WeakPolarHBondContact O-CG 3.39Å; T135-R139 PolarHBondContact O-N 3.17Å; R139-T142 PolarHBondContact O-N 3.01Å; R139-L143 VanDerWaalsContact O-CG 3.29Å; R139-L143 WeakPolarHBondContact O-CG 3.46Å; R139-L143 PolarHBondContact O-N 3.5Å
140S76.5Confident76.8Confident56 Ų5665 Ų6539%0.39235%0.354SS..Hα-helixtrans-65.4-44.4178.8-58.20000111.5S136 Y137 C138 T142 L143 V144S136-S140 VanDerWaalsContact O-CB 3.24Å; S136-S140 WeakPolarHBondContact O-CB 3.2Å; S136-S140 PolarHBondContact O-N 3.04Å; S136-S140 PolarHBondContact O-OG 3.05Å; Y137-S140 PolarHBondContact O-N 2.89Å; C138-S140 VanDerWaalsContact C-N 3.33Å; C138-S140 PolarHBondContact O-N 3.23Å; S140-T142 VanDerWaalsContact C-N 3.33Å; S140-T142 PolarHBondContact O-N 3.31Å; S140-L143 PolarHBondContact O-N 3.4Å; S140-V144 WeakPolarHBondContact O-CB 3.36Å; S140-V144 VanDerWaalsContact O-CG2 3.27Å; S140-V144 WeakPolarHBondContact O-CG2 3.39Å; S140-V144 PolarHBondContact O-N 2.9Å
141A85.5Confident76.9Confident65 Ų6564.1 Ų64.154%0.53735%0.353SS..Hα-helixtrans-59.7-43.6176.400000111.5Y137 C138 V144 G145Y137-A141 VanDerWaalsContact O-CB 3.31Å; Y137-A141 WeakPolarHBondContact O-CB 3.18Å; Y137-A141 PolarHBondContact O-N 2.93Å; C138-A141 PolarHBondContact O-N 3.04Å; A141-V144 PolarHBondContact O-N 3.42Å; A141-G145 PolarHBondContact O-N 3.1Å
142T80.2Confident77.7Confident49 Ų4965.9 Ų65.930%0.30137%0.365SS..Hα-helixtrans-61.8-46175.5-59.80000111.9C138 R139 S140 G145 F146C138-T142 PolarHBondContact O-N 3.47Å; C138-T142 PolarHBondContact O-OG1 2.97Å; C138-T142 VanDerWaalsContact O-OG1 3.06Å; R139-T142 PolarHBondContact O-N 3.01Å; S140-T142 VanDerWaalsContact C-N 3.33Å; S140-T142 PolarHBondContact O-N 3.31Å; T142-G145 PolarHBondContact O-N 3.45Å; T142-F146 HydrophobicContact CG2-CD2 3.7Å; T142-F146 HydrophobicContact CG2-CE2 3.39Å; T142-F146 HydrophobicContact CG2-CZ 4.48Å; T142-F146 WeakPolarHBondContact O-CD2 3.38Å; T142-F146 PolarHBondContact O-N 2.91Å
143L75.1Confident78.5Confident43 Ų4357.7 Ų57.723%0.22533%0.327CS..Hα-helixtrans-65.9-42.1179-71.2166.9000112.7R139 S140 F146 T147 T319 A323 M379R139-L143 VanDerWaalsContact O-CG 3.29Å; R139-L143 WeakPolarHBondContact O-CG 3.46Å; R139-L143 PolarHBondContact O-N 3.5Å; S140-L143 PolarHBondContact O-N 3.4Å; L143-F146 PolarHBondContact O-N 3.33Å; L143-T147 WeakPolarHBondContact O-CB 3.5Å; L143-T147 PolarHBondContact O-N 2.93Å; L143-T147 PolarHBondContact O-OG1 2.94Å; L143-T319 HydrophobicContact CD2-CG2 3.76Å; L143-A323 HydrophobicContact CD1-CB 3.9Å; L143-A323 HydrophobicContact CD2-CB 4.49Å; L143-M379 HydrophobicContact CD2-CE 3.67Å
144V82.4Confident78.8Confident90 Ų9053.8 Ų53.855%0.54531%0.31SS..Hα-helixtrans-63.5-44.7174.4171.20000109.7S140 A141 F146 T147 V148S140-V144 WeakPolarHBondContact O-CB 3.36Å; S140-V144 VanDerWaalsContact O-CG2 3.27Å; S140-V144 WeakPolarHBondContact O-CG2 3.39Å; S140-V144 PolarHBondContact O-N 2.9Å; A141-V144 PolarHBondContact O-N 3.42Å; V144-F146 PolarHBondContact O-N 3.01Å; V144-T147 PolarHBondContact O-N 3.37Å; V144-V148 HydrophobicContact CG1-CG2 4Å; V144-V148 WeakPolarHBondContact O-CB 3.42Å; V144-V148 VanDerWaalsContact O-CG2 3.27Å; V144-V148 WeakPolarHBondContact O-CG2 3.21Å; V144-V148 PolarHBondContact O-N 2.88Å
145G84.6Confident79.2Confident41 Ų4156.3 Ų56.342%0.42332%0.322SS..Hα-helixtrans-56.2-49.7175.200000112.3A141 T142 T147 V148 G149A141-G145 PolarHBondContact O-N 3.1Å; T142-G145 PolarHBondContact O-N 3.45Å; G145-T147 VanDerWaalsContact C-N 3.34Å; G145-T147 PolarHBondContact O-N 2.91Å; G145-V148 PolarHBondContact O-N 3.29Å; G145-G149 PolarHBondContact O-N 3.49Å
146F76.5Confident79.9Confident101 Ų10155.4 Ų55.444%0.44332%0.315SS..Hα-helixtrans-60.1-42.6175.4-81.2-58.2000112.7T142 L143 V144 S150 T319T142-F146 HydrophobicContact CG2-CD2 3.7Å; T142-F146 HydrophobicContact CG2-CE2 3.39Å; T142-F146 HydrophobicContact CG2-CZ 4.48Å; T142-F146 WeakPolarHBondContact O-CD2 3.38Å; T142-F146 PolarHBondContact O-N 2.91Å; L143-F146 PolarHBondContact O-N 3.33Å; V144-F146 PolarHBondContact O-N 3.01Å; F146-S150 WeakPolarHBondContact O-CB 3.4Å; F146-S150 PolarHBondContact O-N 3.46Å; F146-S150 PolarHBondContact O-OG 3.31Å; F146-T319 HydrophobicContact CB-CG2 4.07Å
147T76.5Confident79.8Confident26 Ų2652.3 Ų52.316%0.1629%0.294CS..Hα-helixtrans-68-48.2-179-54.50000110.9L143 V144 G145 S150 V151 L320L143-T147 WeakPolarHBondContact O-CB 3.5Å; L143-T147 PolarHBondContact O-N 2.93Å; L143-T147 PolarHBondContact O-OG1 2.94Å; V144-T147 PolarHBondContact O-N 3.37Å; G145-T147 VanDerWaalsContact C-N 3.34Å; G145-T147 PolarHBondContact O-N 2.91Å; T147-S150 PolarHBondContact O-N 3.48Å; T147-V151 HydrophobicContact CG2-CG2 4.39Å; T147-V151 WeakPolarHBondContact O-CB 3.23Å; T147-V151 VanDerWaalsContact O-CG2 3.24Å; T147-V151 WeakPolarHBondContact O-CG2 3.34Å; T147-V151 PolarHBondContact O-N 2.82Å; T147-L320 HydrophobicContact CG2-CB 4.43Å
148V84.4Confident79.5Confident84 Ų8447.4 Ų47.451%0.50928%0.28SS..Hα-helixtrans-63.4-46.6178.6172.40000110.4V144 G145 S150 V151 L152V144-V148 HydrophobicContact CG1-CG2 4Å; V144-V148 WeakPolarHBondContact O-CB 3.42Å; V144-V148 VanDerWaalsContact O-CG2 3.27Å; V144-V148 WeakPolarHBondContact O-CG2 3.21Å; V144-V148 PolarHBondContact O-N 2.88Å; G145-V148 PolarHBondContact O-N 3.29Å; V148-S150 PolarHBondContact O-N 3.2Å; V148-V151 PolarHBondContact O-N 3.3Å; V148-L152 WeakPolarHBondContact O-CA 2.99Å; V148-L152 WeakPolarHBondContact O-CB 3.44Å; V148-L152 PolarHBondContact O-N 3.29Å
149G83.3Confident79.6Confident11 Ų1152.3 Ų52.311%0.11331%0.309CS..Hα-helixtrans-60.2-45177.600000112.9E21 G145 G153E21-G149 VanDerWaalsContact OE2-C 3.3Å; E21-G149 WeakPolarHBondContact OE2-CA 3.36Å; G145-G149 PolarHBondContact O-N 3.49Å; G149-G153 WeakPolarHBondContact O-CA 3.44Å; G149-G153 PolarHBondContact O-N 3.19Å
150S73.4Confident80.3Confident7 Ų751.2 Ų51.25%0.04931%0.314CS..Hα-helixtrans-66.6-44.9177.8-57.90000112.7F146 T147 V148 Q154F146-S150 WeakPolarHBondContact O-CB 3.4Å; F146-S150 PolarHBondContact O-N 3.46Å; F146-S150 PolarHBondContact O-OG 3.31Å; T147-S150 PolarHBondContact O-N 3.48Å; V148-S150 PolarHBondContact O-N 3.2Å; S150-Q154 WeakPolarHBondContact O-CB 3.43Å; S150-Q154 PolarHBondContact O-N 3Å
151V78.7Confident80.4Confident65 Ų6550.7 Ų50.739%0.39432%0.317SS..Hα-helixtrans-67.6-49.1177.8171.10000111T147 V148 G153 Q154 I155 A316T147-V151 HydrophobicContact CG2-CG2 4.39Å; T147-V151 WeakPolarHBondContact O-CB 3.23Å; T147-V151 VanDerWaalsContact O-CG2 3.24Å; T147-V151 WeakPolarHBondContact O-CG2 3.34Å; T147-V151 PolarHBondContact O-N 2.82Å; V148-V151 PolarHBondContact O-N 3.3Å; V151-G153 VanDerWaalsContact C-N 3.26Å; V151-G153 PolarHBondContact O-N 2.99Å; V151-Q154 PolarHBondContact O-N 3.45Å; V151-Q154 VanDerWaalsContact O-N 3.13Å; V151-I155 HydrophobicContact CG1-CD1 3.67Å; V151-I155 HydrophobicContact CG1-CG1 4.37Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.1Å; V151-I155 PolarHBondContact O-N 2.93Å; V151-A316 HydrophobicContact CG2-CB 3.84Å
152L86.1Confident80.3Confident77 Ų7752.6 Ų52.640%0.40331%0.31SS..Hα-helixtrans-58.4-43.9177179.161.1000109.9V148 Q154 I155 L156 L170V148-L152 WeakPolarHBondContact O-CA 2.99Å; V148-L152 WeakPolarHBondContact O-CB 3.44Å; V148-L152 PolarHBondContact O-N 3.29Å; L152-Q154 PolarHBondContact O-N 2.93Å; L152-I155 PolarHBondContact O-N 3.29Å; L152-L156 HydrophobicContact CD1-CD1 3.98Å; L152-L156 HydrophobicContact CD1-CD2 4.44Å; L152-L156 HydrophobicContact CD1-CG 3.93Å; L152-L156 HydrophobicContact CD2-CD1 4.44Å; L152-L156 HydrophobicContact CG-CD1 3.81Å; L152-L156 HydrophobicContact CG-CG 4.19Å; L152-L156 WeakPolarHBondContact O-CB 3.26Å; L152-L156 VanDerWaalsContact O-CG 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.43Å; L152-L156 PolarHBondContact O-N 2.84Å; L152-L170 HydrophobicContact CD2-CD2 4.48Å
153G80.3Confident80.2Confident0 Ų053.1 Ų53.10%032%0.316CS..Hα-helixtrans-61.3-43.4175.200000113.5G149 V151 I155 V157G149-G153 WeakPolarHBondContact O-CA 3.44Å; G149-G153 PolarHBondContact O-N 3.19Å; V151-G153 VanDerWaalsContact C-N 3.26Å; V151-G153 PolarHBondContact O-N 2.99Å; G153-I155 VanDerWaalsContact C-N 3.33Å; G153-I155 PolarHBondContact O-N 3.2Å; G153-V157 VanDerWaalsContact O-CB 3.24Å; G153-V157 WeakPolarHBondContact O-CB 3.33Å; G153-V157 WeakPolarHBondContact O-CG2 3.4Å; G153-V157 PolarHBondContact O-N 3.38Å
154Q79.1Confident80.1Confident21 Ų2151.9 Ų51.910%0.09831%0.31CS..Hα-helixtrans-64.4-38.6175.8-168.974.256.300111.5T19 S150 V151 L152 S158 I309T19-Q154 HydrophobicContact CG2-CB 3.53Å; T19-Q154 HydrophobicContact CG2-CG 3.99Å; S150-Q154 WeakPolarHBondContact O-CB 3.43Å; S150-Q154 PolarHBondContact O-N 3Å; V151-Q154 PolarHBondContact O-N 3.45Å; V151-Q154 VanDerWaalsContact O-N 3.13Å; L152-Q154 PolarHBondContact O-N 2.93Å; Q154-S158 PolarHBondContact NE2-OG 2.95Å; Q154-S158 WeakPolarHBondContact O-CA 2.85Å; Q154-S158 WeakPolarHBondContact O-CB 3.31Å; Q154-S158 PolarHBondContact O-N 3.38Å; Q154-S158 PolarHBondContact O-OG 3.43Å; Q154-I309 PolarHBondContact NE2-O 2.85Å
155I83.1Confident80Confident81 Ų8151.4 Ų51.442%0.41530%0.301SS..Hα-helixtrans-69.4-50.8178.6-67.8168.4000111.3V151 L152 G153 V157 S158 V159 V160V151-I155 HydrophobicContact CG1-CD1 3.67Å; V151-I155 HydrophobicContact CG1-CG1 4.37Å; V151-I155 VanDerWaalsContact O-CG1 3.3Å; V151-I155 WeakPolarHBondContact O-CG1 3.1Å; V151-I155 PolarHBondContact O-N 2.93Å; L152-I155 PolarHBondContact O-N 3.29Å; G153-I155 VanDerWaalsContact C-N 3.33Å; G153-I155 PolarHBondContact O-N 3.2Å; I155-V157 PolarHBondContact O-N 3.5Å; I155-S158 PolarHBondContact O-N 3.06Å; I155-V159 HydrophobicContact CG2-CB 4.3Å; I155-V159 HydrophobicContact CG2-CG2 4.3Å; I155-V159 WeakPolarHBondContact O-CA 3.34Å; I155-V159 WeakPolarHBondContact O-CB 3.25Å; I155-V159 PolarHBondContact O-N 3.35Å; I155-V160 PolarHBondContact O-N 2.83Å
156L85.9Confident80.1Confident20 Ų2051.5 Ų51.511%0.10530%0.295CS..Iπ-helixtrans-58.9-39.5-179.7-71.8175000111.1L152 V160 G161 W162 L167 L170L152-L156 HydrophobicContact CD1-CD1 3.98Å; L152-L156 HydrophobicContact CD1-CD2 4.44Å; L152-L156 HydrophobicContact CD1-CG 3.93Å; L152-L156 HydrophobicContact CD2-CD1 4.44Å; L152-L156 HydrophobicContact CG-CD1 3.81Å; L152-L156 HydrophobicContact CG-CG 4.19Å; L152-L156 WeakPolarHBondContact O-CB 3.26Å; L152-L156 VanDerWaalsContact O-CG 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.43Å; L152-L156 PolarHBondContact O-N 2.84Å; L156-V160 HydrophobicContact CD2-CG2 4.19Å; L156-V160 CarbonylContact O-C 3.59Å; L156-V160 WeakPolarHBondContact O-CB 3.33Å; L156-G161 PolarHBondContact O-N 2.9Å; L156-W162 HydrophobicContact CB-CB 4.38Å; L156-W162 HydrophobicContact CB-CD2 4.45Å; L156-W162 HydrophobicContact CB-CG 4.41Å; L156-W162 HydrophobicContact CD1-CE3 4.03Å; L156-W162 HydrophobicContact CD1-CZ3 4.14Å; L156-W162 HydrophobicContact CD2-CD2 4.12Å; L156-W162 HydrophobicContact CD2-CE3 4.31Å; L156-W162 HydrophobicContact CD2-CZ2 4.4Å; L156-W162 WeakPolarHBondContact O-CB 3.5Å; L156-W162 PolarHBondContact O-N 3.38Å; L156-L167 HydrophobicContact CB-CD2 3.61Å; L156-L167 HydrophobicContact CD1-CD2 3.59Å; L156-L167 HydrophobicContact CG-CD2 4.26Å; L156-L170 HydrophobicContact CD1-CD2 3.64Å
157V70.7Confident80.4Confident0 Ų046.7 Ų46.70%027%0.273CS..Iπ-helixtrans-66.8-66.3172.6174.50000109.6H17 Q18 G153 I155 G161 L167H17-V157 VanDerWaalsContact CA-CG1 3.41Å; H17-V157 HydrophobicContact CB-CG1 3.5Å; H17-V157 PolarHBondContact CE1-O 2.86Å; H17-V157 WeakPolarHBondContact ND1-CG1 3.29Å; H17-V157 PolarHBondContact ND1-O 3.37Å; Q18-V157 VanDerWaalsContact N-CG1 3.26Å; Q18-V157 WeakPolarHBondContact O-CG2 3.36Å; G153-V157 VanDerWaalsContact O-CB 3.24Å; G153-V157 WeakPolarHBondContact O-CB 3.33Å; G153-V157 WeakPolarHBondContact O-CG2 3.4Å; G153-V157 PolarHBondContact O-N 3.38Å; I155-V157 PolarHBondContact O-N 3.5Å; V157-G161 VanDerWaalsContact O-CA 3.23Å; V157-G161 WeakPolarHBondContact O-CA 3.15Å; V157-G161 PolarHBondContact O-N 3.19Å; V157-L167 HydrophobicContact CG2-CD1 3.2Å; V157-L167 HydrophobicContact CG2-CG 4.49Å
158S74.1Confident80.7Confident39 Ų3945.5 Ų45.527%0.27327%0.266SS..Iπ-helixtrans-72.5-36.4-163-47.10000114.3H17 Q154 I155H17-S158 WeakPolarHBondContact CE1-CA 3.5Å; H17-S158 PolarHBondContact CE1-O 3.34Å; H17-S158 VanDerWaalsContact CE1-O 3.25Å; H17-S158 WeakPolarHBondContact ND1-CA 3.48Å; H17-S158 PolarHBondContact NE2-O 3.48Å; Q154-S158 PolarHBondContact NE2-OG 2.95Å; Q154-S158 WeakPolarHBondContact O-CA 2.85Å; Q154-S158 WeakPolarHBondContact O-CB 3.31Å; Q154-S158 PolarHBondContact O-N 3.38Å; Q154-S158 PolarHBondContact O-OG 3.43Å; I155-S158 PolarHBondContact O-N 3.06Å
159V83.5Confident81Confident119 Ų11944.1 Ų44.172%0.72126%0.258SS*.Iπ-helixtrans-99.3-48.1-174.3-176.40000110.5I155I155-V159 HydrophobicContact CG2-CB 4.3Å; I155-V159 HydrophobicContact CG2-CG2 4.3Å; I155-V159 WeakPolarHBondContact O-CA 3.34Å; I155-V159 WeakPolarHBondContact O-CB 3.25Å; I155-V159 PolarHBondContact O-N 3.35Å
160V86.1Confident81.3Confident81 Ų8146.1 Ų46.149%0.49127%0.266SS..Iπ-helixtrans-84.2-25.4-175-165.70000111.9I155 L156 W162I155-V160 PolarHBondContact O-N 2.83Å; L156-V160 HydrophobicContact CD2-CG2 4.19Å; L156-V160 CarbonylContact O-C 3.59Å; L156-V160 WeakPolarHBondContact O-CB 3.33Å; V160-W162 VanDerWaalsContact CG1-CD1 3.41Å; V160-W162 HydrophobicContact CG1-CG 4.48Å
161G79.9Confident82Confident44 Ų4445.9 Ų45.945%0.45426%0.264SS..  trans77.925.8-179.500000113.7L156 V157L156-G161 PolarHBondContact O-N 2.9Å; V157-G161 VanDerWaalsContact O-CA 3.23Å; V157-G161 WeakPolarHBondContact O-CA 3.15Å; V157-G161 PolarHBondContact O-N 3.19Å
162W83.2Confident82.6Confident105 Ų10544.1 Ų44.140%0.39825%0.252SS..  trans-62.6141176.1-82.625.2000111.8L156 V160 L167 L170L156-W162 HydrophobicContact CB-CB 4.38Å; L156-W162 HydrophobicContact CB-CD2 4.45Å; L156-W162 HydrophobicContact CB-CG 4.41Å; L156-W162 HydrophobicContact CD1-CE3 4.03Å; L156-W162 HydrophobicContact CD1-CZ3 4.14Å; L156-W162 HydrophobicContact CD2-CD2 4.12Å; L156-W162 HydrophobicContact CD2-CE3 4.31Å; L156-W162 HydrophobicContact CD2-CZ2 4.4Å; L156-W162 WeakPolarHBondContact O-CB 3.5Å; L156-W162 PolarHBondContact O-N 3.38Å; V160-W162 VanDerWaalsContact CG1-CD1 3.41Å; V160-W162 HydrophobicContact CG1-CG 4.48Å; W162-L167 HydrophobicContact CB-CD2 4.29Å; W162-L167 HydrophobicContact CB-CG 4.36Å; W162-L167 HydrophobicContact CE3-CD2 3.84Å; W162-L167 HydrophobicContact CE3-CG 4.44Å; W162-L170 HydrophobicContact CZ3-CB 4.38Å; W162-L170 HydrophobicContact CZ3-CD2 4.18Å
163S78.3Confident83.1Confident61 Ų6144.1 Ų44.143%0.42726%0.255SS..  trans-69.6153.4172.265.10000110.9F165 S166 L167S163-F165 PolarHBondContact O-N 2.88Å; S163-S166 WeakPolarHBondContact O-CB 3.44Å; S163-S166 PolarHBondContact O-N 3.41Å; S163-S166 PolarHBondContact OG-N 3.33Å; S163-S166 PolarHBondContact OG-OG 2.83Å; S163-L167 WeakPolarHBondContact O-CG 3.46Å; S163-L167 PolarHBondContact O-N 3.06Å
164L72.2Confident83.7Confident16 Ų1647.6 Ų47.68%0.08428%0.279CS..Hα-helixtrans-54.2-36171.6-84.6176.6000112Q18 R24 C27 W28 S31 L167 N168Q18-L164 HydrophobicContact CB-CD1 4.39Å; Q18-L164 WeakPolarHBondContact O-CD2 3.38Å; R24-L164 VanDerWaalsContact NH2-CD2 3.26Å; C27-L164 HydrophobicContact CB-CD1 4.37Å; C27-L164 WeakPolarHBondContact O-CD1 3.18Å; W28-L164 VanDerWaalsContact CD1-CB 3.5Å; W28-L164 HydrophobicContact CG-CB 4.46Å; W28-L164 PolarHBondContact NE1-O 3.2Å; S31-L164 VanDerWaalsContact CB-CD1 3.41Å; L164-L167 HydrophobicContact CD2-CD1 4.45Å; L164-L167 PolarHBondContact O-N 3.43Å; L164-N168 PolarHBondContact O-N 3.16Å; L164-N168 VanDerWaalsContact O-N 3.13Å; L164-N168 PolarHBondContact O-ND2 2.94Å; L164-N168 VanDerWaalsContact O-ND2 3.09Å
165F80.3Confident84.3Confident81 Ų8147.6 Ų47.636%0.35528%0.28SS..Hα-helixtrans-57.2-52.9172.5-177.8-85.6000112.1W28 L93 S163 L167 N168 V169W28-F165 HydrophobicContact CH2-CD2 4.11Å; W28-F165 HydrophobicContact CZ2-CB 4.07Å; W28-F165 AromaticContact CZ2-CD2 3.73Å; W28-F165 HydrophobicContact CZ2-CD2 3.73Å; W28-F165 HydrophobicContact CZ2-CG 4.3Å; L93-F165 HydrophobicContact CB-CE2 4.36Å; L93-F165 HydrophobicContact CD2-CD2 3.77Å; L93-F165 HydrophobicContact CD2-CE2 3.74Å; L93-F165 HydrophobicContact CD2-CG 4.22Å; L93-F165 HydrophobicContact CD2-CZ 4.19Å; S163-F165 PolarHBondContact O-N 2.88Å; F165-L167 PolarHBondContact O-N 2.99Å; F165-L167 VanDerWaalsContact O-N 3.16Å; F165-N168 PolarHBondContact O-N 2.69Å; F165-V169 HydrophobicContact CD1-CG2 3.99Å; F165-V169 HydrophobicContact CE1-CG2 3.63Å; F165-V169 HydrophobicContact CZ-CG2 4.14Å; F165-V169 PolarHBondContact O-N 3.33Å
166S86.6Confident84.9Confident42 Ų4245.9 Ų45.929%0.29428%0.276SS..Hα-helixtrans-57.5-35.5-179.5-53.90000112.2S163 V169 L170S163-S166 WeakPolarHBondContact O-CB 3.44Å; S163-S166 PolarHBondContact O-N 3.41Å; S163-S166 PolarHBondContact OG-N 3.33Å; S163-S166 PolarHBondContact OG-OG 2.83Å; S166-V169 PolarHBondContact O-N 2.94Å; S166-L170 PolarHBondContact O-N 2.78Å
167L82.6Confident85.4Confident0 Ų049.1 Ų49.10%030%0.296CS..Hα-helixtrans-73.2-32.8178.6-63.6164.5000112.5L20 R24 L156 V157 W162 S163 L164 F165 L170 S171L20-L167 HydrophobicContact CD1-CB 3.76Å; L20-L167 HydrophobicContact CD1-CD1 3.98Å; L20-L167 HydrophobicContact CD1-CD2 3.35Å; L20-L167 HydrophobicContact CD1-CG 3.85Å; L20-L167 HydrophobicContact CD2-CB 4.26Å; L20-L167 HydrophobicContact CG-CB 4.1Å; R24-L167 VanDerWaalsContact NH1-C 3.27Å; R24-L167 PolarHBondContact NH1-O 3.44Å; L156-L167 HydrophobicContact CB-CD2 3.61Å; L156-L167 HydrophobicContact CD1-CD2 3.59Å; L156-L167 HydrophobicContact CG-CD2 4.26Å; V157-L167 HydrophobicContact CG2-CD1 3.2Å; V157-L167 HydrophobicContact CG2-CG 4.49Å; W162-L167 HydrophobicContact CB-CD2 4.29Å; W162-L167 HydrophobicContact CB-CG 4.36Å; W162-L167 HydrophobicContact CE3-CD2 3.84Å; W162-L167 HydrophobicContact CE3-CG 4.44Å; S163-L167 WeakPolarHBondContact O-CG 3.46Å; S163-L167 PolarHBondContact O-N 3.06Å; L164-L167 HydrophobicContact CD2-CD1 4.45Å; L164-L167 PolarHBondContact O-N 3.43Å; F165-L167 PolarHBondContact O-N 2.99Å; F165-L167 VanDerWaalsContact O-N 3.16Å; L167-L170 PolarHBondContact O-N 3.44Å; L167-S171 PolarHBondContact O-N 3.4Å; L167-S171 PolarHBondContact O-OG 3.34Å
168N83.5Confident86.4Confident1 Ų152 Ų521%0.00532%0.32CS..Hα-helixtrans-73.8-32.6173.6-84.1-88.4000111.6R24 W28 L92 L93 L164 F165 L170 S171 L172R24-N168 PolarHBondContact NH1-ND2 2.88Å; W28-N168 PolarHBondContact NE1-ND2 3.42Å; L92-N168 WeakPolarHBondContact CD1-OD1 3.27Å; L93-N168 HydrophobicContact CD2-CB 3.53Å; L93-N168 HydrophobicContact CG-CB 4.15Å; L164-N168 PolarHBondContact O-N 3.16Å; L164-N168 VanDerWaalsContact O-N 3.13Å; L164-N168 PolarHBondContact O-ND2 2.94Å; L164-N168 VanDerWaalsContact O-ND2 3.09Å; F165-N168 PolarHBondContact O-N 2.69Å; N168-L170 VanDerWaalsContact C-N 3.31Å; N168-S171 PolarHBondContact O-N 2.86Å; N168-L172 VanDerWaalsContact O-CB 3.23Å; N168-L172 WeakPolarHBondContact O-CB 3.39Å; N168-L172 PolarHBondContact O-N 3.47Å
169V90Very high87.4Confident55 Ų5552.6 Ų52.633%0.33332%0.318SS..Hα-helixtrans-60.7-42.9168.8175.80000110.7L93 F165 S166 L172 T173L93-V169 HydrophobicContact CD1-CG2 3.99Å; L93-V169 HydrophobicContact CD2-CG2 3.89Å; F165-V169 HydrophobicContact CD1-CG2 3.99Å; F165-V169 HydrophobicContact CE1-CG2 3.63Å; F165-V169 HydrophobicContact CZ-CG2 4.14Å; F165-V169 PolarHBondContact O-N 3.33Å; S166-V169 PolarHBondContact O-N 2.94Å; V169-L172 PolarHBondContact O-N 3.34Å; V169-T173 PolarHBondContact O-N 2.79Å; V169-T173 PolarHBondContact O-OG1 2.8Å
170L90.3Very high88Confident53 Ų5349.3 Ų49.328%0.27730%0.303SS..Hα-helixtrans-62.3-51175.3-178.662.5000111.8L152 L156 W162 S166 L167 N168 L172 T173 C174L152-L170 HydrophobicContact CD2-CD2 4.48Å; L156-L170 HydrophobicContact CD1-CD2 3.64Å; W162-L170 HydrophobicContact CZ3-CB 4.38Å; W162-L170 HydrophobicContact CZ3-CD2 4.18Å; S166-L170 PolarHBondContact O-N 2.78Å; L167-L170 PolarHBondContact O-N 3.44Å; N168-L170 VanDerWaalsContact C-N 3.31Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.22Å; L170-T173 WeakPolarHBondContact O-CB 3.45Å; L170-T173 PolarHBondContact O-N 2.96Å; L170-T173 VanDerWaalsContact O-N 3.14Å; L170-C174 PolarHBondContact O-N 2.63Å; L170-C174 PolarHBondContact O-SG 2.64Å; L170-C174 VanDerWaalsContact O-SG 3.39Å
171S88.1Confident88.4Confident3 Ų349.8 Ų49.82%0.02131%0.306CS..Hα-helixtrans-61.2-37.9177.8-58.20000111.8L20 E21 L167 N168 T173 C174 V175L20-S171 WeakPolarHBondContact CD2-OG 3.38Å; E21-S171 PolarHBondContact OE1-OG 3.43Å; L167-S171 PolarHBondContact O-N 3.4Å; L167-S171 PolarHBondContact O-OG 3.34Å; N168-S171 PolarHBondContact O-N 2.86Å; S171-T173 VanDerWaalsContact C-N 3.32Å; S171-T173 PolarHBondContact O-N 3.35Å; S171-C174 PolarHBondContact O-N 3.32Å; S171-V175 VanDerWaalsContact O-CG2 3.32Å; S171-V175 WeakPolarHBondContact O-CG2 3.47Å; S171-V175 PolarHBondContact O-N 3.46Å
172L91.6Very high88.9Confident28 Ų2848.2 Ų48.215%0.14729%0.289CS..Hα-helixtrans-61.7-44176176.360.4000110.3I86 W89 L93 N168 V169 L170 C174 V175 S176I86-L172 HydrophobicContact CB-CD1 4.46Å; I86-L172 HydrophobicContact CG2-CD1 4.08Å; W89-L172 HydrophobicContact CB-CB 4.1Å; W89-L172 HydrophobicContact CB-CD1 3.94Å; L93-L172 HydrophobicContact CD1-CD2 3.73Å; N168-L172 VanDerWaalsContact O-CB 3.23Å; N168-L172 WeakPolarHBondContact O-CB 3.39Å; N168-L172 PolarHBondContact O-N 3.47Å; V169-L172 PolarHBondContact O-N 3.34Å; L170-L172 VanDerWaalsContact C-N 3.29Å; L170-L172 PolarHBondContact O-N 3.22Å; L172-C174 PolarHBondContact O-N 3.32Å; L172-V175 PolarHBondContact O-N 3.4Å; L172-S176 WeakPolarHBondContact O-CB 3.18Å; L172-S176 PolarHBondContact O-N 2.87Å; L172-S176 PolarHBondContact O-OG 3.5Å
173T95.1Very high89.4Confident76 Ų7650.8 Ų50.847%0.46630%0.299SS..Hα-helixtrans-59.4-47.4175.7-54.10000111.1V169 L170 S171 V175 S176 V177V169-T173 PolarHBondContact O-N 2.79Å; V169-T173 PolarHBondContact O-OG1 2.8Å; L170-T173 WeakPolarHBondContact O-CB 3.45Å; L170-T173 PolarHBondContact O-N 2.96Å; L170-T173 VanDerWaalsContact O-N 3.14Å; S171-T173 VanDerWaalsContact C-N 3.32Å; S171-T173 PolarHBondContact O-N 3.35Å; T173-V175 PolarHBondContact O-N 3.36Å; T173-S176 PolarHBondContact O-N 3.3Å; T173-V177 WeakPolarHBondContact O-CG2 3.23Å; T173-V177 PolarHBondContact O-N 3.04Å
174C92.7Very high90Very high74 Ų7456.5 Ų56.550%0.532%0.316SS..Hα-helixtrans-59.9-45.5177.6-67.20000112.3L170 S171 L172 V177 A178L170-C174 PolarHBondContact O-N 2.63Å; L170-C174 PolarHBondContact O-SG 2.64Å; L170-C174 VanDerWaalsContact O-SG 3.39Å; S171-C174 PolarHBondContact O-N 3.32Å; L172-C174 PolarHBondContact O-N 3.32Å; C174-V177 PolarHBondContact O-N 3.44Å; C174-A178 PolarHBondContact O-N 2.95Å
175V91.9Very high90.8Very high20 Ų2057.8 Ų57.812%0.12132%0.323CS..Hα-helixtrans-66-39.5177.9173.20000111.2L85 I86 S171 L172 T173 A178 F179L85-V175 HydrophobicContact CB-CG1 3.42Å; L85-V175 VanDerWaalsContact CB-CG1 3.42Å; L85-V175 HydrophobicContact CB-CG2 4.41Å; L85-V175 HydrophobicContact CD1-CG1 4.32Å; I86-V175 HydrophobicContact CG1-CG1 3.81Å; S171-V175 VanDerWaalsContact O-CG2 3.32Å; S171-V175 WeakPolarHBondContact O-CG2 3.47Å; S171-V175 PolarHBondContact O-N 3.46Å; L172-V175 PolarHBondContact O-N 3.4Å; T173-V175 PolarHBondContact O-N 3.36Å; V175-A178 PolarHBondContact O-N 3.13Å; V175-F179 WeakPolarHBondContact O-CB 3.35Å; V175-F179 PolarHBondContact O-N 2.96Å
176S96Very high91Very high46 Ų4657.9 Ų57.932%0.32233%0.331SS..Hα-helixtrans-63.2-40.2175.3-63.60000112.3L172 T173 F179 A180L172-S176 WeakPolarHBondContact O-CB 3.18Å; L172-S176 PolarHBondContact O-N 2.87Å; L172-S176 PolarHBondContact O-OG 3.5Å; T173-S176 PolarHBondContact O-N 3.3Å; S176-F179 PolarHBondContact O-N 3.35Å; S176-A180 PolarHBondContact O-N 3.33Å
177V96.1Very high90.7Very high88 Ų8859.9 Ų59.953%0.53334%0.337SS..Hα-helixtrans-64.5-45.2173.5173.10000110.6T173 C174 F179 A180 V181T173-V177 WeakPolarHBondContact O-CG2 3.23Å; T173-V177 PolarHBondContact O-N 3.04Å; C174-V177 PolarHBondContact O-N 3.44Å; V177-F179 VanDerWaalsContact C-N 3.33Å; V177-F179 PolarHBondContact O-N 3.12Å; V177-A180 PolarHBondContact O-N 3Å; V177-V181 WeakPolarHBondContact O-CG2 3.38Å; V177-V181 PolarHBondContact O-N 3.09Å
178A92.5Very high90.2Very high60 Ų6060.1 Ų60.150%0.49634%0.339SS..Hα-helixtrans-61.1-4117700000112.3C174 V175 V181 A182C174-A178 PolarHBondContact O-N 2.95Å; V175-A178 PolarHBondContact O-N 3.13Å; A178-V181 PolarHBondContact O-N 3.28Å; A178-A182 PolarHBondContact O-N 2.77Å
179F95Very high89.2Confident51 Ų5168.5 Ų68.522%0.22438%0.378CS..Hα-helixtrans-62.6-41.4174.3177.4-105.1000112.1L79 L83 I86 V175 S176 V177 A182 W183L79-F179 HydrophobicContact CB-CE2 4.3Å; L79-F179 HydrophobicContact CD2-CE2 4.19Å; L79-F179 VanDerWaalsContact O-CE2 3.29Å; L79-F179 WeakPolarHBondContact O-CE2 3.34Å; L83-F179 HydrophobicContact CB-CE2 4.03Å; L83-F179 HydrophobicContact CB-CZ 4.48Å; I86-F179 HydrophobicContact CD1-CB 3.85Å; I86-F179 HydrophobicContact CD1-CD1 3.82Å; I86-F179 HydrophobicContact CD1-CG 3.83Å; V175-F179 WeakPolarHBondContact O-CB 3.35Å; V175-F179 PolarHBondContact O-N 2.96Å; S176-F179 PolarHBondContact O-N 3.35Å; V177-F179 VanDerWaalsContact C-N 3.33Å; V177-F179 PolarHBondContact O-N 3.12Å; F179-A182 WeakPolarHBondContact O-CB 3.31Å; F179-A182 PolarHBondContact O-N 3.41Å; F179-W183 AromaticContact CE1-NE1 3.97Å; F179-W183 AromaticContact CZ-NE1 3.75Å
180A96.1Very high87.7Confident51 Ų5173.5 Ų73.542%0.42140%0.395SS..Hα-helixtrans-64.5-39.8174.700000112.2S176 V177 A182 W183 F184S176-A180 PolarHBondContact O-N 3.33Å; V177-A180 PolarHBondContact O-N 3Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-W183 WeakPolarHBondContact O-CB 3.34Å; A180-W183 PolarHBondContact O-N 3.03Å; A180-F184 WeakPolarHBondContact O-CD2 3.29Å
181V94.2Very high86.3Confident90 Ų9071.1 Ų71.155%0.54538%0.383SS..Hα-helixtrans-64.8-38.7174.71730000111.3V177 A178 W183 F184V177-V181 WeakPolarHBondContact O-CG2 3.38Å; V177-V181 PolarHBondContact O-N 3.09Å; A178-V181 PolarHBondContact O-N 3.28Å; V181-W183 PolarHBondContact O-N 3.02Å; V181-W183 VanDerWaalsContact O-N 3.15Å; V181-F184 PolarHBondContact O-N 3.38Å
182A91.7Very high84.8Confident12 Ų1274.5 Ų74.510%0.09940%0.401CS..Hα-helixtrans-60.3-25.3-18000000113.6I78 L79 A178 F179 A180 F184 L185I78-A182 HydrophobicContact CG2-CB 4.23Å; L79-A182 HydrophobicContact CD2-CB 3.93Å; A178-A182 PolarHBondContact O-N 2.77Å; F179-A182 WeakPolarHBondContact O-CB 3.31Å; F179-A182 PolarHBondContact O-N 3.41Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A182-F184 VanDerWaalsContact C-N 3.25Å; A182-F184 PolarHBondContact O-N 3.44Å; A182-L185 HydrophobicContact CB-CD1 4.23Å; A182-L185 WeakPolarHBondContact O-CB 3.47Å; A182-L185 WeakPolarHBondContact O-CG 3.43Å; A182-L185 PolarHBondContact O-N 2.85Å
183W91.8Very high83Confident159 Ų15977.1 Ų77.160%0.60241%0.411SS*.THydrogen-bonded Turntrans-63.2-30.6173.7-92.168.8000113.5K75 L79 F179 A180 V181 L185K75-W183 WeakPolarHBondContact CE-O 3.45Å; K75-W183 PolarHBondContact NZ-O 3.49Å; L79-W183 VanDerWaalsContact CD2-CD1 3.43Å; L79-W183 HydrophobicContact CD2-CG 4.19Å; F179-W183 AromaticContact CE1-NE1 3.97Å; F179-W183 AromaticContact CZ-NE1 3.75Å; A180-W183 WeakPolarHBondContact O-CB 3.34Å; A180-W183 PolarHBondContact O-N 3.03Å; V181-W183 PolarHBondContact O-N 3.02Å; V181-W183 VanDerWaalsContact O-N 3.15Å; W183-L185 VanDerWaalsContact C-N 3.29Å; W183-L185 PolarHBondContact O-N 2.94Å
184F92.2Very high81Confident181 Ų18177.9 Ų77.979%0.79441%0.408SS*.THydrogen-bonded Turntrans-84.2-1.1-179.9-62.5-81.2000113.4A180 V181 A182A180-F184 WeakPolarHBondContact O-CD2 3.29Å; V181-F184 PolarHBondContact O-N 3.38Å; A182-F184 VanDerWaalsContact C-N 3.25Å; A182-F184 PolarHBondContact O-N 3.44Å
185L88Confident78.8Confident42 Ų4278.2 Ų78.222%0.2240%0.402CS..SBendtrans-64.6135175.7-71174.3000111.2K75 I78 Y121 A182 W183K75-L185 WeakPolarHBondContact CE-O 3.33Å; K75-L185 PolarHBondContact NZ-O 3.49Å; I78-L185 HydrophobicContact CD1-CD1 4.34Å; I78-L185 HydrophobicContact CG2-CD1 4.13Å; Y121-L185 HydrophobicContact CE1-CD1 4.29Å; Y121-L185 HydrophobicContact CE1-CD2 4.14Å; A182-L185 HydrophobicContact CB-CD1 4.23Å; A182-L185 WeakPolarHBondContact O-CB 3.47Å; A182-L185 WeakPolarHBondContact O-CG 3.43Å; A182-L185 PolarHBondContact O-N 2.85Å; W183-L185 VanDerWaalsContact C-N 3.29Å; W183-L185 PolarHBondContact O-N 2.94Å
186P85.9Confident76.6Confident83 Ų8383.8 Ų83.854%0.53943%0.426SS..PPolyproline II helixtrans-65.4144.4177.324.7-32.4000111.3Y121Y121-P186 VanDerWaalsContact CE2-O 3.27Å; Y121-P186 WeakPolarHBondContact CE2-O 3.42Å; Y121-P186 WeakPolarHBondContact OH-CD 3.35Å; Y121-P186 VanDerWaalsContact OH-CG 3.29Å; Y121-P186 WeakPolarHBondContact OH-CG 3.42Å; Y121-P186 PolarHBondContact OH-O 3.16Å
187M79.5Confident73.6Confident84 Ų8487.9 Ų87.941%0.41444%0.443SS..PPolyproline II helixtrans-76.4124.6174.1-160.373-155.400109L72 R73 K75 Q189L72-M187 WeakPolarHBondContact O-CE 3.24Å; R73-M187 HydrophobicContact CB-CE 3.23Å; R73-M187 HydrophobicContact CG-CE 4.35Å; R73-M187 WeakPolarHBondContact O-CE 3.31Å; K75-M187 HydrophobicContact CB-CE 4.01Å; K75-M187 HydrophobicContact CB-SD 3.59Å; K75-M187 VanDerWaalsContact CB-SD 3.59Å; K75-M187 HydrophobicContact CD-SD 3.77Å; K75-M187 HydrophobicContact CG-SD 4.25Å; M187-Q189 PolarHBondContact O-N 3.05Å
188P71Confident70.8Confident5 Ų588.2 Ų88.23%0.03245%0.447CS..PPolyproline II helixtrans-69134.4178.826.3-25.7000109.6R73 Y74 Y121 T124 V125R73-P188 HydrophobicContact CB-CG 4.36Å; R73-P188 WeakPolarHBondContact O-CD 3.43Å; R73-P188 VanDerWaalsContact O-CG 3.29Å; R73-P188 WeakPolarHBondContact O-CG 3.37Å; Y74-P188 HydrophobicContact CD2-CB 4.5Å; Y74-P188 HydrophobicContact CD2-CG 3.61Å; Y74-P188 HydrophobicContact CE2-CG 4.36Å; Y121-P188 HydrophobicContact CD2-CG 4.06Å; Y121-P188 HydrophobicContact CE2-CG 4.12Å; T124-P188 WeakPolarHBondContact OG1-CB 3.3Å; V125-P188 HydrophobicContact CG1-CB 3.95Å
189Q62.9Low67.9Low178 Ų17890.6 Ų90.683%0.83246%0.46SS*.SBendtrans-79.5-23.8-178.5-67.6-177.3-13.800112.7M187M187-Q189 PolarHBondContact O-N 3.05Å
190K59.5Low64.8Low160 Ų16093.4 Ų93.470%0.69649%0.486SS*.  trans-113134.3-177.1-62.3177-178.21750109.9
191S60.6Low61.6Low3 Ų396.9 Ų96.92%0.02151%0.506CS..  trans-96.8141.1164.282.50000109.8F193 F194 H195S191-F193 PolarHBondContact O-N 3.19Å; S191-F194 PolarHBondContact OG-N 3.29Å; S191-H195 PolarHBondContact OG-N 3.03Å; S191-H195 PolarHBondContact OG-ND1 3.34Å
192L56.6Low58.4Low74 Ų74101.8 Ų101.839%0.38752%0.522SS..THydrogen-bonded Turntrans-64.5-36.9-174.2-80.4165.3000113.3Y74 T124Y74-L192 PolarHBondContact OH-N 3.34Å; T124-L192 HydrophobicContact CG2-CD1 3.77Å; T124-L192 HydrophobicContact CG2-CG 3.78Å
193F54.2Low55.4Low83 Ų83104.8 Ų104.836%0.36456%0.555SS.*THydrogen-bonded Turntrans-109.5-25.6-170.1-71.6-83.7000115.4D70 S191D70-F193 WeakPolarHBondContact OD2-CD2 3.47Å; S191-F193 PolarHBondContact O-N 3.19Å
194F52.2Low52.4Low92 Ų92104.1 Ų104.140%0.40457%0.568SS.*THydrogen-bonded Turntrans-104.7-17.6-171.5-67.8-78.7000114.3L67 D70 S191 P251L67-F194 HydrophobicContact CD1-CZ 4.43Å; D70-F194 HydrophobicContact CB-CD2 4.01Å; D70-F194 HydrophobicContact CB-CE2 4.06Å; S191-F194 PolarHBondContact OG-N 3.29Å; F194-P251 HydrophobicContact CD1-CG 4.5Å
195H46.8Very low49.3Very low81 Ų81103.6 Ų103.638%0.37557%0.573SS.*SBendtrans-117.716.5-178.4-64.884.6000114.6S191 I197 E248S191-H195 PolarHBondContact OG-N 3.03Å; S191-H195 PolarHBondContact OG-ND1 3.34Å; H195-I197 PolarHBondContact O-N 2.99Å; H195-I197 VanDerWaalsContact O-N 3.07Å; H195-E248 IonicContact CD2-OE1 2.64Å
196H45.9Very low46.5Very low136 Ų136104.9 Ų104.963%0.6360%0.597SS**  trans-81.788.3173.6-125.3-66.3000110.5P198H196-P198 WeakPolarHBondContact O-CD 3.46Å
197I33.9Very low43.9Very low133 Ų133108.7 Ų108.768%0.68261%0.612SS**  trans-66.9123.3155.7-59.1169.3000105.7H195 S199H195-I197 PolarHBondContact O-N 2.99Å; H195-I197 VanDerWaalsContact O-N 3.07Å; I197-S199 PolarHBondContact O-N 3.14Å; I197-S199 VanDerWaalsContact O-N 3.11Å
198P36.1Very low41.5Very low94 Ų94113.9 Ų113.961%0.6163%0.632SS**  trans-62.5118.6169.724-28.8000107.6H196 S200H196-P198 WeakPolarHBondContact O-CD 3.46Å; P198-S200 PolarHBondContact O-N 3.01Å
199S31Very low39.6Very low111 Ų111119.7 Ų119.778%0.77667%0.667SS**  trans-67.631.817341.20000113.3I197 C201I197-S199 PolarHBondContact O-N 3.14Å; I197-S199 VanDerWaalsContact O-N 3.11Å; S199-C201 PolarHBondContact O-N 3.49Å
200S30.7Very low38.2Very low109 Ų109119.4 Ų119.476%0.76267%0.666SS**THydrogen-bonded Turntrans-87.757.4169.3-57.80000110.2P198P198-S200 PolarHBondContact O-N 3.01Å
201C28.4Very low36.9Very low124 Ų124119.5 Ų119.584%0.83867%0.674SS**THydrogen-bonded Turntrans-146.523.9164.4-115.60000112.9S199S199-C201 PolarHBondContact O-N 3.49Å
202H27.7Very low35.5Very low193 Ų193123 Ų12389%0.89471%0.71SS**SBendtrans-114.5112.2164.8-87.1-9.6000109.4
203G27.7Very low34.3Very low75 Ų75122.7 Ų122.777%0.77373%0.726SS**SBendtrans115.738.1161.400000118.5
204V30.3Very low33.3Very low145 Ų145126.1 Ų126.188%0.87975%0.746SS**  trans-128.353.9155.3-167.10000109.8
205N27.2Very low32.4Very low170 Ų170127.1 Ų127.191%0.90976%0.76SS**  trans-118.790.8157.1-85.9-14.9000106.2
206G28.7Very low31.8Very low69 Ų69128.8 Ų128.871%0.71178%0.776SS**  trans154.557.8175.600000114.7
207L30.5Very low31.2Very low164 Ų164128.9 Ų128.986%0.85978%0.781SS**  trans-161.372.1151.7-100.4151.1000107V209L207-V209 PolarHBondContact O-N 3.36Å; L207-V209 VanDerWaalsContact O-N 3.07Å
208K30.5Very low31.3Very low192 Ų192128.9 Ų128.984%0.83579%0.787SS**  trans-62.1106.7154.2-91-176175.4176.50105.8Q210K208-Q210 PolarHBondContact O-N 3.23Å
209V29.6Very low31.2Very low128 Ų128130 Ų13078%0.77680%0.795SS**  trans-58.596.6157.2172.50000106.2L207L207-V209 PolarHBondContact O-N 3.36Å; L207-V209 VanDerWaalsContact O-N 3.07Å
210Q33.5Very low31.3Very low171 Ų171129.5 Ų129.580%0.79980%0.797SS**  trans-113.5106.3162.3-132.5-177.943.500106.5K208 G212K208-Q210 PolarHBondContact O-N 3.23Å; Q210-G212 PolarHBondContact O-N 2.91Å
211N32Very low31.2Very low162 Ų162128.9 Ų128.987%0.86679%0.793SS**  trans-55.1127.9164.4-83.9-25.4000109.5
212G32.7Very low31.4Very low76 Ų76130.3 Ų130.378%0.78479%0.792SS**  trans144.7112156.100000115.8Q210Q210-G212 PolarHBondContact O-N 2.91Å
213G31.3Very low31.7Very low69 Ų69129.6 Ų129.671%0.71179%0.789SS**  trans87.694.615300000115.6
214I32.8Very low31.7Very low155 Ų155133.4 Ų133.480%0.79579%0.79SS**  7894.283.6-67173.6000113.5
215T32.4Very low31.6Very low113 Ų113131.7 Ų131.769%0.69378%0.783SS**  77.9145.1128.363.90000123.7
216T34.6Very low31.6Very low116 Ų116125.7 Ų125.771%0.71276%0.761SS**  trans80.2137.9155.463.10000117.2
217D34.4Very low31.6Very low137 Ų137134.4 Ų134.473%0.73377%0.772SS**  cis-174.8144.6-14.3-104.2-26.3000107.6
218T34.7Very low31.8Very low134 Ų134135.5 Ų135.582%0.82277%0.773SS**  trans64.4157.1151.424.50000123.6
219P34.5Very low32Very low118 Ų118132.2 Ų132.277%0.76677%0.765SS**  trans-125.3164.8-133.928.6-3.6000114.6
220A33Very low32.3Very low99 Ų99133.8 Ų133.882%0.81877%0.767SS**  trans-158.6142165.600000112.9
221S27.8Very low32.4Very low96 Ų96135.3 Ų135.367%0.67177%0.774SS**  trans-47152.3172.760.30000115.5
222N33.7Very low32.5Very low155 Ų155132 Ų13283%0.82976%0.763SS**  trans-171.7109.1144.9-81.5-30.7000107.6
223H32.9Very low32.5Very low178 Ų178137.3 Ų137.382%0.82477%0.765SS**  49116.994.2-91.7-81.1000116.5
224L28.2Very low32.7Very low154 Ų154142.1 Ų142.181%0.80677%0.773SS**  trans-15.1153.5162.9-81116.7000119.8
225P29.1Very low32.7Very low110 Ų110140.5 Ų140.571%0.71477%0.772SS**  -143.1149.283.126.8-4.1000114.1
226G26.3Very low32.6Very low44 Ų44143 Ų14345%0.45478%0.781SS.*  79.396.773.400000110.4E228G226-E228 PolarHBondContact O-N 2.94Å
227W28.2Very low32.7Very low252 Ų252144.6 Ų144.696%0.95579%0.785SS**THydrogen-bonded Turntrans-79.220.4-169.7-38.6-38.7000114.5
228E35Very low32.8Very low187 Ų187145 Ų14587%0.87479%0.786SS**THydrogen-bonded Turntrans-102.30.8-171.6-65.3-175.6151.500113.8G226G226-E228 PolarHBondContact O-N 2.94Å
229D34.4Very low32.9Very low123 Ų123145.7 Ų145.766%0.65879%0.785SS**SBendtrans-104.32.1-174-78.5-35.5000116.1
230I36.6Very low33Very low160 Ų160149 Ų14982%0.82179%0.79SS**SBendtrans-93.5-12.9-171.7-63.4176.9000113.6
231E36.3Very low33.3Very low203 Ų203149.1 Ų149.195%0.94978%0.782SS**SBendtrans-90.85.3-177.1-79-173.715100115.7
232S32.9Very low33.8Very low92 Ų92150.8 Ų150.864%0.64379%0.791SS**SBendtrans-109.311.4-169.266.60000117.5
233K32.7Very low34.3Very low189 Ų189149.6 Ų149.682%0.82279%0.789SS**  trans-143.880.4-179.9-76.1-176.5177.8173.50115
234I36.3Very low34.7Very low170 Ų170149.9 Ų149.987%0.87279%0.791SS**  trans-139.4114.3147.4-54-179.9000108.3
235P33.3Very low35.3Very low120 Ų120151.2 Ų151.278%0.77979%0.793SS**  trans-80.2141.2-173.631.7-32000112.6
236L30.2Very low36Very low167 Ų167151.6 Ų151.687%0.87480%0.795SS**  trans-69.8119.1167.6-77.6140.6000111
237N35.4Very low36.7Very low148 Ų148158.7 Ų158.779%0.79182%0.817SS**  trans-168.2107.4152.8-89.5-40.3000107
238L37.3Very low37.4Very low145 Ų145152.9 Ų152.976%0.75980%0.8SS**  65.5114.291-96.3136000114.3
239D35.9Very low38.1Very low150 Ų150149.7 Ų149.780%0.80280%0.795SS**  trans79.382160.7-55.9-33.9000119.7
240E37.1Very low38.7Very low188 Ų188153.1 Ų153.188%0.87980%0.804SS**  trans-132.8141.8149.3-100.7-175.7144.200110.9
241P39.7Very low39.7Very low101 Ų101148.7 Ų148.766%0.65679%0.786SS**  trans-72.2163.4-171.832.4-34.3000111.9V243P241-V243 PolarHBondContact O-N 3.37Å
242P38.8Very low41.1Very low131 Ų131143.9 Ų143.985%0.85177%0.767SS**  trans-65.9111-16826.8-32.7000110.8E244P242-E244 PolarHBondContact O-N 3.24Å
243V43Very low42.8Very low130 Ų130148.9 Ų148.979%0.78877%0.771SS**  trans-71119.7164.9177.70000106.8P241 E245P241-V243 PolarHBondContact O-N 3.37Å; V243-E245 PolarHBondContact O-N 3.43Å
244E42.8Very low44.9Very low183 Ų183146.5 Ų146.586%0.85577%0.767SS**  trans-51.5112.2168.3-73.8175.9151.600108.9P242P242-E244 PolarHBondContact O-N 3.24Å
245E40.9Very low46.8Very low183 Ų183147.1 Ų147.186%0.85576%0.758SS**PPolyproline II helixtrans-60.6126.8170.9-76.1-173.5160.600108.5V243 E247V243-E245 PolarHBondContact O-N 3.43Å; E245-E247 PolarHBondContact O-N 2.96Å
246P43.7Very low48.6Very low117 Ų117144.7 Ų144.776%0.7674%0.741SS**PPolyproline II helixtrans-60130.8174-14.726.6000109.3E248P246-E248 PolarHBondContact O-N 3.3Å
247E40.2Very low50.8Low194 Ų194143.6 Ų143.691%0.90773%0.73SS**PPolyproline II helixtrans-49.8117170.4-81.9-171.9142.300109.9E245E245-E247 PolarHBondContact O-N 2.96Å
248E42.6Very low52.9Low130 Ų130143.4 Ų143.461%0.60772%0.722SS**PPolyproline II helixtrans-55.2128.2175.2-75-172155.100110H195 P246 K250H195-E248 IonicContact CD2-OE1 2.64Å; P246-E248 PolarHBondContact O-N 3.3Å; E248-K250 PolarHBondContact O-N 3.41Å
249P49.1Very low54.8Low119 Ų119140.1 Ų140.177%0.77371%0.708SS**  trans-63.8114.7173.124.8-29.7000108.1P251P249-P251 VanDerWaalsContact O-N 3.09Å
250K48.3Very low56.8Low196 Ų196135.9 Ų135.985%0.85269%0.685SS**  trans-44.6120.9176.1-77.5175.7-179.5166.70108.8E248 D252E248-K250 PolarHBondContact O-N 3.41Å; K250-D252 PolarHBondContact O-N 3.4Å; K250-D252 VanDerWaalsContact O-N 3.12Å
251P56.3Low58.9Low66 Ų66134.2 Ų134.243%0.42967%0.671SS.*  trans-56.9125.6179.320.7-30.6000108.1F194 P249 R253F194-P251 HydrophobicContact CD1-CG 4.5Å; P249-P251 VanDerWaalsContact O-N 3.09Å; P251-R253 VanDerWaalsContact C-N 3.34Å; P251-R253 PolarHBondContact O-N 3.02Å
252D65.7Low61Low102 Ų102133.5 Ų133.555%0.54566%0.661SS.*  trans-59.999.5177.9179.65.8000108K250 L254 R255 V256K250-D252 PolarHBondContact O-N 3.4Å; K250-D252 VanDerWaalsContact O-N 3.12Å; D252-L254 PolarHBondContact O-N 2.88Å; D252-L254 VanDerWaalsContact O-N 3.09Å; D252-L254 WeakPolarHBondContact OD1-CB 3.49Å; D252-L254 PolarHBondContact OD1-N 3.45Å; D252-R255 HydrophobicContact CB-CB 3.95Å; D252-R255 WeakPolarHBondContact O-CA 3.33Å; D252-R255 VanDerWaalsContact O-CB 3.28Å; D252-R255 WeakPolarHBondContact O-CB 3.49Å; D252-R255 PolarHBondContact O-N 3.47Å; D252-V256 PolarHBondContact O-N 2.98Å; D252-V256 VanDerWaalsContact O-N 3.13Å
253R69.9Low62.9Low197 Ų197128.6 Ų128.674%0.74363%0.628SS**Hα-helixtrans-52-36.9-176.8-72.3-177.4171.8180-3110.5P251 R255 V256 F257P251-R253 VanDerWaalsContact C-N 3.34Å; P251-R253 PolarHBondContact O-N 3.02Å; R253-R255 VanDerWaalsContact C-N 3.32Å; R253-R255 PolarHBondContact O-N 3.46Å; R253-V256 PolarHBondContact O-N 2.93Å; R253-F257 WeakPolarHBondContact O-CD2 3.46Å; R253-F257 PolarHBondContact O-N 2.92Å
254L76.9Confident64.8Low139 Ų139125.2 Ų125.273%0.72860%0.602SS**Hα-helixtrans-63.4-40179-130.593.4000111.5D252 K258D252-L254 PolarHBondContact O-N 2.88Å; D252-L254 VanDerWaalsContact O-N 3.09Å; D252-L254 WeakPolarHBondContact OD1-CB 3.49Å; D252-L254 PolarHBondContact OD1-N 3.45Å; L254-K258 VanDerWaalsContact O-CB 3.28Å; L254-K258 WeakPolarHBondContact O-CB 3.29Å; L254-K258 PolarHBondContact O-N 3.2Å
255R75.3Confident66.8Low183 Ų183120.2 Ų120.269%0.69158%0.581SS**Hα-helixtrans-65-44.3176.5-162.6178.8-156.7-175.16.3111.2D252 R253 K258 V259D252-R255 HydrophobicContact CB-CB 3.95Å; D252-R255 WeakPolarHBondContact O-CA 3.33Å; D252-R255 VanDerWaalsContact O-CB 3.28Å; D252-R255 WeakPolarHBondContact O-CB 3.49Å; D252-R255 PolarHBondContact O-N 3.47Å; R253-R255 VanDerWaalsContact C-N 3.32Å; R253-R255 PolarHBondContact O-N 3.46Å; R255-K258 PolarHBondContact O-N 3.04Å; R255-V259 VanDerWaalsContact O-CG2 3.31Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.38Å
256V71.3Confident68.8Low70 Ų70117.1 Ų117.142%0.42457%0.568SS.*Hα-helixtrans-61.8-48.7177.2-178.70000110.7D252 R253 K258 V259 L260D252-V256 PolarHBondContact O-N 2.98Å; D252-V256 VanDerWaalsContact O-N 3.13Å; R253-V256 PolarHBondContact O-N 2.93Å; V256-K258 VanDerWaalsContact C-N 3.32Å; V256-K258 PolarHBondContact O-N 2.97Å; V256-V259 PolarHBondContact O-N 3.31Å; V256-L260 WeakPolarHBondContact O-CB 3.36Å; V256-L260 PolarHBondContact O-N 2.93Å
257F76.4Confident70.6Confident144 Ų144111.7 Ų111.763%0.63253%0.533SS*.Hα-helixtrans-59.5-41.1175.9-85-68.8000112.4R253 L260 W261R253-F257 WeakPolarHBondContact O-CD2 3.46Å; R253-F257 PolarHBondContact O-N 2.92Å; F257-L260 PolarHBondContact O-N 3.3Å; F257-W261 VanDerWaalsContact O-CB 3.26Å; F257-W261 WeakPolarHBondContact O-CB 3.45Å; F257-W261 PolarHBondContact O-N 3.38Å
258K79.5Confident72.7Confident143 Ų143104 Ų10462%0.62250%0.496SS*.Hα-helixtrans-66.3-40.9178.6-171.6175.9-178177.60112.3L254 R255 V256 W261 N262L254-K258 VanDerWaalsContact O-CB 3.28Å; L254-K258 WeakPolarHBondContact O-CB 3.29Å; L254-K258 PolarHBondContact O-N 3.2Å; R255-K258 PolarHBondContact O-N 3.04Å; V256-K258 VanDerWaalsContact C-N 3.32Å; V256-K258 PolarHBondContact O-N 2.97Å; K258-W261 PolarHBondContact O-N 3.47Å; K258-N262 WeakPolarHBondContact O-CB 3.35Å; K258-N262 PolarHBondContact O-N 3.25Å; K258-N262 PolarHBondContact O-ND2 2.99Å
259V77.9Confident74.8Confident76 Ų76102.2 Ų102.246%0.46150%0.498SS..Hα-helixtrans-63.1-49174.4171.60000110.1R255 V256 W261 N262 D263R255-V259 VanDerWaalsContact O-CG2 3.31Å; R255-V259 WeakPolarHBondContact O-CG2 3.49Å; R255-V259 PolarHBondContact O-N 3.38Å; V256-V259 PolarHBondContact O-N 3.31Å; V259-W261 VanDerWaalsContact C-N 3.29Å; V259-W261 PolarHBondContact O-N 3.37Å; V259-N262 PolarHBondContact O-N 3.15Å; V259-N262 VanDerWaalsContact O-N 3.15Å; V259-D263 PolarHBondContact O-N 3.4Å
260L76.7Confident76.5Confident62 Ų6298.6 Ų98.633%0.32548%0.476SS..Hα-helixtrans-59.4-40.6178.6-158.479.3000112.2V256 F257 D263 F264 L400V256-L260 WeakPolarHBondContact O-CB 3.36Å; V256-L260 PolarHBondContact O-N 2.93Å; F257-L260 PolarHBondContact O-N 3.3Å; L260-D263 PolarHBondContact O-N 2.95Å; L260-F264 VanDerWaalsContact O-CB 3.27Å; L260-F264 WeakPolarHBondContact O-CB 3.46Å; L260-F264 PolarHBondContact O-N 3.47Å; L260-L400 HydrophobicContact CD1-CD1 3.85Å; L260-L400 HydrophobicContact CD1-CD2 3.96Å; L260-L400 HydrophobicContact CD1-CG 4.35Å; L260-L400 HydrophobicContact CD2-CD1 4.01Å; L260-L400 HydrophobicContact CG-CD1 3.77Å; L260-L400 HydrophobicContact CG-CD2 4.02Å
261W82.3Confident78.2Confident153 Ų15397.8 Ų97.858%0.5847%0.467SS*.Hα-helixtrans-67.5-40.6176.8-176.8-102.6000112.6F257 K258 V259 F264 L265F257-W261 VanDerWaalsContact O-CB 3.26Å; F257-W261 WeakPolarHBondContact O-CB 3.45Å; F257-W261 PolarHBondContact O-N 3.38Å; K258-W261 PolarHBondContact O-N 3.47Å; V259-W261 VanDerWaalsContact C-N 3.29Å; V259-W261 PolarHBondContact O-N 3.37Å; W261-F264 HydrophobicContact CE3-CD1 4.31Å; W261-F264 HydrophobicContact CH2-CE1 4.44Å; W261-F264 HydrophobicContact CZ3-CD1 4.19Å; W261-F264 HydrophobicContact CZ3-CE1 4.3Å; W261-F264 WeakPolarHBondContact O-CB 3.3Å; W261-F264 PolarHBondContact O-N 3.45Å; W261-L265 HydrophobicContact CZ2-CD2 4.36Å; W261-L265 WeakPolarHBondContact O-CG 3.15Å; W261-L265 PolarHBondContact O-N 3.46Å
262N82.7Confident79.5Confident86 Ų8697.5 Ų97.546%0.4647%0.465SS..Hα-helixtrans-65.7-42.5175.1-73.4-18.9000111.4K258 V259 F264 L265 M266K258-N262 WeakPolarHBondContact O-CB 3.35Å; K258-N262 PolarHBondContact O-N 3.25Å; K258-N262 PolarHBondContact O-ND2 2.99Å; V259-N262 PolarHBondContact O-N 3.15Å; V259-N262 VanDerWaalsContact O-N 3.15Å; N262-F264 VanDerWaalsContact C-N 3.34Å; N262-L265 PolarHBondContact O-N 2.9Å; N262-M266 WeakPolarHBondContact O-CB 3.44Å; N262-M266 PolarHBondContact O-N 3.49Å
263D78.7Confident80.5Confident28 Ų2893 Ų9315%0.1544%0.441CS..Hα-helixtrans-62.6-42.7174.7-76.7-27.1000111.1V259 L260 M266 C267 R397 L400V259-D263 PolarHBondContact O-N 3.4Å; L260-D263 PolarHBondContact O-N 2.95Å; D263-M266 PolarHBondContact O-N 2.98Å; D263-C267 WeakPolarHBondContact O-CB 3.4Å; D263-C267 PolarHBondContact O-N 3.28Å; D263-C267 PolarHBondContact O-SG 3.38Å; D263-R397 HydrophobicContact CB-CG 4.3Å; D263-R397 IonicContact OD1-CZ 3.17Å; D263-R397 IonicContact OD1-NE 2.96Å; D263-R397 PolarHBondContact OD1-NE 2.9Å; D263-R397 IonicContact OD1-NH2 2.71Å; D263-R397 PolarHBondContact OD1-NH2 3.21Å; D263-L400 HydrophobicContact CB-CD2 4.05Å
264F82.8Confident81.5Confident58 Ų5886.7 Ų86.725%0.25442%0.422SS..Hα-helixtrans-55.1-55173.1174.1-90.2000111.3L260 W261 N262 M266 C267 Y268 L400 V404L260-F264 VanDerWaalsContact O-CB 3.27Å; L260-F264 WeakPolarHBondContact O-CB 3.46Å; L260-F264 PolarHBondContact O-N 3.47Å; W261-F264 HydrophobicContact CE3-CD1 4.31Å; W261-F264 HydrophobicContact CH2-CE1 4.44Å; W261-F264 HydrophobicContact CZ3-CD1 4.19Å; W261-F264 HydrophobicContact CZ3-CE1 4.3Å; W261-F264 WeakPolarHBondContact O-CB 3.3Å; W261-F264 PolarHBondContact O-N 3.45Å; N262-F264 VanDerWaalsContact C-N 3.34Å; F264-M266 VanDerWaalsContact C-N 3.3Å; F264-M266 PolarHBondContact O-N 3.04Å; F264-C267 PolarHBondContact O-N 2.98Å; F264-Y268 HydrophobicContact CD1-CD2 4.49Å; F264-Y268 AromaticContact CD2-CD2 3.66Å; F264-Y268 HydrophobicContact CD2-CD2 3.66Å; F264-Y268 AromaticContact CD2-CE2 3.6Å; F264-Y268 HydrophobicContact CD2-CE2 3.6Å; F264-Y268 HydrophobicContact CE1-CD2 4.43Å; F264-Y268 AromaticContact CE2-CD2 3.62Å; F264-Y268 HydrophobicContact CE2-CD2 3.62Å; F264-Y268 AromaticContact CE2-CE2 3.55Å; F264-Y268 HydrophobicContact CE2-CE2 3.55Å; F264-Y268 HydrophobicContact CG-CD2 4.11Å; F264-Y268 HydrophobicContact CG-CE2 4.46Å; F264-Y268 HydrophobicContact CZ-CD2 4.01Å; F264-Y268 HydrophobicContact CZ-CE2 4.33Å; F264-Y268 VanDerWaalsContact O-CD2 3.31Å; F264-Y268 WeakPolarHBondContact O-CD2 3.43Å; F264-Y268 PolarHBondContact O-N 3.16Å; F264-Y268 VanDerWaalsContact O-N 3.07Å; F264-L400 HydrophobicContact CB-CD2 4.24Å; F264-V404 HydrophobicContact CD2-CG2 4.01Å; F264-V404 HydrophobicContact CE2-CG1 3.81Å; F264-V404 HydrophobicContact CE2-CG2 4.01Å
265L86Confident82.2Confident79 Ų7980.8 Ų80.841%0.41439%0.392SS..Hα-helixtrans-59-43179-72.4177.5000111.2W261 N262 S269W261-L265 HydrophobicContact CZ2-CD2 4.36Å; W261-L265 WeakPolarHBondContact O-CG 3.15Å; W261-L265 PolarHBondContact O-N 3.46Å; N262-L265 PolarHBondContact O-N 2.9Å; L265-S269 VanDerWaalsContact O-CB 3.24Å; L265-S269 WeakPolarHBondContact O-CB 3.4Å; L265-S269 PolarHBondContact O-N 2.94Å; L265-S269 PolarHBondContact O-OG 3.25Å
266M82.5Confident83Confident117 Ų11772.4 Ų72.458%0.57636%0.36SS*.Hα-helixtrans-63.8-44.1179.9-174.9174.2172.900112.2N262 D263 F264 S269 R397N262-M266 WeakPolarHBondContact O-CB 3.44Å; N262-M266 PolarHBondContact O-N 3.49Å; D263-M266 PolarHBondContact O-N 2.98Å; F264-M266 VanDerWaalsContact C-N 3.3Å; F264-M266 PolarHBondContact O-N 3.04Å; M266-S269 PolarHBondContact O-N 3.31Å; M266-R397 PolarHBondContact SD-NH1 3.44Å; M266-R397 PolarHBondContact SD-NH2 2.95Å
267C80.7Confident84.1Confident4 Ų469.2 Ų69.23%0.02734%0.341CS..Hα-helixtrans-64.9-49-178.8-66.40000111.9D263 F264 S269 S270 L393 V401D263-C267 WeakPolarHBondContact O-CB 3.4Å; D263-C267 PolarHBondContact O-N 3.28Å; D263-C267 PolarHBondContact O-SG 3.38Å; F264-C267 PolarHBondContact O-N 2.98Å; C267-S269 VanDerWaalsContact C-N 3.31Å; C267-S269 PolarHBondContact O-N 3.2Å; C267-S270 PolarHBondContact O-N 3.03Å; C267-L393 HydrophobicContact CB-CD2 4.03Å; C267-L393 WeakPolarHBondContact SG-CD2 3.39Å; C267-V401 HydrophobicContact CB-CG2 3.76Å
268Y85.6Confident84.9Confident32 Ų3265.1 Ų65.113%0.12533%0.327CS..Hα-helixtrans-80.9-8.7-177.6-70.3-76.9000113.7F264 S270 L274 V401 V404 N405F264-Y268 HydrophobicContact CD1-CD2 4.49Å; F264-Y268 AromaticContact CD2-CD2 3.66Å; F264-Y268 HydrophobicContact CD2-CD2 3.66Å; F264-Y268 AromaticContact CD2-CE2 3.6Å; F264-Y268 HydrophobicContact CD2-CE2 3.6Å; F264-Y268 HydrophobicContact CE1-CD2 4.43Å; F264-Y268 AromaticContact CE2-CD2 3.62Å; F264-Y268 HydrophobicContact CE2-CD2 3.62Å; F264-Y268 AromaticContact CE2-CE2 3.55Å; F264-Y268 HydrophobicContact CE2-CE2 3.55Å; F264-Y268 HydrophobicContact CG-CD2 4.11Å; F264-Y268 HydrophobicContact CG-CE2 4.46Å; F264-Y268 HydrophobicContact CZ-CD2 4.01Å; F264-Y268 HydrophobicContact CZ-CE2 4.33Å; F264-Y268 VanDerWaalsContact O-CD2 3.31Å; F264-Y268 WeakPolarHBondContact O-CD2 3.43Å; F264-Y268 PolarHBondContact O-N 3.16Å; F264-Y268 VanDerWaalsContact O-N 3.07Å; Y268-S270 VanDerWaalsContact C-N 3.3Å; Y268-L274 HydrophobicContact CD1-CD1 3.88Å; Y268-V401 HydrophobicContact CE2-CG2 4.26Å; Y268-V401 PolarHBondContact OH-O 3.36Å; Y268-V404 HydrophobicContact CE2-CB 4.37Å; Y268-V404 HydrophobicContact CE2-CG1 3.98Å; Y268-V404 WeakPolarHBondContact OH-CB 3.25Å; Y268-V404 WeakPolarHBondContact OH-CG1 3.35Å; Y268-N405 PolarHBondContact OH-OD1 2.94Å
269S86.3Confident85.7Confident93 Ų9358.3 Ų58.365%0.6530%0.298SS*.Hα-helixtrans-73.4-23.4170-65.80000112.8L265 M266 C267 R271L265-S269 VanDerWaalsContact O-CB 3.24Å; L265-S269 WeakPolarHBondContact O-CB 3.4Å; L265-S269 PolarHBondContact O-N 2.94Å; L265-S269 PolarHBondContact O-OG 3.25Å; M266-S269 PolarHBondContact O-N 3.31Å; C267-S269 VanDerWaalsContact C-N 3.31Å; C267-S269 PolarHBondContact O-N 3.2Å; S269-R271 PolarHBondContact O-N 3.31Å
270S84.3Confident86.6Confident43 Ų4355.5 Ų55.530%0.30128%0.279SS..SBendtrans-74.7119.4177.4173.20000110.6C267 Y268 L273 L274C267-S270 PolarHBondContact O-N 3.03Å; Y268-S270 VanDerWaalsContact C-N 3.3Å; S270-L273 PolarHBondContact O-N 3.31Å; S270-L274 WeakPolarHBondContact O-CB 3.46Å; S270-L274 PolarHBondContact O-N 2.96Å
271R84.5Confident87.5Confident179 Ų17952.7 Ų52.768%0.67527%0.265SS*.Hα-helixtrans-55.9-48.7-176.8-75-78.1-176.3158-3.8113.6S269 L274 C275S269-R271 PolarHBondContact O-N 3.31Å; R271-L274 PolarHBondContact O-N 3.16Å; R271-C275 WeakPolarHBondContact O-CB 3.39Å; R271-C275 PolarHBondContact O-N 3.21Å
272P83.7Confident88.2Confident60 Ų6047.3 Ų47.339%0.3925%0.247SC..Hα-helixtrans-61.8-43.8177.3-23.334.4000112.6L274 C275 W276P272-L274 PolarHBondContact O-N 3.38Å; P272-C275 WeakPolarHBondContact O-CB 3.43Å; P272-C275 PolarHBondContact O-N 3.47Å; P272-W276 PolarHBondContact O-N 3.36Å
273L86.3Confident89Confident7 Ų743.2 Ų43.24%0.03723%0.225CC..Hα-helixtrans-62.9-43.6179.5-81.4176.5000112S270 C275 S277 I389 N392 L393S270-L273 PolarHBondContact O-N 3.31Å; L273-C275 VanDerWaalsContact C-N 3.34Å; L273-S277 WeakPolarHBondContact O-CB 2.97Å; L273-S277 PolarHBondContact O-N 3.42Å; L273-S277 PolarHBondContact O-OG 2.92Å; L273-I389 HydrophobicContact CD2-CB 4.45Å; L273-I389 HydrophobicContact CD2-CG1 4.41Å; L273-I389 HydrophobicContact CD2-CG2 4.47Å; L273-N392 HydrophobicContact CD1-CB 4.01Å; L273-N392 HydrophobicContact CD2-CB 3.54Å; L273-N392 HydrophobicContact CG-CB 3.79Å; L273-L393 HydrophobicContact CD1-CD2 3.67Å; L273-L393 HydrophobicContact CD1-CG 4.15Å; L273-L393 HydrophobicContact CD2-CD1 4.4Å; L273-L393 HydrophobicContact CD2-CG 4.16Å
274L90.5Very high89.7Confident65 Ų6542.1 Ų42.134%0.3422%0.22SC..Hα-helixtrans-61.9-44.1176.2-176.765.2000111Y268 S270 R271 P272 S277 V278Y268-L274 HydrophobicContact CD1-CD1 3.88Å; S270-L274 WeakPolarHBondContact O-CB 3.46Å; S270-L274 PolarHBondContact O-N 2.96Å; R271-L274 PolarHBondContact O-N 3.16Å; P272-L274 PolarHBondContact O-N 3.38Å; L274-S277 PolarHBondContact O-N 2.79Å; L274-V278 HydrophobicContact CD1-CG2 3.95Å; L274-V278 HydrophobicContact CG-CG2 4.22Å; L274-V278 WeakPolarHBondContact O-CB 3.39Å; L274-V278 WeakPolarHBondContact O-CG2 3.37Å; L274-V278 PolarHBondContact O-N 3.32Å
275C91.8Very high90.4Very high14 Ų1439.4 Ų39.410%0.09521%0.208CC..Hα-helixtrans-58.6-52.5179.1-174.80000111.9R271 P272 L273 S277 W279 F448R271-C275 WeakPolarHBondContact O-CB 3.39Å; R271-C275 PolarHBondContact O-N 3.21Å; P272-C275 WeakPolarHBondContact O-CB 3.43Å; P272-C275 PolarHBondContact O-N 3.47Å; L273-C275 VanDerWaalsContact C-N 3.34Å; C275-S277 PolarHBondContact O-N 3.03Å; C275-W279 PolarHBondContact O-N 3.39Å; C275-W279 VanDerWaalsContact O-N 3.07Å; C275-F448 VanDerWaalsContact SG-CE1 3.52Å
276W92.5Very high90.9Very high8 Ų835.6 Ų35.63%0.0319%0.188CC..Hα-helixtrans-64.2-39.6177.1-72.1111.8000112.6P272 W279 W280 W336 L344 I384 A385 Q388 I389P272-W276 PolarHBondContact O-N 3.36Å; W276-W279 PolarHBondContact O-N 3.32Å; W276-W280 VanDerWaalsContact O-CB 3.24Å; W276-W280 WeakPolarHBondContact O-CB 3.43Å; W276-W280 PolarHBondContact O-N 3.39Å; W276-W336 AromaticContact CH2-CE3 3.98Å; W276-W336 HydrophobicContact CH2-CE3 3.98Å; W276-W336 HydrophobicContact CH2-CZ3 4.4Å; W276-W336 HydrophobicContact CZ2-CB 4.42Å; W276-W336 HydrophobicContact CZ2-CE3 4.11Å; W276-L344 HydrophobicContact CD2-CD1 4.46Å; W276-L344 HydrophobicContact CE3-CD1 4.06Å; W276-L344 HydrophobicContact CE3-CD2 3.95Å; W276-L344 HydrophobicContact CE3-CG 4.35Å; W276-L344 HydrophobicContact CH2-CD2 4.2Å; W276-L344 HydrophobicContact CH2-CG 4.28Å; W276-L344 HydrophobicContact CZ3-CD1 4.15Å; W276-L344 HydrophobicContact CZ3-CD2 3.47Å; W276-L344 VanDerWaalsContact CZ3-CD2 3.47Å; W276-L344 HydrophobicContact CZ3-CG 3.94Å; W276-I384 HydrophobicContact CH2-CG2 3.46Å; W276-I384 VanDerWaalsContact CH2-CG2 3.46Å; W276-I384 HydrophobicContact CZ2-CG2 4.2Å; W276-I384 HydrophobicContact CZ3-CB 4.44Å; W276-I384 HydrophobicContact CZ3-CG2 3.76Å; W276-A385 HydrophobicContact CE3-CB 3.66Å; W276-A385 HydrophobicContact CZ3-CB 4.24Å; W276-Q388 HydrophobicContact CD2-CB 3.98Å; W276-Q388 HydrophobicContact CD2-CG 4.23Å; W276-Q388 HydrophobicContact CG-CB 3.95Å; W276-Q388 HydrophobicContact CH2-CG 4.45Å; W276-Q388 HydrophobicContact CZ2-CB 4.46Å; W276-Q388 HydrophobicContact CZ2-CG 3.82Å; W276-I389 HydrophobicContact CB-CD1 4.3Å; W276-I389 HydrophobicContact CB-CG1 4Å
277S93.3Very high91.6Very high3 Ų331.6 Ų31.62%0.02117%0.167CC..Hα-helixtrans-68.6-41.4180-64.90000113L273 L274 C275 W280 A281 N405L273-S277 WeakPolarHBondContact O-CB 2.97Å; L273-S277 PolarHBondContact O-N 3.42Å; L273-S277 PolarHBondContact O-OG 2.92Å; L274-S277 PolarHBondContact O-N 2.79Å; C275-S277 PolarHBondContact O-N 3.03Å; S277-W280 WeakPolarHBondContact O-CB 3.33Å; S277-W280 PolarHBondContact O-N 2.91Å; S277-A281 PolarHBondContact O-N 2.99Å; S277-N405 WeakPolarHBondContact CB-ND2 3.45Å; S277-N405 WeakPolarHBondContact CB-OD1 3.32Å; S277-N405 PolarHBondContact OG-ND2 3.39Å
278V94.6Very high92.1Very high57 Ų5733.4 Ų33.435%0.34517%0.174SC..Hα-helixtrans-64.3-45.1175.5168.80000110.3L274 W280 A281 L282 F448L274-V278 HydrophobicContact CD1-CG2 3.95Å; L274-V278 HydrophobicContact CG-CG2 4.22Å; L274-V278 WeakPolarHBondContact O-CB 3.39Å; L274-V278 WeakPolarHBondContact O-CG2 3.37Å; L274-V278 PolarHBondContact O-N 3.32Å; V278-W280 VanDerWaalsContact C-N 3.33Å; V278-W280 PolarHBondContact O-N 3.42Å; V278-A281 PolarHBondContact O-N 3.28Å; V278-L282 HydrophobicContact CG1-CD1 3.63Å; V278-L282 HydrophobicContact CG1-CG 4.34Å; V278-L282 WeakPolarHBondContact O-CB 3.47Å; V278-L282 VanDerWaalsContact O-CG 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.24Å; V278-L282 PolarHBondContact O-N 3.02Å; V278-F448 HydrophobicContact CG1-CZ 4.29Å
279W96.8Very high92.5Very high0 Ų031.9 Ų31.90%017%0.168CC..Hα-helixtrans-60.6-44.8175.9-176.282.1000111.5C275 W276 A281 S283 L344 S348 Y378 L381 I382 A385 F448C275-W279 PolarHBondContact O-N 3.39Å; C275-W279 VanDerWaalsContact O-N 3.07Å; W276-W279 PolarHBondContact O-N 3.32Å; W279-A281 VanDerWaalsContact C-N 3.35Å; W279-A281 PolarHBondContact O-N 2.86Å; W279-S283 VanDerWaalsContact CZ2-CB 3.48Å; W279-S283 WeakPolarHBondContact CZ2-OG 3.42Å; W279-S283 PolarHBondContact NE1-OG 3.23Å; W279-S283 VanDerWaalsContact NE1-OG 3.09Å; W279-S283 WeakPolarHBondContact O-CB 3.5Å; W279-S283 PolarHBondContact O-N 3.06Å; W279-S283 PolarHBondContact O-OG 2.92Å; W279-L344 HydrophobicContact CB-CD1 3.91Å; W279-L344 HydrophobicContact CB-CD2 4.16Å; W279-L344 HydrophobicContact CD2-CD2 3.45Å; W279-L344 VanDerWaalsContact CD2-CD2 3.45Å; W279-L344 HydrophobicContact CE3-CD2 4.01Å; W279-L344 HydrophobicContact CG-CD1 4.04Å; W279-L344 HydrophobicContact CG-CD2 3.46Å; W279-L344 VanDerWaalsContact CG-CD2 3.46Å; W279-L344 HydrophobicContact CG-CG 4.19Å; W279-S348 PolarHBondContact NE1-OG 2.58Å; W279-Y378 HydrophobicContact CH2-CD2 4.44Å; W279-L381 HydrophobicContact CH2-CB 3.15Å; W279-L381 HydrophobicContact CH2-CD1 3.71Å; W279-L381 HydrophobicContact CH2-CG 4.13Å; W279-L381 HydrophobicContact CZ2-CB 3.56Å; W279-L381 HydrophobicContact CZ2-CD1 3.13Å; W279-L381 HydrophobicContact CZ2-CG 4.05Å; W279-L381 HydrophobicContact CZ3-CB 3.73Å; W279-I382 HydrophobicContact CZ3-CD1 4.21Å; W279-A385 HydrophobicContact CE3-CB 3.98Å; W279-A385 HydrophobicContact CZ3-CB 4.07Å; W279-F448 HydrophobicContact CB-CE1 3.94Å; W279-F448 HydrophobicContact CB-CE2 3.77Å; W279-F448 HydrophobicContact CB-CZ 3.35Å; W279-F448 AromaticContact CD1-CD2 3.84Å; W279-F448 AromaticContact CD1-CE2 3.56Å; W279-F448 HydrophobicContact CG-CE2 4.07Å; W279-F448 HydrophobicContact CG-CZ 4.1Å
280W95.4Very high92.9Very high17 Ų1727.4 Ų27.46%0.06414%0.137CC..Hα-helixtrans-56.4-48.8178.2-174.9110.1000110.6W276 S277 V278 T284 I382 F402 N405 T406 A409W276-W280 VanDerWaalsContact O-CB 3.24Å; W276-W280 WeakPolarHBondContact O-CB 3.43Å; W276-W280 PolarHBondContact O-N 3.39Å; S277-W280 WeakPolarHBondContact O-CB 3.33Å; S277-W280 PolarHBondContact O-N 2.91Å; V278-W280 VanDerWaalsContact C-N 3.33Å; V278-W280 PolarHBondContact O-N 3.42Å; W280-T284 HydrophobicContact CH2-CG2 4.43Å; W280-T284 HydrophobicContact CZ3-CG2 4.36Å; W280-T284 WeakPolarHBondContact O-CB 3.18Å; W280-T284 PolarHBondContact O-N 3.4Å; W280-T284 PolarHBondContact O-OG1 3.02Å; W280-I382 HydrophobicContact CD2-CD1 4.15Å; W280-I382 HydrophobicContact CG-CD1 3.75Å; W280-F402 HydrophobicContact CZ2-CD2 4.36Å; W280-F402 HydrophobicContact CZ2-CE2 4.01Å; W280-N405 HydrophobicContact CD2-CB 3.95Å; W280-N405 HydrophobicContact CE3-CB 3.39Å; W280-N405 HydrophobicContact CH2-CB 4.31Å; W280-N405 HydrophobicContact CZ3-CB 3.64Å; W280-N405 WeakPolarHBondContact CZ3-O 3.39Å; W280-T406 VanDerWaalsContact CH2-OG1 3.24Å; W280-T406 WeakPolarHBondContact CH2-OG1 3.44Å; W280-T406 VanDerWaalsContact CZ3-CA 3.5Å; W280-T406 VanDerWaalsContact CZ3-N 3.25Å; W280-A409 HydrophobicContact CZ3-CB 3.87Å
281A96.4Very high93.2Very high4 Ų426.1 Ų26.13%0.03313%0.127CC..Hα-helixtrans-68.7-47-175.300000112.1S277 V278 W279 C285 I408 A409S277-A281 PolarHBondContact O-N 2.99Å; V278-A281 PolarHBondContact O-N 3.28Å; W279-A281 VanDerWaalsContact C-N 3.35Å; W279-A281 PolarHBondContact O-N 2.86Å; A281-C285 PolarHBondContact O-N 3.33Å; A281-I408 HydrophobicContact CB-CB 4.13Å; A281-I408 HydrophobicContact CB-CG2 3.84Å; A281-A409 WeakPolarHBondContact O-CB 3.45Å
282L97.6Very high93.2Very high39 Ų3917.7 Ų17.720%0.20410%0.096CC..Hα-helixtrans-63.7-49.8178.1-66.8170.9000111.3V278 T284 C285 G286 L412 Y440 I444V278-L282 HydrophobicContact CG1-CD1 3.63Å; V278-L282 HydrophobicContact CG1-CG 4.34Å; V278-L282 WeakPolarHBondContact O-CB 3.47Å; V278-L282 VanDerWaalsContact O-CG 3.3Å; V278-L282 WeakPolarHBondContact O-CG 3.24Å; V278-L282 PolarHBondContact O-N 3.02Å; L282-T284 VanDerWaalsContact C-N 3.31Å; L282-T284 PolarHBondContact O-N 3.31Å; L282-C285 WeakPolarHBondContact O-CB 3.32Å; L282-C285 PolarHBondContact O-N 2.79Å; L282-G286 PolarHBondContact O-N 3.38Å; L282-G286 VanDerWaalsContact O-N 3.09Å; L282-L412 HydrophobicContact CD2-CD1 3.83Å; L282-Y440 VanDerWaalsContact CA-OH 3.32Å; L282-Y440 WeakPolarHBondContact CA-OH 3.37Å; L282-Y440 WeakPolarHBondContact CD2-OH 3.33Å; L282-Y440 WeakPolarHBondContact O-CE1 3.31Å; L282-Y440 PolarHBondContact O-OH 3.49Å; L282-I444 HydrophobicContact CB-CD1 3.7Å; L282-I444 HydrophobicContact CB-CG1 4.02Å; L282-I444 HydrophobicContact CD1-CG1 4.29Å
283S97.5Very high93.5Very high0 Ų014.8 Ų14.80%08%0.077CC..Hα-helixtrans-69.3-30.9-176.1-57.70000112.5W279 G286 Y287W279-S283 VanDerWaalsContact CZ2-CB 3.48Å; W279-S283 WeakPolarHBondContact CZ2-OG 3.42Å; W279-S283 PolarHBondContact NE1-OG 3.23Å; W279-S283 VanDerWaalsContact NE1-OG 3.09Å; W279-S283 WeakPolarHBondContact O-CB 3.5Å; W279-S283 PolarHBondContact O-N 3.06Å; W279-S283 PolarHBondContact O-OG 2.92Å; S283-G286 PolarHBondContact O-N 2.89Å; S283-Y287 WeakPolarHBondContact O-CB 3.11Å; S283-Y287 PolarHBondContact O-N 3.36Å
284T95.4Very high93.6Very high5 Ų514.5 Ų14.53%0.0318%0.075CC..Hα-helixtrans-68.7-38.6174.8-60.50000111.7W280 L282 Y287 F288 Y378 A409W280-T284 HydrophobicContact CH2-CG2 4.43Å; W280-T284 HydrophobicContact CZ3-CG2 4.36Å; W280-T284 WeakPolarHBondContact O-CB 3.18Å; W280-T284 PolarHBondContact O-N 3.4Å; W280-T284 PolarHBondContact O-OG1 3.02Å; L282-T284 VanDerWaalsContact C-N 3.31Å; L282-T284 PolarHBondContact O-N 3.31Å; T284-Y287 PolarHBondContact O-N 3.13Å; T284-F288 HydrophobicContact CG2-CD2 3.94Å; T284-F288 HydrophobicContact CG2-CE1 4.46Å; T284-F288 HydrophobicContact CG2-CE2 3.45Å; T284-F288 VanDerWaalsContact CG2-CE2 3.45Å; T284-F288 HydrophobicContact CG2-CZ 3.74Å; T284-F288 VanDerWaalsContact O-CD2 3.32Å; T284-F288 WeakPolarHBondContact O-CD2 3.26Å; T284-F288 WeakPolarHBondContact O-CG 3.45Å; T284-F288 PolarHBondContact O-N 3.29Å; T284-Y378 PolarHBondContact OG1-OH 2.97Å; T284-Y378 VanDerWaalsContact OG1-OH 3.06Å; T284-A409 HydrophobicContact CG2-CB 3.92Å
285C97.1Very high93.2Very high1 Ų112.3 Ų12.31%0.0076%0.063CC..Hα-helixtrans-57-54.5169.7168.50000111.4A281 L282 Y287 F288 Q289 L412 Q413A281-C285 PolarHBondContact O-N 3.33Å; L282-C285 WeakPolarHBondContact O-CB 3.32Å; L282-C285 PolarHBondContact O-N 2.79Å; C285-Y287 VanDerWaalsContact C-N 3.29Å; C285-Y287 PolarHBondContact O-N 3.24Å; C285-F288 PolarHBondContact O-N 3.25Å; C285-Q289 WeakPolarHBondContact O-CG 3.35Å; C285-Q289 PolarHBondContact O-N 2.87Å; C285-L412 HydrophobicContact CB-CB 3.93Å; C285-L412 VanDerWaalsContact SG-C 3.54Å; C285-Q413 VanDerWaalsContact SG-CA 3.53Å; C285-Q413 PolarHBondContact SG-N 3.26Å; C285-Q413 VanDerWaalsContact SG-N 3.39Å
286G97Very high92.7Very high0 Ų011.7 Ų11.70%06%0.059CC..Hα-helixtrans-61.6-37.4179.400000112.8L282 S283 Q289 V290L282-G286 PolarHBondContact O-N 3.38Å; L282-G286 VanDerWaalsContact O-N 3.09Å; S283-G286 PolarHBondContact O-N 2.89Å; G286-Q289 PolarHBondContact O-N 3.18Å; G286-V290 WeakPolarHBondContact O-CG2 3.11Å; G286-V290 PolarHBondContact O-N 2.75Å
287Y95.7Very high92.4Very high32 Ų3211.3 Ų11.313%0.1256%0.058CC..Hα-helixtrans-62.3-47.2176.2172-99.6000111.8S283 T284 C285 Q289 V290 V291 F374 R375 Y378S283-Y287 WeakPolarHBondContact O-CB 3.11Å; S283-Y287 PolarHBondContact O-N 3.36Å; T284-Y287 PolarHBondContact O-N 3.13Å; C285-Y287 VanDerWaalsContact C-N 3.29Å; C285-Y287 PolarHBondContact O-N 3.24Å; Y287-Q289 VanDerWaalsContact C-N 3.33Å; Y287-Q289 PolarHBondContact O-N 3.07Å; Y287-V290 PolarHBondContact O-N 3.27Å; Y287-V291 HydrophobicContact CD1-CG2 4.47Å; Y287-V291 HydrophobicContact CD2-CG2 3.94Å; Y287-V291 HydrophobicContact CE1-CG2 4.11Å; Y287-V291 HydrophobicContact CE2-CG2 3.52Å; Y287-V291 HydrophobicContact CG-CG2 4.4Å; Y287-V291 WeakPolarHBondContact O-CB 3.26Å; Y287-V291 WeakPolarHBondContact O-CG2 3.46Å; Y287-V291 PolarHBondContact O-N 3.34Å; Y287-F374 HydrophobicContact CD2-CE1 4.01Å; Y287-F374 HydrophobicContact CD2-CE2 4.35Å; Y287-F374 AromaticContact CD2-CZ 3.52Å; Y287-F374 HydrophobicContact CD2-CZ 3.52Å; Y287-F374 HydrophobicContact CE2-CE1 4.28Å; Y287-F374 HydrophobicContact CE2-CZ 4.24Å; Y287-F374 HydrophobicContact CG-CZ 4.37Å; Y287-R375 HydrophobicContact CE2-CG 4.45Å; Y287-Y378 VanDerWaalsContact CB-CE2 3.45Å; Y287-Y378 HydrophobicContact CD1-CD1 4.18Å; Y287-Y378 AromaticContact CD1-CE1 3.53Å; Y287-Y378 HydrophobicContact CD1-CE1 3.53Å; Y287-Y378 HydrophobicContact CD1-CE2 4.45Å; Y287-Y378 AromaticContact CD1-CZ 3.69Å; Y287-Y378 AromaticContact CD2-CD1 3.16Å; Y287-Y378 HydrophobicContact CD2-CD1 3.16Å; Y287-Y378 AromaticContact CD2-CD2 3.98Å; Y287-Y378 HydrophobicContact CD2-CD2 3.98Å; Y287-Y378 AromaticContact CD2-CE1 3.43Å; Y287-Y378 HydrophobicContact CD2-CE1 3.43Å; Y287-Y378 VanDerWaalsContact CD2-CE1 3.43Å; Y287-Y378 HydrophobicContact CD2-CE2 4.21Å; Y287-Y378 AromaticContact CD2-CG 3.46Å; Y287-Y378 HydrophobicContact CD2-CG 3.46Å; Y287-Y378 VanDerWaalsContact CD2-CG 3.46Å; Y287-Y378 AromaticContact CD2-CZ 3.95Å; Y287-Y378 HydrophobicContact CE1-CD1 4.34Å; Y287-Y378 AromaticContact CE1-CE1 3.77Å; Y287-Y378 HydrophobicContact CE1-CE1 3.77Å; Y287-Y378 AromaticContact CE2-CD1 3.37Å; Y287-Y378 HydrophobicContact CE2-CD1 3.37Å; Y287-Y378 AromaticContact CE2-CE1 3.68Å; Y287-Y378 HydrophobicContact CE2-CE1 3.68Å; Y287-Y378 HydrophobicContact CE2-CG 4.06Å; Y287-Y378 AromaticContact CG-CD1 3.62Å; Y287-Y378 HydrophobicContact CG-CD1 3.62Å; Y287-Y378 HydrophobicContact CG-CD2 4.03Å; Y287-Y378 AromaticContact CG-CE1 3.35Å; Y287-Y378 HydrophobicContact CG-CE1 3.35Å; Y287-Y378 AromaticContact CG-CE2 3.81Å; Y287-Y378 HydrophobicContact CG-CE2 3.81Å; Y287-Y378 AromaticContact CG-CG 3.94Å; Y287-Y378 HydrophobicContact CG-CG 3.94Å; Y287-Y378 AromaticContact CG-CZ 3.45Å; Y287-Y378 VanDerWaalsContact CG-CZ 3.45Å; Y287-Y378 AromaticContact CZ-CD1 3.97Å; Y287-Y378 AromaticContact CZ-CE1 3.84Å
288F92.3Very high92.1Very high42 Ų4211.3 Ų11.318%0.1846%0.057CC..Hα-helixtrans-60.2-43.7176.1-70.2-33.8000111.3T284 C285 V290 V291 N292 L410 Q413T284-F288 HydrophobicContact CG2-CD2 3.94Å; T284-F288 HydrophobicContact CG2-CE1 4.46Å; T284-F288 HydrophobicContact CG2-CE2 3.45Å; T284-F288 VanDerWaalsContact CG2-CE2 3.45Å; T284-F288 HydrophobicContact CG2-CZ 3.74Å; T284-F288 VanDerWaalsContact O-CD2 3.32Å; T284-F288 WeakPolarHBondContact O-CD2 3.26Å; T284-F288 WeakPolarHBondContact O-CG 3.45Å; T284-F288 PolarHBondContact O-N 3.29Å; C285-F288 PolarHBondContact O-N 3.25Å; F288-V290 PolarHBondContact O-N 3.47Å; F288-V291 PolarHBondContact O-N 3.34Å; F288-N292 VanDerWaalsContact C-ND2 3.31Å; F288-N292 WeakPolarHBondContact O-CA 3.33Å; F288-N292 WeakPolarHBondContact O-CB 3.32Å; F288-N292 PolarHBondContact O-N 2.97Å; F288-N292 PolarHBondContact O-ND2 3.39Å; F288-L410 HydrophobicContact CD2-CD2 4.21Å; F288-L410 HydrophobicContact CE2-CD2 3.79Å; F288-Q413 HydrophobicContact CB-CG 4.14Å
289Q94.3Very high91.5Very high0 Ų09.9 Ų9.90%05%0.047CC..Hα-helixtrans-56.1-53.9175.5-68.3-61.8-24.500112.3C285 G286 Y287 V291 N292 Y293 Q413 L416 T417 Y437C285-Q289 WeakPolarHBondContact O-CG 3.35Å; C285-Q289 PolarHBondContact O-N 2.87Å; G286-Q289 PolarHBondContact O-N 3.18Å; Y287-Q289 VanDerWaalsContact C-N 3.33Å; Y287-Q289 PolarHBondContact O-N 3.07Å; Q289-V291 PolarHBondContact O-N 3.25Å; Q289-N292 PolarHBondContact O-N 3.06Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.47Å; Q289-Y293 PolarHBondContact O-N 3.05Å; Q289-Y293 VanDerWaalsContact O-N 3.13Å; Q289-Y293 VanDerWaalsContact OE1-CE2 3.29Å; Q289-Q413 PolarHBondContact NE2-O 3.23Å; Q289-Q413 VanDerWaalsContact NE2-O 3.14Å; Q289-L416 HydrophobicContact CG-CD2 3.65Å; Q289-L416 HydrophobicContact CG-CG 4.26Å; Q289-T417 PolarHBondContact NE2-OG1 3.18Å; Q289-Y437 HydrophobicContact CB-CD1 3.74Å; Q289-Y437 HydrophobicContact CB-CD2 4.11Å; Q289-Y437 HydrophobicContact CB-CE1 3.56Å; Q289-Y437 HydrophobicContact CB-CE2 3.95Å; Q289-Y437 HydrophobicContact CB-CG 4.03Å; Q289-Y437 HydrophobicContact CG-CD1 4.11Å; Q289-Y437 HydrophobicContact CG-CE1 3.72Å; Q289-Y437 PolarHBondContact OE1-OH 3.4Å
290V94.6Very high90.9Very high0 Ų014.7 Ų14.70%07%0.068CC..Hα-helixtrans-59.8-48.4-178.7173.70000111.1G286 Y287 F288 N292 Y293 A294 V355 M358 Y371 F374 F434 Y437 F441G286-V290 WeakPolarHBondContact O-CG2 3.11Å; G286-V290 PolarHBondContact O-N 2.75Å; Y287-V290 PolarHBondContact O-N 3.27Å; F288-V290 PolarHBondContact O-N 3.47Å; V290-N292 VanDerWaalsContact C-N 3.32Å; V290-N292 PolarHBondContact O-N 2.96Å; V290-Y293 PolarHBondContact O-N 2.92Å; V290-A294 WeakPolarHBondContact O-CA 3.45Å; V290-A294 WeakPolarHBondContact O-CB 3.46Å; V290-A294 PolarHBondContact O-N 3.25Å; V290-V355 HydrophobicContact CG2-CG1 4.13Å; V290-V355 HydrophobicContact CG2-CG2 3.89Å; V290-M358 HydrophobicContact CG1-CE 4.45Å; V290-Y371 HydrophobicContact CG1-CD2 4.39Å; V290-Y371 HydrophobicContact CG1-CE2 4.36Å; V290-F374 HydrophobicContact CB-CE1 3.83Å; V290-F374 HydrophobicContact CB-CE2 4.33Å; V290-F374 HydrophobicContact CB-CZ 3.61Å; V290-F374 HydrophobicContact CG1-CD1 3.8Å; V290-F374 HydrophobicContact CG1-CE1 3.32Å; V290-F374 HydrophobicContact CG1-CE2 4.35Å; V290-F374 HydrophobicContact CG1-CG 4.48Å; V290-F374 HydrophobicContact CG1-CZ 3.62Å; V290-F374 HydrophobicContact CG2-CE2 4.35Å; V290-F374 HydrophobicContact CG2-CZ 4.1Å; V290-F434 HydrophobicContact CG1-CE1 4.01Å; V290-F434 HydrophobicContact CG1-CZ 4.45Å; V290-Y437 HydrophobicContact CG2-CD2 4.31Å; V290-F441 HydrophobicContact CG2-CE2 4.23Å
291V90Very high90.4Very high15 Ų1515.7 Ų15.79%0.0918%0.076CC..Hα-helixtrans-68.5-32.2-179.1175.40000111.7R23 Y287 F288 Q289 Y371 F374R23-V291 VanDerWaalsContact CD-O 3.25Å; R23-V291 WeakPolarHBondContact CD-O 3.46Å; R23-V291 PolarHBondContact NE-O 2.68Å; Y287-V291 HydrophobicContact CD1-CG2 4.47Å; Y287-V291 HydrophobicContact CD2-CG2 3.94Å; Y287-V291 HydrophobicContact CE1-CG2 4.11Å; Y287-V291 HydrophobicContact CE2-CG2 3.52Å; Y287-V291 HydrophobicContact CG-CG2 4.4Å; Y287-V291 WeakPolarHBondContact O-CB 3.26Å; Y287-V291 WeakPolarHBondContact O-CG2 3.46Å; Y287-V291 PolarHBondContact O-N 3.34Å; F288-V291 PolarHBondContact O-N 3.34Å; Q289-V291 PolarHBondContact O-N 3.25Å; V291-Y371 HydrophobicContact CG2-CE2 4.39Å; V291-F374 HydrophobicContact CG2-CE1 4.13Å
292N85.4Confident89.8Confident2 Ų217.6 Ų17.61%0.0118%0.084CC..Hα-helixtrans-60.8-44175-78.1-53.9000113R23 Y51 W54 F288 Q289 V290 Q413R23-N292 VanDerWaalsContact NH1-CA 3.27Å; R23-N292 PolarHBondContact NH1-OD1 2.95Å; R23-N292 PolarHBondContact NH2-OD1 2.82Å; Y51-N292 WeakPolarHBondContact CE2-O 3.39Å; W54-N292 WeakPolarHBondContact CZ3-OD1 3.32Å; F288-N292 VanDerWaalsContact C-ND2 3.31Å; F288-N292 WeakPolarHBondContact O-CA 3.33Å; F288-N292 WeakPolarHBondContact O-CB 3.32Å; F288-N292 PolarHBondContact O-N 2.97Å; F288-N292 PolarHBondContact O-ND2 3.39Å; Q289-N292 PolarHBondContact O-N 3.06Å; V290-N292 VanDerWaalsContact C-N 3.32Å; V290-N292 PolarHBondContact O-N 2.96Å; N292-Q413 PolarHBondContact ND2-NE2 3.03Å
293Y89.4Confident88.8Confident0 Ų018.3 Ų18.30%09%0.091CC..Hα-helixtrans-109.3-3.1-166.3-62-71.7000112.7F47 Y51 Q289 V290 Q295 G296 L297 V421 I430 Y437F47-Y293 HydrophobicContact CB-CD1 4.4Å; F47-Y293 HydrophobicContact CB-CE1 4.3Å; F47-Y293 AromaticContact CD1-CD1 3.51Å; F47-Y293 HydrophobicContact CD1-CD1 3.51Å; F47-Y293 AromaticContact CD1-CE1 3.89Å; F47-Y293 HydrophobicContact CD1-CE1 3.89Å; F47-Y293 HydrophobicContact CE1-CD1 4.11Å; F47-Y293 HydrophobicContact CG-CD1 4.24Å; Y51-Y293 HydrophobicContact CD2-CD1 4.21Å; Y51-Y293 AromaticContact CD2-CE1 3.88Å; Y51-Y293 HydrophobicContact CD2-CE1 3.88Å; Y51-Y293 HydrophobicContact CG-CE1 4.42Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.47Å; Q289-Y293 PolarHBondContact O-N 3.05Å; Q289-Y293 VanDerWaalsContact O-N 3.13Å; Q289-Y293 VanDerWaalsContact OE1-CE2 3.29Å; V290-Y293 PolarHBondContact O-N 2.92Å; Y293-Q295 VanDerWaalsContact C-N 3.34Å; Y293-Q295 PolarHBondContact O-N 2.8Å; Y293-G296 WeakPolarHBondContact O-CA 3.19Å; Y293-G296 PolarHBondContact O-N 2.91Å; Y293-L297 PolarHBondContact O-N 3.33Å; Y293-L297 VanDerWaalsContact O-N 3.17Å; Y293-V421 HydrophobicContact CD2-CG2 4.44Å; Y293-V421 HydrophobicContact CE1-CG1 3.63Å; Y293-V421 HydrophobicContact CE1-CG2 4.32Å; Y293-V421 HydrophobicContact CE2-CG2 3.82Å; Y293-V421 WeakPolarHBondContact OH-CG1 3.43Å; Y293-I430 HydrophobicContact CG-CD1 4.49Å; Y293-Y437 HydrophobicContact CD2-CE2 4.2Å; Y293-Y437 VanDerWaalsContact CD2-OH 3.23Å; Y293-Y437 WeakPolarHBondContact CD2-OH 3.43Å
294A88.8Confident87.5Confident0 Ų019.6 Ų19.60%010%0.101CC..Hα-helixtrans-54.2-42.7179.600000114V290 G296 L297 W298 Y371 F434V290-A294 WeakPolarHBondContact O-CA 3.45Å; V290-A294 WeakPolarHBondContact O-CB 3.46Å; V290-A294 PolarHBondContact O-N 3.25Å; A294-G296 PolarHBondContact O-N 3.14Å; A294-L297 WeakPolarHBondContact O-CB 3.2Å; A294-L297 PolarHBondContact O-N 3.36Å; A294-L297 VanDerWaalsContact O-N 3.16Å; A294-W298 HydrophobicContact CB-CH2 4.15Å; A294-W298 HydrophobicContact CB-CZ2 3.95Å; A294-W298 VanDerWaalsContact O-CG 3.24Å; A294-W298 PolarHBondContact O-N 2.9Å; A294-Y371 HydrophobicContact CB-CD2 4.21Å; A294-Y371 HydrophobicContact CB-CE2 3.77Å; A294-F434 HydrophobicContact CB-CZ 4.37Å
295Q80.7Confident86.1Confident19 Ų1926.4 Ų26.49%0.08913%0.132CC..Hα-helixtrans-63-33.8178.1-67.5-170.5-0.700112.4R23 I26 Y293 W298 E299R23-Q295 PolarHBondContact O-OE1 3.14Å; R23-Q295 VanDerWaalsContact O-OE1 3.08Å; I26-Q295 HydrophobicContact CD1-CB 4.02Å; Y293-Q295 VanDerWaalsContact C-N 3.34Å; Y293-Q295 PolarHBondContact O-N 2.8Å; Q295-W298 HydrophobicContact CB-CE3 4.41Å; Q295-W298 HydrophobicContact CG-CE3 4Å; Q295-W298 HydrophobicContact CG-CZ3 3.94Å; Q295-W298 PolarHBondContact O-N 2.85Å; Q295-E299 WeakPolarHBondContact O-CB 3.32Å; Q295-E299 PolarHBondContact O-N 2.91Å
296G81.1Confident84.5Confident1 Ų132.9 Ų32.91%0.0117%0.167CC..Hα-helixtrans-67.1-39.3174.200000113.5Y293 A294 K300Y293-G296 WeakPolarHBondContact O-CA 3.19Å; Y293-G296 PolarHBondContact O-N 2.91Å; A294-G296 PolarHBondContact O-N 3.14Å; G296-K300 WeakPolarHBondContact O-CB 3.4Å; G296-K300 PolarHBondContact O-N 3.24Å
297L87.1Confident83.2Confident0 Ų034.6 Ų34.60%018%0.181CC..Hα-helixtrans-64.5-45.9174.6-179.166000110.5Y293 A294 E299 K300 V301 M358 I430 I431 F434Y293-L297 PolarHBondContact O-N 3.33Å; Y293-L297 VanDerWaalsContact O-N 3.17Å; A294-L297 WeakPolarHBondContact O-CB 3.2Å; A294-L297 PolarHBondContact O-N 3.36Å; A294-L297 VanDerWaalsContact O-N 3.16Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 2.81Å; L297-K300 WeakPolarHBondContact O-CB 3.23Å; L297-K300 PolarHBondContact O-N 3.37Å; L297-K300 VanDerWaalsContact O-N 3.11Å; L297-V301 HydrophobicContact CD1-CG2 4.32Å; L297-V301 HydrophobicContact CG-CG2 4.41Å; L297-V301 WeakPolarHBondContact O-CG2 3.15Å; L297-V301 PolarHBondContact O-N 3.09Å; L297-M358 HydrophobicContact CD2-CB 3.83Å; L297-M358 HydrophobicContact CD2-CE 3.99Å; L297-I430 HydrophobicContact CB-CG1 4.15Å; L297-I431 HydrophobicContact CD1-CD1 3.68Å; L297-F434 HydrophobicContact CB-CD2 4.12Å; L297-F434 HydrophobicContact CB-CE2 3.77Å; L297-F434 HydrophobicContact CB-CZ 4.05Å; L297-F434 HydrophobicContact CD1-CD2 4.46Å; L297-F434 HydrophobicContact CD2-CD1 3.56Å; L297-F434 HydrophobicContact CD2-CD2 4.06Å; L297-F434 HydrophobicContact CD2-CE1 3.6Å; L297-F434 HydrophobicContact CD2-CE2 4.09Å; L297-F434 HydrophobicContact CD2-CG 3.81Å; L297-F434 HydrophobicContact CD2-CZ 3.89Å; L297-F434 HydrophobicContact CG-CD2 4.46Å; L297-F434 HydrophobicContact CG-CE2 4.48Å
298W87.3Confident82Confident3 Ų335.3 Ų35.31%0.01119%0.188CC..Hα-helixtrans-61.4-41.5178.4-60.8-27.1000112.7A294 Q295 K300 V301 M302 N311 V314 I364 Y368 Y371A294-W298 HydrophobicContact CB-CH2 4.15Å; A294-W298 HydrophobicContact CB-CZ2 3.95Å; A294-W298 VanDerWaalsContact O-CG 3.24Å; A294-W298 PolarHBondContact O-N 2.9Å; Q295-W298 HydrophobicContact CB-CE3 4.41Å; Q295-W298 HydrophobicContact CG-CE3 4Å; Q295-W298 HydrophobicContact CG-CZ3 3.94Å; Q295-W298 PolarHBondContact O-N 2.85Å; W298-K300 VanDerWaalsContact C-N 3.28Å; W298-K300 PolarHBondContact O-N 2.91Å; W298-V301 PolarHBondContact O-N 3.46Å; W298-M302 PolarHBondContact O-N 3.09Å; W298-N311 HydrophobicContact CE3-CB 3.98Å; W298-N311 HydrophobicContact CZ3-CB 3.94Å; W298-V314 HydrophobicContact CZ2-CG1 4.39Å; W298-I364 HydrophobicContact CB-CD1 3.98Å; W298-I364 HydrophobicContact CG-CD1 4.21Å; W298-Y368 HydrophobicContact CB-CE1 4.35Å; W298-Y368 AromaticContact CD1-CD1 3.99Å; W298-Y368 AromaticContact CD1-CE1 3.87Å; W298-Y368 HydrophobicContact CD2-CD1 4.19Å; W298-Y368 AromaticContact CD2-CE1 3.7Å; W298-Y368 HydrophobicContact CD2-CE1 3.7Å; W298-Y368 AromaticContact CE2-CD1 3.84Å; W298-Y368 AromaticContact CE2-CE1 3.85Å; W298-Y368 HydrophobicContact CE3-CE1 4.24Å; W298-Y368 HydrophobicContact CG-CD1 4.28Å; W298-Y368 AromaticContact CG-CE1 3.73Å; W298-Y368 HydrophobicContact CG-CE1 3.73Å; W298-Y368 HydrophobicContact CZ2-CD1 4.31Å; W298-Y368 HydrophobicContact CZ2-CE1 4.49Å; W298-Y368 AromaticContact NE1-CD1 3.72Å; W298-Y368 AromaticContact NE1-CE1 3.94Å; W298-Y371 HydrophobicContact CH2-CD1 4Å; W298-Y371 AromaticContact CH2-CE1 3.76Å; W298-Y371 HydrophobicContact CH2-CE1 3.76Å; W298-Y371 HydrophobicContact CH2-CE2 4.42Å; W298-Y371 HydrophobicContact CH2-CG 4.39Å; W298-Y371 AromaticContact CH2-CZ 3.96Å; W298-Y371 AromaticContact CZ2-CD1 3.61Å; W298-Y371 HydrophobicContact CZ2-CD1 3.61Å; W298-Y371 AromaticContact CZ2-CD2 3.92Å; W298-Y371 HydrophobicContact CZ2-CD2 3.92Å; W298-Y371 AromaticContact CZ2-CE1 3.83Å; W298-Y371 HydrophobicContact CZ2-CE1 3.83Å; W298-Y371 HydrophobicContact CZ2-CE2 4.14Å; W298-Y371 AromaticContact CZ2-CG 3.62Å; W298-Y371 HydrophobicContact CZ2-CG 3.62Å
299E81.2Confident80.9Confident27 Ų2733.6 Ų33.613%0.12618%0.181CC..Hα-helixtrans-63.4-35.7175.2-16962.7-152.100111.7L30 Q295 L297 M302 P303 S304L30-E299 HydrophobicContact CD1-CG 4.49Å; Q295-E299 WeakPolarHBondContact O-CB 3.32Å; Q295-E299 PolarHBondContact O-N 2.91Å; L297-E299 VanDerWaalsContact C-N 3.34Å; L297-E299 PolarHBondContact O-N 2.81Å; E299-M302 CarbonylContact O-C 3.4Å; E299-P303 VanDerWaalsContact O-CA 3.32Å; E299-P303 WeakPolarHBondContact O-CA 3.33Å; E299-S304 WeakPolarHBondContact OE1-CB 3.48Å; E299-S304 PolarHBondContact OE1-N 2.98Å; E299-S304 PolarHBondContact OE1-OG 2.62Å; E299-S304 VanDerWaalsContact OE2-CB 3.32Å; E299-S304 WeakPolarHBondContact OE2-CB 3.42Å; E299-S304 PolarHBondContact OE2-N 3.23Å; E299-S304 PolarHBondContact OE2-OG 3.02Å
300K83.7Confident80.1Confident102 Ų10238.3 Ų38.344%0.44320%0.199SC..Hα-helixtrans-70.2-39.8176-177.560.5178.5175.80112.4L40 G296 L297 W298 I430 I431L40-K300 HydrophobicContact CD1-CD 4.32Å; G296-K300 WeakPolarHBondContact O-CB 3.4Å; G296-K300 PolarHBondContact O-N 3.24Å; L297-K300 WeakPolarHBondContact O-CB 3.23Å; L297-K300 PolarHBondContact O-N 3.37Å; L297-K300 VanDerWaalsContact O-N 3.11Å; W298-K300 VanDerWaalsContact C-N 3.28Å; W298-K300 PolarHBondContact O-N 2.91Å; K300-I430 HydrophobicContact CB-CG2 4Å; K300-I430 HydrophobicContact CG-CG2 4.07Å; K300-I431 HydrophobicContact CG-CD1 4.16Å; K300-I431 HydrophobicContact CG-CG1 4.41Å
301V86.4Confident79.4Confident37 Ų3738.6 Ų38.622%0.22420%0.201CC..Hα-helixtrans-73.5-40.6179.2173.20000111.3L297 W298 I364L297-V301 HydrophobicContact CD1-CG2 4.32Å; L297-V301 HydrophobicContact CG-CG2 4.41Å; L297-V301 WeakPolarHBondContact O-CG2 3.15Å; L297-V301 PolarHBondContact O-N 3.09Å; W298-V301 PolarHBondContact O-N 3.46Å; V301-I364 HydrophobicContact CB-CD1 4.4Å; V301-I364 HydrophobicContact CG1-CB 4.2Å; V301-I364 HydrophobicContact CG1-CD1 4.24Å
302M83.8Confident78.5Confident44 Ų4438 Ų3822%0.21720%0.198CC..SBendtrans-142.598177.4-173.5169.676.800110.2W298 E299 S304 A307 I364W298-M302 PolarHBondContact O-N 3.09Å; E299-M302 CarbonylContact O-C 3.4Å; M302-S304 PolarHBondContact O-N 3.01Å; M302-A307 HydrophobicContact CE-CB 3.76Å; M302-A307 HydrophobicContact CG-CB 3.69Å; M302-A307 HydrophobicContact SD-CB 3.4Å; M302-A307 WeakPolarHBondContact SD-CB 3.15Å; M302-I364 HydrophobicContact CB-CB 4.09Å; M302-I364 HydrophobicContact CB-CD1 4.27Å; M302-I364 HydrophobicContact CB-CG1 4.2Å; M302-I364 HydrophobicContact CE-CB 4.3Å; M302-I364 HydrophobicContact CE-CG1 3.95Å; M302-I364 HydrophobicContact CE-CG2 3.93Å; M302-I364 HydrophobicContact SD-CB 4.24Å; M302-I364 HydrophobicContact SD-CG2 3.74Å
303P76.9Confident78.2Confident54 Ų5439 Ų3935%0.35121%0.209SC..  trans-58.5131.8179.1-26.435000112E299 Q305 N306E299-P303 VanDerWaalsContact O-CA 3.32Å; E299-P303 WeakPolarHBondContact O-CA 3.33Å; P303-Q305 PolarHBondContact O-N 3.11Å; P303-Q305 VanDerWaalsContact O-N 3.13Å; P303-N306 PolarHBondContact O-N 3.03Å
304S68.9Low78.1Confident28 Ų2839.7 Ų39.720%0.19621%0.213CC..G310 helixtrans-57-28.6-178.253.20000113.8E299 M302 N306E299-S304 WeakPolarHBondContact OE1-CB 3.48Å; E299-S304 PolarHBondContact OE1-N 2.98Å; E299-S304 PolarHBondContact OE1-OG 2.62Å; E299-S304 VanDerWaalsContact OE2-CB 3.32Å; E299-S304 WeakPolarHBondContact OE2-CB 3.42Å; E299-S304 PolarHBondContact OE2-N 3.23Å; E299-S304 PolarHBondContact OE2-OG 3.02Å; M302-S304 PolarHBondContact O-N 3.01Å; S304-N306 PolarHBondContact O-N 3.25Å
305Q66.3Low77.7Confident147 Ų14741 Ų4169%0.68722%0.219SC*.G310 helixtrans-62.6-23.8178-63.4178.7-0.600113.2P303P303-Q305 PolarHBondContact O-N 3.11Å; P303-Q305 VanDerWaalsContact O-N 3.13Å
306N64.5Low77.7Confident138 Ų13840.4 Ų40.474%0.73822%0.217SC*.G310 helixtrans-112.5-8-169-65.9-35000114.4P303 S304P303-N306 PolarHBondContact O-N 3.03Å; S304-N306 PolarHBondContact O-N 3.25Å
307A69.1Low78.1Confident35 Ų3543.8 Ų43.829%0.28924%0.237SC..SBendtrans-153.6158.5-173.100000113.9M302 I309M302-A307 HydrophobicContact CE-CB 3.76Å; M302-A307 HydrophobicContact CG-CB 3.69Å; M302-A307 HydrophobicContact SD-CB 3.4Å; M302-A307 WeakPolarHBondContact SD-CB 3.15Å; A307-I309 WeakPolarHBondContact O-CD1 3.41Å; A307-I309 PolarHBondContact O-N 3.5Å
308V69.4Low78.2Confident48 Ų4843.8 Ų43.829%0.29124%0.237SC..  trans-69.9125.2172.9-177.70000109.4Y310V308-Y310 HydrophobicContact CB-CE2 4.09Å; V308-Y310 HydrophobicContact CG1-CE1 4.31Å; V308-Y310 HydrophobicContact CG1-CE2 3.95Å; V308-Y310 WeakPolarHBondContact O-CD2 3.28Å; V308-Y310 WeakPolarHBondContact O-CE2 3.11Å
309I69.6Low78Confident5 Ų543.8 Ų43.83%0.02624%0.238CC..  trans-89.2133.1-179.7-62.6111.5000111.6H17 Q18 Q154 A307 N311H17-I309 VanDerWaalsContact O-CD1 3.3Å; H17-I309 WeakPolarHBondContact O-CD1 3.37Å; Q18-I309 HydrophobicContact CB-CD1 4.44Å; Q18-I309 VanDerWaalsContact CD-CD1 3.49Å; Q18-I309 HydrophobicContact CG-CB 3.58Å; Q18-I309 HydrophobicContact CG-CD1 3.57Å; Q18-I309 HydrophobicContact CG-CG1 3.82Å; Q18-I309 HydrophobicContact CG-CG2 3.47Å; Q18-I309 VanDerWaalsContact CG-CG2 3.47Å; Q154-I309 PolarHBondContact NE2-O 2.85Å; A307-I309 WeakPolarHBondContact O-CD1 3.41Å; A307-I309 PolarHBondContact O-N 3.5Å; I309-N311 HydrophobicContact CG2-CB 3.75Å; I309-N311 WeakPolarHBondContact CG2-ND2 3.38Å; I309-N311 WeakPolarHBondContact CG2-OD1 3.3Å
310Y78.8Confident78.3Confident99 Ų9947 Ų4739%0.38826%0.255SS..  trans-11415.3178.3-64.5-80.8000113.3V308 G312 G313 V314 W365V308-Y310 HydrophobicContact CB-CE2 4.09Å; V308-Y310 HydrophobicContact CG1-CE1 4.31Å; V308-Y310 HydrophobicContact CG1-CE2 3.95Å; V308-Y310 WeakPolarHBondContact O-CD2 3.28Å; V308-Y310 WeakPolarHBondContact O-CE2 3.11Å; Y310-G312 VanDerWaalsContact C-N 3.29Å; Y310-G312 PolarHBondContact O-N 2.84Å; Y310-G313 WeakPolarHBondContact O-CA 3.37Å; Y310-G313 PolarHBondContact O-N 2.75Å; Y310-V314 WeakPolarHBondContact O-CG2 3.47Å; Y310-V314 PolarHBondContact O-N 2.87Å; Y310-W365 HydrophobicContact CD2-CH2 4.07Å; Y310-W365 HydrophobicContact CE2-CH2 4.21Å; Y310-W365 HydrophobicContact CE2-CZ2 4.45Å
311N79.6Confident78.7Confident7 Ų745.8 Ų45.84%0.03725%0.254CS..Hα-helixtrans-50.4-45.1-175.8-67.2-3.9000112.8W298 I309 V314 E315 Y368W298-N311 HydrophobicContact CE3-CB 3.98Å; W298-N311 HydrophobicContact CZ3-CB 3.94Å; I309-N311 HydrophobicContact CG2-CB 3.75Å; I309-N311 WeakPolarHBondContact CG2-ND2 3.38Å; I309-N311 WeakPolarHBondContact CG2-OD1 3.3Å; N311-V314 PolarHBondContact O-N 3.44Å; N311-E315 WeakPolarHBondContact O-CG 3.36Å; N311-E315 PolarHBondContact O-N 3.35Å; N311-Y368 WeakPolarHBondContact OD1-CE1 3.45Å; N311-Y368 PolarHBondContact OD1-OH 3.33Å
312G71.3Confident78.9Confident2 Ų244 Ų442%0.02124%0.243CC..Hα-helixtrans-70.3-35.6179.800000112.7T19 Y310 V314 E315 A316T19-G312 PolarHBondContact OG1-N 2.83Å; Y310-G312 VanDerWaalsContact C-N 3.29Å; Y310-G312 PolarHBondContact O-N 2.84Å; G312-V314 VanDerWaalsContact C-N 3.33Å; G312-V314 PolarHBondContact O-N 2.87Å; G312-E315 PolarHBondContact O-N 3.39Å; G312-A316 WeakPolarHBondContact O-CB 3.42Å; G312-A316 PolarHBondContact O-N 3.39Å
313G78.1Confident78.9Confident23 Ų2343.2 Ų43.224%0.23724%0.243CC..Hα-helixtrans-59.9-42.5170.100000112.5Y310 A316 V317Y310-G313 WeakPolarHBondContact O-CA 3.37Å; Y310-G313 PolarHBondContact O-N 2.75Å; G313-A316 WeakPolarHBondContact O-CB 3.44Å; G313-A316 PolarHBondContact O-N 3.25Å; G313-V317 WeakPolarHBondContact O-CB 3.32Å; G313-V317 VanDerWaalsContact O-CG2 3.27Å; G313-V317 WeakPolarHBondContact O-CG2 3.11Å; G313-V317 PolarHBondContact O-N 2.69Å
314V87.3Confident79.4Confident14 Ų1443.7 Ų43.79%0.08525%0.248CC..Hα-helixtrans-65-43.1177.6176.50000111.1W298 Y310 N311 G312 V317 S318 Y368 Y371 V372W298-V314 HydrophobicContact CZ2-CG1 4.39Å; Y310-V314 WeakPolarHBondContact O-CG2 3.47Å; Y310-V314 PolarHBondContact O-N 2.87Å; N311-V314 PolarHBondContact O-N 3.44Å; G312-V314 VanDerWaalsContact C-N 3.33Å; G312-V314 PolarHBondContact O-N 2.87Å; V314-V317 PolarHBondContact O-N 2.95Å; V314-S318 VanDerWaalsContact O-CB 3.29Å; V314-S318 WeakPolarHBondContact O-CB 3.29Å; V314-S318 PolarHBondContact O-N 3.4Å; V314-S318 PolarHBondContact O-OG 3.26Å; V314-Y368 HydrophobicContact CB-CD1 4.32Å; V314-Y368 HydrophobicContact CB-CG 4.4Å; V314-Y368 HydrophobicContact CG1-CD1 4.08Å; V314-Y368 HydrophobicContact CG1-CG 4.23Å; V314-Y368 HydrophobicContact CG2-CD1 3.66Å; V314-Y368 HydrophobicContact CG2-CD2 3.5Å; V314-Y368 HydrophobicContact CG2-CE1 4Å; V314-Y368 HydrophobicContact CG2-CE2 3.87Å; V314-Y368 HydrophobicContact CG2-CG 3.38Å; V314-Y371 HydrophobicContact CG1-CD1 3.83Å; V314-Y371 HydrophobicContact CG1-CE1 4.45Å; V314-V372 HydrophobicContact CG1-CG2 3.89Å
315E80.4Confident80.4Confident28 Ų2843.6 Ų43.613%0.13125%0.248CC..Hα-helixtrans-62.3-42.5174.2-69.5-67.1178.500112.1N311 G312 S318 T319 Y371 R375N311-E315 WeakPolarHBondContact O-CG 3.36Å; N311-E315 PolarHBondContact O-N 3.35Å; G312-E315 PolarHBondContact O-N 3.39Å; E315-S318 WeakPolarHBondContact CA-OG 3.42Å; E315-S318 PolarHBondContact O-N 3.42Å; E315-S318 PolarHBondContact O-OG 3.15Å; E315-T319 WeakPolarHBondContact O-CB 3.48Å; E315-T319 PolarHBondContact O-N 2.92Å; E315-T319 PolarHBondContact O-OG1 3.5Å; E315-Y371 VanDerWaalsContact CD-OH 3.31Å; E315-Y371 PolarHBondContact OE1-OH 2.95Å; E315-Y371 PolarHBondContact OE2-OH 3.41Å; E315-R375 IonicContact OE2-CZ 2.74Å; E315-R375 IonicContact OE2-NH1 3.71Å; E315-R375 PolarHBondContact OE2-NH1 3.12Å
316A80.6Confident81.3Confident7 Ų738.2 Ų38.26%0.05823%0.226CC..Hα-helixtrans-61.3-50.5175.700000111.9V151 G312 G313 S318 T319 L320V151-A316 HydrophobicContact CG2-CB 3.84Å; G312-A316 WeakPolarHBondContact O-CB 3.42Å; G312-A316 PolarHBondContact O-N 3.39Å; G313-A316 WeakPolarHBondContact O-CB 3.44Å; G313-A316 PolarHBondContact O-N 3.25Å; A316-S318 PolarHBondContact O-N 3.28Å; A316-T319 PolarHBondContact O-N 3.44Å; A316-L320 WeakPolarHBondContact O-CB 3.48Å; A316-L320 PolarHBondContact O-N 3Å
317V89.6Confident82.3Confident71 Ų7138.4 Ų38.443%0.4322%0.22SC..Hα-helixtrans-61.3-46.4179.6169.20000110.3G313 V314 T319 L320 L321 V372G313-V317 WeakPolarHBondContact O-CB 3.32Å; G313-V317 VanDerWaalsContact O-CG2 3.27Å; G313-V317 WeakPolarHBondContact O-CG2 3.11Å; G313-V317 PolarHBondContact O-N 2.69Å; V314-V317 PolarHBondContact O-N 2.95Å; V317-T319 VanDerWaalsContact C-N 3.32Å; V317-T319 PolarHBondContact O-N 3.24Å; V317-L320 PolarHBondContact O-N 3.27Å; V317-L321 HydrophobicContact CG1-CD1 3.6Å; V317-L321 HydrophobicContact CG1-CG 4.13Å; V317-L321 VanDerWaalsContact O-CB 3.29Å; V317-L321 WeakPolarHBondContact O-CB 3.45Å; V317-L321 VanDerWaalsContact O-CG 3.26Å; V317-L321 WeakPolarHBondContact O-CG 3.3Å; V317-L321 PolarHBondContact O-N 2.99Å; V317-V372 HydrophobicContact CG1-CG1 4.36Å; V317-V372 HydrophobicContact CG1-CG2 4.46Å
318S89.4Confident83Confident0 Ų039.1 Ų39.10%023%0.226CC..Hα-helixtrans-62.1-38.8178.672.30000112.6V314 E315 A316 G322 R375V314-S318 VanDerWaalsContact O-CB 3.29Å; V314-S318 WeakPolarHBondContact O-CB 3.29Å; V314-S318 PolarHBondContact O-N 3.4Å; V314-S318 PolarHBondContact O-OG 3.26Å; E315-S318 WeakPolarHBondContact CA-OG 3.42Å; E315-S318 PolarHBondContact O-N 3.42Å; E315-S318 PolarHBondContact O-OG 3.15Å; A316-S318 PolarHBondContact O-N 3.28Å; S318-G322 WeakPolarHBondContact O-CA 3.43Å; S318-G322 PolarHBondContact O-N 3.17Å; S318-R375 VanDerWaalsContact OG-CD 3.32Å; S318-R375 WeakPolarHBondContact OG-CD 3.27Å; S318-R375 PolarHBondContact OG-NE 2.87Å
319T83.9Confident83.7Confident4 Ų438 Ų383%0.02522%0.219CC..Hα-helixtrans-69.7-45.6178-59.20000111.4L143 F146 E315 A316 V317 G322 A323 R375L143-T319 HydrophobicContact CD2-CG2 3.76Å; F146-T319 HydrophobicContact CB-CG2 4.07Å; E315-T319 WeakPolarHBondContact O-CB 3.48Å; E315-T319 PolarHBondContact O-N 2.92Å; E315-T319 PolarHBondContact O-OG1 3.5Å; A316-T319 PolarHBondContact O-N 3.44Å; V317-T319 VanDerWaalsContact C-N 3.32Å; V317-T319 PolarHBondContact O-N 3.24Å; T319-G322 PolarHBondContact O-N 3.37Å; T319-A323 WeakPolarHBondContact O-CB 3.46Å; T319-A323 PolarHBondContact O-N 2.87Å; T319-R375 PolarHBondContact OG1-NH2 3.07Å
320L87.7Confident83.9Confident93 Ų9341 Ų4149%0.48725%0.252SS..Hα-helixtrans-65.5-47179.4-179.364.9000112T147 A316 V317 A323 S324T147-L320 HydrophobicContact CG2-CB 4.43Å; A316-L320 WeakPolarHBondContact O-CB 3.48Å; A316-L320 PolarHBondContact O-N 3Å; V317-L320 PolarHBondContact O-N 3.27Å; L320-A323 PolarHBondContact O-N 2.8Å; L320-S324 WeakPolarHBondContact O-CB 3.45Å; L320-S324 PolarHBondContact O-N 2.79Å; L320-S324 PolarHBondContact O-OG 2.72Å
321L91.9Very high84Confident78 Ų7844.2 Ų44.241%0.40826%0.264SS..Hα-helixtrans-67.4-38.4177.4-66.9-179.5000111.2V317 S324 A325 V372 I376V317-L321 HydrophobicContact CG1-CD1 3.6Å; V317-L321 HydrophobicContact CG1-CG 4.13Å; V317-L321 VanDerWaalsContact O-CB 3.29Å; V317-L321 WeakPolarHBondContact O-CB 3.45Å; V317-L321 VanDerWaalsContact O-CG 3.26Å; V317-L321 WeakPolarHBondContact O-CG 3.3Å; V317-L321 PolarHBondContact O-N 2.99Å; L321-S324 PolarHBondContact O-N 3.43Å; L321-A325 WeakPolarHBondContact O-CB 3.31Å; L321-A325 PolarHBondContact O-N 3.29Å; L321-V372 HydrophobicContact CD1-CG1 3.96Å; L321-I376 HydrophobicContact CB-CD1 3.58Å; L321-I376 HydrophobicContact CB-CG1 3.94Å; L321-I376 HydrophobicContact CD1-CD1 4.01Å; L321-I376 HydrophobicContact CG-CD1 4.46Å
322G89.4Confident84.1Confident0 Ų048 Ų480%028%0.284CS..Hα-helixtrans-61-45.9173.700000112.2S318 T319 S324 A325 V326S318-G322 WeakPolarHBondContact O-CA 3.43Å; S318-G322 PolarHBondContact O-N 3.17Å; T319-G322 PolarHBondContact O-N 3.37Å; G322-S324 PolarHBondContact O-N 2.92Å; G322-A325 PolarHBondContact O-N 3.31Å; G322-V326 WeakPolarHBondContact O-CB 3.35Å; G322-V326 VanDerWaalsContact O-CG2 3.27Å; G322-V326 WeakPolarHBondContact O-CG2 3.3Å; G322-V326 PolarHBondContact O-N 3.39Å
323A84.3Confident84.5Confident26 Ų2658 Ų5822%0.21533%0.327CS..Hα-helixtrans-60.9-4417500000112.1L143 T319 L320 V326 F327L143-A323 HydrophobicContact CD1-CB 3.9Å; L143-A323 HydrophobicContact CD2-CB 4.49Å; T319-A323 WeakPolarHBondContact O-CB 3.46Å; T319-A323 PolarHBondContact O-N 2.87Å; L320-A323 PolarHBondContact O-N 2.8Å; A323-V326 PolarHBondContact O-N 3.3Å; A323-F327 PolarHBondContact O-N 3.16Å
324S87.9Confident84.6Confident65 Ų6560.2 Ų60.246%0.45533%0.333SS..Hα-helixtrans-63.2-42.8178.1-55.90000111.8L320 L321 G322 F327 A328L320-S324 WeakPolarHBondContact O-CB 3.45Å; L320-S324 PolarHBondContact O-N 2.79Å; L320-S324 PolarHBondContact O-OG 2.72Å; L321-S324 PolarHBondContact O-N 3.43Å; G322-S324 PolarHBondContact O-N 2.92Å; S324-F327 PolarHBondContact O-N 3.37Å; S324-A328 PolarHBondContact O-N 2.71Å
325A89.8Confident84.4Confident25 Ų2562.7 Ų62.721%0.20735%0.351CS..Hα-helixtrans-65.5-42.2176.400000111.7L321 G322 F327 A328 V329 I376 V380L321-A325 WeakPolarHBondContact O-CB 3.31Å; L321-A325 PolarHBondContact O-N 3.29Å; G322-A325 PolarHBondContact O-N 3.31Å; A325-F327 VanDerWaalsContact C-N 3.33Å; A325-F327 PolarHBondContact O-N 3.37Å; A325-A328 WeakPolarHBondContact O-CB 3.22Å; A325-A328 PolarHBondContact O-N 2.95Å; A325-V329 VanDerWaalsContact O-CG2 3.31Å; A325-V329 WeakPolarHBondContact O-CG2 3.33Å; A325-V329 PolarHBondContact O-N 2.76Å; A325-I376 HydrophobicContact CB-CG2 3.81Å; A325-V380 HydrophobicContact CB-CG2 3.55Å
326V85.9Confident84.6Confident35 Ų3563.1 Ų63.121%0.21235%0.351CS..Hα-helixtrans-61.4-41.3174.5167.10000111.6G322 A323 A328 V329 M379 V380 T383G322-V326 WeakPolarHBondContact O-CB 3.35Å; G322-V326 VanDerWaalsContact O-CG2 3.27Å; G322-V326 WeakPolarHBondContact O-CG2 3.3Å; G322-V326 PolarHBondContact O-N 3.39Å; A323-V326 PolarHBondContact O-N 3.3Å; V326-A328 VanDerWaalsContact C-N 3.34Å; V326-A328 PolarHBondContact O-N 3.28Å; V326-V329 WeakPolarHBondContact O-CB 3.47Å; V326-V329 PolarHBondContact O-N 3.27Å; V326-M379 HydrophobicContact CG2-CB 4.2Å; V326-M379 VanDerWaalsContact CG2-O 3.27Å; V326-M379 WeakPolarHBondContact CG2-O 3.32Å; V326-V380 HydrophobicContact CG2-CG2 4.46Å; V326-T383 HydrophobicContact CG1-CG2 3.72Å; V326-T383 WeakPolarHBondContact CG2-OG1 3.25Å
327F84.2Confident84.5Confident141 Ų14167.6 Ų67.662%0.61838%0.382SS*.Hα-helixtrans-61.7-43.4174.7-176-100.4000111.5A323 S324 A325 V329 G330 Y331A323-F327 PolarHBondContact O-N 3.16Å; S324-F327 PolarHBondContact O-N 3.37Å; A325-F327 VanDerWaalsContact C-N 3.33Å; A325-F327 PolarHBondContact O-N 3.37Å; F327-V329 VanDerWaalsContact C-N 3.3Å; F327-V329 PolarHBondContact O-N 3.16Å; F327-G330 PolarHBondContact O-N 3.31Å; F327-G330 VanDerWaalsContact O-N 3.16Å; F327-Y331 AromaticContact CD1-CE2 3.93Å; F327-Y331 HydrophobicContact CD1-CE2 3.93Å; F327-Y331 AromaticContact CE1-CE2 3.51Å; F327-Y331 HydrophobicContact CE1-CE2 3.51Å; F327-Y331 AromaticContact CZ-CE2 3.86Å; F327-Y331 HydrophobicContact CZ-CE2 3.86Å; F327-Y331 VanDerWaalsContact CZ-OH 3.26Å; F327-Y331 WeakPolarHBondContact CZ-OH 3.28Å; F327-Y331 WeakPolarHBondContact O-CD2 3.49Å
328A85.3Confident84.1Confident51 Ų5167.8 Ų67.842%0.42138%0.384SS..Hα-helixtrans-61.7-34.7177.200000113.1S324 A325 V326 G330 Y331S324-A328 PolarHBondContact O-N 2.71Å; A325-A328 WeakPolarHBondContact O-CB 3.22Å; A325-A328 PolarHBondContact O-N 2.95Å; V326-A328 VanDerWaalsContact C-N 3.34Å; V326-A328 PolarHBondContact O-N 3.28Å; A328-G330 PolarHBondContact O-N 3.11Å; A328-Y331 PolarHBondContact O-N 3.07Å
329V82.3Confident84Confident24 Ų2474.2 Ų74.215%0.14541%0.408CS..Hα-helixtrans-58.6-32.1176.51710000112.1A325 V326 F327 Y331 I332 V380 I384A325-V329 VanDerWaalsContact O-CG2 3.31Å; A325-V329 WeakPolarHBondContact O-CG2 3.33Å; A325-V329 PolarHBondContact O-N 2.76Å; V326-V329 WeakPolarHBondContact O-CB 3.47Å; V326-V329 PolarHBondContact O-N 3.27Å; F327-V329 VanDerWaalsContact C-N 3.3Å; F327-V329 PolarHBondContact O-N 3.16Å; V329-Y331 PolarHBondContact O-N 2.96Å; V329-Y331 VanDerWaalsContact O-N 3.09Å; V329-I332 HydrophobicContact CG2-CD1 4.38Å; V329-I332 PolarHBondContact O-N 2.86Å; V329-V380 HydrophobicContact CG2-CB 4.4Å; V329-V380 HydrophobicContact CG2-CG1 3.65Å; V329-V380 HydrophobicContact CG2-CG2 4.13Å; V329-I384 HydrophobicContact CG1-CD1 4.09Å; V329-I384 HydrophobicContact CG1-CG1 3.63Å
330G75.3Confident84.3Confident69 Ų6974.2 Ų74.271%0.71141%0.408SS*.THydrogen-bonded Turntrans-59.7-19.5176.300000114.2F327 A328F327-G330 PolarHBondContact O-N 3.31Å; F327-G330 VanDerWaalsContact O-N 3.16Å; A328-G330 PolarHBondContact O-N 3.11Å
331Y79.9Confident84.4Confident165 Ų16571.8 Ų71.865%0.64740%0.395SS*.THydrogen-bonded Turntrans-96.8-9.4177.3-60.4-85.6000113.5F327 A328 V329 K333F327-Y331 AromaticContact CD1-CE2 3.93Å; F327-Y331 HydrophobicContact CD1-CE2 3.93Å; F327-Y331 AromaticContact CE1-CE2 3.51Å; F327-Y331 HydrophobicContact CE1-CE2 3.51Å; F327-Y331 AromaticContact CZ-CE2 3.86Å; F327-Y331 HydrophobicContact CZ-CE2 3.86Å; F327-Y331 VanDerWaalsContact CZ-OH 3.26Å; F327-Y331 WeakPolarHBondContact CZ-OH 3.28Å; F327-Y331 WeakPolarHBondContact O-CD2 3.49Å; A328-Y331 PolarHBondContact O-N 3.07Å; V329-Y331 PolarHBondContact O-N 2.96Å; V329-Y331 VanDerWaalsContact O-N 3.09Å; Y331-K333 PolarHBondContact O-N 2.69Å
332I81.4Confident84.4Confident86 Ų8670 Ų7044%0.44139%0.387SS..  trans-81.8110.2-177.4-57.1178.8000109.7V329 L334V329-I332 HydrophobicContact CG2-CD1 4.38Å; V329-I332 PolarHBondContact O-N 2.86Å; I332-L334 VanDerWaalsContact C-N 3.31Å; I332-L334 HydrophobicContact CG2-CB 4.02Å; I332-L334 HydrophobicContact CG2-CD1 4.12Å; I332-L334 PolarHBondContact O-N 3.24Å; I332-L334 VanDerWaalsContact O-N 3.14Å
333K80Confident84.5Confident213 Ų21371.3 Ų71.393%0.92640%0.395SS*.  trans-86.665173.8-63.5-176.2-179.4179.80111.4Y331Y331-K333 PolarHBondContact O-N 2.69Å
334L80.2Confident85.1Confident70 Ų7070 Ų7037%0.36638%0.384SS..  trans-91.3140.9174.3-130.372.9000111.2I332 W336 W339I332-L334 VanDerWaalsContact C-N 3.31Å; I332-L334 HydrophobicContact CG2-CB 4.02Å; I332-L334 HydrophobicContact CG2-CD1 4.12Å; I332-L334 PolarHBondContact O-N 3.24Å; I332-L334 VanDerWaalsContact O-N 3.14Å; L334-W336 HydrophobicContact CB-CZ2 4.31Å; L334-W336 HydrophobicContact CD2-CZ3 4.42Å; L334-W336 VanDerWaalsContact O-CD1 3.29Å; L334-W336 PolarHBondContact O-N 3.05Å; L334-W339 HydrophobicContact CD2-CB 3.64Å; L334-W339 HydrophobicContact CD2-CG 4.06Å; L334-W339 HydrophobicContact CG-CB 4.28Å; L334-W339 HydrophobicContact CG-CG 4.36Å
335S84.2Confident85.4Confident66 Ų6668.8 Ų68.846%0.46237%0.371SS..  trans-76.688.7169.5540000109.9S337 T338 W339S335-S337 PolarHBondContact O-N 3.28Å; S335-S337 VanDerWaalsContact O-N 3.08Å; S335-T338 PolarHBondContact O-N 3.17Å; S335-W339 PolarHBondContact O-N 3.33Å
336W83.9Confident85.7Confident36 Ų3671.7 Ų71.714%0.13638%0.383CS..Hα-helixtrans-58.4-23.5-178-64.8107.3000114W276 L334 T338 G340 T343 I384 Q388W276-W336 AromaticContact CH2-CE3 3.98Å; W276-W336 HydrophobicContact CH2-CE3 3.98Å; W276-W336 HydrophobicContact CH2-CZ3 4.4Å; W276-W336 HydrophobicContact CZ2-CB 4.42Å; W276-W336 HydrophobicContact CZ2-CE3 4.11Å; L334-W336 HydrophobicContact CB-CZ2 4.31Å; L334-W336 HydrophobicContact CD2-CZ3 4.42Å; L334-W336 VanDerWaalsContact O-CD1 3.29Å; L334-W336 PolarHBondContact O-N 3.05Å; W336-T338 VanDerWaalsContact C-N 3.25Å; W336-T338 PolarHBondContact O-N 3.43Å; W336-G340 VanDerWaalsContact O-CA 3.23Å; W336-G340 WeakPolarHBondContact O-CA 3.34Å; W336-G340 PolarHBondContact O-N 3.41Å; W336-T343 HydrophobicContact CZ3-CG2 4.26Å; W336-I384 HydrophobicContact CD2-CG2 3.82Å; W336-I384 HydrophobicContact CE3-CG2 3.68Å; W336-I384 HydrophobicContact CH2-CB 4.44Å; W336-I384 HydrophobicContact CH2-CD1 3.33Å; W336-I384 HydrophobicContact CH2-CG1 3.83Å; W336-I384 HydrophobicContact CH2-CG2 3.76Å; W336-I384 HydrophobicContact CZ2-CD1 3.91Å; W336-I384 HydrophobicContact CZ2-CG1 3.92Å; W336-I384 HydrophobicContact CZ2-CG2 3.86Å; W336-I384 HydrophobicContact CZ3-CD1 3.96Å; W336-I384 HydrophobicContact CZ3-CG1 4.48Å; W336-I384 HydrophobicContact CZ3-CG2 3.67Å; W336-Q388 VanDerWaalsContact CB-CD 3.47Å; W336-Q388 HydrophobicContact CB-CG 4.2Å; W336-Q388 HydrophobicContact CG-CG 4.29Å
337S78.9Confident86.3Confident102 Ų10271.3 Ų71.371%0.71338%0.381SS*.Hα-helixtrans-66.2-22.6171.6-1790000114.1S335 K459S335-S337 PolarHBondContact O-N 3.28Å; S335-S337 VanDerWaalsContact O-N 3.08Å; S337-K459 PolarHBondContact O-NZ 3.41Å
338T80.2Confident86.9Confident75 Ų7564.6 Ų64.646%0.4635%0.352SS..Hα-helixtrans-105.6-44178.7-61.50000112S335 W336 K459S335-T338 PolarHBondContact O-N 3.17Å; W336-T338 VanDerWaalsContact C-N 3.25Å; W336-T338 PolarHBondContact O-N 3.43Å; T338-K459 PolarHBondContact OG1-NZ 3.39Å
339W87.4Confident87.5Confident135 Ų13566.1 Ų66.151%0.51135%0.352SS..Hα-helixtrans-96.5-8.2-173.6-6995.3000114.1L334 S335 V342 T343L334-W339 HydrophobicContact CD2-CB 3.64Å; L334-W339 HydrophobicContact CD2-CG 4.06Å; L334-W339 HydrophobicContact CG-CB 4.28Å; L334-W339 HydrophobicContact CG-CG 4.36Å; S335-W339 PolarHBondContact O-N 3.33Å; W339-V342 HydrophobicContact CE3-CG1 4.46Å; W339-V342 PolarHBondContact O-N 2.88Å; W339-T343 VanDerWaalsContact O-CB 3.3Å; W339-T343 WeakPolarHBondContact O-CB 3.47Å; W339-T343 PolarHBondContact O-N 3.39Å; W339-T343 PolarHBondContact O-OG1 3.09Å
340G89.9Confident88.3Confident3 Ų369.6 Ų69.63%0.03137%0.369CS..Hα-helixtrans-54.9-58.1-176.200000112.7W336 V342 T343 L344W336-G340 VanDerWaalsContact O-CA 3.23Å; W336-G340 WeakPolarHBondContact O-CA 3.34Å; W336-G340 PolarHBondContact O-N 3.41Å; G340-V342 PolarHBondContact O-N 3.25Å; G340-T343 WeakPolarHBondContact O-CB 3.26Å; G340-T343 PolarHBondContact O-N 3.02Å; G340-T343 VanDerWaalsContact O-N 3.15Å; G340-L344 WeakPolarHBondContact O-CG 3.38Å; G340-L344 PolarHBondContact O-N 2.63Å
341E90.3Very high89.4Confident43 Ų4366.3 Ų66.320%0.20134%0.335CS..Hα-helixtrans-62.1-41.3-177.3-66.3179167.600113T343 L344 F345 G452 S455E341-T343 VanDerWaalsContact C-N 3.33Å; E341-T343 PolarHBondContact O-N 3.28Å; E341-L344 PolarHBondContact O-N 3.37Å; E341-F345 PolarHBondContact O-N 2.87Å; E341-G452 VanDerWaalsContact OE2-CA 3.3Å; E341-G452 WeakPolarHBondContact OE2-CA 3.12Å; E341-G452 PolarHBondContact OE2-N 3.08Å; E341-S455 VanDerWaalsContact CD-OG 3.32Å; E341-S455 PolarHBondContact OE1-OG 3.21Å; E341-S455 WeakPolarHBondContact OE2-CB 3.39Å; E341-S455 PolarHBondContact OE2-OG 3.34Å
342V91Very high90.3Very high40 Ų4058.8 Ų58.824%0.24231%0.307CS..Hα-helixtrans-64.4-40.6176.5178.70000110.9W339 G340 F345 L346W339-V342 HydrophobicContact CE3-CG1 4.46Å; W339-V342 PolarHBondContact O-N 2.88Å; G340-V342 PolarHBondContact O-N 3.25Å; V342-F345 PolarHBondContact O-N 3.25Å; V342-L346 HydrophobicContact CG1-CD1 3.95Å; V342-L346 HydrophobicContact CG1-CG 4.39Å; V342-L346 WeakPolarHBondContact O-CG 3.32Å; V342-L346 PolarHBondContact O-N 3.31Å
343T93Very high91.1Very high27 Ų2756.8 Ų56.817%0.16630%0.304CS..Hα-helixtrans-65.2-45176.4-54.70000110.7W336 W339 G340 E341 F345 L346 C347 L381W336-T343 HydrophobicContact CZ3-CG2 4.26Å; W339-T343 VanDerWaalsContact O-CB 3.3Å; W339-T343 WeakPolarHBondContact O-CB 3.47Å; W339-T343 PolarHBondContact O-N 3.39Å; W339-T343 PolarHBondContact O-OG1 3.09Å; G340-T343 WeakPolarHBondContact O-CB 3.26Å; G340-T343 PolarHBondContact O-N 3.02Å; G340-T343 VanDerWaalsContact O-N 3.15Å; E341-T343 VanDerWaalsContact C-N 3.33Å; E341-T343 PolarHBondContact O-N 3.28Å; T343-F345 VanDerWaalsContact C-N 3.32Å; T343-F345 PolarHBondContact O-N 2.92Å; T343-L346 PolarHBondContact O-N 3.01Å; T343-C347 VanDerWaalsContact O-CB 3.24Å; T343-C347 WeakPolarHBondContact O-CB 3.22Å; T343-C347 PolarHBondContact O-N 3.37Å; T343-C347 PolarHBondContact O-SG 2.9Å; T343-L381 HydrophobicContact CG2-CD2 3.97Å
344L95.3Very high91.9Very high0 Ų046.9 Ų46.90%026%0.262CS..Hα-helixtrans-58.5-44.1176.2-69.4-178.9000111.5W276 W279 G340 E341 S348 L381 F448W276-L344 HydrophobicContact CD2-CD1 4.46Å; W276-L344 HydrophobicContact CE3-CD1 4.06Å; W276-L344 HydrophobicContact CE3-CD2 3.95Å; W276-L344 HydrophobicContact CE3-CG 4.35Å; W276-L344 HydrophobicContact CH2-CD2 4.2Å; W276-L344 HydrophobicContact CH2-CG 4.28Å; W276-L344 HydrophobicContact CZ3-CD1 4.15Å; W276-L344 HydrophobicContact CZ3-CD2 3.47Å; W276-L344 VanDerWaalsContact CZ3-CD2 3.47Å; W276-L344 HydrophobicContact CZ3-CG 3.94Å; W279-L344 HydrophobicContact CB-CD1 3.91Å; W279-L344 HydrophobicContact CB-CD2 4.16Å; W279-L344 HydrophobicContact CD2-CD2 3.45Å; W279-L344 VanDerWaalsContact CD2-CD2 3.45Å; W279-L344 HydrophobicContact CE3-CD2 4.01Å; W279-L344 HydrophobicContact CG-CD1 4.04Å; W279-L344 HydrophobicContact CG-CD2 3.46Å; W279-L344 VanDerWaalsContact CG-CD2 3.46Å; W279-L344 HydrophobicContact CG-CG 4.19Å; G340-L344 WeakPolarHBondContact O-CG 3.38Å; G340-L344 PolarHBondContact O-N 2.63Å; E341-L344 PolarHBondContact O-N 3.37Å; L344-S348 WeakPolarHBondContact O-CB 3.32Å; L344-S348 PolarHBondContact O-N 3.48Å; L344-S348 PolarHBondContact O-OG 2.85Å; L344-L381 HydrophobicContact CD2-CD2 4.3Å; L344-F448 HydrophobicContact CB-CB 4.19Å; L344-F448 HydrophobicContact CB-CD1 3.91Å; L344-F448 HydrophobicContact CB-CG 3.94Å; L344-F448 HydrophobicContact CD1-CD1 3.65Å; L344-F448 HydrophobicContact CD1-CE1 3.62Å; L344-F448 HydrophobicContact CD1-CG 4.44Å; L344-F448 HydrophobicContact CD1-CZ 4.4Å; L344-F448 HydrophobicContact CG-CD1 4.45Å
345F95.6Very high92.8Very high39 Ų3943.6 Ų43.617%0.17125%0.245CC..Hα-helixtrans-58.9-60.2173.8158.5-117.5000112.1E341 V342 T343 C347 S348 L349 S445 F448 L449E341-F345 PolarHBondContact O-N 2.87Å; V342-F345 PolarHBondContact O-N 3.25Å; T343-F345 VanDerWaalsContact C-N 3.32Å; T343-F345 PolarHBondContact O-N 2.92Å; F345-C347 PolarHBondContact O-N 2.87Å; F345-S348 PolarHBondContact O-N 3.09Å; F345-L349 HydrophobicContact CE2-CD2 4.33Å; F345-L349 HydrophobicContact CZ-CD2 4.22Å; F345-L349 PolarHBondContact O-N 3.34Å; F345-S445 WeakPolarHBondContact CD2-O 3.31Å; F345-S445 WeakPolarHBondContact CD2-OG 3.43Å; F345-S445 VanDerWaalsContact CE2-OG 3.28Å; F345-S445 WeakPolarHBondContact CE2-OG 3.12Å; F345-S445 PolarHBondContact O-OG 2.79Å; F345-F448 HydrophobicContact CB-CB 4.22Å; F345-L449 HydrophobicContact CD1-CD1 4.04Å; F345-L449 HydrophobicContact CD2-CB 3.61Å; F345-L449 HydrophobicContact CD2-CD1 4.26Å; F345-L449 HydrophobicContact CD2-CG 4.34Å; F345-L449 HydrophobicContact CE1-CD1 3.92Å; F345-L449 HydrophobicContact CE2-CB 3.91Å; F345-L449 HydrophobicContact CE2-CD1 4.14Å; F345-L449 HydrophobicContact CE2-CD2 3.97Å; F345-L449 HydrophobicContact CE2-CG 4.22Å; F345-L449 HydrophobicContact CG-CB 4.05Å; F345-L449 HydrophobicContact CG-CD1 4.21Å; F345-L449 HydrophobicContact CZ-CD1 3.97Å; F345-L449 HydrophobicContact CZ-CD2 4.2Å; F345-L449 HydrophobicContact CZ-CG 4.48Å
346L96.2Very high93.4Very high86 Ų8646.2 Ų46.245%0.4525%0.245SC..Hα-helixtrans-60.7-45.4-173.2-72174000111.7V342 T343 L349 L350V342-L346 HydrophobicContact CG1-CD1 3.95Å; V342-L346 HydrophobicContact CG1-CG 4.39Å; V342-L346 WeakPolarHBondContact O-CG 3.32Å; V342-L346 PolarHBondContact O-N 3.31Å; T343-L346 PolarHBondContact O-N 3.01Å; L346-L349 WeakPolarHBondContact O-CB 3.36Å; L346-L349 PolarHBondContact O-N 2.86Å; L346-L350 WeakPolarHBondContact O-CG 3.46Å; L346-L350 PolarHBondContact O-N 3.5Å
347C97.1Very high94Very high27 Ų2747.6 Ų47.618%0.18225%0.254CS..Hα-helixtrans-72-33-179.4-69.80000112.3T343 F345 L349 L350 I351 I377 L381T343-C347 VanDerWaalsContact O-CB 3.24Å; T343-C347 WeakPolarHBondContact O-CB 3.22Å; T343-C347 PolarHBondContact O-N 3.37Å; T343-C347 PolarHBondContact O-SG 2.9Å; F345-C347 PolarHBondContact O-N 2.87Å; C347-L349 VanDerWaalsContact C-N 3.33Å; C347-L350 PolarHBondContact O-N 3.43Å; C347-I351 WeakPolarHBondContact O-CG1 3.19Å; C347-I351 PolarHBondContact O-N 3.41Å; C347-I377 HydrophobicContact CB-CG2 3.62Å; C347-L381 HydrophobicContact CB-CD1 3.45Å; C347-L381 VanDerWaalsContact CB-CD1 3.45Å; C347-L381 HydrophobicContact CB-CD2 4.01Å; C347-L381 HydrophobicContact CB-CG 3.95Å
348S98.1Very high94.8Very high0 Ų042.7 Ų42.70%022%0.22CC..Hα-helixtrans-67.2-35.2171.8-57.40000111.8W279 L344 F345 I351 A352W279-S348 PolarHBondContact NE1-OG 2.58Å; L344-S348 WeakPolarHBondContact O-CB 3.32Å; L344-S348 PolarHBondContact O-N 3.48Å; L344-S348 PolarHBondContact O-OG 2.85Å; F345-S348 PolarHBondContact O-N 3.09Å; S348-I351 PolarHBondContact O-N 2.92Å; S348-A352 PolarHBondContact O-N 3.41Å
349L98Very high95.3Very high82 Ų8240.1 Ų40.143%0.42920%0.204SC..Hα-helixtrans-64.1-44.3172.5-174.361.3000111.7F345 L346 C347 I351 A352 A353 S445F345-L349 HydrophobicContact CE2-CD2 4.33Å; F345-L349 HydrophobicContact CZ-CD2 4.22Å; F345-L349 PolarHBondContact O-N 3.34Å; L346-L349 WeakPolarHBondContact O-CB 3.36Å; L346-L349 PolarHBondContact O-N 2.86Å; C347-L349 VanDerWaalsContact C-N 3.33Å; L349-I351 VanDerWaalsContact C-N 3.33Å; L349-A352 WeakPolarHBondContact O-CB 3.19Å; L349-A352 PolarHBondContact O-N 3.24Å; L349-A353 PolarHBondContact O-N 2.86Å; L349-S445 WeakPolarHBondContact CB-OG 3.31Å
350L98.1Very high95.5Very high97 Ų9736.7 Ų36.751%0.50820%0.198SC..Hα-helixtrans-64.2-38.3176.4-70.5173.6000112L346 C347 A353 A354 I377L346-L350 WeakPolarHBondContact O-CG 3.46Å; L346-L350 PolarHBondContact O-N 3.5Å; C347-L350 PolarHBondContact O-N 3.43Å; L350-A353 PolarHBondContact O-N 3.2Å; L350-A354 WeakPolarHBondContact O-CB 3.41Å; L350-A354 PolarHBondContact O-N 3.49Å; L350-I377 HydrophobicContact CB-CD1 3.69Å; L350-I377 HydrophobicContact CD1-CD1 4.39Å
351I98.4Very high95.6Very high0 Ų039 Ų390%021%0.212CC..Hα-helixtrans-60.6-48.9171.3-74.8166.2000110.4C347 S348 L349 A353 A354 V355 F374 I377 F441C347-I351 WeakPolarHBondContact O-CG1 3.19Å; C347-I351 PolarHBondContact O-N 3.41Å; S348-I351 PolarHBondContact O-N 2.92Å; L349-I351 VanDerWaalsContact C-N 3.33Å; I351-A353 VanDerWaalsContact C-N 3.3Å; I351-A353 PolarHBondContact O-N 3.43Å; I351-A354 PolarHBondContact O-N 3.2Å; I351-V355 HydrophobicContact CG2-CG2 4.32Å; I351-V355 WeakPolarHBondContact O-CG2 3.21Å; I351-V355 PolarHBondContact O-N 2.7Å; I351-F374 HydrophobicContact CB-CD2 4.49Å; I351-F374 HydrophobicContact CG1-CD2 4.28Å; I351-F374 HydrophobicContact CG2-CD2 3.7Å; I351-F374 HydrophobicContact CG2-CE2 4.02Å; I351-I377 HydrophobicContact CD1-CB 4.34Å; I351-I377 HydrophobicContact CD1-CG2 3.78Å; I351-I377 HydrophobicContact CG1-CB 4.01Å; I351-I377 HydrophobicContact CG1-CG2 3.73Å; I351-F441 HydrophobicContact CB-CD1 4.34Å; I351-F441 HydrophobicContact CB-CG 4.46Å; I351-F441 HydrophobicContact CG2-CB 3.99Å; I351-F441 HydrophobicContact CG2-CD1 3.46Å; I351-F441 VanDerWaalsContact CG2-CD1 3.46Å; I351-F441 HydrophobicContact CG2-CD2 3.54Å; I351-F441 HydrophobicContact CG2-CE1 3.67Å; I351-F441 HydrophobicContact CG2-CE2 3.74Å; I351-F441 HydrophobicContact CG2-CG 3.39Å; I351-F441 HydrophobicContact CG2-CZ 3.79Å
352A98.4Very high95.4Very high7 Ų745.9 Ų45.96%0.05824%0.243CC..Hα-helixtrans-57.6-44.5178.800000111.7S348 L349 V355 Y356 F441 A442S348-A352 PolarHBondContact O-N 3.41Å; L349-A352 WeakPolarHBondContact O-CB 3.19Å; L349-A352 PolarHBondContact O-N 3.24Å; A352-V355 PolarHBondContact O-N 2.98Å; A352-Y356 VanDerWaalsContact O-CB 3.31Å; A352-Y356 WeakPolarHBondContact O-CB 3.13Å; A352-Y356 PolarHBondContact O-N 2.87Å; A352-F441 HydrophobicContact CB-CB 3.77Å; A352-A442 HydrophobicContact CB-CB 4.1Å
353A98.2Very high95.4Very high44 Ų4447.3 Ų47.336%0.36425%0.25SC..Hα-helixtrans-63.2-44.6176.300000112.1L349 L350 I351 Y356 I357L349-A353 PolarHBondContact O-N 2.86Å; L350-A353 PolarHBondContact O-N 3.2Å; I351-A353 VanDerWaalsContact C-N 3.3Å; I351-A353 PolarHBondContact O-N 3.43Å; A353-Y356 PolarHBondContact O-N 3.39Å; A353-I357 WeakPolarHBondContact O-CB 3.44Å; A353-I357 WeakPolarHBondContact O-CD1 3.34Å; A353-I357 WeakPolarHBondContact O-CG1 3.41Å; A353-I357 PolarHBondContact O-N 3.38Å
354A98.1Very high95.3Very high6 Ų646.7 Ų46.75%0.0525%0.245CC..Hα-helixtrans-60.5-47.5177.400000111.6L350 I351 Y356 I357 M358 S370 V373 F374L350-A354 WeakPolarHBondContact O-CB 3.41Å; L350-A354 PolarHBondContact O-N 3.49Å; I351-A354 PolarHBondContact O-N 3.2Å; A354-Y356 VanDerWaalsContact C-N 3.34Å; A354-Y356 PolarHBondContact O-N 3.49Å; A354-I357 PolarHBondContact O-N 2.88Å; A354-M358 VanDerWaalsContact O-CG 3.3Å; A354-M358 WeakPolarHBondContact O-CG 3.3Å; A354-M358 PolarHBondContact O-N 2.81Å; A354-S370 WeakPolarHBondContact O-CB 3.28Å; A354-V373 HydrophobicContact CB-CG1 4.44Å; A354-F374 HydrophobicContact CB-CB 4.1Å
355V98Very high95.2Very high0 Ų054.2 Ų54.20%027%0.274CS..Hα-helixtrans-64.5-38.1178178.60000111.4V290 I351 A352 M358 D359 F374 F434 A438 F441V290-V355 HydrophobicContact CG2-CG1 4.13Å; V290-V355 HydrophobicContact CG2-CG2 3.89Å; I351-V355 HydrophobicContact CG2-CG2 4.32Å; I351-V355 WeakPolarHBondContact O-CG2 3.21Å; I351-V355 PolarHBondContact O-N 2.7Å; A352-V355 PolarHBondContact O-N 2.98Å; V355-M358 WeakPolarHBondContact O-CB 3.33Å; V355-M358 PolarHBondContact O-N 3.42Å; V355-D359 PolarHBondContact O-N 3.42Å; V355-F374 HydrophobicContact CG2-CD2 4.06Å; V355-F374 HydrophobicContact CG2-CE2 4.46Å; V355-F374 HydrophobicContact CG2-CG 4.42Å; V355-F434 HydrophobicContact CG1-CD1 3.98Å; V355-A438 HydrophobicContact CB-CB 4.2Å; V355-A438 HydrophobicContact CG1-CB 3.98Å; V355-F441 HydrophobicContact CG2-CD2 4.44Å
356Y97.3Very high95.2Very high122 Ų12254.9 Ų54.948%0.47828%0.281SS..Hα-helixtrans-65.2-41.4175.2-177.1-102.8000112.7A352 A353 A354 M358 D359 T360 L435 A438A352-Y356 VanDerWaalsContact O-CB 3.31Å; A352-Y356 WeakPolarHBondContact O-CB 3.13Å; A352-Y356 PolarHBondContact O-N 2.87Å; A353-Y356 PolarHBondContact O-N 3.39Å; A354-Y356 VanDerWaalsContact C-N 3.34Å; A354-Y356 PolarHBondContact O-N 3.49Å; Y356-M358 VanDerWaalsContact C-N 3.31Å; Y356-M358 PolarHBondContact O-N 3.43Å; Y356-D359 PolarHBondContact O-N 3.02Å; Y356-T360 HydrophobicContact CD1-CG2 4.21Å; Y356-T360 HydrophobicContact CD2-CG2 4.19Å; Y356-T360 HydrophobicContact CE1-CG2 3.78Å; Y356-T360 HydrophobicContact CE2-CG2 3.75Å; Y356-T360 HydrophobicContact CG-CG2 4.42Å; Y356-T360 WeakPolarHBondContact O-CG2 3.43Å; Y356-T360 PolarHBondContact O-N 3.37Å; Y356-T360 VanDerWaalsContact O-N 3.08Å; Y356-T360 PolarHBondContact O-OG1 2.66Å; Y356-L435 HydrophobicContact CD2-CD1 3.99Å; Y356-L435 HydrophobicContact CE2-CD1 3.84Å; Y356-A438 HydrophobicContact CD2-CB 4.46Å
357I97.3Very high95.1Very high64 Ų6450.8 Ų50.833%0.32826%0.26SS..Hα-helixtrans-65.8-35.8177.2-69164.9000110.9A353 A354 D359 V361 V366 S370A353-I357 WeakPolarHBondContact O-CB 3.44Å; A353-I357 WeakPolarHBondContact O-CD1 3.34Å; A353-I357 WeakPolarHBondContact O-CG1 3.41Å; A353-I357 PolarHBondContact O-N 3.38Å; A354-I357 PolarHBondContact O-N 2.88Å; I357-D359 PolarHBondContact O-N 3.47Å; I357-V361 HydrophobicContact CG2-CG2 3.99Å; I357-V361 PolarHBondContact O-N 2.88Å; I357-V366 HydrophobicContact CG2-CG1 3.55Å; I357-S370 VanDerWaalsContact CG2-OG 3.24Å; I357-S370 WeakPolarHBondContact CG2-OG 3.27Å
358M95Very high95Very high0 Ų049.9 Ų49.90%025%0.252CS..Hα-helixtrans-58.4-35176.7-71.5171.261.600112.7V290 L297 A354 V355 Y356 C367 Y371 F434V290-M358 HydrophobicContact CG1-CE 4.45Å; L297-M358 HydrophobicContact CD2-CB 3.83Å; L297-M358 HydrophobicContact CD2-CE 3.99Å; A354-M358 VanDerWaalsContact O-CG 3.3Å; A354-M358 WeakPolarHBondContact O-CG 3.3Å; A354-M358 PolarHBondContact O-N 2.81Å; V355-M358 WeakPolarHBondContact O-CB 3.33Å; V355-M358 PolarHBondContact O-N 3.42Å; Y356-M358 VanDerWaalsContact C-N 3.31Å; Y356-M358 PolarHBondContact O-N 3.43Å; M358-C367 PolarHBondContact O-SG 3.36Å; M358-C367 VanDerWaalsContact O-SG 3.4Å; M358-Y371 HydrophobicContact CE-CD2 3.76Å; M358-Y371 HydrophobicContact CE-CG 4.3Å; M358-Y371 HydrophobicContact SD-CD2 4.31Å; M358-F434 HydrophobicContact CE-CD1 4.38Å; M358-F434 HydrophobicContact CE-CE1 3.61Å; M358-F434 HydrophobicContact CE-CZ 4.38Å
359D91Very high95Very high20 Ų2052.5 Ų52.511%0.10727%0.274CS..Hα-helixtrans-83.8-43.6-178.4-175.856.3000113V355 Y356 I357 I431 F434V355-D359 PolarHBondContact O-N 3.42Å; Y356-D359 PolarHBondContact O-N 3.02Å; I357-D359 PolarHBondContact O-N 3.47Å; D359-I431 WeakPolarHBondContact OD1-CA 3.3Å; D359-I431 WeakPolarHBondContact OD1-CD1 3.26Å; D359-I431 WeakPolarHBondContact OD1-CG2 3.4Å; D359-F434 HydrophobicContact CB-CB 4.02Å
360T91.4Very high94.9Very high63 Ų6349.3 Ų49.339%0.38726%0.258SS..Hα-helixtrans-84.7-25.6-168.350.20000114.7Y356Y356-T360 HydrophobicContact CD1-CG2 4.21Å; Y356-T360 HydrophobicContact CD2-CG2 4.19Å; Y356-T360 HydrophobicContact CE1-CG2 3.78Å; Y356-T360 HydrophobicContact CE2-CG2 3.75Å; Y356-T360 HydrophobicContact CG-CG2 4.42Å; Y356-T360 WeakPolarHBondContact O-CG2 3.43Å; Y356-T360 PolarHBondContact O-N 3.37Å; Y356-T360 VanDerWaalsContact O-N 3.08Å; Y356-T360 PolarHBondContact O-OG1 2.66Å
361V91.4Very high94.8Very high53 Ų5344.7 Ų44.732%0.32123%0.234SC..  trans-97.9110.5-179-174.90000109.2I357 N363 V366I357-V361 HydrophobicContact CG2-CG2 3.99Å; I357-V361 PolarHBondContact O-N 2.88Å; V361-N363 HydrophobicContact CG1-CB 3.98Å; V361-N363 PolarHBondContact O-N 3.49Å; V361-V366 HydrophobicContact CB-CB 4.42Å; V361-V366 HydrophobicContact CB-CG1 3.95Å; V361-V366 HydrophobicContact CG1-CB 3.95Å; V361-V366 HydrophobicContact CG1-CG1 3.87Å; V361-V366 HydrophobicContact CG1-CG2 4.11Å; V361-V366 HydrophobicContact CG2-CG1 4.24Å
362E87.2Confident94.7Very high186 Ų18645.5 Ų45.587%0.86924%0.239SC*.  trans-72.651176.8-61.5-175.7175.900112.5
363N91.1Very high94.7Very high71 Ų7148.6 Ų48.638%0.3826%0.257SS..  trans-137120.5175.9-174.1-61.7000109.9V361 W365 V366 C367V361-N363 HydrophobicContact CG1-CB 3.98Å; V361-N363 PolarHBondContact O-N 3.49Å; N363-W365 VanDerWaalsContact C-N 3.3Å; N363-W365 PolarHBondContact O-N 3.18Å; N363-W365 WeakPolarHBondContact OD1-CB 3.17Å; N363-W365 PolarHBondContact OD1-N 3.37Å; N363-V366 HydrophobicContact CB-CB 4.18Å; N363-V366 HydrophobicContact CB-CG2 3.97Å; N363-V366 PolarHBondContact O-N 2.91Å; N363-V366 PolarHBondContact OD1-N 2.89Å; N363-C367 PolarHBondContact O-N 3.36Å
364I90.8Very high94.6Very high13 Ų1346.5 Ų46.57%0.06724%0.24CC..Hα-helixtrans-61.6-35.5-175.9-166.763.3000113.2W298 V301 M302 C367 Y368W298-I364 HydrophobicContact CB-CD1 3.98Å; W298-I364 HydrophobicContact CG-CD1 4.21Å; V301-I364 HydrophobicContact CB-CD1 4.4Å; V301-I364 HydrophobicContact CG1-CB 4.2Å; V301-I364 HydrophobicContact CG1-CD1 4.24Å; M302-I364 HydrophobicContact CB-CB 4.09Å; M302-I364 HydrophobicContact CB-CD1 4.27Å; M302-I364 HydrophobicContact CB-CG1 4.2Å; M302-I364 HydrophobicContact CE-CB 4.3Å; M302-I364 HydrophobicContact CE-CG1 3.95Å; M302-I364 HydrophobicContact CE-CG2 3.93Å; M302-I364 HydrophobicContact SD-CB 4.24Å; M302-I364 HydrophobicContact SD-CG2 3.74Å; I364-C367 PolarHBondContact O-N 2.9Å; I364-Y368 HydrophobicContact CD1-CD1 4.11Å; I364-Y368 HydrophobicContact CD1-CE1 3.62Å; I364-Y368 HydrophobicContact CD1-CE2 4.23Å; I364-Y368 HydrophobicContact CG1-CD1 4.28Å; I364-Y368 HydrophobicContact CG1-CD2 3.96Å; I364-Y368 HydrophobicContact CG1-CE1 3.87Å; I364-Y368 HydrophobicContact CG1-CE2 3.5Å; I364-Y368 HydrophobicContact CG1-CG 4.34Å; I364-Y368 VanDerWaalsContact CG1-CZ 3.46Å; I364-Y368 WeakPolarHBondContact O-CB 3.39Å; I364-Y368 WeakPolarHBondContact O-CD2 3.16Å; I364-Y368 PolarHBondContact O-N 2.91Å
365W93.5Very high94.5Very high159 Ų15947.5 Ų47.560%0.60224%0.242SC*.Hα-helixtrans-69.6-37.6179.8-63.8106.9000111.6Y310 N363 Y368 A369Y310-W365 HydrophobicContact CD2-CH2 4.07Å; Y310-W365 HydrophobicContact CE2-CH2 4.21Å; Y310-W365 HydrophobicContact CE2-CZ2 4.45Å; N363-W365 VanDerWaalsContact C-N 3.3Å; N363-W365 PolarHBondContact O-N 3.18Å; N363-W365 WeakPolarHBondContact OD1-CB 3.17Å; N363-W365 PolarHBondContact OD1-N 3.37Å; W365-Y368 HydrophobicContact CE3-CD2 4.33Å; W365-A369 VanDerWaalsContact O-CB 3.28Å; W365-A369 WeakPolarHBondContact O-CB 3.32Å; W365-A369 PolarHBondContact O-N 3.45Å
366V95.6Very high94.4Very high53 Ų5349.4 Ų49.432%0.32125%0.252SS..Hα-helixtrans-66.9-42.8173.1179.50000110.2I357 V361 N363 Y368 A369 S370I357-V366 HydrophobicContact CG2-CG1 3.55Å; V361-V366 HydrophobicContact CB-CB 4.42Å; V361-V366 HydrophobicContact CB-CG1 3.95Å; V361-V366 HydrophobicContact CG1-CB 3.95Å; V361-V366 HydrophobicContact CG1-CG1 3.87Å; V361-V366 HydrophobicContact CG1-CG2 4.11Å; V361-V366 HydrophobicContact CG2-CG1 4.24Å; N363-V366 HydrophobicContact CB-CB 4.18Å; N363-V366 HydrophobicContact CB-CG2 3.97Å; N363-V366 PolarHBondContact O-N 2.91Å; N363-V366 PolarHBondContact OD1-N 2.89Å; V366-Y368 PolarHBondContact O-N 3.46Å; V366-A369 PolarHBondContact O-N 3.5Å; V366-S370 WeakPolarHBondContact O-CB 3.48Å; V366-S370 PolarHBondContact O-N 2.95Å; V366-S370 PolarHBondContact O-OG 2.83Å; V366-S370 VanDerWaalsContact O-OG 3.06Å
367C94.3Very high94.3Very high0 Ų044.8 Ų44.80%024%0.236CC..Hα-helixtrans-60.4-46.3175.9-167.10000111.8M358 N363 I364 S370 Y371M358-C367 PolarHBondContact O-SG 3.36Å; M358-C367 VanDerWaalsContact O-SG 3.4Å; N363-C367 PolarHBondContact O-N 3.36Å; I364-C367 PolarHBondContact O-N 2.9Å; C367-S370 PolarHBondContact O-N 3.05Å; C367-Y371 WeakPolarHBondContact O-CB 3.34Å; C367-Y371 PolarHBondContact O-N 2.97Å
368Y94.5Very high94.2Very high8 Ų842.6 Ų42.63%0.03122%0.223CC..Hα-helixtrans-63.3-45.9175.9-71.1-22000113.1W298 N311 V314 I364 W365 V366 S370 Y371 V372W298-Y368 HydrophobicContact CB-CE1 4.35Å; W298-Y368 AromaticContact CD1-CD1 3.99Å; W298-Y368 AromaticContact CD1-CE1 3.87Å; W298-Y368 HydrophobicContact CD2-CD1 4.19Å; W298-Y368 AromaticContact CD2-CE1 3.7Å; W298-Y368 HydrophobicContact CD2-CE1 3.7Å; W298-Y368 AromaticContact CE2-CD1 3.84Å; W298-Y368 AromaticContact CE2-CE1 3.85Å; W298-Y368 HydrophobicContact CE3-CE1 4.24Å; W298-Y368 HydrophobicContact CG-CD1 4.28Å; W298-Y368 AromaticContact CG-CE1 3.73Å; W298-Y368 HydrophobicContact CG-CE1 3.73Å; W298-Y368 HydrophobicContact CZ2-CD1 4.31Å; W298-Y368 HydrophobicContact CZ2-CE1 4.49Å; W298-Y368 AromaticContact NE1-CD1 3.72Å; W298-Y368 AromaticContact NE1-CE1 3.94Å; N311-Y368 WeakPolarHBondContact OD1-CE1 3.45Å; N311-Y368 PolarHBondContact OD1-OH 3.33Å; V314-Y368 HydrophobicContact CB-CD1 4.32Å; V314-Y368 HydrophobicContact CB-CG 4.4Å; V314-Y368 HydrophobicContact CG1-CD1 4.08Å; V314-Y368 HydrophobicContact CG1-CG 4.23Å; V314-Y368 HydrophobicContact CG2-CD1 3.66Å; V314-Y368 HydrophobicContact CG2-CD2 3.5Å; V314-Y368 HydrophobicContact CG2-CE1 4Å; V314-Y368 HydrophobicContact CG2-CE2 3.87Å; V314-Y368 HydrophobicContact CG2-CG 3.38Å; I364-Y368 HydrophobicContact CD1-CD1 4.11Å; I364-Y368 HydrophobicContact CD1-CE1 3.62Å; I364-Y368 HydrophobicContact CD1-CE2 4.23Å; I364-Y368 HydrophobicContact CG1-CD1 4.28Å; I364-Y368 HydrophobicContact CG1-CD2 3.96Å; I364-Y368 HydrophobicContact CG1-CE1 3.87Å; I364-Y368 HydrophobicContact CG1-CE2 3.5Å; I364-Y368 HydrophobicContact CG1-CG 4.34Å; I364-Y368 VanDerWaalsContact CG1-CZ 3.46Å; I364-Y368 WeakPolarHBondContact O-CB 3.39Å; I364-Y368 WeakPolarHBondContact O-CD2 3.16Å; I364-Y368 PolarHBondContact O-N 2.91Å; W365-Y368 HydrophobicContact CE3-CD2 4.33Å; V366-Y368 PolarHBondContact O-N 3.46Å; Y368-S370 PolarHBondContact O-N 3.35Å; Y368-Y371 PolarHBondContact O-N 2.86Å; Y368-V372 VanDerWaalsContact O-CG2 3.24Å; Y368-V372 WeakPolarHBondContact O-CG2 3.26Å; Y368-V372 PolarHBondContact O-N 2.89Å
369A96.8Very high94.1Very high55 Ų5543.7 Ų43.746%0.45523%0.228SC..Hα-helixtrans-61.9-44.7178.200000111.2W365 V366 Y371 V372 V373W365-A369 VanDerWaalsContact O-CB 3.28Å; W365-A369 WeakPolarHBondContact O-CB 3.32Å; W365-A369 PolarHBondContact O-N 3.45Å; V366-A369 PolarHBondContact O-N 3.5Å; A369-Y371 PolarHBondContact O-N 3.07Å; A369-V372 PolarHBondContact O-N 3.08Å; A369-V373 WeakPolarHBondContact O-CG2 3.38Å; A369-V373 PolarHBondContact O-N 3.39Å
370S97.4Very high94.1Very high14 Ų1444 Ų4410%0.09823%0.231CC..Hα-helixtrans-63.7-40176.4-66.40000112.3A354 I357 V366 C367 Y368 V372 V373 F374A354-S370 WeakPolarHBondContact O-CB 3.28Å; I357-S370 VanDerWaalsContact CG2-OG 3.24Å; I357-S370 WeakPolarHBondContact CG2-OG 3.27Å; V366-S370 WeakPolarHBondContact O-CB 3.48Å; V366-S370 PolarHBondContact O-N 2.95Å; V366-S370 PolarHBondContact O-OG 2.83Å; V366-S370 VanDerWaalsContact O-OG 3.06Å; C367-S370 PolarHBondContact O-N 3.05Å; Y368-S370 PolarHBondContact O-N 3.35Å; S370-V372 PolarHBondContact O-N 2.94Å; S370-V373 PolarHBondContact O-N 3Å; S370-F374 WeakPolarHBondContact O-CB 3.45Å; S370-F374 PolarHBondContact O-N 3.06Å
371Y95.7Very high94.2Very high0 Ų041.1 Ų41.10%021%0.213CC..Hα-helixtrans-61.3-43.1173.2179.8-102.4000112.5V290 V291 A294 W298 V314 E315 M358 C367 Y368 A369 F374 R375V290-Y371 HydrophobicContact CG1-CD2 4.39Å; V290-Y371 HydrophobicContact CG1-CE2 4.36Å; V291-Y371 HydrophobicContact CG2-CE2 4.39Å; A294-Y371 HydrophobicContact CB-CD2 4.21Å; A294-Y371 HydrophobicContact CB-CE2 3.77Å; W298-Y371 HydrophobicContact CH2-CD1 4Å; W298-Y371 AromaticContact CH2-CE1 3.76Å; W298-Y371 HydrophobicContact CH2-CE1 3.76Å; W298-Y371 HydrophobicContact CH2-CE2 4.42Å; W298-Y371 HydrophobicContact CH2-CG 4.39Å; W298-Y371 AromaticContact CH2-CZ 3.96Å; W298-Y371 AromaticContact CZ2-CD1 3.61Å; W298-Y371 HydrophobicContact CZ2-CD1 3.61Å; W298-Y371 AromaticContact CZ2-CD2 3.92Å; W298-Y371 HydrophobicContact CZ2-CD2 3.92Å; W298-Y371 AromaticContact CZ2-CE1 3.83Å; W298-Y371 HydrophobicContact CZ2-CE1 3.83Å; W298-Y371 HydrophobicContact CZ2-CE2 4.14Å; W298-Y371 AromaticContact CZ2-CG 3.62Å; W298-Y371 HydrophobicContact CZ2-CG 3.62Å; V314-Y371 HydrophobicContact CG1-CD1 3.83Å; V314-Y371 HydrophobicContact CG1-CE1 4.45Å; E315-Y371 VanDerWaalsContact CD-OH 3.31Å; E315-Y371 PolarHBondContact OE1-OH 2.95Å; E315-Y371 PolarHBondContact OE2-OH 3.41Å; M358-Y371 HydrophobicContact CE-CD2 3.76Å; M358-Y371 HydrophobicContact CE-CG 4.3Å; M358-Y371 HydrophobicContact SD-CD2 4.31Å; C367-Y371 WeakPolarHBondContact O-CB 3.34Å; C367-Y371 PolarHBondContact O-N 2.97Å; Y368-Y371 PolarHBondContact O-N 2.86Å; A369-Y371 PolarHBondContact O-N 3.07Å; Y371-F374 HydrophobicContact CD2-CD1 4.02Å; Y371-F374 HydrophobicContact CD2-CE1 4.45Å; Y371-F374 HydrophobicContact CE2-CD1 4.24Å; Y371-F374 HydrophobicContact CE2-CE1 4.25Å; Y371-F374 WeakPolarHBondContact O-CB 3.25Å; Y371-F374 PolarHBondContact O-N 2.87Å; Y371-R375 HydrophobicContact CD1-CG 4.37Å; Y371-R375 VanDerWaalsContact CE1-CD 3.42Å; Y371-R375 HydrophobicContact CE1-CG 3.98Å; Y371-R375 HydrophobicContact CE2-CG 4.26Å; Y371-R375 VanDerWaalsContact CZ-CD 3.49Å; Y371-R375 WeakPolarHBondContact O-CB 3.44Å; Y371-R375 PolarHBondContact O-N 3.3Å
372V96.3Very high94.2Very high18 Ų1839.5 Ų39.511%0.10920%0.203CC..Hα-helixtrans-61.4-45.3176.1170.80000110.7V314 V317 L321 Y368 A369 S370 R375 I376V314-V372 HydrophobicContact CG1-CG2 3.89Å; V317-V372 HydrophobicContact CG1-CG1 4.36Å; V317-V372 HydrophobicContact CG1-CG2 4.46Å; L321-V372 HydrophobicContact CD1-CG1 3.96Å; Y368-V372 VanDerWaalsContact O-CG2 3.24Å; Y368-V372 WeakPolarHBondContact O-CG2 3.26Å; Y368-V372 PolarHBondContact O-N 2.89Å; A369-V372 PolarHBondContact O-N 3.08Å; S370-V372 PolarHBondContact O-N 2.94Å; V372-R375 PolarHBondContact O-N 3.38Å; V372-I376 HydrophobicContact CG1-CD1 3.69Å; V372-I376 HydrophobicContact CG1-CG1 4.42Å; V372-I376 WeakPolarHBondContact O-CD1 3.32Å; V372-I376 VanDerWaalsContact O-CG1 3.24Å; V372-I376 WeakPolarHBondContact O-CG1 3.3Å; V372-I376 PolarHBondContact O-N 3.36Å
373V97.5Very high94.2Very high72 Ų7232.5 Ų32.544%0.43617%0.173SC..Hα-helixtrans-59.8-49.5175.7170.60000111.1A354 A369 S370 R375 I376 I377A354-V373 HydrophobicContact CB-CG1 4.44Å; A369-V373 WeakPolarHBondContact O-CG2 3.38Å; A369-V373 PolarHBondContact O-N 3.39Å; S370-V373 PolarHBondContact O-N 3Å; V373-R375 VanDerWaalsContact C-N 3.34Å; V373-R375 PolarHBondContact O-N 2.86Å; V373-I376 PolarHBondContact O-N 3.26Å; V373-I377 HydrophobicContact CG1-CD1 3.66Å; V373-I377 HydrophobicContact CG1-CG1 4.43Å; V373-I377 VanDerWaalsContact O-CG1 3.29Å; V373-I377 WeakPolarHBondContact O-CG1 3.3Å; V373-I377 PolarHBondContact O-N 2.95Å
374F97.5Very high94Very high0 Ų029.5 Ų29.50%016%0.157CC..Hα-helixtrans-52.7-50.6175.3153.4-105.7000111.7Y287 V290 V291 I351 A354 V355 S370 Y371 I376 I377 Y378 F441Y287-F374 HydrophobicContact CD2-CE1 4.01Å; Y287-F374 HydrophobicContact CD2-CE2 4.35Å; Y287-F374 AromaticContact CD2-CZ 3.52Å; Y287-F374 HydrophobicContact CD2-CZ 3.52Å; Y287-F374 HydrophobicContact CE2-CE1 4.28Å; Y287-F374 HydrophobicContact CE2-CZ 4.24Å; Y287-F374 HydrophobicContact CG-CZ 4.37Å; V290-F374 HydrophobicContact CB-CE1 3.83Å; V290-F374 HydrophobicContact CB-CE2 4.33Å; V290-F374 HydrophobicContact CB-CZ 3.61Å; V290-F374 HydrophobicContact CG1-CD1 3.8Å; V290-F374 HydrophobicContact CG1-CE1 3.32Å; V290-F374 HydrophobicContact CG1-CE2 4.35Å; V290-F374 HydrophobicContact CG1-CG 4.48Å; V290-F374 HydrophobicContact CG1-CZ 3.62Å; V290-F374 HydrophobicContact CG2-CE2 4.35Å; V290-F374 HydrophobicContact CG2-CZ 4.1Å; V291-F374 HydrophobicContact CG2-CE1 4.13Å; I351-F374 HydrophobicContact CB-CD2 4.49Å; I351-F374 HydrophobicContact CG1-CD2 4.28Å; I351-F374 HydrophobicContact CG2-CD2 3.7Å; I351-F374 HydrophobicContact CG2-CE2 4.02Å; A354-F374 HydrophobicContact CB-CB 4.1Å; V355-F374 HydrophobicContact CG2-CD2 4.06Å; V355-F374 HydrophobicContact CG2-CE2 4.46Å; V355-F374 HydrophobicContact CG2-CG 4.42Å; S370-F374 WeakPolarHBondContact O-CB 3.45Å; S370-F374 PolarHBondContact O-N 3.06Å; Y371-F374 HydrophobicContact CD2-CD1 4.02Å; Y371-F374 HydrophobicContact CD2-CE1 4.45Å; Y371-F374 HydrophobicContact CE2-CD1 4.24Å; Y371-F374 HydrophobicContact CE2-CE1 4.25Å; Y371-F374 WeakPolarHBondContact O-CB 3.25Å; Y371-F374 PolarHBondContact O-N 2.87Å; F374-I376 PolarHBondContact O-N 3.42Å; F374-I377 PolarHBondContact O-N 3.34Å; F374-Y378 WeakPolarHBondContact O-CB 3.3Å; F374-Y378 PolarHBondContact O-N 3.08Å; F374-F441 HydrophobicContact CE2-CE2 4.2Å; F374-F441 HydrophobicContact CE2-CZ 4.16Å
375R94.6Very high94Very high27 Ų2728.9 Ų28.910%0.10215%0.153CC..Hα-helixtrans-63.5-42.8-179-83.4-156.257.8160-0112.5Y287 E315 S318 T319 Y371 V372 V373 Y378 M379Y287-R375 HydrophobicContact CE2-CG 4.45Å; E315-R375 IonicContact OE2-CZ 2.74Å; E315-R375 IonicContact OE2-NH1 3.71Å; E315-R375 PolarHBondContact OE2-NH1 3.12Å; S318-R375 VanDerWaalsContact OG-CD 3.32Å; S318-R375 WeakPolarHBondContact OG-CD 3.27Å; S318-R375 PolarHBondContact OG-NE 2.87Å; T319-R375 PolarHBondContact OG1-NH2 3.07Å; Y371-R375 HydrophobicContact CD1-CG 4.37Å; Y371-R375 VanDerWaalsContact CE1-CD 3.42Å; Y371-R375 HydrophobicContact CE1-CG 3.98Å; Y371-R375 HydrophobicContact CE2-CG 4.26Å; Y371-R375 VanDerWaalsContact CZ-CD 3.49Å; Y371-R375 WeakPolarHBondContact O-CB 3.44Å; Y371-R375 PolarHBondContact O-N 3.3Å; V372-R375 PolarHBondContact O-N 3.38Å; V373-R375 VanDerWaalsContact C-N 3.34Å; V373-R375 PolarHBondContact O-N 2.86Å; R375-Y378 PolarHBondContact O-N 3.06Å; R375-M379 WeakPolarHBondContact O-CB 3.2Å; R375-M379 VanDerWaalsContact O-CG 3.25Å; R375-M379 WeakPolarHBondContact O-CG 3.24Å; R375-M379 PolarHBondContact O-N 3.43Å
376I95.4Very high93.7Very high40 Ų4022.2 Ų22.221%0.20513%0.131CC..Hα-helixtrans-61.9-48.4178.7-68.1164.2000110.5L321 A325 V372 V373 F374 Y378 M379 V380L321-I376 HydrophobicContact CB-CD1 3.58Å; L321-I376 HydrophobicContact CB-CG1 3.94Å; L321-I376 HydrophobicContact CD1-CD1 4.01Å; L321-I376 HydrophobicContact CG-CD1 4.46Å; A325-I376 HydrophobicContact CB-CG2 3.81Å; V372-I376 HydrophobicContact CG1-CD1 3.69Å; V372-I376 HydrophobicContact CG1-CG1 4.42Å; V372-I376 WeakPolarHBondContact O-CD1 3.32Å; V372-I376 VanDerWaalsContact O-CG1 3.24Å; V372-I376 WeakPolarHBondContact O-CG1 3.3Å; V372-I376 PolarHBondContact O-N 3.36Å; V373-I376 PolarHBondContact O-N 3.26Å; F374-I376 PolarHBondContact O-N 3.42Å; I376-Y378 PolarHBondContact O-N 3.44Å; I376-M379 PolarHBondContact O-N 3.43Å; I376-V380 WeakPolarHBondContact O-CG2 3.48Å; I376-V380 PolarHBondContact O-N 2.92Å
377I96.5Very high93.1Very high25 Ų2525.7 Ų25.713%0.12814%0.142CC..Hα-helixtrans-62.1-46.1-178.9-62.5167.5000110.3C347 L350 I351 V373 F374 V380 L381C347-I377 HydrophobicContact CB-CG2 3.62Å; L350-I377 HydrophobicContact CB-CD1 3.69Å; L350-I377 HydrophobicContact CD1-CD1 4.39Å; I351-I377 HydrophobicContact CD1-CB 4.34Å; I351-I377 HydrophobicContact CD1-CG2 3.78Å; I351-I377 HydrophobicContact CG1-CB 4.01Å; I351-I377 HydrophobicContact CG1-CG2 3.73Å; V373-I377 HydrophobicContact CG1-CD1 3.66Å; V373-I377 HydrophobicContact CG1-CG1 4.43Å; V373-I377 VanDerWaalsContact O-CG1 3.29Å; V373-I377 WeakPolarHBondContact O-CG1 3.3Å; V373-I377 PolarHBondContact O-N 2.95Å; F374-I377 PolarHBondContact O-N 3.34Å; I377-V380 PolarHBondContact O-N 3.47Å; I377-L381 HydrophobicContact CG2-CD1 4.27Å; I377-L381 HydrophobicContact CG2-CG 4.46Å; I377-L381 WeakPolarHBondContact O-CG 3.45Å; I377-L381 PolarHBondContact O-N 3.45Å
378Y95.5Very high92.7Very high17 Ų1726.9 Ų26.97%0.06715%0.147CC..Hα-helixtrans-60-47.9176.8174.9-96.6000111.9W279 T284 Y287 F374 R375 I376 V380 L381 I382W279-Y378 HydrophobicContact CH2-CD2 4.44Å; T284-Y378 PolarHBondContact OG1-OH 2.97Å; T284-Y378 VanDerWaalsContact OG1-OH 3.06Å; Y287-Y378 VanDerWaalsContact CB-CE2 3.45Å; Y287-Y378 HydrophobicContact CD1-CD1 4.18Å; Y287-Y378 AromaticContact CD1-CE1 3.53Å; Y287-Y378 HydrophobicContact CD1-CE1 3.53Å; Y287-Y378 HydrophobicContact CD1-CE2 4.45Å; Y287-Y378 AromaticContact CD1-CZ 3.69Å; Y287-Y378 AromaticContact CD2-CD1 3.16Å; Y287-Y378 HydrophobicContact CD2-CD1 3.16Å; Y287-Y378 AromaticContact CD2-CD2 3.98Å; Y287-Y378 HydrophobicContact CD2-CD2 3.98Å; Y287-Y378 AromaticContact CD2-CE1 3.43Å; Y287-Y378 HydrophobicContact CD2-CE1 3.43Å; Y287-Y378 VanDerWaalsContact CD2-CE1 3.43Å; Y287-Y378 HydrophobicContact CD2-CE2 4.21Å; Y287-Y378 AromaticContact CD2-CG 3.46Å; Y287-Y378 HydrophobicContact CD2-CG 3.46Å; Y287-Y378 VanDerWaalsContact CD2-CG 3.46Å; Y287-Y378 AromaticContact CD2-CZ 3.95Å; Y287-Y378 HydrophobicContact CE1-CD1 4.34Å; Y287-Y378 AromaticContact CE1-CE1 3.77Å; Y287-Y378 HydrophobicContact CE1-CE1 3.77Å; Y287-Y378 AromaticContact CE2-CD1 3.37Å; Y287-Y378 HydrophobicContact CE2-CD1 3.37Å; Y287-Y378 AromaticContact CE2-CE1 3.68Å; Y287-Y378 HydrophobicContact CE2-CE1 3.68Å; Y287-Y378 HydrophobicContact CE2-CG 4.06Å; Y287-Y378 AromaticContact CG-CD1 3.62Å; Y287-Y378 HydrophobicContact CG-CD1 3.62Å; Y287-Y378 HydrophobicContact CG-CD2 4.03Å; Y287-Y378 AromaticContact CG-CE1 3.35Å; Y287-Y378 HydrophobicContact CG-CE1 3.35Å; Y287-Y378 AromaticContact CG-CE2 3.81Å; Y287-Y378 HydrophobicContact CG-CE2 3.81Å; Y287-Y378 AromaticContact CG-CG 3.94Å; Y287-Y378 HydrophobicContact CG-CG 3.94Å; Y287-Y378 AromaticContact CG-CZ 3.45Å; Y287-Y378 VanDerWaalsContact CG-CZ 3.45Å; Y287-Y378 AromaticContact CZ-CD1 3.97Å; Y287-Y378 AromaticContact CZ-CE1 3.84Å; F374-Y378 WeakPolarHBondContact O-CB 3.3Å; F374-Y378 PolarHBondContact O-N 3.08Å; R375-Y378 PolarHBondContact O-N 3.06Å; I376-Y378 PolarHBondContact O-N 3.44Å; Y378-V380 VanDerWaalsContact C-N 3.33Å; Y378-V380 PolarHBondContact O-N 2.76Å; Y378-L381 PolarHBondContact O-N 2.85Å; Y378-I382 HydrophobicContact CD1-CG2 4.46Å; Y378-I382 HydrophobicContact CE1-CB 4.3Å; Y378-I382 HydrophobicContact CE1-CG2 4.17Å; Y378-I382 HydrophobicContact CE2-CB 4.45Å; Y378-I382 HydrophobicContact CE2-CD1 4.32Å; Y378-I382 WeakPolarHBondContact O-CB 3.27Å; Y378-I382 WeakPolarHBondContact O-CG2 3.43Å; Y378-I382 PolarHBondContact O-N 3.22Å
379M91.9Very high92.3Very high23 Ų2326.8 Ų26.811%0.11315%0.147CC..Hα-helixtrans-62.1-37.7-178.9-74.7-17873.600112.9L143 V326 R375 I376 I382 T383L143-M379 HydrophobicContact CD2-CE 3.67Å; V326-M379 HydrophobicContact CG2-CB 4.2Å; V326-M379 VanDerWaalsContact CG2-O 3.27Å; V326-M379 WeakPolarHBondContact CG2-O 3.32Å; R375-M379 WeakPolarHBondContact O-CB 3.2Å; R375-M379 VanDerWaalsContact O-CG 3.25Å; R375-M379 WeakPolarHBondContact O-CG 3.24Å; R375-M379 PolarHBondContact O-N 3.43Å; I376-M379 PolarHBondContact O-N 3.43Å; M379-I382 WeakPolarHBondContact O-CG2 3.46Å; M379-T383 WeakPolarHBondContact O-CB 3.27Å; M379-T383 PolarHBondContact O-N 3.34Å; M379-T383 PolarHBondContact O-OG1 3.48Å
380V91.1Very high91.5Very high28 Ų2826.1 Ų26.117%0.1714%0.141CC..Hα-helixtrans-64.6-53.6173.9162.10000110.7A325 V326 V329 I376 I377 Y378 I382 T383 I384A325-V380 HydrophobicContact CB-CG2 3.55Å; V326-V380 HydrophobicContact CG2-CG2 4.46Å; V329-V380 HydrophobicContact CG2-CB 4.4Å; V329-V380 HydrophobicContact CG2-CG1 3.65Å; V329-V380 HydrophobicContact CG2-CG2 4.13Å; I376-V380 WeakPolarHBondContact O-CG2 3.48Å; I376-V380 PolarHBondContact O-N 2.92Å; I377-V380 PolarHBondContact O-N 3.47Å; Y378-V380 VanDerWaalsContact C-N 3.33Å; Y378-V380 PolarHBondContact O-N 2.76Å; V380-I382 PolarHBondContact O-N 3.01Å; V380-T383 PolarHBondContact O-N 2.64Å; V380-I384 HydrophobicContact CG1-CD1 3.66Å; V380-I384 WeakPolarHBondContact O-CG1 3.23Å; V380-I384 PolarHBondContact O-N 3.04Å
381L93.3Very high90.6Very high1 Ų128.7 Ų28.71%0.00516%0.163CC..Hα-helixtrans-66.3-40.3-176.1-73.2-175.7000113.2W279 T343 L344 C347 I377 Y378 T383 I384 A385W279-L381 HydrophobicContact CH2-CB 3.15Å; W279-L381 HydrophobicContact CH2-CD1 3.71Å; W279-L381 HydrophobicContact CH2-CG 4.13Å; W279-L381 HydrophobicContact CZ2-CB 3.56Å; W279-L381 HydrophobicContact CZ2-CD1 3.13Å; W279-L381 HydrophobicContact CZ2-CG 4.05Å; W279-L381 HydrophobicContact CZ3-CB 3.73Å; T343-L381 HydrophobicContact CG2-CD2 3.97Å; L344-L381 HydrophobicContact CD2-CD2 4.3Å; C347-L381 HydrophobicContact CB-CD1 3.45Å; C347-L381 VanDerWaalsContact CB-CD1 3.45Å; C347-L381 HydrophobicContact CB-CD2 4.01Å; C347-L381 HydrophobicContact CB-CG 3.95Å; I377-L381 HydrophobicContact CG2-CD1 4.27Å; I377-L381 HydrophobicContact CG2-CG 4.46Å; I377-L381 WeakPolarHBondContact O-CG 3.45Å; I377-L381 PolarHBondContact O-N 3.45Å; Y378-L381 PolarHBondContact O-N 2.85Å; L381-T383 PolarHBondContact O-N 3.45Å; L381-I384 HydrophobicContact CD2-CD1 4.45Å; L381-I384 PolarHBondContact O-N 2.99Å; L381-A385 WeakPolarHBondContact O-CB 3.32Å; L381-A385 PolarHBondContact O-N 3.45Å
382I91.1Very high89.6Confident20 Ų2032.5 Ų32.510%0.10318%0.184CC..Hα-helixtrans-63.3-33.8177.9-161.869.9000111W279 W280 Y378 M379 V380 T386W279-I382 HydrophobicContact CZ3-CD1 4.21Å; W280-I382 HydrophobicContact CD2-CD1 4.15Å; W280-I382 HydrophobicContact CG-CD1 3.75Å; Y378-I382 HydrophobicContact CD1-CG2 4.46Å; Y378-I382 HydrophobicContact CE1-CB 4.3Å; Y378-I382 HydrophobicContact CE1-CG2 4.17Å; Y378-I382 HydrophobicContact CE2-CB 4.45Å; Y378-I382 HydrophobicContact CE2-CD1 4.32Å; Y378-I382 WeakPolarHBondContact O-CB 3.27Å; Y378-I382 WeakPolarHBondContact O-CG2 3.43Å; Y378-I382 PolarHBondContact O-N 3.22Å; M379-I382 WeakPolarHBondContact O-CG2 3.46Å; V380-I382 PolarHBondContact O-N 3.01Å; I382-T386 WeakPolarHBondContact O-CB 3.49Å; I382-T386 PolarHBondContact O-N 2.87Å; I382-T386 PolarHBondContact O-OG1 3.19Å
383T87.5Confident88.6Confident39 Ų3932.9 Ų32.924%0.23919%0.185CC..Hα-helixtrans-69.8-44.8175.2-56.60000111.5V326 M379 V380 L381 T386 F387V326-T383 HydrophobicContact CG1-CG2 3.72Å; V326-T383 WeakPolarHBondContact CG2-OG1 3.25Å; M379-T383 WeakPolarHBondContact O-CB 3.27Å; M379-T383 PolarHBondContact O-N 3.34Å; M379-T383 PolarHBondContact O-OG1 3.48Å; V380-T383 PolarHBondContact O-N 2.64Å; L381-T383 PolarHBondContact O-N 3.45Å; T383-T386 PolarHBondContact O-N 3.33Å; T383-F387 WeakPolarHBondContact O-CB 3.48Å; T383-F387 PolarHBondContact O-N 2.92Å
384I88Confident87.3Confident7 Ų732.2 Ų32.24%0.03618%0.184CC..Hα-helixtrans-60.9-47.5175.4-64.4157.8000110.4W276 V329 W336 V380 L381 T386 F387 Q388W276-I384 HydrophobicContact CH2-CG2 3.46Å; W276-I384 VanDerWaalsContact CH2-CG2 3.46Å; W276-I384 HydrophobicContact CZ2-CG2 4.2Å; W276-I384 HydrophobicContact CZ3-CB 4.44Å; W276-I384 HydrophobicContact CZ3-CG2 3.76Å; V329-I384 HydrophobicContact CG1-CD1 4.09Å; V329-I384 HydrophobicContact CG1-CG1 3.63Å; W336-I384 HydrophobicContact CD2-CG2 3.82Å; W336-I384 HydrophobicContact CE3-CG2 3.68Å; W336-I384 HydrophobicContact CH2-CB 4.44Å; W336-I384 HydrophobicContact CH2-CD1 3.33Å; W336-I384 HydrophobicContact CH2-CG1 3.83Å; W336-I384 HydrophobicContact CH2-CG2 3.76Å; W336-I384 HydrophobicContact CZ2-CD1 3.91Å; W336-I384 HydrophobicContact CZ2-CG1 3.92Å; W336-I384 HydrophobicContact CZ2-CG2 3.86Å; W336-I384 HydrophobicContact CZ3-CD1 3.96Å; W336-I384 HydrophobicContact CZ3-CG1 4.48Å; W336-I384 HydrophobicContact CZ3-CG2 3.67Å; V380-I384 HydrophobicContact CG1-CD1 3.66Å; V380-I384 WeakPolarHBondContact O-CG1 3.23Å; V380-I384 PolarHBondContact O-N 3.04Å; L381-I384 HydrophobicContact CD2-CD1 4.45Å; L381-I384 PolarHBondContact O-N 2.99Å; I384-T386 VanDerWaalsContact C-N 3.32Å; I384-T386 PolarHBondContact O-N 3.4Å; I384-F387 PolarHBondContact O-N 3.48Å; I384-Q388 HydrophobicContact CG2-CG 4.13Å; I384-Q388 WeakPolarHBondContact O-CB 3.35Å; I384-Q388 VanDerWaalsContact O-CG 3.3Å; I384-Q388 WeakPolarHBondContact O-CG 3.29Å; I384-Q388 PolarHBondContact O-N 2.93Å
385A90.4Very high85.7Confident0 Ų037.7 Ų37.70%021%0.211CC..Hα-helixtrans-58.4-45.6178.500000111.2W276 W279 L381 F387 Q388 I389W276-A385 HydrophobicContact CE3-CB 3.66Å; W276-A385 HydrophobicContact CZ3-CB 4.24Å; W279-A385 HydrophobicContact CE3-CB 3.98Å; W279-A385 HydrophobicContact CZ3-CB 4.07Å; L381-A385 WeakPolarHBondContact O-CB 3.32Å; L381-A385 PolarHBondContact O-N 3.45Å; A385-F387 PolarHBondContact O-N 3.44Å; A385-Q388 PolarHBondContact O-N 3.47Å; A385-I389 WeakPolarHBondContact O-CB 3.06Å; A385-I389 WeakPolarHBondContact O-CD1 3.07Å; A385-I389 WeakPolarHBondContact O-CG1 3.3Å; A385-I389 PolarHBondContact O-N 3.4Å
386T86.2Confident84.2Confident20 Ų2043.5 Ų43.512%0.12324%0.239CC..Hα-helixtrans-61.4-44.7176.6-55.90000111.5I382 T383 I384 I389 A390 Y398I382-T386 WeakPolarHBondContact O-CB 3.49Å; I382-T386 PolarHBondContact O-N 2.87Å; I382-T386 PolarHBondContact O-OG1 3.19Å; T383-T386 PolarHBondContact O-N 3.33Å; I384-T386 VanDerWaalsContact C-N 3.32Å; I384-T386 PolarHBondContact O-N 3.4Å; T386-I389 PolarHBondContact O-N 2.9Å; T386-A390 WeakPolarHBondContact O-CB 3.44Å; T386-A390 PolarHBondContact O-N 3.26Å; T386-Y398 HydrophobicContact CG2-CE2 4.3Å; T386-Y398 WeakPolarHBondContact CG2-OH 3.39Å
387F83.4Confident83.1Confident126 Ų12644.3 Ų44.355%0.55324%0.24SC*.Hα-helixtrans-63.3-44176.9177.2-97.1000112.3T383 I384 A385 A390 A391T383-F387 WeakPolarHBondContact O-CB 3.48Å; T383-F387 PolarHBondContact O-N 2.92Å; I384-F387 PolarHBondContact O-N 3.48Å; A385-F387 PolarHBondContact O-N 3.44Å; F387-A390 PolarHBondContact O-N 3.35Å; F387-A391 VanDerWaalsContact O-CB 3.3Å; F387-A391 WeakPolarHBondContact O-CB 3.45Å; F387-A391 PolarHBondContact O-N 3.01Å
388Q86.1Confident81.9Confident24 Ų2445.8 Ų45.811%0.11224%0.244CC..Hα-helixtrans-67.2-36.2179.1-70.6-60.4-47.800112.2W276 W336 I384 A385 N392W276-Q388 HydrophobicContact CD2-CB 3.98Å; W276-Q388 HydrophobicContact CD2-CG 4.23Å; W276-Q388 HydrophobicContact CG-CB 3.95Å; W276-Q388 HydrophobicContact CH2-CG 4.45Å; W276-Q388 HydrophobicContact CZ2-CB 4.46Å; W276-Q388 HydrophobicContact CZ2-CG 3.82Å; W336-Q388 VanDerWaalsContact CB-CD 3.47Å; W336-Q388 HydrophobicContact CB-CG 4.2Å; W336-Q388 HydrophobicContact CG-CG 4.29Å; I384-Q388 HydrophobicContact CG2-CG 4.13Å; I384-Q388 WeakPolarHBondContact O-CB 3.35Å; I384-Q388 VanDerWaalsContact O-CG 3.3Å; I384-Q388 WeakPolarHBondContact O-CG 3.29Å; I384-Q388 PolarHBondContact O-N 2.93Å; A385-Q388 PolarHBondContact O-N 3.47Å; Q388-N392 PolarHBondContact O-ND2 2.96Å
389I85.3Confident80.8Confident6 Ų647.1 Ų47.13%0.03126%0.258CS..Hα-helixtrans-66.6-47.8173.4-69.8165.4000110L273 W276 A385 T386 A391 N392 L393 Y398 V401L273-I389 HydrophobicContact CD2-CB 4.45Å; L273-I389 HydrophobicContact CD2-CG1 4.41Å; L273-I389 HydrophobicContact CD2-CG2 4.47Å; W276-I389 HydrophobicContact CB-CD1 4.3Å; W276-I389 HydrophobicContact CB-CG1 4Å; A385-I389 WeakPolarHBondContact O-CB 3.06Å; A385-I389 WeakPolarHBondContact O-CD1 3.07Å; A385-I389 WeakPolarHBondContact O-CG1 3.3Å; A385-I389 PolarHBondContact O-N 3.4Å; T386-I389 PolarHBondContact O-N 2.9Å; I389-A391 PolarHBondContact O-N 3.28Å; I389-N392 PolarHBondContact O-N 2.93Å; I389-L393 HydrophobicContact CG2-CD1 3.6Å; I389-L393 WeakPolarHBondContact O-CG 3.39Å; I389-L393 PolarHBondContact O-N 3.47Å; I389-Y398 HydrophobicContact CG2-CD2 4.29Å; I389-Y398 HydrophobicContact CG2-CE2 4.49Å; I389-V401 HydrophobicContact CG2-CB 4.34Å; I389-V401 HydrophobicContact CG2-CG1 3.63Å
390A81.4Confident80.1Confident41 Ų4147.2 Ų47.234%0.33926%0.259SS..Hα-helixtrans-60.9-43.8179.200000112.7T386 F387 N392 L393 Y398T386-A390 WeakPolarHBondContact O-CB 3.44Å; T386-A390 PolarHBondContact O-N 3.26Å; F387-A390 PolarHBondContact O-N 3.35Å; A390-N392 PolarHBondContact O-N 3.49Å; A390-N392 VanDerWaalsContact O-N 3.17Å; A390-L393 PolarHBondContact O-N 2.73Å; A390-Y398 HydrophobicContact CB-CD2 3.81Å; A390-Y398 HydrophobicContact CB-CE2 3.69Å
391A78.2Confident79.8Confident68 Ų6846 Ų4656%0.56225%0.251SS*.Hα-helixtrans-65.7-18.4-17800000114F387 I389F387-A391 VanDerWaalsContact O-CB 3.3Å; F387-A391 WeakPolarHBondContact O-CB 3.45Å; F387-A391 PolarHBondContact O-N 3.01Å; I389-A391 PolarHBondContact O-N 3.28Å
392N73.5Confident79.3Confident80 Ų8049 Ų4943%0.42827%0.265SS..THydrogen-bonded Turntrans-106.74.7-176.9-74.3-63.5000113.3L273 Q388 I389 A390L273-N392 HydrophobicContact CD1-CB 4.01Å; L273-N392 HydrophobicContact CD2-CB 3.54Å; L273-N392 HydrophobicContact CG-CB 3.79Å; Q388-N392 PolarHBondContact O-ND2 2.96Å; I389-N392 PolarHBondContact O-N 2.93Å; A390-N392 PolarHBondContact O-N 3.49Å; A390-N392 VanDerWaalsContact O-N 3.17Å
393L75.3Confident78.9Confident27 Ų2749.4 Ų49.414%0.14127%0.273CS..SBendtrans-128.8151.5-175.2-67.6174.9000111.8C267 L273 I389 A390 R397 V401C267-L393 HydrophobicContact CB-CD2 4.03Å; C267-L393 WeakPolarHBondContact SG-CD2 3.39Å; L273-L393 HydrophobicContact CD1-CD2 3.67Å; L273-L393 HydrophobicContact CD1-CG 4.15Å; L273-L393 HydrophobicContact CD2-CD1 4.4Å; L273-L393 HydrophobicContact CD2-CG 4.16Å; I389-L393 HydrophobicContact CG2-CD1 3.6Å; I389-L393 WeakPolarHBondContact O-CG 3.39Å; I389-L393 PolarHBondContact O-N 3.47Å; A390-L393 PolarHBondContact O-N 2.73Å; L393-R397 HydrophobicContact CB-CB 4.31Å; L393-R397 HydrophobicContact CD2-CB 4.12Å; L393-V401 HydrophobicContact CD1-CB 3.79Å; L393-V401 HydrophobicContact CD1-CG1 4.16Å; L393-V401 HydrophobicContact CD1-CG2 3.56Å
394S70.7Confident78.9Confident57 Ų5748.9 Ų48.940%0.39927%0.27SS..  trans-68.7154.3160.560.10000109.8E396 R397 Y398S394-E396 VanDerWaalsContact C-N 3.25Å; S394-E396 PolarHBondContact O-N 2.91Å; S394-R397 PolarHBondContact O-N 3.21Å; S394-R397 WeakPolarHBondContact OG-CD 3.42Å; S394-R397 WeakPolarHBondContact OG-CG 3.49Å; S394-Y398 PolarHBondContact O-N 3.39Å
395M64.4Low79.1Confident116 Ų11648.7 Ų48.757%0.57127%0.269SS*.Hα-helixtrans-54.6-40-177.7-69.7-63.4-150.900113Y131 R397 Y398Y131-M395 HydrophobicContact CD2-CE 3.97Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 3.23Å; M395-Y398 WeakPolarHBondContact O-CB 3.46Å; M395-Y398 PolarHBondContact O-N 3.37Å
396E63.7Low79Confident149 Ų14949.3 Ų49.370%0.69627%0.273SS*.Hα-helixtrans-61.8-38.8178-64.5172.5-177.700112S394S394-E396 VanDerWaalsContact C-N 3.25Å; S394-E396 PolarHBondContact O-N 2.91Å
397R71.1Confident79.2Confident57 Ų5753.4 Ų53.422%0.21529%0.289CS..Hα-helixtrans-79.1-25.9-179.9-66.7175.6177.2-173.2-4.8112.7D263 M266 L393 S394 M395 A399 L400 V401D263-R397 HydrophobicContact CB-CG 4.3Å; D263-R397 IonicContact OD1-CZ 3.17Å; D263-R397 IonicContact OD1-NE 2.96Å; D263-R397 PolarHBondContact OD1-NE 2.9Å; D263-R397 IonicContact OD1-NH2 2.71Å; D263-R397 PolarHBondContact OD1-NH2 3.21Å; M266-R397 PolarHBondContact SD-NH1 3.44Å; M266-R397 PolarHBondContact SD-NH2 2.95Å; L393-R397 HydrophobicContact CB-CB 4.31Å; L393-R397 HydrophobicContact CD2-CB 4.12Å; S394-R397 PolarHBondContact O-N 3.21Å; S394-R397 WeakPolarHBondContact OG-CD 3.42Å; S394-R397 WeakPolarHBondContact OG-CG 3.49Å; M395-R397 VanDerWaalsContact C-N 3.3Å; M395-R397 PolarHBondContact O-N 3.23Å; R397-A399 VanDerWaalsContact C-N 3.34Å; R397-A399 PolarHBondContact O-N 2.78Å; R397-L400 PolarHBondContact O-N 3.07Å; R397-V401 WeakPolarHBondContact O-CG2 3.35Å; R397-V401 PolarHBondContact O-N 2.85Å
398Y72.3Confident79.7Confident56 Ų5650.8 Ų50.822%0.2228%0.28CS..Hα-helixtrans-59.6-44.2176.3175.5-100.7000111.7T386 I389 A390 S394 M395 L400 V401 F402T386-Y398 HydrophobicContact CG2-CE2 4.3Å; T386-Y398 WeakPolarHBondContact CG2-OH 3.39Å; I389-Y398 HydrophobicContact CG2-CD2 4.29Å; I389-Y398 HydrophobicContact CG2-CE2 4.49Å; A390-Y398 HydrophobicContact CB-CD2 3.81Å; A390-Y398 HydrophobicContact CB-CE2 3.69Å; S394-Y398 PolarHBondContact O-N 3.39Å; M395-Y398 WeakPolarHBondContact O-CB 3.46Å; M395-Y398 PolarHBondContact O-N 3.37Å; Y398-L400 PolarHBondContact O-N 3.45Å; Y398-V401 PolarHBondContact O-N 3.21Å; Y398-F402 WeakPolarHBondContact O-CB 3.5Å; Y398-F402 PolarHBondContact O-N 3.49Å
399A72.3Confident80.2Confident44 Ų4449.7 Ų49.736%0.36428%0.275SS..Hα-helixtrans-62.3-41.7177.400000112.3R397 G403R397-A399 VanDerWaalsContact C-N 3.34Å; R397-A399 PolarHBondContact O-N 2.78Å; A399-G403 PolarHBondContact O-N 3.31Å
400L77.9Confident80.5Confident25 Ų2549.4 Ų49.413%0.13127%0.274CS..Hα-helixtrans-61.6-50.3176.1176.661.1000111.8L260 D263 F264 R397 Y398 F402 G403 V404L260-L400 HydrophobicContact CD1-CD1 3.85Å; L260-L400 HydrophobicContact CD1-CD2 3.96Å; L260-L400 HydrophobicContact CD1-CG 4.35Å; L260-L400 HydrophobicContact CD2-CD1 4.01Å; L260-L400 HydrophobicContact CG-CD1 3.77Å; L260-L400 HydrophobicContact CG-CD2 4.02Å; D263-L400 HydrophobicContact CB-CD2 4.05Å; F264-L400 HydrophobicContact CB-CD2 4.24Å; R397-L400 PolarHBondContact O-N 3.07Å; Y398-L400 PolarHBondContact O-N 3.45Å; L400-F402 VanDerWaalsContact C-N 3.35Å; L400-F402 PolarHBondContact O-N 3.17Å; L400-G403 PolarHBondContact O-N 3.49Å; L400-V404 HydrophobicContact CD1-CG2 4.11Å; L400-V404 WeakPolarHBondContact O-CG2 3.22Å; L400-V404 PolarHBondContact O-N 3.45Å
401V83.3Confident81.2Confident2 Ų249.1 Ų49.11%0.01227%0.272CS..Hα-helixtrans-64.5-40.3-179.4172.40000111.2C267 Y268 I389 L393 R397 Y398 N405C267-V401 HydrophobicContact CB-CG2 3.76Å; Y268-V401 HydrophobicContact CE2-CG2 4.26Å; Y268-V401 PolarHBondContact OH-O 3.36Å; I389-V401 HydrophobicContact CG2-CB 4.34Å; I389-V401 HydrophobicContact CG2-CG1 3.63Å; L393-V401 HydrophobicContact CD1-CB 3.79Å; L393-V401 HydrophobicContact CD1-CG1 4.16Å; L393-V401 HydrophobicContact CD1-CG2 3.56Å; R397-V401 WeakPolarHBondContact O-CG2 3.35Å; R397-V401 PolarHBondContact O-N 2.85Å; Y398-V401 PolarHBondContact O-N 3.21Å; V401-N405 WeakPolarHBondContact O-CB 3.32Å; V401-N405 PolarHBondContact O-N 2.69Å; V401-N405 PolarHBondContact O-ND2 3.24Å; V401-N405 PolarHBondContact O-OD1 3.37Å
402F82.6Confident82.1Confident66 Ų6648.5 Ų48.529%0.28926%0.258SS..Hα-helixtrans-61.1-46.1174.3-177.2-91.4000111.9W280 Y398 L400 N405 T406W280-F402 HydrophobicContact CZ2-CD2 4.36Å; W280-F402 HydrophobicContact CZ2-CE2 4.01Å; Y398-F402 WeakPolarHBondContact O-CB 3.5Å; Y398-F402 PolarHBondContact O-N 3.49Å; L400-F402 VanDerWaalsContact C-N 3.35Å; L400-F402 PolarHBondContact O-N 3.17Å; F402-N405 PolarHBondContact O-N 3.3Å; F402-T406 WeakPolarHBondContact O-CB 3.3Å; F402-T406 PolarHBondContact O-N 3.46Å; F402-T406 PolarHBondContact O-OG1 3.47Å
403G83.5Confident83.2Confident27 Ų2744.7 Ų44.728%0.27824%0.238SC..Hα-helixtrans-63.2-46.417900000112.9A399 L400 T406 F407A399-G403 PolarHBondContact O-N 3.31Å; L400-G403 PolarHBondContact O-N 3.49Å; G403-T406 PolarHBondContact O-N 2.92Å; G403-F407 WeakPolarHBondContact O-CB 3.2Å; G403-F407 PolarHBondContact O-N 2.94Å
404V87Confident84.1Confident29 Ų2944.4 Ų44.418%0.17624%0.238CC..Hα-helixtrans-62.2-48.8176.4168.40000111F264 Y268 L400 T406 F407 I408F264-V404 HydrophobicContact CD2-CG2 4.01Å; F264-V404 HydrophobicContact CE2-CG1 3.81Å; F264-V404 HydrophobicContact CE2-CG2 4.01Å; Y268-V404 HydrophobicContact CE2-CB 4.37Å; Y268-V404 HydrophobicContact CE2-CG1 3.98Å; Y268-V404 WeakPolarHBondContact OH-CB 3.25Å; Y268-V404 WeakPolarHBondContact OH-CG1 3.35Å; L400-V404 HydrophobicContact CD1-CG2 4.11Å; L400-V404 WeakPolarHBondContact O-CG2 3.22Å; L400-V404 PolarHBondContact O-N 3.45Å; V404-T406 VanDerWaalsContact C-N 3.28Å; V404-T406 PolarHBondContact O-N 3.33Å; V404-F407 PolarHBondContact O-N 2.75Å; V404-I408 HydrophobicContact CG1-CD1 3.75Å; V404-I408 HydrophobicContact CG1-CG1 4.38Å; V404-I408 WeakPolarHBondContact O-CG1 3.15Å; V404-I408 PolarHBondContact O-N 3.48Å
405N91.7Very high85.4Confident3 Ų346.2 Ų46.22%0.01624%0.242CC..Hα-helixtrans-59.4-44-179.7-72.4-7.6000110.3Y268 S277 W280 V401 F402 I408 A409Y268-N405 PolarHBondContact OH-OD1 2.94Å; S277-N405 WeakPolarHBondContact CB-ND2 3.45Å; S277-N405 WeakPolarHBondContact CB-OD1 3.32Å; S277-N405 PolarHBondContact OG-ND2 3.39Å; W280-N405 HydrophobicContact CD2-CB 3.95Å; W280-N405 HydrophobicContact CE3-CB 3.39Å; W280-N405 HydrophobicContact CH2-CB 4.31Å; W280-N405 HydrophobicContact CZ3-CB 3.64Å; W280-N405 WeakPolarHBondContact CZ3-O 3.39Å; V401-N405 WeakPolarHBondContact O-CB 3.32Å; V401-N405 PolarHBondContact O-N 2.69Å; V401-N405 PolarHBondContact O-ND2 3.24Å; V401-N405 PolarHBondContact O-OD1 3.37Å; F402-N405 PolarHBondContact O-N 3.3Å; N405-I408 PolarHBondContact O-N 3.34Å; N405-A409 WeakPolarHBondContact O-CB 3.35Å; N405-A409 PolarHBondContact O-N 3.06Å
406T88.8Confident86.9Confident12 Ų1241.9 Ų41.97%0.07422%0.221CC..Hα-helixtrans-59.5-47.8176-55.90000111.4L62 W280 F402 G403 V404 I408 A409 L410L62-T406 HydrophobicContact CD2-CG2 4.36Å; W280-T406 VanDerWaalsContact CH2-OG1 3.24Å; W280-T406 WeakPolarHBondContact CH2-OG1 3.44Å; W280-T406 VanDerWaalsContact CZ3-CA 3.5Å; W280-T406 VanDerWaalsContact CZ3-N 3.25Å; F402-T406 WeakPolarHBondContact O-CB 3.3Å; F402-T406 PolarHBondContact O-N 3.46Å; F402-T406 PolarHBondContact O-OG1 3.47Å; G403-T406 PolarHBondContact O-N 2.92Å; V404-T406 VanDerWaalsContact C-N 3.28Å; V404-T406 PolarHBondContact O-N 3.33Å; T406-I408 PolarHBondContact O-N 2.92Å; T406-A409 PolarHBondContact O-N 2.93Å; T406-L410 HydrophobicContact CG2-CD1 4.32Å; T406-L410 HydrophobicContact CG2-CG 4.47Å; T406-L410 WeakPolarHBondContact O-CG 3.36Å; T406-L410 PolarHBondContact O-N 3.36Å
407F91.4Very high88.3Confident106 Ų10634.8 Ų34.847%0.46519%0.188SC..Hα-helixtrans-58.6-46.3177.5177.9-96.1000112.1L59 L62 G403 V404 A409 L410 A411L59-F407 HydrophobicContact CD1-CD2 4.19Å; L59-F407 HydrophobicContact CD1-CE2 4.02Å; L62-F407 HydrophobicContact CD2-CB 4.14Å; L62-F407 HydrophobicContact CD2-CD2 4.2Å; G403-F407 WeakPolarHBondContact O-CB 3.2Å; G403-F407 PolarHBondContact O-N 2.94Å; V404-F407 PolarHBondContact O-N 2.75Å; F407-A409 PolarHBondContact O-N 2.8Å; F407-L410 PolarHBondContact O-N 2.93Å; F407-A411 WeakPolarHBondContact O-CB 3.32Å; F407-A411 PolarHBondContact O-N 2.84Å
408I94.1Very high89.5Confident71 Ų7135.6 Ų35.636%0.36420%0.196SC..Hα-helixtrans-62.5-43.9177.5-64.7169.5000110.5A281 V404 N405 T406 L410 A411 L412A281-I408 HydrophobicContact CB-CB 4.13Å; A281-I408 HydrophobicContact CB-CG2 3.84Å; V404-I408 HydrophobicContact CG1-CD1 3.75Å; V404-I408 HydrophobicContact CG1-CG1 4.38Å; V404-I408 WeakPolarHBondContact O-CG1 3.15Å; V404-I408 PolarHBondContact O-N 3.48Å; N405-I408 PolarHBondContact O-N 3.34Å; T406-I408 PolarHBondContact O-N 2.92Å; I408-L410 PolarHBondContact O-N 3Å; I408-A411 PolarHBondContact O-N 3.01Å; I408-L412 HydrophobicContact CG2-CD1 3.88Å; I408-L412 HydrophobicContact CG2-CG 4.31Å; I408-L412 WeakPolarHBondContact O-CB 3.24Å; I408-L412 VanDerWaalsContact O-CG 3.25Å; I408-L412 WeakPolarHBondContact O-CG 3.37Å; I408-L412 PolarHBondContact O-N 3.45Å
409A95.2Very high90.6Very high1 Ų136.8 Ų36.81%0.00821%0.206CC..Hα-helixtrans-59.6-45.6177.800000112.1W280 A281 T284 N405 T406 F407 L412 Q413W280-A409 HydrophobicContact CZ3-CB 3.87Å; A281-A409 WeakPolarHBondContact O-CB 3.45Å; T284-A409 HydrophobicContact CG2-CB 3.92Å; N405-A409 WeakPolarHBondContact O-CB 3.35Å; N405-A409 PolarHBondContact O-N 3.06Å; T406-A409 PolarHBondContact O-N 2.93Å; F407-A409 PolarHBondContact O-N 2.8Å; A409-L412 PolarHBondContact O-N 3.28Å; A409-Q413 WeakPolarHBondContact O-CB 3.43Å; A409-Q413 PolarHBondContact O-N 2.89Å
410L93Very high91.6Very high1 Ų135 Ų351%0.00519%0.19CC..Hα-helixtrans-68.7-40.2177.8-65.7-176.5000112.1Y58 L59 L62 F288 T406 F407 I408 L412 Q413 T414Y58-L410 HydrophobicContact CD1-CD1 3.99Å; Y58-L410 HydrophobicContact CD1-CD2 3.61Å; Y58-L410 HydrophobicContact CD1-CG 4.48Å; Y58-L410 HydrophobicContact CD2-CD1 3.87Å; Y58-L410 HydrophobicContact CE1-CD1 3.88Å; Y58-L410 HydrophobicContact CE1-CD2 3.52Å; Y58-L410 HydrophobicContact CE1-CG 4.33Å; Y58-L410 HydrophobicContact CE2-CD1 3.7Å; Y58-L410 HydrophobicContact CG-CD1 3.99Å; Y58-L410 HydrophobicContact CG-CD2 4.34Å; L59-L410 HydrophobicContact CB-CB 4.46Å; L59-L410 HydrophobicContact CD1-CB 3.83Å; L62-L410 HydrophobicContact CB-CD1 4.45Å; L62-L410 HydrophobicContact CD2-CD1 3.76Å; L62-L410 HydrophobicContact CG-CD1 4.48Å; F288-L410 HydrophobicContact CD2-CD2 4.21Å; F288-L410 HydrophobicContact CE2-CD2 3.79Å; T406-L410 HydrophobicContact CG2-CD1 4.32Å; T406-L410 HydrophobicContact CG2-CG 4.47Å; T406-L410 WeakPolarHBondContact O-CG 3.36Å; T406-L410 PolarHBondContact O-N 3.36Å; F407-L410 PolarHBondContact O-N 2.93Å; I408-L410 PolarHBondContact O-N 3Å; L410-L412 VanDerWaalsContact C-N 3.33Å; L410-L412 PolarHBondContact O-N 3.23Å; L410-Q413 PolarHBondContact O-N 2.66Å; L410-T414 WeakPolarHBondContact O-CB 3.33Å; L410-T414 PolarHBondContact O-N 3.48Å; L410-T414 PolarHBondContact O-OG1 3.23Å; L410-T414 VanDerWaalsContact O-OG1 3.07Å
411A96.2Very high92.2Very high35 Ų3533.8 Ų33.829%0.28918%0.184SC..Hα-helixtrans-60.9-44.2176.100000111.4L59 F407 I408 T414 L415L59-A411 HydrophobicContact CD1-CB 4.43Å; F407-A411 WeakPolarHBondContact O-CB 3.32Å; F407-A411 PolarHBondContact O-N 2.84Å; I408-A411 PolarHBondContact O-N 3.01Å; A411-T414 PolarHBondContact O-N 3.24Å; A411-L415 WeakPolarHBondContact O-CB 3.38Å; A411-L415 PolarHBondContact O-N 3.36Å
412L97Very high92.5Very high54 Ų5434.3 Ų34.328%0.28319%0.186SC..Hα-helixtrans-64.4-42174-70.5171.5000111.8L282 C285 I408 A409 L410 L415 L416L282-L412 HydrophobicContact CD2-CD1 3.83Å; C285-L412 HydrophobicContact CB-CB 3.93Å; C285-L412 VanDerWaalsContact SG-C 3.54Å; I408-L412 HydrophobicContact CG2-CD1 3.88Å; I408-L412 HydrophobicContact CG2-CG 4.31Å; I408-L412 WeakPolarHBondContact O-CB 3.24Å; I408-L412 VanDerWaalsContact O-CG 3.25Å; I408-L412 WeakPolarHBondContact O-CG 3.37Å; I408-L412 PolarHBondContact O-N 3.45Å; A409-L412 PolarHBondContact O-N 3.28Å; L410-L412 VanDerWaalsContact C-N 3.33Å; L410-L412 PolarHBondContact O-N 3.23Å; L412-L415 PolarHBondContact O-N 3.29Å; L412-L416 VanDerWaalsContact O-CB 3.27Å; L412-L416 WeakPolarHBondContact O-CB 3.34Å; L412-L416 PolarHBondContact O-N 3.31Å
413Q95.8Very high92.6Very high0 Ų033.9 Ų33.90%020%0.195CC..Hα-helixtrans-62.9-45.7177.1-177.3-162.2-17.300111T55 C285 F288 Q289 N292 A409 L410 L416 T417T55-Q413 HydrophobicContact CG2-CG 3.92Å; T55-Q413 PolarHBondContact OG1-NE2 3.18Å; C285-Q413 VanDerWaalsContact SG-CA 3.53Å; C285-Q413 PolarHBondContact SG-N 3.26Å; C285-Q413 VanDerWaalsContact SG-N 3.39Å; F288-Q413 HydrophobicContact CB-CG 4.14Å; Q289-Q413 PolarHBondContact NE2-O 3.23Å; Q289-Q413 VanDerWaalsContact NE2-O 3.14Å; N292-Q413 PolarHBondContact ND2-NE2 3.03Å; A409-Q413 WeakPolarHBondContact O-CB 3.43Å; A409-Q413 PolarHBondContact O-N 2.89Å; L410-Q413 PolarHBondContact O-N 2.66Å; Q413-L416 PolarHBondContact O-N 3.43Å; Q413-T417 VanDerWaalsContact O-CB 3.28Å; Q413-T417 WeakPolarHBondContact O-CB 3.4Å; Q413-T417 PolarHBondContact O-N 3.38Å; Q413-T417 PolarHBondContact O-OG1 2.98Å
414T95.1Very high92.9Very high22 Ų2243.1 Ų43.114%0.13522%0.222CC..Hα-helixtrans-60.5-46.6176.6-68.30000111Y56 L59 L410 A411 T417 L418Y56-T414 HydrophobicContact CD1-CG2 3.66Å; Y56-T414 HydrophobicContact CE1-CG2 3.84Å; L59-T414 HydrophobicContact CD2-CG2 3.8Å; L59-T414 WeakPolarHBondContact CD2-OG1 3.4Å; L410-T414 WeakPolarHBondContact O-CB 3.33Å; L410-T414 PolarHBondContact O-N 3.48Å; L410-T414 PolarHBondContact O-OG1 3.23Å; L410-T414 VanDerWaalsContact O-OG1 3.07Å; A411-T414 PolarHBondContact O-N 3.24Å; T414-T417 PolarHBondContact O-N 3.06Å; T414-L418 WeakPolarHBondContact O-CB 3.25Å; T414-L418 PolarHBondContact O-N 2.98Å
415L96.7Very high93Very high95 Ų9543.5 Ų43.550%0.49723%0.231SC..Hα-helixtrans-61.2-47177-17963.2000111.5A411 L412 T417 L418 I419A411-L415 WeakPolarHBondContact O-CB 3.38Å; A411-L415 PolarHBondContact O-N 3.36Å; L412-L415 PolarHBondContact O-N 3.29Å; L415-T417 PolarHBondContact O-N 3.33Å; L415-L418 PolarHBondContact O-N 2.9Å; L415-I419 HydrophobicContact CD1-CD1 3.81Å; L415-I419 HydrophobicContact CD1-CG1 4.36Å; L415-I419 HydrophobicContact CG-CD1 3.9Å; L415-I419 VanDerWaalsContact O-CG1 3.3Å; L415-I419 WeakPolarHBondContact O-CG1 3.22Å; L415-I419 PolarHBondContact O-N 3.15Å
416L95.7Very high93Very high25 Ų2548.8 Ų48.813%0.13126%0.259CS..Hα-helixtrans-64.9-40.4179.5-174.556.2000111.4Q289 L412 Q413 I419 V420 I436 Y437Q289-L416 HydrophobicContact CG-CD2 3.65Å; Q289-L416 HydrophobicContact CG-CG 4.26Å; L412-L416 VanDerWaalsContact O-CB 3.27Å; L412-L416 WeakPolarHBondContact O-CB 3.34Å; L412-L416 PolarHBondContact O-N 3.31Å; Q413-L416 PolarHBondContact O-N 3.43Å; L416-I419 PolarHBondContact O-N 3.48Å; L416-V420 HydrophobicContact CD1-CB 4.43Å; L416-V420 HydrophobicContact CD1-CG2 3.6Å; L416-V420 HydrophobicContact CG-CG2 4.5Å; L416-V420 VanDerWaalsContact O-CB 3.26Å; L416-V420 WeakPolarHBondContact O-CB 3.34Å; L416-V420 PolarHBondContact O-N 2.9Å; L416-I436 HydrophobicContact CD1-CG2 4.35Å; L416-Y437 HydrophobicContact CD2-CD1 4.39Å; L416-Y437 HydrophobicContact CD2-CE1 4.36Å
417T94.7Very high92.9Very high0 Ų049 Ų490%026%0.263CS..Hα-helixtrans-63.2-45.7175.7-55.70000111.3P52 Q289 Q413 T414 L415 I419 V421 D422P52-T417 HydrophobicContact CB-CG2 3.83Å; P52-T417 HydrophobicContact CG-CG2 3.99Å; Q289-T417 PolarHBondContact NE2-OG1 3.18Å; Q413-T417 VanDerWaalsContact O-CB 3.28Å; Q413-T417 WeakPolarHBondContact O-CB 3.4Å; Q413-T417 PolarHBondContact O-N 3.38Å; Q413-T417 PolarHBondContact O-OG1 2.98Å; T414-T417 PolarHBondContact O-N 3.06Å; L415-T417 PolarHBondContact O-N 3.33Å; T417-I419 VanDerWaalsContact C-N 3.34Å; T417-I419 PolarHBondContact O-N 3.3Å; T417-V421 HydrophobicContact CG2-CB 4.13Å; T417-V421 WeakPolarHBondContact O-CA 3.4Å; T417-V421 WeakPolarHBondContact O-CB 3.38Å; T417-V421 PolarHBondContact O-N 3.37Å; T417-D422 PolarHBondContact O-N 3.4Å
418L95.2Very high92.9Very high74 Ų7445.9 Ų45.939%0.38725%0.252SS..Hα-helixtrans-60.8-42.317817865.2000112Y56 T414 L415 D422 G425Y56-L418 HydrophobicContact CE1-CB 4.42Å; Y56-L418 WeakPolarHBondContact OH-CA 3.38Å; T414-L418 WeakPolarHBondContact O-CB 3.25Å; T414-L418 PolarHBondContact O-N 2.98Å; L415-L418 PolarHBondContact O-N 2.9Å; L418-D422 HydrophobicContact CD1-CB 4.43Å; L418-G425 VanDerWaalsContact O-CA 3.25Å; L418-G425 WeakPolarHBondContact O-CA 3.34Å
419I95.6Very high92.7Very high81 Ų8145.7 Ų45.742%0.41526%0.256SS..Hα-helixtrans-74.3-48.7-178.3-66168.2000111L415 L416 T417 L426L415-I419 HydrophobicContact CD1-CD1 3.81Å; L415-I419 HydrophobicContact CD1-CG1 4.36Å; L415-I419 HydrophobicContact CG-CD1 3.9Å; L415-I419 VanDerWaalsContact O-CG1 3.3Å; L415-I419 WeakPolarHBondContact O-CG1 3.22Å; L415-I419 PolarHBondContact O-N 3.15Å; L416-I419 PolarHBondContact O-N 3.48Å; T417-I419 VanDerWaalsContact C-N 3.34Å; T417-I419 PolarHBondContact O-N 3.3Å; I419-L426 HydrophobicContact CG2-CD1 4.21Å; I419-L426 VanDerWaalsContact O-CB 3.23Å; I419-L426 WeakPolarHBondContact O-CB 3.34Å; I419-L426 VanDerWaalsContact O-CG 3.27Å; I419-L426 WeakPolarHBondContact O-CG 2.99Å; I419-L426 PolarHBondContact O-N 2.84Å
420V94.1Very high92.4Very high5 Ų546.4 Ų46.43%0.0326%0.259CS..Hα-helixtrans-92.9-40.7-165.3169.10000112.8L416 L428 Q433 I436 Y437L416-V420 HydrophobicContact CD1-CB 4.43Å; L416-V420 HydrophobicContact CD1-CG2 3.6Å; L416-V420 HydrophobicContact CG-CG2 4.5Å; L416-V420 VanDerWaalsContact O-CB 3.26Å; L416-V420 WeakPolarHBondContact O-CB 3.34Å; L416-V420 PolarHBondContact O-N 2.9Å; V420-L428 HydrophobicContact CG1-CD1 4.2Å; V420-L428 WeakPolarHBondContact O-CB 3.4Å; V420-L428 PolarHBondContact O-N 3.32Å; V420-Q433 HydrophobicContact CG1-CB 4.14Å; V420-Q433 HydrophobicContact CG1-CG 3.82Å; V420-I436 HydrophobicContact CG1-CD1 3.94Å; V420-I436 HydrophobicContact CG2-CD1 3.91Å; V420-I436 HydrophobicContact CG2-CG2 4.1Å; V420-Y437 HydrophobicContact CG1-CE1 4.45Å
421V90.6Very high92.3Very high0 Ų049 Ų490%027%0.273CS..THydrogen-bonded Turntrans-104.1-48.8-166.8-176.80000112.1F47 N48 P52 Y293 T417 A423 Q433 Y437F47-V421 WeakPolarHBondContact O-CG1 3.13Å; N48-V421 WeakPolarHBondContact CA-O 3.19Å; N48-V421 VanDerWaalsContact CB-O 3.26Å; N48-V421 WeakPolarHBondContact CB-O 3.04Å; N48-V421 PolarHBondContact ND2-O 2.96Å; N48-V421 PolarHBondContact OD1-O 2.89Å; P52-V421 HydrophobicContact CG-CG1 4.36Å; Y293-V421 HydrophobicContact CD2-CG2 4.44Å; Y293-V421 HydrophobicContact CE1-CG1 3.63Å; Y293-V421 HydrophobicContact CE1-CG2 4.32Å; Y293-V421 HydrophobicContact CE2-CG2 3.82Å; Y293-V421 WeakPolarHBondContact OH-CG1 3.43Å; T417-V421 HydrophobicContact CG2-CB 4.13Å; T417-V421 WeakPolarHBondContact O-CA 3.4Å; T417-V421 WeakPolarHBondContact O-CB 3.38Å; T417-V421 PolarHBondContact O-N 3.37Å; V421-A423 PolarHBondContact O-N 3.42Å; V421-Q433 HydrophobicContact CG2-CG 4.48Å; V421-Y437 WeakPolarHBondContact CG2-OH 3.18Å
422D88Confident92.1Very high13 Ų1349.9 Ų49.97%0.0727%0.274CS..SBendtrans-58.8139.7-173.1-165.3-42.8000111P52 Y56 T417 L418 R424 G425 G427P52-D422 HydrophobicContact CG-CB 4.4Å; Y56-D422 WeakPolarHBondContact CE2-OD2 3.47Å; Y56-D422 VanDerWaalsContact CZ-OD2 3.3Å; Y56-D422 WeakPolarHBondContact OH-CB 3.32Å; Y56-D422 PolarHBondContact OH-OD2 2.94Å; T417-D422 PolarHBondContact O-N 3.4Å; L418-D422 HydrophobicContact CD1-CB 4.43Å; D422-R424 PolarHBondContact O-N 2.81Å; D422-R424 WeakPolarHBondContact OD1-CB 3.44Å; D422-R424 WeakPolarHBondContact OD1-CG 3.19Å; D422-R424 PolarHBondContact OD1-N 3.41Å; D422-G425 WeakPolarHBondContact O-CA 3.21Å; D422-G425 PolarHBondContact O-N 3.38Å; D422-G427 WeakPolarHBondContact O-CA 3.3Å; D422-G427 PolarHBondContact O-N 2.86Å; D422-G427 VanDerWaalsContact O-N 3.14Å
423A85.4Confident92Very high57 Ų5747.3 Ų47.347%0.47126%0.261SS..THydrogen-bonded Turntrans-59.3-24.5175.100000112.8N48 E49 V421 G425N48-A423 HydrophobicContact CB-CB 4.1Å; N48-A423 PolarHBondContact O-N 3.31Å; E49-A423 HydrophobicContact CG-CB 4.41Å; V421-A423 PolarHBondContact O-N 3.42Å; A423-G425 VanDerWaalsContact C-N 3.32Å
424R89Confident92Very high222 Ų22247.3 Ų47.384%0.83826%0.261SS*.THydrogen-bonded Turntrans-75-20.4173.3-61.8176.4-176.1-175.93113.4D422D422-R424 PolarHBondContact O-N 2.81Å; D422-R424 WeakPolarHBondContact OD1-CB 3.44Å; D422-R424 WeakPolarHBondContact OD1-CG 3.19Å; D422-R424 PolarHBondContact OD1-N 3.41Å
425G90.4Very high92Very high37 Ų3750.1 Ų50.138%0.38127%0.274SS..THydrogen-bonded Turntrans-92.2-130.1173.600000111.2L418 D422 A423L418-G425 VanDerWaalsContact O-CA 3.25Å; L418-G425 WeakPolarHBondContact O-CA 3.34Å; D422-G425 WeakPolarHBondContact O-CA 3.21Å; D422-G425 PolarHBondContact O-N 3.38Å; A423-G425 VanDerWaalsContact C-N 3.32Å
426L91.5Very high92Very high114 Ų11447.7 Ų47.760%0.59726%0.262SS*.THydrogen-bonded Turntrans-82.6-20.2176.9-63.4173.5000113.1I419 L428I419-L426 HydrophobicContact CG2-CD1 4.21Å; I419-L426 VanDerWaalsContact O-CB 3.23Å; I419-L426 WeakPolarHBondContact O-CB 3.34Å; I419-L426 VanDerWaalsContact O-CG 3.27Å; I419-L426 WeakPolarHBondContact O-CG 2.99Å; I419-L426 PolarHBondContact O-N 2.84Å; L426-L428 HydrophobicContact CB-CD1 4.13Å; L426-L428 HydrophobicContact CB-CD2 3.86Å; L426-L428 HydrophobicContact CB-CG 3.61Å; L426-L428 HydrophobicContact CD1-CD1 3.94Å; L426-L428 HydrophobicContact CD1-CG 4.32Å; L426-L428 PolarHBondContact O-N 3.41Å
427G87.4Confident92.1Very high16 Ų1646.5 Ų46.517%0.16526%0.255CS..  trans54.237.6-179.700000114N48 D422N48-G427 VanDerWaalsContact ND2-CA 3.31Å; N48-G427 WeakPolarHBondContact ND2-CA 3.35Å; N48-G427 PolarHBondContact ND2-O 3.33Å; N48-G427 VanDerWaalsContact ND2-O 3.12Å; D422-G427 WeakPolarHBondContact O-CA 3.3Å; D422-G427 PolarHBondContact O-N 2.86Å; D422-G427 VanDerWaalsContact O-N 3.14Å
428L90.8Very high92.3Very high41 Ų4146.8 Ų46.822%0.21526%0.258CS..  trans-65.1151.9-168.2-63.3175.4000112.1V420 L426 T432 Q433 I436V420-L428 HydrophobicContact CG1-CD1 4.2Å; V420-L428 WeakPolarHBondContact O-CB 3.4Å; V420-L428 PolarHBondContact O-N 3.32Å; L426-L428 HydrophobicContact CB-CD1 4.13Å; L426-L428 HydrophobicContact CB-CD2 3.86Å; L426-L428 HydrophobicContact CB-CG 3.61Å; L426-L428 HydrophobicContact CD1-CD1 3.94Å; L426-L428 HydrophobicContact CD1-CG 4.32Å; L426-L428 PolarHBondContact O-N 3.41Å; L428-T432 HydrophobicContact CB-CG2 4.41Å; L428-T432 HydrophobicContact CD1-CG2 3.93Å; L428-T432 HydrophobicContact CD2-CG2 4.4Å; L428-T432 HydrophobicContact CG-CG2 4.48Å; L428-Q433 HydrophobicContact CB-CG 4.23Å; L428-Q433 PolarHBondContact O-NE2 3.01Å; L428-I436 HydrophobicContact CD1-CD1 3.36Å
429C89.3Confident92.4Very high67 Ų6746.6 Ų46.645%0.45326%0.262SS..  trans-70.7155.5174.372.60000111.3I431 T432 Q433C429-I431 PolarHBondContact O-N 3.42Å; C429-I431 VanDerWaalsContact O-N 3.1Å; C429-T432 PolarHBondContact O-N 3.09Å; C429-T432 PolarHBondContact SG-OG1 2.57Å; C429-T432 VanDerWaalsContact SG-OG1 3.34Å; C429-Q433 WeakPolarHBondContact O-CG 3.2Å; C429-Q433 PolarHBondContact O-N 3.33Å
430I88.5Confident92.5Very high15 Ų1544.8 Ų44.88%0.07725%0.251CS..Hα-helixtrans-53.5-37.1-171.2-167.660.6000114.6Y293 L297 K300 Q433 F434Y293-I430 HydrophobicContact CG-CD1 4.49Å; L297-I430 HydrophobicContact CB-CG1 4.15Å; K300-I430 HydrophobicContact CB-CG2 4Å; K300-I430 HydrophobicContact CG-CG2 4.07Å; I430-Q433 WeakPolarHBondContact O-CB 3.32Å; I430-Q433 PolarHBondContact O-N 2.95Å; I430-F434 HydrophobicContact CD1-CD2 4Å; I430-F434 HydrophobicContact CD1-CE2 3.85Å; I430-F434 HydrophobicContact CG1-CD2 4.19Å; I430-F434 HydrophobicContact CG1-CE2 4.28Å; I430-F434 WeakPolarHBondContact O-CD2 3.32Å; I430-F434 PolarHBondContact O-N 3.22Å
431I90.8Very high92.7Very high57 Ų5744.6 Ų44.629%0.29225%0.249SC..Hα-helixtrans-62.5-49.9177.8-61.3-57.9000110.3L297 K300 D359 C429 Q433 F434 L435L297-I431 HydrophobicContact CD1-CD1 3.68Å; K300-I431 HydrophobicContact CG-CD1 4.16Å; K300-I431 HydrophobicContact CG-CG1 4.41Å; D359-I431 WeakPolarHBondContact OD1-CA 3.3Å; D359-I431 WeakPolarHBondContact OD1-CD1 3.26Å; D359-I431 WeakPolarHBondContact OD1-CG2 3.4Å; C429-I431 PolarHBondContact O-N 3.42Å; C429-I431 VanDerWaalsContact O-N 3.1Å; I431-Q433 VanDerWaalsContact C-N 3.28Å; I431-Q433 PolarHBondContact O-N 3.41Å; I431-F434 PolarHBondContact O-N 3Å; I431-L435 PolarHBondContact O-N 2.93Å
432T92.9Very high93.1Very high52 Ų5246.3 Ų46.332%0.31926%0.264SS..Hα-helixtrans-64.2-34.5177.2-48.50000112L428 C429 L435 I436L428-T432 HydrophobicContact CB-CG2 4.41Å; L428-T432 HydrophobicContact CD1-CG2 3.93Å; L428-T432 HydrophobicContact CD2-CG2 4.4Å; L428-T432 HydrophobicContact CG-CG2 4.48Å; C429-T432 PolarHBondContact O-N 3.09Å; C429-T432 PolarHBondContact SG-OG1 2.57Å; C429-T432 VanDerWaalsContact SG-OG1 3.34Å; T432-L435 PolarHBondContact O-N 3.45Å; T432-I436 HydrophobicContact CG2-CD1 4.32Å; T432-I436 VanDerWaalsContact O-CG1 3.3Å; T432-I436 WeakPolarHBondContact O-CG1 3.47Å; T432-I436 PolarHBondContact O-N 3.49Å
433Q94.5Very high93.6Very high0 Ų048.5 Ų48.50%028%0.283CS..Hα-helixtrans-60.2-47.4174.1-59.4179.611.500111.1V420 V421 L428 C429 I430 I431 L435 I436 Y437V420-Q433 HydrophobicContact CG1-CB 4.14Å; V420-Q433 HydrophobicContact CG1-CG 3.82Å; V421-Q433 HydrophobicContact CG2-CG 4.48Å; L428-Q433 HydrophobicContact CB-CG 4.23Å; L428-Q433 PolarHBondContact O-NE2 3.01Å; C429-Q433 WeakPolarHBondContact O-CG 3.2Å; C429-Q433 PolarHBondContact O-N 3.33Å; I430-Q433 WeakPolarHBondContact O-CB 3.32Å; I430-Q433 PolarHBondContact O-N 2.95Å; I431-Q433 VanDerWaalsContact C-N 3.28Å; I431-Q433 PolarHBondContact O-N 3.41Å; Q433-L435 PolarHBondContact O-N 3.29Å; Q433-I436 WeakPolarHBondContact O-CB 3.44Å; Q433-I436 PolarHBondContact O-N 3Å; Q433-I436 VanDerWaalsContact O-N 3.16Å; Q433-Y437 HydrophobicContact CB-CE2 3.91Å; Q433-Y437 WeakPolarHBondContact O-CD1 3.5Å; Q433-Y437 VanDerWaalsContact O-CD2 3.29Å; Q433-Y437 WeakPolarHBondContact O-CD2 3.42Å; Q433-Y437 PolarHBondContact O-N 3.4Å
434F95.4Very high94.2Very high0 Ų046 Ų460%026%0.262CS..Hα-helixtrans-66.7-36.5179.3-91.9-98.5000113.5V290 A294 L297 V355 M358 D359 I430 I431 I436 Y437 A438V290-F434 HydrophobicContact CG1-CE1 4.01Å; V290-F434 HydrophobicContact CG1-CZ 4.45Å; A294-F434 HydrophobicContact CB-CZ 4.37Å; L297-F434 HydrophobicContact CB-CD2 4.12Å; L297-F434 HydrophobicContact CB-CE2 3.77Å; L297-F434 HydrophobicContact CB-CZ 4.05Å; L297-F434 HydrophobicContact CD1-CD2 4.46Å; L297-F434 HydrophobicContact CD2-CD1 3.56Å; L297-F434 HydrophobicContact CD2-CD2 4.06Å; L297-F434 HydrophobicContact CD2-CE1 3.6Å; L297-F434 HydrophobicContact CD2-CE2 4.09Å; L297-F434 HydrophobicContact CD2-CG 3.81Å; L297-F434 HydrophobicContact CD2-CZ 3.89Å; L297-F434 HydrophobicContact CG-CD2 4.46Å; L297-F434 HydrophobicContact CG-CE2 4.48Å; V355-F434 HydrophobicContact CG1-CD1 3.98Å; M358-F434 HydrophobicContact CE-CD1 4.38Å; M358-F434 HydrophobicContact CE-CE1 3.61Å; M358-F434 HydrophobicContact CE-CZ 4.38Å; D359-F434 HydrophobicContact CB-CB 4.02Å; I430-F434 HydrophobicContact CD1-CD2 4Å; I430-F434 HydrophobicContact CD1-CE2 3.85Å; I430-F434 HydrophobicContact CG1-CD2 4.19Å; I430-F434 HydrophobicContact CG1-CE2 4.28Å; I430-F434 WeakPolarHBondContact O-CD2 3.32Å; I430-F434 PolarHBondContact O-N 3.22Å; I431-F434 PolarHBondContact O-N 3Å; F434-I436 VanDerWaalsContact C-N 3.31Å; F434-I436 PolarHBondContact O-N 3.31Å; F434-Y437 HydrophobicContact CD2-CD2 4.28Å; F434-Y437 HydrophobicContact CD2-CE2 4.31Å; F434-Y437 HydrophobicContact CE2-CE2 4.4Å; F434-Y437 HydrophobicContact CG-CD2 4.27Å; F434-Y437 PolarHBondContact O-N 3.48Å; F434-A438 PolarHBondContact O-N 3.39Å
435L96.1Very high94.6Very high81 Ų8135.6 Ų35.642%0.42422%0.223SC..Hα-helixtrans-60.4-41.9171-176.563.7000111.7Y356 I431 T432 Q433 A438 S439Y356-L435 HydrophobicContact CD2-CD1 3.99Å; Y356-L435 HydrophobicContact CE2-CD1 3.84Å; I431-L435 PolarHBondContact O-N 2.93Å; T432-L435 PolarHBondContact O-N 3.45Å; Q433-L435 PolarHBondContact O-N 3.29Å; L435-A438 PolarHBondContact O-N 3.36Å; L435-S439 PolarHBondContact O-N 2.88Å
436I97.2Very high94.9Very high45 Ų4538.2 Ų38.223%0.23123%0.232CC..Hα-helixtrans-63-43.3174.7-68.5167000110.3L416 V420 L428 T432 Q433 F434 A438 S439 Y440L416-I436 HydrophobicContact CD1-CG2 4.35Å; V420-I436 HydrophobicContact CG1-CD1 3.94Å; V420-I436 HydrophobicContact CG2-CD1 3.91Å; V420-I436 HydrophobicContact CG2-CG2 4.1Å; L428-I436 HydrophobicContact CD1-CD1 3.36Å; T432-I436 HydrophobicContact CG2-CD1 4.32Å; T432-I436 VanDerWaalsContact O-CG1 3.3Å; T432-I436 WeakPolarHBondContact O-CG1 3.47Å; T432-I436 PolarHBondContact O-N 3.49Å; Q433-I436 WeakPolarHBondContact O-CB 3.44Å; Q433-I436 PolarHBondContact O-N 3Å; Q433-I436 VanDerWaalsContact O-N 3.16Å; F434-I436 VanDerWaalsContact C-N 3.31Å; F434-I436 PolarHBondContact O-N 3.31Å; I436-A438 PolarHBondContact O-N 3.04Å; I436-S439 PolarHBondContact O-N 3.25Å; I436-S439 PolarHBondContact O-OG 3.07Å; I436-Y440 WeakPolarHBondContact O-CB 3.06Å; I436-Y440 PolarHBondContact O-N 3.37Å
437Y97.7Very high95Very high0 Ų036.1 Ų36.10%022%0.224CC..Hα-helixtrans-64.5-39.3178-53.1-28000112.6Q289 V290 Y293 L416 V420 V421 Q433 F434 Y440 F441Q289-Y437 HydrophobicContact CB-CD1 3.74Å; Q289-Y437 HydrophobicContact CB-CD2 4.11Å; Q289-Y437 HydrophobicContact CB-CE1 3.56Å; Q289-Y437 HydrophobicContact CB-CE2 3.95Å; Q289-Y437 HydrophobicContact CB-CG 4.03Å; Q289-Y437 HydrophobicContact CG-CD1 4.11Å; Q289-Y437 HydrophobicContact CG-CE1 3.72Å; Q289-Y437 PolarHBondContact OE1-OH 3.4Å; V290-Y437 HydrophobicContact CG2-CD2 4.31Å; Y293-Y437 HydrophobicContact CD2-CE2 4.2Å; Y293-Y437 VanDerWaalsContact CD2-OH 3.23Å; Y293-Y437 WeakPolarHBondContact CD2-OH 3.43Å; L416-Y437 HydrophobicContact CD2-CD1 4.39Å; L416-Y437 HydrophobicContact CD2-CE1 4.36Å; V420-Y437 HydrophobicContact CG1-CE1 4.45Å; V421-Y437 WeakPolarHBondContact CG2-OH 3.18Å; Q433-Y437 HydrophobicContact CB-CE2 3.91Å; Q433-Y437 WeakPolarHBondContact O-CD1 3.5Å; Q433-Y437 VanDerWaalsContact O-CD2 3.29Å; Q433-Y437 WeakPolarHBondContact O-CD2 3.42Å; Q433-Y437 PolarHBondContact O-N 3.4Å; F434-Y437 HydrophobicContact CD2-CD2 4.28Å; F434-Y437 HydrophobicContact CD2-CE2 4.31Å; F434-Y437 HydrophobicContact CE2-CE2 4.4Å; F434-Y437 HydrophobicContact CG-CD2 4.27Å; F434-Y437 PolarHBondContact O-N 3.48Å; Y437-Y440 WeakPolarHBondContact O-CB 3.27Å; Y437-Y440 PolarHBondContact O-N 3.46Å; Y437-F441 WeakPolarHBondContact O-CD2 3.47Å; Y437-F441 PolarHBondContact O-N 2.71Å; Y437-F441 VanDerWaalsContact O-N 3.11Å
438A98Very high95.4Very high6 Ų635.4 Ų35.45%0.0522%0.216CC..Hα-helixtrans-61.5-46.5173.100000111.4V355 Y356 F434 L435 I436 Y440 F441 A442V355-A438 HydrophobicContact CB-CB 4.2Å; V355-A438 HydrophobicContact CG1-CB 3.98Å; Y356-A438 HydrophobicContact CD2-CB 4.46Å; F434-A438 PolarHBondContact O-N 3.39Å; L435-A438 PolarHBondContact O-N 3.36Å; I436-A438 PolarHBondContact O-N 3.04Å; A438-Y440 VanDerWaalsContact C-N 3.3Å; A438-Y440 PolarHBondContact O-N 3.36Å; A438-F441 PolarHBondContact O-N 3.16Å; A438-A442 PolarHBondContact O-N 3.35Å
439S97.8Very high95.6Very high69 Ų6936.7 Ų36.748%0.48322%0.223SC..Hα-helixtrans-64.3-34.317774.30000112.9L435 I436 A442 A443L435-S439 PolarHBondContact O-N 2.88Å; I436-S439 PolarHBondContact O-N 3.25Å; I436-S439 PolarHBondContact O-OG 3.07Å; S439-A442 WeakPolarHBondContact O-CB 3.35Å; S439-A442 PolarHBondContact O-N 3.48Å; S439-A443 PolarHBondContact O-N 3.35Å
440Y98.2Very high95.7Very high44 Ų4435.9 Ų35.917%0.17322%0.221CC..Hα-helixtrans-61.1-47.5174.6177.1-96.8000111.4L282 I436 Y437 A438 A442 A443 I444L282-Y440 VanDerWaalsContact CA-OH 3.32Å; L282-Y440 WeakPolarHBondContact CA-OH 3.37Å; L282-Y440 WeakPolarHBondContact CD2-OH 3.33Å; L282-Y440 WeakPolarHBondContact O-CE1 3.31Å; L282-Y440 PolarHBondContact O-OH 3.49Å; I436-Y440 WeakPolarHBondContact O-CB 3.06Å; I436-Y440 PolarHBondContact O-N 3.37Å; Y437-Y440 WeakPolarHBondContact O-CB 3.27Å; Y437-Y440 PolarHBondContact O-N 3.46Å; A438-Y440 VanDerWaalsContact C-N 3.3Å; A438-Y440 PolarHBondContact O-N 3.36Å; Y440-A442 PolarHBondContact O-N 3.43Å; Y440-A443 WeakPolarHBondContact O-CB 3.13Å; Y440-A443 PolarHBondContact O-N 2.86Å; Y440-I444 HydrophobicContact CD1-CD1 3.85Å; Y440-I444 HydrophobicContact CE1-CD1 3.42Å; Y440-I444 VanDerWaalsContact CE1-CD1 3.42Å; Y440-I444 HydrophobicContact CE1-CG1 4.37Å; Y440-I444 WeakPolarHBondContact O-CG1 3.35Å; Y440-I444 PolarHBondContact O-N 3.32Å
441F98.4Very high95.7Very high0 Ų038.1 Ų38.10%023%0.233CC..Hα-helixtrans-68.4-32.4175-79.7-70.3000113.3V290 I351 A352 V355 F374 Y437 A438 A443 I444 S445V290-F441 HydrophobicContact CG2-CE2 4.23Å; I351-F441 HydrophobicContact CB-CD1 4.34Å; I351-F441 HydrophobicContact CB-CG 4.46Å; I351-F441 HydrophobicContact CG2-CB 3.99Å; I351-F441 HydrophobicContact CG2-CD1 3.46Å; I351-F441 VanDerWaalsContact CG2-CD1 3.46Å; I351-F441 HydrophobicContact CG2-CD2 3.54Å; I351-F441 HydrophobicContact CG2-CE1 3.67Å; I351-F441 HydrophobicContact CG2-CE2 3.74Å; I351-F441 HydrophobicContact CG2-CG 3.39Å; I351-F441 HydrophobicContact CG2-CZ 3.79Å; A352-F441 HydrophobicContact CB-CB 3.77Å; V355-F441 HydrophobicContact CG2-CD2 4.44Å; F374-F441 HydrophobicContact CE2-CE2 4.2Å; F374-F441 HydrophobicContact CE2-CZ 4.16Å; Y437-F441 WeakPolarHBondContact O-CD2 3.47Å; Y437-F441 PolarHBondContact O-N 2.71Å; Y437-F441 VanDerWaalsContact O-N 3.11Å; A438-F441 PolarHBondContact O-N 3.16Å; F441-A443 VanDerWaalsContact C-N 3.34Å; F441-I444 HydrophobicContact CD1-CD1 3.9Å; F441-I444 HydrophobicContact CE1-CD1 4.26Å; F441-I444 PolarHBondContact O-N 2.96Å; F441-S445 WeakPolarHBondContact O-CB 3.19Å; F441-S445 PolarHBondContact O-N 3.09Å
442A98.1Very high95.5Very high37 Ų3735.7 Ų35.731%0.30622%0.222SC..Hα-helixtrans-63.8-40.6171.800000111.4A352 A438 S439 Y440 S445 V446A352-A442 HydrophobicContact CB-CB 4.1Å; A438-A442 PolarHBondContact O-N 3.35Å; S439-A442 WeakPolarHBondContact O-CB 3.35Å; S439-A442 PolarHBondContact O-N 3.48Å; Y440-A442 PolarHBondContact O-N 3.43Å; A442-S445 VanDerWaalsContact O-CB 3.32Å; A442-S445 WeakPolarHBondContact O-CB 3.35Å; A442-S445 PolarHBondContact O-N 3.06Å; A442-V446 WeakPolarHBondContact O-CG2 3.37Å; A442-V446 PolarHBondContact O-N 2.85Å
443A97.9Very high95.4Very high58 Ų5837.5 Ų37.548%0.47923%0.229SC..Hα-helixtrans-63.9-42.7174.700000112S439 Y440 F441 S445 V446 V447S439-A443 PolarHBondContact O-N 3.35Å; Y440-A443 WeakPolarHBondContact O-CB 3.13Å; Y440-A443 PolarHBondContact O-N 2.86Å; F441-A443 VanDerWaalsContact C-N 3.34Å; A443-S445 VanDerWaalsContact C-N 3.31Å; A443-S445 PolarHBondContact O-N 3.38Å; A443-V446 PolarHBondContact O-N 3.35Å; A443-V447 WeakPolarHBondContact O-CG2 3.4Å; A443-V447 PolarHBondContact O-N 2.89Å
444I97.6Very high95Very high5 Ų540.8 Ų40.83%0.02625%0.249CC..Hα-helixtrans-55.7-49.4171.8-67.5171000110L282 Y440 F441 V446 V447 F448L282-I444 HydrophobicContact CB-CD1 3.7Å; L282-I444 HydrophobicContact CB-CG1 4.02Å; L282-I444 HydrophobicContact CD1-CG1 4.29Å; Y440-I444 HydrophobicContact CD1-CD1 3.85Å; Y440-I444 HydrophobicContact CE1-CD1 3.42Å; Y440-I444 VanDerWaalsContact CE1-CD1 3.42Å; Y440-I444 HydrophobicContact CE1-CG1 4.37Å; Y440-I444 WeakPolarHBondContact O-CG1 3.35Å; Y440-I444 PolarHBondContact O-N 3.32Å; F441-I444 HydrophobicContact CD1-CD1 3.9Å; F441-I444 HydrophobicContact CE1-CD1 4.26Å; F441-I444 PolarHBondContact O-N 2.96Å; I444-V446 VanDerWaalsContact C-N 3.33Å; I444-V446 PolarHBondContact O-N 3.39Å; I444-V447 WeakPolarHBondContact O-CB 3.27Å; I444-V447 PolarHBondContact O-N 3.29Å; I444-V447 VanDerWaalsContact O-N 3.12Å; I444-F448 HydrophobicContact CG2-CD2 3.74Å; I444-F448 HydrophobicContact CG2-CE2 3.82Å; I444-F448 VanDerWaalsContact O-CD2 3.27Å; I444-F448 WeakPolarHBondContact O-CD2 3.4Å; I444-F448 PolarHBondContact O-N 3.28Å; I444-F448 VanDerWaalsContact O-N 3.08Å
445S97.5Very high94.4Very high3 Ų342.5 Ų42.52%0.02126%0.261CS..Hα-helixtrans-54.2-47.5178.2178.50000111.9F345 L349 F441 A442 A443 V447 F448 L449F345-S445 WeakPolarHBondContact CD2-O 3.31Å; F345-S445 WeakPolarHBondContact CD2-OG 3.43Å; F345-S445 VanDerWaalsContact CE2-OG 3.28Å; F345-S445 WeakPolarHBondContact CE2-OG 3.12Å; F345-S445 PolarHBondContact O-OG 2.79Å; L349-S445 WeakPolarHBondContact CB-OG 3.31Å; F441-S445 WeakPolarHBondContact O-CB 3.19Å; F441-S445 PolarHBondContact O-N 3.09Å; A442-S445 VanDerWaalsContact O-CB 3.32Å; A442-S445 WeakPolarHBondContact O-CB 3.35Å; A442-S445 PolarHBondContact O-N 3.06Å; A443-S445 VanDerWaalsContact C-N 3.31Å; A443-S445 PolarHBondContact O-N 3.38Å; S445-V447 PolarHBondContact O-N 2.93Å; S445-F448 PolarHBondContact O-N 3.07Å; S445-L449 WeakPolarHBondContact O-CB 3.4Å; S445-L449 PolarHBondContact O-N 3.29Å
446V96.8Very high93.9Very high93 Ų9343 Ų4356%0.56426%0.263SS*.Hα-helixtrans-61.1-40.4177.3173.10000112.4A442 A443 I444 L449 A450A442-V446 WeakPolarHBondContact O-CG2 3.37Å; A442-V446 PolarHBondContact O-N 2.85Å; A443-V446 PolarHBondContact O-N 3.35Å; I444-V446 VanDerWaalsContact C-N 3.33Å; I444-V446 PolarHBondContact O-N 3.39Å; V446-L449 WeakPolarHBondContact O-CB 3.24Å; V446-L449 PolarHBondContact O-N 3.19Å; V446-A450 PolarHBondContact O-N 2.92Å
447V95.2Very high93.3Very high70 Ų7044 Ų4442%0.42427%0.271SS..Hα-helixtrans-61.8-45.2177.1171.20000111.2A443 I444 S445 A450 N451A443-V447 WeakPolarHBondContact O-CG2 3.4Å; A443-V447 PolarHBondContact O-N 2.89Å; I444-V447 WeakPolarHBondContact O-CB 3.27Å; I444-V447 PolarHBondContact O-N 3.29Å; I444-V447 VanDerWaalsContact O-N 3.12Å; S445-V447 PolarHBondContact O-N 2.93Å; V447-A450 PolarHBondContact O-N 2.59Å; V447-N451 PolarHBondContact O-N 3.5Å; V447-N451 PolarHBondContact O-ND2 2.98Å
448F95.1Very high92.7Very high1 Ų149.2 Ų49.20%0.00429%0.293CS..Hα-helixtrans-74-27.7178.7-74.7-77.1000113.2C275 V278 W279 L344 F345 I444 S445 G452C275-F448 VanDerWaalsContact SG-CE1 3.52Å; V278-F448 HydrophobicContact CG1-CZ 4.29Å; W279-F448 HydrophobicContact CB-CE1 3.94Å; W279-F448 HydrophobicContact CB-CE2 3.77Å; W279-F448 HydrophobicContact CB-CZ 3.35Å; W279-F448 AromaticContact CD1-CD2 3.84Å; W279-F448 AromaticContact CD1-CE2 3.56Å; W279-F448 HydrophobicContact CG-CE2 4.07Å; W279-F448 HydrophobicContact CG-CZ 4.1Å; L344-F448 HydrophobicContact CB-CB 4.19Å; L344-F448 HydrophobicContact CB-CD1 3.91Å; L344-F448 HydrophobicContact CB-CG 3.94Å; L344-F448 HydrophobicContact CD1-CD1 3.65Å; L344-F448 HydrophobicContact CD1-CE1 3.62Å; L344-F448 HydrophobicContact CD1-CG 4.44Å; L344-F448 HydrophobicContact CD1-CZ 4.4Å; L344-F448 HydrophobicContact CG-CD1 4.45Å; F345-F448 HydrophobicContact CB-CB 4.22Å; I444-F448 HydrophobicContact CG2-CD2 3.74Å; I444-F448 HydrophobicContact CG2-CE2 3.82Å; I444-F448 VanDerWaalsContact O-CD2 3.27Å; I444-F448 WeakPolarHBondContact O-CD2 3.4Å; I444-F448 PolarHBondContact O-N 3.28Å; I444-F448 VanDerWaalsContact O-N 3.08Å; S445-F448 PolarHBondContact O-N 3.07Å; F448-G452 PolarHBondContact O-N 2.78Å
449L94.7Very high92Very high68 Ų6853.2 Ų53.236%0.35631%0.31SS..Hα-helixtrans-62.5-50.3169.2179.859.2000111.1F345 S445 V446 N451 G452 I453F345-L449 HydrophobicContact CD1-CD1 4.04Å; F345-L449 HydrophobicContact CD2-CB 3.61Å; F345-L449 HydrophobicContact CD2-CD1 4.26Å; F345-L449 HydrophobicContact CD2-CG 4.34Å; F345-L449 HydrophobicContact CE1-CD1 3.92Å; F345-L449 HydrophobicContact CE2-CB 3.91Å; F345-L449 HydrophobicContact CE2-CD1 4.14Å; F345-L449 HydrophobicContact CE2-CD2 3.97Å; F345-L449 HydrophobicContact CE2-CG 4.22Å; F345-L449 HydrophobicContact CG-CB 4.05Å; F345-L449 HydrophobicContact CG-CD1 4.21Å; F345-L449 HydrophobicContact CZ-CD1 3.97Å; F345-L449 HydrophobicContact CZ-CD2 4.2Å; F345-L449 HydrophobicContact CZ-CG 4.48Å; S445-L449 WeakPolarHBondContact O-CB 3.4Å; S445-L449 PolarHBondContact O-N 3.29Å; V446-L449 WeakPolarHBondContact O-CB 3.24Å; V446-L449 PolarHBondContact O-N 3.19Å; L449-N451 VanDerWaalsContact C-N 3.33Å; L449-N451 PolarHBondContact O-N 3.11Å; L449-G452 PolarHBondContact O-N 3.29Å; L449-I453 HydrophobicContact CD1-CD1 3.98Å; L449-I453 HydrophobicContact CD1-CG1 4.27Å; L449-I453 HydrophobicContact CG-CD1 3.94Å; L449-I453 VanDerWaalsContact O-CG1 3.3Å; L449-I453 WeakPolarHBondContact O-CG1 3.5Å; L449-I453 PolarHBondContact O-N 3.43Å
450A92.2Very high91.3Very high50 Ų5052.8 Ų52.841%0.41331%0.306SS..Hα-helixtrans-59.8-44.3179.100000111.4V446 V447 I453 V454V446-A450 PolarHBondContact O-N 2.92Å; V447-A450 PolarHBondContact O-N 2.59Å; A450-I453 PolarHBondContact O-N 2.87Å; A450-V454 VanDerWaalsContact O-CG2 3.3Å; A450-V454 WeakPolarHBondContact O-CG2 3.44Å; A450-V454 PolarHBondContact O-N 3.33Å
451N88.5Confident90.7Very high62 Ų6258.8 Ų58.833%0.33233%0.328SS..Hα-helixtrans-62.8-45175.2-75.5-34.1000112.2V447 L449 I453 V454 S455V447-N451 PolarHBondContact O-N 3.5Å; V447-N451 PolarHBondContact O-ND2 2.98Å; L449-N451 VanDerWaalsContact C-N 3.33Å; L449-N451 PolarHBondContact O-N 3.11Å; N451-I453 PolarHBondContact O-N 3.15Å; N451-V454 PolarHBondContact O-N 3.37Å; N451-S455 PolarHBondContact O-N 2.97Å; N451-S455 PolarHBondContact O-OG 3Å
452G86.9Confident89.8Confident6 Ų667 Ų676%0.06236%0.364CS..Hα-helixtrans-56.7-46.4176.100000112.7E341 F448 L449 S455 I456E341-G452 VanDerWaalsContact OE2-CA 3.3Å; E341-G452 WeakPolarHBondContact OE2-CA 3.12Å; E341-G452 PolarHBondContact OE2-N 3.08Å; F448-G452 PolarHBondContact O-N 2.78Å; L449-G452 PolarHBondContact O-N 3.29Å; G452-S455 PolarHBondContact O-N 3.38Å; G452-I456 VanDerWaalsContact O-CG1 3.25Å; G452-I456 WeakPolarHBondContact O-CG1 3.26Å; G452-I456 PolarHBondContact O-N 2.94Å
453I88.8Confident88.7Confident90 Ų9072.8 Ų72.846%0.46239%0.385SS..Hα-helixtrans-61.4-47.4176.3-66.6165.9000110.4L449 A450 N451 S455 I456 V457L449-I453 HydrophobicContact CD1-CD1 3.98Å; L449-I453 HydrophobicContact CD1-CG1 4.27Å; L449-I453 HydrophobicContact CG-CD1 3.94Å; L449-I453 VanDerWaalsContact O-CG1 3.3Å; L449-I453 WeakPolarHBondContact O-CG1 3.5Å; L449-I453 PolarHBondContact O-N 3.43Å; A450-I453 PolarHBondContact O-N 2.87Å; N451-I453 PolarHBondContact O-N 3.15Å; I453-S455 VanDerWaalsContact C-N 3.32Å; I453-S455 PolarHBondContact O-N 3.49Å; I453-I456 PolarHBondContact O-N 3.36Å; I453-V457 HydrophobicContact CG2-CG2 4.28Å; I453-V457 WeakPolarHBondContact O-CB 3.36Å; I453-V457 VanDerWaalsContact O-CG2 3.26Å; I453-V457 WeakPolarHBondContact O-CG2 3.28Å; I453-V457 PolarHBondContact O-N 3.01Å
454V86.7Confident87.3Confident69 Ų6977.4 Ų77.442%0.41840%0.396SS..Hα-helixtrans-59.9-41.8178.5169.90000111.6A450 N451 K458A450-V454 VanDerWaalsContact O-CG2 3.3Å; A450-V454 WeakPolarHBondContact O-CG2 3.44Å; A450-V454 PolarHBondContact O-N 3.33Å; N451-V454 PolarHBondContact O-N 3.37Å; V454-K458 HydrophobicContact CG1-CD 4.16Å; V454-K458 WeakPolarHBondContact O-CB 3.41Å; V454-K458 VanDerWaalsContact O-CG 3.32Å; V454-K458 WeakPolarHBondContact O-CG 3.17Å; V454-K458 PolarHBondContact O-N 3.07Å
455S83.8Confident85.4Confident35 Ų3582.8 Ų82.825%0.24543%0.425CS..Hα-helixtrans-66.8-41.4178-70.30000112.7E341 N451 G452 I453 K458 K459E341-S455 VanDerWaalsContact CD-OG 3.32Å; E341-S455 PolarHBondContact OE1-OG 3.21Å; E341-S455 WeakPolarHBondContact OE2-CB 3.39Å; E341-S455 PolarHBondContact OE2-OG 3.34Å; N451-S455 PolarHBondContact O-N 2.97Å; N451-S455 PolarHBondContact O-OG 3Å; G452-S455 PolarHBondContact O-N 3.38Å; I453-S455 VanDerWaalsContact C-N 3.32Å; I453-S455 PolarHBondContact O-N 3.49Å; S455-K458 PolarHBondContact O-N 2.87Å; S455-K459 WeakPolarHBondContact O-CG 3.43Å; S455-K459 PolarHBondContact O-N 2.89Å
456I84Confident83.4Confident93 Ų9387.7 Ų87.748%0.47746%0.457SS..Hα-helixtrans-63.3-49.1175.4-68.3165.1000109.9G452 I453 K458 K459 C460G452-I456 VanDerWaalsContact O-CG1 3.25Å; G452-I456 WeakPolarHBondContact O-CG1 3.26Å; G452-I456 PolarHBondContact O-N 2.94Å; I453-I456 PolarHBondContact O-N 3.36Å; I456-K458 VanDerWaalsContact C-N 3.31Å; I456-K458 PolarHBondContact O-N 3.33Å; I456-K459 PolarHBondContact O-N 3.06Å; I456-C460 PolarHBondContact O-N 3.13Å; I456-C460 PolarHBondContact O-SG 2.8Å
457V86.3Confident81.3Confident64 Ų6490.8 Ų90.839%0.38847%0.47SS..Hα-helixtrans-58.7-41.8178.5171.40000111.4I453 C460 R461I453-V457 HydrophobicContact CG2-CG2 4.28Å; I453-V457 WeakPolarHBondContact O-CB 3.36Å; I453-V457 VanDerWaalsContact O-CG2 3.26Å; I453-V457 WeakPolarHBondContact O-CG2 3.28Å; I453-V457 PolarHBondContact O-N 3.01Å; V457-C460 PolarHBondContact O-N 2.87Å; V457-R461 WeakPolarHBondContact O-CG 3.43Å; V457-R461 PolarHBondContact O-N 3.42Å
458K85.1Confident78.9Confident111 Ų11192.1 Ų92.148%0.48348%0.483SS..Hα-helixtrans-64.7-37.4175.4-77.4177.1179.6178.50112.9V454 S455 I456 K462V454-K458 HydrophobicContact CG1-CD 4.16Å; V454-K458 WeakPolarHBondContact O-CB 3.41Å; V454-K458 VanDerWaalsContact O-CG 3.32Å; V454-K458 WeakPolarHBondContact O-CG 3.17Å; V454-K458 PolarHBondContact O-N 3.07Å; S455-K458 PolarHBondContact O-N 2.87Å; I456-K458 VanDerWaalsContact C-N 3.31Å; I456-K458 PolarHBondContact O-N 3.33Å; K458-K462 WeakPolarHBondContact O-CG 3.31Å; K458-K462 PolarHBondContact O-N 3.31Å; K458-K462 VanDerWaalsContact O-N 3.16Å
459K82.2Confident76.4Confident89 Ų8996.8 Ų96.839%0.38752%0.516SS..Hα-helixtrans-68.2-42.9176.3-76.2179.2-179.4178.20111.2S337 T338 S455 I456 K462 Q463S337-K459 PolarHBondContact O-NZ 3.41Å; T338-K459 PolarHBondContact OG1-NZ 3.39Å; S455-K459 WeakPolarHBondContact O-CG 3.43Å; S455-K459 PolarHBondContact O-N 2.89Å; I456-K459 PolarHBondContact O-N 3.06Å; K459-K462 PolarHBondContact O-N 3.02Å; K459-Q463 PolarHBondContact O-N 3.12Å
460C84Confident73.9Confident60 Ų6099.5 Ų99.541%0.40554%0.537SS..Hα-helixtrans-62-46175.8-62.40000111.8I456 V457 K462 Q463 E464I456-C460 PolarHBondContact O-N 3.13Å; I456-C460 PolarHBondContact O-SG 2.8Å; V457-C460 PolarHBondContact O-N 2.87Å; C460-K462 VanDerWaalsContact C-N 3.33Å; C460-K462 PolarHBondContact O-N 2.93Å; C460-Q463 WeakPolarHBondContact O-CB 3.28Å; C460-Q463 PolarHBondContact O-N 3.3Å; C460-E464 PolarHBondContact O-N 3.09Å; C460-E464 VanDerWaalsContact O-N 3.15Å
461R84.6Confident71.3Confident171 Ų171105.9 Ų105.965%0.64556%0.559SS**Hα-helixtrans-60.5-39.3177.1-74.7-177.1179.6-175.60113.2V457 Q463 E464 D465V457-R461 WeakPolarHBondContact O-CG 3.43Å; V457-R461 PolarHBondContact O-N 3.42Å; R461-Q463 PolarHBondContact O-N 3.46Å; R461-E464 PolarHBondContact O-N 2.92Å; R461-D465 PolarHBondContact O-N 2.96Å
462K80.7Confident69Low173 Ų173107.1 Ų107.175%0.75258%0.577SS**Hα-helixtrans-66.3-25.3175.6-77.1-173.5177.8-168.20113.4K458 K459 C460K458-K462 WeakPolarHBondContact O-CG 3.31Å; K458-K462 PolarHBondContact O-N 3.31Å; K458-K462 VanDerWaalsContact O-N 3.16Å; K459-K462 PolarHBondContact O-N 3.02Å; C460-K462 VanDerWaalsContact C-N 3.33Å; C460-K462 PolarHBondContact O-N 2.93Å
463Q73.7Confident67.2Low157 Ų157113.4 Ų113.473%0.73461%0.614SS**Hα-helixtrans-81-25.9175.2-77.3179-34.600112.6K459 C460 R461K459-Q463 PolarHBondContact O-N 3.12Å; C460-Q463 WeakPolarHBondContact O-CB 3.28Å; C460-Q463 PolarHBondContact O-N 3.3Å; R461-Q463 PolarHBondContact O-N 3.46Å
464E69.4Low64.9Low156 Ų156115.3 Ų115.373%0.72963%0.63SS**Hα-helixtrans-79.7-15.2176.2-71.7176.5154.400113.8C460 R461 P466C460-E464 PolarHBondContact O-N 3.09Å; C460-E464 VanDerWaalsContact O-N 3.15Å; R461-E464 PolarHBondContact O-N 2.92Å; E464-P466 WeakPolarHBondContact O-CD 3.37Å
465D58.1Low62.9Low117 Ų117120.6 Ų120.663%0.62667%0.671SS**  trans-106.264.2173-79.2-37.8000114.8R461 N467R461-D465 PolarHBondContact O-N 2.96Å; D465-N467 PolarHBondContact O-N 3.09Å
466P54.9Low61.8Low106 Ų106124.9 Ų124.969%0.68869%0.692SS**THydrogen-bonded Turntrans-69.9-10.2172.8-14.326.8000115.1E464E464-P466 WeakPolarHBondContact O-CD 3.37Å
467N51.9Low60.7Low159 Ų159126.6 Ų126.685%0.8570%0.703SS**THydrogen-bonded Turntrans-106.311.9-166.1-86.3-9.9000116.1D465 S469D465-N467 PolarHBondContact O-N 3.09Å; N467-S469 PolarHBondContact O-N 3.22Å
468S46Very low59.2Low97 Ų97130.1 Ų130.168%0.67872%0.721SS**  trans-95.667.8171.357.80000111.6
469S41.5Very low57.7Low100 Ų100131.2 Ų131.270%0.69974%0.735SS**  trans-56.7134.9164-52.30000109.2N467 Q471N467-S469 PolarHBondContact O-N 3.22Å; S469-Q471 PolarHBondContact O-N 3.24Å
470P41.9Very low56.2Low125 Ų125133.8 Ų133.881%0.81276%0.757SS**  trans-63.7112.9171.425.4-29000107.6A472P470-A472 PolarHBondContact O-N 3.44Å
471Q39Very low54.3Low184 Ų184138.7 Ų138.786%0.8678%0.78SS**  trans-54.5111164.8-94.9-179.9-28.700107.5S469 T473S469-Q471 PolarHBondContact O-N 3.24Å; Q471-T473 PolarHBondContact O-N 2.91Å; Q471-T473 VanDerWaalsContact O-N 3.09Å
472A40.2Very low52.2Low87 Ų87136.4 Ų136.472%0.71979%0.79SS**  trans-52.4113.4165.700000108.4P470 T474P470-A472 PolarHBondContact O-N 3.44Å; A472-T474 PolarHBondContact O-N 3.07Å
473T49.4Very low50Low138 Ų138133.6 Ų133.685%0.84779%0.793SS**  trans-8391.1165.8-6.60000106.7Q471Q471-T473 PolarHBondContact O-N 2.91Å; Q471-T473 VanDerWaalsContact O-N 3.09Å
474T38.5Very low48Very low130 Ų130131.7 Ų131.780%0.79880%0.798SS**  trans-84.8103.315739.50000108.3A472A472-T474 PolarHBondContact O-N 3.07Å
475S45.4Very low46.1Very low181 Ų181129.5 Ų129.5100%1.26680%0.804SS**  trans-170.50152.558.30000109.2

Retrieved 475 of 475 residues in 273.4 ms (Link to these results)

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