A0A096LU99_POEFO Loading...

Paired box 7a

AlphaFold DB (A0A3Q2CW19), UniProt , Accession A0A096LU99, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 507 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
1M41.3Very low42.1Very low250 Ų250151.3 Ų151.3100%1.23287%0.869SS**  0161.40-75.9-178.8167.600108.7
2A38.3Very low42.1Very low99 Ų99149.7 Ų149.782%0.81886%0.863SS**  trans-104.4152.1-175.900000112.2
3T39.2Very low42.1Very low140 Ų140156.1 Ų156.186%0.85986%0.864SS**  trans-138.4130171.247.40000111.5
4L48.9Very low41.9Very low170 Ų170153.7 Ų153.789%0.8986%0.86SS**  trans-33.5152.3171.4-57.2172.4000115.7
5P49.9Very low41.8Very low132 Ų132149.3 Ų149.386%0.85785%0.85SS**  -134.1-177.161.237.5-20.4000114.1
6G37.2Very low42Very low70 Ų70148.8 Ų148.872%0.72285%0.854SS**  cis175153.5-5.400000111.6
7T42.5Very low41.6Very low137 Ų137143.6 Ų143.684%0.8484%0.841SS**  trans-53.5155.6-179.9-11.40000113.1
8V39Very low41.4Very low127 Ų127144.5 Ų144.577%0.7784%0.836SS**  cis-164.5-178.935.2-123.40000108.4
9P44.1Very low41.2Very low119 Ų119144.1 Ų144.177%0.77383%0.83SS**  cis-123.1-175.6-24.131.7-10.9000113M11P9-M11 PolarHBondContact O-N 3.19Å
10R43.7Very low40.9Very low237 Ų237147.9 Ų147.989%0.89483%0.832SS**  trans-83.5105.6-171.5-176.2-175.1-169.4170.22.6113.6
11M38.9Very low40.8Very low183 Ų183145.4 Ų145.490%0.90182%0.822SS**PPolyproline II helixtrans-74.9139165.1-75.9-174.771.400111.8P9P9-M11 PolarHBondContact O-N 3.19Å
12V42.3Very low40.7Very low132 Ų132144.3 Ų144.380%0.880%0.804SS**PPolyproline II helixtrans-81.5132.7177.9178.40000109.9
13R42.2Very low41Very low233 Ų233145.1 Ų145.188%0.87980%0.799SS**PPolyproline II helixtrans-71125.3178.7-168178.1-169.6171.73.8109.9A15R13-A15 PolarHBondContact O-N 2.7Å
14P38.8Very low40.9Very low123 Ų123140.9 Ų140.980%0.79978%0.783SS**PPolyproline II helixtrans-62134.8179.4-24.434.5000112.5
15A40.6Very low40.4Very low87 Ų87141.7 Ų141.772%0.71978%0.78SS**PPolyproline II helixtrans-93.4143.3168.400000110R13 G17R13-A15 PolarHBondContact O-N 2.7Å; A15-G17 PolarHBondContact O-N 2.97Å
16P44.8Very low40.1Very low141 Ų141140 Ų14092%0.91677%0.769SS**  trans-77.490.4179.531.1-34.3000111.6
17G36.3Very low40.4Very low61 Ų61144.3 Ų144.363%0.62978%0.775SS**  trans-115.2159.5158.300000110A15A15-G17 PolarHBondContact O-N 2.97Å
18Q37.3Very low40.5Very low160 Ų160144.8 Ų144.875%0.74877%0.767SS**  cis-153.7165.2-2.5-104.9-70-900108.5
19N37.1Very low40.6Very low136 Ų136143.7 Ų143.773%0.72776%0.761SS**  trans18.5110.2163.2-91.4-83.5000120.2
20Y35.2Very low40.3Very low221 Ų221142.7 Ų142.787%0.86776%0.757SS**  trans-99.1128.1140.3-88.1-85.3000108.7R22Y20-R22 PolarHBondContact O-N 2.87Å
21P39Very low40.5Very low96 Ų96135.1 Ų135.162%0.62374%0.737SS**  trans-69.3114.9177.227.9-33.1000110T23P21-T23 PolarHBondContact O-N 3.21Å
22R38.8Very low40.9Very low226 Ų226132.6 Ų132.685%0.85373%0.734SS**  trans-79.344.9-179.3-155.6-163.7-174.4-77.4-0.3112.9Y20 G24Y20-R22 PolarHBondContact O-N 2.87Å; R22-G24 PolarHBondContact O-N 3.39Å
23T45.9Very low41.4Very low116 Ų116131.1 Ų131.171%0.71272%0.721SS**  trans-77.257.317650.40000111.5P21P21-T23 PolarHBondContact O-N 3.21Å
24G36.8Very low42Very low51 Ų51124 Ų12453%0.52672%0.721SS.*  trans-105.199.6165.300000108.1R22R22-G24 PolarHBondContact O-N 3.39Å
25F37.9Very low43.5Very low187 Ų187123.2 Ų123.282%0.8271%0.706SS**  trans-49141.8-171.2-66.7-96.2000112.8L27F25-L27 PolarHBondContact O-N 2.9Å
26P44.7Very low45.2Very low97 Ų97120.8 Ų120.863%0.6369%0.69SS**  trans-55.8132.5152.5-10.825.8000107.2E28P26-E28 PolarHBondContact O-N 3.45Å
27L41.9Very low47.2Very low161 Ų161121.5 Ų121.584%0.84367%0.674SS**  trans-73.880.5167-152.584000107.4F25 V29F25-L27 PolarHBondContact O-N 2.9Å; L27-V29 HydrophobicContact CD2-CG2 4.4Å; L27-V29 PolarHBondContact O-N 3.01Å
28E45Very low49.8Very low146 Ų146123.4 Ų123.468%0.68267%0.673SS**  trans-59.191.5166.5-80.1-63.1123.300107.4P26 S30P26-E28 PolarHBondContact O-N 3.45Å; E28-S30 PolarHBondContact O-N 2.72Å; E28-S30 PolarHBondContact O-OG 2.94Å
29V41.3Very low52.3Low105 Ų105117.6 Ų117.664%0.63665%0.647SS**  trans-68.387.7163.4171.30000105.5L27 T31L27-V29 HydrophobicContact CD2-CG2 4.4Å; L27-V29 PolarHBondContact O-N 3.01Å; V29-T31 HydrophobicContact CG1-CG2 4.39Å; V29-T31 PolarHBondContact O-N 3.48Å
30S37.3Very low54.9Low98 Ų98121 Ų12169%0.68566%0.659SS**  trans-67.563179.8-62.10000111.7E28E28-S30 PolarHBondContact O-N 2.72Å; E28-S30 PolarHBondContact O-OG 2.94Å
31T49.3Very low57.5Low77 Ų77113.7 Ų113.747%0.47264%0.635SS.*  trans-56.6127152.449.10000107V29 L33V29-T31 HydrophobicContact CG1-CG2 4.39Å; V29-T31 PolarHBondContact O-N 3.48Å; T31-L33 CarbonylContact O-C 3.54Å; T31-L33 PolarHBondContact O-N 2.7Å
32P47.4Very low59.8Low131 Ų131110.6 Ų110.685%0.85162%0.62SS**SBendtrans-66.72.8-160.421.9-33.8000116.5
33L52.5Low62.3Low100 Ų100100.2 Ų100.252%0.52458%0.583SS.*SBendtrans-121.1117.5160.7-86.274.8000108.8T31 Q35T31-L33 CarbonylContact O-C 3.54Å; T31-L33 PolarHBondContact O-N 2.7Å; L33-Q35 HydrophobicContact CB-CG 4.47Å; L33-Q35 PolarHBondContact O-N 2.97Å
34G54.2Low64.5Low85 Ų8599.7 Ų99.788%0.87658%0.58SS**SBendtrans-69.247.8177.400000115.2
35Q69.3Low67.2Low105 Ų105100.4 Ų100.449%0.49157%0.569SS.*  trans-105.30.5-179.7-65-173.7-1700113.3L33 R37 I46L33-Q35 HydrophobicContact CB-CG 4.47Å; L33-Q35 PolarHBondContact O-N 2.97Å; Q35-R37 PolarHBondContact O-N 3.1Å; Q35-I46 HydrophobicContact CB-CG2 4.22Å
36G77.1Confident69.6Low36 Ų3694.4 Ų94.437%0.37154%0.544SS..EExtended strand (participates in β ladder)trans-68.6117.8173.800000111.1
37R85.8Confident71.6Confident157 Ų15794.3 Ų94.359%0.59254%0.538SS*.EExtended strand (participates in β ladder)trans-101148.7170.3-63.4-169.8-176.8-162.7-1.9109.7Q35 V44 F45Q35-R37 PolarHBondContact O-N 3.1Å; R37-V44 CarbonylContact O-C 3.36Å; R37-V44 WeakPolarHBondContact O-CA 3.24Å; R37-F45 HydrophobicContact CB-CD1 4.4Å; R37-F45 HydrophobicContact CB-CE1 3.83Å; R37-F45 HydrophobicContact CB-CZ 3.91Å; R37-F45 PolarHBondContact N-O 3.04Å; R37-F45 WeakPolarHBondContact O-CD1 3.3Å; R37-F45 WeakPolarHBondContact O-CE1 3.27Å; R37-F45 PolarHBondContact O-N 3.28Å
38V91.2Very high73.7Confident101 Ų10190 Ų9061%0.61253%0.533SS*.EExtended strand (participates in β ladder)trans-93138.3173.7-172.70000109.3
39N91Very high75.8Confident37 Ų3790.2 Ų90.220%0.19853%0.527CS..PPolyproline II helixtrans-93.2173.5175.570.937.1000112L41 G42 G43 F45 R77N39-L41 PolarHBondContact O-N 2.7Å; N39-L41 WeakPolarHBondContact OD1-CA 3.42Å; N39-L41 WeakPolarHBondContact OD1-CB 3.31Å; N39-L41 PolarHBondContact OD1-N 3.45Å; N39-G42 PolarHBondContact O-N 2.91Å; N39-G42 PolarHBondContact OD1-N 3.06Å; N39-G43 PolarHBondContact N-O 3.4Å; N39-G43 PolarHBondContact ND2-O 2.59Å; N39-G43 PolarHBondContact OD1-N 3.13Å; N39-G43 VanDerWaalsContact OD1-N 3.08Å; N39-F45 HydrophobicContact CB-CD1 3.93Å; N39-F45 HydrophobicContact CB-CE1 3.78Å; N39-R77 PolarHBondContact ND2-O 3.47Å; N39-R77 PolarHBondContact OD1-O 2.87Å
40Q91.3Very high78.2Confident207 Ų20788 Ų8897%0.96752%0.515SS*.THydrogen-bonded Turntrans-60.4-13.9-179.9-70.4174-28.700115.1
41L89.1Confident80.9Confident69 Ų6984.9 Ų84.936%0.36149%0.491SS..THydrogen-bonded Turntrans-97.55.5175.5-57.2171.5000112.2N39 R77 V78N39-L41 PolarHBondContact O-N 2.7Å; N39-L41 WeakPolarHBondContact OD1-CA 3.42Å; N39-L41 WeakPolarHBondContact OD1-CB 3.31Å; N39-L41 PolarHBondContact OD1-N 3.45Å; L41-R77 HydrophobicContact CB-CB 4.15Å; L41-R77 WeakPolarHBondContact O-CB 3.5Å; L41-R77 WeakPolarHBondContact O-CD 3.43Å; L41-R77 VanDerWaalsContact O-CG 3.24Å; L41-R77 WeakPolarHBondContact O-CG 3.45Å; L41-V78 WeakPolarHBondContact CD1-O 3.48Å
42G88.8Confident83Confident30 Ų3084.2 Ų84.231%0.30949%0.487SS..SBendtrans75.120.5-176.800000114.2N39 R77N39-G42 PolarHBondContact O-N 2.91Å; N39-G42 PolarHBondContact OD1-N 3.06Å; G42-R77 VanDerWaalsContact O-CD 3.27Å; G42-R77 WeakPolarHBondContact O-CD 3.5Å; G42-R77 PolarHBondContact O-NH1 3.15Å
43G90.8Very high85.2Confident9 Ų981.9 Ų81.99%0.09347%0.468CS..  trans-100.6137.8179.400000112.8N39N39-G43 PolarHBondContact N-O 3.4Å; N39-G43 PolarHBondContact ND2-O 2.59Å; N39-G43 PolarHBondContact OD1-N 3.13Å; N39-G43 VanDerWaalsContact OD1-N 3.08Å
44V92.2Very high87.2Confident104 Ų10483.2 Ų83.263%0.6347%0.471SS*.EExtended strand (participates in β ladder)trans-81.6137-178.8-1740000111R37R37-V44 CarbonylContact O-C 3.36Å; R37-V44 WeakPolarHBondContact O-CA 3.24Å
45F92.1Very high89.2Confident67 Ų6781.1 Ų81.129%0.29444%0.439SS..EExtended strand (participates in β ladder)trans-149.3153.1175.373.1-76.6000111.5R37 N39R37-F45 HydrophobicContact CB-CD1 4.4Å; R37-F45 HydrophobicContact CB-CE1 3.83Å; R37-F45 HydrophobicContact CB-CZ 3.91Å; R37-F45 PolarHBondContact N-O 3.04Å; R37-F45 WeakPolarHBondContact O-CD1 3.3Å; R37-F45 WeakPolarHBondContact O-CE1 3.27Å; R37-F45 PolarHBondContact O-N 3.28Å; N39-F45 HydrophobicContact CB-CD1 3.93Å; N39-F45 HydrophobicContact CB-CE1 3.78Å
46I90.3Very high90.5Very high60 Ų6077 Ų7731%0.30842%0.42SS..EExtended strand (participates in β ladder)trans-104.9128.3174.4-57.3171.1000108.6Q35 R49Q35-I46 HydrophobicContact CB-CG2 4.22Å; I46-R49 HydrophobicContact CB-CB 4.16Å; I46-R49 HydrophobicContact CB-CG 4.37Å; I46-R49 HydrophobicContact CG2-CB 4.21Å; I46-R49 HydrophobicContact CG2-CG 3.89Å; I46-R49 PolarHBondContact O-N 2.92Å
47N86.1Confident91.4Very high95 Ų9580 Ų8051%0.50842%0.424SS..THydrogen-bonded Turntrans-62137.8179.6-102.7-36.4000111.6R49N47-R49 PolarHBondContact O-N 3.5Å
48G84.9Confident92Very high70 Ų7076.4 Ų76.472%0.72241%0.412SS*.THydrogen-bonded Turntrans74.8-19.6179.800000115.8
49R89.4Confident92.2Very high151 Ų15171.6 Ų71.657%0.5738%0.383SS*.SBendtrans-86.7153.2175.7-64.3-165.1-175.5-153.40111.5I46 N47I46-R49 HydrophobicContact CB-CB 4.16Å; I46-R49 HydrophobicContact CB-CG 4.37Å; I46-R49 HydrophobicContact CG2-CB 4.21Å; I46-R49 HydrophobicContact CG2-CG 3.89Å; I46-R49 PolarHBondContact O-N 2.92Å; N47-R49 PolarHBondContact O-N 3.5Å
50P92.8Very high92.5Very high60 Ų6070.3 Ų70.339%0.3938%0.376SS..PPolyproline II helixtrans-70.6152.9172.430.7-33.3000110.8P98 I101P50-P98 HydrophobicContact CB-CB 3.78Å; P50-P98 HydrophobicContact CB-CG 4.25Å; P50-P98 HydrophobicContact CG-CB 4.16Å; P50-P98 HydrophobicContact CG-CG 4.21Å; P50-I101 HydrophobicContact CB-CD1 4.06Å; P50-I101 HydrophobicContact CG-CD1 4.04Å
51L93.3Very high92.8Very high32 Ų3264.2 Ų64.217%0.16835%0.348CS..PPolyproline II helixtrans-57.2142.5172.9-166.469000110.7I55 R56 I59 V78 I86L51-I55 HydrophobicContact CD2-CB 4.13Å; L51-I55 HydrophobicContact CD2-CG2 3.64Å; L51-I55 HydrophobicContact CG-CB 4.13Å; L51-I55 HydrophobicContact CG-CG2 4.08Å; L51-R56 HydrophobicContact CB-CG 4.19Å; L51-R56 HydrophobicContact CD2-CG 4.36Å; L51-R56 WeakPolarHBondContact O-CD 3.47Å; L51-I59 HydrophobicContact CD2-CD1 3.82Å; L51-V78 HydrophobicContact CD1-CG2 4.39Å; L51-V78 HydrophobicContact CD2-CG1 3.92Å; L51-V78 HydrophobicContact CD2-CG2 3.99Å; L51-I86 HydrophobicContact CD2-CD1 3.81Å
52P93.9Very high93.2Very high62 Ų6261.3 Ų61.340%0.40333%0.333SS..PPolyproline II helixtrans-54.4144.6-179.1-28.536.1000113.6H54 I55 R56P52-H54 PolarHBondContact O-N 3.25Å; P52-I55 HydrophobicContact CB-CG1 4.29Å; P52-I55 PolarHBondContact O-N 3.39Å; P52-I55 VanDerWaalsContact O-N 3.15Å; P52-R56 WeakPolarHBondContact O-CG 3.5Å; P52-R56 PolarHBondContact O-N 3.35Å
53N93.9Very high93.6Very high82 Ų8261.4 Ų61.444%0.43933%0.331SS..Hα-helixtrans-59.9-42.7-170.8180-75.9000112.6I55 R56 H57N53-I55 PolarHBondContact O-N 3.37Å; N53-R56 WeakPolarHBondContact O-CA 3.21Å; N53-R56 WeakPolarHBondContact O-CB 3.37Å; N53-R56 PolarHBondContact O-N 2.73Å; N53-H57 PolarHBondContact O-CD2 3.48Å; N53-H57 PolarHBondContact O-N 2.69Å; N53-H57 PolarHBondContact OD1-CD2 3.41Å; N53-H57 PolarHBondContact OD1-NE2 3.43Å
54H94.8Very high93.8Very high128 Ų12867.4 Ų67.459%0.59336%0.356SS*.Hα-helixtrans-60.1-38.4176.557.8-101.7000113.4P52 R56 H57 K58P52-H54 PolarHBondContact O-N 3.25Å; H54-R56 VanDerWaalsContact C-N 3.29Å; H54-R56 PolarHBondContact O-N 3.01Å; H54-H57 PolarHBondContact O-N 3.01Å; H54-K58 PolarHBondContact O-N 3.02Å
55I95.6Very high94Very high41 Ų4169 Ų6921%0.2136%0.357CS..Hα-helixtrans-67.1-34.3174.6-52.3-63.8000110.7L51 P52 N53 K58 I59 L76 V78L51-I55 HydrophobicContact CD2-CB 4.13Å; L51-I55 HydrophobicContact CD2-CG2 3.64Å; L51-I55 HydrophobicContact CG-CB 4.13Å; L51-I55 HydrophobicContact CG-CG2 4.08Å; P52-I55 HydrophobicContact CB-CG1 4.29Å; P52-I55 PolarHBondContact O-N 3.39Å; P52-I55 VanDerWaalsContact O-N 3.15Å; N53-I55 PolarHBondContact O-N 3.37Å; I55-K58 PolarHBondContact O-N 3.27Å; I55-I59 HydrophobicContact CG2-CD1 4.17Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.48Å; I55-I59 PolarHBondContact O-N 2.93Å; I55-L76 HydrophobicContact CG2-CD1 4.41Å; I55-V78 HydrophobicContact CG2-CG2 3.65Å
56R96.5Very high94.1Very high20 Ų2068.7 Ų68.78%0.07537%0.372CS..Hα-helixtrans-70.2-38.2178.1-62.9170.262.7116.38.5112.1L51 P52 N53 H54 V60 I86 I96 R97L51-R56 HydrophobicContact CB-CG 4.19Å; L51-R56 HydrophobicContact CD2-CG 4.36Å; L51-R56 WeakPolarHBondContact O-CD 3.47Å; P52-R56 WeakPolarHBondContact O-CG 3.5Å; P52-R56 PolarHBondContact O-N 3.35Å; N53-R56 WeakPolarHBondContact O-CA 3.21Å; N53-R56 WeakPolarHBondContact O-CB 3.37Å; N53-R56 PolarHBondContact O-N 2.73Å; H54-R56 VanDerWaalsContact C-N 3.29Å; H54-R56 PolarHBondContact O-N 3.01Å; R56-V60 PolarHBondContact O-N 2.93Å; R56-I86 HydrophobicContact CG-CD1 4.06Å; R56-I96 PolarHBondContact NE-O 2.79Å; R56-I96 PolarHBondContact NH2-O 2.71Å; R56-R97 VanDerWaalsContact NH2-C 3.25Å; R56-R97 PolarHBondContact NH2-O 3.09Å; R56-R97 VanDerWaalsContact NH2-O 3.16Å
57H96.3Very high94.5Very high99 Ų9968.4 Ų68.446%0.45837%0.37SS..Hα-helixtrans-57.3-54.9165.2-83.9-92.2000110.3N53 H54 I59 V60 E61 I96N53-H57 PolarHBondContact O-CD2 3.48Å; N53-H57 PolarHBondContact O-N 2.69Å; N53-H57 PolarHBondContact OD1-CD2 3.41Å; N53-H57 PolarHBondContact OD1-NE2 3.43Å; H54-H57 PolarHBondContact O-N 3.01Å; H57-I59 VanDerWaalsContact C-N 3.26Å; H57-I59 PolarHBondContact O-N 3.2Å; H57-V60 PolarHBondContact O-N 2.98Å; H57-E61 WeakPolarHBondContact O-CB 3.36Å; H57-E61 PolarHBondContact O-N 2.85Å; H57-I96 WeakPolarHBondContact CE1-CD1 3.27Å; H57-I96 WeakPolarHBondContact NE2-CD1 3.36Å
58K97.1Very high94.9Very high81 Ų8172.6 Ų72.635%0.35238%0.379SS..Hα-helixtrans-60.4-33.8-174.2-159.455158-176.60113.4H54 I55 E61 M62 L76H54-K58 PolarHBondContact O-N 3.02Å; I55-K58 PolarHBondContact O-N 3.27Å; K58-E61 WeakPolarHBondContact CD-OE2 3.36Å; K58-E61 IonicContact NZ-OE1 2.89Å; K58-E61 PolarHBondContact NZ-OE1 2.84Å; K58-E61 IonicContact NZ-OE2 2.66Å; K58-E61 PolarHBondContact NZ-OE2 3.5Å; K58-M62 HydrophobicContact CD-CG 4.36Å; K58-M62 HydrophobicContact CG-CG 4.34Å; K58-M62 HydrophobicContact CG-SD 4.13Å; K58-M62 VanDerWaalsContact O-CB 3.29Å; K58-M62 WeakPolarHBondContact O-CB 3.26Å; K58-M62 WeakPolarHBondContact O-CG 3.48Å; K58-M62 PolarHBondContact O-N 2.87Å; K58-L76 HydrophobicContact CB-CD1 4.06Å; K58-L76 HydrophobicContact CB-CD2 4.36Å; K58-L76 HydrophobicContact CG-CD1 4.12Å; K58-L76 HydrophobicContact CG-CD2 3.76Å
59I97.2Very high95.4Very high0 Ų071.8 Ų71.80%036%0.361CS..Hα-helixtrans-59.6-45.4171.8-75.6165.8000112L51 I55 H57 A63 I72 L76 V78 V83 I86 L87L51-I59 HydrophobicContact CD2-CD1 3.82Å; I55-I59 HydrophobicContact CG2-CD1 4.17Å; I55-I59 VanDerWaalsContact O-CG1 3.3Å; I55-I59 WeakPolarHBondContact O-CG1 3.48Å; I55-I59 PolarHBondContact O-N 2.93Å; H57-I59 VanDerWaalsContact C-N 3.26Å; H57-I59 PolarHBondContact O-N 3.2Å; I59-A63 PolarHBondContact O-N 3.46Å; I59-I72 HydrophobicContact CB-CG2 4.34Å; I59-I72 HydrophobicContact CG1-CG2 3.93Å; I59-I72 HydrophobicContact CG2-CG2 4.48Å; I59-L76 HydrophobicContact CB-CD1 4.49Å; I59-L76 HydrophobicContact CG1-CD1 3.58Å; I59-V78 HydrophobicContact CD1-CG1 4.23Å; I59-V78 HydrophobicContact CD1-CG2 4.43Å; I59-V83 HydrophobicContact CD1-CG2 4.25Å; I59-V83 HydrophobicContact CG1-CG2 4.45Å; I59-V83 HydrophobicContact CG2-CG1 4.04Å; I59-I86 HydrophobicContact CB-CG2 4.38Å; I59-I86 HydrophobicContact CD1-CD1 3.57Å; I59-I86 HydrophobicContact CG2-CB 4.18Å; I59-I86 HydrophobicContact CG2-CG2 3.81Å; I59-L87 HydrophobicContact CG2-CD2 3.76Å; I59-L87 HydrophobicContact CG2-CG 3.88Å
60V96.8Very high95.7Very high9 Ų966.6 Ų66.66%0.05535%0.347CS..Hα-helixtrans-74.4-44.7-179.61700000111.1R56 H57 M62 A63 H64 I86 L87 Y90 I96R56-V60 PolarHBondContact O-N 2.93Å; H57-V60 PolarHBondContact O-N 2.98Å; V60-M62 PolarHBondContact O-N 3.22Å; V60-A63 PolarHBondContact O-N 3.01Å; V60-A63 VanDerWaalsContact O-N 3.07Å; V60-H64 PolarHBondContact O-CD2 2.77Å; V60-H64 PolarHBondContact O-N 3.41Å; V60-I86 HydrophobicContact CG2-CG2 4.31Å; V60-L87 HydrophobicContact CG2-CD2 4.18Å; V60-Y90 HydrophobicContact CG1-CD1 3.7Å; V60-Y90 HydrophobicContact CG1-CD2 4.05Å; V60-Y90 HydrophobicContact CG1-CE1 3.45Å; V60-Y90 VanDerWaalsContact CG1-CE1 3.45Å; V60-Y90 HydrophobicContact CG1-CE2 3.83Å; V60-Y90 HydrophobicContact CG1-CG 4Å; V60-Y90 HydrophobicContact CG2-CD1 4.15Å; V60-Y90 HydrophobicContact CG2-CD2 4.01Å; V60-Y90 HydrophobicContact CG2-CG 3.79Å; V60-I96 HydrophobicContact CB-CG2 4.47Å; V60-I96 HydrophobicContact CG2-CG2 3.99Å
61E97Very high95.9Very high80 Ų8066.1 Ų66.137%0.37434%0.343SS..Hα-helixtrans-54.3-50.2176.4-170.1-145.9116.400111.2H57 K58 A63 H64 H65H57-E61 WeakPolarHBondContact O-CB 3.36Å; H57-E61 PolarHBondContact O-N 2.85Å; K58-E61 WeakPolarHBondContact CD-OE2 3.36Å; K58-E61 IonicContact NZ-OE1 2.89Å; K58-E61 PolarHBondContact NZ-OE1 2.84Å; K58-E61 IonicContact NZ-OE2 2.66Å; K58-E61 PolarHBondContact NZ-OE2 3.5Å; E61-A63 VanDerWaalsContact C-N 3.3Å; E61-A63 PolarHBondContact O-N 3.23Å; E61-H64 PolarHBondContact O-N 3.33Å; E61-H65 PolarHBondContact O-N 2.79Å; E61-H65 VanDerWaalsContact O-N 3.15Å; E61-H65 PolarHBondContact O-ND1 3.01Å
62M97.3Very high96.1Very high7 Ų764.6 Ų64.63%0.03434%0.335CS..Hα-helixtrans-63.1-35.2177-71.4177.274.100112.7K58 V60 H65 I67 I72 Q75 L76K58-M62 HydrophobicContact CD-CG 4.36Å; K58-M62 HydrophobicContact CG-CG 4.34Å; K58-M62 HydrophobicContact CG-SD 4.13Å; K58-M62 VanDerWaalsContact O-CB 3.29Å; K58-M62 WeakPolarHBondContact O-CB 3.26Å; K58-M62 WeakPolarHBondContact O-CG 3.48Å; K58-M62 PolarHBondContact O-N 2.87Å; V60-M62 PolarHBondContact O-N 3.22Å; M62-H65 CarbonylContact O-C 3.55Å; M62-H65 PolarHBondContact O-N 2.75Å; M62-I67 HydrophobicContact CB-CB 4.28Å; M62-I67 HydrophobicContact CB-CD1 4Å; M62-I67 HydrophobicContact CE-CD1 3.85Å; M62-I67 HydrophobicContact CE-CG2 4.09Å; M62-I67 HydrophobicContact CG-CD1 4.13Å; M62-I67 WeakPolarHBondContact O-CB 3.42Å; M62-I67 WeakPolarHBondContact O-CG1 3.35Å; M62-I67 PolarHBondContact O-N 2.75Å; M62-I72 HydrophobicContact CB-CD1 3.83Å; M62-I72 HydrophobicContact CB-CG1 3.85Å; M62-I72 HydrophobicContact CE-CB 4.44Å; M62-I72 HydrophobicContact CE-CG1 4.08Å; M62-I72 HydrophobicContact SD-CG1 4.46Å; M62-I72 HydrophobicContact SD-CG2 4.22Å; M62-Q75 HydrophobicContact CE-CB 4.16Å; M62-Q75 HydrophobicContact CE-CG 4.18Å; M62-L76 HydrophobicContact SD-CD1 3.84Å; M62-L76 HydrophobicContact SD-CD2 3.98Å; M62-L76 HydrophobicContact SD-CG 3.87Å
63A96.7Very high96.3Very high33 Ų3362 Ų6227%0.27332%0.319SS..Hα-helixtrans-70.7-34177.100000112.6I59 V60 E61 H65 G66 I72 L87I59-A63 PolarHBondContact O-N 3.46Å; V60-A63 PolarHBondContact O-N 3.01Å; V60-A63 VanDerWaalsContact O-N 3.07Å; E61-A63 VanDerWaalsContact C-N 3.3Å; E61-A63 PolarHBondContact O-N 3.23Å; A63-H65 VanDerWaalsContact C-N 3.31Å; A63-G66 PolarHBondContact O-N 3.11Å; A63-I72 HydrophobicContact CB-CD1 3.95Å; A63-L87 HydrophobicContact CB-CD1 4.07Å; A63-L87 HydrophobicContact CB-CD2 3.48Å; A63-L87 VanDerWaalsContact CB-CD2 3.48Å; A63-L87 HydrophobicContact CB-CG 4.44Å
64H95.6Very high96.4Very high134 Ų13465.2 Ų65.262%0.6233%0.325SS*.Hα-helixtrans-63.5-36.1170.3-91.4-99.2000112.2V60 E61 G66 Y90V60-H64 PolarHBondContact O-CD2 2.77Å; V60-H64 PolarHBondContact O-N 3.41Å; E61-H64 PolarHBondContact O-N 3.33Å; H64-G66 PolarHBondContact O-N 3.43Å; H64-Y90 AromaticContact NE2-CE1 3.5Å; H64-Y90 WeakPolarHBondContact NE2-CE1 3.42Å
65H97Very high96.5Very high139 Ų13965.3 Ų65.364%0.64433%0.326SS*.THydrogen-bonded Turntrans-74.819.1170.4-65.483.4000113.5E61 M62 A63 I67E61-H65 PolarHBondContact O-N 2.79Å; E61-H65 VanDerWaalsContact O-N 3.15Å; E61-H65 PolarHBondContact O-ND1 3.01Å; M62-H65 CarbonylContact O-C 3.55Å; M62-H65 PolarHBondContact O-N 2.75Å; A63-H65 VanDerWaalsContact C-N 3.31Å; H65-I67 HydrophobicContact CB-CD1 4.46Å; H65-I67 HydrophobicContact CB-CG1 4.32Å; H65-I67 PolarHBondContact O-N 3.25Å; H65-I67 VanDerWaalsContact O-N 3.15Å
66G94.8Very high96.5Very high60 Ų6065.1 Ų65.162%0.61933%0.325SS*.THydrogen-bonded Turntrans69.95.1177.700000115.7A63 H64 R68A63-G66 PolarHBondContact O-N 3.11Å; H64-G66 PolarHBondContact O-N 3.43Å; G66-R68 PolarHBondContact O-N 3.4Å
67I96.9Very high96.5Very high53 Ų5370.8 Ų70.827%0.27235%0.346SS..  trans-71123.2-173.5-54.2177.7000110M62 H65 V71 I72M62-I67 HydrophobicContact CB-CB 4.28Å; M62-I67 HydrophobicContact CB-CD1 4Å; M62-I67 HydrophobicContact CE-CD1 3.85Å; M62-I67 HydrophobicContact CE-CG2 4.09Å; M62-I67 HydrophobicContact CG-CD1 4.13Å; M62-I67 WeakPolarHBondContact O-CB 3.42Å; M62-I67 WeakPolarHBondContact O-CG1 3.35Å; M62-I67 PolarHBondContact O-N 2.75Å; H65-I67 HydrophobicContact CB-CD1 4.46Å; H65-I67 HydrophobicContact CB-CG1 4.32Å; H65-I67 PolarHBondContact O-N 3.25Å; H65-I67 VanDerWaalsContact O-N 3.15Å; I67-V71 HydrophobicContact CG2-CB 3.74Å; I67-V71 HydrophobicContact CG2-CG1 3.68Å; I67-I72 HydrophobicContact CB-CG1 4.19Å; I67-I72 HydrophobicContact CG2-CG1 3.9Å; I67-I72 VanDerWaalsContact O-CD1 3.29Å; I67-I72 WeakPolarHBondContact O-CD1 3.48Å
68R95.8Very high96.5Very high183 Ų18366.5 Ų66.569%0.69133%0.327SS*.  trans-58.9137.5-176.1-62.9173.970.5-170.94.4111.2G66 C70 V71 I72G66-R68 PolarHBondContact O-N 3.4Å; R68-C70 PolarHBondContact O-N 3.18Å; R68-V71 HydrophobicContact CB-CG2 4.37Å; R68-V71 WeakPolarHBondContact O-CA 3.41Å; R68-V71 WeakPolarHBondContact O-CB 3.06Å; R68-V71 PolarHBondContact O-N 3.13Å; R68-I72 PolarHBondContact O-N 2.97Å
69P95Very high96.4Very high54 Ų5465.7 Ų65.735%0.35133%0.331SS..Hα-helixtrans-54.5-27.6-176.7-30.836.2000116.1S73 V83 L87P69-S73 VanDerWaalsContact O-CB 3.29Å; P69-S73 WeakPolarHBondContact O-CB 3.48Å; P69-S73 PolarHBondContact O-N 3.37Å; P69-V83 HydrophobicContact CB-CG1 4.15Å; P69-L87 HydrophobicContact CB-CD1 4.3Å; P69-L87 HydrophobicContact CG-CD1 3.93Å
70C96Very high96.4Very high41 Ų4170.4 Ų70.428%0.27735%0.353SS..Hα-helixtrans-72.9-26174.862.90000113.7R68 R74R68-C70 PolarHBondContact O-N 3.18Å; C70-R74 VanDerWaalsContact O-CZ 3.25Å; C70-R74 PolarHBondContact O-N 3.19Å; C70-R74 PolarHBondContact O-NE 3.16Å; C70-R74 PolarHBondContact O-NH1 3.01Å
71V97Very high96.4Very high50 Ų5072.3 Ų72.330%0.30338%0.375SS..Hα-helixtrans-77.6-47.7172.1179.70000109.7I67 R68 S73 R74 Q75I67-V71 HydrophobicContact CG2-CB 3.74Å; I67-V71 HydrophobicContact CG2-CG1 3.68Å; R68-V71 HydrophobicContact CB-CG2 4.37Å; R68-V71 WeakPolarHBondContact O-CA 3.41Å; R68-V71 WeakPolarHBondContact O-CB 3.06Å; R68-V71 PolarHBondContact O-N 3.13Å; V71-S73 PolarHBondContact O-N 3.37Å; V71-R74 PolarHBondContact O-N 3.01Å; V71-Q75 WeakPolarHBondContact O-CB 3.27Å; V71-Q75 PolarHBondContact O-N 3.27Å
72I97.1Very high96.3Very high0 Ų070.1 Ų70.10%037%0.368CS..Hα-helixtrans-51.8-45.8173.7-56.7-179.9000110.7I59 M62 A63 I67 R68 R74 Q75 L76 V83I59-I72 HydrophobicContact CB-CG2 4.34Å; I59-I72 HydrophobicContact CG1-CG2 3.93Å; I59-I72 HydrophobicContact CG2-CG2 4.48Å; M62-I72 HydrophobicContact CB-CD1 3.83Å; M62-I72 HydrophobicContact CB-CG1 3.85Å; M62-I72 HydrophobicContact CE-CB 4.44Å; M62-I72 HydrophobicContact CE-CG1 4.08Å; M62-I72 HydrophobicContact SD-CG1 4.46Å; M62-I72 HydrophobicContact SD-CG2 4.22Å; A63-I72 HydrophobicContact CB-CD1 3.95Å; I67-I72 HydrophobicContact CB-CG1 4.19Å; I67-I72 HydrophobicContact CG2-CG1 3.9Å; I67-I72 VanDerWaalsContact O-CD1 3.29Å; I67-I72 WeakPolarHBondContact O-CD1 3.48Å; R68-I72 PolarHBondContact O-N 2.97Å; I72-R74 PolarHBondContact O-N 3.4Å; I72-Q75 PolarHBondContact O-N 3.44Å; I72-L76 HydrophobicContact CG2-CD1 3.76Å; I72-L76 HydrophobicContact CG2-CG 4.37Å; I72-L76 WeakPolarHBondContact O-CB 3.25Å; I72-L76 PolarHBondContact O-N 3.45Å; I72-V83 HydrophobicContact CB-CG1 4.14Å; I72-V83 HydrophobicContact CG2-CG1 3.93Å; I72-V83 HydrophobicContact CG2-CG2 4.35Å
73S97.3Very high96.3Very high8 Ų869.8 Ų69.86%0.05637%0.366CS..Hα-helixtrans-57.8-43.7177.6-179.50000113.2P69 V71 R77 V78 H80P69-S73 VanDerWaalsContact O-CB 3.29Å; P69-S73 WeakPolarHBondContact O-CB 3.48Å; P69-S73 PolarHBondContact O-N 3.37Å; V71-S73 PolarHBondContact O-N 3.37Å; S73-R77 CarbonylContact O-C 3.57Å; S73-R77 WeakPolarHBondContact O-CA 3.46Å; S73-R77 PolarHBondContact O-N 3.46Å; S73-V78 CarbonylContact C-O 3.49Å; S73-V78 VanDerWaalsContact CA-O 3.25Å; S73-V78 WeakPolarHBondContact CA-O 3.28Å; S73-V78 WeakPolarHBondContact CB-O 3.25Å; S73-V78 PolarHBondContact O-N 3.2Å; S73-V78 VanDerWaalsContact O-O 3.04Å; S73-V78 PolarHBondContact OG-O 3.27Å; S73-H80 WeakPolarHBondContact OG-CA 3.24Å; S73-H80 PolarHBondContact OG-N 3.09Å
74R96.6Very high96.3Very high150 Ų15071.2 Ų71.257%0.56637%0.374SS*.Hα-helixtrans-72.5-48.4177.9-72.1-176.2-68.6-98.62.5112.1C70 V71 I72 R77C70-R74 VanDerWaalsContact O-CZ 3.25Å; C70-R74 PolarHBondContact O-N 3.19Å; C70-R74 PolarHBondContact O-NE 3.16Å; C70-R74 PolarHBondContact O-NH1 3.01Å; V71-R74 PolarHBondContact O-N 3.01Å; I72-R74 PolarHBondContact O-N 3.4Å; R74-R77 PolarHBondContact O-N 3.33Å; R74-R77 VanDerWaalsContact O-N 3.14Å
75Q96.4Very high96.2Very high130 Ų13072.1 Ų72.161%0.60738%0.376SS*.Hα-helixtrans-66.1-41.6-174-174.9169.3-5.400112.6M62 V71 I72 R77M62-Q75 HydrophobicContact CE-CB 4.16Å; M62-Q75 HydrophobicContact CE-CG 4.18Å; V71-Q75 WeakPolarHBondContact O-CB 3.27Å; V71-Q75 PolarHBondContact O-N 3.27Å; I72-Q75 PolarHBondContact O-N 3.44Å; Q75-R77 VanDerWaalsContact C-N 3.3Å
76L96.4Very high96.2Very high37 Ų3766 Ų6619%0.19435%0.348CS..THydrogen-bonded Turntrans-87.2-0.5175.7-55.7-179.1000113I55 K58 I59 M62 I72 V78I55-L76 HydrophobicContact CG2-CD1 4.41Å; K58-L76 HydrophobicContact CB-CD1 4.06Å; K58-L76 HydrophobicContact CB-CD2 4.36Å; K58-L76 HydrophobicContact CG-CD1 4.12Å; K58-L76 HydrophobicContact CG-CD2 3.76Å; I59-L76 HydrophobicContact CB-CD1 4.49Å; I59-L76 HydrophobicContact CG1-CD1 3.58Å; M62-L76 HydrophobicContact SD-CD1 3.84Å; M62-L76 HydrophobicContact SD-CD2 3.98Å; M62-L76 HydrophobicContact SD-CG 3.87Å; I72-L76 HydrophobicContact CG2-CD1 3.76Å; I72-L76 HydrophobicContact CG2-CG 4.37Å; I72-L76 WeakPolarHBondContact O-CB 3.25Å; I72-L76 PolarHBondContact O-N 3.45Å; L76-V78 HydrophobicContact CB-CG2 3.96Å; L76-V78 WeakPolarHBondContact O-CG2 3.31Å; L76-V78 PolarHBondContact O-N 2.97Å; L76-V78 VanDerWaalsContact O-N 3.15Å
77R96.3Very high96.2Very high139 Ų13964.6 Ų64.653%0.52533%0.326SS..THydrogen-bonded Turntrans52.130.8-174.1-55.2-178.3170.8-167.1-1.1113.8N39 L41 G42 S73 R74 Q75N39-R77 PolarHBondContact ND2-O 3.47Å; N39-R77 PolarHBondContact OD1-O 2.87Å; L41-R77 HydrophobicContact CB-CB 4.15Å; L41-R77 WeakPolarHBondContact O-CB 3.5Å; L41-R77 WeakPolarHBondContact O-CD 3.43Å; L41-R77 VanDerWaalsContact O-CG 3.24Å; L41-R77 WeakPolarHBondContact O-CG 3.45Å; G42-R77 VanDerWaalsContact O-CD 3.27Å; G42-R77 WeakPolarHBondContact O-CD 3.5Å; G42-R77 PolarHBondContact O-NH1 3.15Å; S73-R77 CarbonylContact O-C 3.57Å; S73-R77 WeakPolarHBondContact O-CA 3.46Å; S73-R77 PolarHBondContact O-N 3.46Å; R74-R77 PolarHBondContact O-N 3.33Å; R74-R77 VanDerWaalsContact O-N 3.14Å; Q75-R77 VanDerWaalsContact C-N 3.3Å
78V95.9Very high96.1Very high8 Ų865.3 Ų65.35%0.04834%0.335CS..  trans-98.5135.9179.1177.90000109.2L41 L51 I55 I59 S73 L76 H80 C82 V83L41-V78 WeakPolarHBondContact CD1-O 3.48Å; L51-V78 HydrophobicContact CD1-CG2 4.39Å; L51-V78 HydrophobicContact CD2-CG1 3.92Å; L51-V78 HydrophobicContact CD2-CG2 3.99Å; I55-V78 HydrophobicContact CG2-CG2 3.65Å; I59-V78 HydrophobicContact CD1-CG1 4.23Å; I59-V78 HydrophobicContact CD1-CG2 4.43Å; S73-V78 CarbonylContact C-O 3.49Å; S73-V78 VanDerWaalsContact CA-O 3.25Å; S73-V78 WeakPolarHBondContact CA-O 3.28Å; S73-V78 WeakPolarHBondContact CB-O 3.25Å; S73-V78 PolarHBondContact O-N 3.2Å; S73-V78 VanDerWaalsContact O-O 3.04Å; S73-V78 PolarHBondContact OG-O 3.27Å; L76-V78 HydrophobicContact CB-CG2 3.96Å; L76-V78 WeakPolarHBondContact O-CG2 3.31Å; L76-V78 PolarHBondContact O-N 2.97Å; L76-V78 VanDerWaalsContact O-N 3.15Å; V78-H80 PolarHBondContact O-N 2.8Å; V78-C82 HydrophobicContact CG1-CB 3.77Å; V78-V83 HydrophobicContact CB-CG2 3.98Å; V78-V83 HydrophobicContact CG1-CG2 3.81Å
79S96.4Very high95.9Very high64 Ų6460.8 Ų60.845%0.44832%0.318SS..  trans-59.7138.7179.563.60000112.5G81 C82 V83S79-G81 VanDerWaalsContact C-N 3.28Å; S79-G81 PolarHBondContact O-N 2.96Å; S79-C82 WeakPolarHBondContact O-CA 3.48Å; S79-C82 VanDerWaalsContact O-CB 3.29Å; S79-C82 WeakPolarHBondContact O-CB 3.45Å; S79-C82 PolarHBondContact O-N 2.74Å; S79-V83 PolarHBondContact O-N 2.73Å; S79-V83 VanDerWaalsContact O-N 3.14Å
80H96.7Very high95.9Very high100 Ų10061.7 Ų61.746%0.46332%0.315SS..Hα-helixtrans-54.7-40.1-173.6-176.7-112.9000113.4S73 V78 C82 V83 S84S73-H80 WeakPolarHBondContact OG-CA 3.24Å; S73-H80 PolarHBondContact OG-N 3.09Å; V78-H80 PolarHBondContact O-N 2.8Å; H80-C82 PolarHBondContact O-N 2.99Å; H80-V83 PolarHBondContact O-N 2.83Å; H80-S84 WeakPolarHBondContact O-CB 3.3Å; H80-S84 PolarHBondContact O-N 3.37Å
81G95.8Very high95.7Very high49 Ų4967.3 Ų67.351%0.50534%0.337SS..Hα-helixtrans-70.4-10.7175.500000115.2S79 K85S79-G81 VanDerWaalsContact C-N 3.28Å; S79-G81 PolarHBondContact O-N 2.96Å; G81-K85 WeakPolarHBondContact O-CB 3.24Å
82C95Very high95.1Very high34 Ų3469.6 Ų69.623%0.2335%0.345CS..Hα-helixtrans-88.5-46.3168.3-167.20000110.7V78 S79 H80 S84 K85 I86V78-C82 HydrophobicContact CG1-CB 3.77Å; S79-C82 WeakPolarHBondContact O-CA 3.48Å; S79-C82 VanDerWaalsContact O-CB 3.29Å; S79-C82 WeakPolarHBondContact O-CB 3.45Å; S79-C82 PolarHBondContact O-N 2.74Å; H80-C82 PolarHBondContact O-N 2.99Å; C82-S84 PolarHBondContact O-N 3.21Å; C82-K85 PolarHBondContact O-N 3.15Å; C82-K85 VanDerWaalsContact O-N 3.17Å; C82-I86 WeakPolarHBondContact O-CG1 2.88Å; C82-I86 PolarHBondContact O-N 2.96Å
83V96.9Very high94.6Very high0 Ų073.4 Ų73.40%037%0.368CS..Hα-helixtrans-53.9-54.7173.6177.80000110.9I59 P69 I72 V78 S79 H80 K85 I86 L87I59-V83 HydrophobicContact CD1-CG2 4.25Å; I59-V83 HydrophobicContact CG1-CG2 4.45Å; I59-V83 HydrophobicContact CG2-CG1 4.04Å; P69-V83 HydrophobicContact CB-CG1 4.15Å; I72-V83 HydrophobicContact CB-CG1 4.14Å; I72-V83 HydrophobicContact CG2-CG1 3.93Å; I72-V83 HydrophobicContact CG2-CG2 4.35Å; V78-V83 HydrophobicContact CB-CG2 3.98Å; V78-V83 HydrophobicContact CG1-CG2 3.81Å; S79-V83 PolarHBondContact O-N 2.73Å; S79-V83 VanDerWaalsContact O-N 3.14Å; H80-V83 PolarHBondContact O-N 2.83Å; V83-K85 VanDerWaalsContact C-N 3.26Å; V83-K85 PolarHBondContact O-N 2.87Å; V83-I86 PolarHBondContact O-N 3.25Å; V83-I86 VanDerWaalsContact O-N 3.13Å; V83-L87 HydrophobicContact CG1-CD1 3.95Å; V83-L87 HydrophobicContact CG1-CG 4.45Å; V83-L87 WeakPolarHBondContact O-CG 3.5Å; V83-L87 PolarHBondContact O-N 2.98Å
84S96.7Very high94.2Very high63 Ų6375.4 Ų75.444%0.44139%0.39SS..Hα-helixtrans-56-38.2177.8170.20000113H80 C82 C88H80-S84 WeakPolarHBondContact O-CB 3.3Å; H80-S84 PolarHBondContact O-N 3.37Å; C82-S84 PolarHBondContact O-N 3.21Å; S84-C88 WeakPolarHBondContact O-CB 3.49Å; S84-C88 PolarHBondContact O-N 3.36Å
85K95.3Very high93.8Very high152 Ų15270.2 Ų70.266%0.66138%0.377SS*.Hα-helixtrans-71.9-34.4179.4-173.7-175.7-59.6173.40112.9G81 C82 V83 R89G81-K85 WeakPolarHBondContact O-CB 3.24Å; C82-K85 PolarHBondContact O-N 3.15Å; C82-K85 VanDerWaalsContact O-N 3.17Å; V83-K85 VanDerWaalsContact C-N 3.26Å; V83-K85 PolarHBondContact O-N 2.87Å; K85-R89 WeakPolarHBondContact O-CB 3.08Å; K85-R89 PolarHBondContact O-N 2.92Å
86I95.5Very high93.5Very high11 Ų1165.5 Ų65.56%0.05636%0.355CS..Hα-helixtrans-71.1-48.3175.7-70.5161.5000109.8L51 R56 I59 V60 C82 V83 R89 Y90L51-I86 HydrophobicContact CD2-CD1 3.81Å; R56-I86 HydrophobicContact CG-CD1 4.06Å; I59-I86 HydrophobicContact CB-CG2 4.38Å; I59-I86 HydrophobicContact CD1-CD1 3.57Å; I59-I86 HydrophobicContact CG2-CB 4.18Å; I59-I86 HydrophobicContact CG2-CG2 3.81Å; V60-I86 HydrophobicContact CG2-CG2 4.31Å; C82-I86 WeakPolarHBondContact O-CG1 2.88Å; C82-I86 PolarHBondContact O-N 2.96Å; V83-I86 PolarHBondContact O-N 3.25Å; V83-I86 VanDerWaalsContact O-N 3.13Å; I86-R89 PolarHBondContact O-N 2.98Å; I86-Y90 WeakPolarHBondContact O-CB 3.48Å; I86-Y90 PolarHBondContact O-N 3.07Å
87L95.8Very high93.1Very high31 Ų3171.9 Ų71.916%0.16238%0.377CS..Hα-helixtrans-62.5-43.7178-65177.5000112.3I59 V60 A63 P69 V83 R89 Y90 Q91I59-L87 HydrophobicContact CG2-CD2 3.76Å; I59-L87 HydrophobicContact CG2-CG 3.88Å; V60-L87 HydrophobicContact CG2-CD2 4.18Å; A63-L87 HydrophobicContact CB-CD1 4.07Å; A63-L87 HydrophobicContact CB-CD2 3.48Å; A63-L87 VanDerWaalsContact CB-CD2 3.48Å; A63-L87 HydrophobicContact CB-CG 4.44Å; P69-L87 HydrophobicContact CB-CD1 4.3Å; P69-L87 HydrophobicContact CG-CD1 3.93Å; V83-L87 HydrophobicContact CG1-CD1 3.95Å; V83-L87 HydrophobicContact CG1-CG 4.45Å; V83-L87 WeakPolarHBondContact O-CG 3.5Å; V83-L87 PolarHBondContact O-N 2.98Å; L87-R89 PolarHBondContact O-N 3.26Å; L87-Y90 PolarHBondContact O-N 3.45Å; L87-Q91 PolarHBondContact O-N 2.86Å
88C94.3Very high92.7Very high68 Ų6867.6 Ų67.646%0.45937%0.367SS..Hα-helixtrans-61.2-45.7176.2-173.50000111.9S84 Y90 Q91 E92S84-C88 WeakPolarHBondContact O-CB 3.49Å; S84-C88 PolarHBondContact O-N 3.36Å; C88-Y90 VanDerWaalsContact C-N 3.31Å; C88-Y90 PolarHBondContact O-N 3.49Å; C88-Q91 PolarHBondContact O-N 2.83Å; C88-E92 WeakPolarHBondContact O-CG 3.41Å; C88-E92 PolarHBondContact O-N 2.91Å
89R91.9Very high92Very high87 Ų8768.9 Ų68.933%0.32838%0.382SS..Hα-helixtrans-61.5-38.5174.5178.4-175.7175.983.8-0.2112.4K85 I86 L87 E92 T93 R97K85-R89 WeakPolarHBondContact O-CB 3.08Å; K85-R89 PolarHBondContact O-N 2.92Å; I86-R89 PolarHBondContact O-N 2.98Å; L87-R89 PolarHBondContact O-N 3.26Å; R89-E92 PolarHBondContact O-N 3.32Å; R89-T93 PolarHBondContact O-N 2.7Å; R89-T93 PolarHBondContact O-OG1 2.63Å; R89-R97 PolarHBondContact NE-O 3Å; R89-R97 PolarHBondContact NH2-O 2.79Å; R89-R97 VanDerWaalsContact NH2-O 3.13Å
90Y93.8Very high91.2Very high73 Ų7371 Ų7129%0.28640%0.403SS..Hα-helixtrans-65-44.9177.6-176.3-103.1000110.7V60 H64 I86 L87 C88 E92 T93 G94 I96V60-Y90 HydrophobicContact CG1-CD1 3.7Å; V60-Y90 HydrophobicContact CG1-CD2 4.05Å; V60-Y90 HydrophobicContact CG1-CE1 3.45Å; V60-Y90 VanDerWaalsContact CG1-CE1 3.45Å; V60-Y90 HydrophobicContact CG1-CE2 3.83Å; V60-Y90 HydrophobicContact CG1-CG 4Å; V60-Y90 HydrophobicContact CG2-CD1 4.15Å; V60-Y90 HydrophobicContact CG2-CD2 4.01Å; V60-Y90 HydrophobicContact CG2-CG 3.79Å; H64-Y90 AromaticContact NE2-CE1 3.5Å; H64-Y90 WeakPolarHBondContact NE2-CE1 3.42Å; I86-Y90 WeakPolarHBondContact O-CB 3.48Å; I86-Y90 PolarHBondContact O-N 3.07Å; L87-Y90 PolarHBondContact O-N 3.45Å; C88-Y90 VanDerWaalsContact C-N 3.31Å; C88-Y90 PolarHBondContact O-N 3.49Å; Y90-E92 VanDerWaalsContact C-N 3.31Å; Y90-E92 PolarHBondContact O-N 3.37Å; Y90-T93 PolarHBondContact O-N 2.67Å; Y90-G94 VanDerWaalsContact CD2-O 3.29Å; Y90-G94 WeakPolarHBondContact CD2-O 3.47Å; Y90-G94 WeakPolarHBondContact CE2-O 3.39Å; Y90-G94 VanDerWaalsContact O-CA 3.31Å; Y90-G94 WeakPolarHBondContact O-CA 3.32Å; Y90-G94 PolarHBondContact O-N 3.33Å; Y90-I96 HydrophobicContact CD2-CG2 3.77Å; Y90-I96 HydrophobicContact CE2-CG2 3.99Å
91Q91.7Very high89.8Confident160 Ų16071.7 Ų71.775%0.74841%0.409SS*.Hα-helixtrans-62.1-34.1172.7-159.880.875.600113.2L87 C88L87-Q91 PolarHBondContact O-N 2.86Å; C88-Q91 PolarHBondContact O-N 2.83Å
92E84.4Confident87.8Confident97 Ų9772.5 Ų72.545%0.45342%0.417SS..Hα-helixtrans-76.1-26.2178-76.4-177.4162.800114.2C88 R89 Y90 R221C88-E92 WeakPolarHBondContact O-CG 3.41Å; C88-E92 PolarHBondContact O-N 2.91Å; R89-E92 PolarHBondContact O-N 3.32Å; Y90-E92 VanDerWaalsContact C-N 3.31Å; Y90-E92 PolarHBondContact O-N 3.37Å; E92-R221 WeakPolarHBondContact OE1-CD 3.42Å
93T87.9Confident86.1Confident80 Ų8074.6 Ų74.649%0.49145%0.445SS..Hα-helixtrans-144.4-4.9-164.265.50000116.7R89 Y90 S95R89-T93 PolarHBondContact O-N 2.7Å; R89-T93 PolarHBondContact O-OG1 2.63Å; Y90-T93 PolarHBondContact O-N 2.67Å; T93-S95 PolarHBondContact O-N 2.97Å; T93-S95 PolarHBondContact OG1-N 2.8Å
94G88.9Confident84.2Confident50 Ų5079.5 Ų79.552%0.51548%0.479SS..SBendtrans62.3-7.9-165.600000114.8Y90 I96Y90-G94 VanDerWaalsContact CD2-O 3.29Å; Y90-G94 WeakPolarHBondContact CD2-O 3.47Å; Y90-G94 WeakPolarHBondContact CE2-O 3.39Å; Y90-G94 VanDerWaalsContact O-CA 3.31Å; Y90-G94 WeakPolarHBondContact O-CA 3.32Å; Y90-G94 PolarHBondContact O-N 3.33Å; G94-I96 PolarHBondContact O-N 3.1Å
95S87.8Confident82.3Confident41 Ų4185.2 Ų85.229%0.28750%0.496SS..  trans-97.5104.2-165.2-163.10000113.1T93 R97T93-S95 PolarHBondContact O-N 2.97Å; T93-S95 PolarHBondContact OG1-N 2.8Å; S95-R97 PolarHBondContact O-N 3.27Å
96I89.4Confident80.3Confident32 Ų3283.4 Ų83.416%0.16450%0.5CS..  trans-60.5-16.5167.855.4162000113.8R56 H57 V60 Y90 G94R56-I96 PolarHBondContact NE-O 2.79Å; R56-I96 PolarHBondContact NH2-O 2.71Å; H57-I96 WeakPolarHBondContact CE1-CD1 3.27Å; H57-I96 WeakPolarHBondContact NE2-CD1 3.36Å; V60-I96 HydrophobicContact CB-CG2 4.47Å; V60-I96 HydrophobicContact CG2-CG2 3.99Å; Y90-I96 HydrophobicContact CD2-CG2 3.77Å; Y90-I96 HydrophobicContact CE2-CG2 3.99Å; G94-I96 PolarHBondContact O-N 3.1Å
97R88.9Confident78.3Confident170 Ų17093.1 Ų93.164%0.64254%0.536SS*.SBendtrans-70.3145.2-175.2-61.1-178.582-121.59.3111.2R56 R89 S95R56-R97 VanDerWaalsContact NH2-C 3.25Å; R56-R97 PolarHBondContact NH2-O 3.09Å; R56-R97 VanDerWaalsContact NH2-O 3.16Å; R89-R97 PolarHBondContact NE-O 3Å; R89-R97 PolarHBondContact NH2-O 2.79Å; R89-R97 VanDerWaalsContact NH2-O 3.13Å; S95-R97 PolarHBondContact O-N 3.27Å
98P87.3Confident76.4Confident49 Ų4999.4 Ų99.432%0.31856%0.564SS.*PPolyproline II helixtrans-58.3151168.126.3-33.4000110.4P50P50-P98 HydrophobicContact CB-CB 3.78Å; P50-P98 HydrophobicContact CB-CG 4.25Å; P50-P98 HydrophobicContact CG-CB 4.16Å; P50-P98 HydrophobicContact CG-CG 4.21Å
99G82.6Confident74.5Confident36 Ų3698.1 Ų98.137%0.37155%0.554SS.*PPolyproline II helixtrans-68.3163162.200000109.9I101G99-I101 PolarHBondContact O-N 3.05Å
100A77.9Confident72.9Confident107 Ų10794.7 Ų94.788%0.88454%0.544SS*.PPolyproline II helixtrans-55.3133.2170.500000110.1
101I67.8Low71.9Confident115 Ų11594.4 Ų94.459%0.5955%0.55SS**  trans-117.9116178.6-67.2164.6000106.5P50 G99P50-I101 HydrophobicContact CB-CD1 4.06Å; P50-I101 HydrophobicContact CG-CD1 4.04Å; G99-I101 PolarHBondContact O-N 3.05Å
102G54.9Low71.1Confident66 Ų6690.9 Ų90.968%0.6854%0.541SS*.  trans83.6-174.5-170.700000112.8
103G59.5Low70.7Confident78 Ų7891.5 Ų91.580%0.80455%0.548SS*.  trans81.6128.6-153.600000109.9
104S56.2Low70.4Confident103 Ų10387.9 Ų87.972%0.7253%0.526SS*.PPolyproline II helixtrans-62.4157.515457.60000107.7
105K55.7Low70.1Confident183 Ų18389.4 Ų89.480%0.79652%0.519SS*.PPolyproline II helixtrans-49.3146.1148.7-67.3-177.1177-174.90106.7R107K105-R107 PolarHBondContact O-N 3.11Å
106P54.6Low70Confident114 Ų11494 Ų9474%0.7453%0.534SS*.PPolyproline II helixtrans-46.8123.1160.8-23.533.8000106.7Q108P106-Q108 PolarHBondContact O-N 3.39Å
107R52.9Low69.7Low216 Ų21695.5 Ų95.582%0.81554%0.538SS*.PPolyproline II helixtrans-54.1136.4159.3-73.8-177.1-177-113.35.3103.9K105 V109K105-R107 PolarHBondContact O-N 3.11Å; R107-V109 HydrophobicContact CB-CG2 3.76Å; R107-V109 PolarHBondContact O-N 3.42Å
108Q55.2Low69.5Low163 Ų16387.4 Ų87.476%0.76251%0.507SS*.  trans-73.867.6175-70.4161.3-98.700106.7P106 A110P106-Q108 PolarHBondContact O-N 3.39Å; Q108-A110 VanDerWaalsContact C-N 3.31Å; Q108-A110 CarbonylContact C-O 3.46Å
109V54.9Low69.5Low41 Ų4186.9 Ų86.925%0.24850%0.5CS..SBendtrans-63.6-46.4-174.4176.10000107.2R107 A153 S158R107-V109 HydrophobicContact CB-CG2 3.76Å; R107-V109 PolarHBondContact O-N 3.42Å; V109-A153 WeakPolarHBondContact O-CA 3.35Å; V109-A153 WeakPolarHBondContact O-CB 3.16Å; V109-A153 PolarHBondContact O-N 3.13Å; V109-S158 WeakPolarHBondContact CG1-OG 3.44Å
110A59Low69.8Low14 Ų1487.5 Ų87.512%0.11649%0.494CS..SBendtrans-101.2144.3158.100000110.3Q108 V114 E115 A153Q108-A110 VanDerWaalsContact C-N 3.31Å; Q108-A110 CarbonylContact C-O 3.46Å; A110-V114 HydrophobicContact CB-CB 4.42Å; A110-V114 HydrophobicContact CB-CG1 4.45Å; A110-E115 HydrophobicContact CB-CG 3.44Å; A110-E115 VanDerWaalsContact CB-CG 3.44Å; A110-A153 HydrophobicContact CB-CB 4.16Å
111T71.8Confident70.2Confident67 Ų6782.4 Ų82.441%0.41145%0.451SS..  trans-71.4150.2155.445.70000108.9D113 V114 E115T111-D113 PolarHBondContact O-N 2.91Å; T111-D113 VanDerWaalsContact O-N 3.13Å; T111-V114 PolarHBondContact O-N 3.49Å; T111-V114 VanDerWaalsContact OG1-CG2 3.27Å; T111-V114 WeakPolarHBondContact OG1-CG2 3.26Å; T111-E115 PolarHBondContact O-N 3.29Å
112P75.6Confident71Confident86 Ų8678.9 Ų78.956%0.55843%0.432SS*.Hα-helixtrans-60-27.1-177.425.1-34.7000112.7E115 K116P112-E115 PolarHBondContact O-N 2.78Å; P112-K116 WeakPolarHBondContact O-CB 3.33Å; P112-K116 PolarHBondContact O-N 3.38Å
113D75.6Confident72.6Confident111 Ų11182.9 Ų82.959%0.59443%0.427SS*.Hα-helixtrans-67.8-36.7176.3-47.4-79.4000112.4T111 R117T111-D113 PolarHBondContact O-N 2.91Å; T111-D113 VanDerWaalsContact O-N 3.13Å; D113-R117 WeakPolarHBondContact O-CB 3.48Å; D113-R117 PolarHBondContact O-N 2.93Å
114V81.6Confident73.9Confident4 Ų483.7 Ų83.72%0.02441%0.409CS..Hα-helixtrans-70.8-41173.6174.80000110.6A110 T111 K116 R117 I118 L137 V142 A153A110-V114 HydrophobicContact CB-CB 4.42Å; A110-V114 HydrophobicContact CB-CG1 4.45Å; T111-V114 PolarHBondContact O-N 3.49Å; T111-V114 VanDerWaalsContact OG1-CG2 3.27Å; T111-V114 WeakPolarHBondContact OG1-CG2 3.26Å; V114-K116 PolarHBondContact O-N 3.02Å; V114-R117 PolarHBondContact O-N 3.32Å; V114-I118 HydrophobicContact CG1-CD1 3.88Å; V114-I118 HydrophobicContact CG1-CG1 4.42Å; V114-I118 WeakPolarHBondContact O-CD1 3.08Å; V114-I118 VanDerWaalsContact O-CG1 3.25Å; V114-I118 WeakPolarHBondContact O-CG1 3.09Å; V114-I118 PolarHBondContact O-N 3.21Å; V114-L137 HydrophobicContact CG1-CD1 4.06Å; V114-L137 HydrophobicContact CG1-CD2 4.36Å; V114-V142 HydrophobicContact CG2-CG1 4.12Å; V114-A153 HydrophobicContact CB-CB 4.47Å; V114-A153 HydrophobicContact CG1-CB 4.02Å; V114-A153 HydrophobicContact CG2-CB 4.44Å
115E83.3Confident75.1Confident81 Ų8182.4 Ų82.438%0.37939%0.394SS..Hα-helixtrans-60.5-45.6174.5-59.9-168.6142.800111.3A110 T111 P112 R117 I118 E119 V162A110-E115 HydrophobicContact CB-CG 3.44Å; A110-E115 VanDerWaalsContact CB-CG 3.44Å; T111-E115 PolarHBondContact O-N 3.29Å; P112-E115 PolarHBondContact O-N 2.78Å; E115-R117 VanDerWaalsContact C-N 3.35Å; E115-R117 PolarHBondContact O-N 3.4Å; E115-I118 WeakPolarHBondContact O-CB 3.38Å; E115-I118 PolarHBondContact O-N 3.31Å; E115-E119 WeakPolarHBondContact O-CG 3.31Å; E115-E119 PolarHBondContact O-N 3.44Å; E115-V162 HydrophobicContact CG-CG2 4.26Å
116K84.7Confident76.4Confident137 Ų13778.4 Ų78.460%0.59639%0.387SS*.Hα-helixtrans-57.9-42.8174.9-177.2-172.9174.3-168.50112.4P112 V114 E119 E120P112-K116 WeakPolarHBondContact O-CB 3.33Å; P112-K116 PolarHBondContact O-N 3.38Å; V114-K116 PolarHBondContact O-N 3.02Å; K116-E119 PolarHBondContact O-N 3.18Å; K116-E120 WeakPolarHBondContact O-CB 3.42Å; K116-E120 PolarHBondContact O-N 3.13Å
117R83.5Confident77.8Confident64 Ų6475.9 Ų75.924%0.24238%0.382CS..Hα-helixtrans-73.5-31.7179.9-16370.4169.8155.41.7112.6D113 V114 E115 E120 Y121 L137 D140 V142D113-R117 WeakPolarHBondContact O-CB 3.48Å; D113-R117 PolarHBondContact O-N 2.93Å; V114-R117 PolarHBondContact O-N 3.32Å; E115-R117 VanDerWaalsContact C-N 3.35Å; E115-R117 PolarHBondContact O-N 3.4Å; R117-E120 WeakPolarHBondContact CD-OE2 3.43Å; R117-E120 IonicContact CZ-OE2 2.75Å; R117-E120 IonicContact NE-OE2 3.72Å; R117-E120 IonicContact NH1-OE2 3.9Å; R117-E120 PolarHBondContact NH1-OE2 3.12Å; R117-E120 PolarHBondContact O-N 2.99Å; R117-Y121 HydrophobicContact CG-CD1 4.45Å; R117-Y121 HydrophobicContact CG-CE1 3.82Å; R117-Y121 HydrophobicContact CG-CE2 3.87Å; R117-Y121 VanDerWaalsContact CG-CZ 3.47Å; R117-Y121 VanDerWaalsContact NE-CZ 3.31Å; R117-Y121 PolarHBondContact NE-OH 2.92Å; R117-Y121 VanDerWaalsContact O-CG 3.28Å; R117-Y121 PolarHBondContact O-N 3.47Å; R117-L137 HydrophobicContact CB-CD2 3.85Å; R117-L137 HydrophobicContact CG-CD2 3.82Å; R117-D140 IonicContact CZ-OD2 2.7Å; R117-D140 IonicContact NE-OD2 3.19Å; R117-D140 IonicContact NH2-OD2 2.81Å; R117-D140 PolarHBondContact NH2-OD2 2.93Å; R117-V142 HydrophobicContact CB-CG1 4.25Å; R117-V142 HydrophobicContact CG-CG1 4.36Å; R117-V142 HydrophobicContact CG-CG2 4.26Å
118I86.1Confident79.3Confident1 Ų167 Ų671%0.00535%0.35CS..Hα-helixtrans-61-47.4169.3-70.2162.1000110.8V114 E115 E120 Y121 K122 I133 L137 I159 V162 L163V114-I118 HydrophobicContact CG1-CD1 3.88Å; V114-I118 HydrophobicContact CG1-CG1 4.42Å; V114-I118 WeakPolarHBondContact O-CD1 3.08Å; V114-I118 VanDerWaalsContact O-CG1 3.25Å; V114-I118 WeakPolarHBondContact O-CG1 3.09Å; V114-I118 PolarHBondContact O-N 3.21Å; E115-I118 WeakPolarHBondContact O-CB 3.38Å; E115-I118 PolarHBondContact O-N 3.31Å; I118-E120 VanDerWaalsContact C-N 3.32Å; I118-E120 PolarHBondContact O-N 3.01Å; I118-Y121 PolarHBondContact O-N 3.06Å; I118-K122 PolarHBondContact O-N 3.07Å; I118-K122 VanDerWaalsContact O-N 3.1Å; I118-I133 HydrophobicContact CB-CG2 4.32Å; I118-I133 HydrophobicContact CG1-CG2 3.88Å; I118-I133 HydrophobicContact CG2-CG2 4.23Å; I118-L137 HydrophobicContact CD1-CD1 4.32Å; I118-L137 HydrophobicContact CG1-CD1 3.85Å; I118-I159 HydrophobicContact CD1-CB 4.47Å; I118-I159 HydrophobicContact CD1-CG1 3.84Å; I118-I159 HydrophobicContact CG1-CG1 4.33Å; I118-I159 HydrophobicContact CG2-CG2 4.2Å; I118-V162 HydrophobicContact CB-CG1 4.46Å; I118-V162 HydrophobicContact CD1-CG2 4.48Å; I118-V162 HydrophobicContact CG2-CB 4.43Å; I118-V162 HydrophobicContact CG2-CG1 3.97Å; I118-L163 HydrophobicContact CG2-CD2 3.86Å; I118-L163 HydrophobicContact CG2-CG 4.22Å
119E86.9Confident80.7Confident37 Ų3765.4 Ų65.417%0.17334%0.341CS..Hα-helixtrans-61.5-40.9176.8-72.5171.9-162.100112.1E115 K116 K122 R123 R166 F167E115-E119 WeakPolarHBondContact O-CG 3.31Å; E115-E119 PolarHBondContact O-N 3.44Å; K116-E119 PolarHBondContact O-N 3.18Å; E119-K122 PolarHBondContact O-N 3.19Å; E119-R123 VanDerWaalsContact O-CB 3.24Å; E119-R123 WeakPolarHBondContact O-CB 3.5Å; E119-R123 PolarHBondContact O-N 2.7Å; E119-R166 IonicContact OE1-CZ 3.3Å; E119-R166 IonicContact OE1-NE 3.16Å; E119-R166 PolarHBondContact OE1-NE 2.96Å; E119-R166 IonicContact OE1-NH2 3.75Å; E119-R166 PolarHBondContact OE1-NH2 2.96Å; E119-R166 IonicContact OE2-NH2 3.99Å; E119-R166 PolarHBondContact OE2-NH2 3.42Å; E119-F167 HydrophobicContact CG-CE2 4.3Å
120E87.6Confident82.1Confident49 Ų4964.5 Ų64.523%0.22934%0.336CS..Hα-helixtrans-63.4-48.4177.9-174.9153-104.600112.3K116 R117 I118 K122 R123 E124K116-E120 WeakPolarHBondContact O-CB 3.42Å; K116-E120 PolarHBondContact O-N 3.13Å; R117-E120 WeakPolarHBondContact CD-OE2 3.43Å; R117-E120 IonicContact CZ-OE2 2.75Å; R117-E120 IonicContact NE-OE2 3.72Å; R117-E120 IonicContact NH1-OE2 3.9Å; R117-E120 PolarHBondContact NH1-OE2 3.12Å; R117-E120 PolarHBondContact O-N 2.99Å; I118-E120 VanDerWaalsContact C-N 3.32Å; I118-E120 PolarHBondContact O-N 3.01Å; E120-K122 VanDerWaalsContact C-N 3.33Å; E120-K122 PolarHBondContact O-N 3.36Å; E120-R123 PolarHBondContact O-N 3.14Å; E120-R123 IonicContact OE1-NH2 2.61Å; E120-R123 PolarHBondContact OE1-NH2 3.13Å; E120-E124 WeakPolarHBondContact O-CB 3.12Å; E120-E124 VanDerWaalsContact O-CG 3.31Å; E120-E124 WeakPolarHBondContact O-CG 3.29Å; E120-E124 PolarHBondContact O-N 2.76Å
121Y86.7Confident83.3Confident0 Ų070.4 Ų70.40%036%0.356CS..Hα-helixtrans-62.8-37.8176.7-64.1-16.6000113.1R117 I118 N125 I133 K136 L137 D140R117-Y121 HydrophobicContact CG-CD1 4.45Å; R117-Y121 HydrophobicContact CG-CE1 3.82Å; R117-Y121 HydrophobicContact CG-CE2 3.87Å; R117-Y121 VanDerWaalsContact CG-CZ 3.47Å; R117-Y121 VanDerWaalsContact NE-CZ 3.31Å; R117-Y121 PolarHBondContact NE-OH 2.92Å; R117-Y121 VanDerWaalsContact O-CG 3.28Å; R117-Y121 PolarHBondContact O-N 3.47Å; I118-Y121 PolarHBondContact O-N 3.06Å; Y121-N125 PolarHBondContact O-N 3.15Å; Y121-I133 HydrophobicContact CD2-CG2 4.23Å; Y121-K136 HydrophobicContact CD1-CD 3.66Å; Y121-K136 VanDerWaalsContact CD1-CE 3.48Å; Y121-K136 HydrophobicContact CD1-CG 4.4Å; Y121-K136 VanDerWaalsContact CD1-NZ 3.32Å; Y121-K136 HydrophobicContact CD2-CB 3.92Å; Y121-K136 HydrophobicContact CD2-CD 3.86Å; Y121-K136 HydrophobicContact CD2-CG 4.06Å; Y121-K136 HydrophobicContact CE1-CD 3.63Å; Y121-K136 HydrophobicContact CE1-CG 3.95Å; Y121-K136 HydrophobicContact CE2-CB 3.59Å; Y121-K136 HydrophobicContact CE2-CD 3.86Å; Y121-K136 HydrophobicContact CE2-CG 3.61Å; Y121-K136 HydrophobicContact CG-CD 3.77Å; Y121-K136 HydrophobicContact CG-CG 4.45Å; Y121-K136 PolarHBondContact OH-O 3.37Å; Y121-L137 HydrophobicContact CD2-CG 4.48Å; Y121-L137 HydrophobicContact CE2-CD2 3.94Å; Y121-L137 HydrophobicContact CE2-CG 3.94Å; Y121-D140 WeakPolarHBondContact OH-CB 3.32Å; Y121-D140 VanDerWaalsContact OH-CG 3.22Å; Y121-D140 PolarHBondContact OH-OD2 3.45Å
122K85.5Confident84Confident42 Ų4270.4 Ų70.418%0.18335%0.351CS..Hα-helixtrans-72.3-31.3176.6-167.362.5162.3174.40112.7I118 E119 E120 N125 P126 M128 I133 L163 F167I118-K122 PolarHBondContact O-N 3.07Å; I118-K122 VanDerWaalsContact O-N 3.1Å; E119-K122 PolarHBondContact O-N 3.19Å; E120-K122 VanDerWaalsContact C-N 3.33Å; E120-K122 PolarHBondContact O-N 3.36Å; K122-N125 CarbonylContact O-C 3.21Å; K122-P126 VanDerWaalsContact CE-O 3.27Å; K122-P126 WeakPolarHBondContact CE-O 3.45Å; K122-P126 PolarHBondContact NZ-O 2.93Å; K122-P126 VanDerWaalsContact O-CA 3.3Å; K122-P126 WeakPolarHBondContact O-CA 3.28Å; K122-P126 VanDerWaalsContact O-N 3.17Å; K122-M128 PolarHBondContact NZ-O 3.32Å; K122-I133 HydrophobicContact CB-CD1 4.45Å; K122-I133 HydrophobicContact CD-CD1 4.35Å; K122-L163 HydrophobicContact CB-CD2 3.84Å; K122-L163 HydrophobicContact CD-CD2 4.13Å; K122-L163 HydrophobicContact CG-CD2 3.74Å; K122-F167 HydrophobicContact CB-CE1 4.31Å; K122-F167 HydrophobicContact CB-CE2 3.91Å; K122-F167 HydrophobicContact CB-CZ 3.74Å; K122-F167 HydrophobicContact CG-CD1 4.23Å; K122-F167 HydrophobicContact CG-CD2 4.15Å; K122-F167 HydrophobicContact CG-CE1 3.98Å; K122-F167 HydrophobicContact CG-CE2 3.91Å; K122-F167 HydrophobicContact CG-CG 4.31Å; K122-F167 HydrophobicContact CG-CZ 3.82Å
123R86.9Confident84.4Confident150 Ų15066.3 Ų66.357%0.56632%0.324SS*.Hα-helixtrans-71.2-41.8173.3178176.762.2-121.1-0.9112.1E119 E120 N125E119-R123 VanDerWaalsContact O-CB 3.24Å; E119-R123 WeakPolarHBondContact O-CB 3.5Å; E119-R123 PolarHBondContact O-N 2.7Å; E120-R123 PolarHBondContact O-N 3.14Å; E120-R123 IonicContact OE1-NH2 2.61Å; E120-R123 PolarHBondContact OE1-NH2 3.13Å; R123-N125 VanDerWaalsContact C-N 3.34Å
124E86.7Confident84.8Confident94 Ų9464.9 Ų64.944%0.43931%0.311SS..Hα-helixtrans-64.8-38.3173.7-71.4169.6-178.500111.8E120 K136E120-E124 WeakPolarHBondContact O-CB 3.12Å; E120-E124 VanDerWaalsContact O-CG 3.31Å; E120-E124 WeakPolarHBondContact O-CG 3.29Å; E120-E124 PolarHBondContact O-N 2.76Å; E124-K136 IonicContact OE2-NZ 3.72Å; E124-K136 PolarHBondContact OE2-NZ 3.11Å
125N83.1Confident84.9Confident76 Ų7668.4 Ų68.441%0.40633%0.329SS..  trans-138.287.5-175.7-69.5-95.5000110.6Y121 K122 R123 G127 M128Y121-N125 PolarHBondContact O-N 3.15Å; K122-N125 CarbonylContact O-C 3.21Å; R123-N125 VanDerWaalsContact C-N 3.34Å; N125-G127 PolarHBondContact O-N 2.98Å; N125-G127 VanDerWaalsContact O-N 3.13Å; N125-M128 HydrophobicContact CB-CB 3.86Å; N125-M128 HydrophobicContact CB-CE 3.92Å; N125-M128 WeakPolarHBondContact O-CB 3.11Å; N125-M128 PolarHBondContact O-N 3.23Å
126P82.3Confident84.9Confident99 Ų9966.8 Ų66.864%0.64332%0.321SS*.THydrogen-bonded Turntrans-58.3-27179.8-28.937.2000114.3K122 M128K122-P126 VanDerWaalsContact CE-O 3.27Å; K122-P126 WeakPolarHBondContact CE-O 3.45Å; K122-P126 PolarHBondContact NZ-O 2.93Å; K122-P126 VanDerWaalsContact O-CA 3.3Å; K122-P126 WeakPolarHBondContact O-CA 3.28Å; K122-P126 VanDerWaalsContact O-N 3.17Å; P126-M128 VanDerWaalsContact C-N 3.31Å; P126-M128 PolarHBondContact O-N 3.5Å
127G84.5Confident84.9Confident62 Ų6260.3 Ų60.364%0.63929%0.293SS*.THydrogen-bonded Turntrans-71.3-18.2173.300000115N125 F129N125-G127 PolarHBondContact O-N 2.98Å; N125-G127 VanDerWaalsContact O-N 3.13Å; G127-F129 PolarHBondContact O-N 3.18Å
128M84Confident84.9Confident28 Ų2859.6 Ų59.614%0.13829%0.294CS..  trans-65.6130.3-167.6-166.3180-81.300112.8K122 N125 P126 E132 I133 K136K122-M128 PolarHBondContact NZ-O 3.32Å; N125-M128 HydrophobicContact CB-CB 3.86Å; N125-M128 HydrophobicContact CB-CE 3.92Å; N125-M128 WeakPolarHBondContact O-CB 3.11Å; N125-M128 PolarHBondContact O-N 3.23Å; P126-M128 VanDerWaalsContact C-N 3.31Å; P126-M128 PolarHBondContact O-N 3.5Å; M128-E132 WeakPolarHBondContact CA-OE2 3.23Å; M128-E132 HydrophobicContact CG-CB 3.51Å; M128-E132 HydrophobicContact CG-CG 4.46Å; M128-E132 WeakPolarHBondContact CG-OE2 3.36Å; M128-E132 HydrophobicContact SD-CB 4.2Å; M128-I133 HydrophobicContact CB-CG1 4.4Å; M128-I133 HydrophobicContact CG-CG1 3.82Å; M128-I133 HydrophobicContact SD-CG1 3.64Å; M128-K136 HydrophobicContact CE-CD 4.21Å; M128-K136 HydrophobicContact SD-CD 4.46Å
129F84.9Confident84.8Confident130 Ų13068 Ų6857%0.5733%0.331SS*.  trans-81157.7-178.3-66.2-76.6000112.5G127 W131 E132 I133G127-F129 PolarHBondContact O-N 3.18Å; F129-W131 HydrophobicContact CB-CG 4.37Å; F129-W131 AromaticContact CG-NE1 3.84Å; F129-W131 PolarHBondContact O-N 3.34Å; F129-E132 HydrophobicContact CB-CG 4.4Å; F129-E132 WeakPolarHBondContact CD2-OE2 3.16Å; F129-E132 PolarHBondContact N-OE2 2.94Å; F129-E132 PolarHBondContact O-N 2.93Å; F129-E132 VanDerWaalsContact O-N 3.11Å; F129-I133 WeakPolarHBondContact O-CG1 3.37Å; F129-I133 PolarHBondContact O-N 3.45Å
130S83.6Confident84.6Confident22 Ų2269.5 Ų69.515%0.15434%0.34CS..Hα-helixtrans-60.2-15.9179.8-52.20000115I159 S160S130-I159 WeakPolarHBondContact O-CD1 3.39Å; S130-S160 VanDerWaalsContact CB-OG 3.24Å; S130-S160 WeakPolarHBondContact CB-OG 3.28Å; S130-S160 PolarHBondContact OG-OG 2.79Å
131W83.6Confident84Confident139 Ų13969.9 Ų69.953%0.52736%0.356SS..Hα-helixtrans-90.5-38.9174.865.6-93.5000111.9F129 I133 R134 D135 V156F129-W131 HydrophobicContact CB-CG 4.37Å; F129-W131 AromaticContact CG-NE1 3.84Å; F129-W131 PolarHBondContact O-N 3.34Å; W131-I133 VanDerWaalsContact C-N 3.32Å; W131-I133 PolarHBondContact O-N 2.96Å; W131-R134 VanDerWaalsContact O-CB 3.3Å; W131-R134 WeakPolarHBondContact O-CB 3.42Å; W131-R134 PolarHBondContact O-N 3.42Å; W131-R134 VanDerWaalsContact O-N 3.09Å; W131-D135 PolarHBondContact O-N 3.16Å; W131-V156 HydrophobicContact CB-CG2 4.4Å
132E86.9Confident83.4Confident66 Ų6672.4 Ų72.431%0.30837%0.372SS..Hα-helixtrans-63.2-40172.5-62.3172.3134.800111.2M128 F129 R134 D135 K136M128-E132 WeakPolarHBondContact CA-OE2 3.23Å; M128-E132 HydrophobicContact CG-CB 3.51Å; M128-E132 HydrophobicContact CG-CG 4.46Å; M128-E132 WeakPolarHBondContact CG-OE2 3.36Å; M128-E132 HydrophobicContact SD-CB 4.2Å; F129-E132 HydrophobicContact CB-CG 4.4Å; F129-E132 WeakPolarHBondContact CD2-OE2 3.16Å; F129-E132 PolarHBondContact N-OE2 2.94Å; F129-E132 PolarHBondContact O-N 2.93Å; F129-E132 VanDerWaalsContact O-N 3.11Å; E132-R134 VanDerWaalsContact C-N 3.29Å; E132-R134 PolarHBondContact O-N 2.83Å; E132-D135 PolarHBondContact O-N 3.42Å; E132-K136 WeakPolarHBondContact O-CB 3.36Å; E132-K136 PolarHBondContact O-N 2.75Å
133I85.3Confident82.7Confident0 Ų071.1 Ų71.10%037%0.368CS..Hα-helixtrans-59.2-40.9172.3-71168.1000110.8I118 Y121 K122 M128 F129 W131 K136 L137 I159 L163I118-I133 HydrophobicContact CB-CG2 4.32Å; I118-I133 HydrophobicContact CG1-CG2 3.88Å; I118-I133 HydrophobicContact CG2-CG2 4.23Å; Y121-I133 HydrophobicContact CD2-CG2 4.23Å; K122-I133 HydrophobicContact CB-CD1 4.45Å; K122-I133 HydrophobicContact CD-CD1 4.35Å; M128-I133 HydrophobicContact CB-CG1 4.4Å; M128-I133 HydrophobicContact CG-CG1 3.82Å; M128-I133 HydrophobicContact SD-CG1 3.64Å; F129-I133 WeakPolarHBondContact O-CG1 3.37Å; F129-I133 PolarHBondContact O-N 3.45Å; W131-I133 VanDerWaalsContact C-N 3.32Å; W131-I133 PolarHBondContact O-N 2.96Å; I133-K136 PolarHBondContact O-N 2.78Å; I133-L137 HydrophobicContact CG2-CD1 4.27Å; I133-L137 VanDerWaalsContact O-CG 3.25Å; I133-L137 WeakPolarHBondContact O-CG 3.38Å; I133-L137 PolarHBondContact O-N 3.5Å; I133-I159 HydrophobicContact CB-CG2 4.14Å; I133-I159 HydrophobicContact CD1-CG2 4.39Å; I133-I159 HydrophobicContact CG2-CD1 4.27Å; I133-I159 HydrophobicContact CG2-CG2 3.7Å; I133-L163 HydrophobicContact CD1-CD1 3.91Å; I133-L163 HydrophobicContact CD1-CD2 4.17Å
134R84Confident81.9Confident81 Ų8169 Ų6931%0.30637%0.368SS..Hα-helixtrans-63.4-45.3175.8174.8-179.4-179.2-129.11.7111.4W131 E132 K136 L137 L138 S154 I159W131-R134 VanDerWaalsContact O-CB 3.3Å; W131-R134 WeakPolarHBondContact O-CB 3.42Å; W131-R134 PolarHBondContact O-N 3.42Å; W131-R134 VanDerWaalsContact O-N 3.09Å; E132-R134 VanDerWaalsContact C-N 3.29Å; E132-R134 PolarHBondContact O-N 2.83Å; R134-K136 VanDerWaalsContact C-N 3.34Å; R134-L137 WeakPolarHBondContact O-CB 3.45Å; R134-L137 PolarHBondContact O-N 3.39Å; R134-L138 HydrophobicContact CG-CD1 4.1Å; R134-L138 WeakPolarHBondContact O-CG 3.24Å; R134-L138 PolarHBondContact O-N 3.25Å; R134-S154 WeakPolarHBondContact CD-O 3.46Å; R134-S154 VanDerWaalsContact CG-O 3.24Å; R134-S154 WeakPolarHBondContact CG-O 3.37Å; R134-S154 PolarHBondContact NE-O 3.3Å; R134-I159 HydrophobicContact CB-CD1 3.63Å; R134-I159 HydrophobicContact CG-CD1 4.44Å
135D82.7Confident80.8Confident78 Ų7875.2 Ų75.242%0.41739%0.387SS..Hα-helixtrans-71.5-31.3-177.5-67.6-11.6000111.5W131 E132 L138 K139W131-D135 PolarHBondContact O-N 3.16Å; E132-D135 PolarHBondContact O-N 3.42Å; D135-L138 PolarHBondContact O-N 3.18Å; D135-K139 VanDerWaalsContact O-CB 3.26Å; D135-K139 WeakPolarHBondContact O-CB 3.34Å; D135-K139 PolarHBondContact O-N 2.81Å
136K84Confident79.4Confident48 Ų4876.5 Ų76.521%0.20940%0.402CS..Hα-helixtrans-73.9-26.3170-160.2-178.6170.4-170.90113.3Y121 E124 M128 E132 I133 R134 D140Y121-K136 HydrophobicContact CD1-CD 3.66Å; Y121-K136 VanDerWaalsContact CD1-CE 3.48Å; Y121-K136 HydrophobicContact CD1-CG 4.4Å; Y121-K136 VanDerWaalsContact CD1-NZ 3.32Å; Y121-K136 HydrophobicContact CD2-CB 3.92Å; Y121-K136 HydrophobicContact CD2-CD 3.86Å; Y121-K136 HydrophobicContact CD2-CG 4.06Å; Y121-K136 HydrophobicContact CE1-CD 3.63Å; Y121-K136 HydrophobicContact CE1-CG 3.95Å; Y121-K136 HydrophobicContact CE2-CB 3.59Å; Y121-K136 HydrophobicContact CE2-CD 3.86Å; Y121-K136 HydrophobicContact CE2-CG 3.61Å; Y121-K136 HydrophobicContact CG-CD 3.77Å; Y121-K136 HydrophobicContact CG-CG 4.45Å; Y121-K136 PolarHBondContact OH-O 3.37Å; E124-K136 IonicContact OE2-NZ 3.72Å; E124-K136 PolarHBondContact OE2-NZ 3.11Å; M128-K136 HydrophobicContact CE-CD 4.21Å; M128-K136 HydrophobicContact SD-CD 4.46Å; E132-K136 WeakPolarHBondContact O-CB 3.36Å; E132-K136 PolarHBondContact O-N 2.75Å; I133-K136 PolarHBondContact O-N 2.78Å; R134-K136 VanDerWaalsContact C-N 3.34Å; K136-D140 WeakPolarHBondContact O-CB 3.48Å; K136-D140 PolarHBondContact O-N 3.33Å
137L84.6Confident78Confident0 Ų075 Ų750%039%0.391CS..Hα-helixtrans-71.1-38.2169.3-74.5168.4000111.7V114 R117 I118 Y121 I133 R134 V142 C143 I159V114-L137 HydrophobicContact CG1-CD1 4.06Å; V114-L137 HydrophobicContact CG1-CD2 4.36Å; R117-L137 HydrophobicContact CB-CD2 3.85Å; R117-L137 HydrophobicContact CG-CD2 3.82Å; I118-L137 HydrophobicContact CD1-CD1 4.32Å; I118-L137 HydrophobicContact CG1-CD1 3.85Å; Y121-L137 HydrophobicContact CD2-CG 4.48Å; Y121-L137 HydrophobicContact CE2-CD2 3.94Å; Y121-L137 HydrophobicContact CE2-CG 3.94Å; I133-L137 HydrophobicContact CG2-CD1 4.27Å; I133-L137 VanDerWaalsContact O-CG 3.25Å; I133-L137 WeakPolarHBondContact O-CG 3.38Å; I133-L137 PolarHBondContact O-N 3.5Å; R134-L137 WeakPolarHBondContact O-CB 3.45Å; R134-L137 PolarHBondContact O-N 3.39Å; L137-V142 HydrophobicContact CD2-CB 4.03Å; L137-V142 HydrophobicContact CD2-CG1 3.87Å; L137-V142 PolarHBondContact O-N 2.93Å; L137-C143 PolarHBondContact O-N 2.93Å; L137-I159 HydrophobicContact CD1-CD1 4.2Å
138L82.9Confident76.5Confident49 Ų4974 Ų7426%0.25737%0.373SS..Hα-helixtrans-68.9-43.5174.6-74.6162.4000111.6R134 D135 G141 C143 R145R134-L138 HydrophobicContact CG-CD1 4.1Å; R134-L138 WeakPolarHBondContact O-CG 3.24Å; R134-L138 PolarHBondContact O-N 3.25Å; D135-L138 PolarHBondContact O-N 3.18Å; L138-G141 PolarHBondContact O-N 3.24Å; L138-C143 WeakPolarHBondContact CD2-O 3.23Å; L138-R145 HydrophobicContact CD2-CB 4.32Å
139K83.9Confident74.4Confident179 Ų17977.3 Ų77.378%0.77840%0.396SS*.Hα-helixtrans-64.7-40.6-179.3-175.7178.9179.1-178.60112.8D135 G141D135-K139 VanDerWaalsContact O-CB 3.26Å; D135-K139 WeakPolarHBondContact O-CB 3.34Å; D135-K139 PolarHBondContact O-N 2.81Å; K139-G141 PolarHBondContact O-N 2.63Å
140D82.6Confident72.5Confident68 Ų6877.3 Ų77.336%0.36441%0.412SS..THydrogen-bonded Turntrans-86.58.9-177.6-67.827.8000112.5R117 Y121 K136 V142R117-D140 IonicContact CZ-OD2 2.7Å; R117-D140 IonicContact NE-OD2 3.19Å; R117-D140 IonicContact NH2-OD2 2.81Å; R117-D140 PolarHBondContact NH2-OD2 2.93Å; Y121-D140 WeakPolarHBondContact OH-CB 3.32Å; Y121-D140 VanDerWaalsContact OH-CG 3.22Å; Y121-D140 PolarHBondContact OH-OD2 3.45Å; K136-D140 WeakPolarHBondContact O-CB 3.48Å; K136-D140 PolarHBondContact O-N 3.33Å; D140-V142 HydrophobicContact CB-CG2 4.12Å; D140-V142 PolarHBondContact O-N 3.43Å
141G76Confident71Confident56 Ų5678.4 Ų78.458%0.57743%0.427SS*.THydrogen-bonded Turntrans69.912.8176.700000115.3L138 K139 C143L138-G141 PolarHBondContact O-N 3.24Å; K139-G141 PolarHBondContact O-N 2.63Å; G141-C143 VanDerWaalsContact C-N 3.33Å
142V73.9Confident69.6Low53 Ų5375.6 Ų75.632%0.32142%0.42SS..SBendtrans-80.2-18.3-176.2-175.50000111.9V114 R117 L137 D140V114-V142 HydrophobicContact CG2-CG1 4.12Å; R117-V142 HydrophobicContact CB-CG1 4.25Å; R117-V142 HydrophobicContact CG-CG1 4.36Å; R117-V142 HydrophobicContact CG-CG2 4.26Å; L137-V142 HydrophobicContact CD2-CB 4.03Å; L137-V142 HydrophobicContact CD2-CG1 3.87Å; L137-V142 PolarHBondContact O-N 2.93Å; D140-V142 HydrophobicContact CB-CG2 4.12Å; D140-V142 PolarHBondContact O-N 3.43Å
143C70.9Confident68.1Low16 Ų1673 Ų7311%0.10841%0.409CS..SBendtrans-139.5125.6170.9-71.90000110L137 L138 G141L137-C143 PolarHBondContact O-N 2.93Å; L138-C143 WeakPolarHBondContact CD2-O 3.23Å; G141-C143 VanDerWaalsContact C-N 3.33Å
144D69.3Low66.8Low105 Ų10573 Ų7356%0.56141%0.41SS*.  trans-73.7149.2173.4-75.6-58.9000113.1S146 T147 V148D144-S146 VanDerWaalsContact C-N 3.26Å; D144-S146 PolarHBondContact O-N 3.29Å; D144-T147 PolarHBondContact O-N 3.25Å; D144-V148 WeakPolarHBondContact O-CG2 3.46Å
145R63.2Low66.1Low225 Ų22570.4 Ų70.485%0.84940%0.404SS*.SBendtrans-69.5-22.1178.2-164.6172.3-175.4153.90.5113.3L138L138-R145 HydrophobicContact CD2-CB 4.32Å
146S54.8Low65.8Low102 Ų10269.3 Ų69.371%0.71340%0.4SS*.SBendtrans-75.7-30173.947.70000112.7D144 V148D144-S146 VanDerWaalsContact C-N 3.26Å; D144-S146 PolarHBondContact O-N 3.29Å; S146-V148 PolarHBondContact O-N 3.2Å
147T53.6Low65.4Low69 Ų6970.7 Ų70.742%0.42342%0.416SS..SBendtrans-78.230.9178.1-35.30000112.3D144 P149 E152D144-T147 PolarHBondContact O-N 3.25Å; T147-P149 VanDerWaalsContact C-CD 3.44Å; T147-E152 HydrophobicContact CG2-CG 4.37Å; T147-E152 WeakPolarHBondContact O-CB 3.22Å; T147-E152 WeakPolarHBondContact O-CG 3.4Å
148V51.5Low65Low41 Ų4171.1 Ų71.125%0.24842%0.419CS..  trans-129.353.4-177.6-158.60000114.6D144 S146 S150 S154D144-V148 WeakPolarHBondContact O-CG2 3.46Å; S146-V148 PolarHBondContact O-N 3.2Å; V148-S150 PolarHBondContact O-N 2.9Å; V148-S154 WeakPolarHBondContact CG2-OG 3.34Å
149P41.1Very low64.8Low97 Ų9768.8 Ų68.863%0.6341%0.406SS*.SBendtrans-85.877161.535.6-32.6000110.8T147 G151T147-P149 VanDerWaalsContact C-CD 3.44Å; P149-G151 PolarHBondContact O-N 3.38Å
150S45.2Very low64.7Low129 Ų12961.4 Ų61.490%0.90238%0.377SS*.SBendtrans50.515.4163.1-590000119.8V148V148-S150 PolarHBondContact O-N 2.9Å
151G51Low64.5Low46 Ų4664.4 Ų64.447%0.47438%0.384SS..SBendtrans-145.80.3-178.800000116.6P149P149-G151 PolarHBondContact O-N 3.38Å
152E54.5Low64.8Low79 Ų7962.5 Ų62.537%0.36936%0.361SS..SBendtrans-103.5173.2-167.6-69.7-62.815300114T147 S154 S155T147-E152 HydrophobicContact CG2-CG 4.37Å; T147-E152 WeakPolarHBondContact O-CB 3.22Å; T147-E152 WeakPolarHBondContact O-CG 3.4Å; E152-S154 PolarHBondContact O-N 3Å; E152-S155 WeakPolarHBondContact O-CB 3.41Å; E152-S155 PolarHBondContact O-N 2.98Å; E152-S155 VanDerWaalsContact O-N 3.1Å; E152-S155 PolarHBondContact O-OG 3.36Å
153A55.3Low65.1Low11 Ų1160.9 Ų60.99%0.09135%0.35CS..THydrogen-bonded Turntrans-45.1-51.1-167.200000116V109 A110 V114 S155 S158V109-A153 WeakPolarHBondContact O-CA 3.35Å; V109-A153 WeakPolarHBondContact O-CB 3.16Å; V109-A153 PolarHBondContact O-N 3.13Å; A110-A153 HydrophobicContact CB-CB 4.16Å; V114-A153 HydrophobicContact CB-CB 4.47Å; V114-A153 HydrophobicContact CG1-CB 4.02Å; V114-A153 HydrophobicContact CG2-CB 4.44Å; A153-S155 PolarHBondContact O-N 3.15Å; A153-S155 VanDerWaalsContact O-N 3.15Å; A153-S158 WeakPolarHBondContact O-CB 3.42Å
154S58Low65.6Low2 Ų267.6 Ų67.61%0.01437%0.373CS..THydrogen-bonded Turntrans-75.11.5-172.660.70000113.9R134 V148 E152 V156 I159R134-S154 WeakPolarHBondContact CD-O 3.46Å; R134-S154 VanDerWaalsContact CG-O 3.24Å; R134-S154 WeakPolarHBondContact CG-O 3.37Å; R134-S154 PolarHBondContact NE-O 3.3Å; V148-S154 WeakPolarHBondContact CG2-OG 3.34Å; E152-S154 PolarHBondContact O-N 3Å; S154-V156 PolarHBondContact O-N 3.07Å; S154-I159 WeakPolarHBondContact O-CD1 3.16Å
155S70.1Confident65.9Low26 Ų2666.4 Ų66.418%0.18238%0.378CS..  trans-64.3132.617651.50000111.2E152 A153 S157 S158 I159E152-S155 WeakPolarHBondContact O-CB 3.41Å; E152-S155 PolarHBondContact O-N 2.98Å; E152-S155 VanDerWaalsContact O-N 3.1Å; E152-S155 PolarHBondContact O-OG 3.36Å; A153-S155 PolarHBondContact O-N 3.15Å; A153-S155 VanDerWaalsContact O-N 3.15Å; S155-S157 PolarHBondContact O-N 3.37Å; S155-S157 VanDerWaalsContact O-N 3.07Å; S155-S158 WeakPolarHBondContact O-CA 3.29Å; S155-S158 WeakPolarHBondContact O-CB 3.45Å; S155-S158 PolarHBondContact O-N 3.24Å; S155-S158 WeakPolarHBondContact OG-CB 3.36Å; S155-S158 PolarHBondContact OG-OG 3.17Å; S155-I159 PolarHBondContact O-N 2.91Å
156V75.5Confident66.4Low55 Ų5563.3 Ų63.333%0.33337%0.366SS..Hα-helixtrans-55.9-32.2-175.3-176.40000112.3W131 S154 S160W131-V156 HydrophobicContact CB-CG2 4.4Å; S154-V156 PolarHBondContact O-N 3.07Å; V156-S160 VanDerWaalsContact O-CB 3.26Å; V156-S160 WeakPolarHBondContact O-CB 3.29Å; V156-S160 PolarHBondContact O-N 3.2Å; V156-S160 PolarHBondContact O-OG 2.98Å
157S75.8Confident67.2Low77 Ų7761.8 Ų61.854%0.53835%0.347SS..Hα-helixtrans-71.5-28.4173.9-175.90000113.8S155 R161S155-S157 PolarHBondContact O-N 3.37Å; S155-S157 VanDerWaalsContact O-N 3.07Å; S157-R161 VanDerWaalsContact O-CG 3.27Å; S157-R161 WeakPolarHBondContact O-CG 3.19Å; S157-R161 PolarHBondContact O-N 2.83Å; S157-R161 PolarHBondContact O-NE 3.13Å
158S75.4Confident67.5Low8 Ų861 Ų616%0.05635%0.352CS..Hα-helixtrans-77.2-46.5172.8-56.90000111.1V109 A153 S155 S160 R161 V162V109-S158 WeakPolarHBondContact CG1-OG 3.44Å; A153-S158 WeakPolarHBondContact O-CB 3.42Å; S155-S158 WeakPolarHBondContact O-CA 3.29Å; S155-S158 WeakPolarHBondContact O-CB 3.45Å; S155-S158 PolarHBondContact O-N 3.24Å; S155-S158 WeakPolarHBondContact OG-CB 3.36Å; S155-S158 PolarHBondContact OG-OG 3.17Å; S158-S160 VanDerWaalsContact C-N 3.3Å; S158-S160 PolarHBondContact O-N 2.94Å; S158-R161 WeakPolarHBondContact O-CA 3.3Å; S158-R161 WeakPolarHBondContact O-CB 3.44Å; S158-R161 PolarHBondContact O-N 2.61Å; S158-R161 PolarHBondContact OG-NH2 2.97Å; S158-V162 PolarHBondContact O-N 3.31Å
159I79Confident67.7Low0 Ų067 Ų670%038%0.375CS..Hα-helixtrans-54.5-48.5172.1-64.4165000110.1I118 S130 I133 R134 L137 S154 S155 R161 V162 L163I118-I159 HydrophobicContact CD1-CB 4.47Å; I118-I159 HydrophobicContact CD1-CG1 3.84Å; I118-I159 HydrophobicContact CG1-CG1 4.33Å; I118-I159 HydrophobicContact CG2-CG2 4.2Å; S130-I159 WeakPolarHBondContact O-CD1 3.39Å; I133-I159 HydrophobicContact CB-CG2 4.14Å; I133-I159 HydrophobicContact CD1-CG2 4.39Å; I133-I159 HydrophobicContact CG2-CD1 4.27Å; I133-I159 HydrophobicContact CG2-CG2 3.7Å; R134-I159 HydrophobicContact CB-CD1 3.63Å; R134-I159 HydrophobicContact CG-CD1 4.44Å; L137-I159 HydrophobicContact CD1-CD1 4.2Å; S154-I159 WeakPolarHBondContact O-CD1 3.16Å; S155-I159 PolarHBondContact O-N 2.91Å; I159-R161 PolarHBondContact O-N 3.49Å; I159-V162 PolarHBondContact O-N 2.97Å; I159-V162 VanDerWaalsContact O-N 3.15Å; I159-L163 HydrophobicContact CG2-CD1 3.97Å; I159-L163 HydrophobicContact CG2-CG 4.27Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.46Å; I159-L163 PolarHBondContact O-N 3.44Å
160S81.9Confident68.2Low24 Ų2468.6 Ų68.617%0.16837%0.372CS..Hα-helixtrans-64.6-22178-55.70000114.1S130 V156 S158 R164S130-S160 VanDerWaalsContact CB-OG 3.24Å; S130-S160 WeakPolarHBondContact CB-OG 3.28Å; S130-S160 PolarHBondContact OG-OG 2.79Å; V156-S160 VanDerWaalsContact O-CB 3.26Å; V156-S160 WeakPolarHBondContact O-CB 3.29Å; V156-S160 PolarHBondContact O-N 3.2Å; V156-S160 PolarHBondContact O-OG 2.98Å; S158-S160 VanDerWaalsContact C-N 3.3Å; S158-S160 PolarHBondContact O-N 2.94Å; S160-R164 WeakPolarHBondContact O-CG 3.37Å; S160-R164 VanDerWaalsContact O-CZ 3.26Å; S160-R164 PolarHBondContact O-N 3Å; S160-R164 PolarHBondContact O-NH1 2.91Å
161R78.8Confident68.4Low131 Ų13169 Ų6949%0.49437%0.365SS..Hα-helixtrans-79.1-43.5172-78.8176.4-69.2168.33.1111.5S157 S158 I159 R164 A165S157-R161 VanDerWaalsContact O-CG 3.27Å; S157-R161 WeakPolarHBondContact O-CG 3.19Å; S157-R161 PolarHBondContact O-N 2.83Å; S157-R161 PolarHBondContact O-NE 3.13Å; S158-R161 WeakPolarHBondContact O-CA 3.3Å; S158-R161 WeakPolarHBondContact O-CB 3.44Å; S158-R161 PolarHBondContact O-N 2.61Å; S158-R161 PolarHBondContact OG-NH2 2.97Å; I159-R161 PolarHBondContact O-N 3.49Å; R161-R164 PolarHBondContact O-N 3.15Å; R161-A165 WeakPolarHBondContact O-CB 3.45Å; R161-A165 PolarHBondContact O-N 3.3Å
162V81.5Confident68.3Low16 Ų1674.1 Ų74.110%0.09738%0.381CS..Hα-helixtrans-59.1-48.4173.4175.30000110.2E115 I118 S158 I159 R164 A165 R166E115-V162 HydrophobicContact CG-CG2 4.26Å; I118-V162 HydrophobicContact CB-CG1 4.46Å; I118-V162 HydrophobicContact CD1-CG2 4.48Å; I118-V162 HydrophobicContact CG2-CB 4.43Å; I118-V162 HydrophobicContact CG2-CG1 3.97Å; S158-V162 PolarHBondContact O-N 3.31Å; I159-V162 PolarHBondContact O-N 2.97Å; I159-V162 VanDerWaalsContact O-N 3.15Å; V162-R164 PolarHBondContact O-N 3.36Å; V162-A165 PolarHBondContact O-N 3.01Å; V162-A165 VanDerWaalsContact O-N 3.16Å; V162-R166 HydrophobicContact CG1-CG 4.47Å; V162-R166 WeakPolarHBondContact O-CB 3.11Å; V162-R166 VanDerWaalsContact O-CG 3.28Å; V162-R166 WeakPolarHBondContact O-CG 3.48Å; V162-R166 PolarHBondContact O-N 2.93Å
163L81.3Confident68.2Low19 Ų1977.8 Ų77.810%0.09940%0.398CS..Hα-helixtrans-57.9-49.2178.5-68.9177.1000112.5I118 K122 I133 I159 A165 R166 F167 G168I118-L163 HydrophobicContact CG2-CD2 3.86Å; I118-L163 HydrophobicContact CG2-CG 4.22Å; K122-L163 HydrophobicContact CB-CD2 3.84Å; K122-L163 HydrophobicContact CD-CD2 4.13Å; K122-L163 HydrophobicContact CG-CD2 3.74Å; I133-L163 HydrophobicContact CD1-CD1 3.91Å; I133-L163 HydrophobicContact CD1-CD2 4.17Å; I159-L163 HydrophobicContact CG2-CD1 3.97Å; I159-L163 HydrophobicContact CG2-CG 4.27Å; I159-L163 VanDerWaalsContact O-CG 3.31Å; I159-L163 WeakPolarHBondContact O-CG 3.46Å; I159-L163 PolarHBondContact O-N 3.44Å; L163-A165 VanDerWaalsContact C-N 3.31Å; L163-A165 PolarHBondContact O-N 2.78Å; L163-R166 PolarHBondContact O-N 3.06Å; L163-F167 HydrophobicContact CD2-CD2 4Å; L163-F167 HydrophobicContact CD2-CE2 4.08Å; L163-F167 WeakPolarHBondContact O-CB 2.99Å; L163-F167 PolarHBondContact O-N 3.11Å; L163-G168 PolarHBondContact O-N 3.2Å
164R80.2Confident67.8Low157 Ų15783 Ų8359%0.59242%0.424SS*.Hα-helixtrans-63.6-35176.6-75.6-170.5-61.2-92.61.4113.1S160 R161 V162 R166 G168S160-R164 WeakPolarHBondContact O-CG 3.37Å; S160-R164 VanDerWaalsContact O-CZ 3.26Å; S160-R164 PolarHBondContact O-N 3Å; S160-R164 PolarHBondContact O-NH1 2.91Å; R161-R164 PolarHBondContact O-N 3.15Å; V162-R164 PolarHBondContact O-N 3.36Å; R164-R166 VanDerWaalsContact C-N 3.25Å; R164-R166 PolarHBondContact O-N 3.35Å; R164-G168 PolarHBondContact O-N 3.45Å
165A76.9Confident67.3Low80 Ų8090.7 Ų90.766%0.66147%0.465SS*.Hα-helixtrans-73.9-12179.800000114.4R161 V162 L163R161-A165 WeakPolarHBondContact O-CB 3.45Å; R161-A165 PolarHBondContact O-N 3.3Å; V162-A165 PolarHBondContact O-N 3.01Å; V162-A165 VanDerWaalsContact O-N 3.16Å; L163-A165 VanDerWaalsContact C-N 3.31Å; L163-A165 PolarHBondContact O-N 2.78Å
166R74Confident65.8Low161 Ų16195.1 Ų95.161%0.60850%0.495SS*.Hα-helixtrans-126.1-31.6-171.5-57.7-70.1-95.9179.3-3.6114.1E119 V162 L163 R164E119-R166 IonicContact OE1-CZ 3.3Å; E119-R166 IonicContact OE1-NE 3.16Å; E119-R166 PolarHBondContact OE1-NE 2.96Å; E119-R166 IonicContact OE1-NH2 3.75Å; E119-R166 PolarHBondContact OE1-NH2 2.96Å; E119-R166 IonicContact OE2-NH2 3.99Å; E119-R166 PolarHBondContact OE2-NH2 3.42Å; V162-R166 HydrophobicContact CG1-CG 4.47Å; V162-R166 WeakPolarHBondContact O-CB 3.11Å; V162-R166 VanDerWaalsContact O-CG 3.28Å; V162-R166 WeakPolarHBondContact O-CG 3.48Å; V162-R166 PolarHBondContact O-N 2.93Å; L163-R166 PolarHBondContact O-N 3.06Å; R164-R166 VanDerWaalsContact C-N 3.25Å; R164-R166 PolarHBondContact O-N 3.35Å
167F70.2Confident64.4Low70 Ų7099.8 Ų99.831%0.30752%0.518SS..THydrogen-bonded Turntrans-111-35178.9-63.2-92000112.7E119 K122 L163 K169 K170E119-F167 HydrophobicContact CG-CE2 4.3Å; K122-F167 HydrophobicContact CB-CE1 4.31Å; K122-F167 HydrophobicContact CB-CE2 3.91Å; K122-F167 HydrophobicContact CB-CZ 3.74Å; K122-F167 HydrophobicContact CG-CD1 4.23Å; K122-F167 HydrophobicContact CG-CD2 4.15Å; K122-F167 HydrophobicContact CG-CE1 3.98Å; K122-F167 HydrophobicContact CG-CE2 3.91Å; K122-F167 HydrophobicContact CG-CG 4.31Å; K122-F167 HydrophobicContact CG-CZ 3.82Å; L163-F167 HydrophobicContact CD2-CD2 4Å; L163-F167 HydrophobicContact CD2-CE2 4.08Å; L163-F167 WeakPolarHBondContact O-CB 2.99Å; L163-F167 PolarHBondContact O-N 3.11Å; F167-K169 PolarHBondContact O-N 2.75Å; F167-K170 PolarHBondContact O-N 3.31Å
168G60Low63.1Low52 Ų52105.4 Ų105.454%0.53653%0.533SS..THydrogen-bonded Turntrans-72.939.3-178.300000115.4L163 R164L163-G168 PolarHBondContact O-N 3.2Å; R164-G168 PolarHBondContact O-N 3.45Å
169K55.7Low61.4Low167 Ų167114.7 Ų114.773%0.72657%0.572SS**THydrogen-bonded Turntrans-154.525.9176.2-153.2-135.3172.9-140.90112.3F167F167-K169 PolarHBondContact O-N 2.75Å
170K51.9Low59.4Low130 Ų130122 Ų12257%0.56561%0.612SS**SBendtrans-134.73.6-175.8-145.6-164.5174.2-75.90114.7F167 D174F167-K170 PolarHBondContact O-N 3.31Å; K170-D174 IonicContact NZ-OD2 3.97Å; K170-D174 PolarHBondContact NZ-OD2 3.35Å
171D48.8Very low57.4Low139 Ų139130 Ų13074%0.74365%0.646SS**SBendtrans-100.82.1-173.2-52.9-38.4000112.6
172D49.1Very low55.4Low153 Ų153131.9 Ų131.982%0.81867%0.666SS**SBendtrans-110-5-173.9-61.5-68.8000114.8
173E53.8Low53.1Low155 Ų155134 Ų13472%0.72469%0.692SS**SBendtrans-121.9-5.7-169.7-70.1179.4-179.300115.1
174D45.8Very low51.2Low120 Ų120140.3 Ų140.364%0.64272%0.72SS**SBendtrans-112.85.1-169.8-80.2-41.3000115.2K170K170-D174 IonicContact NZ-OD2 3.97Å; K170-D174 PolarHBondContact NZ-OD2 3.35Å
175D47.2Very low49.4Very low164 Ų164140 Ų14088%0.87772%0.723SS**  trans-125.458.9-176.7-167.640.3000114.6
176C38.7Very low47.6Very low120 Ų120145.7 Ų145.781%0.81173%0.733SS**  trans-145.227.3174.150.10000115.1
177D46.5Very low46Very low153 Ų153144.6 Ų144.682%0.81874%0.744SS**  trans-114.669.9174.3-161.1-10.8000111.9
178K47.9Very low45.1Very low194 Ų194149.7 Ų149.784%0.84377%0.767SS**  trans-178.6100.7160.4-102.9150-166.8157.60113
179K39.4Very low44.6Very low203 Ų203156.1 Ų156.188%0.88378%0.782SS**  169.8136.7123-94.4166.7-176.7177.90111.7
180D38.7Very low44Very low155 Ų155153.8 Ų153.883%0.82979%0.787SS**  trans-83.3175.4174-51.1-93.9000113
181E39.3Very low44Very low190 Ų190154.6 Ų154.689%0.88880%0.796SS**  trans72.1118.4163.8-62.2-161.4116.100121.4
182D36.9Very low44Very low171 Ų171155 Ų15591%0.91480%0.798SS**  trans66.9158143.3-159.430.1000120.7
183G33.5Very low43.9Very low62 Ų62151.5 Ų151.564%0.63980%0.798SS**  trans119.983.7167.100000115.6
184E41.7Very low43.6Very low150 Ų150150.7 Ų150.770%0.70180%0.797SS**  trans-63.6140.5165.1-12.2149.586.900111.2
185K41.8Very low43.6Very low151 Ų151153 Ų15366%0.65781%0.809SS**  159.1115.9123.7-83.3146-149.885.30114.4
186K38.1Very low43.2Very low200 Ų200148.3 Ų148.387%0.8780%0.8SS**  trans66.5157.8156.3-56.3168.2-177.7172.40114.4
187T41.5Very low43.5Very low137 Ų137150 Ų15084%0.8480%0.8SS**  cis-120.6166.312.647.30000113.1
188K51.2Low43.1Very low178 Ų178152.7 Ų152.777%0.77481%0.805SS**  trans-88.5164.9170.2-66.7179.3178.4179.90110.1
189H49.8Very low42.4Very low187 Ų187148.5 Ų148.587%0.86680%0.799SS**  trans81.675171.3-41-70.2000116.5
190S42.9Very low42.3Very low118 Ų118146 Ų14683%0.82580%0.795SS**  trans-124.8155.7148.1-169.30000109.3D192S190-D192 PolarHBondContact O-N 2.86Å
191I50.6Low42.1Very low146 Ų146148.8 Ų148.875%0.74979%0.794SS**THydrogen-bonded Turntrans-93.623.3-156.6-162.7162.5000115.4
192D49.8Very low41.9Very low147 Ų147145 Ų14579%0.78678%0.784SS**THydrogen-bonded Turntrans-76.2-25.8-172.2-150.850.7000113.8S190 I194S190-D192 PolarHBondContact O-N 2.86Å; D192-I194 VanDerWaalsContact C-N 3.26Å; D192-I194 PolarHBondContact O-N 3.07Å
193G47.4Very low41.7Very low80 Ų80144.4 Ų144.483%0.82578%0.781SS**THydrogen-bonded Turntrans-77.527.8-17100000117.6
194I47.3Very low41.7Very low138 Ų138149.2 Ų149.271%0.70879%0.792SS**THydrogen-bonded Turntrans-117.5-18.8-177.2-69.2-179.1000113.7D192D192-I194 VanDerWaalsContact C-N 3.26Å; D192-I194 PolarHBondContact O-N 3.07Å
195L46.1Very low41.4Very low169 Ų169144.9 Ų144.989%0.88579%0.787SS**SBendtrans-12711.5-178-74.4167.2000114.2
196G38.6Very low41Very low66 Ų66143.4 Ų143.468%0.6880%0.796SS**  trans-96122.1176.900000113.8
197D43.6Very low41.2Very low154 Ų154140.8 Ų140.882%0.82479%0.791SS**  trans-21.2135.6179.9-69.3-89.1000122.5
198K39.7Very low41Very low210 Ų210140.5 Ų140.591%0.91379%0.789SS**  trans-149.1101.1137.2-110.6172.8-179.1174.70108.5
199C32.9Very low40.7Very low106 Ų106138.5 Ų138.572%0.71679%0.787SS**  88.891.862.7-172.10000114.1
200N36.7Very low40.1Very low151 Ų151134.9 Ų134.981%0.80778%0.783SS**  trans66.9158.7131.7-150.92.9000121.2
201R34.3Very low40Very low213 Ų213136.2 Ų136.280%0.80478%0.776SS**  trans75.9137-174.3-64.2-179.7163.2-97.1-1.5115
202T35.3Very low39.8Very low112 Ų112134.5 Ų134.569%0.68777%0.774SS**  cis-150.2143.23.1-4.90000112.2
203D33.3Very low39.3Very low158 Ų158133 Ų13385%0.84577%0.767SS**  trans21.9110.9136.4-158.2-140.6000120.2
204D32.7Very low39Very low163 Ų163136 Ų13687%0.87276%0.762SS**  trans-157.8155.4135.2-169.919.6000108.6
205G36.6Very low38.8Very low58 Ų58133.9 Ų133.960%0.59876%0.758SS**  trans-103.6151.9-160.700000117.1
206S33.3Very low38.7Very low120 Ų120132.6 Ų132.684%0.83975%0.751SS**  trans-159107.1144.69.10000110.8
207D42.4Very low38.9Very low145 Ų145138.7 Ų138.778%0.77576%0.759SS**  trans-68.9132.3168.2169.627.3000110.6D209D207-D209 PolarHBondContact OD1-N 2.82Å
208V36.2Very low38.9Very low132 Ų132142.7 Ų142.780%0.876%0.763SS**  trans-147.665165.1-79.10000110.1S210V208-S210 PolarHBondContact O-N 3.33Å
209D44.8Very low39.3Very low135 Ų135142.6 Ų142.672%0.72276%0.762SS**  trans-54.7121.4162.8-177.6-117.9000111.2D207D207-D209 PolarHBondContact OD1-N 2.82Å
210S36.9Very low39.9Very low112 Ų112145.5 Ų145.578%0.78377%0.765SS**  trans-169.654.1173-81.30000111.6V208V208-S210 PolarHBondContact O-N 3.33Å
211E41.2Very low40.8Very low146 Ų146146.2 Ų146.268%0.68276%0.757SS**  trans-65.2143.7146.1-107.9-84124.100108D213E211-D213 PolarHBondContact OE2-N 3.46Å
212P47.2Very low42.2Very low109 Ų109147.2 Ų147.271%0.70876%0.761SS**  -142.4139.691.935.3-20.7000115.1L214P212-L214 PolarHBondContact O-N 3.36Å
213D39.5Very low43.7Very low117 Ų117146.9 Ų146.963%0.62676%0.762SS**  trans-38.1105.2168.617921.1000112.1E211 P215E211-D213 PolarHBondContact OE2-N 3.46Å; D213-P215 WeakPolarHBondContact O-CD 3.47Å
214L40.5Very low46.1Very low141 Ų141149.7 Ų149.774%0.73876%0.761SS**  trans-90.997.8159.4-76.2177.2000107.4P212 L216P212-L214 PolarHBondContact O-N 3.36Å; L214-L216 VanDerWaalsContact C-N 3.32Å; L214-L216 PolarHBondContact O-N 3.04Å
215P43.3Very low48.6Very low95 Ų95144 Ų14462%0.61773%0.733SS**  trans-6693-18024.9-35.4000109.8D213 K217D213-P215 WeakPolarHBondContact O-CD 3.47Å; P215-K217 VanDerWaalsContact C-N 3.28Å; P215-K217 PolarHBondContact O-N 2.99Å
216L43.6Very low51.1Low142 Ų142147.1 Ų147.174%0.74374%0.74SS**  trans-62.987.6-179-70.8179.7000109.5L214 R218L214-L216 VanDerWaalsContact C-N 3.32Å; L214-L216 PolarHBondContact O-N 3.04Å; L216-R218 PolarHBondContact O-N 2.81Å
217K44.1Very low53.9Low194 Ų194144.5 Ų144.584%0.84371%0.714SS**  trans-49.7102.4-177.2-83.5-179.9173.8172.70110.2P215 K219P215-K217 VanDerWaalsContact C-N 3.28Å; P215-K217 PolarHBondContact O-N 2.99Å; K217-K219 PolarHBondContact O-N 2.77Å
218R43.5Very low56.4Low238 Ų238140.9 Ų140.990%0.89870%0.697SS**  trans-50101.1-178.7-58.9178.8-169.593.94.8108.6L216 Q220L216-R218 PolarHBondContact O-N 2.81Å; R218-Q220 VanDerWaalsContact C-N 3.27Å; R218-Q220 PolarHBondContact O-N 3.35Å
219K46.8Very low59.2Low207 Ų207138.6 Ų138.690%0.969%0.692SS**  trans-80.481.7-167.6-147.2161.5-169.1167.60108.8K217 R221K217-K219 PolarHBondContact O-N 2.77Å; K219-R221 PolarHBondContact O-N 3.04Å
220Q45.7Very low61.5Low168 Ų168139.4 Ų139.479%0.78569%0.692SS**  trans-39.1110.8-167.3-174.866.8-2.500111.6R218 R222R218-Q220 VanDerWaalsContact C-N 3.27Å; R218-Q220 PolarHBondContact O-N 3.35Å; Q220-R222 PolarHBondContact O-N 2.8Å; Q220-R222 VanDerWaalsContact O-N 3.09Å
221R55.9Low64.4Low166 Ų166135.5 Ų135.563%0.62666%0.661SS**  trans-63.1117.5-170.5-159-17176.6-145.3-5.5108.9E92 K219 S223E92-R221 WeakPolarHBondContact OE1-CD 3.42Å; K219-R221 PolarHBondContact O-N 3.04Å; R221-S223 PolarHBondContact O-N 3Å; R221-S223 VanDerWaalsContact O-N 3.11Å
222R64Low67Low234 Ų234131.4 Ų131.488%0.88364%0.643SS**  trans-45.5120.5-173.6-172.7-177.7-68.9-132.63.5110.3Q220 R224Q220-R222 PolarHBondContact O-N 2.8Å; Q220-R222 VanDerWaalsContact O-N 3.09Å; R222-R224 PolarHBondContact O-N 3.06Å
223S66.2Low69.4Low104 Ų104132.7 Ų132.773%0.72764%0.64SS**PPolyproline II helixtrans-51.8133.4-169.5-57.10000111.8R221 T225R221-S223 PolarHBondContact O-N 3Å; R221-S223 VanDerWaalsContact O-N 3.11Å; S223-T225 PolarHBondContact O-N 2.9Å
224R84.6Confident72.1Confident217 Ų217129 Ų12982%0.81962%0.619SS**PPolyproline II helixtrans-74123178.7-177.9-176.7179.7109.85.1108.7R222 T226R222-R224 PolarHBondContact O-N 3.06Å; R224-T226 PolarHBondContact O-N 3.18Å; R224-T226 VanDerWaalsContact O-N 3.13Å
225T84.9Confident74.8Confident45 Ų45122.2 Ų122.228%0.27658%0.584SS.*PPolyproline II helixtrans-54.5117.2170.4-460000110.4S223 L259 R263S223-T225 PolarHBondContact O-N 2.9Å; T225-L259 HydrophobicContact CG2-CD2 4.05Å; T225-R263 HydrophobicContact CG2-CG 4.48Å; T225-R263 VanDerWaalsContact OG1-CD 3.28Å; T225-R263 WeakPolarHBondContact OG1-CD 3.42Å
226T89Confident77.4Confident123 Ų123120.6 Ų120.676%0.75557%0.568SS**PPolyproline II helixtrans-95.9129.8164.145.40000107.7R224R224-T226 PolarHBondContact O-N 3.18Å; R224-T226 VanDerWaalsContact O-N 3.13Å
227F92.7Very high79.9Confident65 Ų65119.3 Ų119.329%0.28556%0.556SS.*PPolyproline II helixtrans-88.1141.5177.3-58.5-102.6000108.9Q231 L232 L235 L259 W267F227-Q231 VanDerWaalsContact CA-OE1 3.3Å; F227-Q231 HydrophobicContact CB-CB 4.43Å; F227-L232 HydrophobicContact CB-CD1 4.31Å; F227-L232 HydrophobicContact CB-CD2 3.73Å; F227-L232 HydrophobicContact CB-CG 3.75Å; F227-L232 HydrophobicContact CD1-CD2 4.43Å; F227-L232 HydrophobicContact CG-CD2 4.03Å; F227-L235 HydrophobicContact CD1-CD1 3.95Å; F227-L235 HydrophobicContact CE1-CD1 3.95Å; F227-L259 HydrophobicContact CD1-CD1 3.67Å; F227-L259 HydrophobicContact CE1-CD1 3.54Å; F227-W267 HydrophobicContact CE1-CB 4.17Å; F227-W267 AromaticContact CE1-CD1 3.63Å; F227-W267 HydrophobicContact CE1-CG 4.17Å; F227-W267 HydrophobicContact CZ-CB 4.02Å; F227-W267 AromaticContact CZ-CD1 3.64Å; F227-W267 HydrophobicContact CZ-CG 4.21Å
228T94.8Very high82.4Confident69 Ų69110.7 Ų110.742%0.42352%0.521SS..PPolyproline II helixtrans-73.9169.6168.270.10000110.7Q231 L232T228-Q231 PolarHBondContact O-N 2.84Å; T228-Q231 WeakPolarHBondContact OG1-CB 3.2Å; T228-Q231 VanDerWaalsContact OG1-CG 3.23Å; T228-Q231 WeakPolarHBondContact OG1-CG 3.24Å; T228-Q231 PolarHBondContact OG1-N 2.99Å; T228-Q231 VanDerWaalsContact OG1-N 3.13Å; T228-L232 WeakPolarHBondContact O-CG 3.45Å; T228-L232 PolarHBondContact O-N 3.26Å; T228-L232 VanDerWaalsContact O-N 3.12Å
229A93.8Very high85Confident84 Ų8499.6 Ų99.669%0.69448%0.479SS*.Hα-helixtrans-62.4-50.5175.800000111.5Q231 L232 E233A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 3.21Å; A229-L232 CarbonylContact O-C 3.6Å; A229-L232 WeakPolarHBondContact O-CA 3.45Å; A229-L232 WeakPolarHBondContact O-CB 3.41Å; A229-L232 PolarHBondContact O-N 3.04Å; A229-E233 PolarHBondContact O-N 2.82Å
230E94.5Very high87.3Confident152 Ų15297 Ų9771%0.7147%0.47SS*.Hα-helixtrans-51.8-45.9173.1179.1-166.9-166.600112.8L232 E233 E234E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 2.89Å; E230-E233 PolarHBondContact O-N 3.3Å; E230-E234 PolarHBondContact O-N 3.14Å
231Q95.9Very high89.7Confident30 Ų3099.6 Ų99.614%0.1447%0.473CS..Hα-helixtrans-63.4-33.6176.1-75.4173.9-18.200112.6F227 T228 A229 L235 T257F227-Q231 VanDerWaalsContact CA-OE1 3.3Å; F227-Q231 HydrophobicContact CB-CB 4.43Å; T228-Q231 PolarHBondContact O-N 2.84Å; T228-Q231 WeakPolarHBondContact OG1-CB 3.2Å; T228-Q231 VanDerWaalsContact OG1-CG 3.23Å; T228-Q231 WeakPolarHBondContact OG1-CG 3.24Å; T228-Q231 PolarHBondContact OG1-N 2.99Å; T228-Q231 VanDerWaalsContact OG1-N 3.13Å; A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 3.21Å; Q231-L235 WeakPolarHBondContact O-CB 3.44Å; Q231-L235 VanDerWaalsContact O-CD1 3.22Å; Q231-L235 WeakPolarHBondContact O-CD1 3.49Å; Q231-L235 WeakPolarHBondContact O-CG 3.48Å; Q231-L235 PolarHBondContact O-N 2.82Å; Q231-T257 PolarHBondContact NE2-O 3.31Å
232L97.2Very high91.6Very high60 Ų6094.1 Ų94.131%0.31446%0.458SS..Hα-helixtrans-75.1-36.7175.6-69.5171.3000111.5F227 T228 A229 E230 L235 E236 W267F227-L232 HydrophobicContact CB-CD1 4.31Å; F227-L232 HydrophobicContact CB-CD2 3.73Å; F227-L232 HydrophobicContact CB-CG 3.75Å; F227-L232 HydrophobicContact CD1-CD2 4.43Å; F227-L232 HydrophobicContact CG-CD2 4.03Å; T228-L232 WeakPolarHBondContact O-CG 3.45Å; T228-L232 PolarHBondContact O-N 3.26Å; T228-L232 VanDerWaalsContact O-N 3.12Å; A229-L232 CarbonylContact O-C 3.6Å; A229-L232 WeakPolarHBondContact O-CA 3.45Å; A229-L232 WeakPolarHBondContact O-CB 3.41Å; A229-L232 PolarHBondContact O-N 3.04Å; E230-L232 VanDerWaalsContact C-N 3.29Å; E230-L232 PolarHBondContact O-N 2.89Å; L232-L235 PolarHBondContact O-N 3.19Å; L232-E236 WeakPolarHBondContact O-CB 3.41Å; L232-E236 WeakPolarHBondContact O-CG 3.37Å; L232-E236 PolarHBondContact O-N 2.66Å; L232-W267 VanDerWaalsContact CD2-NE1 3.29Å
233E96.8Very high93.1Very high136 Ų13686 Ų8664%0.63643%0.43SS*.Hα-helixtrans-61.5-53.6179.7-170.1-178.6155.800112A229 E230 L235 E236 K237A229-E233 PolarHBondContact O-N 2.82Å; E230-E233 PolarHBondContact O-N 3.3Å; E233-L235 VanDerWaalsContact C-N 3.27Å; E233-L235 PolarHBondContact O-N 3.18Å; E233-E236 PolarHBondContact O-N 2.89Å; E233-K237 VanDerWaalsContact O-CB 3.22Å; E233-K237 WeakPolarHBondContact O-CB 3.11Å; E233-K237 PolarHBondContact O-N 3Å
234E96.4Very high94.6Very high38 Ų3888.5 Ų88.518%0.17843%0.425CS..Hα-helixtrans-64.9-31.6178.3-17574.7165.300111.7E230 K237 A238 L253 R256E230-E234 PolarHBondContact O-N 3.14Å; E234-K237 WeakPolarHBondContact OE2-CD 3.36Å; E234-K237 IonicContact OE2-NZ 3.35Å; E234-K237 PolarHBondContact OE2-NZ 3.4Å; E234-A238 VanDerWaalsContact O-CB 3.24Å; E234-A238 WeakPolarHBondContact O-CB 3.24Å; E234-A238 PolarHBondContact O-N 3.28Å; E234-L253 HydrophobicContact CG-CD2 4.05Å; E234-R256 VanDerWaalsContact OE1-CD 3.24Å; E234-R256 WeakPolarHBondContact OE1-CD 3.36Å; E234-R256 IonicContact OE1-CZ 2.7Å; E234-R256 IonicContact OE1-NE 2.72Å; E234-R256 IonicContact OE1-NH1 2.59Å; E234-R256 PolarHBondContact OE1-NH1 3.5Å
235L97.4Very high95.1Very high0 Ų078.6 Ų78.60%039%0.388CS..Hα-helixtrans-71-36.1173.6-72.9173.1000113.2F227 Q231 L232 E233 F239 L253 T257 V264 W267 F268F227-L235 HydrophobicContact CD1-CD1 3.95Å; F227-L235 HydrophobicContact CE1-CD1 3.95Å; Q231-L235 WeakPolarHBondContact O-CB 3.44Å; Q231-L235 VanDerWaalsContact O-CD1 3.22Å; Q231-L235 WeakPolarHBondContact O-CD1 3.49Å; Q231-L235 WeakPolarHBondContact O-CG 3.48Å; Q231-L235 PolarHBondContact O-N 2.82Å; L232-L235 PolarHBondContact O-N 3.19Å; E233-L235 VanDerWaalsContact C-N 3.27Å; E233-L235 PolarHBondContact O-N 3.18Å; L235-F239 WeakPolarHBondContact O-CB 3.49Å; L235-F239 PolarHBondContact O-N 3.47Å; L235-L253 HydrophobicContact CD2-CB 4.47Å; L235-T257 HydrophobicContact CD2-CG2 4.43Å; L235-T257 HydrophobicContact CG-CG2 4.13Å; L235-V264 HydrophobicContact CD2-CG1 3.92Å; L235-V264 HydrophobicContact CD2-CG2 4.34Å; L235-W267 HydrophobicContact CB-CD2 4.09Å; L235-W267 HydrophobicContact CB-CE3 4.03Å; L235-W267 HydrophobicContact CB-CH2 3.83Å; L235-W267 HydrophobicContact CB-CZ2 3.85Å; L235-W267 HydrophobicContact CB-CZ3 3.92Å; L235-W267 HydrophobicContact CD1-CB 4.5Å; L235-W267 HydrophobicContact CD1-CD2 3.92Å; L235-W267 HydrophobicContact CD1-CE3 4.43Å; L235-W267 HydrophobicContact CD1-CG 3.89Å; L235-W267 HydrophobicContact CD2-CE3 4.4Å; L235-W267 HydrophobicContact CG-CD2 4.45Å; L235-W267 WeakPolarHBondContact O-CH2 3.42Å; L235-W267 WeakPolarHBondContact O-CZ3 3.44Å; L235-F268 HydrophobicContact CD2-CE2 3.87Å
236E97.1Very high95.7Very high61 Ų6179.7 Ų79.729%0.28539%0.392SS..Hα-helixtrans-77.1-41.1178.3-69.8-166.4-178.100111.8L232 E233 A238 F239 E240 W267 R271L232-E236 WeakPolarHBondContact O-CB 3.41Å; L232-E236 WeakPolarHBondContact O-CG 3.37Å; L232-E236 PolarHBondContact O-N 2.66Å; E233-E236 PolarHBondContact O-N 2.89Å; E236-A238 VanDerWaalsContact C-N 3.3Å; E236-A238 PolarHBondContact O-N 3.07Å; E236-F239 CarbonylContact O-C 3.52Å; E236-F239 WeakPolarHBondContact O-CA 3.36Å; E236-F239 VanDerWaalsContact O-CB 3.31Å; E236-F239 WeakPolarHBondContact O-CB 3.44Å; E236-F239 PolarHBondContact O-N 2.98Å; E236-E240 WeakPolarHBondContact O-CG 3.22Å; E236-E240 PolarHBondContact O-N 3.47Å; E236-W267 HydrophobicContact CB-CH2 4.5Å; E236-W267 HydrophobicContact CG-CH2 3.6Å; E236-W267 HydrophobicContact CG-CZ2 3.49Å; E236-W267 VanDerWaalsContact CG-CZ2 3.49Å; E236-R271 IonicContact OE1-CZ 2.73Å; E236-R271 VanDerWaalsContact OE1-CZ 3.3Å; E236-R271 IonicContact OE1-NE 3.91Å; E236-R271 IonicContact OE1-NH1 2.69Å; E236-R271 PolarHBondContact OE1-NH1 3.08Å; E236-R271 IonicContact OE1-NH2 3.88Å; E236-R271 IonicContact OE2-CZ 3.13Å; E236-R271 IonicContact OE2-NH1 2.83Å; E236-R271 PolarHBondContact OE2-NH1 2.93Å; E236-R271 IonicContact OE2-NH2 2.93Å; E236-R271 PolarHBondContact OE2-NH2 2.93Å
237K96.8Very high96.1Very high114 Ų11477 Ų7750%0.49637%0.373SS..Hα-helixtrans-57.4-38.5168.9177.7178.4164.8-155.20112.9E233 E234 R241E233-K237 VanDerWaalsContact O-CB 3.22Å; E233-K237 WeakPolarHBondContact O-CB 3.11Å; E233-K237 PolarHBondContact O-N 3Å; E234-K237 WeakPolarHBondContact OE2-CD 3.36Å; E234-K237 IonicContact OE2-NZ 3.35Å; E234-K237 PolarHBondContact OE2-NZ 3.4Å; K237-R241 PolarHBondContact O-N 3.48Å
238A96.5Very high96.4Very high13 Ų1382 Ų8211%0.10739%0.391CS..Hα-helixtrans-72.7-32.9172.100000113.1E234 E236 E240 R241 T242 L253 F268E234-A238 VanDerWaalsContact O-CB 3.24Å; E234-A238 WeakPolarHBondContact O-CB 3.24Å; E234-A238 PolarHBondContact O-N 3.28Å; E236-A238 VanDerWaalsContact C-N 3.3Å; E236-A238 PolarHBondContact O-N 3.07Å; A238-E240 VanDerWaalsContact C-N 3.33Å; A238-R241 PolarHBondContact O-N 3.35Å; A238-T242 PolarHBondContact O-N 3.09Å; A238-L253 HydrophobicContact CB-CD1 3.64Å; A238-L253 HydrophobicContact CB-CD2 3.7Å; A238-L253 HydrophobicContact CB-CG 4.31Å; A238-F268 HydrophobicContact CB-CZ 4.11Å
239F97.3Very high96.5Very high6 Ų681.1 Ų81.13%0.02639%0.385CS..Hα-helixtrans-66-34175.1-173-96000112.7L235 E236 T242 H243 W267 F268 R271 R272 W275L235-F239 WeakPolarHBondContact O-CB 3.49Å; L235-F239 PolarHBondContact O-N 3.47Å; E236-F239 CarbonylContact O-C 3.52Å; E236-F239 WeakPolarHBondContact O-CA 3.36Å; E236-F239 VanDerWaalsContact O-CB 3.31Å; E236-F239 WeakPolarHBondContact O-CB 3.44Å; E236-F239 PolarHBondContact O-N 2.98Å; F239-T242 CarbonylContact O-C 3.17Å; F239-T242 PolarHBondContact O-N 2.95Å; F239-H243 AromaticContact CD1-CD2 3.61Å; F239-H243 AromaticContact CE1-CD2 3.2Å; F239-H243 WeakPolarHBondContact CE1-CD2 3.36Å; F239-H243 AromaticContact CE1-NE2 3.51Å; F239-H243 HydrophobicContact CE2-CB 4.29Å; F239-H243 AromaticContact CE2-CD2 3.82Å; F239-H243 HydrophobicContact CZ-CB 4.38Å; F239-H243 AromaticContact CZ-CD2 3.3Å; F239-H243 WeakPolarHBondContact CZ-CD2 3.4Å; F239-H243 AromaticContact CZ-NE2 3.95Å; F239-H243 PolarHBondContact O-CD2 3.1Å; F239-H243 VanDerWaalsContact O-CD2 3.24Å; F239-H243 PolarHBondContact O-N 3.28Å; F239-W267 HydrophobicContact CB-CH2 4.12Å; F239-W267 HydrophobicContact CB-CZ3 4.11Å; F239-W267 HydrophobicContact CD2-CZ3 4.18Å; F239-W267 HydrophobicContact CG-CH2 4.48Å; F239-W267 HydrophobicContact CG-CZ3 4.42Å; F239-F268 HydrophobicContact CB-CE1 3.99Å; F239-F268 HydrophobicContact CB-CZ 4.38Å; F239-F268 AromaticContact CD2-CD1 3.7Å; F239-F268 HydrophobicContact CD2-CD1 3.7Å; F239-F268 AromaticContact CD2-CE1 3.73Å; F239-F268 HydrophobicContact CD2-CE1 3.73Å; F239-F268 HydrophobicContact CE2-CD1 4.4Å; F239-F268 HydrophobicContact CG-CE1 4.35Å; F239-R271 HydrophobicContact CD1-CG 3.82Å; F239-R271 HydrophobicContact CD2-CB 4.06Å; F239-R271 HydrophobicContact CD2-CG 3.51Å; F239-R271 HydrophobicContact CE1-CG 3.71Å; F239-R271 HydrophobicContact CE2-CB 3.83Å; F239-R271 HydrophobicContact CE2-CG 3.41Å; F239-R271 VanDerWaalsContact CE2-CG 3.41Å; F239-R271 HydrophobicContact CG-CG 3.73Å; F239-R271 HydrophobicContact CZ-CB 4.28Å; F239-R271 HydrophobicContact CZ-CG 3.53Å; F239-R272 HydrophobicContact CE2-CG 3.8Å; F239-R272 HydrophobicContact CZ-CG 4.26Å; F239-W275 HydrophobicContact CE1-CB 4.48Å; F239-W275 HydrophobicContact CE1-CG 4.49Å; F239-W275 HydrophobicContact CZ-CB 4.2Å; F239-W275 HydrophobicContact CZ-CG 4.45Å
240E96.4Very high96.6Very high152 Ų15279 Ų7971%0.7136%0.36SS*.Hα-helixtrans-66.3-39.2173-71.2169.8177.100112.3E236 A238E236-E240 WeakPolarHBondContact O-CG 3.22Å; E236-E240 PolarHBondContact O-N 3.47Å; A238-E240 VanDerWaalsContact C-N 3.33Å
241R95.6Very high96.8Very high222 Ų22275.8 Ų75.884%0.83834%0.344SS*.Hα-helixtrans-66.5-41.9172-75.2-179.860.784.8-2.8112.6K237 A238K237-R241 PolarHBondContact O-N 3.48Å; A238-R241 PolarHBondContact O-N 3.35Å
242T95.1Very high96.9Very high51 Ų5179.5 Ų79.531%0.31336%0.362SS..  trans-155.6128.7173.1176.50000112.8A238 F239 Y244 P245A238-T242 PolarHBondContact O-N 3.09Å; F239-T242 CarbonylContact O-C 3.17Å; F239-T242 PolarHBondContact O-N 2.95Å; T242-Y244 PolarHBondContact O-N 2.95Å; T242-Y244 VanDerWaalsContact OG1-C 3.24Å; T242-Y244 PolarHBondContact OG1-N 2.73Å; T242-Y244 PolarHBondContact OG1-O 2.71Å; T242-P245 HydrophobicContact CG2-CB 4.01Å
243H95.9Very high96.9Very high63 Ų6377 Ų7729%0.29235%0.349SS..SBendtrans-65.9-19.2169.5-61.6148.2000112.9F239 R272 W275F239-H243 AromaticContact CD1-CD2 3.61Å; F239-H243 AromaticContact CE1-CD2 3.2Å; F239-H243 WeakPolarHBondContact CE1-CD2 3.36Å; F239-H243 AromaticContact CE1-NE2 3.51Å; F239-H243 HydrophobicContact CE2-CB 4.29Å; F239-H243 AromaticContact CE2-CD2 3.82Å; F239-H243 HydrophobicContact CZ-CB 4.38Å; F239-H243 AromaticContact CZ-CD2 3.3Å; F239-H243 WeakPolarHBondContact CZ-CD2 3.4Å; F239-H243 AromaticContact CZ-NE2 3.95Å; F239-H243 PolarHBondContact O-CD2 3.1Å; F239-H243 VanDerWaalsContact O-CD2 3.24Å; F239-H243 PolarHBondContact O-N 3.28Å; H243-R272 HydrophobicContact CB-CG 4.47Å; H243-R272 VanDerWaalsContact O-CD 3.23Å; H243-R272 WeakPolarHBondContact O-CD 3.2Å; H243-R272 WeakPolarHBondContact O-CG 3.3Å; H243-R272 PolarHBondContact O-NH1 3.2Å; H243-W275 AromaticContact CE1-CE2 3.85Å; H243-W275 AromaticContact CE1-CZ2 3.98Å; H243-W275 AromaticContact CE1-NE1 3.93Å; H243-W275 AromaticContact NE2-NE1 4Å
244Y97Very high96.9Very high158 Ų15871 Ų7162%0.6232%0.322SS*.SBendtrans-132.374.5-176.2-64.8-90.5000110.9T242 R272T242-Y244 PolarHBondContact O-N 2.95Å; T242-Y244 VanDerWaalsContact OG1-C 3.24Å; T242-Y244 PolarHBondContact OG1-N 2.73Å; T242-Y244 PolarHBondContact OG1-O 2.71Å; Y244-R272 VanDerWaalsContact CE1-NE 3.32Å
245P96.7Very high96.9Very high8 Ų876.3 Ų76.35%0.05235%0.347CS..  trans-66.3142.2172.729.4-36.8000111.2T242 T249 R250 F268T242-P245 HydrophobicContact CG2-CB 4.01Å; P245-T249 HydrophobicContact CB-CG2 3.69Å; P245-R250 HydrophobicContact CB-CG 3.88Å; P245-R250 HydrophobicContact CG-CG 3.66Å; P245-R250 PolarHBondContact O-NH1 3.49Å; P245-F268 VanDerWaalsContact CD-CE1 3.46Å; P245-F268 HydrophobicContact CG-CD1 3.55Å; P245-F268 HydrophobicContact CG-CD2 4.09Å; P245-F268 HydrophobicContact CG-CE1 3.49Å; P245-F268 VanDerWaalsContact CG-CE1 3.49Å; P245-F268 HydrophobicContact CG-CE2 4.06Å; P245-F268 HydrophobicContact CG-CG 3.87Å; P245-F268 HydrophobicContact CG-CZ 3.78Å
246D97.6Very high96.9Very high69 Ų6983.6 Ų83.637%0.36937%0.374SS..  trans-72.6-170.3177.184.1-57.6000111.7Y248 T249 R250D246-Y248 VanDerWaalsContact OD2-CD2 3.23Å; D246-Y248 WeakPolarHBondContact OD2-CD2 3.49Å; D246-Y248 PolarHBondContact OD2-N 3Å; D246-T249 WeakPolarHBondContact OD1-CB 3.47Å; D246-T249 PolarHBondContact OD1-N 3.37Å; D246-T249 PolarHBondContact OD1-OG1 3.46Å; D246-R250 VanDerWaalsContact O-CG 3.22Å; D246-R250 WeakPolarHBondContact O-CG 3.35Å; D246-R250 VanDerWaalsContact O-CZ 3.28Å; D246-R250 PolarHBondContact O-N 2.87Å; D246-R250 PolarHBondContact O-NH1 3.1Å
247I97.3Very high96.8Very high67 Ų6781.1 Ų81.134%0.34436%0.363SS..Hα-helixtrans-66.1-48.4178.8-175.360000111.6T249 R250 E251 E261I247-T249 PolarHBondContact O-N 2.87Å; I247-R250 PolarHBondContact O-N 3.36Å; I247-R250 VanDerWaalsContact O-N 3.09Å; I247-E251 HydrophobicContact CD1-CG 4.22Å; I247-E251 HydrophobicContact CG1-CG 4.43Å; I247-E251 WeakPolarHBondContact O-CG 3.48Å; I247-E251 PolarHBondContact O-N 2.59Å; I247-E261 HydrophobicContact CD1-CG 4.04Å
248Y97.7Very high96.8Very high170 Ų17084.7 Ų84.767%0.66738%0.379SS*.Hα-helixtrans-66.4-43.8-173.5-56.7-62.8000111.4D246 R250 E251 E252D246-Y248 VanDerWaalsContact OD2-CD2 3.23Å; D246-Y248 WeakPolarHBondContact OD2-CD2 3.49Å; D246-Y248 PolarHBondContact OD2-N 3Å; Y248-R250 VanDerWaalsContact C-N 3.26Å; Y248-R250 PolarHBondContact O-N 3Å; Y248-E251 PolarHBondContact O-N 3.33Å; Y248-E251 VanDerWaalsContact O-N 3.1Å; Y248-E252 PolarHBondContact O-N 2.95Å
249T96.9Very high96.7Very high49 Ų4985.5 Ų85.530%0.30138%0.381SS..Hα-helixtrans-59-36.9174.2-53.90000111.8P245 D246 I247 L253P245-T249 HydrophobicContact CB-CG2 3.69Å; D246-T249 WeakPolarHBondContact OD1-CB 3.47Å; D246-T249 PolarHBondContact OD1-N 3.37Å; D246-T249 PolarHBondContact OD1-OG1 3.46Å; I247-T249 PolarHBondContact O-N 2.87Å; T249-L253 HydrophobicContact CG2-CD1 4.09Å; T249-L253 WeakPolarHBondContact O-CB 3.29Å; T249-L253 WeakPolarHBondContact O-CD1 3.29Å; T249-L253 WeakPolarHBondContact O-CG 3.47Å; T249-L253 PolarHBondContact O-N 3.01Å; T249-L253 VanDerWaalsContact O-N 3.11Å
250R97.6Very high96.6Very high41 Ų4189.4 Ų89.416%0.15541%0.405CS..Hα-helixtrans-74.5-28.4178-67.6-174.2-37.2-92.3-5.3112.7P245 D246 I247 Y248 A254 E261 V264P245-R250 HydrophobicContact CB-CG 3.88Å; P245-R250 HydrophobicContact CG-CG 3.66Å; P245-R250 PolarHBondContact O-NH1 3.49Å; D246-R250 VanDerWaalsContact O-CG 3.22Å; D246-R250 WeakPolarHBondContact O-CG 3.35Å; D246-R250 VanDerWaalsContact O-CZ 3.28Å; D246-R250 PolarHBondContact O-N 2.87Å; D246-R250 PolarHBondContact O-NH1 3.1Å; I247-R250 PolarHBondContact O-N 3.36Å; I247-R250 VanDerWaalsContact O-N 3.09Å; Y248-R250 VanDerWaalsContact C-N 3.26Å; Y248-R250 PolarHBondContact O-N 3Å; R250-A254 VanDerWaalsContact O-CB 3.24Å; R250-A254 WeakPolarHBondContact O-CB 3.22Å; R250-A254 PolarHBondContact O-N 3.46Å; R250-E261 HydrophobicContact CB-CG 4.08Å; R250-E261 IonicContact CZ-OE1 3.16Å; R250-E261 IonicContact NE-OE1 2.71Å; R250-E261 PolarHBondContact NE-OE1 2.89Å; R250-E261 IonicContact NH2-OE1 2.73Å; R250-E261 PolarHBondContact NH2-OE1 2.81Å; R250-V264 HydrophobicContact CB-CG1 4.12Å; R250-V264 HydrophobicContact CG-CG1 4.1Å
251E97.9Very high96.7Very high84 Ų8484.1 Ų84.139%0.39338%0.381SS..Hα-helixtrans-74.7-40.2174.1-71.8177.9166.200112.2I247 Y248 A254 Q255 E261I247-E251 HydrophobicContact CD1-CG 4.22Å; I247-E251 HydrophobicContact CG1-CG 4.43Å; I247-E251 WeakPolarHBondContact O-CG 3.48Å; I247-E251 PolarHBondContact O-N 2.59Å; Y248-E251 PolarHBondContact O-N 3.33Å; Y248-E251 VanDerWaalsContact O-N 3.1Å; E251-A254 WeakPolarHBondContact O-CB 3.25Å; E251-A254 PolarHBondContact O-N 2.92Å; E251-Q255 WeakPolarHBondContact O-CG 3.41Å; E251-Q255 PolarHBondContact O-N 3.33Å; E251-Q255 PolarHBondContact O-NE2 3Å; E251-E261 HydrophobicContact CG-CB 4.44Å; E251-E261 HydrophobicContact CG-CG 4.11Å
252E97.2Very high96.7Very high107 Ų10775.5 Ų75.550%0.536%0.357SS..Hα-helixtrans-59.9-47.4170.2-72.6-160.3115.800111.6Y248 A254 Q255 R256Y248-E252 PolarHBondContact O-N 2.95Å; E252-A254 VanDerWaalsContact C-N 3.3Å; E252-A254 PolarHBondContact O-N 3.43Å; E252-Q255 PolarHBondContact O-N 2.62Å; E252-R256 WeakPolarHBondContact O-CG 3.14Å; E252-R256 PolarHBondContact O-N 3.13Å
253L96.9Very high96.7Very high9 Ų977.6 Ų77.65%0.04736%0.359CS..Hα-helixtrans-63.7-36.1177.1-70.6168.4000112E234 L235 A238 T249 T257 V264 F268E234-L253 HydrophobicContact CG-CD2 4.05Å; L235-L253 HydrophobicContact CD2-CB 4.47Å; A238-L253 HydrophobicContact CB-CD1 3.64Å; A238-L253 HydrophobicContact CB-CD2 3.7Å; A238-L253 HydrophobicContact CB-CG 4.31Å; T249-L253 HydrophobicContact CG2-CD1 4.09Å; T249-L253 WeakPolarHBondContact O-CB 3.29Å; T249-L253 WeakPolarHBondContact O-CD1 3.29Å; T249-L253 WeakPolarHBondContact O-CG 3.47Å; T249-L253 PolarHBondContact O-N 3.01Å; T249-L253 VanDerWaalsContact O-N 3.11Å; L253-T257 VanDerWaalsContact O-CB 3.32Å; L253-T257 WeakPolarHBondContact O-CB 3.41Å; L253-T257 WeakPolarHBondContact O-CG2 3.45Å; L253-T257 PolarHBondContact O-N 3.44Å; L253-T257 PolarHBondContact O-OG1 3.48Å; L253-V264 HydrophobicContact CB-CG1 4.12Å; L253-V264 HydrophobicContact CB-CG2 4.48Å; L253-V264 HydrophobicContact CD1-CG1 4.36Å; L253-F268 HydrophobicContact CD1-CE2 3.9Å; L253-F268 HydrophobicContact CD1-CZ 4.06Å
254A97.4Very high96.8Very high8 Ų874.6 Ų74.67%0.06635%0.345CS..Hα-helixtrans-62.1-45.3174.600000111.3R250 E251 E252 K258 L259 E261 V264R250-A254 VanDerWaalsContact O-CB 3.24Å; R250-A254 WeakPolarHBondContact O-CB 3.22Å; R250-A254 PolarHBondContact O-N 3.46Å; E251-A254 WeakPolarHBondContact O-CB 3.25Å; E251-A254 PolarHBondContact O-N 2.92Å; E252-A254 VanDerWaalsContact C-N 3.3Å; E252-A254 PolarHBondContact O-N 3.43Å; A254-K258 WeakPolarHBondContact O-CA 3.37Å; A254-K258 PolarHBondContact O-N 2.92Å; A254-L259 CarbonylContact C-O 3.56Å; A254-L259 WeakPolarHBondContact CB-O 3.43Å; A254-L259 PolarHBondContact O-N 3.01Å; A254-E261 HydrophobicContact CB-CB 4.5Å; A254-V264 HydrophobicContact CB-CG2 4.03Å
255Q97.4Very high96.8Very high151 Ų15171.4 Ų71.471%0.70634%0.336SS*.Hα-helixtrans-61.4-53.3175.1-69.217360.200111.9E251 E252 T257 K258E251-Q255 WeakPolarHBondContact O-CG 3.41Å; E251-Q255 PolarHBondContact O-N 3.33Å; E251-Q255 PolarHBondContact O-NE2 3Å; E252-Q255 PolarHBondContact O-N 2.62Å; Q255-T257 PolarHBondContact O-N 3.23Å; Q255-K258 PolarHBondContact O-N 3.14Å; Q255-K258 VanDerWaalsContact O-N 3.14Å
256R95.8Very high96.8Very high153 Ų15374.1 Ų74.158%0.57735%0.352SS*.Hα-helixtrans-58.4-47.6-179.9-69.9-175.6-170.7-176.65112.5E234 E252 K258E234-R256 VanDerWaalsContact OE1-CD 3.24Å; E234-R256 WeakPolarHBondContact OE1-CD 3.36Å; E234-R256 IonicContact OE1-CZ 2.7Å; E234-R256 IonicContact OE1-NE 2.72Å; E234-R256 IonicContact OE1-NH1 2.59Å; E234-R256 PolarHBondContact OE1-NH1 3.5Å; E252-R256 WeakPolarHBondContact O-CG 3.14Å; E252-R256 PolarHBondContact O-N 3.13Å; R256-K258 VanDerWaalsContact C-N 3.25Å; R256-K258 PolarHBondContact O-N 3.21Å
257T95.2Very high96.8Very high8 Ų872 Ų725%0.04934%0.339CS..Hα-helixtrans-77.7-6.8-179.260.90000113.7Q231 L235 L253 Q255 L259Q231-T257 PolarHBondContact NE2-O 3.31Å; L235-T257 HydrophobicContact CD2-CG2 4.43Å; L235-T257 HydrophobicContact CG-CG2 4.13Å; L253-T257 VanDerWaalsContact O-CB 3.32Å; L253-T257 WeakPolarHBondContact O-CB 3.41Å; L253-T257 WeakPolarHBondContact O-CG2 3.45Å; L253-T257 PolarHBondContact O-N 3.44Å; L253-T257 PolarHBondContact O-OG1 3.48Å; Q255-T257 PolarHBondContact O-N 3.23Å; T257-L259 VanDerWaalsContact C-N 3.28Å; T257-L259 PolarHBondContact O-N 3.15Å; T257-L259 WeakPolarHBondContact OG1-CG 3.48Å
258K96.5Very high96.8Very high189 Ų18968.8 Ų68.882%0.82232%0.323SS*.THydrogen-bonded Turntrans56.341.7-173.2-57.7170.6-175.11670112.2A254 Q255 R256A254-K258 WeakPolarHBondContact O-CA 3.37Å; A254-K258 PolarHBondContact O-N 2.92Å; Q255-K258 PolarHBondContact O-N 3.14Å; Q255-K258 VanDerWaalsContact O-N 3.14Å; R256-K258 VanDerWaalsContact C-N 3.25Å; R256-K258 PolarHBondContact O-N 3.21Å
259L94.8Very high96.8Very high31 Ų3163.8 Ų63.816%0.16231%0.312CS..SBendtrans-118.1170.9177-61.4179.1000110T225 F227 A254 T257 R263T225-L259 HydrophobicContact CG2-CD2 4.05Å; F227-L259 HydrophobicContact CD1-CD1 3.67Å; F227-L259 HydrophobicContact CE1-CD1 3.54Å; A254-L259 CarbonylContact C-O 3.56Å; A254-L259 WeakPolarHBondContact CB-O 3.43Å; A254-L259 PolarHBondContact O-N 3.01Å; T257-L259 VanDerWaalsContact C-N 3.28Å; T257-L259 PolarHBondContact O-N 3.15Å; T257-L259 WeakPolarHBondContact OG1-CG 3.48Å; L259-R263 HydrophobicContact CB-CB 4.21Å
260T96.6Very high96.8Very high87 Ų8765.7 Ų65.753%0.53432%0.321SS..  trans-86152.5167.8700000110.8A262 R263 V264T260-A262 PolarHBondContact O-N 3.39Å; T260-R263 WeakPolarHBondContact O-CA 3.31Å; T260-R263 WeakPolarHBondContact O-CB 3.43Å; T260-R263 PolarHBondContact O-N 2.82Å; T260-V264 PolarHBondContact O-N 3.21Å
261E96.9Very high96.7Very high41 Ų4167 Ų6719%0.19233%0.326CS..Hα-helixtrans-48-45.2173.5-173.6-74.9160.300110.8I247 R250 E251 A254 R263 V264 Q265I247-E261 HydrophobicContact CD1-CG 4.04Å; R250-E261 HydrophobicContact CB-CG 4.08Å; R250-E261 IonicContact CZ-OE1 3.16Å; R250-E261 IonicContact NE-OE1 2.71Å; R250-E261 PolarHBondContact NE-OE1 2.89Å; R250-E261 IonicContact NH2-OE1 2.73Å; R250-E261 PolarHBondContact NH2-OE1 2.81Å; E251-E261 HydrophobicContact CG-CB 4.44Å; E251-E261 HydrophobicContact CG-CG 4.11Å; A254-E261 HydrophobicContact CB-CB 4.5Å; E261-R263 PolarHBondContact O-N 2.99Å; E261-V264 CarbonylContact O-C 3.45Å; E261-V264 WeakPolarHBondContact O-CA 3.48Å; E261-V264 WeakPolarHBondContact O-CB 3.49Å; E261-V264 PolarHBondContact O-N 2.89Å; E261-Q265 WeakPolarHBondContact O-CB 3.24Å; E261-Q265 PolarHBondContact O-N 3.34Å
262A96Very high96.6Very high41 Ų4165.2 Ų65.234%0.33932%0.316SS..Hα-helixtrans-69.7-2.5178.700000114.7T260 V266T260-A262 PolarHBondContact O-N 3.39Å; A262-V266 VanDerWaalsContact O-CG2 3.23Å; A262-V266 WeakPolarHBondContact O-CG2 3.45Å
263R96.2Very high96.4Very high95 Ų9561.8 Ų61.836%0.35831%0.305SS..Hα-helixtrans-91-43.9161.5-62-5976.6150.34.2110.8T225 L259 T260 E261 V266 W267T225-R263 HydrophobicContact CG2-CG 4.48Å; T225-R263 VanDerWaalsContact OG1-CD 3.28Å; T225-R263 WeakPolarHBondContact OG1-CD 3.42Å; L259-R263 HydrophobicContact CB-CB 4.21Å; T260-R263 WeakPolarHBondContact O-CA 3.31Å; T260-R263 WeakPolarHBondContact O-CB 3.43Å; T260-R263 PolarHBondContact O-N 2.82Å; E261-R263 PolarHBondContact O-N 2.99Å; R263-V266 PolarHBondContact O-N 3.22Å; R263-W267 WeakPolarHBondContact O-CB 3.33Å; R263-W267 PolarHBondContact O-N 2.85Å
264V97.1Very high96.2Very high0 Ų069.6 Ų69.60%033%0.334CS..Hα-helixtrans-59.3-51.7175.6-179.40000110.4L235 R250 L253 A254 T260 E261 V266 W267 F268L235-V264 HydrophobicContact CD2-CG1 3.92Å; L235-V264 HydrophobicContact CD2-CG2 4.34Å; R250-V264 HydrophobicContact CB-CG1 4.12Å; R250-V264 HydrophobicContact CG-CG1 4.1Å; L253-V264 HydrophobicContact CB-CG1 4.12Å; L253-V264 HydrophobicContact CB-CG2 4.48Å; L253-V264 HydrophobicContact CD1-CG1 4.36Å; A254-V264 HydrophobicContact CB-CG2 4.03Å; T260-V264 PolarHBondContact O-N 3.21Å; E261-V264 CarbonylContact O-C 3.45Å; E261-V264 WeakPolarHBondContact O-CA 3.48Å; E261-V264 WeakPolarHBondContact O-CB 3.49Å; E261-V264 PolarHBondContact O-N 2.89Å; V264-V266 VanDerWaalsContact C-N 3.32Å; V264-V266 PolarHBondContact O-N 2.99Å; V264-W267 WeakPolarHBondContact O-CB 3.45Å; V264-W267 PolarHBondContact O-N 3.37Å; V264-F268 HydrophobicContact CG1-CD2 3.71Å; V264-F268 HydrophobicContact CG1-CE2 3.8Å; V264-F268 WeakPolarHBondContact O-CD2 3.36Å; V264-F268 PolarHBondContact O-N 2.76Å
265Q97.3Very high95.8Very high92 Ų9274.9 Ų74.943%0.4335%0.352SS..Hα-helixtrans-54.3-45.3176.3-167.2-154.752.300112.5E261 S269E261-Q265 WeakPolarHBondContact O-CB 3.24Å; E261-Q265 PolarHBondContact O-N 3.34Å; Q265-S269 WeakPolarHBondContact O-CB 3.41Å; Q265-S269 PolarHBondContact O-N 2.79Å
266V96.9Very high95.5Very high64 Ų6474.3 Ų74.339%0.38834%0.344SS..Hα-helixtrans-68.6-38.1177169.20000111.4A262 R263 V264 N270A262-V266 VanDerWaalsContact O-CG2 3.23Å; A262-V266 WeakPolarHBondContact O-CG2 3.45Å; R263-V266 PolarHBondContact O-N 3.22Å; V264-V266 VanDerWaalsContact C-N 3.32Å; V264-V266 PolarHBondContact O-N 2.99Å; V266-N270 WeakPolarHBondContact O-CB 3.47Å; V266-N270 PolarHBondContact O-N 3.27Å; V266-N270 PolarHBondContact O-ND2 2.85Å
267W97.1Very high94.9Very high24 Ų2474.8 Ų74.89%0.09135%0.35CS..Hα-helixtrans-62.6-51.1174.8-176.8102.9000110.7F227 L232 L235 E236 F239 R263 V264 S269 N270 R271F227-W267 HydrophobicContact CE1-CB 4.17Å; F227-W267 AromaticContact CE1-CD1 3.63Å; F227-W267 HydrophobicContact CE1-CG 4.17Å; F227-W267 HydrophobicContact CZ-CB 4.02Å; F227-W267 AromaticContact CZ-CD1 3.64Å; F227-W267 HydrophobicContact CZ-CG 4.21Å; L232-W267 VanDerWaalsContact CD2-NE1 3.29Å; L235-W267 HydrophobicContact CB-CD2 4.09Å; L235-W267 HydrophobicContact CB-CE3 4.03Å; L235-W267 HydrophobicContact CB-CH2 3.83Å; L235-W267 HydrophobicContact CB-CZ2 3.85Å; L235-W267 HydrophobicContact CB-CZ3 3.92Å; L235-W267 HydrophobicContact CD1-CB 4.5Å; L235-W267 HydrophobicContact CD1-CD2 3.92Å; L235-W267 HydrophobicContact CD1-CE3 4.43Å; L235-W267 HydrophobicContact CD1-CG 3.89Å; L235-W267 HydrophobicContact CD2-CE3 4.4Å; L235-W267 HydrophobicContact CG-CD2 4.45Å; L235-W267 WeakPolarHBondContact O-CH2 3.42Å; L235-W267 WeakPolarHBondContact O-CZ3 3.44Å; E236-W267 HydrophobicContact CB-CH2 4.5Å; E236-W267 HydrophobicContact CG-CH2 3.6Å; E236-W267 HydrophobicContact CG-CZ2 3.49Å; E236-W267 VanDerWaalsContact CG-CZ2 3.49Å; F239-W267 HydrophobicContact CB-CH2 4.12Å; F239-W267 HydrophobicContact CB-CZ3 4.11Å; F239-W267 HydrophobicContact CD2-CZ3 4.18Å; F239-W267 HydrophobicContact CG-CH2 4.48Å; F239-W267 HydrophobicContact CG-CZ3 4.42Å; R263-W267 WeakPolarHBondContact O-CB 3.33Å; R263-W267 PolarHBondContact O-N 2.85Å; V264-W267 WeakPolarHBondContact O-CB 3.45Å; V264-W267 PolarHBondContact O-N 3.37Å; W267-S269 VanDerWaalsContact C-N 3.33Å; W267-S269 PolarHBondContact O-N 3.45Å; W267-N270 CarbonylContact O-C 3.6Å; W267-N270 WeakPolarHBondContact O-CA 3.08Å; W267-N270 PolarHBondContact O-N 2.73Å; W267-R271 HydrophobicContact CE3-CB 4.17Å; W267-R271 HydrophobicContact CH2-CB 3.94Å; W267-R271 HydrophobicContact CH2-CG 3.66Å; W267-R271 HydrophobicContact CZ2-CB 4.33Å; W267-R271 HydrophobicContact CZ2-CG 4.22Å; W267-R271 HydrophobicContact CZ3-CB 3.86Å; W267-R271 HydrophobicContact CZ3-CG 3.96Å; W267-R271 PolarHBondContact O-N 3.24Å
268F97.9Very high94Very high1 Ų180.4 Ų80.40%0.00438%0.376CS..Hα-helixtrans-59.9-41.4178.6-92-92.4000112.1L235 A238 F239 P245 L253 V264 N270 R271 R272L235-F268 HydrophobicContact CD2-CE2 3.87Å; A238-F268 HydrophobicContact CB-CZ 4.11Å; F239-F268 HydrophobicContact CB-CE1 3.99Å; F239-F268 HydrophobicContact CB-CZ 4.38Å; F239-F268 AromaticContact CD2-CD1 3.7Å; F239-F268 HydrophobicContact CD2-CD1 3.7Å; F239-F268 AromaticContact CD2-CE1 3.73Å; F239-F268 HydrophobicContact CD2-CE1 3.73Å; F239-F268 HydrophobicContact CE2-CD1 4.4Å; F239-F268 HydrophobicContact CG-CE1 4.35Å; P245-F268 VanDerWaalsContact CD-CE1 3.46Å; P245-F268 HydrophobicContact CG-CD1 3.55Å; P245-F268 HydrophobicContact CG-CD2 4.09Å; P245-F268 HydrophobicContact CG-CE1 3.49Å; P245-F268 VanDerWaalsContact CG-CE1 3.49Å; P245-F268 HydrophobicContact CG-CE2 4.06Å; P245-F268 HydrophobicContact CG-CG 3.87Å; P245-F268 HydrophobicContact CG-CZ 3.78Å; L253-F268 HydrophobicContact CD1-CE2 3.9Å; L253-F268 HydrophobicContact CD1-CZ 4.06Å; V264-F268 HydrophobicContact CG1-CD2 3.71Å; V264-F268 HydrophobicContact CG1-CE2 3.8Å; V264-F268 WeakPolarHBondContact O-CD2 3.36Å; V264-F268 PolarHBondContact O-N 2.76Å; F268-N270 PolarHBondContact O-N 2.91Å; F268-R271 PolarHBondContact O-N 3.42Å; F268-R272 WeakPolarHBondContact O-CB 3.32Å; F268-R272 WeakPolarHBondContact O-CG 3.23Å; F268-R272 PolarHBondContact O-N 3.09Å
269S96.9Very high92.8Very high64 Ų6473.1 Ų73.145%0.44835%0.351SS..Hα-helixtrans-60-44.2173.9-171.90000112.1Q265 W267 A273Q265-S269 WeakPolarHBondContact O-CB 3.41Å; Q265-S269 PolarHBondContact O-N 2.79Å; W267-S269 VanDerWaalsContact C-N 3.33Å; W267-S269 PolarHBondContact O-N 3.45Å; S269-A273 WeakPolarHBondContact O-CB 3.23Å; S269-A273 PolarHBondContact O-N 3.33Å; S269-A273 VanDerWaalsContact O-N 3.1Å
270N96.3Very high91.1Very high89 Ų8973.3 Ų73.348%0.47636%0.36SS..Hα-helixtrans-68.7-37.9175.7-79.4-73.2000113V266 W267 F268 A273 R274V266-N270 WeakPolarHBondContact O-CB 3.47Å; V266-N270 PolarHBondContact O-N 3.27Å; V266-N270 PolarHBondContact O-ND2 2.85Å; W267-N270 CarbonylContact O-C 3.6Å; W267-N270 WeakPolarHBondContact O-CA 3.08Å; W267-N270 PolarHBondContact O-N 2.73Å; F268-N270 PolarHBondContact O-N 2.91Å; N270-A273 PolarHBondContact O-N 3.17Å; N270-R274 WeakPolarHBondContact O-CG 3.49Å; N270-R274 PolarHBondContact O-N 2.93Å; N270-R274 VanDerWaalsContact O-N 3.13Å
271R96.1Very high89.3Confident70 Ų7071.7 Ų71.726%0.26436%0.356SS..Hα-helixtrans-65.7-49177.2-17573.7-179.4-173.3-5.2110.6E236 F239 W267 F268 A273 R274 W275E236-R271 IonicContact OE1-CZ 2.73Å; E236-R271 VanDerWaalsContact OE1-CZ 3.3Å; E236-R271 IonicContact OE1-NE 3.91Å; E236-R271 IonicContact OE1-NH1 2.69Å; E236-R271 PolarHBondContact OE1-NH1 3.08Å; E236-R271 IonicContact OE1-NH2 3.88Å; E236-R271 IonicContact OE2-CZ 3.13Å; E236-R271 IonicContact OE2-NH1 2.83Å; E236-R271 PolarHBondContact OE2-NH1 2.93Å; E236-R271 IonicContact OE2-NH2 2.93Å; E236-R271 PolarHBondContact OE2-NH2 2.93Å; F239-R271 HydrophobicContact CD1-CG 3.82Å; F239-R271 HydrophobicContact CD2-CB 4.06Å; F239-R271 HydrophobicContact CD2-CG 3.51Å; F239-R271 HydrophobicContact CE1-CG 3.71Å; F239-R271 HydrophobicContact CE2-CB 3.83Å; F239-R271 HydrophobicContact CE2-CG 3.41Å; F239-R271 VanDerWaalsContact CE2-CG 3.41Å; F239-R271 HydrophobicContact CG-CG 3.73Å; F239-R271 HydrophobicContact CZ-CB 4.28Å; F239-R271 HydrophobicContact CZ-CG 3.53Å; W267-R271 HydrophobicContact CE3-CB 4.17Å; W267-R271 HydrophobicContact CH2-CB 3.94Å; W267-R271 HydrophobicContact CH2-CG 3.66Å; W267-R271 HydrophobicContact CZ2-CB 4.33Å; W267-R271 HydrophobicContact CZ2-CG 4.22Å; W267-R271 HydrophobicContact CZ3-CB 3.86Å; W267-R271 HydrophobicContact CZ3-CG 3.96Å; W267-R271 PolarHBondContact O-N 3.24Å; F268-R271 PolarHBondContact O-N 3.42Å; R271-A273 PolarHBondContact O-N 2.94Å; R271-R274 PolarHBondContact O-N 3.18Å; R271-W275 PolarHBondContact O-N 3.03Å
272R95.8Very high87.4Confident46 Ų4675.6 Ų75.617%0.17438%0.378CS..Hα-helixtrans-54.6-38.2171.1-73.7-165-67.8-88.75.6112.8F239 H243 Y244 F268 R274 R276F239-R272 HydrophobicContact CE2-CG 3.8Å; F239-R272 HydrophobicContact CZ-CG 4.26Å; H243-R272 HydrophobicContact CB-CG 4.47Å; H243-R272 VanDerWaalsContact O-CD 3.23Å; H243-R272 WeakPolarHBondContact O-CD 3.2Å; H243-R272 WeakPolarHBondContact O-CG 3.3Å; H243-R272 PolarHBondContact O-NH1 3.2Å; Y244-R272 VanDerWaalsContact CE1-NE 3.32Å; F268-R272 WeakPolarHBondContact O-CB 3.32Å; F268-R272 WeakPolarHBondContact O-CG 3.23Å; F268-R272 PolarHBondContact O-N 3.09Å; R272-R274 VanDerWaalsContact C-N 3.32Å; R272-R274 PolarHBondContact O-N 3.41Å; R272-R276 PolarHBondContact O-N 3.12Å; R272-R276 VanDerWaalsContact O-N 3.09Å
273A93.7Very high85.5Confident34 Ų3480.5 Ų80.528%0.28139%0.394SS..Hα-helixtrans-72.3-20.7178.400000114.2S269 N270 R271 K277S269-A273 WeakPolarHBondContact O-CB 3.23Å; S269-A273 PolarHBondContact O-N 3.33Å; S269-A273 VanDerWaalsContact O-N 3.1Å; N270-A273 PolarHBondContact O-N 3.17Å; R271-A273 PolarHBondContact O-N 2.94Å; A273-K277 WeakPolarHBondContact O-CG 3.35Å
274R91.9Very high83.6Confident173 Ų17382 Ų8265%0.65341%0.408SS*.Hα-helixtrans-83.6-46.8169-66.3177.9-166.8-135.99.2111.4N270 R271 R272 R276 K277 Q278N270-R274 WeakPolarHBondContact O-CG 3.49Å; N270-R274 PolarHBondContact O-N 2.93Å; N270-R274 VanDerWaalsContact O-N 3.13Å; R271-R274 PolarHBondContact O-N 3.18Å; R272-R274 VanDerWaalsContact C-N 3.32Å; R272-R274 PolarHBondContact O-N 3.41Å; R274-R276 VanDerWaalsContact C-N 3.34Å; R274-R276 PolarHBondContact O-N 2.89Å; R274-K277 WeakPolarHBondContact O-CA 3.42Å; R274-K277 WeakPolarHBondContact O-CB 3.22Å; R274-K277 PolarHBondContact O-N 3.42Å; R274-Q278 PolarHBondContact O-N 2.94Å
275W90.5Very high81.7Confident120 Ų12084 Ų8446%0.45543%0.425SS..Hα-helixtrans-53.6-47.8178.4179.987.9000111.9F239 H243 R271 K277 Q278 A279F239-W275 HydrophobicContact CE1-CB 4.48Å; F239-W275 HydrophobicContact CE1-CG 4.49Å; F239-W275 HydrophobicContact CZ-CB 4.2Å; F239-W275 HydrophobicContact CZ-CG 4.45Å; H243-W275 AromaticContact CE1-CE2 3.85Å; H243-W275 AromaticContact CE1-CZ2 3.98Å; H243-W275 AromaticContact CE1-NE1 3.93Å; H243-W275 AromaticContact NE2-NE1 4Å; R271-W275 PolarHBondContact O-N 3.03Å; W275-K277 PolarHBondContact O-N 2.73Å; W275-Q278 PolarHBondContact O-N 2.81Å; W275-Q278 VanDerWaalsContact O-N 3.12Å; W275-A279 PolarHBondContact O-N 3.38Å
276R89.8Confident79.6Confident139 Ų13982 Ų8253%0.52542%0.424SS..Hα-helixtrans-60.8-27.5174.5-78.5-173.7-81.9100.2-2.6114.2R272 R274 G280R272-R276 PolarHBondContact O-N 3.12Å; R272-R276 VanDerWaalsContact O-N 3.09Å; R274-R276 VanDerWaalsContact C-N 3.34Å; R274-R276 PolarHBondContact O-N 2.89Å; R276-G280 PolarHBondContact O-N 3.24Å; R276-G280 VanDerWaalsContact O-N 3.17Å
277K83.3Confident77.3Confident163 Ų16384.9 Ų84.971%0.70943%0.432SS*.Hα-helixtrans-78.5-36.6174.9-71.1179.6176.8-171.80112.2A273 R274 W275 A281A273-K277 WeakPolarHBondContact O-CG 3.35Å; R274-K277 WeakPolarHBondContact O-CA 3.42Å; R274-K277 WeakPolarHBondContact O-CB 3.22Å; R274-K277 PolarHBondContact O-N 3.42Å; W275-K277 PolarHBondContact O-N 2.73Å; K277-A281 VanDerWaalsContact O-CB 3.31Å; K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.48Å
278Q76.9Confident75.2Confident125 Ų12589.2 Ų89.258%0.58446%0.457SS*.Hα-helixtrans-65.9-46.9173.8-72.2167.2-5400110.6R274 W275 G280 A281 N282R274-Q278 PolarHBondContact O-N 2.94Å; W275-Q278 PolarHBondContact O-N 2.81Å; W275-Q278 VanDerWaalsContact O-N 3.12Å; Q278-G280 PolarHBondContact O-N 2.85Å; Q278-A281 PolarHBondContact O-N 3.28Å; Q278-N282 PolarHBondContact O-N 3.5Å
279A69.9Low73Confident37 Ų3797.2 Ų97.231%0.30649%0.494SS..Hα-helixtrans-58.9-43.4174.800000112.8W275 N282 Q283W275-A279 PolarHBondContact O-N 3.38Å; A279-N282 PolarHBondContact O-N 3.41Å; A279-Q283 PolarHBondContact O-N 2.84Å; A279-Q283 VanDerWaalsContact O-N 3.1Å
280G60.6Low70.8Confident34 Ų34100.4 Ų100.435%0.35151%0.505SS..Hα-helixtrans-67.3-33.9175.200000114R276 Q278 L284R276-G280 PolarHBondContact O-N 3.24Å; R276-G280 VanDerWaalsContact O-N 3.17Å; Q278-G280 PolarHBondContact O-N 2.85Å; G280-L284 WeakPolarHBondContact O-CG 3.34Å; G280-L284 PolarHBondContact O-N 3.1Å
281A58.4Low68.1Low54 Ų54100.9 Ų100.945%0.44651%0.507SS..Hα-helixtrans-69.6-40.3173.800000111.9K277 Q278 Q283 L284 A285K277-A281 VanDerWaalsContact O-CB 3.31Å; K277-A281 WeakPolarHBondContact O-CB 3.27Å; K277-A281 PolarHBondContact O-N 3.48Å; Q278-A281 PolarHBondContact O-N 3.28Å; A281-Q283 PolarHBondContact O-N 2.81Å; A281-L284 PolarHBondContact O-N 3.32Å; A281-A285 PolarHBondContact O-N 2.98Å
282N55.9Low65.5Low122 Ų122104.2 Ų104.265%0.65254%0.538SS*.Hα-helixtrans-64.3-36.4175.1-94.939000112.6Q278 A279 L284 A285 A286Q278-N282 PolarHBondContact O-N 3.5Å; A279-N282 PolarHBondContact O-N 3.41Å; N282-L284 VanDerWaalsContact C-N 3.35Å; N282-A285 PolarHBondContact O-N 3.33Å; N282-A286 WeakPolarHBondContact O-CB 3.47Å; N282-A286 PolarHBondContact O-N 3.43Å
283Q57.6Low63.4Low145 Ų145105.6 Ų105.668%0.67857%0.566SS**Hα-helixtrans-66-37174.2-74.5-17649.600112.3A279 A281 A286 F287A279-Q283 PolarHBondContact O-N 2.84Å; A279-Q283 VanDerWaalsContact O-N 3.1Å; A281-Q283 PolarHBondContact O-N 2.81Å; Q283-A286 PolarHBondContact O-N 3.36Å; Q283-F287 WeakPolarHBondContact O-CB 3.31Å; Q283-F287 PolarHBondContact O-N 3.33Å
284L54.9Low60.9Low125 Ų125106.7 Ų106.765%0.65458%0.581SS**Hα-helixtrans-67.8-37173.3-69.5167.4000112.2G280 A281 N282 N288G280-L284 WeakPolarHBondContact O-CG 3.34Å; G280-L284 PolarHBondContact O-N 3.1Å; A281-L284 PolarHBondContact O-N 3.32Å; N282-L284 VanDerWaalsContact C-N 3.35Å; L284-N288 PolarHBondContact O-N 3.45Å; L284-N288 PolarHBondContact O-ND2 3.14Å
285A57.9Low58.5Low44 Ų44107.9 Ų107.936%0.36459%0.591SS.*Hα-helixtrans-66.4-45.9173.400000111.9A281 N282 F287 N288 H289A281-A285 PolarHBondContact O-N 2.98Å; N282-A285 PolarHBondContact O-N 3.33Å; A285-F287 VanDerWaalsContact C-N 3.32Å; A285-F287 PolarHBondContact O-N 3.2Å; A285-N288 WeakPolarHBondContact O-CB 3.41Å; A285-N288 PolarHBondContact O-N 3.09Å; A285-H289 PolarHBondContact O-CD2 2.88Å; A285-H289 PolarHBondContact O-N 3.41Å
286A53.8Low56.4Low50 Ų50107.7 Ų107.741%0.41361%0.605SS.*Hα-helixtrans-61.5-38.317700000112.3N282 Q283 N288 H289 L290N282-A286 WeakPolarHBondContact O-CB 3.47Å; N282-A286 PolarHBondContact O-N 3.43Å; Q283-A286 PolarHBondContact O-N 3.36Å; A286-N288 VanDerWaalsContact C-N 3.32Å; A286-N288 PolarHBondContact O-N 3.32Å; A286-H289 PolarHBondContact O-N 2.97Å; A286-H289 VanDerWaalsContact O-N 3.09Å; A286-L290 WeakPolarHBondContact O-CG 3.34Å; A286-L290 PolarHBondContact O-N 2.89Å
287F48.1Very low54.7Low124 Ų124106.4 Ų106.454%0.54462%0.615SS.*Hα-helixtrans-63.7-35.4176.4-164.6-96.8000112.7Q283 A285 H289 L290 L291Q283-F287 WeakPolarHBondContact O-CB 3.31Å; Q283-F287 PolarHBondContact O-N 3.33Å; A285-F287 VanDerWaalsContact C-N 3.32Å; A285-F287 PolarHBondContact O-N 3.2Å; F287-H289 PolarHBondContact O-N 3.45Å; F287-L290 PolarHBondContact O-N 3.22Å; F287-L290 VanDerWaalsContact O-N 3.14Å; F287-L291 HydrophobicContact CD1-CD1 4.4Å; F287-L291 HydrophobicContact CE1-CD1 4.04Å; F287-L291 HydrophobicContact CE1-CG 4.45Å
288N52.8Low53Low115 Ų115105.2 Ų105.262%0.61562%0.622SS**Hα-helixtrans-65-24.9173.7-67.5-29.6000113.1L284 A285 A286L284-N288 PolarHBondContact O-N 3.45Å; L284-N288 PolarHBondContact O-ND2 3.14Å; A285-N288 WeakPolarHBondContact O-CB 3.41Å; A285-N288 PolarHBondContact O-N 3.09Å; A286-N288 VanDerWaalsContact C-N 3.32Å; A286-N288 PolarHBondContact O-N 3.32Å
289H52.5Low51.1Low168 Ų168102.8 Ų102.878%0.77863%0.63SS**THydrogen-bonded Turntrans-86.9-3.5175.6-69.4-69.1000113.9A285 A286 F287A285-H289 PolarHBondContact O-CD2 2.88Å; A285-H289 PolarHBondContact O-N 3.41Å; A286-H289 PolarHBondContact O-N 2.97Å; A286-H289 VanDerWaalsContact O-N 3.09Å; F287-H289 PolarHBondContact O-N 3.45Å
290L49.2Very low50.1Low132 Ų132109.1 Ų109.169%0.69166%0.655SS**SBendtrans-106.65.9-178.1-71.1167.1000113.6A286 F287A286-L290 WeakPolarHBondContact O-CG 3.34Å; A286-L290 PolarHBondContact O-N 2.89Å; F287-L290 PolarHBondContact O-N 3.22Å; F287-L290 VanDerWaalsContact O-N 3.14Å
291L40.9Very low49Very low98 Ų98113 Ų11351%0.51367%0.674SS.*SBendtrans-108.3108.9175.5-69.1174.5000110.7F287 G293 G294F287-L291 HydrophobicContact CD1-CD1 4.4Å; F287-L291 HydrophobicContact CE1-CD1 4.04Å; F287-L291 HydrophobicContact CE1-CG 4.45Å; L291-G293 PolarHBondContact O-N 3.27Å; L291-G294 PolarHBondContact O-N 3.2Å
292P41.3Very low48.2Very low141 Ų141116.7 Ų116.792%0.91669%0.692SS**THydrogen-bonded Turntrans-66.699.7172.2-16.430.8000110.1
293G52.1Low47.2Very low74 Ų74118.9 Ų118.976%0.76370%0.702SS**THydrogen-bonded Turntrans133.61.4-18000000116.4L291L291-G293 PolarHBondContact O-N 3.27Å
294G39.7Very low46.2Very low57 Ų57117.3 Ų117.359%0.58870%0.704SS**PPolyproline II helixtrans-70.5127.5173.700000113.1L291L291-G294 PolarHBondContact O-N 3.2Å
295F42.8Very low45.6Very low198 Ų198117.8 Ų117.887%0.86871%0.713SS**PPolyproline II helixtrans-57.8138.6-179.6-74.3-97.8000113.2
296P45.4Very low44.4Very low116 Ų116125.9 Ų125.975%0.75374%0.736SS**PPolyproline II helixtrans-74138.7175.730.6-34.4000111.8
297P53.8Low43.5Very low112 Ų112131.7 Ų131.773%0.72775%0.754SS**SBendtrans-78.5140.7169.431.9-32.7000111.4
298T48.8Very low42.8Very low139 Ų139133.6 Ų133.685%0.85377%0.769SS**  trans57.1107.7169.351.50000117.4
299G36Very low42.1Very low73 Ų73133.8 Ų133.875%0.75378%0.777SS**  trans-172.481.3170.300000110.9P301G299-P301 WeakPolarHBondContact O-CD 3.47Å
300M49.3Very low41.1Very low170 Ų170134.3 Ų134.384%0.83778%0.78SS**  trans-73.7120.7177.136.6-79-170.400110.4T302M300-T302 PolarHBondContact O-N 3.01Å
301P38.1Very low40.2Very low115 Ų115135.1 Ų135.175%0.74779%0.79SS**  trans-83.8108.4-175.531.9-33000111.7G299G299-P301 WeakPolarHBondContact O-CD 3.47Å
302T41.8Very low40Very low133 Ų133135 Ų13582%0.81680%0.797SS**PPolyproline II helixtrans-70.8122.4152.349.20000108.2M300 P304M300-T302 PolarHBondContact O-N 3.01Å; T302-P304 WeakPolarHBondContact O-CD 3.48Å
303L35.5Very low39.6Very low167 Ų167139.6 Ų139.687%0.87480%0.798SS**PPolyproline II helixtrans-69.2127.1-179.7-63.8175.1000111.7
304P36.2Very low39.2Very low112 Ų112141.2 Ų141.273%0.72780%0.795SS**PPolyproline II helixtrans-92.1134.5156.134.3-27.3000110.2T302T302-P304 WeakPolarHBondContact O-CD 3.48Å
305T41.2Very low38.7Very low135 Ų135143.7 Ų143.783%0.82880%0.804SS**PPolyproline II helixtrans-61.6137.8172.5-580000111.4
306Y33.7Very low38.1Very low215 Ų215140.4 Ų140.484%0.84380%0.8SS**  trans-138.5151.1157.7-120.7-87.9000111.2
307Q33.9Very low37.4Very low172 Ų172140.7 Ų140.780%0.80480%0.799SS**PPolyproline II helixtrans-81.2145.2-166.3-65.3162.4-59.500113.1
308L34.1Very low36.4Very low163 Ų163143 Ų14385%0.85381%0.805SS**PPolyproline II helixtrans-93.5142.6153.5-104.982.9000109.5
309P37.1Very low35.5Very low120 Ų120141.1 Ų141.178%0.77980%0.797SS**PPolyproline II helixtrans-74148.9156.1-11.128.5000110.9
310E32.4Very low35.3Very low179 Ų179145.6 Ų145.684%0.83680%0.799SS**PPolyproline II helixtrans-83145.4178.5-59.6-179.7105.200113.2
311T30.8Very low34.2Very low149 Ų149145.8 Ų145.891%0.91480%0.798SS**  trans-138.6135138.546.80000109.3
312S36.1Very low33.8Very low94 Ų94143.6 Ų143.666%0.65780%0.796SS**  trans-92.6146.5-167.3-30.70000113.2
313Y32.2Very low33.2Very low238 Ų238142.4 Ų142.493%0.93379%0.793SS**  trans-157153.9136.2-84.7-59000110.3
314P44.1Very low32.9Very low109 Ų109139.2 Ų139.271%0.70879%0.785SS**  trans-108150.5-152.839.5-37000118.6
315S29.1Very low32.9Very low109 Ų109139.7 Ų139.776%0.76279%0.786SS**  trans51.6119136.2-56.90000123.3
316T30.9Very low32.4Very low129 Ų129140.3 Ų140.379%0.79178%0.783SS**  -170.3106.3123.215.60000109.1
317T29.4Very low32.3Very low121 Ų121137.9 Ų137.974%0.74278%0.78SS**  77.4141.69057.40000117.3
318L33.9Very low32.1Very low160 Ų160140.2 Ų140.284%0.83878%0.781SS**  trans71.8131.2178-105.649.3000114.9
319S29.4Very low33.1Very low100 Ų100137.6 Ų137.670%0.69977%0.774SS**  cis73.2139.537.1-590000113
320Q32Very low33Very low167 Ų167139 Ų13978%0.7877%0.77SS**  cis-174.5158.80.6152.3-177.38.200109.9
321E26.3Very low33.8Very low174 Ų174136.2 Ų136.281%0.81377%0.767SS**  trans61.6173.4164.6-83.1-64.3136.600118.9
322G29Very low34.1Very low70 Ų70135.7 Ų135.772%0.72276%0.758SS**  trans13391148.200000119.7
323S29.3Very low34.9Very low107 Ų107137.1 Ų137.175%0.74877%0.765SS**  trans-43.3133.9166.8-550000119.5
324S30.8Very low36Very low101 Ų101131.5 Ų131.571%0.70676%0.757SS**  71.1150.2126.471.90000124.4
325T34.4Very low35.8Very low122 Ų122131.9 Ų131.975%0.74876%0.763SS**  trans105.2130.2149.271.60000123.2
326L32.3Very low36.3Very low147 Ų147132.2 Ų132.277%0.7777%0.765SS**  trans80.8142.7133.9-75.4166.2000125.7
327H30Very low36.7Very low165 Ų165133.4 Ų133.476%0.76476%0.764SS**  trans64.2165.4161.2-84-118.8000120.7
328R31.1Very low36.9Very low221 Ų221135.8 Ų135.883%0.83477%0.766SS**  cis-170.6154.8-43.7-175.4166.7168.9140.42.7107.1
329P54.1Low36.9Very low108 Ų108136.3 Ų136.370%0.70176%0.764SS**  trans-116.8-167.3-149.945.8-40.1000118.3
330Q35.3Very low36.9Very low150 Ų150135.4 Ų135.470%0.70177%0.771SS**  trans78.7159.2168.3-81.2-77.9-57.900115.5
331P48.9Very low36.8Very low119 Ų119130.8 Ų130.877%0.77377%0.768SS**  cis-137.7178.330.844-25.4000119.9
332L38.5Very low37.2Very low139 Ų139130.4 Ų130.473%0.72877%0.77SS**  trans-81.2165.8161-58.8165.4000110.8
333P52.4Low37.3Very low123 Ų123132.5 Ų132.580%0.79977%0.774SS**  -156.5-156.579.546-24.9000112.7
334P54.7Low37.4Very low120 Ų120131.7 Ų131.778%0.77977%0.774SS**  cis-124.6178.4-16.640.4-25000114.9
335S40.4Very low37.3Very low118 Ų118134.2 Ų134.283%0.82578%0.779SS**  trans-105.8173177.1-46.40000112.7
336S39.5Very low37.1Very low116 Ų116132.6 Ų132.681%0.81177%0.773SS**  trans-138.8164.6154.1-1650000111.1
337M38.3Very low37Very low153 Ų153130.4 Ų130.475%0.75477%0.77SS**  trans-127.8163.6-163.9-63.7-96.376.800112.7
338H33.9Very low37.4Very low171 Ų171128 Ų12879%0.79277%0.772SS**  trans153158.5135.8-83.5-74.7000111.3
339Q34Very low37.5Very low171 Ų171120.4 Ų120.480%0.79976%0.757SS**  cis-169.4130.1-47.7-176169.832.500110.2
340G30.3Very low36.5Very low81 Ų81126.1 Ų126.184%0.83577%0.766SS**  trans73.9161.8166.200000117.4
341G29Very low36.2Very low70 Ų70122.6 Ų122.672%0.72277%0.77SS**  cis164155.8-11.300000114.1
342L34.5Very low35.6Very low166 Ų166125.1 Ų125.187%0.86978%0.776SS**  trans71.8120.7167.7-48.2-179.4000116
343S31Very low35.1Very low115 Ų115123.9 Ų123.980%0.80478%0.779SS**  85.314990.3-62.70000114.2
344A31.8Very low34.2Very low90 Ų90123.3 Ų123.374%0.74478%0.778SS**  cis-168.7171.2-20.600000110.5
345D28.9Very low33Very low153 Ų153124.3 Ų124.382%0.81878%0.777SS**  trans86145.1149.6-137.4-21.3000122.9
346S29.5Very low32.6Very low88 Ų88127.4 Ų127.462%0.61577%0.77SS**  trans68.1106146.8-83.20000126.5
347S31.8Very low32.2Very low102 Ų102129.1 Ų129.171%0.71377%0.765SS**  68.8116.8106.8-53.40000123.2
348S38.4Very low31.7Very low115 Ų115127.1 Ų127.180%0.80477%0.766SS**  trans63.1151.6136-610000121
349A31.7Very low31.5Very low61 Ų61128.4 Ų128.450%0.50477%0.77SS.*  cis-170.3-170.3-18.600000108.5
350Y33.8Very low31.2Very low227 Ų227124.8 Ų124.889%0.8976%0.764SS**  trans66.7153.8171.9-16.3-72.4000115.6
351G29.9Very low31.1Very low77 Ų77125.8 Ų125.879%0.79476%0.758SS**  cis-161.4-171.3-1.300000111.9
352L34.7Very low31.2Very low172 Ų172132.4 Ų132.490%0.90176%0.762SS**  trans-108142.7-170.1-75.9159.1000114.7
353S28.3Very low31.1Very low113 Ų113129.1 Ų129.179%0.7975%0.753SS**  trans161.3137.7145.7-76.90000109.6
354S33Very low30.9Very low110 Ų110129.6 Ų129.677%0.76975%0.747SS**  cis105.6136.726-74.40000113.2
355N29.9Very low30.9Very low141 Ų141130.9 Ų130.975%0.75475%0.745SS**  trans69.4147.2174.1-92.6-8.1000116.9
356R31.7Very low31.1Very low183 Ų183132.1 Ų132.169%0.69174%0.744SS**  cis-170.7163.7-12.1-143.7173.7-149.1-136.71.5111.2
357H31.9Very low31.4Very low152 Ų152135.4 Ų135.470%0.70475%0.751SS**  trans44.7166.5152.949.7-150.7000123.3
358S27.4Very low31.3Very low112 Ų112135.4 Ų135.478%0.78375%0.752SS**  cis-171.1147.7-37.5-85.60000111.2
359F30.1Very low32Very low198 Ų198135.3 Ų135.387%0.86875%0.748SS**  trans36.7126.3138.9-151-96.3000122.2
360S27.1Very low31.9Very low95 Ų95137.9 Ų137.966%0.66476%0.763SS**  173.5155109.7-163.40000114.3
361S29.5Very low31.9Very low101 Ų101131.1 Ų131.171%0.70675%0.754SS**  trans-93.4173161.8-54.90000111.6
362Y30.6Very low32Very low210 Ų210133.3 Ų133.382%0.82476%0.756SS**  trans166.7118.2130.5-104.3-93.2000109.1
363S31.3Very low32Very low97 Ų97129.2 Ų129.268%0.67874%0.743SS**  83.2162.1109.9750000115.1
364D28.5Very low32.4Very low125 Ų125131.1 Ų131.167%0.66874%0.744SS**  cis-158.4172.75.9-147.5-67000112.4
365T31.3Very low32.4Very low116 Ų116132.8 Ų132.871%0.71274%0.739SS**  trans38.3160.2151.333.70000123.7
366F32.9Very low32.4Very low179 Ų179134 Ų13479%0.78574%0.742SS**  cis-169.7170.3-40.6-133.1-83.7000110.7
367M34.6Very low32.5Very low157 Ų157132.5 Ų132.577%0.77375%0.748SS**  trans80.5161.6159.6-85.1-64.2103.900122.1
368S31.1Very low33.6Very low103 Ų103130 Ų13072%0.7275%0.745SS**  trans-125-149.9-164.3-40.20000111.2
369P53.3Low33.8Very low113 Ų113131.2 Ų131.273%0.73475%0.747SS**  cis-143.1-168.61345.6-25000117.8
370S29.9Very low33.9Very low115 Ų115125.2 Ų125.280%0.80474%0.741SS**  trans73.3147.8158.270.30000119.8
371A32.1Very low34.2Very low85 Ų85128.9 Ų128.970%0.70275%0.754SS**  cis-165.6163.7-18.800000111.7
372S32.2Very low34.2Very low122 Ų122127.8 Ų127.885%0.85376%0.758SS**  trans39.3150.6143-59.50000122.6
373S35.1Very low34.3Very low87 Ų87126.4 Ų126.461%0.60876%0.764SS**  cis-179.1137.1-1.6140.40000111.3
374N36.3Very low34.3Very low152 Ų152126.1 Ų126.181%0.81376%0.762SS**  trans61.7161155-73-53.3000119
375H34.2Very low34.8Very low145 Ų145126.3 Ų126.367%0.67177%0.77SS**  cis-166.2166.7-15.6167.6-85.4000108.4
376M30.5Very low34.9Very low168 Ų168129 Ų12983%0.82878%0.775SS**  trans136.6148.2155.6-70.1-60.3167.400114.4
377N33.2Very low35Very low150 Ų150127 Ų12780%0.80278%0.777SS**  trans-145179.6-172.1-152.329.4000107.1
378P54.8Low34.9Very low100 Ų100128.5 Ų128.565%0.64978%0.784SS**  cis-111.1-149.1-919.67.6000111
379V32.4Very low34.8Very low137 Ų137128.9 Ų128.983%0.8379%0.787SS**  cis-156.1164.714.5-141.80000111
380G30.6Very low33.8Very low72 Ų72131.8 Ų131.874%0.74280%0.795SS**  trans169.8123.9164.500000114.4
381N33Very low34Very low173 Ų173134.2 Ų134.293%0.92580%0.798SS**  trans-71.6149.5-172.3-67.5-10.9000115
382G30.7Very low34Very low78 Ų78136.2 Ų136.280%0.80481%0.807SS**  trans17494.9165.600000115.1
383L32.8Very low34.1Very low181 Ų181137.9 Ų137.995%0.94881%0.806SS**  trans-82.8161170.9-54.3171.3000109.5
384S30.5Very low34.9Very low90 Ų90138.6 Ų138.663%0.62981%0.808SS**  cis-158.8154.810.7-179.30000109.7
385P40.1Very low34.6Very low129 Ų129137.1 Ų137.184%0.83881%0.81SS**  trans-133.9127.6140.935.1-22.9000113.3
386Q33.4Very low34.3Very low173 Ų173135.2 Ų135.281%0.80882%0.819SS**  trans-110.9111.4171-71.9-175.6-6.100111.1
387V34.9Very low34.5Very low137 Ų137133.9 Ų133.983%0.8382%0.82SS**  trans-17386.6143.7-96.40000109.7
388M31.8Very low35.3Very low188 Ų188132.1 Ų132.193%0.92682%0.817SS**  trans-164.9153.8161.9-115.4158.4-11900112.5
389S29.7Very low33.9Very low111 Ų111132.6 Ų132.678%0.77682%0.823SS**  trans63.591.8165.7-58.20000119.1
390I32.2Very low33.9Very low175 Ų175134.3 Ų134.390%0.89782%0.822SS**  trans-131.997.2136-53.4179.9000108.7
391L33Very low34.7Very low166 Ų166135.4 Ų135.487%0.86982%0.816SS**  trans-158.288.8162.4-166.481.8000110.2
392S31.8Very low34.6Very low127 Ų127133.8 Ų133.889%0.88880%0.803SS**  trans-163.9141.7161-83.70000112.1
393N35.5Very low34.7Very low157 Ų157136.8 Ų136.884%0.8480%0.795SS**  trans-77.5-177.1-178.7-105.64.6000113.1
394P52.6Low34.4Very low102 Ų102133.7 Ų133.766%0.66278%0.78SS**  cis-139.7-179-22.234.9-14.7000115.6
395S28Very low34.6Very low120 Ų120137.7 Ų137.784%0.83979%0.786SS**  trans48.7115.6145.6-61.60000123.5
396A28.8Very low34Very low105 Ų105135.6 Ų135.687%0.86878%0.775SS**  trans-168150.6133.500000113.4
397V34Very low33.9Very low140 Ų140135 Ų13585%0.84878%0.775SS**  trans-153144.7175173.80000104.7
398P50Low33.5Very low114 Ų114133.4 Ų133.474%0.7477%0.77SS**  cis-124.5-161.233.225.62000112.7
399S26.9Very low34.7Very low110 Ų110129.7 Ų129.777%0.76976%0.76SS**  cis-158.9165.529.7-56.10000115.1
400Q31Very low34.9Very low173 Ų173132 Ų13281%0.80876%0.763SS**  trans-84.9-176.9166.3-134.1-152.822.800110.9
401P48.1Very low34.9Very low95 Ų95131.6 Ų131.662%0.61776%0.757SS**  -155.1-171.850.339.7-14.3000119.3
402Q31Very low34.7Very low139 Ų139128.4 Ų128.465%0.6575%0.748SS**  trans75.4122.5161.2-59.2-51.2-79.800117.1
403H31.9Very low34.6Very low140 Ų140126.9 Ų126.965%0.64874%0.738SS**  113.3149.651.9-103.9-116.4000108.7
404D27.4Very low34.6Very low116 Ų116125.8 Ų125.862%0.6273%0.731SS**  cis-157.6158.838.2-98.6-37.9000114.9
405F34.8Very low33.3Very low174 Ų174128.6 Ų128.676%0.76374%0.735SS**  trans40156.2144.2-65.7-59.7000124.4
406S28Very low33.5Very low86 Ų86126.8 Ų126.860%0.60172%0.723SS**  cis-163.9150.56.5-126.60000117
407I30.4Very low34.1Very low160 Ų160126.3 Ų126.382%0.82171%0.713SS**  trans72.1147.1138.8-69.9166.5000123.2
408S27.5Very low34.2Very low104 Ų104126.5 Ų126.573%0.72771%0.71SS**  trans-117.8-149.3-174-41.80000111
409P56.9Low34.9Very low109 Ų109126.6 Ų126.671%0.70871%0.71SS**  cis-141.5-166.1-12.329.4-2.7000116.7
410L33.9Very low35.4Very low160 Ų160128.7 Ų128.784%0.83871%0.711SS**  trans86.1149.6161.4-46.8-178.6000117.6
411H31.6Very low35.3Very low167 Ų167125 Ų12577%0.77371%0.705SS**  cis-153.1167.27.7-173.1-111000113.3
412S28.4Very low34.5Very low98 Ų98124.9 Ų124.969%0.68571%0.711SS**  trans68.1145.3166.3-90.30000120.1
413S29Very low34.6Very low95 Ų95123.9 Ų123.966%0.66472%0.72SS**  cis-166.9137.4-23.2-176.70000111.4
414L35.5Very low34.3Very low135 Ų135123 Ų12371%0.70773%0.728SS**  trans21.6149.6147.4-56.8169.9000121.5
415E27.1Very low34.5Very low160 Ų160121.8 Ų121.875%0.74873%0.729SS**  cis-152.4122.149.7-158.161.6-123.400109.1
416S32.1Very low34.3Very low83 Ų83121.3 Ų121.358%0.5873%0.729SS**  86.5150.769.7-52.30000115.7
417S40.4Very low34.3Very low94 Ų94127 Ų12766%0.65774%0.737SS**  trans-164.3175-166.954.90000113.8
418N36.9Very low34.2Very low145 Ų145123.5 Ų123.578%0.77573%0.727SS**  trans71.4-178.2166.4-49.6-41.2000115.8
419P64.6Low34.2Very low116 Ų116125.3 Ų125.375%0.75373%0.728SS**  cis-109.7-151.7-14.824.6-0.2000110.9
420I36.2Very low33Very low153 Ų153125.7 Ų125.779%0.78573%0.729SS**  cis-149.6-177.97.9-4.3179.8000106.5
421S29Very low33Very low97 Ų97124.7 Ų124.768%0.67872%0.723SS**  cis-155.5169.39.1-104.10000107.1
422A32Very low33Very low91 Ų91125.6 Ų125.675%0.75273%0.725SS**  cis77.4132.933.900000115.2
423S32.3Very low32.9Very low119 Ų119125.5 Ų125.583%0.83272%0.724SS**  cis-167.7179.5-10.2-168.40000111.1
424C26.5Very low33Very low121 Ų121127.1 Ų127.182%0.81873%0.73SS**  trans79.1165.6159.7-155.20000119.6
425S31Very low32.7Very low91 Ų91127.3 Ų127.364%0.63673%0.731SS**  -170.8155.6-69.6-157.80000111.8
426Q31.8Very low32.8Very low164 Ų164124.3 Ų124.377%0.76673%0.728SS**  trans65.6159.7161.2-71.6-165.910200119.8
427R27.2Very low32.8Very low204 Ų204128.2 Ų128.277%0.7774%0.742SS**  cis-175.3155.3-28.1-163.6180176.9-136.60.4110.2
428S29.5Very low32.2Very low87 Ų87127.7 Ų127.761%0.60874%0.743SS**  trans70.9166.2162.5-55.30000118.3
429D27Very low31.8Very low142 Ų142125.8 Ų125.876%0.75974%0.741SS**  cis-147.4166.89.4-131-44.8000117.2
430T30.2Very low30.3Very low118 Ų118124.7 Ų124.772%0.72474%0.736SS**  trans-61.6-176.1-174.8-45.20000117.9
431I35Very low30Very low139 Ų139125.9 Ų125.971%0.71374%0.739SS**  trans105.9137.7163.1-65.2173.9000114
432K30.7Very low30Very low185 Ų185125 Ų12580%0.80473%0.733SS**  cis-169.1-175.7-15.2-98.9-177-168.4174.80106.4
433S27Very low29.9Very low97 Ų97131.2 Ų131.268%0.67874%0.738SS**  cis177.5176.7-41.8-165.90000108.7
434V32.2Very low30Very low129 Ų129130.6 Ų130.678%0.78273%0.732SS**  trans70.2137.8176.4-33.10000115.5
435D28.5Very low31.1Very low138 Ų138130.4 Ų130.474%0.73873%0.73SS**  cis-156-173.6-0.1-145.2-125.3000108.8
436S29.1Very low31.7Very low97 Ų97132 Ų13268%0.67874%0.738SS**  cis-151.1178.213.7-70.70000113.4
437L31.5Very low31.8Very low165 Ų165130.2 Ų130.286%0.86474%0.739SS**  trans-83.8175.6168.6-98.265.8000112.8
438A29.1Very low32.1Very low84 Ų84131.3 Ų131.369%0.69474%0.744SS**  cis-171.3174.5-11.200000112.2
439S28.2Very low32.2Very low105 Ų105132.1 Ų132.173%0.73475%0.75SS**  trans100.1122.6135.5-142.80000122.4
440S33.1Very low32.4Very low92 Ų92129.8 Ų129.864%0.64375%0.751SS**  trans75125132.9-66.90000124.6
441Q28.2Very low32.7Very low179 Ų179131.2 Ų131.284%0.83676%0.759SS**  trans70.5152138.8-71.5-155.994.100118.9
442S30.1Very low32.5Very low79 Ų79129.1 Ų129.155%0.55276%0.757SS**  cis-167.9-179.4-9.8450000111.6
443Y29.5Very low32.6Very low220 Ų220131.6 Ų131.686%0.86376%0.763SS**  trans77.8126.3164.8-75.1-79.2000121.9
444C34.3Very low33.1Very low106 Ų106131.9 Ų131.972%0.71677%0.765SS**  trans-91.9171149.7-47.60000108.9
445P50.6Low33.2Very low118 Ų118132.6 Ų132.677%0.76677%0.769SS**  -151.2155.984.439-22.1000116.7
446P42Very low33.4Very low125 Ų125133.1 Ų133.181%0.81277%0.772SS**  trans-102.2135.2145.419.6-2.6000110.6
447T34.9Very low34.5Very low126 Ų126133.6 Ų133.677%0.77377%0.773SS**  trans-99130.1-17750.80000112.9
448Y32.9Very low34.5Very low226 Ų226131.3 Ų131.389%0.88677%0.766SS**  trans43.7142.4142.6-101.3-126.2000120.2
449S32.5Very low34.6Very low104 Ų104133.6 Ų133.673%0.72777%0.771SS**  cis-143.6164.518.6-54.90000111.3
450A30.9Very low34.8Very low94 Ų94133.7 Ų133.778%0.77778%0.778SS**  trans-122.9149.4167.900000111.2
451T35.4Very low34.5Very low147 Ų147132.4 Ų132.490%0.90278%0.779SS**  trans-146.3111.9146420000108.4
452S31.8Very low34.4Very low96 Ų96134.8 Ų134.867%0.67178%0.782SS**  trans-83.8158.9162500000109.9
453Y33Very low34.5Very low236 Ų236140.7 Ų140.793%0.92580%0.801SS**  -163.6160.8120.1-106-71000109.8
454S36.6Very low34.3Very low103 Ų103138.8 Ų138.872%0.7279%0.794SS**  trans-127.8140.5-176.8173.40000109.5
455V34Very low34Very low145 Ų145138.5 Ų138.588%0.87979%0.793SS**  trans-167.5131.9143.1-96.10000111.2
456D34.2Very low33.1Very low148 Ų148139.4 Ų139.479%0.79179%0.787SS**  trans-93.9171.9146.1-121.4-32.8000106.6
457P51.4Low32.6Very low107 Ų107144.4 Ų144.470%0.69579%0.791SS**  cis-145.1-161.21528.20.5000116.1
458V31.2Very low32.5Very low118 Ų118141.3 Ų141.372%0.71578%0.784SS**  trans94.194.8153-1730000120.2
459T30.9Very low32.4Very low132 Ų132139 Ų13981%0.8178%0.782SS**  47.9105118.7-41.30000122.6
460A32.5Very low32.5Very low106 Ų106140.1 Ų140.188%0.87679%0.785SS**  173.3149.2128.800000110.2
461G26.5Very low32.8Very low65 Ų65140.4 Ų140.467%0.6779%0.787SS**  cis179.1154.7-8.900000111.8
462Y27.8Very low32.8Very low229 Ų229139.8 Ų139.890%0.89878%0.782SS**  trans30.5118.7162.3-73.6-92.9000122
463Q30.6Very low32.9Very low204 Ų204142.2 Ų142.295%0.95379%0.788SS**  -152.4178.4106.3-119.4-174.2-0.100112.5
464Y26.8Very low32.8Very low179 Ų179142 Ų14270%0.70279%0.787SS**  trans-135179.1-153.1-173.7-96.9000113.4Q466Y464-Q466 PolarHBondContact OH-OE1 3.47Å
465S27.9Very low32.7Very low101 Ų101145 Ų14571%0.70679%0.794SS**  trans83110-177.2-55.60000113.4
466Q30.3Very low32.6Very low137 Ų137143.2 Ų143.264%0.6480%0.795SS**  cis68.59833.7-159.8-164.426.800114.1Y464Y464-Q466 PolarHBondContact OH-OE1 3.47Å
467Y31.9Very low32.7Very low229 Ų229144.8 Ų144.890%0.89879%0.794SS**  trans-162.3155130.5-108.1-73.8000108.2
468G32.7Very low31.6Very low61 Ų61147.3 Ų147.363%0.62980%0.802SS**  trans-158137.8174.700000111.9
469Q31.2Very low31.6Very low177 Ų177148.1 Ų148.183%0.82781%0.807SS**  trans-168.9161.5165.2-121.9168.788.200113
470T34.2Very low31.6Very low129 Ų129147 Ų14779%0.79181%0.805SS**  trans61.8134.8162.151.90000119.1
471A38.9Very low31.5Very low99 Ų99150.1 Ų150.182%0.81881%0.805SS**  trans-107.6141170.600000110.5
472V33.7Very low31.6Very low134 Ų134152 Ų15281%0.81281%0.809SS**  trans-148.8159161.9-92.90000110
473D34Very low31.8Very low147 Ų147147.8 Ų147.879%0.78681%0.807SS**  trans-27.2123.9-171.4-65.6-88.2000120.4
474Y31.6Very low31.9Very low232 Ų232145.4 Ų145.491%0.9180%0.796SS**  trans-149.981.1153.5-95-73.8000113
475L33.7Very low32.1Very low165 Ų165147.6 Ų147.686%0.86480%0.803SS**  trans-159.346140.8-152.762.2000114.8K477L475-K477 PolarHBondContact O-N 3.46Å
476A32.7Very low32.3Very low108 Ų108154.6 Ų154.689%0.89381%0.814SS**  trans-88.190.5164.900000110.2
477K35.4Very low32.6Very low181 Ų181156.9 Ų156.979%0.78783%0.826SS**  trans-131.3109.8169.6-82.1-168.5175.1-177.70111.8L475L475-K477 PolarHBondContact O-N 3.46Å
478N29.3Very low32.7Very low161 Ų161155.8 Ų155.886%0.86183%0.826SS**  trans14090.9148-71-5.2000110.6
479V32Very low32.8Very low135 Ų135160 Ų16082%0.81883%0.834SS**  trans-125.5131.8175.4169.70000108.8
480S29.8Very low32.8Very low108 Ų108154.6 Ų154.676%0.75583%0.825SS**  trans48.7103.6159.9-58.80000120.8
481L31Very low32.8Very low171 Ų171155.2 Ų155.290%0.89582%0.824SS**  trans-158.9131.4135-81.8177.6000105.9
482S28.2Very low32.7Very low105 Ų105159.4 Ų159.473%0.73483%0.826SS**  cis-153150.7-7.2-74.40000109.8
483T32.1Very low32.7Very low141 Ų141158.7 Ų158.787%0.86583%0.827SS**  trans-119.7108.8169.6-60.20000110.3
484Q32.1Very low32.8Very low154 Ų154155.9 Ų155.972%0.7282%0.824SS**  trans-172.6138.2140.8-107.9-17446.500113.4
485R32.3Very low33Very low224 Ų224151.3 Ų151.385%0.84582%0.82SS**  trans44.4118.1146.4-63.1172.6173.8-177.7-3.7119.4
486R31.2Very low33.2Very low248 Ų248151.5 Ų151.594%0.93682%0.821SS**  -164.3138.693.3-163.2168.7-177.9167.71.1111.1
487M36.6Very low33.4Very low185 Ų185150.2 Ų150.291%0.91182%0.818SS**  trans-74.9145.4169.1-69.7169.5166.200110.8
488K33.7Very low33.5Very low206 Ų206150 Ų15090%0.89683%0.825SS**  trans-152.1131.9156.1-158.9172.1179.8-178.40109.8
489L34.8Very low33.8Very low151 Ų151150.6 Ų150.679%0.79183%0.827SS**  trans-68.8155169.3-83.868.9000110
490G32.4Very low34.1Very low62 Ų62153.1 Ų153.164%0.63983%0.83SS**  trans-161.6102.6171.100000108.4
491D33.6Very low34.4Very low142 Ų142155 Ų15576%0.75984%0.837SS**  trans-74.2130.8-168.6-51.9-85.6000112.2
492H37.1Very low34.7Very low188 Ų188154.8 Ų154.887%0.8783%0.831SS**  trans-126.6103.7166.2-76.6-63.6000109.2
493S34Very low35.4Very low118 Ų118156.3 Ų156.383%0.82584%0.836SS**  trans-61.6142.1-178.4-167.90000111.8
494A35.2Very low35.5Very low88 Ų88152.9 Ų152.973%0.72783%0.829SS**  trans-75.9142.3173.700000111.2
495V36.6Very low35.8Very low137 Ų137154.9 Ų154.983%0.8384%0.838SS**  trans-126.892.9163.6-179.40000108
496L37.5Very low36.2Very low169 Ų169148.4 Ų148.489%0.88583%0.832SS**  trans-134121.8161.8-74177.8000107.1
497G36.3Very low36.9Very low81 Ų81151.3 Ų151.384%0.83585%0.846SS**  trans-74.7144.7177.100000111.2
498L38.1Very low36.9Very low177 Ų177149.6 Ų149.693%0.92784%0.842SS**  trans-108.6136.2167.1-93.6165.3000109.8
499L35.9Very low37.1Very low172 Ų172146.6 Ų146.690%0.90184%0.839SS**  trans-77.5154.9174.5-93.8144.5000111.1
500Q36.9Very low37.2Very low189 Ų189146.4 Ų146.488%0.88384%0.842SS**  trans-80130.9-172.2-179.9177.4-11.200111.7
501V37.2Very low37.5Very low148 Ų148151.4 Ų151.490%0.89785%0.854SS**  trans-135.1160165.3-176.80000107.8
502E37.8Very low37.7Very low165 Ų165151.9 Ų151.977%0.77186%0.86SS**  trans-116.7165.6-147.6-158-179.8158.800113.8
503T41.1Very low37.8Very low138 Ų138149.5 Ų149.585%0.84786%0.859SS**  trans68.3148.9171.473.10000118.1
504G35Very low38Very low69 Ų69151.8 Ų151.871%0.71186%0.862SS**  cis174.1152-10.500000112.4
505Q39.6Very low38.2Very low195 Ų195156.7 Ų156.791%0.91187%0.872SS**  trans51124.6173.5-66.2-178.2-27.100117.9
506A40Very low38.4Very low88 Ų88158.3 Ų158.373%0.72788%0.876SS**  cis76.598.637.500000115.3
507Y45.1Very low38.5Very low309 Ų309157.4 Ų157.4100%1.21288%0.875SS**  trans-150.70131.2-107.9-71.4000109.6

Retrieved 507 of 507 residues in 393.9 ms (Link to these results)