A0A087YMG4_POEFO Loading...

Retinal degeneration 3, GUCY2D regulator

AlphaFold DB , UniProt , Accession A0A087YMG4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 214 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
1M41.4Very low54.7Low247 Ų247155.5 Ų155.5100%1.21776%0.758SS**  0107.50-76.2169.8170.600107.1
2A48.7Very low54.6Low78 Ų78155.6 Ų155.665%0.64576%0.756SS**  trans-78.7132.8-170.500000110.5W4A2-W4 PolarHBondContact O-N 3.05Å; A2-W4 VanDerWaalsContact O-N 3.16Å
3S57.4Low54.7Low108 Ų108162.2 Ų162.276%0.75577%0.768SS**  trans-70.9100.9177.3-175.10000109.9
4W63.1Low54.9Low218 Ų218156.4 Ų156.483%0.82675%0.754SS**  trans-98.76.9179.9-74.833.4000112.6A2A2-W4 PolarHBondContact O-N 3.05Å; A2-W4 VanDerWaalsContact O-N 3.16Å
5F56.4Low55.7Low163 Ų163153.4 Ų153.472%0.71575%0.751SS**  trans-134.471179.8-76-90.6000109.8W7F5-W7 VanDerWaalsContact C-N 3.27Å; F5-W7 AromaticContact CD1-CD1 3.44Å; F5-W7 VanDerWaalsContact CD1-CD1 3.44Å; F5-W7 AromaticContact CD1-NE1 3.48Å; F5-W7 AromaticContact CE1-NE1 3.91Å; F5-W7 PolarHBondContact O-N 2.69Å
6N57.7Low56.8Low101 Ų101159.6 Ų159.654%0.5476%0.764SS.*  trans-87.276159.5-170.15.6000108.9N8 E9N6-N8 VanDerWaalsContact C-N 3.31Å; N6-N8 PolarHBondContact OD1-N 2.67Å; N6-E9 PolarHBondContact ND2-OE2 2.74Å
7W60.9Low58.4Low212 Ų212159.1 Ų159.180%0.80375%0.753SS**  trans-92.69.9171.4-79.576.5000112.3F5F5-W7 VanDerWaalsContact C-N 3.27Å; F5-W7 AromaticContact CD1-CD1 3.44Å; F5-W7 VanDerWaalsContact CD1-CD1 3.44Å; F5-W7 AromaticContact CD1-NE1 3.48Å; F5-W7 AromaticContact CE1-NE1 3.91Å; F5-W7 PolarHBondContact O-N 2.69Å
8N51.2Low60.2Low146 Ų146155 Ų15578%0.78174%0.736SS**  trans-119.436180-67.9-62.3000111.5N6 P10N6-N8 VanDerWaalsContact C-N 3.31Å; N6-N8 PolarHBondContact OD1-N 2.67Å; N8-P10 VanDerWaalsContact O-CD 3.3Å; N8-P10 WeakPolarHBondContact O-CD 3.38Å
9E57.9Low61.8Low108 Ų108150.8 Ų150.851%0.50572%0.723SS.*  trans-75.6113160.7-150.579.5-148.500106N6 Y11N6-E9 PolarHBondContact ND2-OE2 2.74Å; E9-Y11 PolarHBondContact O-N 2.74Å
10P53.7Low63.3Low102 Ų102144.6 Ų144.666%0.66270%0.698SS**  trans-56.5117.4171.823.7-30.3000105.5N8 Q12N8-P10 VanDerWaalsContact O-CD 3.3Å; N8-P10 WeakPolarHBondContact O-CD 3.38Å; P10-Q12 VanDerWaalsContact C-N 3.3Å; P10-Q12 PolarHBondContact O-N 3.46Å
11Y53.4Low64.8Low228 Ų228142 Ų14289%0.89469%0.688SS**  trans-3498.9178.6-67.9-90.3000108.3E9 R13E9-Y11 PolarHBondContact O-N 2.74Å; Y11-R13 PolarHBondContact O-N 3.46Å
12Q52.8Low67.3Low156 Ų156133.3 Ų133.373%0.72965%0.648SS**  trans-57.3104.8175.8-75.5-93-16.700102P10 S14P10-Q12 VanDerWaalsContact C-N 3.3Å; P10-Q12 PolarHBondContact O-N 3.46Å; Q12-S14 VanDerWaalsContact C-N 3.34Å; Q12-S14 PolarHBondContact O-N 3.16Å
13R56Low69.6Low242 Ų242130 Ų13091%0.91362%0.62SS**  trans-46.9110.7175.5-119.9-175.8-176.3122-1103.1Y11 P15Y11-R13 PolarHBondContact O-N 3.46Å; R13-P15 VanDerWaalsContact O-N 3.12Å
14S58.5Low71.5Confident81 Ų81125.5 Ų125.557%0.56659%0.589SS**  trans-47.2131-176.661.90000106.1Q12 R16Q12-S14 VanDerWaalsContact C-N 3.34Å; Q12-S14 PolarHBondContact O-N 3.16Å; S14-R16 PolarHBondContact O-N 2.94Å
15P66.9Low73.1Confident111 Ų111119.1 Ų119.172%0.72157%0.571SS**  trans-45.1127.3179.915.8-28.6000107.2R13 R17R13-P15 VanDerWaalsContact O-N 3.12Å; P15-R17 VanDerWaalsContact C-N 3.29Å; P15-R17 WeakPolarHBondContact O-CG 3.3Å; P15-R17 PolarHBondContact O-N 3.45Å
16R73.3Confident75.1Confident253 Ų253113.7 Ų113.796%0.95555%0.551SS**  trans-5595.1-168.8-163.9-180-171.2-118.73.9107.4S14S14-R16 PolarHBondContact O-N 2.94Å
17R83.1Confident77Confident151 Ų151108.9 Ų108.957%0.5753%0.525SS*.  trans-66.4142.3-173.5-68.6-168.5180-171.31.3108.2P15 V22 D25P15-R17 VanDerWaalsContact C-N 3.29Å; P15-R17 WeakPolarHBondContact O-CG 3.3Å; P15-R17 PolarHBondContact O-N 3.45Å; R17-V22 HydrophobicContact CB-CG2 3.8Å; R17-D25 IonicContact NH1-OD2 3.05Å; R17-D25 PolarHBondContact NH1-OD2 3.46Å
18D90.6Very high78.8Confident85 Ų8599.8 Ų99.846%0.45549%0.492SS..  trans-61.5133.9174.7-173.170.2000108.6A20 D21 V22D18-A20 PolarHBondContact O-N 2.87Å; D18-A20 WeakPolarHBondContact OD2-CB 3.33Å; D18-A20 PolarHBondContact OD2-N 2.83Å; D18-D21 HydrophobicContact CB-CB 4.39Å; D18-D21 WeakPolarHBondContact O-CB 3.46Å; D18-D21 PolarHBondContact O-N 2.96Å; D18-V22 PolarHBondContact O-N 2.66Å; D18-V22 VanDerWaalsContact O-N 3.13Å
19P92.1Very high81Confident75 Ų7598.4 Ų98.449%0.48748%0.484SS..Hα-helixtrans-58-28.1-179.922.9-35.7000113V22 V23 P88P19-V22 PolarHBondContact O-N 3.5Å; P19-V23 VanDerWaalsContact O-CG2 3.27Å; P19-V23 WeakPolarHBondContact O-CG2 3.42Å; P19-V23 PolarHBondContact O-N 3.18Å; P19-V23 VanDerWaalsContact O-N 3.11Å; P19-P88 HydrophobicContact CB-CG 3.86Å
20A91.9Very high82.9Confident26 Ų2695.1 Ų95.122%0.21547%0.468CS..Hα-helixtrans-69.7-38.3175.100000111.7D18 V22 V23 S24D18-A20 PolarHBondContact O-N 2.87Å; D18-A20 WeakPolarHBondContact OD2-CB 3.33Å; D18-A20 PolarHBondContact OD2-N 2.83Å; A20-V22 VanDerWaalsContact C-N 3.32Å; A20-V22 PolarHBondContact O-N 3.04Å; A20-V23 PolarHBondContact O-N 3.01Å; A20-S24 PolarHBondContact O-N 3.49Å
21D93.4Very high85Confident91 Ų9190.5 Ų90.549%0.48744%0.438SS..Hα-helixtrans-62-41.8174.4-64.4-22000111D18 V23 S24 D25D18-D21 HydrophobicContact CB-CB 4.39Å; D18-D21 WeakPolarHBondContact O-CB 3.46Å; D18-D21 PolarHBondContact O-N 2.96Å; D21-V23 VanDerWaalsContact C-N 3.33Å; D21-V23 PolarHBondContact O-N 3.02Å; D21-S24 PolarHBondContact O-N 3.05Å; D21-D25 WeakPolarHBondContact O-CB 3.42Å; D21-D25 PolarHBondContact O-N 3.28Å
22V94.9Very high87Confident65 Ų6581.4 Ų81.439%0.39441%0.408SS..Hα-helixtrans-63.2-40.3177.1178.30000111.3R17 D18 P19 A20 T26R17-V22 HydrophobicContact CB-CG2 3.8Å; D18-V22 PolarHBondContact O-N 2.66Å; D18-V22 VanDerWaalsContact O-N 3.13Å; P19-V22 PolarHBondContact O-N 3.5Å; A20-V22 VanDerWaalsContact C-N 3.32Å; A20-V22 PolarHBondContact O-N 3.04Å; V22-T26 VanDerWaalsContact O-CB 3.3Å; V22-T26 WeakPolarHBondContact O-CB 3.12Å; V22-T26 PolarHBondContact O-N 3.1Å; V22-T26 PolarHBondContact O-OG1 3.18Å
23V97.1Very high89Confident7 Ų780.3 Ų80.34%0.04240%0.397CS..Hα-helixtrans-63.7-46.8175.2172.10000110.2P19 A20 D21 T26 L27 V86 P88 C91P19-V23 VanDerWaalsContact O-CG2 3.27Å; P19-V23 WeakPolarHBondContact O-CG2 3.42Å; P19-V23 PolarHBondContact O-N 3.18Å; P19-V23 VanDerWaalsContact O-N 3.11Å; A20-V23 PolarHBondContact O-N 3.01Å; D21-V23 VanDerWaalsContact C-N 3.33Å; D21-V23 PolarHBondContact O-N 3.02Å; V23-T26 PolarHBondContact O-N 2.78Å; V23-L27 HydrophobicContact CG1-CD1 3.65Å; V23-L27 HydrophobicContact CG1-CG 4.16Å; V23-L27 WeakPolarHBondContact O-CB 3.41Å; V23-L27 VanDerWaalsContact O-CG 3.27Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 3.31Å; V23-V86 HydrophobicContact CG1-CB 3.98Å; V23-V86 HydrophobicContact CG1-CG1 4.13Å; V23-P88 HydrophobicContact CG2-CB 4.02Å; V23-P88 HydrophobicContact CG2-CG 4.13Å; V23-C91 HydrophobicContact CG1-CB 4.14Å; V23-C91 HydrophobicContact CG2-CB 4.21Å
24S97.1Very high90.9Very high15 Ų1569.5 Ų69.511%0.10536%0.357CS..Hα-helixtrans-59.2-50.7177.8-166.70000112.2A20 D21 T26 L27 M28A20-S24 PolarHBondContact O-N 3.49Å; D21-S24 PolarHBondContact O-N 3.05Å; S24-T26 VanDerWaalsContact C-N 3.29Å; S24-T26 PolarHBondContact O-N 3.13Å; S24-L27 PolarHBondContact O-N 2.78Å; S24-M28 VanDerWaalsContact O-CB 3.31Å; S24-M28 WeakPolarHBondContact O-CB 3.38Å; S24-M28 VanDerWaalsContact O-CG 3.22Å; S24-M28 WeakPolarHBondContact O-CG 3.42Å; S24-M28 PolarHBondContact O-N 2.94Å
25D96.6Very high92.7Very high83 Ų8366.4 Ų66.444%0.44433%0.334SS..Hα-helixtrans-55.3-45.1176.1-78.7-12.6000111.4R17 D21 L29R17-D25 IonicContact NH1-OD2 3.05Å; R17-D25 PolarHBondContact NH1-OD2 3.46Å; D21-D25 WeakPolarHBondContact O-CB 3.42Å; D21-D25 PolarHBondContact O-N 3.28Å; D25-L29 VanDerWaalsContact O-CB 3.26Å; D25-L29 WeakPolarHBondContact O-CB 3.49Å; D25-L29 PolarHBondContact O-N 3.32Å
26T97.8Very high94Very high49 Ų4967.1 Ų67.130%0.30133%0.326SS..Hα-helixtrans-67.2-47-177.7-57.10000111.4V22 V23 S24 L29 E30 I95V22-T26 VanDerWaalsContact O-CB 3.3Å; V22-T26 WeakPolarHBondContact O-CB 3.12Å; V22-T26 PolarHBondContact O-N 3.1Å; V22-T26 PolarHBondContact O-OG1 3.18Å; V23-T26 PolarHBondContact O-N 2.78Å; S24-T26 VanDerWaalsContact C-N 3.29Å; S24-T26 PolarHBondContact O-N 3.13Å; T26-L29 WeakPolarHBondContact O-CB 3.27Å; T26-L29 PolarHBondContact O-N 3.25Å; T26-E30 WeakPolarHBondContact O-CG 3.43Å; T26-E30 PolarHBondContact O-N 3.5Å; T26-I95 HydrophobicContact CG2-CD1 4.13Å
27L98.3Very high94.9Very high1 Ų157.5 Ų57.51%0.00529%0.291CS..Hα-helixtrans-67.4-39.5-179.7-68.7179.4000111.6V23 S24 L29 E30 F31 C83 V86 V94 I95 F116 L120V23-L27 HydrophobicContact CG1-CD1 3.65Å; V23-L27 HydrophobicContact CG1-CG 4.16Å; V23-L27 WeakPolarHBondContact O-CB 3.41Å; V23-L27 VanDerWaalsContact O-CG 3.27Å; V23-L27 WeakPolarHBondContact O-CG 3.46Å; V23-L27 PolarHBondContact O-N 3.31Å; S24-L27 PolarHBondContact O-N 2.78Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L27-E30 PolarHBondContact O-N 2.94Å; L27-F31 WeakPolarHBondContact O-CB 3.45Å; L27-F31 PolarHBondContact O-N 3.3Å; L27-C83 HydrophobicContact CB-CB 4.34Å; L27-C83 HydrophobicContact CD1-CB 4.06Å; L27-V86 HydrophobicContact CD1-CB 4.24Å; L27-V86 HydrophobicContact CD1-CG1 4.36Å; L27-V86 HydrophobicContact CD1-CG2 4.12Å; L27-V94 HydrophobicContact CD1-CG1 4.34Å; L27-V94 HydrophobicContact CD2-CB 3.92Å; L27-V94 HydrophobicContact CD2-CG1 3.71Å; L27-I95 HydrophobicContact CD2-CD1 4.39Å; L27-I95 HydrophobicContact CD2-CG1 3.77Å; L27-F116 HydrophobicContact CB-CZ 4.04Å; L27-L120 HydrophobicContact CD1-CD2 4.14Å
28M97.8Very high95.5Very high20 Ų2050.6 Ų50.610%0.09927%0.267CS..Hα-helixtrans-67.7-32.9174.7-68.6-55.9-64.100112.4S24 F31 S32 R76 L79 E80 F116S24-M28 VanDerWaalsContact O-CB 3.31Å; S24-M28 WeakPolarHBondContact O-CB 3.38Å; S24-M28 VanDerWaalsContact O-CG 3.22Å; S24-M28 WeakPolarHBondContact O-CG 3.42Å; S24-M28 PolarHBondContact O-N 2.94Å; M28-F31 HydrophobicContact CE-CD1 4.28Å; M28-S32 WeakPolarHBondContact O-CB 3.45Å; M28-S32 PolarHBondContact O-N 3.24Å; M28-R76 HydrophobicContact CE-CG 4Å; M28-L79 HydrophobicContact CE-CB 4.31Å; M28-L79 HydrophobicContact SD-CB 3.92Å; M28-E80 HydrophobicContact CE-CG 4.05Å; M28-E80 HydrophobicContact CG-CG 3.85Å; M28-E80 HydrophobicContact SD-CG 3.98Å; M28-F116 HydrophobicContact SD-CE1 4.14Å
29L97.4Very high95.6Very high118 Ų11846.7 Ų46.762%0.61825%0.246SC*.Hα-helixtrans-64.8-48.6172.6-177.867.2000111D25 T26 L27 F31 S32 W33D25-L29 VanDerWaalsContact O-CB 3.26Å; D25-L29 WeakPolarHBondContact O-CB 3.49Å; D25-L29 PolarHBondContact O-N 3.32Å; T26-L29 WeakPolarHBondContact O-CB 3.27Å; T26-L29 PolarHBondContact O-N 3.25Å; L27-L29 VanDerWaalsContact C-N 3.33Å; L29-F31 VanDerWaalsContact C-N 3.35Å; L29-F31 PolarHBondContact O-N 3.08Å; L29-S32 PolarHBondContact O-N 3.16Å; L29-S32 PolarHBondContact O-OG 3.34Å; L29-W33 PolarHBondContact O-N 3.45Å
30E98.1Very high95.6Very high38 Ų3847.2 Ų47.218%0.17824%0.238CC..Hα-helixtrans-60.5-43.3176.2-74.5-72.3163.300111.7T26 L27 S32 W33 Q34 I95 R99T26-E30 WeakPolarHBondContact O-CG 3.43Å; T26-E30 PolarHBondContact O-N 3.5Å; L27-E30 PolarHBondContact O-N 2.94Å; E30-S32 PolarHBondContact O-N 3.43Å; E30-W33 WeakPolarHBondContact O-CB 3.45Å; E30-W33 PolarHBondContact O-N 2.96Å; E30-Q34 WeakPolarHBondContact O-CG 3.39Å; E30-Q34 PolarHBondContact O-N 3.42Å; E30-I95 HydrophobicContact CG-CD1 4.05Å; E30-I95 HydrophobicContact CG-CG1 4.06Å; E30-I95 HydrophobicContact CG-CG2 4.29Å; E30-R99 IonicContact OE1-NH2 3.94Å; E30-R99 PolarHBondContact OE1-NH2 2.71Å; E30-R99 IonicContact OE2-CZ 3.74Å; E30-R99 IonicContact OE2-NE 3.7Å; E30-R99 PolarHBondContact OE2-NE 3.26Å; E30-R99 IonicContact OE2-NH2 3.29Å; E30-R99 PolarHBondContact OE2-NH2 3Å
31F97.3Very high95.6Very high5 Ų548.6 Ų48.62%0.02224%0.242CC..Hα-helixtrans-55.2-49.9171.7168.7-101.1000111.9L27 M28 L29 W33 Q34 L35 I71 L79 F98 V112 F116L27-F31 WeakPolarHBondContact O-CB 3.45Å; L27-F31 PolarHBondContact O-N 3.3Å; M28-F31 HydrophobicContact CE-CD1 4.28Å; L29-F31 VanDerWaalsContact C-N 3.35Å; L29-F31 PolarHBondContact O-N 3.08Å; F31-W33 PolarHBondContact O-N 3.23Å; F31-Q34 PolarHBondContact O-N 3.21Å; F31-L35 HydrophobicContact CE1-CD2 4.26Å; F31-L35 HydrophobicContact CZ-CD2 4.14Å; F31-L35 WeakPolarHBondContact O-CB 3.24Å; F31-L35 PolarHBondContact O-N 3.24Å; F31-I71 HydrophobicContact CE1-CD1 3.73Å; F31-I71 HydrophobicContact CE1-CG1 4.36Å; F31-I71 HydrophobicContact CE1-CG2 3.99Å; F31-I71 HydrophobicContact CZ-CD1 4.32Å; F31-I71 HydrophobicContact CZ-CG2 3.65Å; F31-L79 HydrophobicContact CE1-CD1 4.47Å; F31-L79 HydrophobicContact CE2-CD1 4.5Å; F31-L79 HydrophobicContact CZ-CD1 4.36Å; F31-F98 HydrophobicContact CD2-CZ 4.32Å; F31-V112 HydrophobicContact CD2-CG1 4.25Å; F31-V112 HydrophobicContact CE2-CG1 3.91Å; F31-F116 HydrophobicContact CB-CD1 3.96Å; F31-F116 HydrophobicContact CB-CD2 4.4Å; F31-F116 HydrophobicContact CB-CE1 3.83Å; F31-F116 HydrophobicContact CB-CE2 4.28Å; F31-F116 HydrophobicContact CB-CG 4.25Å; F31-F116 HydrophobicContact CB-CZ 3.99Å; F31-F116 HydrophobicContact CD2-CB 3.78Å; F31-F116 AromaticContact CD2-CD1 3.61Å; F31-F116 HydrophobicContact CD2-CD1 3.61Å; F31-F116 HydrophobicContact CD2-CE1 4.31Å; F31-F116 AromaticContact CD2-CG 3.72Å; F31-F116 HydrophobicContact CD2-CG 3.72Å; F31-F116 HydrophobicContact CE2-CB 4.27Å; F31-F116 HydrophobicContact CE2-CD1 4.42Å; F31-F116 AromaticContact CG-CD1 3.88Å; F31-F116 HydrophobicContact CG-CD1 3.88Å; F31-F116 HydrophobicContact CG-CE1 4.13Å; F31-F116 HydrophobicContact CG-CG 4.29Å
32S95.6Very high95.6Very high37 Ų3745.9 Ų45.926%0.25923%0.226SC..Hα-helixtrans-63.2-32.118080.10000112.8M28 L29 E30 K36M28-S32 WeakPolarHBondContact O-CB 3.45Å; M28-S32 PolarHBondContact O-N 3.24Å; L29-S32 PolarHBondContact O-N 3.16Å; L29-S32 PolarHBondContact O-OG 3.34Å; E30-S32 PolarHBondContact O-N 3.43Å; S32-K36 VanDerWaalsContact O-CG 3.28Å; S32-K36 WeakPolarHBondContact O-CG 3.3Å; S32-K36 PolarHBondContact O-N 3.43Å
33W95.3Very high95.3Very high134 Ų13445.5 Ų45.551%0.50822%0.218SC..Hα-helixtrans-68.6-49.3175.8-17690000110.6L29 E30 F31 L35 K36 E37L29-W33 PolarHBondContact O-N 3.45Å; E30-W33 WeakPolarHBondContact O-CB 3.45Å; E30-W33 PolarHBondContact O-N 2.96Å; F31-W33 PolarHBondContact O-N 3.23Å; W33-L35 VanDerWaalsContact C-N 3.31Å; W33-L35 PolarHBondContact O-N 3.1Å; W33-K36 PolarHBondContact O-N 3.39Å; W33-E37 HydrophobicContact CE3-CB 4.43Å; W33-E37 HydrophobicContact CH2-CB 4.36Å; W33-E37 HydrophobicContact CH2-CG 3.99Å; W33-E37 HydrophobicContact CZ2-CG 4.44Å; W33-E37 HydrophobicContact CZ3-CB 4.23Å; W33-E37 HydrophobicContact CZ3-CG 4.22Å; W33-E37 WeakPolarHBondContact O-CB 3.12Å; W33-E37 PolarHBondContact O-N 3.19Å
34Q96.6Very high95Very high14 Ų1449.1 Ų49.17%0.06523%0.234CC..Hα-helixtrans-61.9-38.7178.3-69.6-66.9-7.800112.4E30 F31 E37 A38 F98 M102 V112E30-Q34 WeakPolarHBondContact O-CG 3.39Å; E30-Q34 PolarHBondContact O-N 3.42Å; F31-Q34 PolarHBondContact O-N 3.21Å; Q34-E37 PolarHBondContact O-N 3.45Å; Q34-A38 WeakPolarHBondContact O-CB 3.4Å; Q34-A38 PolarHBondContact O-N 3.43Å; Q34-F98 HydrophobicContact CB-CE1 3.66Å; Q34-F98 HydrophobicContact CB-CZ 3.78Å; Q34-F98 HydrophobicContact CG-CD1 3.96Å; Q34-F98 HydrophobicContact CG-CE1 3.34Å; Q34-F98 HydrophobicContact CG-CZ 3.89Å; Q34-M102 HydrophobicContact CB-CE 4.18Å; Q34-M102 HydrophobicContact CB-CG 4.38Å; Q34-M102 HydrophobicContact CB-SD 4.44Å; Q34-M102 HydrophobicContact CG-CG 4.14Å; Q34-V112 HydrophobicContact CB-CG1 4.2Å
35L95.3Very high94.8Very high16 Ų1652.8 Ų52.88%0.08425%0.246CC..Hα-helixtrans-62.6-45.2176.3-177.863000111.8F31 W33 E37 E39 F69 I71 P109 V112F31-L35 HydrophobicContact CE1-CD2 4.26Å; F31-L35 HydrophobicContact CZ-CD2 4.14Å; F31-L35 WeakPolarHBondContact O-CB 3.24Å; F31-L35 PolarHBondContact O-N 3.24Å; W33-L35 VanDerWaalsContact C-N 3.31Å; W33-L35 PolarHBondContact O-N 3.1Å; L35-E37 VanDerWaalsContact C-N 3.3Å; L35-E37 PolarHBondContact O-N 3.14Å; L35-E39 WeakPolarHBondContact O-CB 3.42Å; L35-E39 PolarHBondContact O-N 3.42Å; L35-F69 HydrophobicContact CD1-CB 4.49Å; L35-I71 HydrophobicContact CD2-CG2 4.44Å; L35-P109 HydrophobicContact CD1-CB 4.15Å; L35-P109 WeakPolarHBondContact CD1-O 3.28Å; L35-V112 HydrophobicContact CB-CG1 4.42Å; L35-V112 HydrophobicContact CD1-CB 4.12Å; L35-V112 HydrophobicContact CD1-CG2 4.28Å
36K93.7Very high94.5Very high127 Ų12753.1 Ų53.155%0.55224%0.244SC*.Hα-helixtrans-65.2-36.8176.4-74.1170.9-176.9172.10112S32 W33 E39 R40S32-K36 VanDerWaalsContact O-CG 3.28Å; S32-K36 WeakPolarHBondContact O-CG 3.3Å; S32-K36 PolarHBondContact O-N 3.43Å; W33-K36 PolarHBondContact O-N 3.39Å; K36-E39 PolarHBondContact O-N 2.83Å; K36-R40 WeakPolarHBondContact O-CB 3.45Å; K36-R40 PolarHBondContact O-N 3.48Å
37E94.1Very high94.1Very high50 Ų5053.9 Ų53.923%0.23425%0.246CC..Hα-helixtrans-70.5-42.8-179.9-170.263.2-176.300111.7W33 Q34 L35 E39 R40 L41W33-E37 HydrophobicContact CE3-CB 4.43Å; W33-E37 HydrophobicContact CH2-CB 4.36Å; W33-E37 HydrophobicContact CH2-CG 3.99Å; W33-E37 HydrophobicContact CZ2-CG 4.44Å; W33-E37 HydrophobicContact CZ3-CB 4.23Å; W33-E37 HydrophobicContact CZ3-CG 4.22Å; W33-E37 WeakPolarHBondContact O-CB 3.12Å; W33-E37 PolarHBondContact O-N 3.19Å; Q34-E37 PolarHBondContact O-N 3.45Å; L35-E37 VanDerWaalsContact C-N 3.3Å; L35-E37 PolarHBondContact O-N 3.14Å; E37-E39 VanDerWaalsContact C-N 3.3Å; E37-E39 PolarHBondContact O-N 3.41Å; E37-R40 VanDerWaalsContact CD-NE 3.33Å; E37-R40 WeakPolarHBondContact O-CB 3.22Å; E37-R40 PolarHBondContact O-N 2.86Å; E37-R40 VanDerWaalsContact O-N 3.15Å; E37-R40 IonicContact OE1-CZ 3.3Å; E37-R40 VanDerWaalsContact OE1-CZ 3.29Å; E37-R40 IonicContact OE1-NE 3.48Å; E37-R40 PolarHBondContact OE1-NE 3.31Å; E37-R40 VanDerWaalsContact OE1-NE 3.15Å; E37-R40 IonicContact OE1-NH2 3.54Å; E37-R40 PolarHBondContact OE1-NH2 3.17Å; E37-R40 IonicContact OE2-CZ 2.76Å; E37-R40 IonicContact OE2-NE 3.31Å; E37-R40 PolarHBondContact OE2-NE 2.89Å; E37-R40 IonicContact OE2-NH2 3.39Å; E37-L41 WeakPolarHBondContact O-CG 3.28Å; E37-L41 PolarHBondContact O-N 2.87Å
38A94.6Very high93.8Very high6 Ų658.8 Ų58.85%0.0527%0.269CS..Hα-helixtrans-58.7-43.2171.300000111.3Q34 R40 L41 Q42 M102 P109 V112Q34-A38 WeakPolarHBondContact O-CB 3.4Å; Q34-A38 PolarHBondContact O-N 3.43Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 2.7Å; A38-L41 PolarHBondContact O-N 2.93Å; A38-Q42 WeakPolarHBondContact O-CB 2.95Å; A38-Q42 PolarHBondContact O-N 3.07Å; A38-M102 HydrophobicContact CB-CE 4.32Å; A38-P109 HydrophobicContact CB-CG 4.25Å; A38-V112 HydrophobicContact CB-CG2 3.81Å
39E93.1Very high93.5Very high3 Ų365.2 Ų65.21%0.01429%0.294CS..Hα-helixtrans-64.5-36.4176.7-159.6-169.2161.200112.1L35 K36 E37 R43 S67 S68 F69 P109L35-E39 WeakPolarHBondContact O-CB 3.42Å; L35-E39 PolarHBondContact O-N 3.42Å; K36-E39 PolarHBondContact O-N 2.83Å; E37-E39 VanDerWaalsContact C-N 3.3Å; E37-E39 PolarHBondContact O-N 3.41Å; E39-R43 VanDerWaalsContact C-NH1 3.34Å; E39-R43 WeakPolarHBondContact O-CG 3.42Å; E39-R43 PolarHBondContact O-N 2.9Å; E39-R43 VanDerWaalsContact O-N 3.16Å; E39-R43 PolarHBondContact O-NH1 3.43Å; E39-R43 IonicContact OE1-CZ 2.74Å; E39-R43 IonicContact OE1-NE 2.94Å; E39-R43 IonicContact OE1-NH2 2.59Å; E39-R43 PolarHBondContact OE1-NH2 2.81Å; E39-R43 IonicContact OE2-NH2 3.87Å; E39-R43 PolarHBondContact OE2-NH2 3.33Å; E39-S67 VanDerWaalsContact OE1-CA 3.31Å; E39-S67 WeakPolarHBondContact OE1-CA 3.37Å; E39-S67 WeakPolarHBondContact OE2-CB 3.48Å; E39-S67 PolarHBondContact OE2-OG 3.27Å; E39-S68 PolarHBondContact OE1-N 3.46Å; E39-S68 PolarHBondContact OE1-OG 3.21Å; E39-F69 HydrophobicContact CG-CD2 3.88Å; E39-P109 HydrophobicContact CB-CG 4.21Å
40R91.7Very high93.2Very high86 Ų8666.2 Ų66.233%0.32529%0.289SS..Hα-helixtrans-62.2-52173.9-170.6-170.967.373.18.2111K36 E37 A38 Q42 R43 E44K36-R40 WeakPolarHBondContact O-CB 3.45Å; K36-R40 PolarHBondContact O-N 3.48Å; E37-R40 VanDerWaalsContact CD-NE 3.33Å; E37-R40 WeakPolarHBondContact O-CB 3.22Å; E37-R40 PolarHBondContact O-N 2.86Å; E37-R40 VanDerWaalsContact O-N 3.15Å; E37-R40 IonicContact OE1-CZ 3.3Å; E37-R40 VanDerWaalsContact OE1-CZ 3.29Å; E37-R40 IonicContact OE1-NE 3.48Å; E37-R40 PolarHBondContact OE1-NE 3.31Å; E37-R40 VanDerWaalsContact OE1-NE 3.15Å; E37-R40 IonicContact OE1-NH2 3.54Å; E37-R40 PolarHBondContact OE1-NH2 3.17Å; E37-R40 IonicContact OE2-CZ 2.76Å; E37-R40 IonicContact OE2-NE 3.31Å; E37-R40 PolarHBondContact OE2-NE 2.89Å; E37-R40 IonicContact OE2-NH2 3.39Å; A38-R40 VanDerWaalsContact C-N 3.31Å; A38-R40 PolarHBondContact O-N 2.7Å; R40-Q42 PolarHBondContact O-N 2.85Å; R40-R43 VanDerWaalsContact CA-NH1 3.33Å; R40-R43 PolarHBondContact O-N 3.45Å; R40-E44 IonicContact CZ-OE1 3.31Å; R40-E44 IonicContact CZ-OE2 3.49Å; R40-E44 IonicContact NH1-OE1 2.9Å; R40-E44 PolarHBondContact NH1-OE1 2.95Å; R40-E44 IonicContact NH1-OE2 2.83Å; R40-E44 PolarHBondContact NH1-OE2 3.31Å; R40-E44 WeakPolarHBondContact O-CG 3.41Å; R40-E44 PolarHBondContact O-N 2.76Å
41L92.6Very high92.9Very high56 Ų5669.7 Ų69.729%0.29330%0.301SS..Hα-helixtrans-61.6-43.9180-71172.5000112E37 A38 R43 E44 R45E37-L41 WeakPolarHBondContact O-CG 3.28Å; E37-L41 PolarHBondContact O-N 2.87Å; A38-L41 PolarHBondContact O-N 2.93Å; L41-R43 VanDerWaalsContact C-N 3.33Å; L41-R43 PolarHBondContact O-N 3.24Å; L41-E44 WeakPolarHBondContact O-CB 3.44Å; L41-E44 PolarHBondContact O-N 3.18Å; L41-E44 VanDerWaalsContact O-N 3.15Å; L41-R45 WeakPolarHBondContact O-CG 3.3Å; L41-R45 PolarHBondContact O-N 3.19Å
42Q92.3Very high92.7Very high34 Ų3476.3 Ų76.316%0.15934%0.336CS..Hα-helixtrans-57.4-46.8176.3-171.9-168.7-15.300111.3A38 R40 E44 R45 E46 E108 P109A38-Q42 WeakPolarHBondContact O-CB 2.95Å; A38-Q42 PolarHBondContact O-N 3.07Å; R40-Q42 PolarHBondContact O-N 2.85Å; Q42-E44 VanDerWaalsContact C-N 3.31Å; Q42-E44 PolarHBondContact O-N 2.87Å; Q42-R45 PolarHBondContact O-N 3.33Å; Q42-E46 PolarHBondContact NE2-OE1 2.88Å; Q42-E46 WeakPolarHBondContact O-CG 3.21Å; Q42-E46 PolarHBondContact O-N 3.31Å; Q42-E108 VanDerWaalsContact CD-OE2 3.23Å; Q42-E108 WeakPolarHBondContact CG-OE2 3.41Å; Q42-E108 PolarHBondContact OE1-OE2 3.26Å; Q42-P109 HydrophobicContact CB-CG 4.45Å
43R89.4Confident92.5Very high57 Ų5782.3 Ų82.322%0.21536%0.357CS..Hα-helixtrans-64.3-35.7177.9-76.5-169.2-124.286.8-13.3112.8E39 R40 L41 E46 N47E39-R43 VanDerWaalsContact C-NH1 3.34Å; E39-R43 WeakPolarHBondContact O-CG 3.42Å; E39-R43 PolarHBondContact O-N 2.9Å; E39-R43 VanDerWaalsContact O-N 3.16Å; E39-R43 PolarHBondContact O-NH1 3.43Å; E39-R43 IonicContact OE1-CZ 2.74Å; E39-R43 IonicContact OE1-NE 2.94Å; E39-R43 IonicContact OE1-NH2 2.59Å; E39-R43 PolarHBondContact OE1-NH2 2.81Å; E39-R43 IonicContact OE2-NH2 3.87Å; E39-R43 PolarHBondContact OE2-NH2 3.33Å; R40-R43 VanDerWaalsContact CA-NH1 3.33Å; R40-R43 PolarHBondContact O-N 3.45Å; L41-R43 VanDerWaalsContact C-N 3.33Å; L41-R43 PolarHBondContact O-N 3.24Å; R43-E46 PolarHBondContact O-N 3.11Å; R43-N47 VanDerWaalsContact O-CB 3.32Å; R43-N47 WeakPolarHBondContact O-CB 3.31Å; R43-N47 PolarHBondContact O-N 3.35Å; R43-N47 PolarHBondContact O-ND2 3.45Å
44E90.8Very high92.3Very high83 Ų8379.9 Ų79.939%0.38836%0.357SS..Hα-helixtrans-63-46.6175.2-75.8174.2-179.900110.9R40 L41 Q42 E46 N47 E48R40-E44 IonicContact CZ-OE1 3.31Å; R40-E44 IonicContact CZ-OE2 3.49Å; R40-E44 IonicContact NH1-OE1 2.9Å; R40-E44 PolarHBondContact NH1-OE1 2.95Å; R40-E44 IonicContact NH1-OE2 2.83Å; R40-E44 PolarHBondContact NH1-OE2 3.31Å; R40-E44 WeakPolarHBondContact O-CG 3.41Å; R40-E44 PolarHBondContact O-N 2.76Å; L41-E44 WeakPolarHBondContact O-CB 3.44Å; L41-E44 PolarHBondContact O-N 3.18Å; L41-E44 VanDerWaalsContact O-N 3.15Å; Q42-E44 VanDerWaalsContact C-N 3.31Å; Q42-E44 PolarHBondContact O-N 2.87Å; E44-E46 VanDerWaalsContact C-N 3.33Å; E44-E46 PolarHBondContact O-N 3.38Å; E44-N47 PolarHBondContact O-N 3.43Å; E44-E48 WeakPolarHBondContact O-CG 3.27Å; E44-E48 PolarHBondContact O-N 3.47Å
45R92.5Very high92.2Very high92 Ų9282.3 Ų82.335%0.34739%0.386SS..Hα-helixtrans-57.3-44.8173.8-65.7-168.7-121.5131.8-5.4111.9L41 Q42 E48 Y49 E106 E108L41-R45 WeakPolarHBondContact O-CG 3.3Å; L41-R45 PolarHBondContact O-N 3.19Å; Q42-R45 PolarHBondContact O-N 3.33Å; R45-E48 PolarHBondContact O-N 3.32Å; R45-Y49 WeakPolarHBondContact O-CB 3.42Å; R45-Y49 PolarHBondContact O-N 2.67Å; R45-E106 IonicContact CZ-OE1 2.7Å; R45-E106 VanDerWaalsContact CZ-OE1 3.23Å; R45-E106 IonicContact NE-OE1 3.02Å; R45-E106 PolarHBondContact NE-OE1 3.38Å; R45-E106 IonicContact NH2-OE1 3.65Å; R45-E106 PolarHBondContact NH2-OE1 2.82Å; R45-E108 IonicContact CZ-OE1 3.15Å; R45-E108 IonicContact NH1-OE1 2.77Å; R45-E108 PolarHBondContact NH1-OE1 3.41Å; R45-E108 IonicContact NH2-OE1 3.23Å
46E90.4Very high92Very high89 Ų8984.9 Ų84.942%0.41640%0.402SS..Hα-helixtrans-65.9-39.2178.1-71.7173.1-171.600113.1Q42 R43 E44 R50Q42-E46 PolarHBondContact NE2-OE1 2.88Å; Q42-E46 WeakPolarHBondContact O-CG 3.21Å; Q42-E46 PolarHBondContact O-N 3.31Å; R43-E46 PolarHBondContact O-N 3.11Å; E44-E46 VanDerWaalsContact C-N 3.33Å; E44-E46 PolarHBondContact O-N 3.38Å; E46-R50 WeakPolarHBondContact O-CB 3.47Å; E46-R50 WeakPolarHBondContact O-CG 3.48Å; E46-R50 PolarHBondContact O-N 3.01Å
47N89.6Confident91.8Very high65 Ų6582.3 Ų82.335%0.34839%0.394SS..Hα-helixtrans-65.4-44.9176.4-73.5-18000111.3R43 E44 R50 R51R43-N47 VanDerWaalsContact O-CB 3.32Å; R43-N47 WeakPolarHBondContact O-CB 3.31Å; R43-N47 PolarHBondContact O-N 3.35Å; R43-N47 PolarHBondContact O-ND2 3.45Å; E44-N47 PolarHBondContact O-N 3.43Å; N47-R50 PolarHBondContact O-N 3.27Å; N47-R50 PolarHBondContact OD1-NH2 3.02Å; N47-R51 WeakPolarHBondContact O-CB 3.42Å; N47-R51 PolarHBondContact O-N 3.27Å
48E91.3Very high91.3Very high104 Ų10486.4 Ų86.449%0.48641%0.409SS..Hα-helixtrans-62.3-45.6176.1-73.1-172.2159.400111.5E44 R45 R50 R51 L52E44-E48 WeakPolarHBondContact O-CG 3.27Å; E44-E48 PolarHBondContact O-N 3.47Å; R45-E48 PolarHBondContact O-N 3.32Å; E48-R50 VanDerWaalsContact C-N 3.32Å; E48-R50 PolarHBondContact O-N 3.07Å; E48-R51 PolarHBondContact O-N 2.97Å; E48-L52 WeakPolarHBondContact O-CG 3.33Å; E48-L52 PolarHBondContact O-N 3.39Å
49Y92.4Very high90.8Very high155 Ų15588.9 Ų88.961%0.60843%0.426SS*.Hα-helixtrans-57.6-44.9175.2178.6-98.5000111.8R45 L52 K53R45-Y49 WeakPolarHBondContact O-CB 3.42Å; R45-Y49 PolarHBondContact O-N 2.67Å; Y49-L52 PolarHBondContact O-N 2.89Å; Y49-K53 HydrophobicContact CE1-CD 4.41Å; Y49-K53 WeakPolarHBondContact O-CB 3.43Å; Y49-K53 PolarHBondContact O-N 3.43Å
50R90.1Very high90.4Very high139 Ų13998.1 Ų98.153%0.52546%0.461SS..Hα-helixtrans-61.2-47.5175.2-77.8-170.9-70.3168.7-7.8111.8E46 N47 E48 L52 K53 T54E46-R50 WeakPolarHBondContact O-CB 3.47Å; E46-R50 WeakPolarHBondContact O-CG 3.48Å; E46-R50 PolarHBondContact O-N 3.01Å; N47-R50 PolarHBondContact O-N 3.27Å; N47-R50 PolarHBondContact OD1-NH2 3.02Å; E48-R50 VanDerWaalsContact C-N 3.32Å; E48-R50 PolarHBondContact O-N 3.07Å; R50-L52 VanDerWaalsContact C-N 3.31Å; R50-L52 PolarHBondContact O-N 3.33Å; R50-K53 PolarHBondContact O-N 3.27Å; R50-T54 PolarHBondContact O-N 3.47Å; R50-T54 PolarHBondContact O-OG1 2.92Å
51R91.5Very high90.1Very high111 Ų11199.1 Ų99.142%0.41947%0.472SS..Hα-helixtrans-58.5-42178.3-175.4179.367.5-164.2-3111.8N47 E48 K53 G55 D57N47-R51 WeakPolarHBondContact O-CB 3.42Å; N47-R51 PolarHBondContact O-N 3.27Å; E48-R51 PolarHBondContact O-N 2.97Å; R51-K53 VanDerWaalsContact C-N 3.32Å; R51-K53 PolarHBondContact O-N 3.13Å; R51-G55 WeakPolarHBondContact O-CA 3.34Å; R51-G55 PolarHBondContact O-N 3.41Å; R51-D57 HydrophobicContact CG-CB 4.26Å
52L93.3Very high89.6Confident145 Ų14599.4 Ų99.476%0.75948%0.482SS*.Hα-helixtrans-63.9-37.5175.7-72.8168.6000111.9E48 Y49 R50E48-L52 WeakPolarHBondContact O-CG 3.33Å; E48-L52 PolarHBondContact O-N 3.39Å; Y49-L52 PolarHBondContact O-N 2.89Å; R50-L52 VanDerWaalsContact C-N 3.31Å; R50-L52 PolarHBondContact O-N 3.33Å
53K92.6Very high89Confident162 Ų162102.7 Ų102.770%0.70451%0.509SS*.Hα-helixtrans-75.6-39.1179.5-173175-179.1176.70113.3Y49 R50 R51Y49-K53 HydrophobicContact CE1-CD 4.41Å; Y49-K53 WeakPolarHBondContact O-CB 3.43Å; Y49-K53 PolarHBondContact O-N 3.43Å; R50-K53 PolarHBondContact O-N 3.27Å; R51-K53 VanDerWaalsContact C-N 3.32Å; R51-K53 PolarHBondContact O-N 3.13Å
54T91.2Very high88.3Confident83 Ų83106.5 Ų106.551%0.50954%0.539SS..Hα-helixtrans-90.3-19.5-17757.30000113.1R50 V56R50-T54 PolarHBondContact O-N 3.47Å; R50-T54 PolarHBondContact O-OG1 2.92Å; T54-V56 PolarHBondContact O-N 2.79Å; T54-V56 PolarHBondContact OG1-O 3.49Å
55G93.5Very high87.3Confident65 Ų65106.3 Ų106.367%0.6755%0.545SS*.SBendtrans71.70.9-175.900000114.5R51R51-G55 WeakPolarHBondContact O-CA 3.34Å; R51-G55 PolarHBondContact O-N 3.41Å
56V91.5Very high86.4Confident70 Ų70112.9 Ų112.942%0.42457%0.57SS.*SBendtrans-138.4140.2-175.4-175.10000109.6T54 Y58T54-V56 PolarHBondContact O-N 2.79Å; T54-V56 PolarHBondContact OG1-O 3.49Å; V56-Y58 HydrophobicContact CB-CD2 4.45Å; V56-Y58 HydrophobicContact CB-CE2 3.78Å; V56-Y58 HydrophobicContact CG1-CD1 4.39Å; V56-Y58 HydrophobicContact CG1-CD2 4.33Å; V56-Y58 HydrophobicContact CG1-CE1 3.85Å; V56-Y58 HydrophobicContact CG1-CE2 3.77Å; V56-Y58 VanDerWaalsContact CG1-CZ 3.5Å
57D88.7Confident85.7Confident73 Ų73112 Ų11239%0.3957%0.573SS.*  trans-95.2109.9178.9-166.4-10.6000111.5R51 S59R51-D57 HydrophobicContact CG-CB 4.26Å; D57-S59 WeakPolarHBondContact OD1-CB 3.41Å; D57-S59 PolarHBondContact OD1-N 3.37Å; D57-S59 PolarHBondContact OD1-OG 3.12Å; D57-S59 PolarHBondContact OD2-OG 2.94Å
58Y83.8Confident84.9Confident136 Ų136113.2 Ų113.253%0.53359%0.587SS.*  trans-106.816.5174.4-59.9-70.4000112.4V56 W60 L61 A62V56-Y58 HydrophobicContact CB-CD2 4.45Å; V56-Y58 HydrophobicContact CB-CE2 3.78Å; V56-Y58 HydrophobicContact CG1-CD1 4.39Å; V56-Y58 HydrophobicContact CG1-CD2 4.33Å; V56-Y58 HydrophobicContact CG1-CE1 3.85Å; V56-Y58 HydrophobicContact CG1-CE2 3.77Å; V56-Y58 VanDerWaalsContact CG1-CZ 3.5Å; Y58-W60 PolarHBondContact O-N 3.36Å; Y58-L61 HydrophobicContact CD1-CD1 3.9Å; Y58-L61 WeakPolarHBondContact O-CB 3.43Å; Y58-L61 PolarHBondContact O-N 3.46Å; Y58-A62 PolarHBondContact O-N 3.34Å
59S83.5Confident84.5Confident59 Ų59111.3 Ų111.341%0.41358%0.577SS.*G310 helixtrans-57.9-32.3-177.755.40000113.2D57 L61 A62D57-S59 WeakPolarHBondContact OD1-CB 3.41Å; D57-S59 PolarHBondContact OD1-N 3.37Å; D57-S59 PolarHBondContact OD1-OG 3.12Å; D57-S59 PolarHBondContact OD2-OG 2.94Å; S59-L61 VanDerWaalsContact C-N 3.26Å; S59-L61 PolarHBondContact O-N 2.9Å; S59-A62 VanDerWaalsContact O-CB 3.3Å; S59-A62 WeakPolarHBondContact O-CB 3.36Å; S59-A62 PolarHBondContact O-N 3.04Å
60W85.1Confident84.1Confident196 Ų196109.2 Ų109.274%0.74259%0.585SS**G310 helixtrans-67.9-21.3175.867.3-88.5000114.2Y58Y58-W60 PolarHBondContact O-N 3.36Å
61L86.1Confident84.2Confident107 Ų107104.5 Ų104.556%0.5657%0.57SS**G310 helixtrans-84.8-12.8172.3-70.7173.3000112.3Y58 S59Y58-L61 HydrophobicContact CD1-CD1 3.9Å; Y58-L61 WeakPolarHBondContact O-CB 3.43Å; Y58-L61 PolarHBondContact O-N 3.46Å; S59-L61 VanDerWaalsContact C-N 3.26Å; S59-L61 PolarHBondContact O-N 2.9Å
62A81.7Confident84.3Confident62 Ų62102 Ų10251%0.51257%0.57SS.*SBendtrans-77.3129.8-179.900000110.3Y58 S59Y58-A62 PolarHBondContact O-N 3.34Å; S59-A62 VanDerWaalsContact O-CB 3.3Å; S59-A62 WeakPolarHBondContact O-CB 3.36Å; S59-A62 PolarHBondContact O-N 3.04Å
63S79.3Confident84.3Confident103 Ų103100.4 Ų100.472%0.7257%0.566SS**  trans-62.5146.2169.256.20000110.6P65S63-P65 WeakPolarHBondContact O-CD 3.48Å
64T74.9Confident84.4Confident138 Ų13894.9 Ų94.985%0.84756%0.555SS**  trans-55.4111.2171.30.10000109.2
65P70.3Confident84.6Confident79 Ų7995.2 Ų95.251%0.51355%0.551SS.*PPolyproline II helixtrans-68.5143-175.525.2-29.7000109.5S63S63-P65 WeakPolarHBondContact O-CD 3.48Å
66R74.1Confident84.7Confident230 Ų23098.4 Ų98.487%0.86854%0.543SS*.PPolyproline II helixtrans-69143.3169.2-67-177.6175.1-123.6-0.9108.3S68R66-S68 PolarHBondContact O-N 2.99Å
67S74.2Confident84.9Confident70 Ų70100.2 Ų100.249%0.4955%0.549SS..PPolyproline II helixtrans-56.7116.2171.2178.90000108.4E39E39-S67 VanDerWaalsContact OE1-CA 3.31Å; E39-S67 WeakPolarHBondContact OE1-CA 3.37Å; E39-S67 WeakPolarHBondContact OE2-CB 3.48Å; E39-S67 PolarHBondContact OE2-OG 3.27Å
68S74.7Confident85.3Confident90 Ų9099.9 Ų99.963%0.62955%0.55SS*.  trans-89.8-17.8-176.756.90000112.1E39 R66E39-S68 PolarHBondContact OE1-N 3.46Å; E39-S68 PolarHBondContact OE1-OG 3.21Å; R66-S68 PolarHBondContact O-N 2.99Å
69F81.7Confident86Confident65 Ų6593.7 Ų93.729%0.28553%0.526SS..  trans-99.7114.3-178.7-75.9-84.9000111.3L35 E39 P109 H110L35-F69 HydrophobicContact CD1-CB 4.49Å; E39-F69 HydrophobicContact CG-CD2 3.88Å; F69-P109 HydrophobicContact CB-CB 4.18Å; F69-P109 HydrophobicContact CD1-CB 3.87Å; F69-P109 HydrophobicContact CD2-CB 3.77Å; F69-P109 HydrophobicContact CD2-CG 4.14Å; F69-P109 HydrophobicContact CE1-CB 4.15Å; F69-P109 HydrophobicContact CE2-CB 4.03Å; F69-P109 HydrophobicContact CE2-CG 4.1Å; F69-P109 HydrophobicContact CG-CB 3.65Å; F69-P109 HydrophobicContact CZ-CB 4.21Å; F69-P109 HydrophobicContact CZ-CG 4.49Å; F69-H110 HydrophobicContact CE1-CB 4.2Å
70S84.7Confident86.6Confident110 Ų11093.3 Ų93.377%0.76952%0.518SS*.  trans-130.8141.2168.363.30000109.2
71I91Very high87.2Confident40 Ų4087.7 Ų87.721%0.20550%0.502CS..  trans-73.8150.6173.757.4169.4000110.4F31 L35 R76 L79F31-I71 HydrophobicContact CE1-CD1 3.73Å; F31-I71 HydrophobicContact CE1-CG1 4.36Å; F31-I71 HydrophobicContact CE1-CG2 3.99Å; F31-I71 HydrophobicContact CZ-CD1 4.32Å; F31-I71 HydrophobicContact CZ-CG2 3.65Å; L35-I71 HydrophobicContact CD2-CG2 4.44Å; I71-R76 HydrophobicContact CD1-CB 3.53Å; I71-R76 HydrophobicContact CD1-CG 3.97Å; I71-R76 HydrophobicContact CG1-CB 4.17Å; I71-L79 HydrophobicContact CD1-CD1 4.24Å
72S93.6Very high87.7Confident60 Ų6083.4 Ų83.442%0.4248%0.479SS..  trans-65.1152.5173.4690000110.7G74 E75 R76S72-G74 PolarHBondContact O-N 2.82Å; S72-E75 WeakPolarHBondContact CB-OE2 3.17Å; S72-E75 PolarHBondContact N-OE2 2.72Å; S72-E75 PolarHBondContact O-N 3.45Å; S72-E75 WeakPolarHBondContact OG-CB 3.35Å; S72-E75 VanDerWaalsContact OG-CD 3.26Å; S72-E75 WeakPolarHBondContact OG-CG 3.45Å; S72-E75 PolarHBondContact OG-N 3.07Å; S72-E75 PolarHBondContact OG-OE2 2.89Å; S72-R76 PolarHBondContact O-N 2.97Å
73T94.4Very high88.5Confident110 Ų11080.4 Ų80.468%0.67546%0.455SS*.Hα-helixtrans-58.4-35.5177.2-50.20000111.9R76 L77T73-R76 PolarHBondContact O-N 2.88Å; T73-L77 HydrophobicContact CG2-CD1 4.45Å; T73-L77 WeakPolarHBondContact O-CG 3.4Å; T73-L77 PolarHBondContact O-N 2.88Å; T73-L77 VanDerWaalsContact O-N 3.08Å
74G95.1Very high89.3Confident46 Ų4678 Ų7847%0.47444%0.438SS..Hα-helixtrans-64.4-46.7177.200000112.7S72 R76 L77 V78S72-G74 PolarHBondContact O-N 2.82Å; G74-R76 VanDerWaalsContact C-N 3.31Å; G74-R76 PolarHBondContact O-N 2.96Å; G74-L77 PolarHBondContact O-N 2.92Å; G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 3Å; G74-V78 VanDerWaalsContact O-N 3.16Å
75E94.5Very high90.3Very high91 Ų9177 Ų7743%0.42542%0.422SS..Hα-helixtrans-62.8-40.7176-71.9166.6134.900111.8S72 L77 V78 L79S72-E75 WeakPolarHBondContact CB-OE2 3.17Å; S72-E75 PolarHBondContact N-OE2 2.72Å; S72-E75 PolarHBondContact O-N 3.45Å; S72-E75 WeakPolarHBondContact OG-CB 3.35Å; S72-E75 VanDerWaalsContact OG-CD 3.26Å; S72-E75 WeakPolarHBondContact OG-CG 3.45Å; S72-E75 PolarHBondContact OG-N 3.07Å; S72-E75 PolarHBondContact OG-OE2 2.89Å; E75-L77 VanDerWaalsContact C-N 3.34Å; E75-L77 PolarHBondContact O-N 2.89Å; E75-V78 PolarHBondContact O-N 2.98Å; E75-L79 WeakPolarHBondContact O-CG 3.19Å; E75-L79 PolarHBondContact O-N 2.98Å
76R95.9Very high91.6Very high132 Ų13273.3 Ų73.350%0.49840%0.398SS..Hα-helixtrans-57.2-47.7176.7-176.4172.5173.2166.70.9112M28 I71 S72 T73 G74 V78 L79 E80M28-R76 HydrophobicContact CE-CG 4Å; I71-R76 HydrophobicContact CD1-CB 3.53Å; I71-R76 HydrophobicContact CD1-CG 3.97Å; I71-R76 HydrophobicContact CG1-CB 4.17Å; S72-R76 PolarHBondContact O-N 2.97Å; T73-R76 PolarHBondContact O-N 2.88Å; G74-R76 VanDerWaalsContact C-N 3.31Å; G74-R76 PolarHBondContact O-N 2.96Å; R76-V78 VanDerWaalsContact C-N 3.31Å; R76-V78 PolarHBondContact O-N 3.26Å; R76-L79 PolarHBondContact O-N 3.41Å; R76-E80 HydrophobicContact CG-CG 4.43Å; R76-E80 WeakPolarHBondContact CG-OE1 3.49Å; R76-E80 IonicContact CZ-OE1 3.84Å; R76-E80 IonicContact NE-OE1 3.73Å; R76-E80 PolarHBondContact NE-OE1 2.92Å; R76-E80 IonicContact NH2-OE1 2.74Å; R76-E80 PolarHBondContact NH2-OE1 3.46Å; R76-E80 WeakPolarHBondContact O-CB 3.47Å; R76-E80 WeakPolarHBondContact O-CG 3.25Å; R76-E80 PolarHBondContact O-N 3.29Å
77L96.6Very high92.6Very high107 Ų10764.7 Ų64.756%0.5637%0.372SS*.Hα-helixtrans-62.4-38.5178.7-70.5171.1000112T73 G74 E75 E80 D81T73-L77 HydrophobicContact CG2-CD1 4.45Å; T73-L77 WeakPolarHBondContact O-CG 3.4Å; T73-L77 PolarHBondContact O-N 2.88Å; T73-L77 VanDerWaalsContact O-N 3.08Å; G74-L77 PolarHBondContact O-N 2.92Å; E75-L77 VanDerWaalsContact C-N 3.34Å; E75-L77 PolarHBondContact O-N 2.89Å; L77-E80 PolarHBondContact O-N 3.39Å; L77-D81 WeakPolarHBondContact O-CB 3.44Å; L77-D81 PolarHBondContact O-N 2.88Å
78V96.8Very high93.7Very high67 Ų6764.9 Ų64.941%0.40637%0.372SS..Hα-helixtrans-65.3-41.6176.4171.70000111.4G74 E75 R76 L82G74-V78 WeakPolarHBondContact O-CG2 3.46Å; G74-V78 PolarHBondContact O-N 3Å; G74-V78 VanDerWaalsContact O-N 3.16Å; E75-V78 PolarHBondContact O-N 2.98Å; R76-V78 VanDerWaalsContact C-N 3.31Å; R76-V78 PolarHBondContact O-N 3.26Å; V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 3.48Å; V78-L82 VanDerWaalsContact O-N 3.1Å
79L97.2Very high94.7Very high6 Ų665.8 Ų65.83%0.03138%0.378CS..Hα-helixtrans-66.6-43.8176.7-69175.8000111.4M28 F31 I71 E75 R76 D81 L82 C83 F116 R117 L120M28-L79 HydrophobicContact CE-CB 4.31Å; M28-L79 HydrophobicContact SD-CB 3.92Å; F31-L79 HydrophobicContact CE1-CD1 4.47Å; F31-L79 HydrophobicContact CE2-CD1 4.5Å; F31-L79 HydrophobicContact CZ-CD1 4.36Å; I71-L79 HydrophobicContact CD1-CD1 4.24Å; E75-L79 WeakPolarHBondContact O-CG 3.19Å; E75-L79 PolarHBondContact O-N 2.98Å; R76-L79 PolarHBondContact O-N 3.41Å; L79-D81 VanDerWaalsContact C-N 3.34Å; L79-D81 PolarHBondContact O-N 3.22Å; L79-L82 PolarHBondContact O-N 2.87Å; L79-C83 PolarHBondContact O-N 3.24Å; L79-C83 PolarHBondContact O-SG 2.86Å; L79-F116 HydrophobicContact CB-CE1 4.36Å; L79-F116 HydrophobicContact CD1-CD1 3.98Å; L79-F116 HydrophobicContact CD1-CE1 4.44Å; L79-F116 HydrophobicContact CD2-CD1 3.72Å; L79-F116 HydrophobicContact CD2-CE1 4.22Å; L79-F116 HydrophobicContact CG-CD1 4.29Å; L79-R117 HydrophobicContact CD2-CB 3.96Å; L79-L120 HydrophobicContact CD2-CD1 4.29Å
80E96.9Very high95.4Very high51 Ų5163.5 Ų63.524%0.23837%0.37CS..Hα-helixtrans-60.5-41.8175.9-74.8172.2-178.400111.8M28 R76 L77 L82 C83 S84M28-E80 HydrophobicContact CE-CG 4.05Å; M28-E80 HydrophobicContact CG-CG 3.85Å; M28-E80 HydrophobicContact SD-CG 3.98Å; R76-E80 HydrophobicContact CG-CG 4.43Å; R76-E80 WeakPolarHBondContact CG-OE1 3.49Å; R76-E80 IonicContact CZ-OE1 3.84Å; R76-E80 IonicContact NE-OE1 3.73Å; R76-E80 PolarHBondContact NE-OE1 2.92Å; R76-E80 IonicContact NH2-OE1 2.74Å; R76-E80 PolarHBondContact NH2-OE1 3.46Å; R76-E80 WeakPolarHBondContact O-CB 3.47Å; R76-E80 WeakPolarHBondContact O-CG 3.25Å; R76-E80 PolarHBondContact O-N 3.29Å; L77-E80 PolarHBondContact O-N 3.39Å; E80-L82 PolarHBondContact O-N 2.94Å; E80-C83 PolarHBondContact O-N 3.1Å; E80-S84 PolarHBondContact O-N 3.13Å
81D96.9Very high96Very high78 Ų7859 Ų5942%0.41734%0.338SS..Hα-helixtrans-60.4-43.3173.8175.571.7000111.9L77 L79 S84 K85L77-D81 WeakPolarHBondContact O-CB 3.44Å; L77-D81 PolarHBondContact O-N 2.88Å; L79-D81 VanDerWaalsContact C-N 3.34Å; L79-D81 PolarHBondContact O-N 3.22Å; D81-S84 PolarHBondContact O-N 3.38Å; D81-S84 PolarHBondContact O-OG 3.31Å; D81-K85 IonicContact OD1-NZ 3.6Å; D81-K85 IonicContact OD2-NZ 2.66Å; D81-K85 PolarHBondContact OD2-NZ 3.06Å
82L97.7Very high96.3Very high16 Ų1659 Ų598%0.08435%0.348CS..Hα-helixtrans-64.7-43.9175.5-73.6171.6000112V78 L79 E80 S84 K85 R117 L120 L121 L124V78-L82 WeakPolarHBondContact O-CG 3.29Å; V78-L82 PolarHBondContact O-N 3.48Å; V78-L82 VanDerWaalsContact O-N 3.1Å; L79-L82 PolarHBondContact O-N 2.87Å; E80-L82 PolarHBondContact O-N 2.94Å; L82-S84 VanDerWaalsContact C-N 3.29Å; L82-S84 PolarHBondContact O-N 3.36Å; L82-K85 WeakPolarHBondContact O-CB 3.5Å; L82-K85 PolarHBondContact O-N 3.43Å; L82-K85 VanDerWaalsContact O-N 3.14Å; L82-R117 HydrophobicContact CD1-CG 3.91Å; L82-L120 HydrophobicContact CB-CB 4.41Å; L82-L120 HydrophobicContact CB-CD1 3.91Å; L82-L120 HydrophobicContact CD1-CD1 4.41Å; L82-L121 HydrophobicContact CD2-CD2 3.83Å; L82-L124 HydrophobicContact CD2-CD1 4.14Å
83C97.6Very high96.5Very high0 Ų059.5 Ų59.50%035%0.346CS..Hα-helixtrans-61.9-37.6178.3-66.40000112.1L27 L79 E80 K85 V86L27-C83 HydrophobicContact CB-CB 4.34Å; L27-C83 HydrophobicContact CD1-CB 4.06Å; L79-C83 PolarHBondContact O-N 3.24Å; L79-C83 PolarHBondContact O-SG 2.86Å; E80-C83 PolarHBondContact O-N 3.1Å; C83-K85 PolarHBondContact O-N 3.49Å; C83-V86 WeakPolarHBondContact O-CB 3.46Å; C83-V86 PolarHBondContact O-N 3.44Å
84S96.1Very high96.7Very high53 Ų5354.3 Ų54.337%0.37131%0.314SS..Hα-helixtrans-62-22.9177.278.80000113.7E80 D81 L82E80-S84 PolarHBondContact O-N 3.13Å; D81-S84 PolarHBondContact O-N 3.38Å; D81-S84 PolarHBondContact O-OG 3.31Å; L82-S84 VanDerWaalsContact C-N 3.29Å; L82-S84 PolarHBondContact O-N 3.36Å
85K96.5Very high96.9Very high115 Ų11553.3 Ų53.350%0.530%0.297SS..THydrogen-bonded Turntrans-84.2-12.2178.5-67.5164.7179163.40112.9D81 L82 C83 P87 L124D81-K85 IonicContact OD1-NZ 3.6Å; D81-K85 IonicContact OD2-NZ 2.66Å; D81-K85 PolarHBondContact OD2-NZ 3.06Å; L82-K85 WeakPolarHBondContact O-CB 3.5Å; L82-K85 PolarHBondContact O-N 3.43Å; L82-K85 VanDerWaalsContact O-N 3.14Å; C83-K85 PolarHBondContact O-N 3.49Å; K85-P87 WeakPolarHBondContact O-CD 3.26Å; K85-L124 HydrophobicContact CB-CD1 4.21Å; K85-L124 HydrophobicContact CB-CD2 4.07Å; K85-L124 WeakPolarHBondContact O-CD2 3.47Å
86V97.5Very high97.1Very high3 Ų354 Ų542%0.01830%0.303CS..SBendtrans-77.1124-178.7178.80000109.7V23 L27 C83 C90 V94 L120 L124V23-V86 HydrophobicContact CG1-CB 3.98Å; V23-V86 HydrophobicContact CG1-CG1 4.13Å; L27-V86 HydrophobicContact CD1-CB 4.24Å; L27-V86 HydrophobicContact CD1-CG1 4.36Å; L27-V86 HydrophobicContact CD1-CG2 4.12Å; C83-V86 WeakPolarHBondContact O-CB 3.46Å; C83-V86 PolarHBondContact O-N 3.44Å; V86-C90 HydrophobicContact CG1-CB 4.19Å; V86-V94 HydrophobicContact CG1-CG2 3.97Å; V86-V94 HydrophobicContact CG2-CG2 4.4Å; V86-L120 HydrophobicContact CG2-CD2 3.85Å; V86-L124 HydrophobicContact CG2-CD2 4.13Å; V86-L124 HydrophobicContact CG2-CG 4.46Å
87P96.1Very high97.2Very high48 Ų4851.1 Ų51.131%0.31229%0.294SS..  trans-62.2143.7174.2-22.233.5000111.5K85 S89 C90 C91 L127K85-P87 WeakPolarHBondContact O-CD 3.26Å; P87-S89 PolarHBondContact O-N 3.02Å; P87-S89 VanDerWaalsContact O-N 3.1Å; P87-C90 WeakPolarHBondContact O-CB 3.27Å; P87-C90 PolarHBondContact O-N 3.27Å; P87-C91 PolarHBondContact O-N 3Å; P87-L127 HydrophobicContact CG-CD1 3.98Å
88P96.1Very high97.2Very high75 Ų7546.1 Ų46.149%0.48727%0.268SS..G310 helixtrans-55.9-32.9179.8-26.834.1000114.5P19 V23 C90 C91P19-P88 HydrophobicContact CB-CG 3.86Å; V23-P88 HydrophobicContact CG2-CB 4.02Å; V23-P88 HydrophobicContact CG2-CG 4.13Å; P88-C90 PolarHBondContact O-N 2.94Å; P88-C91 PolarHBondContact O-N 3.4Å
89S95.4Very high97.3Very high109 Ų10948 Ų4876%0.76227%0.268SS*.G310 helixtrans-63.4-21.7175.451.40000113.9P87P87-S89 PolarHBondContact O-N 3.02Å; P87-S89 VanDerWaalsContact O-N 3.1Å
90C96.2Very high97.3Very high16 Ų1652.1 Ų52.111%0.10829%0.29CS..G310 helixtrans-106-6.7-172-56.10000112.6V86 P87 P88 G92 L93 V94 L127V86-C90 HydrophobicContact CG1-CB 4.19Å; P87-C90 WeakPolarHBondContact O-CB 3.27Å; P87-C90 PolarHBondContact O-N 3.27Å; P88-C90 PolarHBondContact O-N 2.94Å; C90-G92 VanDerWaalsContact C-N 3.26Å; C90-G92 PolarHBondContact O-N 3.4Å; C90-L93 WeakPolarHBondContact O-CB 3.43Å; C90-L93 PolarHBondContact O-N 3.47Å; C90-V94 PolarHBondContact O-N 2.84Å; C90-L127 HydrophobicContact CB-CD1 4.05Å; C90-L127 WeakPolarHBondContact SG-CD2 3.45Å
91C97.8Very high97.3Very high16 Ų1650.6 Ų50.611%0.10829%0.286CS..Hα-helixtrans-52.5-44.7178.4-176.90000112V23 P87 P88 L93 V94 I95V23-C91 HydrophobicContact CG1-CB 4.14Å; V23-C91 HydrophobicContact CG2-CB 4.21Å; P87-C91 PolarHBondContact O-N 3Å; P88-C91 PolarHBondContact O-N 3.4Å; C91-L93 VanDerWaalsContact C-N 3.33Å; C91-L93 PolarHBondContact O-N 3.04Å; C91-V94 PolarHBondContact O-N 3.3Å; C91-I95 WeakPolarHBondContact O-CG1 3.04Å; C91-I95 PolarHBondContact O-N 3.25Å
92G97.8Very high97.3Very high40 Ų4047.8 Ų47.841%0.41227%0.271SS..Hα-helixtrans-63.4-36.1178.500000113.5C90 I95 L96C90-G92 VanDerWaalsContact C-N 3.26Å; C90-G92 PolarHBondContact O-N 3.4Å; G92-I95 PolarHBondContact O-N 3.3Å; G92-L96 WeakPolarHBondContact O-CG 3.39Å; G92-L96 PolarHBondContact O-N 2.98Å
93L97.9Very high97.2Very high71 Ų7154.8 Ų54.837%0.37230%0.303SS..Hα-helixtrans-65-43.7177.4178.162.8000111.2C90 C91 I95 L96 K97 V123C90-L93 WeakPolarHBondContact O-CB 3.43Å; C90-L93 PolarHBondContact O-N 3.47Å; C91-L93 VanDerWaalsContact C-N 3.33Å; C91-L93 PolarHBondContact O-N 3.04Å; L93-I95 VanDerWaalsContact C-N 3.34Å; L93-I95 PolarHBondContact O-N 2.97Å; L93-L96 PolarHBondContact O-N 3.25Å; L93-K97 HydrophobicContact CD1-CG 4.08Å; L93-K97 HydrophobicContact CG-CG 4.41Å; L93-K97 WeakPolarHBondContact O-CB 3.43Å; L93-K97 WeakPolarHBondContact O-CG 3.41Å; L93-K97 PolarHBondContact O-N 3.06Å; L93-V123 HydrophobicContact CD2-CG1 4.27Å; L93-V123 HydrophobicContact CG-CG2 4.46Å
94V98.4Very high97.1Very high0 Ų058.7 Ų58.70%034%0.335CS..Hα-helixtrans-58.7-46.6175.9177.70000110.6L27 V86 C90 C91 L96 K97 F98 V119 L120 V123L27-V94 HydrophobicContact CD1-CG1 4.34Å; L27-V94 HydrophobicContact CD2-CB 3.92Å; L27-V94 HydrophobicContact CD2-CG1 3.71Å; V86-V94 HydrophobicContact CG1-CG2 3.97Å; V86-V94 HydrophobicContact CG2-CG2 4.4Å; C90-V94 PolarHBondContact O-N 2.84Å; C91-V94 PolarHBondContact O-N 3.3Å; V94-L96 PolarHBondContact O-N 2.66Å; V94-K97 PolarHBondContact O-N 2.93Å; V94-F98 VanDerWaalsContact O-CB 3.22Å; V94-F98 WeakPolarHBondContact O-CB 3.34Å; V94-F98 PolarHBondContact O-N 3.38Å; V94-V119 HydrophobicContact CG1-CG1 4.28Å; V94-L120 HydrophobicContact CG1-CD2 3.8Å; V94-L120 HydrophobicContact CG1-CG 4.49Å; V94-V123 HydrophobicContact CG2-CB 4.05Å; V94-V123 HydrophobicContact CG2-CG1 3.78Å; V94-V123 HydrophobicContact CG2-CG2 4.07Å
95I98.4Very high96.9Very high26 Ų2660.8 Ų60.813%0.13334%0.342CS..Hα-helixtrans-60.9-45.8180-64.8170.6000111.1T26 L27 E30 C91 G92 L93 F98 R99T26-I95 HydrophobicContact CG2-CD1 4.13Å; L27-I95 HydrophobicContact CD2-CD1 4.39Å; L27-I95 HydrophobicContact CD2-CG1 3.77Å; E30-I95 HydrophobicContact CG-CD1 4.05Å; E30-I95 HydrophobicContact CG-CG1 4.06Å; E30-I95 HydrophobicContact CG-CG2 4.29Å; C91-I95 WeakPolarHBondContact O-CG1 3.04Å; C91-I95 PolarHBondContact O-N 3.25Å; G92-I95 PolarHBondContact O-N 3.3Å; L93-I95 VanDerWaalsContact C-N 3.34Å; L93-I95 PolarHBondContact O-N 2.97Å; I95-F98 PolarHBondContact O-N 3.18Å; I95-R99 WeakPolarHBondContact O-CB 3.38Å; I95-R99 VanDerWaalsContact O-CG 3.31Å; I95-R99 WeakPolarHBondContact O-CG 3.41Å; I95-R99 PolarHBondContact O-N 3.02Å
96L98.3Very high96.8Very high105 Ų10560.4 Ų60.455%0.5534%0.342SS..Hα-helixtrans-62.2-52.3179-71.7171.5000111.2G92 L93 V94 F98 R99 D100G92-L96 WeakPolarHBondContact O-CG 3.39Å; G92-L96 PolarHBondContact O-N 2.98Å; L93-L96 PolarHBondContact O-N 3.25Å; V94-L96 PolarHBondContact O-N 2.66Å; L96-F98 VanDerWaalsContact C-N 3.27Å; L96-F98 PolarHBondContact O-N 3.33Å; L96-R99 PolarHBondContact O-N 3.24Å; L96-D100 VanDerWaalsContact O-CG 3.28Å; L96-D100 PolarHBondContact O-N 2.88Å
97K98.1Very high96.6Very high72 Ų7260.5 Ų60.531%0.31334%0.343SS..Hα-helixtrans-58.5-39.7178.5-74.6-74.7-167.9149.40112.5L93 V94 D100 A101 V119 E122L93-K97 HydrophobicContact CD1-CG 4.08Å; L93-K97 HydrophobicContact CG-CG 4.41Å; L93-K97 WeakPolarHBondContact O-CB 3.43Å; L93-K97 WeakPolarHBondContact O-CG 3.41Å; L93-K97 PolarHBondContact O-N 3.06Å; V94-K97 PolarHBondContact O-N 2.93Å; K97-D100 PolarHBondContact O-N 3.45Å; K97-A101 WeakPolarHBondContact O-CB 3.4Å; K97-A101 PolarHBondContact O-N 3.46Å; K97-V119 HydrophobicContact CB-CG1 3.66Å; K97-E122 IonicContact NZ-OE1 2.66Å; K97-E122 PolarHBondContact NZ-OE1 2.88Å
98F98.3Very high96.4Very high1 Ų160.7 Ų60.70%0.00434%0.34CS..Hα-helixtrans-67.2-44.4178.2-177.9-134.1000111.7F31 Q34 V94 I95 L96 D100 A101 M102 V112 H115 F116 V119F31-F98 HydrophobicContact CD2-CZ 4.32Å; Q34-F98 HydrophobicContact CB-CE1 3.66Å; Q34-F98 HydrophobicContact CB-CZ 3.78Å; Q34-F98 HydrophobicContact CG-CD1 3.96Å; Q34-F98 HydrophobicContact CG-CE1 3.34Å; Q34-F98 HydrophobicContact CG-CZ 3.89Å; V94-F98 VanDerWaalsContact O-CB 3.22Å; V94-F98 WeakPolarHBondContact O-CB 3.34Å; V94-F98 PolarHBondContact O-N 3.38Å; I95-F98 PolarHBondContact O-N 3.18Å; L96-F98 VanDerWaalsContact C-N 3.27Å; L96-F98 PolarHBondContact O-N 3.33Å; F98-D100 VanDerWaalsContact C-N 3.34Å; F98-D100 PolarHBondContact O-N 2.95Å; F98-A101 PolarHBondContact O-N 3.35Å; F98-M102 HydrophobicContact CD2-CG 4.2Å; F98-M102 HydrophobicContact CE2-CG 3.9Å; F98-M102 HydrophobicContact CE2-SD 3.8Å; F98-M102 HydrophobicContact CZ-CG 4.14Å; F98-M102 HydrophobicContact CZ-SD 4.03Å; F98-M102 VanDerWaalsContact O-CG 3.26Å; F98-M102 WeakPolarHBondContact O-CG 3.39Å; F98-M102 PolarHBondContact O-N 3.47Å; F98-V112 HydrophobicContact CE2-CG1 4.42Å; F98-V112 HydrophobicContact CZ-CG1 3.85Å; F98-H115 HydrophobicContact CE2-CB 4.38Å; F98-F116 AromaticContact CD1-CD2 3.82Å; F98-F116 HydrophobicContact CD1-CD2 3.82Å; F98-F116 HydrophobicContact CD1-CE2 4.31Å; F98-F116 HydrophobicContact CD2-CB 4.21Å; F98-F116 HydrophobicContact CD2-CD2 4.01Å; F98-F116 AromaticContact CE1-CD2 3.81Å; F98-F116 HydrophobicContact CE1-CD2 3.81Å; F98-F116 HydrophobicContact CE1-CE2 4.46Å; F98-F116 HydrophobicContact CE1-CG 4.43Å; F98-F116 HydrophobicContact CE2-CB 3.64Å; F98-F116 HydrophobicContact CE2-CD2 4.05Å; F98-F116 HydrophobicContact CE2-CG 4.3Å; F98-F116 AromaticContact CG-CD2 3.92Å; F98-F116 HydrophobicContact CG-CD2 3.92Å; F98-F116 HydrophobicContact CZ-CB 3.82Å; F98-F116 AromaticContact CZ-CD2 3.96Å; F98-F116 HydrophobicContact CZ-CD2 3.96Å; F98-F116 HydrophobicContact CZ-CG 4.2Å; F98-V119 HydrophobicContact CB-CG1 4.25Å
99R97.9Very high96.2Very high108 Ų10857.2 Ų57.241%0.40832%0.317SS..Hα-helixtrans-60.9-43.1174.5-74.3173.5178.4-163.22112.1E30 I95 L96 A101 M102 Q103E30-R99 IonicContact OE1-NH2 3.94Å; E30-R99 PolarHBondContact OE1-NH2 2.71Å; E30-R99 IonicContact OE2-CZ 3.74Å; E30-R99 IonicContact OE2-NE 3.7Å; E30-R99 PolarHBondContact OE2-NE 3.26Å; E30-R99 IonicContact OE2-NH2 3.29Å; E30-R99 PolarHBondContact OE2-NH2 3Å; I95-R99 WeakPolarHBondContact O-CB 3.38Å; I95-R99 VanDerWaalsContact O-CG 3.31Å; I95-R99 WeakPolarHBondContact O-CG 3.41Å; I95-R99 PolarHBondContact O-N 3.02Å; L96-R99 PolarHBondContact O-N 3.24Å; R99-A101 VanDerWaalsContact C-N 3.33Å; R99-A101 PolarHBondContact O-N 3.19Å; R99-M102 PolarHBondContact O-N 2.95Å; R99-Q103 WeakPolarHBondContact O-CB 3.42Å; R99-Q103 PolarHBondContact O-N 3.18Å
100D97.9Very high96.1Very high92 Ų9257.7 Ų57.749%0.49231%0.307SS..Hα-helixtrans-60.5-43.7175.8-68.4-12.3000111L96 K97 F98 M102 Q103 A104L96-D100 VanDerWaalsContact O-CG 3.28Å; L96-D100 PolarHBondContact O-N 2.88Å; K97-D100 PolarHBondContact O-N 3.45Å; F98-D100 VanDerWaalsContact C-N 3.34Å; F98-D100 PolarHBondContact O-N 2.95Å; D100-M102 PolarHBondContact O-N 3.2Å; D100-Q103 PolarHBondContact O-N 3.45Å; D100-A104 VanDerWaalsContact O-CB 3.3Å; D100-A104 WeakPolarHBondContact O-CB 3.47Å; D100-A104 PolarHBondContact O-N 3.48Å
101A96.7Very high96Very high19 Ų1960.8 Ų60.816%0.15732%0.32CS..Hα-helixtrans-64.6-38.4176.600000112.7K97 F98 R99 N105 V119K97-A101 WeakPolarHBondContact O-CB 3.4Å; K97-A101 PolarHBondContact O-N 3.46Å; F98-A101 PolarHBondContact O-N 3.35Å; R99-A101 VanDerWaalsContact C-N 3.33Å; R99-A101 PolarHBondContact O-N 3.19Å; A101-N105 WeakPolarHBondContact O-CB 3.42Å; A101-N105 PolarHBondContact O-N 3.39Å; A101-N105 VanDerWaalsContact O-N 3.13Å; A101-N105 PolarHBondContact O-ND2 2.83Å; A101-V119 HydrophobicContact CB-CG2 4.22Å
102M96.9Very high95.9Very high19 Ų1960 Ų609%0.09432%0.315CS..Hα-helixtrans-65.5-40.5175.1-68.5-62.9-58.300111.5Q34 A38 F98 R99 D100 E106 P107 V112Q34-M102 HydrophobicContact CB-CE 4.18Å; Q34-M102 HydrophobicContact CB-CG 4.38Å; Q34-M102 HydrophobicContact CB-SD 4.44Å; Q34-M102 HydrophobicContact CG-CG 4.14Å; A38-M102 HydrophobicContact CB-CE 4.32Å; F98-M102 HydrophobicContact CD2-CG 4.2Å; F98-M102 HydrophobicContact CE2-CG 3.9Å; F98-M102 HydrophobicContact CE2-SD 3.8Å; F98-M102 HydrophobicContact CZ-CG 4.14Å; F98-M102 HydrophobicContact CZ-SD 4.03Å; F98-M102 VanDerWaalsContact O-CG 3.26Å; F98-M102 WeakPolarHBondContact O-CG 3.39Å; F98-M102 PolarHBondContact O-N 3.47Å; R99-M102 PolarHBondContact O-N 2.95Å; D100-M102 PolarHBondContact O-N 3.2Å; M102-E106 WeakPolarHBondContact O-CA 3.22Å; M102-E106 PolarHBondContact O-N 2.95Å; M102-P107 HydrophobicContact CE-CG 3.52Å; M102-P107 WeakPolarHBondContact O-CD 3.4Å; M102-P107 HydrophobicContact SD-CG 3.48Å; M102-P107 WeakPolarHBondContact SD-CG 3.34Å; M102-V112 HydrophobicContact CE-CG1 4.23Å; M102-V112 HydrophobicContact CE-CG2 3.91Å; M102-V112 HydrophobicContact SD-CG1 4Å; M102-V112 HydrophobicContact SD-CG2 4.34Å
103Q95.8Very high95.8Very high163 Ų16359.2 Ų59.276%0.76230%0.303SS*.Hα-helixtrans-71.2-37178.4-174.417410.600112.6R99 D100R99-Q103 WeakPolarHBondContact O-CB 3.42Å; R99-Q103 PolarHBondContact O-N 3.18Å; D100-Q103 PolarHBondContact O-N 3.45Å
104A95.3Very high95.7Very high82 Ų8257.8 Ų57.868%0.67831%0.305SS*.Hα-helixtrans-74.4-38.5-177.400000113D100D100-A104 VanDerWaalsContact O-CB 3.3Å; D100-A104 WeakPolarHBondContact O-CB 3.47Å; D100-A104 PolarHBondContact O-N 3.48Å
105N92.2Very high95.7Very high97 Ų9760 Ų6052%0.51932%0.315SS..Hα-helixtrans-100.1-20.1-172.4-57.7-58000113.6A101A101-N105 WeakPolarHBondContact O-CB 3.42Å; A101-N105 PolarHBondContact O-N 3.39Å; A101-N105 VanDerWaalsContact O-N 3.13Å; A101-N105 PolarHBondContact O-ND2 2.83Å
106E93.1Very high95.7Very high106 Ų10658.8 Ų58.850%0.49531%0.309SS..  trans43.256.8-170.8-158.4-169.5150.600112.9R45 M102R45-E106 IonicContact CZ-OE1 2.7Å; R45-E106 VanDerWaalsContact CZ-OE1 3.23Å; R45-E106 IonicContact NE-OE1 3.02Å; R45-E106 PolarHBondContact NE-OE1 3.38Å; R45-E106 IonicContact NH2-OE1 3.65Å; R45-E106 PolarHBondContact NH2-OE1 2.82Å; M102-E106 WeakPolarHBondContact O-CA 3.22Å; M102-E106 PolarHBondContact O-N 2.95Å
107P93.3Very high95.7Very high6 Ų660.1 Ų60.14%0.03931%0.307CS..  trans-68.7153.1-168.429.1-35.4000112.7M102 E111 V112M102-P107 HydrophobicContact CE-CG 3.52Å; M102-P107 WeakPolarHBondContact O-CD 3.4Å; M102-P107 HydrophobicContact SD-CG 3.48Å; M102-P107 WeakPolarHBondContact SD-CG 3.34Å; P107-E111 HydrophobicContact CB-CB 3.99Å; P107-V112 HydrophobicContact CG-CG2 4.35Å
108E92.6Very high95.7Very high52 Ų5259.5 Ų59.524%0.24332%0.315CS..  trans-69.8156.8169.9-70.3-65.7139.300110.6Q42 R45 H110 E111 V112Q42-E108 VanDerWaalsContact CD-OE2 3.23Å; Q42-E108 WeakPolarHBondContact CG-OE2 3.41Å; Q42-E108 PolarHBondContact OE1-OE2 3.26Å; R45-E108 IonicContact CZ-OE1 3.15Å; R45-E108 IonicContact NH1-OE1 2.77Å; R45-E108 PolarHBondContact NH1-OE1 3.41Å; R45-E108 IonicContact NH2-OE1 3.23Å; E108-H110 WeakPolarHBondContact CB-CE1 3.43Å; E108-H110 WeakPolarHBondContact CB-ND1 3.47Å; E108-H110 PolarHBondContact O-N 2.9Å; E108-E111 HydrophobicContact CB-CG 4.36Å; E108-E111 PolarHBondContact N-OE2 2.88Å; E108-E111 WeakPolarHBondContact O-CB 3.39Å; E108-E111 PolarHBondContact O-N 3.38Å; E108-V112 PolarHBondContact O-N 3.17Å
109P92.8Very high95.7Very high2 Ų259.8 Ų59.81%0.01332%0.317CS..THydrogen-bonded Turntrans-56.4-33.3-173-29.938.3000114.7L35 A38 E39 Q42 F69 E111L35-P109 HydrophobicContact CD1-CB 4.15Å; L35-P109 WeakPolarHBondContact CD1-O 3.28Å; A38-P109 HydrophobicContact CB-CG 4.25Å; E39-P109 HydrophobicContact CB-CG 4.21Å; Q42-P109 HydrophobicContact CB-CG 4.45Å; F69-P109 HydrophobicContact CB-CB 4.18Å; F69-P109 HydrophobicContact CD1-CB 3.87Å; F69-P109 HydrophobicContact CD2-CB 3.77Å; F69-P109 HydrophobicContact CD2-CG 4.14Å; F69-P109 HydrophobicContact CE1-CB 4.15Å; F69-P109 HydrophobicContact CE2-CB 4.03Å; F69-P109 HydrophobicContact CE2-CG 4.1Å; F69-P109 HydrophobicContact CG-CB 3.65Å; F69-P109 HydrophobicContact CZ-CB 4.21Å; F69-P109 HydrophobicContact CZ-CG 4.49Å; P109-E111 VanDerWaalsContact C-N 3.28Å; P109-E111 PolarHBondContact O-N 3.04Å
110H91.8Very high95.7Very high118 Ų11854.6 Ų54.655%0.54630%0.297SS..THydrogen-bonded Turntrans-73.2-19.8178.862.4-81.4000113.3F69 E108F69-H110 HydrophobicContact CE1-CB 4.2Å; E108-H110 WeakPolarHBondContact CB-CE1 3.43Å; E108-H110 WeakPolarHBondContact CB-ND1 3.47Å; E108-H110 PolarHBondContact O-N 2.9Å
111E94.3Very high95.7Very high82 Ų8253.4 Ų53.438%0.38329%0.291SS..THydrogen-bonded Turntrans-90.2-17.5-179.3-57.8179.7151.300112.3P107 E108 P109 S113 G114 H115P107-E111 HydrophobicContact CB-CB 3.99Å; E108-E111 HydrophobicContact CB-CG 4.36Å; E108-E111 PolarHBondContact N-OE2 2.88Å; E108-E111 WeakPolarHBondContact O-CB 3.39Å; E108-E111 PolarHBondContact O-N 3.38Å; P109-E111 VanDerWaalsContact C-N 3.28Å; P109-E111 PolarHBondContact O-N 3.04Å; E111-S113 VanDerWaalsContact C-N 3.26Å; E111-S113 PolarHBondContact O-N 2.84Å; E111-G114 PolarHBondContact O-N 2.91Å; E111-H115 PolarHBondContact O-N 3.41Å; E111-H115 PolarHBondContact O-ND1 2.87Å
112V96.5Very high95.8Very high0 Ų056.3 Ų56.30%030%0.301CS..Hα-helixtrans-57.8-39.2-177.3-177.50000111.7F31 Q34 L35 A38 F98 M102 P107 E108 G114 H115 F116F31-V112 HydrophobicContact CD2-CG1 4.25Å; F31-V112 HydrophobicContact CE2-CG1 3.91Å; Q34-V112 HydrophobicContact CB-CG1 4.2Å; L35-V112 HydrophobicContact CB-CG1 4.42Å; L35-V112 HydrophobicContact CD1-CB 4.12Å; L35-V112 HydrophobicContact CD1-CG2 4.28Å; A38-V112 HydrophobicContact CB-CG2 3.81Å; F98-V112 HydrophobicContact CE2-CG1 4.42Å; F98-V112 HydrophobicContact CZ-CG1 3.85Å; M102-V112 HydrophobicContact CE-CG1 4.23Å; M102-V112 HydrophobicContact CE-CG2 3.91Å; M102-V112 HydrophobicContact SD-CG1 4Å; M102-V112 HydrophobicContact SD-CG2 4.34Å; P107-V112 HydrophobicContact CG-CG2 4.35Å; E108-V112 PolarHBondContact O-N 3.17Å; V112-G114 VanDerWaalsContact C-N 3.35Å; V112-G114 PolarHBondContact O-N 2.7Å; V112-H115 PolarHBondContact O-N 3.05Å; V112-F116 WeakPolarHBondContact O-CB 3.34Å; V112-F116 PolarHBondContact O-N 3.44Å
113S96.2Very high95.8Very high22 Ų2255.4 Ų55.415%0.15430%0.296CS..Hα-helixtrans-63.5-40177.161.50000112.3E111 R117E111-S113 VanDerWaalsContact C-N 3.26Å; E111-S113 PolarHBondContact O-N 2.84Å; S113-R117 WeakPolarHBondContact O-CB 3.45Å; S113-R117 PolarHBondContact O-N 3.31Å
114G96.1Very high95.9Very high41 Ų4148.6 Ų48.642%0.42327%0.265SS..Hα-helixtrans-64.5-45.9176.100000112.1E111 V112 R117 A118E111-G114 PolarHBondContact O-N 2.91Å; V112-G114 VanDerWaalsContact C-N 3.35Å; V112-G114 PolarHBondContact O-N 2.7Å; G114-R117 PolarHBondContact O-N 3.06Å; G114-A118 WeakPolarHBondContact O-CB 3.34Å; G114-A118 PolarHBondContact O-N 3.18Å
115H97.3Very high96Very high46 Ų4648.1 Ų48.121%0.21325%0.251CS..Hα-helixtrans-62.5-44.7176.9-72.983.4000111.9F98 E111 V112 R117 A118 V119F98-H115 HydrophobicContact CE2-CB 4.38Å; E111-H115 PolarHBondContact O-N 3.41Å; E111-H115 PolarHBondContact O-ND1 2.87Å; V112-H115 PolarHBondContact O-N 3.05Å; H115-R117 PolarHBondContact O-N 2.92Å; H115-A118 PolarHBondContact O-N 2.98Å; H115-V119 WeakPolarHBondContact O-CG2 3.5Å; H115-V119 PolarHBondContact O-N 3.42Å
116F98.1Very high96.2Very high1 Ų146.4 Ų46.40%0.00424%0.24CC..Hα-helixtrans-61.6-44.9178.2-175.9-124000111.8L27 M28 F31 L79 F98 V112 A118 V119 L120L27-F116 HydrophobicContact CB-CZ 4.04Å; M28-F116 HydrophobicContact SD-CE1 4.14Å; F31-F116 HydrophobicContact CB-CD1 3.96Å; F31-F116 HydrophobicContact CB-CD2 4.4Å; F31-F116 HydrophobicContact CB-CE1 3.83Å; F31-F116 HydrophobicContact CB-CE2 4.28Å; F31-F116 HydrophobicContact CB-CG 4.25Å; F31-F116 HydrophobicContact CB-CZ 3.99Å; F31-F116 HydrophobicContact CD2-CB 3.78Å; F31-F116 AromaticContact CD2-CD1 3.61Å; F31-F116 HydrophobicContact CD2-CD1 3.61Å; F31-F116 HydrophobicContact CD2-CE1 4.31Å; F31-F116 AromaticContact CD2-CG 3.72Å; F31-F116 HydrophobicContact CD2-CG 3.72Å; F31-F116 HydrophobicContact CE2-CB 4.27Å; F31-F116 HydrophobicContact CE2-CD1 4.42Å; F31-F116 AromaticContact CG-CD1 3.88Å; F31-F116 HydrophobicContact CG-CD1 3.88Å; F31-F116 HydrophobicContact CG-CE1 4.13Å; F31-F116 HydrophobicContact CG-CG 4.29Å; L79-F116 HydrophobicContact CB-CE1 4.36Å; L79-F116 HydrophobicContact CD1-CD1 3.98Å; L79-F116 HydrophobicContact CD1-CE1 4.44Å; L79-F116 HydrophobicContact CD2-CD1 3.72Å; L79-F116 HydrophobicContact CD2-CE1 4.22Å; L79-F116 HydrophobicContact CG-CD1 4.29Å; F98-F116 AromaticContact CD1-CD2 3.82Å; F98-F116 HydrophobicContact CD1-CD2 3.82Å; F98-F116 HydrophobicContact CD1-CE2 4.31Å; F98-F116 HydrophobicContact CD2-CB 4.21Å; F98-F116 HydrophobicContact CD2-CD2 4.01Å; F98-F116 AromaticContact CE1-CD2 3.81Å; F98-F116 HydrophobicContact CE1-CD2 3.81Å; F98-F116 HydrophobicContact CE1-CE2 4.46Å; F98-F116 HydrophobicContact CE1-CG 4.43Å; F98-F116 HydrophobicContact CE2-CB 3.64Å; F98-F116 HydrophobicContact CE2-CD2 4.05Å; F98-F116 HydrophobicContact CE2-CG 4.3Å; F98-F116 AromaticContact CG-CD2 3.92Å; F98-F116 HydrophobicContact CG-CD2 3.92Å; F98-F116 HydrophobicContact CZ-CB 3.82Å; F98-F116 AromaticContact CZ-CD2 3.96Å; F98-F116 HydrophobicContact CZ-CD2 3.96Å; F98-F116 HydrophobicContact CZ-CG 4.2Å; V112-F116 WeakPolarHBondContact O-CB 3.34Å; V112-F116 PolarHBondContact O-N 3.44Å; F116-A118 PolarHBondContact O-N 3.3Å; F116-V119 PolarHBondContact O-N 3.48Å; F116-L120 HydrophobicContact CD1-CD1 3.94Å; F116-L120 HydrophobicContact CE1-CD1 3.62Å; F116-L120 HydrophobicContact CE2-CD1 4.26Å; F116-L120 HydrophobicContact CE2-CG 4.32Å; F116-L120 HydrophobicContact CG-CD1 4.38Å; F116-L120 HydrophobicContact CZ-CD1 3.79Å; F116-L120 HydrophobicContact CZ-CD2 4.45Å; F116-L120 HydrophobicContact CZ-CG 4.28Å; F116-L120 WeakPolarHBondContact O-CG 3.31Å; F116-L120 PolarHBondContact O-N 3.3Å
117R98.2Very high96.3Very high134 Ų13443.1 Ų43.151%0.50623%0.225SC..Hα-helixtrans-59.9-43.9174-177.5178.7177.1-176.8-0.7112.1L79 L82 S113 G114 H115 L120 L121L79-R117 HydrophobicContact CD2-CB 3.96Å; L82-R117 HydrophobicContact CD1-CG 3.91Å; S113-R117 WeakPolarHBondContact O-CB 3.45Å; S113-R117 PolarHBondContact O-N 3.31Å; G114-R117 PolarHBondContact O-N 3.06Å; H115-R117 PolarHBondContact O-N 2.92Å; R117-L120 PolarHBondContact O-N 3.24Å; R117-L121 HydrophobicContact CG-CD1 4.08Å; R117-L121 WeakPolarHBondContact O-CG 3.48Å; R117-L121 PolarHBondContact O-N 3.47Å
118A98.1Very high96.4Very high58 Ų5848.7 Ų48.748%0.47925%0.249SC..Hα-helixtrans-61.3-45.8179.700000111.5G114 H115 F116 L121 E122G114-A118 WeakPolarHBondContact O-CB 3.34Å; G114-A118 PolarHBondContact O-N 3.18Å; H115-A118 PolarHBondContact O-N 2.98Å; F116-A118 PolarHBondContact O-N 3.3Å; A118-L121 PolarHBondContact O-N 3.45Å; A118-E122 WeakPolarHBondContact O-CB 3.48Å; A118-E122 PolarHBondContact O-N 2.94Å
119V98.3Very high96.5Very high7 Ų752.5 Ų52.54%0.04227%0.267CS..Hα-helixtrans-63.6-42.7177.2172.10000111.7V94 K97 F98 A101 H115 F116 L121 E122 V123V94-V119 HydrophobicContact CG1-CG1 4.28Å; K97-V119 HydrophobicContact CB-CG1 3.66Å; F98-V119 HydrophobicContact CB-CG1 4.25Å; A101-V119 HydrophobicContact CB-CG2 4.22Å; H115-V119 WeakPolarHBondContact O-CG2 3.5Å; H115-V119 PolarHBondContact O-N 3.42Å; F116-V119 PolarHBondContact O-N 3.48Å; V119-L121 VanDerWaalsContact C-N 3.34Å; V119-L121 PolarHBondContact O-N 2.9Å; V119-E122 PolarHBondContact O-N 3.22Å; V119-V123 HydrophobicContact CG1-CG2 4.43Å; V119-V123 WeakPolarHBondContact O-CG2 3.39Å; V119-V123 PolarHBondContact O-N 3.47Å
120L98.3Very high96.6Very high0 Ų057.6 Ų57.60%029%0.291CS..Hα-helixtrans-58.6-46.6175.8-75.5168.6000111.4L27 L79 L82 V86 V94 F116 R117 L124L27-L120 HydrophobicContact CD1-CD2 4.14Å; L79-L120 HydrophobicContact CD2-CD1 4.29Å; L82-L120 HydrophobicContact CB-CB 4.41Å; L82-L120 HydrophobicContact CB-CD1 3.91Å; L82-L120 HydrophobicContact CD1-CD1 4.41Å; V86-L120 HydrophobicContact CG2-CD2 3.85Å; V94-L120 HydrophobicContact CG1-CD2 3.8Å; V94-L120 HydrophobicContact CG1-CG 4.49Å; F116-L120 HydrophobicContact CD1-CD1 3.94Å; F116-L120 HydrophobicContact CE1-CD1 3.62Å; F116-L120 HydrophobicContact CE2-CD1 4.26Å; F116-L120 HydrophobicContact CE2-CG 4.32Å; F116-L120 HydrophobicContact CG-CD1 4.38Å; F116-L120 HydrophobicContact CZ-CD1 3.79Å; F116-L120 HydrophobicContact CZ-CD2 4.45Å; F116-L120 HydrophobicContact CZ-CG 4.28Å; F116-L120 WeakPolarHBondContact O-CG 3.31Å; F116-L120 PolarHBondContact O-N 3.3Å; R117-L120 PolarHBondContact O-N 3.24Å; L120-L124 WeakPolarHBondContact O-CB 3.26Å; L120-L124 WeakPolarHBondContact O-CG 3.16Å; L120-L124 PolarHBondContact O-N 3.07Å
121L98.3Very high96.6Very high67 Ų6756.6 Ų56.635%0.35129%0.286SS..Hα-helixtrans-64.8-44.7178.2-69.3172.6000111.7L82 R117 A118 V119 V123 L124 D125L82-L121 HydrophobicContact CD2-CD2 3.83Å; R117-L121 HydrophobicContact CG-CD1 4.08Å; R117-L121 WeakPolarHBondContact O-CG 3.48Å; R117-L121 PolarHBondContact O-N 3.47Å; A118-L121 PolarHBondContact O-N 3.45Å; V119-L121 VanDerWaalsContact C-N 3.34Å; V119-L121 PolarHBondContact O-N 2.9Å; L121-V123 PolarHBondContact O-N 2.9Å; L121-L124 PolarHBondContact O-N 2.91Å; L121-D125 WeakPolarHBondContact O-CB 3.39Å; L121-D125 PolarHBondContact O-N 2.87Å
122E98.1Very high96.6Very high79 Ų7958.5 Ų58.537%0.36930%0.295SS..Hα-helixtrans-56-49.8177.3-175.1-165.1148.300111.3K97 A118 V119 D125 Q126K97-E122 IonicContact NZ-OE1 2.66Å; K97-E122 PolarHBondContact NZ-OE1 2.88Å; A118-E122 WeakPolarHBondContact O-CB 3.48Å; A118-E122 PolarHBondContact O-N 2.94Å; V119-E122 PolarHBondContact O-N 3.22Å; E122-D125 PolarHBondContact O-N 3.13Å; E122-Q126 VanDerWaalsContact CG-NE2 3.34Å; E122-Q126 WeakPolarHBondContact O-CG 3.42Å; E122-Q126 PolarHBondContact O-N 3.24Å; E122-Q126 PolarHBondContact OE1-NE2 2.74Å
123V97.8Very high96.5Very high1 Ų161 Ų611%0.00632%0.316CS..Hα-helixtrans-66.7-41.4-179.5173.30000111.1L93 V94 V119 L121 D125 Q126 L127L93-V123 HydrophobicContact CD2-CG1 4.27Å; L93-V123 HydrophobicContact CG-CG2 4.46Å; V94-V123 HydrophobicContact CG2-CB 4.05Å; V94-V123 HydrophobicContact CG2-CG1 3.78Å; V94-V123 HydrophobicContact CG2-CG2 4.07Å; V119-V123 HydrophobicContact CG1-CG2 4.43Å; V119-V123 WeakPolarHBondContact O-CG2 3.39Å; V119-V123 PolarHBondContact O-N 3.47Å; L121-V123 PolarHBondContact O-N 2.9Å; V123-D125 VanDerWaalsContact C-N 3.3Å; V123-D125 PolarHBondContact O-N 2.88Å; V123-Q126 PolarHBondContact O-N 3.26Å; V123-L127 HydrophobicContact CG1-CD1 3.99Å; V123-L127 HydrophobicContact CG1-CG 4.41Å; V123-L127 WeakPolarHBondContact O-CB 3.41Å; V123-L127 WeakPolarHBondContact O-CG 3.5Å; V123-L127 PolarHBondContact O-N 2.97Å
124L97.3Very high96.3Very high20 Ų2064.5 Ų64.511%0.10533%0.329CS..Hα-helixtrans-64.6-35.2177.7-72.7172.7000112.5L82 K85 V86 L120 L121 K128L82-L124 HydrophobicContact CD2-CD1 4.14Å; K85-L124 HydrophobicContact CB-CD1 4.21Å; K85-L124 HydrophobicContact CB-CD2 4.07Å; K85-L124 WeakPolarHBondContact O-CD2 3.47Å; V86-L124 HydrophobicContact CG2-CD2 4.13Å; V86-L124 HydrophobicContact CG2-CG 4.46Å; L120-L124 WeakPolarHBondContact O-CB 3.26Å; L120-L124 WeakPolarHBondContact O-CG 3.16Å; L120-L124 PolarHBondContact O-N 3.07Å; L121-L124 PolarHBondContact O-N 2.91Å; L124-K128 WeakPolarHBondContact O-CG 3.46Å; L124-K128 PolarHBondContact O-N 3.26Å
125D97.7Very high96.1Very high71 Ų7170 Ų7038%0.3834%0.338SS..Hα-helixtrans-73.7-42.7177-72.1-20.5000111.5L121 E122 V123 L127 K128 E129L121-D125 WeakPolarHBondContact O-CB 3.39Å; L121-D125 PolarHBondContact O-N 2.87Å; E122-D125 PolarHBondContact O-N 3.13Å; V123-D125 VanDerWaalsContact C-N 3.3Å; V123-D125 PolarHBondContact O-N 2.88Å; D125-L127 PolarHBondContact O-N 2.64Å; D125-K128 WeakPolarHBondContact O-CB 3.42Å; D125-K128 PolarHBondContact O-N 3.16Å; D125-K128 IonicContact OD1-NZ 2.78Å; D125-K128 PolarHBondContact OD1-NZ 2.96Å; D125-E129 WeakPolarHBondContact O-CG 3.31Å; D125-E129 PolarHBondContact O-N 3.39Å
126Q96.4Very high95.8Very high61 Ų6173 Ų7329%0.28536%0.355SS..Hα-helixtrans-55.5-41.3171.2-75.3170.816.600111.8E122 V123 K128 E129 E130E122-Q126 VanDerWaalsContact CG-NE2 3.34Å; E122-Q126 WeakPolarHBondContact O-CG 3.42Å; E122-Q126 PolarHBondContact O-N 3.24Å; E122-Q126 PolarHBondContact OE1-NE2 2.74Å; V123-Q126 PolarHBondContact O-N 3.26Å; Q126-K128 VanDerWaalsContact C-N 3.35Å; Q126-K128 PolarHBondContact O-N 3.4Å; Q126-E129 PolarHBondContact O-N 3.35Å; Q126-E130 WeakPolarHBondContact O-CB 3.46Å; Q126-E130 WeakPolarHBondContact O-CG 3.48Å; Q126-E130 PolarHBondContact O-N 3.31Å
127L94.5Very high95.4Very high37 Ų3777.2 Ų77.219%0.19438%0.381CS..Hα-helixtrans-65.7-35.5177.9-73.6169.9000113.3P87 C90 V123 D125 Q131P87-L127 HydrophobicContact CG-CD1 3.98Å; C90-L127 HydrophobicContact CB-CD1 4.05Å; C90-L127 WeakPolarHBondContact SG-CD2 3.45Å; V123-L127 HydrophobicContact CG1-CD1 3.99Å; V123-L127 HydrophobicContact CG1-CG 4.41Å; V123-L127 WeakPolarHBondContact O-CB 3.41Å; V123-L127 WeakPolarHBondContact O-CG 3.5Å; V123-L127 PolarHBondContact O-N 2.97Å; D125-L127 PolarHBondContact O-N 2.64Å; L127-Q131 WeakPolarHBondContact O-CB 3.44Å; L127-Q131 PolarHBondContact O-N 3.25Å
128K95.3Very high94.9Very high124 Ų12478.8 Ų78.854%0.53939%0.387SS..Hα-helixtrans-66.2-47.6174.2-69.2169.1-162.3155.90110.4L124 D125 Q126 E130 Q131 E132L124-K128 WeakPolarHBondContact O-CG 3.46Å; L124-K128 PolarHBondContact O-N 3.26Å; D125-K128 WeakPolarHBondContact O-CB 3.42Å; D125-K128 PolarHBondContact O-N 3.16Å; D125-K128 IonicContact OD1-NZ 2.78Å; D125-K128 PolarHBondContact OD1-NZ 2.96Å; Q126-K128 VanDerWaalsContact C-N 3.35Å; Q126-K128 PolarHBondContact O-N 3.4Å; K128-E130 PolarHBondContact O-N 3.49Å; K128-Q131 PolarHBondContact O-N 2.92Å; K128-Q131 VanDerWaalsContact O-N 3.13Å; K128-E132 WeakPolarHBondContact O-CG 3.3Å; K128-E132 PolarHBondContact O-N 3.47Å
129E95.9Very high94.4Very high131 Ų13181.2 Ų81.261%0.61239%0.388SS*.Hα-helixtrans-59.2-46.1178.6-69.4178.2-176.300111.7D125 Q126 Q131 E132 A133D125-E129 WeakPolarHBondContact O-CG 3.31Å; D125-E129 PolarHBondContact O-N 3.39Å; Q126-E129 PolarHBondContact O-N 3.35Å; E129-Q131 VanDerWaalsContact C-N 3.3Å; E129-Q131 PolarHBondContact O-N 3.42Å; E129-E132 PolarHBondContact O-N 3.02Å; E129-A133 WeakPolarHBondContact O-CB 3.3Å; E129-A133 PolarHBondContact O-N 2.94Å
130E93.9Very high93.5Very high109 Ų10988.4 Ų88.451%0.50941%0.414SS..Hα-helixtrans-60.2-40.7175-77-175.1179.700111.8Q126 K128 A133 Q134Q126-E130 WeakPolarHBondContact O-CB 3.46Å; Q126-E130 WeakPolarHBondContact O-CG 3.48Å; Q126-E130 PolarHBondContact O-N 3.31Å; K128-E130 PolarHBondContact O-N 3.49Å; E130-A133 PolarHBondContact O-N 2.74Å; E130-Q134 WeakPolarHBondContact O-CB 3.46Å; E130-Q134 VanDerWaalsContact O-CG 3.25Å; E130-Q134 WeakPolarHBondContact O-CG 3.36Å; E130-Q134 PolarHBondContact O-N 3.06Å
131Q92.5Very high92.4Very high97 Ų9793 Ų9345%0.45344%0.439SS..Hα-helixtrans-67.1-38.8179.3-140.5-149.687.300111.9L127 K128 E129 Q134 R135L127-Q131 WeakPolarHBondContact O-CB 3.44Å; L127-Q131 PolarHBondContact O-N 3.25Å; K128-Q131 PolarHBondContact O-N 2.92Å; K128-Q131 VanDerWaalsContact O-N 3.13Å; E129-Q131 VanDerWaalsContact C-N 3.3Å; E129-Q131 PolarHBondContact O-N 3.42Å; Q131-Q134 PolarHBondContact O-N 3.5Å; Q131-R135 VanDerWaalsContact O-CG 3.27Å; Q131-R135 WeakPolarHBondContact O-CG 3.49Å; Q131-R135 PolarHBondContact O-N 3.5Å
132E93.9Very high90.9Very high123 Ų12395 Ų9558%0.57545%0.45SS*.Hα-helixtrans-65.4-44.8174.3-70.2-173.6174.800111.8K128 E129 Q134 R135 L136K128-E132 WeakPolarHBondContact O-CG 3.3Å; K128-E132 PolarHBondContact O-N 3.47Å; E129-E132 PolarHBondContact O-N 3.02Å; E132-Q134 VanDerWaalsContact C-N 3.29Å; E132-Q134 PolarHBondContact O-N 3.15Å; E132-R135 WeakPolarHBondContact O-CB 3.38Å; E132-R135 PolarHBondContact O-N 2.93Å; E132-R135 VanDerWaalsContact O-N 3.12Å; E132-L136 WeakPolarHBondContact O-CG 3.49Å; E132-L136 PolarHBondContact O-N 2.66Å
133A93.6Very high89.1Confident52 Ų5298 Ų9843%0.4346%0.462SS..Hα-helixtrans-59.6-40.4174.900000111.8E129 E130 L136 T137E129-A133 WeakPolarHBondContact O-CB 3.3Å; E129-A133 PolarHBondContact O-N 2.94Å; E130-A133 PolarHBondContact O-N 2.74Å; A133-L136 PolarHBondContact O-N 2.59Å; A133-T137 WeakPolarHBondContact O-CB 3.48Å; A133-T137 PolarHBondContact O-N 2.94Å; A133-T137 PolarHBondContact O-OG1 3.15Å
134Q91.8Very high87.2Confident95 Ų95106 Ų10644%0.44449%0.492SS..Hα-helixtrans-65.5-41.2174.2-75.8-178.128.200112.2E130 Q131 E132 T137 R138E130-Q134 WeakPolarHBondContact O-CB 3.46Å; E130-Q134 VanDerWaalsContact O-CG 3.25Å; E130-Q134 WeakPolarHBondContact O-CG 3.36Å; E130-Q134 PolarHBondContact O-N 3.06Å; Q131-Q134 PolarHBondContact O-N 3.5Å; E132-Q134 VanDerWaalsContact C-N 3.29Å; E132-Q134 PolarHBondContact O-N 3.15Å; Q134-T137 PolarHBondContact O-N 2.86Å; Q134-R138 WeakPolarHBondContact O-CB 3.47Å; Q134-R138 VanDerWaalsContact O-CG 3.24Å; Q134-R138 WeakPolarHBondContact O-CG 3.37Å; Q134-R138 PolarHBondContact O-N 3.23Å
135R91.9Very high85.3Confident157 Ų157108 Ų10859%0.59251%0.512SS*.Hα-helixtrans-60.6-47.1176-75.2171.9-177.6-168.20111.3Q131 E132 T137 R138 Q139Q131-R135 VanDerWaalsContact O-CG 3.27Å; Q131-R135 WeakPolarHBondContact O-CG 3.49Å; Q131-R135 PolarHBondContact O-N 3.5Å; E132-R135 WeakPolarHBondContact O-CB 3.38Å; E132-R135 PolarHBondContact O-N 2.93Å; E132-R135 VanDerWaalsContact O-N 3.12Å; R135-T137 PolarHBondContact O-N 3.2Å; R135-R138 PolarHBondContact O-N 3.1Å; R135-Q139 PolarHBondContact O-N 3.1Å
136L91.6Very high83.4Confident110 Ų110112.4 Ų112.458%0.57653%0.532SS*.Hα-helixtrans-62.1-43.6176.7-68.1173.5000111.6E132 A133 R138 Q139 W140E132-L136 WeakPolarHBondContact O-CG 3.49Å; E132-L136 PolarHBondContact O-N 2.66Å; A133-L136 PolarHBondContact O-N 2.59Å; L136-R138 PolarHBondContact O-N 3.29Å; L136-Q139 PolarHBondContact O-N 3.3Å; L136-W140 WeakPolarHBondContact O-CB 3.32Å; L136-W140 PolarHBondContact O-N 2.77Å
137T89.9Confident81.7Confident89 Ų89113.8 Ų113.855%0.54655%0.548SS..Hα-helixtrans-61.9-43.3177-60.60000111.4A133 Q134 R135 W140 N141A133-T137 WeakPolarHBondContact O-CB 3.48Å; A133-T137 PolarHBondContact O-N 2.94Å; A133-T137 PolarHBondContact O-OG1 3.15Å; Q134-T137 PolarHBondContact O-N 2.86Å; R135-T137 PolarHBondContact O-N 3.2Å; T137-W140 PolarHBondContact O-N 3.38Å; T137-N141 VanDerWaalsContact O-CB 3.29Å; T137-N141 WeakPolarHBondContact O-CB 3.44Å; T137-N141 PolarHBondContact O-N 2.94Å
138R88.8Confident80Confident167 Ų167117.9 Ų117.963%0.6357%0.568SS**Hα-helixtrans-64-40.2175.6-71.4173.1-169-151.26.5112Q134 R135 L136 N141 N142Q134-R138 WeakPolarHBondContact O-CB 3.47Å; Q134-R138 VanDerWaalsContact O-CG 3.24Å; Q134-R138 WeakPolarHBondContact O-CG 3.37Å; Q134-R138 PolarHBondContact O-N 3.23Å; R135-R138 PolarHBondContact O-N 3.1Å; L136-R138 PolarHBondContact O-N 3.29Å; R138-N141 PolarHBondContact O-N 2.96Å; R138-N142 VanDerWaalsContact O-CB 3.3Å; R138-N142 WeakPolarHBondContact O-CB 3.12Å; R138-N142 PolarHBondContact O-N 3.47Å
139Q86.9Confident78.2Confident108 Ų108120.1 Ų120.151%0.50559%0.585SS.*Hα-helixtrans-63.5-43.7175.6-170.2-174.69.400111.4R135 L136 K143R135-Q139 PolarHBondContact O-N 3.1Å; L136-Q139 PolarHBondContact O-N 3.3Å; Q139-K143 WeakPolarHBondContact O-CG 3.49Å; Q139-K143 PolarHBondContact O-N 3.38Å
140W78.9Confident76.4Confident159 Ų159120.5 Ų120.560%0.60259%0.585SS**Hα-helixtrans-67.5-37.1176.9-178.2-109000112.7L136 T137L136-W140 WeakPolarHBondContact O-CB 3.32Å; L136-W140 PolarHBondContact O-N 2.77Å; T137-W140 PolarHBondContact O-N 3.38Å
141N75.1Confident74.8Confident95 Ų95126.6 Ų126.651%0.50860%0.604SS.*Hα-helixtrans-74.6-37.7177.4-153.912.4000112T137 R138 K143 R144 A145T137-N141 VanDerWaalsContact O-CB 3.29Å; T137-N141 WeakPolarHBondContact O-CB 3.44Å; T137-N141 PolarHBondContact O-N 2.94Å; R138-N141 PolarHBondContact O-N 2.96Å; N141-K143 VanDerWaalsContact C-N 3.26Å; N141-K143 PolarHBondContact O-N 3.15Å; N141-R144 CarbonylContact O-C 3.53Å; N141-R144 PolarHBondContact O-N 3.02Å; N141-A145 WeakPolarHBondContact O-CB 3.48Å; N141-A145 PolarHBondContact O-N 3.35Å
142N67.1Low73.2Confident109 Ų109125.2 Ų125.258%0.58361%0.605SS**Hα-helixtrans-59.8-36.5174.5-100.6-27.6000112.4R138 R144 A145 M146R138-N142 VanDerWaalsContact O-CB 3.3Å; R138-N142 WeakPolarHBondContact O-CB 3.12Å; R138-N142 PolarHBondContact O-N 3.47Å; N142-R144 PolarHBondContact O-N 2.99Å; N142-A145 PolarHBondContact O-N 2.98Å; N142-M146 WeakPolarHBondContact O-CG 3.37Å; N142-M146 PolarHBondContact O-N 2.91Å
143K60.1Low71.7Confident144 Ų144129.2 Ų129.263%0.62662%0.62SS**Hα-helixtrans-65.7-24.1174.8-70.1176-179.7-178.20113.2Q139 N141Q139-K143 WeakPolarHBondContact O-CG 3.49Å; Q139-K143 PolarHBondContact O-N 3.38Å; N141-K143 VanDerWaalsContact C-N 3.26Å; N141-K143 PolarHBondContact O-N 3.15Å
144R58.7Low70.2Confident168 Ų168132.8 Ų132.863%0.63463%0.631SS**Hα-helixtrans-97.2-23.6177-70.9-170.1-76.3167.54113.6N141 N142 M146N141-R144 CarbonylContact O-C 3.53Å; N141-R144 PolarHBondContact O-N 3.02Å; N142-R144 PolarHBondContact O-N 2.99Å; R144-M146 VanDerWaalsContact C-N 3.33Å
145A57.3Low68.9Low63 Ų63136.9 Ų136.952%0.52165%0.647SS.*SBendtrans-87.64175.800000113.6N141 N142 S147N141-A145 WeakPolarHBondContact O-CB 3.48Å; N141-A145 PolarHBondContact O-N 3.35Å; N142-A145 PolarHBondContact O-N 2.98Å; A145-S147 PolarHBondContact O-N 3.2Å
146M57.4Low67.5Low162 Ų162136.1 Ų136.180%0.79865%0.653SS**  trans-73.463.7166.4-64.6-119.8107.600110.4N142 R144N142-M146 WeakPolarHBondContact O-CG 3.37Å; N142-M146 PolarHBondContact O-N 2.91Å; R144-M146 VanDerWaalsContact C-N 3.33Å
147S60.7Low65.8Low90 Ų90136.2 Ų136.263%0.62966%0.655SS**  trans-174.5124174.2-135.20000106.5A145A145-S147 PolarHBondContact O-N 3.2Å
148M58.1Low64.5Low123 Ų123137.1 Ų137.161%0.60666%0.662SS**  cis-155.5123.817.3-65.6-177.7-7200108.1F150M148-F150 HydrophobicContact CB-CB 4.17Å; M148-F150 HydrophobicContact CB-CD2 3.62Å; M148-F150 HydrophobicContact CB-CE2 4.34Å; M148-F150 HydrophobicContact CB-CG 4.02Å; M148-F150 HydrophobicContact CE-CD2 3.33Å; M148-F150 HydrophobicContact CE-CE2 3.22Å; M148-F150 HydrophobicContact CE-CZ 4.44Å; M148-F150 HydrophobicContact CG-CD2 3.97Å; M148-F150 HydrophobicContact CG-CE2 4.2Å; M148-F150 PolarHBondContact O-N 3.48Å; M148-F150 HydrophobicContact SD-CD2 3.28Å; M148-F150 WeakPolarHBondContact SD-CD2 3.46Å; M148-F150 HydrophobicContact SD-CE2 2.95Å; M148-F150 WeakPolarHBondContact SD-CE2 3.36Å; M148-F150 HydrophobicContact SD-CG 4.32Å; M148-F150 HydrophobicContact SD-CZ 3.75Å
149N57.4Low63.1Low171 Ų171138.7 Ų138.791%0.91467%0.673SS**  trans-72.171.8151.8-82.1-14.1000107.2R151N149-R151 PolarHBondContact O-N 2.6Å
150F59.8Low61.6Low139 Ų139136.3 Ų136.361%0.6168%0.678SS**  trans-70.981.9171.9-108.1-48.7000108.4M148 S152M148-F150 HydrophobicContact CB-CB 4.17Å; M148-F150 HydrophobicContact CB-CD2 3.62Å; M148-F150 HydrophobicContact CB-CE2 4.34Å; M148-F150 HydrophobicContact CB-CG 4.02Å; M148-F150 HydrophobicContact CE-CD2 3.33Å; M148-F150 HydrophobicContact CE-CE2 3.22Å; M148-F150 HydrophobicContact CE-CZ 4.44Å; M148-F150 HydrophobicContact CG-CD2 3.97Å; M148-F150 HydrophobicContact CG-CE2 4.2Å; M148-F150 PolarHBondContact O-N 3.48Å; M148-F150 HydrophobicContact SD-CD2 3.28Å; M148-F150 WeakPolarHBondContact SD-CD2 3.46Å; M148-F150 HydrophobicContact SD-CE2 2.95Å; M148-F150 WeakPolarHBondContact SD-CE2 3.36Å; M148-F150 HydrophobicContact SD-CG 4.32Å; M148-F150 HydrophobicContact SD-CZ 3.75Å; F150-S152 PolarHBondContact O-N 2.9Å
151R60.3Low60.5Low237 Ų237134.4 Ų134.489%0.89469%0.689SS**  trans-80.459.7151.6-66.8-167.9-173.9-107.55.3108N149 K153N149-R151 PolarHBondContact O-N 2.6Å; R151-K153 PolarHBondContact O-N 3.46Å
152S57.2Low59.3Low68 Ų68136 Ų13648%0.47670%0.703SS.*  trans-73.293.2171460000108.7F150 I154F150-S152 PolarHBondContact O-N 2.9Å; S152-I154 PolarHBondContact O-N 2.93Å
153K62.8Low58.4Low208 Ų208137.8 Ų137.890%0.90472%0.718SS**  trans-75.340159.4-71.3-172.1177.8179.70110.8R151 K155R151-K153 PolarHBondContact O-N 3.46Å; K153-K155 PolarHBondContact O-N 3.37Å
154I62.6Low58Low127 Ų127134.2 Ų134.265%0.65172%0.721SS**  trans-96.8100.3180-64.4170.1000106.6S152 I156S152-I154 PolarHBondContact O-N 2.93Å; I154-I156 HydrophobicContact CG2-CD1 4.32Å; I154-I156 HydrophobicContact CG2-CG1 3.63Å; I154-I156 PolarHBondContact O-N 2.96Å
155K64.6Low57.4Low180 Ų180134.3 Ų134.378%0.78373%0.733SS**  trans-76.994.7168.8-125.7178.173.4175.60107.2K153 N157K153-K155 PolarHBondContact O-N 3.37Å; K155-N157 PolarHBondContact O-N 2.84Å
156I61.6Low56.9Low141 Ų141138 Ų13872%0.72375%0.75SS**  trans-78.5108171.6-54.4-179.9000106.9I154 P158I154-I156 HydrophobicContact CG2-CD1 4.32Å; I154-I156 HydrophobicContact CG2-CG1 3.63Å; I154-I156 PolarHBondContact O-N 2.96Å; I156-P158 WeakPolarHBondContact O-CD 3.34Å
157N57Low55.9Low113 Ų113134.9 Ų134.960%0.60475%0.75SS**  trans-88.7111.6169-92.59.9000108.4K155 F159K155-N157 PolarHBondContact O-N 2.84Å; N157-F159 PolarHBondContact O-N 3.39Å; N157-F159 VanDerWaalsContact O-N 3.13Å
158P62.6Low54.6Low107 Ų107135.3 Ų135.370%0.69576%0.759SS**THydrogen-bonded Turntrans-77.35-172.830-33000114.7I156I156-P158 WeakPolarHBondContact O-CD 3.34Å
159F58.8Low53.9Low200 Ų200136.9 Ų136.988%0.87778%0.775SS**THydrogen-bonded Turntrans-136.618.6-178.8-73.4-74.7000114.9N157N157-F159 PolarHBondContact O-N 3.39Å; N157-F159 VanDerWaalsContact O-N 3.13Å
160G56Low52.9Low59 Ų59131.8 Ų131.861%0.60876%0.763SS**  trans-122.366.7-17200000114.8
161S54.7Low51.9Low118 Ų118133.1 Ų133.183%0.82578%0.776SS**  trans-158.678.1156.5-147.40000111.7
162T50.2Low51.4Low130 Ų130125.6 Ų125.680%0.79877%0.773SS**SBendtrans-149.467.5160.9150.40000105.7
163T49Very low50.5Low146 Ų146129.1 Ų129.190%0.89679%0.791SS**SBendtrans-162.545.8170.531.60000108.9
164G50.3Low49.5Very low68 Ų68122.5 Ų122.570%0.70178%0.783SS**SBendtrans-134.79177.400000114.4
165L46.4Very low48.8Very low170 Ų170125.1 Ų125.189%0.8980%0.797SS**SBendtrans-124.435.9-177.3-66.7178.5000112.9
166T46.4Very low48.2Very low140 Ų140121.5 Ų121.586%0.85980%0.795SS**SBendtrans-157.162.5163.548.90000111
167A36.8Very low47.7Very low98 Ų98120.8 Ų120.881%0.8179%0.792SS**SBendtrans-152.8117.5160.100000112
168A33.2Very low47.3Very low99 Ų99123.1 Ų123.182%0.81880%0.804SS**  trans71.399.5154.600000118.6G170A168-G170 PolarHBondContact O-N 3.4Å
169V43.7Very low46.8Very low156 Ų156126.2 Ų126.295%0.94581%0.806SS**  trans-25.3126.6136.4173.80000112.1
170G37.3Very low46.9Very low64 Ų64122.1 Ų122.166%0.6680%0.798SS**  trans170.187.6169.800000113.4A168A168-G170 PolarHBondContact O-N 3.4Å
171N38.5Very low46.9Very low166 Ų166126.6 Ų126.689%0.88881%0.813SS**  trans53.7116.8160.4-7210000119.6T173N171-T173 PolarHBondContact O-N 2.89Å
172G49.7Very low46.9Very low79 Ų79126.3 Ų126.381%0.81481%0.811SS**  trans-58.2131.3170.500000112.8
173T37.5Very low46.8Very low142 Ų142129 Ų12987%0.87182%0.815SS**  trans-149126.3147.9-530000106.1N171N171-T173 PolarHBondContact O-N 2.89Å
174G42.9Very low47Very low70 Ų70129.3 Ų129.372%0.72281%0.81SS**  trans-58.4135.6-161.700000114.8S176G174-S176 PolarHBondContact O-N 3.21Å
175L48.4Very low47.3Very low181 Ų181133.2 Ų133.295%0.94882%0.82SS**  trans-92.783.7161.7-133.9142.7000106.2
176S51.9Low47.6Very low105 Ų105134.3 Ų134.373%0.73482%0.821SS**  trans-116.2132.3174.852.40000110.8G174G174-S176 PolarHBondContact O-N 3.21Å
177D49.8Very low47.8Very low125 Ų125137.7 Ų137.767%0.66882%0.824SS**  trans96.670159-117.122.5000118.8K179D177-K179 IonicContact OD2-NZ 3.5Å
178L49Very low48Very low163 Ų163136.7 Ų136.785%0.85382%0.823SS**  trans-94.791.9144.4-83.8148.3000107.7T180L178-T180 PolarHBondContact O-N 2.89Å; L178-T180 VanDerWaalsContact O-N 3.1Å
179K52.3Low48.5Very low172 Ų172140.8 Ų140.875%0.74883%0.828SS**  trans-68.2101.6172.9-103.2172.4176.8135.10110.1D177D177-K179 IonicContact OD2-NZ 3.5Å
180T60.1Low48.6Very low113 Ų113142.3 Ų142.369%0.69382%0.824SS**  trans-81.5131.2165.644.80000109.1L178 S182L178-T180 PolarHBondContact O-N 2.89Å; L178-T180 VanDerWaalsContact O-N 3.1Å; T180-S182 PolarHBondContact O-N 3.07Å
181V56.3Low48.9Very low154 Ų154146.3 Ų146.393%0.93384%0.836SS**SBendtrans-74.665.3179-172.90000109.6
182S54Low49.2Very low111 Ų111142.2 Ų142.278%0.77683%0.834SS**  trans-134.312.1175-69.10000113.4T180T180-S182 PolarHBondContact O-N 3.07Å
183E49.7Very low48.6Very low188 Ų188145.9 Ų145.988%0.87983%0.834SS**  trans-111.653.6179.6-160.2-175.2163.600111
184D53.3Low49.2Very low151 Ų151148.7 Ų148.781%0.80783%0.829SS**  trans-15676.7160.9-15233000111
185V55.7Low49.4Very low150 Ų150150.9 Ų150.991%0.90983%0.833SS**  trans-150.836163.9124.90000110.8
186E52.9Low49.4Very low193 Ų193148.4 Ų148.490%0.90282%0.817SS**SBendtrans-137.352173.1-145-176173.100112.8
187K51.2Low49.6Very low211 Ų211154.7 Ų154.792%0.91782%0.824SS**SBendtrans-153.381.2159.1-147.2169.2-176.1176.30111.7
188G40.6Very low49.9Very low78 Ų78153.2 Ų153.280%0.80482%0.82SS**  trans-172.426.8178.700000114.7
189M43.2Very low49.8Very low184 Ų184157.1 Ų157.191%0.90682%0.824SS**  trans-92.6121.2155.5-80.8170.569.400105.6
190E46.6Very low50.6Low188 Ų188153.9 Ų153.988%0.87982%0.823SS**SBendtrans139.147.7164.8-66.7-104.8153.500112.2
191T42.7Very low50.7Low148 Ų148156.7 Ų156.791%0.90883%0.83SS**SBendtrans-163.3127.1140.3-14.30000109.5
192G46.2Very low51.1Low81 Ų81154 Ų15484%0.83582%0.816SS**  trans-72.1136.2-170.900000114.6
193D37.3Very low51.5Low155 Ų155156.2 Ų156.283%0.82982%0.819SS**  -168.5137.7114.9-162.53.7000108.9S195D193-S195 PolarHBondContact O-N 3.4Å
194R49.9Very low52.1Low202 Ų202156.2 Ų156.276%0.76282%0.816SS**  trans-87.688.5-165.7-179.2-179.4159.1177.4-5.2110.3Q196R194-Q196 HydrophobicContact CG-CG 4.46Å; R194-Q196 VanDerWaalsContact NE-OE1 3.17Å
195S45.8Very low52.8Low115 Ų115159.6 Ų159.680%0.80482%0.817SS**  trans-9885.6165.5-77.80000111.2D193 R197D193-S195 PolarHBondContact O-N 3.4Å; S195-R197 PolarHBondContact O-N 3.31Å; S195-R197 VanDerWaalsContact O-N 3.1Å
196Q48.2Very low52.9Low130 Ų130163.1 Ų163.161%0.60782%0.816SS**  trans-64.9102.6168.6-85-177.6-84.800109.9R194 V198R194-Q196 HydrophobicContact CG-CG 4.46Å; R194-Q196 VanDerWaalsContact NE-OE1 3.17Å; Q196-V198 VanDerWaalsContact C-N 3.35Å; Q196-V198 HydrophobicContact CB-CG2 4.3Å; Q196-V198 PolarHBondContact O-N 3.04Å; Q196-V198 VanDerWaalsContact O-N 3.1Å
197R57.4Low52.8Low236 Ų236163.6 Ų163.689%0.89182%0.815SS**  trans-76.588.4162.2-95.7-170.4-78.3-135.5-2.9109.3S195S195-R197 PolarHBondContact O-N 3.31Å; S195-R197 VanDerWaalsContact O-N 3.1Å
198V56.5Low53Low95 Ų95156.8 Ų156.858%0.57680%0.804SS**  trans-93114.3166.7177.10000107.6Q196 S200Q196-V198 VanDerWaalsContact C-N 3.35Å; Q196-V198 HydrophobicContact CB-CG2 4.3Å; Q196-V198 PolarHBondContact O-N 3.04Å; Q196-V198 VanDerWaalsContact O-N 3.1Å; V198-S200 PolarHBondContact O-N 3.31Å
199W46.8Very low53.1Low245 Ų245156.7 Ų156.793%0.92880%0.804SS**  trans-77.7100.5162-83.151.9000107.2
200S69.2Low53.5Low104 Ų104156.1 Ų156.173%0.72780%0.803SS**PPolyproline II helixtrans-74.1125.4174.2-51.80000109.6V198V198-S200 PolarHBondContact O-N 3.31Å
201M60.8Low53.5Low171 Ų171157.2 Ų157.284%0.84281%0.805SS**PPolyproline II helixtrans-64.3140.6165.3-85.9-177.559.100110.1D203M201-D203 PolarHBondContact O-N 3.22Å
202P65.5Low53.8Low98 Ų98153.4 Ų153.464%0.63680%0.796SS**PPolyproline II helixtrans-74.4124.2173.427.5-30.1000111F204P202-F204 HydrophobicContact CG-CE2 4.46Å; P202-F204 PolarHBondContact O-N 2.85Å
203D62.4Low53.8Low157 Ų157161.8 Ų161.884%0.8480%0.802SS**  trans-76110.3174.4-95.1-27.4000111M201 R205M201-D203 PolarHBondContact O-N 3.22Å; D203-R205 PolarHBondContact O-N 3.49Å
204F62.8Low54.1Low188 Ų188167.7 Ų167.783%0.82582%0.82SS**  trans-83.596.5165.1-73.9-83.9000109.6P202 Y206P202-F204 HydrophobicContact CG-CE2 4.46Å; P202-F204 PolarHBondContact O-N 2.85Å; F204-Y206 PolarHBondContact O-N 3.24Å
205R67.4Low54.3Low222 Ų222166 Ų16684%0.83882%0.823SS**  trans-75.7104.4169.3-74.1-156.2-93.3-142.7-3.5110.5D203 K207D203-R205 PolarHBondContact O-N 3.49Å; R205-K207 PolarHBondContact O-N 3.2Å
206Y57.2Low54.7Low224 Ų224168.6 Ų168.688%0.87882%0.824SS**  trans-65.7109.8161.1-114.9-96.6000109.1F204F204-Y206 PolarHBondContact O-N 3.24Å
207K51.8Low55.1Low204 Ų204170.8 Ų170.889%0.88784%0.836SS**  trans-99.882164-79.7-84.8-172.9174.50108R205R205-K207 PolarHBondContact O-N 3.2Å
208G54.9Low55Low67 Ų67166.9 Ų166.969%0.69183%0.833SS**  trans-124.5126.5161.600000108.4
209G42.9Very low54.9Low77 Ų77171.4 Ų171.479%0.79485%0.849SS**  trans151.995.8167.800000115.3
210L50.7Low55.4Low171 Ų171166.5 Ų166.590%0.89584%0.844SS**  trans-48.4153.7167.2-73.980.1000114.5
211K46.1Very low54.4Low212 Ų212171 Ų17192%0.92285%0.852SS**  trans-175.6128.7138.4-97.3162.7-174.3-1780105.9
212G50.7Low53.9Low68 Ų68171 Ų17170%0.70185%0.853SS**  cis100.7108.228.600000110
213R45.3Very low53Low256 Ų256177.1 Ų177.197%0.96687%0.871SS**  trans79.2139173.7-62.7176.9166.6164.7-3.9115.7
214K43.4Very low52.1Low279 Ų279178.9 Ų178.9100%1.21387%0.874SS**  cis-129.6021-94.9174.8172.4174.50111.4

Retrieved 214 of 214 residues in 217.6 ms (Link to these results)

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