A0A087WYP8_HUMAN Loading...

EPH receptor B6

AlphaFold DB , UniProt , Accession A0A087WYP8, Species HUMAN (Homo sapiens, Human), Gene EPHB6, Length 112 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
1G86.4Confident94.2Very high134 Ų134117.5 Ų117.5100%1.38162%0.622SS**  0110.4000000107.1
2E91.4Very high94.5Very high167 Ų167116 Ų11678%0.7861%0.609SS**PPolyproline II helixtrans-67.1153.5175.9-66.4-179.8-177.900110.4P4E2-P4 WeakPolarHBondContact O-CD 3.37Å
3R94.1Very high94.7Very high169 Ų169109.4 Ų109.464%0.63858%0.576SS**PPolyproline II helixtrans-71.1126.2175.1171.4179170.3173.2-2.8108.9Y5 W6R3-Y5 PolarHBondContact O-N 2.85Å; R3-W6 HydrophobicContact CB-CB 3.93Å; R3-W6 HydrophobicContact CG-CB 4.03Å; R3-W6 WeakPolarHBondContact O-CB 3.26Å; R3-W6 PolarHBondContact O-N 3.34Å
4P95.2Very high94.9Very high87 Ų87109.3 Ų109.357%0.56558%0.575SS**THydrogen-bonded Turntrans-59.6135.1173.1-24.335000111.2E2 W6 L23E2-P4 WeakPolarHBondContact O-CD 3.37Å; P4-W6 PolarHBondContact O-N 2.77Å; P4-L23 HydrophobicContact CB-CD1 4.03Å
5Y94.9Very high95.1Very high28 Ų28107.5 Ų107.511%0.1157%0.567CS.*THydrogen-bonded Turntrans51.442.5178.2-49-83.5000112.9R3 D7 M8 V13 F21 L23R3-Y5 PolarHBondContact O-N 2.85Å; Y5-D7 PolarHBondContact O-N 3.01Å; Y5-D7 VanDerWaalsContact O-N 3.12Å; Y5-M8 HydrophobicContact CD1-SD 3.77Å; Y5-M8 HydrophobicContact CG-SD 4.32Å; Y5-M8 PolarHBondContact O-N 3.32Å; Y5-V13 HydrophobicContact CD2-CG1 3.98Å; Y5-V13 HydrophobicContact CD2-CG2 4.36Å; Y5-V13 HydrophobicContact CE2-CG1 4.32Å; Y5-V13 HydrophobicContact CG-CG1 4.28Å; Y5-V13 HydrophobicContact CG-CG2 4Å; Y5-F21 HydrophobicContact CD1-CD1 4.42Å; Y5-F21 HydrophobicContact CD1-CE1 4.05Å; Y5-F21 AromaticContact CE1-CD1 3.84Å; Y5-F21 HydrophobicContact CE1-CD1 3.84Å; Y5-F21 AromaticContact CE1-CE1 3.76Å; Y5-F21 HydrophobicContact CE1-CE1 3.76Å; Y5-L23 HydrophobicContact CD1-CD2 3.7Å; Y5-L23 HydrophobicContact CD1-CG 4.07Å; Y5-L23 HydrophobicContact CD2-CD1 4.39Å; Y5-L23 HydrophobicContact CE1-CD2 3.86Å; Y5-L23 HydrophobicContact CE1-CG 3.76Å; Y5-L23 HydrophobicContact CE2-CD1 4.21Å; Y5-L23 HydrophobicContact CE2-CG 4.27Å; Y5-L23 HydrophobicContact CG-CD2 4.16Å; Y5-L23 HydrophobicContact CG-CG 4.47Å
6W92.4Very high95Very high178 Ų178101.4 Ų101.467%0.67454%0.536SS*.THydrogen-bonded Turntrans-62-22-168.361.8-91.8000114.7R3 P4R3-W6 HydrophobicContact CB-CB 3.93Å; R3-W6 HydrophobicContact CG-CB 4.03Å; R3-W6 WeakPolarHBondContact O-CB 3.26Å; R3-W6 PolarHBondContact O-N 3.34Å; P4-W6 PolarHBondContact O-N 2.77Å
7D93.6Very high95Very high116 Ų11699.5 Ų99.562%0.6253%0.526SS*.THydrogen-bonded Turntrans-91.12.8178.461.5-33000113.5Y5Y5-D7 PolarHBondContact O-N 3.01Å; Y5-D7 VanDerWaalsContact O-N 3.12Å
8M95.8Very high95Very high41 Ų41101.6 Ų101.620%0.20253%0.532CS..SBendtrans-117.6142.2-175.4-54.5179.374.900111.7Y5 E12 V13 A16Y5-M8 HydrophobicContact CD1-SD 3.77Å; Y5-M8 HydrophobicContact CG-SD 4.32Å; Y5-M8 PolarHBondContact O-N 3.32Å; M8-E12 HydrophobicContact CB-CB 4.1Å; M8-E12 HydrophobicContact CE-CB 3.82Å; M8-E12 WeakPolarHBondContact CE-O 3.43Å; M8-V13 HydrophobicContact CB-CG2 3.68Å; M8-V13 HydrophobicContact SD-CG2 4.49Å; M8-A16 HydrophobicContact CE-CB 3.58Å
9S97.8Very high95Very high57 Ų57104.7 Ų104.740%0.39954%0.543SS..  trans-69.9161.9164.867.40000111.3Q11 E12 V13S9-Q11 PolarHBondContact O-N 3.5Å; S9-E12 VanDerWaalsContact CB-OE2 3.28Å; S9-E12 WeakPolarHBondContact CB-OE2 3.38Å; S9-E12 PolarHBondContact N-OE2 2.94Å; S9-E12 PolarHBondContact O-N 3.3Å; S9-E12 VanDerWaalsContact O-N 3.16Å; S9-E12 VanDerWaalsContact OG-CD 3.25Å; S9-E12 VanDerWaalsContact OG-CG 3.31Å; S9-E12 WeakPolarHBondContact OG-CG 3.31Å; S9-E12 PolarHBondContact OG-N 3.43Å; S9-E12 PolarHBondContact OG-OE2 3.43Å; S9-V13 WeakPolarHBondContact O-CG2 3.45Å; S9-V13 PolarHBondContact O-N 3.42Å
10E96.4Very high94.8Very high166 Ų166105.2 Ų105.278%0.77654%0.543SS*.Hα-helixtrans-55.9-38.5179.4-64.6180176.900112.7V13 L14E10-V13 PolarHBondContact O-N 3.05Å; E10-L14 WeakPolarHBondContact O-CG 3.49Å; E10-L14 PolarHBondContact O-N 3.1Å; E10-L14 VanDerWaalsContact O-N 3.13Å
11Q98.1Very high94.8Very high150 Ų150104.8 Ų104.870%0.70154%0.537SS*.Hα-helixtrans-70.3-39.6-179.7-135.3169.627.900111.9S9 V13 L14 N15S9-Q11 PolarHBondContact O-N 3.5Å; Q11-V13 VanDerWaalsContact C-N 3.34Å; Q11-L14 PolarHBondContact O-N 3.47Å; Q11-N15 PolarHBondContact O-N 2.93Å; Q11-N15 VanDerWaalsContact O-N 3.13Å; Q11-N15 PolarHBondContact O-ND2 3.39Å
12E97.9Very high95.3Very high99 Ų99100.6 Ų100.646%0.46348%0.48SS..Hα-helixtrans-65-39.2173.9-71.6163.7142.200111.3M8 S9 L14 N15 A16M8-E12 HydrophobicContact CB-CB 4.1Å; M8-E12 HydrophobicContact CE-CB 3.82Å; M8-E12 WeakPolarHBondContact CE-O 3.43Å; S9-E12 VanDerWaalsContact CB-OE2 3.28Å; S9-E12 WeakPolarHBondContact CB-OE2 3.38Å; S9-E12 PolarHBondContact N-OE2 2.94Å; S9-E12 PolarHBondContact O-N 3.3Å; S9-E12 VanDerWaalsContact O-N 3.16Å; S9-E12 VanDerWaalsContact OG-CD 3.25Å; S9-E12 VanDerWaalsContact OG-CG 3.31Å; S9-E12 WeakPolarHBondContact OG-CG 3.31Å; S9-E12 PolarHBondContact OG-N 3.43Å; S9-E12 PolarHBondContact OG-OE2 3.43Å; E12-L14 PolarHBondContact O-N 3.19Å; E12-N15 PolarHBondContact O-N 3.36Å; E12-A16 WeakPolarHBondContact O-CB 2.97Å; E12-A16 PolarHBondContact O-N 2.98Å
13V97.4Very high95.3Very high30 Ų3095.1 Ų95.118%0.18246%0.455CS..Hα-helixtrans-60.2-45.1175.8173.40000111.2Y5 M8 S9 E10 Q11 A16 I17Y5-V13 HydrophobicContact CD2-CG1 3.98Å; Y5-V13 HydrophobicContact CD2-CG2 4.36Å; Y5-V13 HydrophobicContact CE2-CG1 4.32Å; Y5-V13 HydrophobicContact CG-CG1 4.28Å; Y5-V13 HydrophobicContact CG-CG2 4Å; M8-V13 HydrophobicContact CB-CG2 3.68Å; M8-V13 HydrophobicContact SD-CG2 4.49Å; S9-V13 WeakPolarHBondContact O-CG2 3.45Å; S9-V13 PolarHBondContact O-N 3.42Å; E10-V13 PolarHBondContact O-N 3.05Å; Q11-V13 VanDerWaalsContact C-N 3.34Å; V13-A16 PolarHBondContact O-N 2.92Å; V13-I17 HydrophobicContact CG1-CD1 3.81Å; V13-I17 HydrophobicContact CG1-CG1 4.47Å; V13-I17 VanDerWaalsContact O-CG1 3.3Å; V13-I17 WeakPolarHBondContact O-CG1 3.43Å; V13-I17 PolarHBondContact O-N 3.15Å
14L96.9Very high95.3Very high108 Ų10891.3 Ų91.357%0.56545%0.453SS*.Hα-helixtrans-59.7-49176.8-68.6173.9000111.3E10 Q11 E12 A16 I17 E18E10-L14 WeakPolarHBondContact O-CG 3.49Å; E10-L14 PolarHBondContact O-N 3.1Å; E10-L14 VanDerWaalsContact O-N 3.13Å; Q11-L14 PolarHBondContact O-N 3.47Å; E12-L14 PolarHBondContact O-N 3.19Å; L14-A16 VanDerWaalsContact C-N 3.32Å; L14-A16 PolarHBondContact O-N 3.05Å; L14-I17 PolarHBondContact O-N 2.91Å; L14-E18 WeakPolarHBondContact O-CG 3.02Å; L14-E18 PolarHBondContact O-N 3.39Å
15N97.4Very high95Very high83 Ų8390.5 Ų90.544%0.44445%0.447SS..Hα-helixtrans-59.9-42178.6-70-21000112Q11 E12 E18 Q19Q11-N15 PolarHBondContact O-N 2.93Å; Q11-N15 VanDerWaalsContact O-N 3.13Å; Q11-N15 PolarHBondContact O-ND2 3.39Å; E12-N15 PolarHBondContact O-N 3.36Å; N15-E18 PolarHBondContact O-N 2.67Å; N15-Q19 VanDerWaalsContact O-CG 3.32Å; N15-Q19 WeakPolarHBondContact O-CG 3.47Å; N15-Q19 PolarHBondContact O-N 3.04Å
16A95Very high94.8Very high10 Ų1092.3 Ų92.38%0.08346%0.463CS..Hα-helixtrans-64-43.5178.100000111.6M8 E12 V13 L14 E18 Q19 E20 F21M8-A16 HydrophobicContact CE-CB 3.58Å; E12-A16 WeakPolarHBondContact O-CB 2.97Å; E12-A16 PolarHBondContact O-N 2.98Å; V13-A16 PolarHBondContact O-N 2.92Å; L14-A16 VanDerWaalsContact C-N 3.32Å; L14-A16 PolarHBondContact O-N 3.05Å; A16-E18 VanDerWaalsContact C-N 3.32Å; A16-E18 PolarHBondContact O-N 2.9Å; A16-Q19 CarbonylContact O-C 3.48Å; A16-Q19 PolarHBondContact O-N 3.18Å; A16-E20 PolarHBondContact O-N 3.39Å; A16-F21 HydrophobicContact CB-CB 4Å; A16-F21 HydrophobicContact CB-CD1 3.92Å; A16-F21 HydrophobicContact CB-CG 4.31Å; A16-F21 VanDerWaalsContact O-CB 3.26Å; A16-F21 WeakPolarHBondContact O-CB 3.26Å; A16-F21 PolarHBondContact O-N 2.9Å
17I94.6Very high94.6Very high69 Ų6989.8 Ų89.835%0.35447%0.469SS..Hα-helixtrans-62.1-41.3177.4-69.9169000111.2V13 L14 Q19 E20 R22V13-I17 HydrophobicContact CG1-CD1 3.81Å; V13-I17 HydrophobicContact CG1-CG1 4.47Å; V13-I17 VanDerWaalsContact O-CG1 3.3Å; V13-I17 WeakPolarHBondContact O-CG1 3.43Å; V13-I17 PolarHBondContact O-N 3.15Å; L14-I17 PolarHBondContact O-N 2.91Å; I17-Q19 VanDerWaalsContact C-N 3.33Å; I17-E20 WeakPolarHBondContact O-CA 3.49Å; I17-E20 PolarHBondContact O-N 3.07Å; I17-R22 PolarHBondContact O-NH1 3.44Å; I17-R22 VanDerWaalsContact O-NH1 3.14Å
18E94.5Very high94.3Very high136 Ų13687.2 Ų87.264%0.63647%0.47SS*.Hα-helixtrans-63.2-37.5177.1-75-176.517700112.9L14 N15 A16 E20L14-E18 WeakPolarHBondContact O-CG 3.02Å; L14-E18 PolarHBondContact O-N 3.39Å; N15-E18 PolarHBondContact O-N 2.67Å; A16-E18 VanDerWaalsContact C-N 3.32Å; A16-E18 PolarHBondContact O-N 2.9Å; E18-E20 PolarHBondContact O-N 3.32Å
19Q94.4Very high94Very high161 Ų16186.2 Ų86.275%0.75247%0.467SS*.THydrogen-bonded Turntrans-78.711.2173.1-65.817819.100113.3N15 A16 I17 F21N15-Q19 VanDerWaalsContact O-CG 3.32Å; N15-Q19 WeakPolarHBondContact O-CG 3.47Å; N15-Q19 PolarHBondContact O-N 3.04Å; A16-Q19 CarbonylContact O-C 3.48Å; A16-Q19 PolarHBondContact O-N 3.18Å; I17-Q19 VanDerWaalsContact C-N 3.33Å; Q19-F21 PolarHBondContact O-N 3.01Å; Q19-F21 VanDerWaalsContact O-N 3.16Å
20E92Very high93.6Very high115 Ų11584.2 Ų84.254%0.53745%0.453SS..THydrogen-bonded Turntrans63.216.4178.9-50.5-154.9101.100114.8A16 I17 E18 R22 K43A16-E20 PolarHBondContact O-N 3.39Å; I17-E20 WeakPolarHBondContact O-CA 3.49Å; I17-E20 PolarHBondContact O-N 3.07Å; E18-E20 PolarHBondContact O-N 3.32Å; E20-R22 PolarHBondContact O-N 3.47Å; E20-K43 HydrophobicContact CG-CD 4.44Å
21F94.9Very high93.2Very high96 Ų9678.7 Ų78.742%0.42143%0.431SS..  trans-65.8135.4170179.1-98.8000110.4Y5 A16 Q19Y5-F21 HydrophobicContact CD1-CD1 4.42Å; Y5-F21 HydrophobicContact CD1-CE1 4.05Å; Y5-F21 AromaticContact CE1-CD1 3.84Å; Y5-F21 HydrophobicContact CE1-CD1 3.84Å; Y5-F21 AromaticContact CE1-CE1 3.76Å; Y5-F21 HydrophobicContact CE1-CE1 3.76Å; A16-F21 HydrophobicContact CB-CB 4Å; A16-F21 HydrophobicContact CB-CD1 3.92Å; A16-F21 HydrophobicContact CB-CG 4.31Å; A16-F21 VanDerWaalsContact O-CB 3.26Å; A16-F21 WeakPolarHBondContact O-CB 3.26Å; A16-F21 PolarHBondContact O-N 2.9Å; Q19-F21 PolarHBondContact O-N 3.01Å; Q19-F21 VanDerWaalsContact O-N 3.16Å
22R95.5Very high92.8Very high47 Ų4773.3 Ų73.318%0.17742%0.416CS..  trans-133153.1174.9-61.9-62.9179.7-91.2-0.1108.7I17 E20 L38 W41I17-R22 PolarHBondContact O-NH1 3.44Å; I17-R22 VanDerWaalsContact O-NH1 3.14Å; E20-R22 PolarHBondContact O-N 3.47Å; R22-L38 HydrophobicContact CB-CD2 3.63Å; R22-L38 HydrophobicContact CG-CD2 3.99Å; R22-W41 HydrophobicContact CB-CE3 4.32Å; R22-W41 HydrophobicContact CG-CE3 4.43Å; R22-W41 PolarHBondContact NE-O 2.92Å; R22-W41 VanDerWaalsContact NE-O 3.17Å; R22-W41 PolarHBondContact NH2-O 3.09Å
23L93.5Very high92.6Very high51 Ų5170.6 Ų70.627%0.26741%0.405SS..PPolyproline II helixtrans-60.2142.7179.3-71.2169.4000110.7P4 Y5 H34P4-L23 HydrophobicContact CB-CD1 4.03Å; Y5-L23 HydrophobicContact CD1-CD2 3.7Å; Y5-L23 HydrophobicContact CD1-CG 4.07Å; Y5-L23 HydrophobicContact CD2-CD1 4.39Å; Y5-L23 HydrophobicContact CE1-CD2 3.86Å; Y5-L23 HydrophobicContact CE1-CG 3.76Å; Y5-L23 HydrophobicContact CE2-CD1 4.21Å; Y5-L23 HydrophobicContact CE2-CG 4.27Å; Y5-L23 HydrophobicContact CG-CD2 4.16Å; Y5-L23 HydrophobicContact CG-CG 4.47Å; L23-H34 PolarHBondContact O-CE1 3.33Å; L23-H34 VanDerWaalsContact O-CE1 3.29Å
24P92.4Very high92.5Very high89 Ų8970.4 Ų70.458%0.57840%0.402SS*.PPolyproline II helixtrans-64.9165.2173.429.6-35.5000111.3
25P90.4Very high92.4Very high70 Ų7070.2 Ų70.246%0.45540%0.401SS..PPolyproline II helixtrans-59.5134.3173.824-32.4000110.7C29 H34P25-C29 HydrophobicContact CB-CB 4.2Å; P25-H34 HydrophobicContact CB-CB 4.06Å
26P89.6Confident92.3Very high67 Ų6767.2 Ų67.244%0.43538%0.384SS..PPolyproline II helixtrans-59.7157.1171.3-24.333.2000112.3G28 C29P26-G28 PolarHBondContact O-N 3.49Å; P26-C29 HydrophobicContact CB-CB 4.27Å; P26-C29 HydrophobicContact CG-CB 4.44Å; P26-C29 WeakPolarHBondContact O-CB 3.43Å; P26-C29 PolarHBondContact O-N 3.46Å
27P89.3Confident92.4Very high124 Ų12469.6 Ų69.681%0.80540%0.395SS*.THydrogen-bonded Turntrans-54.3128.5174.3-25.634.6000112.1C29P27-C29 PolarHBondContact O-N 3.23Å
28G86.8Confident92.4Very high63 Ų6368.7 Ų68.765%0.64939%0.39SS*.THydrogen-bonded Turntrans7211.7-17800000114.7P26 A70P26-G28 PolarHBondContact O-N 3.49Å; G28-A70 VanDerWaalsContact O-CB 3.29Å; G28-A70 WeakPolarHBondContact O-CB 3.41Å
29C89Confident92.6Very high20 Ų2065.6 Ų65.614%0.13538%0.378CS..  trans-72127.7175.9-171.10000110.9P25 P26 P27P25-C29 HydrophobicContact CB-CB 4.2Å; P26-C29 HydrophobicContact CB-CB 4.27Å; P26-C29 HydrophobicContact CG-CB 4.44Å; P26-C29 WeakPolarHBondContact O-CB 3.43Å; P26-C29 PolarHBondContact O-N 3.46Å; P27-C29 PolarHBondContact O-N 3.23Å
30P90.5Very high92.7Very high15 Ų1560 Ų6010%0.09736%0.355CS..  trans-63.9137.7174.3-20.533.4000111.2G32 L33 H34 L68P30-G32 VanDerWaalsContact C-N 3.31Å; P30-G32 PolarHBondContact O-N 2.97Å; P30-L33 HydrophobicContact CB-CB 4.2Å; P30-L33 HydrophobicContact CG-CB 4.42Å; P30-L33 WeakPolarHBondContact O-CB 3.41Å; P30-L33 PolarHBondContact O-N 3.23Å; P30-H34 PolarHBondContact O-N 3.22Å; P30-H34 VanDerWaalsContact O-N 3.1Å; P30-L68 HydrophobicContact CB-CD2 4.36Å; P30-L68 HydrophobicContact CG-CB 4.19Å; P30-L68 HydrophobicContact CG-CD2 4.06Å; P30-L68 WeakPolarHBondContact CG-O 3.46Å
31P87.7Confident92.9Very high50 Ų5059.3 Ų59.333%0.32535%0.347SS..Hα-helixtrans-56.1-42.9-177.1-27.634.4000113.7L33 H34 L35P31-L33 PolarHBondContact O-N 2.92Å; P31-H34 PolarHBondContact O-N 3.26Å; P31-L35 WeakPolarHBondContact O-CG 3.18Å; P31-L35 PolarHBondContact O-N 3.36Å
32G90.1Very high93Very high37 Ų3757.6 Ų57.638%0.38134%0.341SS..Hα-helixtrans-62.2-31.4177.900000113.3P30 L36P30-G32 VanDerWaalsContact C-N 3.31Å; P30-G32 PolarHBondContact O-N 2.97Å; G32-L36 PolarHBondContact O-N 2.86Å; G32-L36 VanDerWaalsContact O-N 3.17Å
33L93.6Very high92.8Very high42 Ų4261.8 Ų61.822%0.2236%0.36CS..Hα-helixtrans-73.4-43.3176.2-179.661.1000111.2P30 P31 L36 M37 F58 M61P30-L33 HydrophobicContact CB-CB 4.2Å; P30-L33 HydrophobicContact CG-CB 4.42Å; P30-L33 WeakPolarHBondContact O-CB 3.41Å; P30-L33 PolarHBondContact O-N 3.23Å; P31-L33 PolarHBondContact O-N 2.92Å; L33-L36 WeakPolarHBondContact O-CB 3.39Å; L33-L36 PolarHBondContact O-N 3.32Å; L33-M37 HydrophobicContact CD2-CE 4.32Å; L33-M37 HydrophobicContact CG-CE 4.09Å; L33-M37 WeakPolarHBondContact O-CG 3.5Å; L33-M37 PolarHBondContact O-N 2.66Å; L33-F58 HydrophobicContact CD1-CE1 3.65Å; L33-F58 HydrophobicContact CD1-CZ 4.43Å; L33-M61 HydrophobicContact CD1-CE 4.32Å
34H94.6Very high92.9Very high26 Ų2663 Ų6312%0.1237%0.367CS..Hα-helixtrans-63.4-41.4176.4-178.254000112.1L23 P25 P30 P31 L36 M37 L38L23-H34 PolarHBondContact O-CE1 3.33Å; L23-H34 VanDerWaalsContact O-CE1 3.29Å; P25-H34 HydrophobicContact CB-CB 4.06Å; P30-H34 PolarHBondContact O-N 3.22Å; P30-H34 VanDerWaalsContact O-N 3.1Å; P31-H34 PolarHBondContact O-N 3.26Å; H34-L36 VanDerWaalsContact C-N 3.32Å; H34-L36 PolarHBondContact O-N 3.28Å; H34-M37 WeakPolarHBondContact O-CB 3.46Å; H34-M37 PolarHBondContact O-N 3.08Å; H34-M37 VanDerWaalsContact O-N 3.1Å; H34-L38 PolarHBondContact O-N 3.39Å
35L93.9Very high93.1Very high103 Ų10368.7 Ų68.754%0.53938%0.377SS..Hα-helixtrans-58.7-44.2174.1-71.2175.2000111.7P31 M37 L38 D39P31-L35 WeakPolarHBondContact O-CG 3.18Å; P31-L35 PolarHBondContact O-N 3.36Å; L35-M37 VanDerWaalsContact C-N 3.28Å; L35-M37 PolarHBondContact O-N 3.39Å; L35-L38 WeakPolarHBondContact O-CB 3.42Å; L35-L38 PolarHBondContact O-N 3.37Å; L35-L38 VanDerWaalsContact O-N 3.09Å; L35-D39 PolarHBondContact O-N 3.1Å
36L95.9Very high93.5Very high20 Ų2069.3 Ų69.311%0.10539%0.388CS..Hα-helixtrans-60.5-38.5175.4-171.364.4000111.9G32 L33 H34 D39 T40 L54 A57 F58 M61G32-L36 PolarHBondContact O-N 2.86Å; G32-L36 VanDerWaalsContact O-N 3.17Å; L33-L36 WeakPolarHBondContact O-CB 3.39Å; L33-L36 PolarHBondContact O-N 3.32Å; H34-L36 VanDerWaalsContact C-N 3.32Å; H34-L36 PolarHBondContact O-N 3.28Å; L36-D39 PolarHBondContact O-N 2.97Å; L36-T40 WeakPolarHBondContact O-CG2 3.31Å; L36-T40 PolarHBondContact O-N 3.04Å; L36-T40 VanDerWaalsContact O-N 3.14Å; L36-L54 HydrophobicContact CD1-CD2 3.8Å; L36-L54 HydrophobicContact CD2-CD2 4.25Å; L36-L54 HydrophobicContact CG-CD2 4.01Å; L36-A57 HydrophobicContact CD1-CB 4.18Å; L36-A57 HydrophobicContact CD2-CB 4.01Å; L36-F58 HydrophobicContact CD2-CD1 4.34Å; L36-F58 HydrophobicContact CD2-CE1 3.86Å; L36-F58 HydrophobicContact CD2-CE2 4.12Å; L36-F58 HydrophobicContact CD2-CZ 3.72Å; L36-M61 HydrophobicContact CD2-CE 3.78Å
37M96.6Very high93.8Very high61 Ų6174.7 Ų74.730%0.340%0.4SS..Hα-helixtrans-60.6-46.2172.9-64.3175.3177.100111.2L33 H34 L35 D39 T40 W41L33-M37 HydrophobicContact CD2-CE 4.32Å; L33-M37 HydrophobicContact CG-CE 4.09Å; L33-M37 WeakPolarHBondContact O-CG 3.5Å; L33-M37 PolarHBondContact O-N 2.66Å; H34-M37 WeakPolarHBondContact O-CB 3.46Å; H34-M37 PolarHBondContact O-N 3.08Å; H34-M37 VanDerWaalsContact O-N 3.1Å; L35-M37 VanDerWaalsContact C-N 3.28Å; L35-M37 PolarHBondContact O-N 3.39Å; M37-D39 VanDerWaalsContact C-N 3.3Å; M37-D39 PolarHBondContact O-N 3.14Å; M37-T40 PolarHBondContact O-N 3.1Å; M37-T40 VanDerWaalsContact O-N 3.08Å; M37-T40 PolarHBondContact O-OG1 3.28Å; M37-W41 HydrophobicContact CB-CH2 4.19Å; M37-W41 HydrophobicContact CB-CZ3 4.21Å; M37-W41 PolarHBondContact O-N 3.42Å
38L96Very high94.2Very high49 Ų4974 Ų7426%0.25738%0.381SS..Hα-helixtrans-61.4-37.9177.4-64.5178.2000112.1R22 H34 L35 T40 W41 Q42R22-L38 HydrophobicContact CB-CD2 3.63Å; R22-L38 HydrophobicContact CG-CD2 3.99Å; H34-L38 PolarHBondContact O-N 3.39Å; L35-L38 WeakPolarHBondContact O-CB 3.42Å; L35-L38 PolarHBondContact O-N 3.37Å; L35-L38 VanDerWaalsContact O-N 3.09Å; L38-T40 VanDerWaalsContact C-N 3.29Å; L38-T40 PolarHBondContact O-N 3.34Å; L38-W41 HydrophobicContact CD2-CE3 4.18Å; L38-W41 CarbonylContact O-C 3.44Å; L38-W41 WeakPolarHBondContact O-CA 3.24Å; L38-W41 PolarHBondContact O-N 3.17Å; L38-Q42 PolarHBondContact O-N 3.29Å
39D97.2Very high94.8Very high71 Ų7172.4 Ų72.438%0.3836%0.359SS..Hα-helixtrans-61.7-36.1174.2-70-25.7000112.2L35 L36 M37 W41 Q42 P49L35-D39 PolarHBondContact O-N 3.1Å; L36-D39 PolarHBondContact O-N 2.97Å; M37-D39 VanDerWaalsContact C-N 3.3Å; M37-D39 PolarHBondContact O-N 3.14Å; D39-W41 PolarHBondContact O-N 3.36Å; D39-Q42 VanDerWaalsContact O-CG 3.24Å; D39-Q42 WeakPolarHBondContact O-CG 3.36Å; D39-P49 HydrophobicContact CB-CG 4.41Å; D39-P49 VanDerWaalsContact O-CD 3.31Å; D39-P49 WeakPolarHBondContact O-CD 3.47Å
40T97.6Very high95.2Very high44 Ų4477.6 Ų77.627%0.2738%0.381SS..Hα-helixtrans-69-18.9173.371.10000113.5L36 M37 L38 R48 P49 L54L36-T40 WeakPolarHBondContact O-CG2 3.31Å; L36-T40 PolarHBondContact O-N 3.04Å; L36-T40 VanDerWaalsContact O-N 3.14Å; M37-T40 PolarHBondContact O-N 3.1Å; M37-T40 VanDerWaalsContact O-N 3.08Å; M37-T40 PolarHBondContact O-OG1 3.28Å; L38-T40 VanDerWaalsContact C-N 3.29Å; L38-T40 PolarHBondContact O-N 3.34Å; T40-R48 WeakPolarHBondContact O-CD 3.49Å; T40-P49 HydrophobicContact CG2-CG 4.13Å; T40-L54 HydrophobicContact CG2-CD1 4.41Å; T40-L54 HydrophobicContact CG2-CD2 3.87Å
41W96.5Very high95.5Very high100 Ų10085.2 Ų85.238%0.37941%0.413SS..THydrogen-bonded Turntrans-107.517.7-176.5-58.8-26.7000114.1R22 M37 L38 D39R22-W41 HydrophobicContact CB-CE3 4.32Å; R22-W41 HydrophobicContact CG-CE3 4.43Å; R22-W41 PolarHBondContact NE-O 2.92Å; R22-W41 VanDerWaalsContact NE-O 3.17Å; R22-W41 PolarHBondContact NH2-O 3.09Å; M37-W41 HydrophobicContact CB-CH2 4.19Å; M37-W41 HydrophobicContact CB-CZ3 4.21Å; M37-W41 PolarHBondContact O-N 3.42Å; L38-W41 HydrophobicContact CD2-CE3 4.18Å; L38-W41 CarbonylContact O-C 3.44Å; L38-W41 WeakPolarHBondContact O-CA 3.24Å; L38-W41 PolarHBondContact O-N 3.17Å; D39-W41 PolarHBondContact O-N 3.36Å
42Q96.8Very high96Very high61 Ų6188 Ų8829%0.28543%0.425SS..  trans-55.5138.5173.3-69.5-69.9-18.400111.5L38 D39 R47 R48L38-Q42 PolarHBondContact O-N 3.29Å; D39-Q42 VanDerWaalsContact O-CG 3.24Å; D39-Q42 WeakPolarHBondContact O-CG 3.36Å; Q42-R47 HydrophobicContact CB-CB 4.16Å; Q42-R47 HydrophobicContact CG-CB 4.25Å; Q42-R48 HydrophobicContact CB-CG 4.01Å; Q42-R48 PolarHBondContact O-NE 2.96Å; Q42-R48 PolarHBondContact O-NH2 3.36Å
43K91.9Very high96.4Very high135 Ų13591.1 Ų91.159%0.58743%0.43SS*.SBendtrans-61.3-47.2177.9-173.1173-173.9165.70111E20 R45E20-K43 HydrophobicContact CG-CD 4.44Å; K43-R45 PolarHBondContact O-N 2.97Å
44D95.6Very high96.6Very high76 Ų7690.3 Ų90.341%0.40643%0.426SS..SBendtrans-74.7114.7171.7-177.50.3000110.4A46 R47D44-A46 PolarHBondContact O-N 3.22Å; D44-A46 WeakPolarHBondContact OD1-CB 3.39Å; D44-A46 PolarHBondContact OD1-N 3.1Å; D44-R47 HydrophobicContact CB-CB 4.43Å; D44-R47 HydrophobicContact CB-CG 4Å; D44-R47 PolarHBondContact O-N 3.04Å; D44-R47 VanDerWaalsContact O-N 3.1Å; D44-R47 IonicContact OD2-NE 3.65Å
45R96.5Very high96.8Very high209 Ų20993.8 Ų93.879%0.78945%0.449SS*.G310 helixtrans-59.5-29.6178.774177.9-167.8168.23.6113K43 R47 R48K43-R45 PolarHBondContact O-N 2.97Å; R45-R47 PolarHBondContact O-N 3.24Å; R45-R48 PolarHBondContact O-N 2.95Å
46A97.3Very high96.9Very high83 Ų8391.8 Ų91.869%0.68645%0.446SS*.G310 helixtrans-72.8-16.6-178.300000112.3D44D44-A46 PolarHBondContact O-N 3.22Å; D44-A46 WeakPolarHBondContact OD1-CB 3.39Å; D44-A46 PolarHBondContact OD1-N 3.1Å
47R96.6Very high96.9Very high179 Ų17992.3 Ų92.368%0.67545%0.454SS*.G310 helixtrans-90.6-9.9176.4-63.7-174.9-178-163.6-4.6113.7Q42 D44 R45Q42-R47 HydrophobicContact CB-CB 4.16Å; Q42-R47 HydrophobicContact CG-CB 4.25Å; D44-R47 HydrophobicContact CB-CB 4.43Å; D44-R47 HydrophobicContact CB-CG 4Å; D44-R47 PolarHBondContact O-N 3.04Å; D44-R47 VanDerWaalsContact O-N 3.1Å; D44-R47 IonicContact OD2-NE 3.65Å; R45-R47 PolarHBondContact O-N 3.24Å
48R98.3Very high96.8Very high111 Ų11193.5 Ų93.542%0.41946%0.457SS..SBendtrans-72.4138.5178.8-62.7178.2-166.1171.35109.4T40 Q42 R45T40-R48 WeakPolarHBondContact O-CD 3.49Å; Q42-R48 HydrophobicContact CB-CG 4.01Å; Q42-R48 PolarHBondContact O-NE 2.96Å; Q42-R48 PolarHBondContact O-NH2 3.36Å; R45-R48 PolarHBondContact O-N 2.95Å
49P97.9Very high96.7Very high28 Ų2894.4 Ų94.418%0.18246%0.463CS..PPolyproline II helixtrans-64.3142.7177.627.7-35.2000110.7D39 T40 Q53 L54D39-P49 HydrophobicContact CB-CG 4.41Å; D39-P49 VanDerWaalsContact O-CD 3.31Å; D39-P49 WeakPolarHBondContact O-CD 3.47Å; T40-P49 HydrophobicContact CG2-CG 4.13Å; P49-Q53 HydrophobicContact CB-CB 4.12Å; P49-L54 HydrophobicContact CB-CD2 4.12Å; P49-L54 HydrophobicContact CB-CG 4.26Å; P49-L54 HydrophobicContact CG-CD2 3.61Å; P49-L54 HydrophobicContact CG-CG 4.11Å
50H97.9Very high96.5Very high130 Ų13098 Ų9860%0.60248%0.475SS*.PPolyproline II helixtrans-74.4164168.7-67.4-70.5000110.8D52 Q53 L54H50-D52 VanDerWaalsContact C-N 3.31Å; H50-D52 WeakPolarHBondContact CB-OD1 3.46Å; H50-D52 PolarHBondContact O-N 3.41Å; H50-Q53 PolarHBondContact CD2-NE2 2.9Å; H50-Q53 WeakPolarHBondContact O-CB 3.42Å; H50-Q53 PolarHBondContact O-N 3.44Å; H50-Q53 VanDerWaalsContact O-N 3.1Å; H50-L54 PolarHBondContact O-N 2.98Å
51F98.2Very high96.2Very high175 Ų17597 Ų9777%0.76847%0.467SS*.Hα-helixtrans-61.5-36.1-175.6-81.9-69.7000113.8Q53 L54 V55F51-Q53 VanDerWaalsContact C-N 3.33Å; F51-Q53 PolarHBondContact O-N 3.36Å; F51-L54 HydrophobicContact CD1-CD1 4.19Å; F51-L54 PolarHBondContact O-N 2.98Å; F51-V55 VanDerWaalsContact O-CG2 3.31Å; F51-V55 WeakPolarHBondContact O-CG2 3.39Å; F51-V55 PolarHBondContact O-N 3.28Å
52D98.1Very high96.1Very high109 Ų10998 Ų9858%0.58348%0.479SS*.Hα-helixtrans-60-42.5173.760.8-41.2000111.9H50 V55 A56H50-D52 VanDerWaalsContact C-N 3.31Å; H50-D52 WeakPolarHBondContact CB-OD1 3.46Å; H50-D52 PolarHBondContact O-N 3.41Å; D52-V55 PolarHBondContact O-N 3.18Å; D52-A56 WeakPolarHBondContact O-CB 3.39Å; D52-A56 PolarHBondContact O-N 3.31Å
53Q97.9Very high95.9Very high101 Ų101103.7 Ų103.747%0.47250%0.498SS..Hα-helixtrans-65.8-40.6175.7-64.4175.568.200111.9P49 H50 F51 A56 A57P49-Q53 HydrophobicContact CB-CB 4.12Å; H50-Q53 PolarHBondContact CD2-NE2 2.9Å; H50-Q53 WeakPolarHBondContact O-CB 3.42Å; H50-Q53 PolarHBondContact O-N 3.44Å; H50-Q53 VanDerWaalsContact O-N 3.1Å; F51-Q53 VanDerWaalsContact C-N 3.33Å; F51-Q53 PolarHBondContact O-N 3.36Å; Q53-A56 PolarHBondContact O-N 3.46Å; Q53-A57 WeakPolarHBondContact O-CB 3.07Å; Q53-A57 PolarHBondContact O-N 3.17Å
54L97.7Very high95.6Very high26 Ų26103.2 Ų103.214%0.13650%0.496CS..Hα-helixtrans-60.9-48.9174.6-69.4177000111.2L36 T40 P49 H50 F51 A56 A57 F58L36-L54 HydrophobicContact CD1-CD2 3.8Å; L36-L54 HydrophobicContact CD2-CD2 4.25Å; L36-L54 HydrophobicContact CG-CD2 4.01Å; T40-L54 HydrophobicContact CG2-CD1 4.41Å; T40-L54 HydrophobicContact CG2-CD2 3.87Å; P49-L54 HydrophobicContact CB-CD2 4.12Å; P49-L54 HydrophobicContact CB-CG 4.26Å; P49-L54 HydrophobicContact CG-CD2 3.61Å; P49-L54 HydrophobicContact CG-CG 4.11Å; H50-L54 PolarHBondContact O-N 2.98Å; F51-L54 HydrophobicContact CD1-CD1 4.19Å; F51-L54 PolarHBondContact O-N 2.98Å; L54-A56 VanDerWaalsContact C-N 3.33Å; L54-A56 PolarHBondContact O-N 3.25Å; L54-A57 PolarHBondContact O-N 3.48Å; L54-F58 HydrophobicContact CB-CD2 4.45Å; L54-F58 HydrophobicContact CB-CE2 4.26Å; L54-F58 WeakPolarHBondContact O-CD2 3.49Å; L54-F58 PolarHBondContact O-N 3.29Å
55V98Very high94.7Very high99 Ų99103.6 Ų103.660%0.650%0.502SS*.Hα-helixtrans-59.4-45178.6170.80000110.8F51 D52 A57 F58 D59F51-V55 VanDerWaalsContact O-CG2 3.31Å; F51-V55 WeakPolarHBondContact O-CG2 3.39Å; F51-V55 PolarHBondContact O-N 3.28Å; D52-V55 PolarHBondContact O-N 3.18Å; V55-A57 PolarHBondContact O-N 3.37Å; V55-F58 PolarHBondContact O-N 2.89Å; V55-D59 WeakPolarHBondContact O-CB 3.29Å; V55-D59 PolarHBondContact O-N 3.19Å
56A96.8Very high93.9Very high60 Ų6099.3 Ų99.350%0.49650%0.495SS..Hα-helixtrans-62.7-40.2176.800000112.6D52 Q53 L54 K60D52-A56 WeakPolarHBondContact O-CB 3.39Å; D52-A56 PolarHBondContact O-N 3.31Å; Q53-A56 PolarHBondContact O-N 3.46Å; L54-A56 VanDerWaalsContact C-N 3.33Å; L54-A56 PolarHBondContact O-N 3.25Å; A56-K60 WeakPolarHBondContact O-CB 3.29Å; A56-K60 PolarHBondContact O-N 3.28Å
57A94.9Very high92.8Very high31 Ų3198.8 Ų98.826%0.25648%0.483SS..Hα-helixtrans-64.2-46176.700000111.7L36 Q53 L54 V55 K60 M61L36-A57 HydrophobicContact CD1-CB 4.18Å; L36-A57 HydrophobicContact CD2-CB 4.01Å; Q53-A57 WeakPolarHBondContact O-CB 3.07Å; Q53-A57 PolarHBondContact O-N 3.17Å; L54-A57 PolarHBondContact O-N 3.48Å; V55-A57 PolarHBondContact O-N 3.37Å; A57-K60 PolarHBondContact O-N 3.2Å; A57-M61 WeakPolarHBondContact O-CG 3.46Å; A57-M61 PolarHBondContact O-N 3.15Å; A57-M61 VanDerWaalsContact O-N 3.07Å
58F94.9Very high91.8Very high86 Ų8693.4 Ų93.438%0.37747%0.467SS..Hα-helixtrans-63-45.3176.3-72.7-59.3000112.2L33 L36 L54 V55 K60 M61 I62L33-F58 HydrophobicContact CD1-CE1 3.65Å; L33-F58 HydrophobicContact CD1-CZ 4.43Å; L36-F58 HydrophobicContact CD2-CD1 4.34Å; L36-F58 HydrophobicContact CD2-CE1 3.86Å; L36-F58 HydrophobicContact CD2-CE2 4.12Å; L36-F58 HydrophobicContact CD2-CZ 3.72Å; L54-F58 HydrophobicContact CB-CD2 4.45Å; L54-F58 HydrophobicContact CB-CE2 4.26Å; L54-F58 WeakPolarHBondContact O-CD2 3.49Å; L54-F58 PolarHBondContact O-N 3.29Å; V55-F58 PolarHBondContact O-N 2.89Å; F58-K60 VanDerWaalsContact C-N 3.29Å; F58-K60 PolarHBondContact O-N 3.17Å; F58-M61 HydrophobicContact CD1-CE 3.56Å; F58-M61 HydrophobicContact CE1-CE 3.95Å; F58-M61 HydrophobicContact CG-CE 4.35Å; F58-M61 PolarHBondContact O-N 3.5Å; F58-M61 VanDerWaalsContact O-N 3.15Å; F58-I62 WeakPolarHBondContact O-CB 3.34Å; F58-I62 WeakPolarHBondContact O-CD1 3.38Å; F58-I62 VanDerWaalsContact O-CG1 3.26Å; F58-I62 WeakPolarHBondContact O-CG1 3.43Å; F58-I62 PolarHBondContact O-N 3.26Å
59D95.3Very high90.6Very high69 Ų6993.4 Ų93.437%0.36947%0.472SS..Hα-helixtrans-58.7-42.2177.8-174.663.2000111.4V55 M61 I62 R63V55-D59 WeakPolarHBondContact O-CB 3.29Å; V55-D59 PolarHBondContact O-N 3.19Å; D59-M61 PolarHBondContact O-N 3.35Å; D59-I62 PolarHBondContact O-N 2.8Å; D59-R63 WeakPolarHBondContact O-CB 3.46Å; D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.4Å; D59-R63 PolarHBondContact O-N 3.01Å; D59-R63 IonicContact OD1-CZ 3.34Å; D59-R63 IonicContact OD1-NE 3.01Å; D59-R63 PolarHBondContact OD1-NE 2.89Å; D59-R63 IonicContact OD1-NH2 3.34Å; D59-R63 PolarHBondContact OD1-NH2 2.91Å; D59-R63 IonicContact OD2-CZ 2.77Å; D59-R63 IonicContact OD2-NE 2.85Å; D59-R63 PolarHBondContact OD2-NE 3.46Å; D59-R63 IonicContact OD2-NH2 3.49Å; D59-R63 PolarHBondContact OD2-NH2 2.97Å
60K92.1Very high88.8Confident146 Ų14694.5 Ų94.564%0.63548%0.483SS*.Hα-helixtrans-62.3-43175.3-172.6-178.3179.1-176.50112.7A56 A57 F58 K64A56-K60 WeakPolarHBondContact O-CB 3.29Å; A56-K60 PolarHBondContact O-N 3.28Å; A57-K60 PolarHBondContact O-N 3.2Å; F58-K60 VanDerWaalsContact C-N 3.29Å; F58-K60 PolarHBondContact O-N 3.17Å; K60-K64 PolarHBondContact O-N 3.09Å
61M91.9Very high86.7Confident22 Ų2290.9 Ų90.911%0.10848%0.482CS..Hα-helixtrans-66.9-43.5178.6-73.6-172.7-7500111.7L33 L36 A57 F58 D59 R63 K64 L68L33-M61 HydrophobicContact CD1-CE 4.32Å; L36-M61 HydrophobicContact CD2-CE 3.78Å; A57-M61 WeakPolarHBondContact O-CG 3.46Å; A57-M61 PolarHBondContact O-N 3.15Å; A57-M61 VanDerWaalsContact O-N 3.07Å; F58-M61 HydrophobicContact CD1-CE 3.56Å; F58-M61 HydrophobicContact CE1-CE 3.95Å; F58-M61 HydrophobicContact CG-CE 4.35Å; F58-M61 PolarHBondContact O-N 3.5Å; F58-M61 VanDerWaalsContact O-N 3.15Å; D59-M61 PolarHBondContact O-N 3.35Å; M61-R63 PolarHBondContact O-N 3.45Å; M61-K64 CarbonylContact O-C 3.21Å; M61-K64 PolarHBondContact O-N 3.03Å; M61-K64 VanDerWaalsContact O-O 3.06Å; M61-L68 HydrophobicContact CB-CD2 3.96Å; M61-L68 HydrophobicContact CB-CG 4.31Å; M61-L68 HydrophobicContact CG-CD2 4.47Å; M61-L68 HydrophobicContact SD-CD2 4.18Å
62I93.1Very high84.3Confident121 Ų12184.5 Ų84.562%0.62147%0.465SS*.Hα-helixtrans-65.9-38.9-179.3-67.4164.1000111.2F58 D59 K64F58-I62 WeakPolarHBondContact O-CB 3.34Å; F58-I62 WeakPolarHBondContact O-CD1 3.38Å; F58-I62 VanDerWaalsContact O-CG1 3.26Å; F58-I62 WeakPolarHBondContact O-CG1 3.43Å; F58-I62 PolarHBondContact O-N 3.26Å; D59-I62 PolarHBondContact O-N 2.8Å; I62-K64 PolarHBondContact O-N 3.38Å
63R93.3Very high81.9Confident181 Ų18184.7 Ų84.768%0.68347%0.466SS*.THydrogen-bonded Turntrans-70.7-14.4176.7-70.3177.9-165.2-83.5-11113.9D59 M61D59-R63 WeakPolarHBondContact O-CB 3.46Å; D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.4Å; D59-R63 PolarHBondContact O-N 3.01Å; D59-R63 IonicContact OD1-CZ 3.34Å; D59-R63 IonicContact OD1-NE 3.01Å; D59-R63 PolarHBondContact OD1-NE 2.89Å; D59-R63 IonicContact OD1-NH2 3.34Å; D59-R63 PolarHBondContact OD1-NH2 2.91Å; D59-R63 IonicContact OD2-CZ 2.77Å; D59-R63 IonicContact OD2-NE 2.85Å; D59-R63 PolarHBondContact OD2-NE 3.46Å; D59-R63 IonicContact OD2-NH2 3.49Å; D59-R63 PolarHBondContact OD2-NH2 2.97Å; M61-R63 PolarHBondContact O-N 3.45Å
64K85.7Confident79.8Confident126 Ų12684.8 Ų84.855%0.54848%0.475SS..  trans-131.677.7-179.8-67.1-170.2177-171.40110K60 M61 I62 D66 T67K60-K64 PolarHBondContact O-N 3.09Å; M61-K64 CarbonylContact O-C 3.21Å; M61-K64 PolarHBondContact O-N 3.03Å; M61-K64 VanDerWaalsContact O-O 3.06Å; I62-K64 PolarHBondContact O-N 3.38Å; K64-D66 PolarHBondContact O-N 3.02Å; K64-T67 HydrophobicContact CB-CG2 3.99Å; K64-T67 WeakPolarHBondContact O-CB 3.28Å; K64-T67 PolarHBondContact O-N 3.22Å; K64-T67 PolarHBondContact O-OG1 3.14Å
65P77.1Confident77.6Confident83 Ų8385 Ų8554%0.53948%0.483SS..G310 helixtrans-60.5-22-172.323.8-34.1000113.9T67 L68P65-T67 PolarHBondContact O-N 3.42Å; P65-L68 WeakPolarHBondContact O-CA 3.5Å; P65-L68 WeakPolarHBondContact O-CB 3.35Å; P65-L68 PolarHBondContact O-N 3.36Å
66D78.1Confident75.2Confident120 Ų12086.4 Ų86.464%0.64248%0.484SS*.G310 helixtrans-58.9-30.3172.3-56.3-37.7000112.6K64 L68 Q69K64-D66 PolarHBondContact O-N 3.02Å; D66-L68 PolarHBondContact O-N 3.06Å; D66-Q69 WeakPolarHBondContact O-CB 3.47Å; D66-Q69 WeakPolarHBondContact O-CG 3.49Å; D66-Q69 PolarHBondContact O-N 3.47Å
67T74.3Confident73.3Confident72 Ų7287.9 Ų87.944%0.44248%0.477SS..G310 helixtrans-73.3-15176.766.60000113.2K64 P65K64-T67 HydrophobicContact CB-CG2 3.99Å; K64-T67 WeakPolarHBondContact O-CB 3.28Å; K64-T67 PolarHBondContact O-N 3.22Å; K64-T67 PolarHBondContact O-OG1 3.14Å; P65-T67 PolarHBondContact O-N 3.42Å
68L76.5Confident71.5Confident65 Ų6591 Ų9134%0.3449%0.489SS..G310 helixtrans-937.1174.3-64.4173.2000112.3P30 M61 P65 D66 A70P30-L68 HydrophobicContact CB-CD2 4.36Å; P30-L68 HydrophobicContact CG-CB 4.19Å; P30-L68 HydrophobicContact CG-CD2 4.06Å; P30-L68 WeakPolarHBondContact CG-O 3.46Å; M61-L68 HydrophobicContact CB-CD2 3.96Å; M61-L68 HydrophobicContact CB-CG 4.31Å; M61-L68 HydrophobicContact CG-CD2 4.47Å; M61-L68 HydrophobicContact SD-CD2 4.18Å; P65-L68 WeakPolarHBondContact O-CA 3.5Å; P65-L68 WeakPolarHBondContact O-CB 3.35Å; P65-L68 PolarHBondContact O-N 3.36Å; D66-L68 PolarHBondContact O-N 3.06Å; L68-A70 PolarHBondContact O-N 2.98Å
69Q72.1Confident70.2Confident112 Ų11287.5 Ų87.552%0.52347%0.474SS..  trans-75.1115.5175.8-66.9-177.54.200110.6D66 G71D66-Q69 WeakPolarHBondContact O-CB 3.47Å; D66-Q69 WeakPolarHBondContact O-CG 3.49Å; D66-Q69 PolarHBondContact O-N 3.47Å; Q69-G71 PolarHBondContact O-N 3.13Å
70A61.1Low68.9Low50 Ų5087 Ų8741%0.41347%0.474SS..  trans-68.75.8172.300000113.7G28 L68G28-A70 VanDerWaalsContact O-CB 3.29Å; G28-A70 WeakPolarHBondContact O-CB 3.41Å; L68-A70 PolarHBondContact O-N 2.98Å
71G54.5Low67.6Low55 Ų5584.2 Ų84.257%0.56748%0.479SS*.  trans-94.5118.1-174.100000112.8Q69 R77Q69-G71 PolarHBondContact O-N 3.13Å; G71-R77 PolarHBondContact O-NH1 2.96Å; G71-R77 PolarHBondContact O-NH2 3.12Å
72G47.4Very low66.6Low40 Ų4089.6 Ų89.641%0.41251%0.507SS..  trans155.8104.7174.500000109R77G72-R77 PolarHBondContact O-NE 3.39Å; G72-R77 PolarHBondContact O-NH2 2.95Å
73D48Very low65.6Low114 Ų11486.6 Ų86.661%0.6151%0.506SS*.  trans-34.4136.9172.9-172.1-88.7000112.4G75 E76D73-G75 PolarHBondContact O-N 3.48Å; D73-G75 PolarHBondContact OD1-N 3.39Å; D73-E76 PolarHBondContact O-N 3.36Å; D73-E76 VanDerWaalsContact O-N 3.12Å
74P52.2Low64.9Low102 Ų10280 Ų8066%0.66248%0.484SS*.Hα-helixtrans-55-20.6-17916.5-27.1000113.6
75G52.1Low64.7Low30 Ų3079.3 Ų79.331%0.30949%0.491SS..Hα-helixtrans-70-30.7177.400000115.4D73 L79 L94D73-G75 PolarHBondContact O-N 3.48Å; D73-G75 PolarHBondContact OD1-N 3.39Å; G75-L79 VanDerWaalsContact O-CD1 3.26Å; G75-L79 WeakPolarHBondContact O-CD1 3.26Å; G75-L94 WeakPolarHBondContact O-CD2 3.33Å
76E48.7Very low65.2Low129 Ų12980.1 Ų80.160%0.60349%0.49SS*.Hα-helixtrans-92.6-22.8-165.2-163.7160.6170.900114.1D73 L94D73-E76 PolarHBondContact O-N 3.36Å; D73-E76 VanDerWaalsContact O-N 3.12Å; E76-L94 HydrophobicContact CG-CD1 4.2Å
77R56.4Low65.2Low92 Ų9277 Ų7735%0.34748%0.481SS..Hα-helixtrans-99.5-12.5-171.8-60.1-162.5-117.7-156.518.6115.3G71 G72G71-R77 PolarHBondContact O-NH1 2.96Å; G71-R77 PolarHBondContact O-NH2 3.12Å; G72-R77 PolarHBondContact O-NE 3.39Å; G72-R77 PolarHBondContact O-NH2 2.95Å
78D57.6Low65.7Low96 Ų9675.8 Ų75.851%0.51348%0.483SS..Hα-helixtrans-78.9-25.5-180-72.1-13.7000112.8A81 L82D78-A81 WeakPolarHBondContact O-CB 3.3Å; D78-A81 PolarHBondContact O-N 2.97Å; D78-A81 VanDerWaalsContact O-N 3.17Å; D78-L82 VanDerWaalsContact O-CG 3.29Å; D78-L82 WeakPolarHBondContact O-CG 3.44Å; D78-L82 PolarHBondContact O-N 3.16Å
79L67.2Low66.1Low12 Ų1278 Ų786%0.06349%0.491CS..Hα-helixtrans-65.2-46.6-176.6-79.880.4000113.2G75 A81 L82 G83 I84 Q90 L93 L94G75-L79 VanDerWaalsContact O-CD1 3.26Å; G75-L79 WeakPolarHBondContact O-CD1 3.26Å; L79-A81 VanDerWaalsContact C-N 3.26Å; L79-A81 PolarHBondContact O-N 3.21Å; L79-L82 PolarHBondContact O-N 2.76Å; L79-G83 PolarHBondContact O-N 3.12Å; L79-I84 CarbonylContact C-O 3.43Å; L79-I84 HydrophobicContact CB-CB 4.19Å; L79-I84 HydrophobicContact CB-CD1 4.36Å; L79-I84 HydrophobicContact CD2-CD1 4.44Å; L79-I84 HydrophobicContact CD2-CG2 4.5Å; L79-I84 HydrophobicContact CG-CD1 4.2Å; L79-I84 WeakPolarHBondContact O-CA 3.35Å; L79-I84 VanDerWaalsContact O-CB 3.28Å; L79-I84 WeakPolarHBondContact O-CB 3.46Å; L79-I84 PolarHBondContact O-N 3.35Å; L79-Q90 HydrophobicContact CB-CG 4Å; L79-Q90 HydrophobicContact CD2-CB 4.07Å; L79-Q90 HydrophobicContact CD2-CG 4.18Å; L79-L93 HydrophobicContact CD2-CB 3.68Å; L79-L93 HydrophobicContact CD2-CD1 3.84Å; L79-L93 HydrophobicContact CD2-CG 4.43Å; L79-L94 HydrophobicContact CD1-CD2 4.26Å
80P67.8Low66.6Low59 Ų5974.5 Ų74.538%0.38348%0.475SS..Hα-helixtrans-56.3-39170.9-22.629000113.5L82 G83 I84P80-L82 VanDerWaalsContact C-N 3.3Å; P80-L82 PolarHBondContact O-N 3.01Å; P80-G83 PolarHBondContact O-N 2.98Å; P80-G83 VanDerWaalsContact O-N 3.15Å; P80-I84 WeakPolarHBondContact CA-O 3.5Å
81A64.6Low67.6Low88 Ų8879.7 Ų79.773%0.72749%0.488SS*.Hα-helixtrans-69-28.3179.800000112.6D78 L79 G83D78-A81 WeakPolarHBondContact O-CB 3.3Å; D78-A81 PolarHBondContact O-N 2.97Å; D78-A81 VanDerWaalsContact O-N 3.17Å; L79-A81 VanDerWaalsContact C-N 3.26Å; L79-A81 PolarHBondContact O-N 3.21Å; A81-G83 PolarHBondContact O-N 3.26Å
82L71.9Confident69.2Low134 Ų13483.5 Ų83.570%0.70249%0.489SS*.THydrogen-bonded Turntrans-82.911.3173.1-65.7169.7000113.4D78 L79 P80 I84D78-L82 VanDerWaalsContact O-CG 3.29Å; D78-L82 WeakPolarHBondContact O-CG 3.44Å; D78-L82 PolarHBondContact O-N 3.16Å; L79-L82 PolarHBondContact O-N 2.76Å; P80-L82 VanDerWaalsContact C-N 3.3Å; P80-L82 PolarHBondContact O-N 3.01Å; L82-I84 VanDerWaalsContact C-N 3.35Å; L82-I84 HydrophobicContact CB-CD1 4.3Å
83G70.8Confident71.1Confident58 Ų5885.2 Ų85.260%0.59849%0.488SS*.THydrogen-bonded Turntrans83.65.8179.900000114.5L79 P80 A81 T85L79-G83 PolarHBondContact O-N 3.12Å; P80-G83 PolarHBondContact O-N 2.98Å; P80-G83 VanDerWaalsContact O-N 3.15Å; A81-G83 PolarHBondContact O-N 3.26Å; G83-T85 PolarHBondContact O-N 3.36Å
84I79.7Confident72.8Confident44 Ų4481.9 Ų81.923%0.22647%0.47CS..  trans-93.682.1178.6-53.9150000108.4L79 P80 L82 H89 Q90 L93L79-I84 CarbonylContact C-O 3.43Å; L79-I84 HydrophobicContact CB-CB 4.19Å; L79-I84 HydrophobicContact CB-CD1 4.36Å; L79-I84 HydrophobicContact CD2-CD1 4.44Å; L79-I84 HydrophobicContact CD2-CG2 4.5Å; L79-I84 HydrophobicContact CG-CD1 4.2Å; L79-I84 WeakPolarHBondContact O-CA 3.35Å; L79-I84 VanDerWaalsContact O-CB 3.28Å; L79-I84 WeakPolarHBondContact O-CB 3.46Å; L79-I84 PolarHBondContact O-N 3.35Å; P80-I84 WeakPolarHBondContact CA-O 3.5Å; L82-I84 VanDerWaalsContact C-N 3.35Å; L82-I84 HydrophobicContact CB-CD1 4.3Å; I84-H89 HydrophobicContact CG2-CB 3.66Å; I84-Q90 HydrophobicContact CG2-CG 4.06Å; I84-Q90 WeakPolarHBondContact O-CG 3.46Å; I84-Q90 PolarHBondContact O-NE2 3.13Å; I84-L93 HydrophobicContact CD1-CD1 3.51Å; I84-L93 HydrophobicContact CG1-CD1 4.25Å; I84-L93 HydrophobicContact CG2-CD1 4.07Å
85T81.8Confident74.5Confident111 Ų11182.2 Ų82.268%0.68146%0.462SS*.  trans-89.7-18.3-174.157.10000113.9G83 A87 Q90G83-T85 PolarHBondContact O-N 3.36Å; T85-A87 PolarHBondContact O-N 3.27Å; T85-Q90 PolarHBondContact O-NE2 3.26Å
86L86.1Confident76.2Confident100 Ų10085.6 Ų85.652%0.52447%0.47SS..  trans-79.6119.5-179.1-170.969.1000110.9G88 H89 Q90L86-G88 PolarHBondContact O-N 3.25Å; L86-G88 VanDerWaalsContact O-N 3.09Å; L86-H89 HydrophobicContact CB-CB 4.34Å; L86-H89 WeakPolarHBondContact O-CA 3.32Å; L86-H89 WeakPolarHBondContact O-CB 3.26Å; L86-H89 PolarHBondContact O-N 3.04Å; L86-Q90 PolarHBondContact O-N 3.32Å
87A78.5Confident78Confident55 Ų5582.9 Ų82.946%0.45546%0.459SS..Hα-helixtrans-53.9-33.5-179.400000113.8T85 Q90 K91T85-A87 PolarHBondContact O-N 3.27Å; A87-Q90 PolarHBondContact O-N 2.98Å; A87-K91 WeakPolarHBondContact O-CG 3.33Å; A87-K91 PolarHBondContact O-N 2.87Å
88G84.8Confident79.3Confident46 Ų4684.9 Ų84.947%0.47447%0.472SS..Hα-helixtrans-65.3-41.4174.700000113.2L86 K92L86-G88 PolarHBondContact O-N 3.25Å; L86-G88 VanDerWaalsContact O-N 3.09Å; G88-K92 WeakPolarHBondContact O-CB 3.47Å; G88-K92 PolarHBondContact O-N 3.45Å; G88-K92 VanDerWaalsContact O-N 3.13Å
89H84.1Confident80.9Confident110 Ų11084.2 Ų84.251%0.50947%0.468SS..Hα-helixtrans-69.1-38.5175.4-65.3157.6000111.5I84 L86 K92 L93I84-H89 HydrophobicContact CG2-CB 3.66Å; L86-H89 HydrophobicContact CB-CB 4.34Å; L86-H89 WeakPolarHBondContact O-CA 3.32Å; L86-H89 WeakPolarHBondContact O-CB 3.26Å; L86-H89 PolarHBondContact O-N 3.04Å; H89-K92 PolarHBondContact O-N 3.16Å; H89-L93 WeakPolarHBondContact O-CB 3.49Å; H89-L93 WeakPolarHBondContact O-CG 3.37Å; H89-L93 PolarHBondContact O-N 3.03Å
90Q84.1Confident81.8Confident40 Ų4088.9 Ų88.919%0.18749%0.493CS..Hα-helixtrans-59.4-52.1176.4-66.2168.6-0.200111.5L79 I84 T85 L86 A87 K92 L93 L94L79-Q90 HydrophobicContact CB-CG 4Å; L79-Q90 HydrophobicContact CD2-CB 4.07Å; L79-Q90 HydrophobicContact CD2-CG 4.18Å; I84-Q90 HydrophobicContact CG2-CG 4.06Å; I84-Q90 WeakPolarHBondContact O-CG 3.46Å; I84-Q90 PolarHBondContact O-NE2 3.13Å; T85-Q90 PolarHBondContact O-NE2 3.26Å; L86-Q90 PolarHBondContact O-N 3.32Å; A87-Q90 PolarHBondContact O-N 2.98Å; Q90-K92 VanDerWaalsContact C-N 3.32Å; Q90-K92 PolarHBondContact O-N 2.95Å; Q90-L93 PolarHBondContact O-N 3.44Å; Q90-L94 WeakPolarHBondContact O-CB 3.4Å; Q90-L94 WeakPolarHBondContact O-CG 3.28Å; Q90-L94 PolarHBondContact O-N 3.42Å
91K82.6Confident82.7Confident158 Ų15891.4 Ų91.469%0.68750%0.499SS*.Hα-helixtrans-58.9-41.9177.7-73.2179.2-179.4-175.50112.6A87 H95A87-K91 WeakPolarHBondContact O-CG 3.33Å; A87-K91 PolarHBondContact O-N 2.87Å; K91-H95 WeakPolarHBondContact O-CB 3.31Å; K91-H95 PolarHBondContact O-N 2.68Å
92K87.6Confident83.8Confident136 Ų13692.5 Ų92.559%0.59149%0.489SS*.Hα-helixtrans-64.1-45.2179-169.1174.9-177.5-179.20111.3G88 H89 Q90 H95 H96G88-K92 WeakPolarHBondContact O-CB 3.47Å; G88-K92 PolarHBondContact O-N 3.45Å; G88-K92 VanDerWaalsContact O-N 3.13Å; H89-K92 PolarHBondContact O-N 3.16Å; Q90-K92 VanDerWaalsContact C-N 3.32Å; Q90-K92 PolarHBondContact O-N 2.95Å; K92-H95 PolarHBondContact O-N 3.4Å; K92-H96 PolarHBondContact O-CD2 3.06Å; K92-H96 VanDerWaalsContact O-CD2 3.23Å; K92-H96 PolarHBondContact O-N 3.45Å; K92-H96 VanDerWaalsContact O-N 3.13Å
93L86.8Confident84.4Confident75 Ų7591 Ų9139%0.39348%0.478SS..Hα-helixtrans-65.9-45.5179-76.6169000112.1L79 I84 H89 Q90 H95 H96 I97L79-L93 HydrophobicContact CD2-CB 3.68Å; L79-L93 HydrophobicContact CD2-CD1 3.84Å; L79-L93 HydrophobicContact CD2-CG 4.43Å; I84-L93 HydrophobicContact CD1-CD1 3.51Å; I84-L93 HydrophobicContact CG1-CD1 4.25Å; I84-L93 HydrophobicContact CG2-CD1 4.07Å; H89-L93 WeakPolarHBondContact O-CB 3.49Å; H89-L93 WeakPolarHBondContact O-CG 3.37Å; H89-L93 PolarHBondContact O-N 3.03Å; Q90-L93 PolarHBondContact O-N 3.44Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 2.89Å; L93-H96 PolarHBondContact O-N 3.37Å; L93-H96 VanDerWaalsContact O-N 3.16Å; L93-I97 WeakPolarHBondContact O-CG1 3.31Å; L93-I97 PolarHBondContact O-N 3.37Å
94L84.1Confident84.8Confident44 Ų4493.6 Ų93.623%0.2348%0.478CS..Hα-helixtrans-57.2-44175.8-72.1171.8000112.1G75 E76 L79 Q90 H96 I97 Q98G75-L94 WeakPolarHBondContact O-CD2 3.33Å; E76-L94 HydrophobicContact CG-CD1 4.2Å; L79-L94 HydrophobicContact CD1-CD2 4.26Å; Q90-L94 WeakPolarHBondContact O-CB 3.4Å; Q90-L94 WeakPolarHBondContact O-CG 3.28Å; Q90-L94 PolarHBondContact O-N 3.42Å; L94-H96 PolarHBondContact O-N 3.33Å; L94-I97 PolarHBondContact O-N 3.13Å; L94-Q98 WeakPolarHBondContact O-CB 3.32Å; L94-Q98 PolarHBondContact O-N 2.88Å
95H88.1Confident85Confident109 Ų109102 Ų10251%0.50551%0.507SS..Hα-helixtrans-59.1-45.9175.8176.8-94.9000112.3K91 K92 L93 Q98 L99K91-H95 WeakPolarHBondContact O-CB 3.31Å; K91-H95 PolarHBondContact O-N 2.68Å; K92-H95 PolarHBondContact O-N 3.4Å; L93-H95 VanDerWaalsContact C-N 3.31Å; L93-H95 PolarHBondContact O-N 2.89Å; H95-Q98 PolarHBondContact O-N 2.95Å; H95-L99 VanDerWaalsContact CE1-CD1 3.47Å; H95-L99 WeakPolarHBondContact CE1-CD1 3.33Å; H95-L99 WeakPolarHBondContact O-CG 3.32Å; H95-L99 PolarHBondContact O-N 3.32Å
96H87.2Confident84.7Confident101 Ų101102.9 Ų102.947%0.46850%0.503SS..Hα-helixtrans-67.8-38.3178-83.5-100.5000112.7K92 L93 L94 Q98 L99 L100K92-H96 PolarHBondContact O-CD2 3.06Å; K92-H96 VanDerWaalsContact O-CD2 3.23Å; K92-H96 PolarHBondContact O-N 3.45Å; K92-H96 VanDerWaalsContact O-N 3.13Å; L93-H96 PolarHBondContact O-N 3.37Å; L93-H96 VanDerWaalsContact O-N 3.16Å; L94-H96 PolarHBondContact O-N 3.33Å; H96-Q98 VanDerWaalsContact C-N 3.29Å; H96-Q98 PolarHBondContact O-N 3.16Å; H96-L99 PolarHBondContact O-N 3.23Å; H96-L100 WeakPolarHBondContact O-CG 3.47Å; H96-L100 PolarHBondContact O-N 3.13Å
97I86.8Confident83.6Confident73 Ų73103.8 Ų103.837%0.37451%0.505SS..Hα-helixtrans-59.4-43.7174.1-70.3165.6000110.2L93 L94 L99 L100 Q101L93-I97 WeakPolarHBondContact O-CG1 3.31Å; L93-I97 PolarHBondContact O-N 3.37Å; L94-I97 PolarHBondContact O-N 3.13Å; I97-L99 PolarHBondContact O-N 3.22Å; I97-L100 WeakPolarHBondContact O-CB 3.41Å; I97-L100 PolarHBondContact O-N 3.5Å; I97-Q101 HydrophobicContact CG2-CG 4.41Å; I97-Q101 VanDerWaalsContact O-CG 3.31Å; I97-Q101 WeakPolarHBondContact O-CG 3.29Å; I97-Q101 PolarHBondContact O-N 3.43Å
98Q83.9Confident82.6Confident133 Ų133104.6 Ų104.662%0.62152%0.518SS*.Hα-helixtrans-66.8-38.3179.6-166.7153.5-5.300112.5L94 H95 H96 Q101 Q102L94-Q98 WeakPolarHBondContact O-CB 3.32Å; L94-Q98 PolarHBondContact O-N 2.88Å; H95-Q98 PolarHBondContact O-N 2.95Å; H96-Q98 VanDerWaalsContact C-N 3.29Å; H96-Q98 PolarHBondContact O-N 3.16Å; Q98-Q101 PolarHBondContact O-N 2.97Å; Q98-Q102 WeakPolarHBondContact O-CB 3.44Å; Q98-Q102 PolarHBondContact O-N 2.88Å
99L90.3Very high81Confident83 Ų83107.3 Ų107.344%0.43553%0.53SS..Hα-helixtrans-62.4-42.3171.4-70.7178000112.1H95 H96 I97 Q102 H103H95-L99 VanDerWaalsContact CE1-CD1 3.47Å; H95-L99 WeakPolarHBondContact CE1-CD1 3.33Å; H95-L99 WeakPolarHBondContact O-CG 3.32Å; H95-L99 PolarHBondContact O-N 3.32Å; H96-L99 PolarHBondContact O-N 3.23Å; I97-L99 PolarHBondContact O-N 3.22Å; L99-Q102 PolarHBondContact O-N 3.22Å; L99-H103 WeakPolarHBondContact O-CB 3.5Å; L99-H103 PolarHBondContact O-N 2.96Å
100L87.2Confident79.5Confident110 Ų110108 Ų10858%0.57654%0.541SS*.Hα-helixtrans-64-43.7176.9-72.8169.1000111.5H96 I97 Q102 H103 L104H96-L100 WeakPolarHBondContact O-CG 3.47Å; H96-L100 PolarHBondContact O-N 3.13Å; I97-L100 WeakPolarHBondContact O-CB 3.41Å; I97-L100 PolarHBondContact O-N 3.5Å; L100-Q102 VanDerWaalsContact C-N 3.33Å; L100-Q102 PolarHBondContact O-N 2.93Å; L100-H103 PolarHBondContact O-N 3.36Å; L100-L104 WeakPolarHBondContact O-CB 3.5Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 2.89Å
101Q85.1Confident77.7Confident112 Ų112115.1 Ų115.152%0.52358%0.575SS.*Hα-helixtrans-61.3-40.8175.3-72.3171.7-15.700112.1I97 Q98 R105I97-Q101 HydrophobicContact CG2-CG 4.41Å; I97-Q101 VanDerWaalsContact O-CG 3.31Å; I97-Q101 WeakPolarHBondContact O-CG 3.29Å; I97-Q101 PolarHBondContact O-N 3.43Å; Q98-Q101 PolarHBondContact O-N 2.97Å; Q101-R105 WeakPolarHBondContact O-CB 3.38Å; Q101-R105 WeakPolarHBondContact O-CG 3.42Å; Q101-R105 PolarHBondContact O-N 3.35Å
102Q88.8Confident75.8Confident111 Ų111118.1 Ų118.152%0.51961%0.606SS.*Hα-helixtrans-66.2-37.7175.8-174.5-179.1-8.700112Q98 L99 L100 Q106Q98-Q102 WeakPolarHBondContact O-CB 3.44Å; Q98-Q102 PolarHBondContact O-N 2.88Å; L99-Q102 PolarHBondContact O-N 3.22Å; L100-Q102 VanDerWaalsContact C-N 3.33Å; L100-Q102 PolarHBondContact O-N 2.93Å; Q102-Q106 WeakPolarHBondContact O-CG 3.47Å; Q102-Q106 PolarHBondContact O-N 3.45Å; Q102-Q106 PolarHBondContact O-NE2 3.34Å
103H84.1Confident75.2Confident102 Ų102117.2 Ų117.247%0.47261%0.607SS.*Hα-helixtrans-67-48.1176.2-168.278.9000111.4L99 L100 R105 Q106 Q107L99-H103 WeakPolarHBondContact O-CB 3.5Å; L99-H103 PolarHBondContact O-N 2.96Å; L100-H103 PolarHBondContact O-N 3.36Å; H103-R105 VanDerWaalsContact C-N 3.3Å; H103-R105 PolarHBondContact O-N 3.2Å; H103-Q106 PolarHBondContact O-N 3.05Å; H103-Q107 PolarHBondContact CD2-OE1 2.97Å; H103-Q107 PolarHBondContact NE2-OE1 3.03Å; H103-Q107 PolarHBondContact O-N 3.26Å
104L80.4Confident74.6Confident112 Ų112119.4 Ų119.459%0.58662%0.618SS**Hα-helixtrans-61.6-36.9177.4-70.1169.9000112.2L100 Q106 Q107 G108L100-L104 WeakPolarHBondContact O-CB 3.5Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 2.89Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.23Å; L104-Q107 PolarHBondContact O-N 3.23Å; L104-G108 PolarHBondContact O-N 3.06Å
105R82.6Confident74.1Confident220 Ų220123.6 Ų123.683%0.8364%0.639SS**Hα-helixtrans-63.2-33.3172.6-89.3-176.6156.9160.2-3.6113.6Q101 H103Q101-R105 WeakPolarHBondContact O-CB 3.38Å; Q101-R105 WeakPolarHBondContact O-CG 3.42Å; Q101-R105 PolarHBondContact O-N 3.35Å; H103-R105 VanDerWaalsContact C-N 3.3Å; H103-R105 PolarHBondContact O-N 3.2Å
106Q75.1Confident73.3Confident131 Ų131124.5 Ų124.561%0.61265%0.647SS**Hα-helixtrans-78.6-28.9175.7-71.6176.794.400112.1Q102 H103 L104Q102-Q106 WeakPolarHBondContact O-CG 3.47Å; Q102-Q106 PolarHBondContact O-N 3.45Å; Q102-Q106 PolarHBondContact O-NE2 3.34Å; H103-Q106 PolarHBondContact O-N 3.05Å; L104-Q106 VanDerWaalsContact C-N 3.3Å; L104-Q106 PolarHBondContact O-N 3.23Å
107Q63.2Low72.4Confident119 Ų119125.9 Ų125.956%0.55666%0.658SS**Hα-helixtrans-78-24.6176.7-70.6-165.4-73.100114H103 L104 S109H103-Q107 PolarHBondContact CD2-OE1 2.97Å; H103-Q107 PolarHBondContact NE2-OE1 3.03Å; H103-Q107 PolarHBondContact O-N 3.26Å; L104-Q107 PolarHBondContact O-N 3.23Å; Q107-S109 PolarHBondContact O-N 3.43Å
108G57.1Low71.4Confident71 Ų71129.5 Ų129.573%0.73268%0.677SS**THydrogen-bonded Turntrans-72.49.9178.800000116.3L104L104-G108 PolarHBondContact O-N 3.06Å
109S51.5Low70.5Confident103 Ų103129.2 Ų129.272%0.7268%0.681SS**THydrogen-bonded Turntrans-108.69.6-178.7-158.30000114.1Q107Q107-S109 PolarHBondContact O-N 3.43Å
110V53.4Low69Low124 Ų124132.8 Ų132.875%0.75270%0.7SS**  trans-136.282.6175.6-171.90000109.3
111E46.3Very low67.5Low191 Ų191134.7 Ų134.789%0.89371%0.711SS**  trans-155.1113.3144.2-67.4-155.1107.300109.7
112V42.5Very low65.9Low220 Ų220136.7 Ų136.7100%1.33373%0.728SS**  trans47.50161.8-165.30000120.6

Retrieved 112 of 112 residues in 728.6 ms (Link to these results)