A0A087X1W7_HUMAN Loading...

POTE ankyrin domain family member D

AlphaFold DB , UniProt , Accession A0A087X1W7, Species HUMAN (Homo sapiens, Human), Gene POTED, Length 381 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
1M42.1Very low31.7Very low243 Ų243144.5 Ų144.5100%1.19787%0.871SS**  090.70-76.4176.4171.900108.8
2V31.5Very low31.4Very low145 Ų145141.1 Ų141.188%0.87986%0.859SS**  trans-152.8120.5149.9-175.50000105
3A30.4Very low31.2Very low93 Ų93140.2 Ų140.277%0.76985%0.854SS**  trans-88.7126.6177.400000108.8
4E30Very low31.1Very low190 Ų190140.7 Ų140.789%0.88886%0.857SS**  trans-84.5129.6169.3-81.7-177.615000110.3
5V32.7Very low31Very low130 Ų130144.2 Ų144.279%0.78886%0.856SS**  trans-82.9113.8175.8176.20000107.9
6C29Very low30.9Very low130 Ų130147 Ų14788%0.87885%0.853SS**  trans-97.9104.9168.3-93.80000110.3
7S30.5Very low30.9Very low108 Ų108146 Ų14676%0.75585%0.853SS**PPolyproline II helixtrans-69.9137.2169.1-57.90000111.3
8M32.6Very low30.6Very low181 Ų181148.2 Ų148.289%0.89285%0.851SS**PPolyproline II helixtrans-76.8144.4170.9-62.9-155.4115.500111.8
9P30.4Very low30.6Very low127 Ų127147.2 Ų147.283%0.82584%0.842SS**PPolyproline II helixtrans-88.6135166.230.4-25000112
10T28.4Very low30.6Very low137 Ų137147.2 Ų147.284%0.8484%0.839SS**PPolyproline II helixtrans-68.4146.3176.642.90000113.7
11A31Very low30.6Very low105 Ų105151.7 Ų151.787%0.86884%0.842SS**PPolyproline II helixtrans-54.2135.8172.500000113.9
12S28.7Very low30Very low104 Ų104145.1 Ų145.173%0.72782%0.82SS**  trans-158.9148.7149.268.10000111.8
13T28Very low29.9Very low130 Ų130147.5 Ų147.580%0.79882%0.819SS**  trans90.664166.1730000119.1
14V30.9Very low30Very low147 Ų147148.8 Ų148.889%0.89181%0.81SS**  trans-84.1115.7148.6-178.90000108.3K16V14-K16 PolarHBondContact O-N 3.24Å
15K29Very low29.8Very low193 Ų193143.7 Ų143.784%0.83981%0.809SS**PPolyproline II helixtrans-60.8125.4175.9-71.4174.7176.3174.40110.2
16K29.9Very low29.7Very low189 Ų189147 Ų14782%0.82281%0.812SS**PPolyproline II helixtrans-61.6130.4165.6-69.6177.6177.4177.60109.2V14V14-K16 PolarHBondContact O-N 3.24Å
17P29.8Very low29.8Very low130 Ų130149.3 Ų149.384%0.84480%0.803SS**PPolyproline II helixtrans-76.8136.9160.513.50.6000109.4
18F26.9Very low29.6Very low185 Ų185149.6 Ų149.681%0.81180%0.804SS**PPolyproline II helixtrans-66.3153.5-169.5-87-102.6000116.3
19D29.3Very low29.2Very low130 Ų130149.1 Ų149.170%0.69580%0.799SS**  trans7.5101.9150.7-74.2-48.2000119.3
20L31Very low28.9Very low146 Ų146151.3 Ų151.376%0.76480%0.798SS**  trans-98.33.1160.5-91.6157.6000113.4S22L20-S22 VanDerWaalsContact C-N 3.34Å; L20-S22 PolarHBondContact O-N 3.39Å
21R29.8Very low28.6Very low242 Ų242154.3 Ų154.391%0.91379%0.794SS**THydrogen-bonded Turntrans-80-3.5-171.2-140.1177.5-166.2-158.73.1115.6
22S29.5Very low28.2Very low105 Ų105157.7 Ų157.773%0.73479%0.789SS**THydrogen-bonded Turntrans-115.96.2-172.767.50000116.6L20L20-S22 VanDerWaalsContact C-N 3.34Å; L20-S22 PolarHBondContact O-N 3.39Å
23K29.9Very low28.2Very low195 Ų195158.3 Ų158.385%0.84879%0.791SS**SBendtrans-127.614.1-178.5-87.2-175.3178.6175.80117.6
24M31.9Very low28Very low121 Ų121157.3 Ų157.360%0.59679%0.788SS**  trans-109.227.2177.8-70178.681.600114.9K26 W27M24-K26 PolarHBondContact O-N 3.41Å; M24-W27 HydrophobicContact CE-CD2 4.45Å; M24-W27 HydrophobicContact CE-CZ2 4.24Å
25G27.6Very low27.8Very low83 Ų83157 Ų15786%0.85679%0.79SS**  trans-73.225.7173.100000116.3
26K30.2Very low27.7Very low198 Ų198159.1 Ų159.186%0.86179%0.793SS**  trans-145.449.1178.6-69.2-170.5-179.6-179.40112.9M24M24-K26 PolarHBondContact O-N 3.41Å
27W31.1Very low27.5Very low179 Ų179154 Ų15468%0.67879%0.794SS**  trans-117.771.8171-75.472.9000110.1M24 L253M24-W27 HydrophobicContact CE-CD2 4.45Å; M24-W27 HydrophobicContact CE-CZ2 4.24Å; W27-L253 HydrophobicContact CH2-CD1 3.78Å
28C25.9Very low27.4Very low115 Ų115153.7 Ų153.778%0.77780%0.795SS**  trans-162.8113.9158.1-91.40000109.3
29H24.2Very low27.4Very low171 Ų171148.7 Ų148.779%0.79280%0.796SS**  167.9139.2127.7-91-63.9000112.5
30H23.9Very low27.4Very low172 Ų172152.7 Ų152.780%0.79681%0.807SS**  trans84.4127.4169.1-57.4-62.7000116.2
31R22.8Very low27.2Very low200 Ų200151.8 Ų151.876%0.75581%0.813SS**  cis-168.8141.18.5-155.4177.1-163.2-137.75.2109
32F22.8Very low27Very low177 Ų177147.2 Ų147.278%0.77681%0.807SS**  trans162.4152.2131.2-89.4-60.8000110.9
33P27.3Very low26.9Very low117 Ų117150.8 Ų150.876%0.7681%0.814SS**  trans-103.3161.1-1319.414.2000113.8
34C24.1Very low26.6Very low109 Ų109144.6 Ų144.674%0.73681%0.805SS**  trans-51.1138.2173.6-60.20000114.8
35C25.9Very low26.2Very low139 Ų139145.2 Ų145.294%0.93982%0.816SS**  trans-115.991.6137.8-70.80000108.4
36R27.5Very low26.4Very low238 Ų238147.1 Ų147.190%0.89882%0.816SS**  trans-84111.4160.8-88-174.8173.2-158-0.8107.3
37G26.1Very low26.2Very low82 Ų82141.1 Ų141.185%0.84581%0.811SS**  trans-96.1108.9162.500000109.3
38S28.5Very low26.4Very low124 Ų124139.9 Ų139.987%0.86782%0.817SS**  trans-84.3132.7168.750.90000110.3
39G25.7Very low26.6Very low80 Ų80143.3 Ų143.383%0.82582%0.821SS**  trans-174.5106165.900000111.3
40K28.7Very low27.2Very low213 Ų213142.1 Ų142.193%0.92682%0.821SS**  trans-94.2134166.4-74.1-179.8175.41790108.5
41S27.3Very low28.1Very low128 Ų128138.8 Ų138.890%0.89581%0.809SS**  trans-175.5156135.452.50000112.1
42N25.4Very low28.9Very low146 Ų146134.1 Ų134.178%0.78181%0.807SS**  trans-79.2158.3-163.8-93.7-13.8000116.9
43M27.7Very low29.5Very low179 Ų179131.6 Ų131.688%0.88280%0.796SS**  trans52.9128.9141.9-60.2-66.4-177.200122
44G23.3Very low29.9Very low65 Ų65131.4 Ų131.467%0.6779%0.787SS**  trans124.5110137.900000118.9
45T25.4Very low30.5Very low135 Ų135132.4 Ų132.483%0.82878%0.778SS**  trans62.3120.4142.859.80000122.3
46S30.3Very low30.8Very low122 Ų122130.6 Ų130.685%0.85376%0.757SS**  trans34.9132.3136.563.40000121.3
47G26.3Very low31Very low72 Ų72123 Ų12374%0.74273%0.734SS**  trans144.8117.4151.900000113.3H49G47-H49 PolarHBondContact O-N 3.35Å
48D35.8Very low31.4Very low153 Ų153128.4 Ų128.482%0.81873%0.729SS**  trans-47.9124.8170.3-60.6-61.5000112.3
49H30.2Very low31.7Very low187 Ų187125.6 Ų125.687%0.86671%0.709SS**  trans-170.8101.3152.1-84.2-44.4000110.5G47G47-H49 PolarHBondContact O-N 3.35Å
50D36.6Very low32Very low147 Ų147128.8 Ų128.879%0.78670%0.7SS**  trans-147.938.7167.6-107-19000113.2
51D42.3Very low32.2Very low101 Ų101125.8 Ų125.854%0.5469%0.692SS.*SBendtrans-108.6-4.8175-160.339.5000113.9K55D51-K55 WeakPolarHBondContact O-CD 3.22Å; D51-K55 IonicContact OD2-NZ 2.72Å; D51-K55 PolarHBondContact OD2-NZ 3.07Å
52S39.1Very low32.7Very low103 Ų103121.9 Ų121.972%0.7267%0.672SS**Hα-helixtrans-89.7-34.4179.9101.30000113K55 M56S52-K55 PolarHBondContact O-N 3.1Å; S52-M56 PolarHBondContact O-N 2.87Å; S52-M56 VanDerWaalsContact O-N 3.14Å
53F36.8Very low33.1Very low124 Ų124122.7 Ų122.754%0.54467%0.668SS.*Hα-helixtrans-70.7-40.2-179.1-166.5-101.9000112.3K55 M56 L57F53-K55 PolarHBondContact O-N 2.7Å; F53-M56 PolarHBondContact O-N 3.45Å; F53-L57 HydrophobicContact CD1-CD1 3.81Å; F53-L57 HydrophobicContact CE1-CD1 3.56Å; F53-L57 HydrophobicContact CZ-CD1 4.34Å; F53-L57 PolarHBondContact O-N 3.29Å; F53-L57 VanDerWaalsContact O-N 3.15Å
54M35.6Very low33.1Very low113 Ų113119.7 Ų119.756%0.55766%0.664SS**Hα-helixtrans-70.6-27.9176.2-73.9-64.5-166.900113.3R58M54-R58 PolarHBondContact O-N 3.25Å
55K35.4Very low33.5Very low129 Ų129122.1 Ų122.156%0.56167%0.669SS**Hα-helixtrans-72.2-35.6171.5-84.1173.4177.1147.60112.2D51 S52 F53 S59D51-K55 WeakPolarHBondContact O-CD 3.22Å; D51-K55 IonicContact OD2-NZ 2.72Å; D51-K55 PolarHBondContact OD2-NZ 3.07Å; S52-K55 PolarHBondContact O-N 3.1Å; F53-K55 PolarHBondContact O-N 2.7Å; K55-S59 WeakPolarHBondContact O-CB 3.48Å; K55-S59 PolarHBondContact O-N 3.27Å
56M33Very low33.7Very low102 Ų102125.6 Ų125.650%0.50267%0.667SS.*Hα-helixtrans-67.9-37.5174.9-166.5176.478.600112.4S52 F53 S59 K60S52-M56 PolarHBondContact O-N 2.87Å; S52-M56 VanDerWaalsContact O-N 3.14Å; F53-M56 PolarHBondContact O-N 3.45Å; M56-S59 PolarHBondContact O-N 3.46Å; M56-K60 PolarHBondContact O-N 3.29Å; M56-K60 VanDerWaalsContact O-N 3.11Å
57L31.4Very low33.7Very low77 Ų77128.7 Ų128.740%0.40367%0.667SS.*Hα-helixtrans-68-40.6175.7-88.2157.1000112.7F53 K60 M61F53-L57 HydrophobicContact CD1-CD1 3.81Å; F53-L57 HydrophobicContact CE1-CD1 3.56Å; F53-L57 HydrophobicContact CZ-CD1 4.34Å; F53-L57 PolarHBondContact O-N 3.29Å; F53-L57 VanDerWaalsContact O-N 3.15Å; L57-K60 PolarHBondContact O-N 3.42Å; L57-M61 PolarHBondContact O-N 3.02Å
58R33.6Very low33.8Very low197 Ų197130.6 Ų130.674%0.74367%0.668SS**Hα-helixtrans-65-37.5172.8-102.7-179.1-107.4-126.5-0.5113M54 G62M54-R58 PolarHBondContact O-N 3.25Å; R58-G62 PolarHBondContact O-N 3.01Å
59S35.2Very low33.4Very low65 Ų65132.2 Ų132.246%0.45567%0.668SS.*Hα-helixtrans-66.3-35.2176.3167.70000113.3K55 M56K55-S59 WeakPolarHBondContact O-CB 3.48Å; K55-S59 PolarHBondContact O-N 3.27Å; M56-S59 PolarHBondContact O-N 3.46Å
60K32.9Very low33.3Very low146 Ų146128.6 Ų128.664%0.63566%0.661SS**Hα-helixtrans-81.8-30177-86.2178.8173.6176.40113.8M56 L57M56-K60 PolarHBondContact O-N 3.29Å; M56-K60 VanDerWaalsContact O-N 3.11Å; L57-K60 PolarHBondContact O-N 3.42Å
61M33.6Very low32.8Very low151 Ų151127.4 Ų127.474%0.74466%0.663SS**Hα-helixtrans-73.9-26170.2-79.8-178169.900113L57 K63L57-M61 PolarHBondContact O-N 3.02Å; M61-K63 VanDerWaalsContact C-N 3.29Å; M61-K63 PolarHBondContact O-N 3.39Å
62G35.8Very low32.2Very low46 Ų46128.9 Ų128.947%0.47468%0.68SS.*THydrogen-bonded Turntrans-76-4.6175.400000116.1R58R58-G62 PolarHBondContact O-N 3.01Å
63K34.9Very low31.7Very low162 Ų162136.6 Ų136.670%0.70469%0.693SS**THydrogen-bonded Turntrans-104.4-10.4179.7-73.9-180-179.8179.40114.6M61M61-K63 VanDerWaalsContact C-N 3.29Å; M61-K63 PolarHBondContact O-N 3.39Å
64C28.3Very low31.2Very low117 Ų117134.3 Ų134.379%0.79171%0.705SS**THydrogen-bonded Turntrans-89.1-8.9175.2-79.60000114.6
65C30.1Very low30.9Very low115 Ų115135.1 Ų135.178%0.77772%0.722SS**THydrogen-bonded Turntrans-9724.4176.4-73.30000114.1
66R29.7Very low30.5Very low209 Ų209132.7 Ų132.779%0.78973%0.734SS**SBendtrans-11829.7-178.7-72.1-164.2-173.4-139.22114.9
67H31.1Very low30.3Very low186 Ų186134.7 Ų134.786%0.86175%0.752SS**SBendtrans-136.711.6176.6-102.663.6000116.1
68C28.8Very low30.2Very low113 Ų113136.8 Ų136.876%0.76477%0.773SS**SBendtrans-131115.8168.5-62.90000109.7
69F26.3Very low30Very low187 Ų187135 Ų13582%0.8278%0.778SS**  trans92.7103.1176.1-67-81000118.5
70P29Very low29.6Very low111 Ų111138.8 Ų138.872%0.72180%0.798SS**  trans-78.7161.8152.933.6-27.3000110.5
71C26.3Very low29.3Very low121 Ų121135 Ų13582%0.81880%0.801SS**  trans84.884.7172.7-59.20000117.1
72C29.3Very low29.1Very low133 Ų133134.3 Ų134.390%0.89981%0.805SS**  -173.992.9109-94.40000108.7G74C72-G74 PolarHBondContact O-N 3.5Å
73R27.6Very low28.8Very low264 Ų264138 Ų138100%0.99682%0.823SS**  trans-68.4121.3160.7-85.6-177.7171.1-165.3-1.7107.6
74G27.1Very low28.4Very low77 Ų77133.8 Ų133.879%0.79483%0.827SS**  trans-146.795.4164.600000107.9C72C72-G74 PolarHBondContact O-N 3.5Å
75S30.2Very low29Very low129 Ų129135.8 Ų135.890%0.90283%0.829SS**  trans-68.4132.3174.946.70000110.9
76G27.2Very low29.1Very low79 Ų79139.4 Ų139.481%0.81484%0.835SS**  trans-174.793.5170.400000111.5
77T28.2Very low29.3Very low144 Ų144136.4 Ų136.488%0.88383%0.829SS**  trans-76.7129.916646.80000109.7
78S28.4Very low29.7Very low121 Ų121133.6 Ų133.685%0.84682%0.821SS**  trans-168.2133.4142.538.80000111.3
79N29.2Very low30.3Very low158 Ų158132.5 Ų132.585%0.84582%0.815SS**  trans-67.6150.4159.4-80.3-25.1000109.6
80V28.2Very low30.7Very low145 Ų145130.5 Ų130.588%0.87981%0.806SS**  trans160.2131130.3166.10000109.9
81G25.3Very low31.1Very low68 Ų68131 Ų13170%0.70180%0.8SS**  70.5125.1128.900000121.4
82T31.2Very low31.7Very low135 Ų135131.5 Ų131.583%0.82879%0.788SS**  trans-23.3151.3159.450.90000120.2
83S27.8Very low32Very low123 Ų123130.1 Ų130.186%0.8677%0.77SS**  trans94139.4147.278.50000119.1
84G27.7Very low32.3Very low75 Ų75121 Ų12177%0.77374%0.741SS**  trans117.7100.2155.500000115.8H86G84-H86 PolarHBondContact O-N 3.19Å
85D39.5Very low32.7Very low158 Ų158126 Ų12685%0.84574%0.735SS**  trans-59.4122.6162.2-69.2-51.4000111
86H32.6Very low33.1Very low192 Ų192123.2 Ų123.289%0.88972%0.716SS**  trans-158.797.2150.2-86.9-57.4000109.5G84 N88G84-H86 PolarHBondContact O-N 3.19Å; H86-N88 PolarHBondContact O-N 2.75Å; H86-N88 VanDerWaalsContact O-N 3.15Å
87E35.2Very low33.4Very low145 Ų145126.4 Ų126.468%0.67871%0.707SS**  trans-67.3108.3166.8-79.9-159.2147.500109.9S89 K92E87-S89 PolarHBondContact O-N 3.02Å; E87-K92 WeakPolarHBondContact OE2-CE 3.45Å; E87-K92 IonicContact OE2-NZ 3.41Å; E87-K92 PolarHBondContact OE2-NZ 3.14Å
88N38.9Very low33.6Very low127 Ų127126 Ų12668%0.67970%0.697SS**  trans-73.6124.1176.6-128.6-17000110.4H86 F90 M91H86-N88 PolarHBondContact O-N 2.75Å; H86-N88 VanDerWaalsContact O-N 3.15Å; N88-F90 PolarHBondContact O-N 3.02Å; N88-M91 PolarHBondContact O-N 3.2Å
89S40.4Very low33.8Very low91 Ų91122.9 Ų122.964%0.63668%0.684SS**Hα-helixtrans-51.7-24.2-177.2-176.40000114.3E87 M91 K92 M93E87-S89 PolarHBondContact O-N 3.02Å; S89-M91 PolarHBondContact O-N 3.2Å; S89-K92 PolarHBondContact O-N 3.46Å; S89-M93 PolarHBondContact O-N 2.85Å
90F35.7Very low34.2Very low144 Ų144123.7 Ų123.763%0.63268%0.68SS**Hα-helixtrans-64.3-36.5174.3-167.5-106.1000113.7N88 M93 L94N88-F90 PolarHBondContact O-N 3.02Å; F90-M93 PolarHBondContact O-N 3.33Å; F90-L94 HydrophobicContact CD1-CD1 3.72Å; F90-L94 HydrophobicContact CE1-CD1 3.41Å; F90-L94 VanDerWaalsContact CE1-CD1 3.41Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 HydrophobicContact CZ-CD1 4.07Å; F90-L94 PolarHBondContact O-N 2.99Å; F90-L94 VanDerWaalsContact O-N 3.12Å
91M36.7Very low34.1Very low121 Ų121128 Ų12860%0.59668%0.68SS**Hα-helixtrans-73.8-27.7178.5-78.1-65.8-146.400112.8N88 S89 R95N88-M91 PolarHBondContact O-N 3.2Å; S89-M91 PolarHBondContact O-N 3.2Å; M91-R95 WeakPolarHBondContact O-CB 3.45Å; M91-R95 PolarHBondContact O-N 3.49Å
92K39.6Very low34.3Very low132 Ų132130.5 Ų130.557%0.57469%0.686SS**Hα-helixtrans-70.2-38.3171.7-100.6171.1169.8141.40111.5E87 S89 R95 S96E87-K92 WeakPolarHBondContact OE2-CE 3.45Å; E87-K92 IonicContact OE2-NZ 3.41Å; E87-K92 PolarHBondContact OE2-NZ 3.14Å; S89-K92 PolarHBondContact O-N 3.46Å; K92-R95 PolarHBondContact O-N 3.06Å; K92-S96 PolarHBondContact O-N 2.99Å
93M35.4Very low34.5Very low104 Ų104128.9 Ų128.951%0.51268%0.679SS.*Hα-helixtrans-67.1-43.3176.8-165.4-175.3-60.400112.1S89 F90 S96 K97S89-M93 PolarHBondContact O-N 2.85Å; F90-M93 PolarHBondContact O-N 3.33Å; M93-S96 PolarHBondContact O-N 3.28Å; M93-S96 PolarHBondContact O-OG 3.06Å; M93-K97 PolarHBondContact O-N 3.38Å; M93-K97 VanDerWaalsContact O-N 3.09Å
94L33.4Very low34.8Very low74 Ų74131.5 Ų131.539%0.38768%0.677SS.*Hα-helixtrans-64.8-38.5174.9-83.3162.7000112.4F90 K97 M98F90-L94 HydrophobicContact CD1-CD1 3.72Å; F90-L94 HydrophobicContact CE1-CD1 3.41Å; F90-L94 VanDerWaalsContact CE1-CD1 3.41Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 HydrophobicContact CZ-CD1 4.07Å; F90-L94 PolarHBondContact O-N 2.99Å; F90-L94 VanDerWaalsContact O-N 3.12Å; L94-K97 PolarHBondContact O-N 2.99Å; L94-M98 WeakPolarHBondContact O-CB 3.49Å; L94-M98 PolarHBondContact O-N 3.4Å
95R36.8Very low34.9Very low181 Ų181133 Ų13368%0.68368%0.675SS**Hα-helixtrans-66.8-36.3175.4-147.1-179.5-66.3-146.56112.1M91 K92 G99M91-R95 WeakPolarHBondContact O-CB 3.45Å; M91-R95 PolarHBondContact O-N 3.49Å; K92-R95 PolarHBondContact O-N 3.06Å; R95-G99 PolarHBondContact O-N 3Å
96S38.6Very low34.3Very low71 Ų71134.5 Ų134.550%0.49767%0.674SS.*Hα-helixtrans-70.9-30.8176.184.30000113.7K92 M93K92-S96 PolarHBondContact O-N 2.99Å; M93-S96 PolarHBondContact O-N 3.28Å; M93-S96 PolarHBondContact O-OG 3.06Å
97K33.3Very low34.3Very low145 Ų145130.8 Ų130.863%0.6367%0.667SS**Hα-helixtrans-84.2-33.8176.9-78.9-176.2175.3178.80112.6M93 L94 G99 K100M93-K97 PolarHBondContact O-N 3.38Å; M93-K97 VanDerWaalsContact O-N 3.09Å; L94-K97 PolarHBondContact O-N 2.99Å; K97-G99 VanDerWaalsContact C-N 3.32Å; K97-K100 PolarHBondContact O-N 2.96Å
98M30.8Very low34.3Very low137 Ų137129.9 Ų129.968%0.67568%0.675SS**Hα-helixtrans-69.5-28.7170.5-79.7177.4163.600112.7L94 K100 W101L94-M98 WeakPolarHBondContact O-CB 3.49Å; L94-M98 PolarHBondContact O-N 3.4Å; M98-K100 PolarHBondContact O-N 2.63Å; M98-W101 PolarHBondContact O-N 3.12Å
99G34.1Very low33.8Very low54 Ų54130 Ų13056%0.55769%0.685SS**THydrogen-bonded Turntrans-69-9.4173.500000115.5R95 K97R95-G99 PolarHBondContact O-N 3Å; K97-G99 VanDerWaalsContact C-N 3.32Å
100K36.8Very low33.6Very low176 Ų176138.3 Ų138.377%0.76570%0.702SS**THydrogen-bonded Turntrans-108.9-5.5177.7-74.3-177.9176.9-179.10114.4K97 M98K97-K100 PolarHBondContact O-N 2.96Å; M98-K100 PolarHBondContact O-N 2.63Å
101W27.1Very low33.3Very low235 Ų235134.2 Ų134.289%0.8970%0.7SS**THydrogen-bonded Turntrans-110.1-12.1-176.6-96.549.7000114.7M98 C103M98-W101 PolarHBondContact O-N 3.12Å; W101-C103 VanDerWaalsContact C-N 3.26Å; W101-C103 PolarHBondContact O-N 3.39Å
102C29.2Very low33.3Very low120 Ų120133.9 Ų133.981%0.81171%0.71SS**THydrogen-bonded Turntrans-80.72.2176-910000114.7
103C35Very low32.9Very low101 Ų101131.4 Ų131.468%0.68272%0.721SS**THydrogen-bonded Turntrans-92.83.5-172.8-560000115.1W101W101-C103 VanDerWaalsContact C-N 3.26Å; W101-C103 PolarHBondContact O-N 3.39Å
104H34.3Very low33.1Very low178 Ų178136 Ų13682%0.82474%0.739SS**SBendtrans-130.4-1.5-169.7-111.3-43.8000119
105C29.6Very low33.2Very low108 Ų108134.4 Ų134.473%0.7373%0.734SS**SBendtrans-140.595.8179.2-64.60000110.6
106F26.6Very low33.1Very low188 Ų188134 Ų13483%0.82575%0.745SS**  trans160.9101143.5-92.9-70.7000110.6
107P33.7Very low33.1Very low114 Ų114132 Ų13274%0.7473%0.73SS**  trans-83.4149164.524.1-12.1000110.5
108C33.9Very low33.4Very low127 Ų127127.8 Ų127.886%0.85873%0.728SS**  trans8375.2169.1-56.90000118.1
109C28.3Very low33.7Very low130 Ų130126.5 Ų126.588%0.87874%0.739SS**  trans-120.2115.8144.7-81.50000108.9G111C109-G111 PolarHBondContact O-N 2.86Å
110R36.6Very low34.5Very low265 Ų265129.6 Ų129.6100%173%0.734SS**  trans-65.597.9167.4-86-176.6172.9-144.30108.6
111G28.7Very low35Very low57 Ų57122.3 Ų122.359%0.58871%0.708SS**SBendtrans-175.3108.5170.900000107.7C109 G113C109-G111 PolarHBondContact O-N 2.86Å; G111-G113 PolarHBondContact O-N 2.65Å
112S38Very low36.3Very low115 Ų115116.6 Ų116.680%0.80470%0.695SS**  trans25.886.5168.660.80000114.7K114S112-K114 PolarHBondContact O-N 3.49Å
113G31.6Very low37.9Very low79 Ų79112.6 Ų112.681%0.81466%0.663SS**  trans-56111173.600000110.1G111 S115G111-G113 PolarHBondContact O-N 2.65Å; G113-S115 PolarHBondContact O-N 3.43Å
114K38.7Very low39.5Very low200 Ų200111.7 Ų111.787%0.8765%0.652SS**  trans-74.795.8159-69.6-176178-177.80106S112S112-K114 PolarHBondContact O-N 3.49Å
115S35.3Very low41.4Very low41 Ų41105.9 Ų105.929%0.28763%0.625SS.*  trans-64136.4160.948.70000107.9G113 V117G113-S115 PolarHBondContact O-N 3.43Å; S115-V117 PolarHBondContact O-N 3.47Å
116N34.9Very low43.8Very low173 Ų173102.6 Ų102.693%0.92560%0.603SS**SBendtrans-85.251.6-170.2-134.419000110.7
117V38.8Very low46.3Very low29 Ų2993.7 Ų93.718%0.17657%0.565CS.*SBendtrans-133.7111.7-180-172.40000109.9S115 Y344 S347 S348S115-V117 PolarHBondContact O-N 3.47Å; V117-Y344 HydrophobicContact CG1-CD1 3.87Å; V117-Y344 HydrophobicContact CG1-CE1 3.99Å; V117-S347 VanDerWaalsContact CG2-C 3.45Å; V117-S347 VanDerWaalsContact CG2-O 3.32Å; V117-S347 WeakPolarHBondContact CG2-O 3.36Å; V117-S348 VanDerWaalsContact CG2-OG 3.29Å; V117-S348 WeakPolarHBondContact CG2-OG 3.42Å
118G39.1Very low48.8Very low57 Ų5788.8 Ų88.859%0.58853%0.532SS*.SBendtrans69.8125169.800000114.6W120G118-W120 VanDerWaalsContact O-CD1 3.31Å; G118-W120 PolarHBondContact O-N 3.23Å
119A37.9Very low50.6Low109 Ų10988.7 Ų88.790%0.90152%0.52SS*.  trans-57.1109.4169.200000109.6G121A119-G121 PolarHBondContact O-N 2.91Å
120W51Low53Low119 Ų11987 Ų8745%0.45150%0.499SS..  trans-66.386.2170.6-65.484.6000108.5G118 D122 C314G118-W120 VanDerWaalsContact O-CD1 3.31Å; G118-W120 PolarHBondContact O-N 3.23Å; W120-D122 PolarHBondContact O-N 3.2Å; W120-C314 HydrophobicContact CH2-CB 3.36Å; W120-C314 HydrophobicContact CZ2-CB 3.81Å; W120-C314 VanDerWaalsContact CZ2-O 3.27Å; W120-C314 WeakPolarHBondContact CZ2-O 3.43Å; W120-C314 HydrophobicContact CZ3-CB 4.3Å
121G45.8Very low55.1Low23 Ų2377.1 Ų77.124%0.23747%0.469CS..  trans-71.6120.817800000111.4A119 Y123 Y304A119-G121 PolarHBondContact O-N 2.91Å; G121-Y123 PolarHBondContact O-N 3.35Å; G121-Y304 PolarHBondContact O-OH 3.32Å
122D54.3Low58Low115 Ų11580.1 Ų80.162%0.61546%0.463SS*.  trans66.521.8145-31.3-37.4000120W120 D124 R303W120-D122 PolarHBondContact O-N 3.2Å; D122-D124 PolarHBondContact O-N 3.08Å; D122-D124 VanDerWaalsContact O-N 3.15Å; D122-R303 IonicContact OD2-CZ 3.21Å; D122-R303 IonicContact OD2-NH1 2.73Å; D122-R303 PolarHBondContact OD2-NH1 3.25Å; D122-R303 IonicContact OD2-NH2 3.74Å
123Y63.9Low60.4Low36 Ų3675.4 Ų75.414%0.14143%0.428CS..  trans-78.398.3163.3-167-108.9000110G121 H125 F128 C271 L273 L278 H281 E282G121-Y123 PolarHBondContact O-N 3.35Å; Y123-H125 AromaticContact CD1-CD2 3.91Å; Y123-H125 AromaticContact CD1-CE1 3.53Å; Y123-H125 AromaticContact CD1-ND1 3.77Å; Y123-H125 AromaticContact CD1-NE2 3.62Å; Y123-H125 AromaticContact CE1-CE1 3.71Å; Y123-H125 AromaticContact CE1-ND1 3.64Å; Y123-H125 PolarHBondContact O-CD2 2.94Å; Y123-H125 PolarHBondContact O-N 3.06Å; Y123-F128 HydrophobicContact CE1-CE2 4.3Å; Y123-F128 WeakPolarHBondContact OH-CE2 3.37Å; Y123-F128 WeakPolarHBondContact OH-CZ 3.25Å; Y123-C271 HydrophobicContact CD2-CB 3.77Å; Y123-C271 WeakPolarHBondContact CD2-SG 3.44Å; Y123-C271 HydrophobicContact CE2-CB 4.09Å; Y123-L273 HydrophobicContact CD2-CD1 3.73Å; Y123-L273 HydrophobicContact CE2-CD1 3.48Å; Y123-L273 VanDerWaalsContact CE2-CD1 3.48Å; Y123-L278 HydrophobicContact CE1-CD1 4.14Å; Y123-L278 WeakPolarHBondContact OH-CD1 3.41Å; Y123-H281 AromaticContact CD1-CE1 3.56Å; Y123-H281 AromaticContact CD1-ND1 3.89Å; Y123-H281 AromaticContact CG-CE1 3.98Å; Y123-E282 WeakPolarHBondContact CE1-OE1 3.41Å
124D68.4Low63Low82 Ų8278.3 Ų78.344%0.43942%0.42SS..  trans-78.1103.1179.4-174.19.9000111.4D122 S126D122-D124 PolarHBondContact O-N 3.08Å; D122-D124 VanDerWaalsContact O-N 3.15Å; D124-S126 PolarHBondContact O-N 3.36Å; D124-S126 WeakPolarHBondContact OD1-CA 3.21Å; D124-S126 WeakPolarHBondContact OD1-CB 3.48Å; D124-S126 PolarHBondContact OD1-N 2.93Å; D124-S126 PolarHBondContact OD1-OG 3.37Å; D124-S126 WeakPolarHBondContact OD2-CB 3.26Å; D124-S126 PolarHBondContact OD2-OG 3.09Å
125H74.4Confident65.2Low57 Ų5770.8 Ų70.826%0.26439%0.389SS..G310 helixtrans-73.2-1.7174.3-64.1-92.5000113.5Y123 A127 F128 M129 E282Y123-H125 AromaticContact CD1-CD2 3.91Å; Y123-H125 AromaticContact CD1-CE1 3.53Å; Y123-H125 AromaticContact CD1-ND1 3.77Å; Y123-H125 AromaticContact CD1-NE2 3.62Å; Y123-H125 AromaticContact CE1-CE1 3.71Å; Y123-H125 AromaticContact CE1-ND1 3.64Å; Y123-H125 PolarHBondContact O-CD2 2.94Å; Y123-H125 PolarHBondContact O-N 3.06Å; H125-A127 PolarHBondContact O-N 3.28Å; H125-A127 VanDerWaalsContact O-N 3.09Å; H125-F128 PolarHBondContact O-N 2.86Å; H125-M129 HydrophobicContact CB-CE 4Å; H125-M129 HydrophobicContact CB-CG 4.35Å; H125-M129 WeakPolarHBondContact O-CG 3.29Å; H125-M129 PolarHBondContact O-N 3.32Å; H125-E282 IonicContact CE1-OE1 3.23Å; H125-E282 PolarHBondContact CE1-OE1 3.09Å; H125-E282 IonicContact CE1-OE2 3.7Å; H125-E282 PolarHBondContact CE1-OE2 2.92Å; H125-E282 IonicContact ND1-OE1 3.55Å; H125-E282 IonicContact ND1-OE2 3.97Å
126S80Confident67.4Low39 Ų3977.9 Ų77.927%0.27341%0.409SS..G310 helixtrans-55-30.2-179.572.50000112.9D124 F128 Y238D124-S126 PolarHBondContact O-N 3.36Å; D124-S126 WeakPolarHBondContact OD1-CA 3.21Å; D124-S126 WeakPolarHBondContact OD1-CB 3.48Å; D124-S126 PolarHBondContact OD1-N 2.93Å; D124-S126 PolarHBondContact OD1-OG 3.37Å; D124-S126 WeakPolarHBondContact OD2-CB 3.26Å; D124-S126 PolarHBondContact OD2-OG 3.09Å; S126-F128 PolarHBondContact O-N 3.05Å; S126-F128 VanDerWaalsContact O-N 3.14Å; S126-Y238 PolarHBondContact OG-OH 3.34Å
127A79.7Confident69.2Low1 Ų179.2 Ų79.21%0.00840%0.401CS..G310 helixtrans-55-31174.800000112.8H125 Q215 Y238 Y245H125-A127 PolarHBondContact O-N 3.28Å; H125-A127 VanDerWaalsContact O-N 3.09Å; A127-Q215 PolarHBondContact O-NE2 3.49Å; A127-Y238 HydrophobicContact CB-CD1 4.35Å; A127-Y238 HydrophobicContact CB-CD2 3.31Å; A127-Y238 HydrophobicContact CB-CE2 3.7Å; A127-Y238 HydrophobicContact CB-CG 3.72Å; A127-Y245 WeakPolarHBondContact O-CE1 3.48Å; A127-Y245 PolarHBondContact O-OH 3.08Å
128F85.4Confident71.1Confident11 Ų1186.1 Ų86.15%0.04843%0.431CS..THydrogen-bonded Turntrans-106.8-22.2-172.3-51.6-80.6000114.5Y123 H125 S126 E130 Y245 Y248 L278Y123-F128 HydrophobicContact CE1-CE2 4.3Å; Y123-F128 WeakPolarHBondContact OH-CE2 3.37Å; Y123-F128 WeakPolarHBondContact OH-CZ 3.25Å; H125-F128 PolarHBondContact O-N 2.86Å; S126-F128 PolarHBondContact O-N 3.05Å; S126-F128 VanDerWaalsContact O-N 3.14Å; F128-E130 VanDerWaalsContact C-N 3.31Å; F128-E130 PolarHBondContact O-N 3.21Å; F128-Y245 AromaticContact CD1-CD1 3.64Å; F128-Y245 HydrophobicContact CD1-CD1 3.64Å; F128-Y245 AromaticContact CD1-CE1 3.59Å; F128-Y245 HydrophobicContact CD1-CE1 3.59Å; F128-Y245 HydrophobicContact CD1-CG 4.48Å; F128-Y245 AromaticContact CE1-CD1 3.83Å; F128-Y245 HydrophobicContact CE1-CD1 3.83Å; F128-Y245 AromaticContact CE1-CE1 3.9Å; F128-Y245 HydrophobicContact CE1-CE1 3.9Å; F128-Y245 HydrophobicContact CE1-CG 4.24Å; F128-Y245 HydrophobicContact CG-CE1 4.48Å; F128-Y248 HydrophobicContact CB-CD1 3.69Å; F128-Y248 HydrophobicContact CB-CD2 4.15Å; F128-Y248 HydrophobicContact CB-CE1 3.31Å; F128-Y248 HydrophobicContact CB-CE2 3.81Å; F128-Y248 HydrophobicContact CB-CG 4.09Å; F128-Y248 AromaticContact CD1-CD1 3.55Å; F128-Y248 HydrophobicContact CD1-CD1 3.55Å; F128-Y248 AromaticContact CD1-CD2 3.71Å; F128-Y248 HydrophobicContact CD1-CD2 3.71Å; F128-Y248 HydrophobicContact CD1-CE1 4.12Å; F128-Y248 HydrophobicContact CD1-CE2 4.25Å; F128-Y248 AromaticContact CD1-CG 3.32Å; F128-Y248 HydrophobicContact CD1-CG 3.32Å; F128-Y248 AromaticContact CD2-CD2 3.77Å; F128-Y248 HydrophobicContact CD2-CD2 3.77Å; F128-Y248 AromaticContact CD2-CE2 3.76Å; F128-Y248 HydrophobicContact CD2-CE2 3.76Å; F128-Y248 HydrophobicContact CD2-CG 4.26Å; F128-Y248 HydrophobicContact CE1-CD1 4.4Å; F128-Y248 HydrophobicContact CE1-CD2 4.01Å; F128-Y248 AromaticContact CE1-CG 3.74Å; F128-Y248 HydrophobicContact CE1-CG 3.74Å; F128-Y248 HydrophobicContact CE2-CD2 4.1Å; F128-Y248 HydrophobicContact CE2-CE2 4.43Å; F128-Y248 AromaticContact CG-CD1 3.74Å; F128-Y248 HydrophobicContact CG-CD1 3.74Å; F128-Y248 AromaticContact CG-CD2 3.59Å; F128-Y248 HydrophobicContact CG-CD2 3.59Å; F128-Y248 AromaticContact CG-CE1 3.82Å; F128-Y248 HydrophobicContact CG-CE1 3.82Å; F128-Y248 AromaticContact CG-CE2 3.67Å; F128-Y248 HydrophobicContact CG-CE2 3.67Å; F128-Y248 AromaticContact CG-CG 3.62Å; F128-Y248 HydrophobicContact CG-CG 3.62Å; F128-Y248 AromaticContact CG-CZ 3.77Å; F128-Y248 HydrophobicContact CZ-CD2 4.2Å; F128-Y248 HydrophobicContact CZ-CG 4.38Å; F128-L278 HydrophobicContact CZ-CD2 4.28Å
129M72.4Confident72.8Confident124 Ų12485.1 Ų85.161%0.61141%0.413SS*.SBendtrans-75.1-6.1-166.7-72.2-66.5172.900116.3H125H125-M129 HydrophobicContact CB-CE 4Å; H125-M129 HydrophobicContact CB-CG 4.35Å; H125-M129 WeakPolarHBondContact O-CG 3.29Å; H125-M129 PolarHBondContact O-N 3.32Å
130E77.3Confident75Confident96 Ų9680.1 Ų80.145%0.44937%0.371SS..  trans-137.587.3179.2-69.5176.1178.300110.9F128 H134 Q215F128-E130 VanDerWaalsContact C-N 3.31Å; F128-E130 PolarHBondContact O-N 3.21Å; E130-H134 IonicContact OE1-NE2 3.51Å; E130-H134 IonicContact OE2-CD2 3.73Å; E130-H134 IonicContact OE2-NE2 2.98Å; E130-Q215 PolarHBondContact O-NE2 2.92Å
131P81.1Confident76.8Confident57 Ų5777.4 Ų77.437%0.3737%0.365SS..  trans-70.4-40.5-172.725.6-32.7000111.9K212 Q215 C216P131-K212 WeakPolarHBondContact O-CE 3.4Å; P131-K212 PolarHBondContact O-NZ 2.84Å; P131-Q215 HydrophobicContact CB-CG 4.02Å; P131-Q215 WeakPolarHBondContact CB-O 3.38Å; P131-C216 VanDerWaalsContact C-SG 3.53Å; P131-C216 PolarHBondContact O-SG 2.7Å
132R88.9Confident78.8Confident119 Ų11983.3 Ų83.345%0.44938%0.384SS..SBendtrans-90.3152.3-179.9-63.8-170.8-174.2-83.5-4.2111.4A182 E218R132-A182 PolarHBondContact NH1-O 2.97Å; R132-E218 IonicContact CZ-OE1 3.66Å; R132-E218 IonicContact NH1-OE1 3.27Å; R132-E218 PolarHBondContact NH1-OE1 3.04Å; R132-E218 IonicContact NH2-OE1 3.86Å; R132-E218 PolarHBondContact NH2-OE1 3.31Å
133Y89.9Confident80.6Confident17 Ų1778 Ų787%0.06736%0.356CS..PPolyproline II helixtrans-69.7139.5175.4-71-64.3000111.7W148 R174 H178 L179 A182 D203 K212Y133-W148 HydrophobicContact CD2-CZ3 4.23Å; Y133-W148 WeakPolarHBondContact O-CH2 3.32Å; Y133-R174 HydrophobicContact CE1-CG 4.04Å; Y133-H178 HydrophobicContact CE2-CB 4.1Å; Y133-H178 PolarHBondContact OH-CD2 2.92Å; Y133-L179 HydrophobicContact CD2-CD2 3.78Å; Y133-L179 HydrophobicContact CE2-CD2 4.14Å; Y133-L179 HydrophobicContact CG-CD2 4.43Å; Y133-A182 HydrophobicContact CD2-CB 3.78Å; Y133-A182 HydrophobicContact CE2-CB 3.77Å; Y133-D203 WeakPolarHBondContact CE1-OD2 3.37Å; Y133-D203 PolarHBondContact OH-OD2 3.32Å; Y133-K212 HydrophobicContact CE1-CD 4.17Å; Y133-K212 HydrophobicContact CE2-CD 4.37Å; Y133-K212 HydrophobicContact CE2-CG 4.23Å; Y133-K212 VanDerWaalsContact OH-CG 3.29Å; Y133-K212 WeakPolarHBondContact OH-CG 3.46Å
134H85.3Confident82Confident139 Ų13976.3 Ų76.364%0.64435%0.349SS*.PPolyproline II helixtrans-82.9124.5162.1-65.6-59.6000109.1E130 R174E130-H134 IonicContact OE1-NE2 3.51Å; E130-H134 IonicContact OE2-CD2 3.73Å; E130-H134 IonicContact OE2-NE2 2.98Å; H134-R174 PolarHBondContact O-NH1 3.49Å
135I84.7Confident83Confident43 Ų4376.5 Ų76.522%0.22134%0.344CS..  trans-136.1130.9-172.1-60-167.3000110L140 W148 L179I135-L140 HydrophobicContact CD1-CD1 4.14Å; I135-L140 HydrophobicContact CD1-CD2 4.37Å; I135-L140 HydrophobicContact CG2-CD1 3.54Å; I135-L140 HydrophobicContact CG2-CD2 3.92Å; I135-L140 HydrophobicContact CG2-CG 3.56Å; I135-W148 HydrophobicContact CB-CZ2 4.5Å; I135-W148 HydrophobicContact CD1-CD2 3.51Å; I135-W148 HydrophobicContact CD1-CE3 3.21Å; I135-W148 HydrophobicContact CD1-CG 4.32Å; I135-W148 HydrophobicContact CD1-CH2 3.6Å; I135-W148 HydrophobicContact CD1-CZ2 3.9Å; I135-W148 HydrophobicContact CD1-CZ3 3.27Å; I135-W148 HydrophobicContact CG1-CE3 4.42Å; I135-W148 HydrophobicContact CG1-CH2 4Å; I135-W148 HydrophobicContact CG1-CZ2 4.23Å; I135-W148 HydrophobicContact CG1-CZ3 4.12Å; I135-L179 HydrophobicContact CD1-CD2 3.55Å
136R81.7Confident83.9Confident190 Ų19074 Ų7472%0.71733%0.333SS*.  trans-97.6144.4164.7-52.3179.4175.3-172.3-0.5109.2E138 D139R136-E138 PolarHBondContact O-N 3.15Å; R136-E138 VanDerWaalsContact O-N 3.17Å; R136-D139 WeakPolarHBondContact CB-OD2 3.49Å; R136-D139 PolarHBondContact O-N 2.85Å; R136-D139 VanDerWaalsContact O-N 3.1Å
137R72.8Confident84.5Confident200 Ų20072.1 Ų72.176%0.75532%0.32SS*.G310 helixtrans-58.4-32.1-174.2-77.7-175.3172.9177.8-1.3113.5D139R137-D139 VanDerWaalsContact C-N 3.27Å; R137-D139 PolarHBondContact O-N 3.41Å
138E78.3Confident85.1Confident174 Ų17474.3 Ų74.381%0.81333%0.328SS*.G310 helixtrans-73-16.7-178-67.4150.8-146.500113.4R136R136-E138 PolarHBondContact O-N 3.15Å; R136-E138 VanDerWaalsContact O-N 3.17Å
139D75.4Confident85.2Confident36 Ų3679.6 Ų79.619%0.19335%0.348CS..G310 helixtrans-88.6-10.9-174.2-63.5-36.8000113.6R136 R137 K171R136-D139 WeakPolarHBondContact CB-OD2 3.49Å; R136-D139 PolarHBondContact O-N 2.85Å; R136-D139 VanDerWaalsContact O-N 3.1Å; R137-D139 VanDerWaalsContact C-N 3.27Å; R137-D139 PolarHBondContact O-N 3.41Å; D139-K171 IonicContact OD1-NZ 3.24Å; D139-K171 PolarHBondContact OD1-NZ 3.13Å
140L84.3Confident86Confident4 Ų474.5 Ų74.52%0.02133%0.326CS..  trans-107.4131-173.8-61.8-165.7000112.1I135 H144 R145 W148 L179I135-L140 HydrophobicContact CD1-CD1 4.14Å; I135-L140 HydrophobicContact CD1-CD2 4.37Å; I135-L140 HydrophobicContact CG2-CD1 3.54Å; I135-L140 HydrophobicContact CG2-CD2 3.92Å; I135-L140 HydrophobicContact CG2-CG 3.56Å; L140-H144 HydrophobicContact CB-CB 3.92Å; L140-H144 HydrophobicContact CD1-CB 4.41Å; L140-H144 HydrophobicContact CD2-CB 4Å; L140-H144 HydrophobicContact CG-CB 4.32Å; L140-R145 HydrophobicContact CB-CG 3.59Å; L140-R145 HydrophobicContact CD1-CG 4.19Å; L140-R145 PolarHBondContact O-NH1 3.25Å; L140-W148 HydrophobicContact CD1-CB 4.12Å; L140-W148 HydrophobicContact CD1-CG 4.37Å; L140-L179 HydrophobicContact CD1-CD1 4.18Å; L140-L179 HydrophobicContact CD2-CD1 3.89Å
141D87.6Confident86.2Confident63 Ų6379.3 Ų79.334%0.33735%0.346SS..  trans-71.7173.6167-72.3-25.5000112.2L143 H144 R145 K168D141-L143 VanDerWaalsContact C-N 3.32Å; D141-L143 PolarHBondContact O-N 2.95Å; D141-H144 PolarHBondContact O-N 3.14Å; D141-R145 VanDerWaalsContact O-CB 3.3Å; D141-R145 WeakPolarHBondContact O-CB 3.47Å; D141-R145 WeakPolarHBondContact O-CG 3.43Å; D141-R145 PolarHBondContact O-N 3.26Å; D141-K168 VanDerWaalsContact OD2-CD 3.31Å; D141-K168 WeakPolarHBondContact OD2-CD 3.42Å; D141-K168 WeakPolarHBondContact OD2-CE 3.46Å; D141-K168 IonicContact OD2-NZ 3.75Å; D141-K168 PolarHBondContact OD2-NZ 3Å
142K89.2Confident86.4Confident146 Ų14678 Ų7864%0.63534%0.337SS*.Hα-helixtrans-52.9-46.2-179.8-67.9-179.4-177.8176.30112.6R145 A146 M160K142-R145 WeakPolarHBondContact O-CB 3.48Å; K142-R145 PolarHBondContact O-N 3.47Å; K142-A146 WeakPolarHBondContact O-CB 3.4Å; K142-A146 PolarHBondContact O-N 2.73Å; K142-M160 HydrophobicContact CB-SD 4.45Å
143L91.4Very high86.3Confident3 Ų375.6 Ų75.62%0.01634%0.337CS..Hα-helixtrans-68.5-44.6-179.9-179.462.5000111.9D141 R145 A146 A147 L161 T164 A176D141-L143 VanDerWaalsContact C-N 3.32Å; D141-L143 PolarHBondContact O-N 2.95Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.35Å; L143-A146 PolarHBondContact O-N 3.45Å; L143-A147 WeakPolarHBondContact O-CB 3.32Å; L143-A147 PolarHBondContact O-N 3.1Å; L143-L161 HydrophobicContact CD1-CD2 3.59Å; L143-L161 HydrophobicContact CD1-CG 4.21Å; L143-L161 HydrophobicContact CD2-CD2 3.72Å; L143-L161 HydrophobicContact CG-CD2 4.32Å; L143-T164 HydrophobicContact CB-CG2 4.3Å; L143-T164 HydrophobicContact CD2-CG2 4.33Å; L143-A176 HydrophobicContact CD1-CB 4.47Å; L143-A176 HydrophobicContact CD2-CB 3.92Å; L143-A176 HydrophobicContact CG-CB 3.76Å
144H92.7Very high86.1Confident2 Ų280.4 Ų80.41%0.00936%0.355CS..Hα-helixtrans-60-41.2176.3-6796.8000112.2L140 D141 A147 W148 K168 R174 L179L140-H144 HydrophobicContact CB-CB 3.92Å; L140-H144 HydrophobicContact CD1-CB 4.41Å; L140-H144 HydrophobicContact CD2-CB 4Å; L140-H144 HydrophobicContact CG-CB 4.32Å; D141-H144 PolarHBondContact O-N 3.14Å; H144-A147 PolarHBondContact O-N 3.24Å; H144-W148 WeakPolarHBondContact O-CB 3.41Å; H144-W148 PolarHBondContact O-N 2.97Å; H144-K168 PolarHBondContact CE1-O 3.09Å; H144-K168 VanDerWaalsContact CE1-O 3.28Å; H144-K168 PolarHBondContact NE2-O 3.43Å; H144-R174 PolarHBondContact NE2-O 3.3Å; H144-L179 HydrophobicContact CB-CD1 3.54Å; H144-L179 WeakPolarHBondContact O-CD1 3.47Å
145R90.9Very high86.2Confident85 Ų8580.8 Ų80.832%0.32135%0.354SS..Hα-helixtrans-59.3-49.7173.2-84.9-165.2-54.6-11211.6112.1L140 D141 K142 L143 A147 W148 W149L140-R145 HydrophobicContact CB-CG 3.59Å; L140-R145 HydrophobicContact CD1-CG 4.19Å; L140-R145 PolarHBondContact O-NH1 3.25Å; D141-R145 VanDerWaalsContact O-CB 3.3Å; D141-R145 WeakPolarHBondContact O-CB 3.47Å; D141-R145 WeakPolarHBondContact O-CG 3.43Å; D141-R145 PolarHBondContact O-N 3.26Å; K142-R145 WeakPolarHBondContact O-CB 3.48Å; K142-R145 PolarHBondContact O-N 3.47Å; L143-R145 VanDerWaalsContact C-N 3.3Å; L143-R145 PolarHBondContact O-N 3.35Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 3.2Å; R145-W148 PolarHBondContact O-N 3.04Å; R145-W149 HydrophobicContact CB-CE3 3.8Å; R145-W149 HydrophobicContact CB-CH2 4Å; R145-W149 HydrophobicContact CB-CZ3 3.27Å; R145-W149 VanDerWaalsContact CD-CH2 3.5Å; R145-W149 VanDerWaalsContact CD-CZ3 3.48Å; R145-W149 HydrophobicContact CG-CE3 4.33Å; R145-W149 HydrophobicContact CG-CH2 3.6Å; R145-W149 HydrophobicContact CG-CZ3 3.42Å; R145-W149 VanDerWaalsContact CG-CZ3 3.42Å; R145-W149 PolarHBondContact O-N 3.45Å
146A91.8Very high86.3Confident4 Ų481.9 Ų81.93%0.03336%0.361CS..Hα-helixtrans-59.1-44177.100000111.7K142 L143 W148 G150 V152 L157 M160K142-A146 WeakPolarHBondContact O-CB 3.4Å; K142-A146 PolarHBondContact O-N 2.73Å; L143-A146 PolarHBondContact O-N 3.45Å; A146-W148 PolarHBondContact O-N 3.42Å; A146-G150 PolarHBondContact O-N 3.24Å; A146-V152 HydrophobicContact CB-CB 4.26Å; A146-V152 HydrophobicContact CB-CG1 4.45Å; A146-V152 HydrophobicContact CB-CG2 3.67Å; A146-L157 HydrophobicContact CB-CD2 3.64Å; A146-M160 HydrophobicContact CB-SD 4.02Å
147A93.3Very high86.4Confident0 Ų073.1 Ų73.10%033%0.328CS..Hα-helixtrans-66.1-34.717700000113.9L143 H144 R145 A176 L179 A180 N185 V188L143-A147 WeakPolarHBondContact O-CB 3.32Å; L143-A147 PolarHBondContact O-N 3.1Å; H144-A147 PolarHBondContact O-N 3.24Å; R145-A147 VanDerWaalsContact C-N 3.31Å; R145-A147 PolarHBondContact O-N 3.2Å; A147-A176 HydrophobicContact CB-CB 3.88Å; A147-A176 VanDerWaalsContact CB-O 3.28Å; A147-A176 WeakPolarHBondContact CB-O 3.35Å; A147-L179 HydrophobicContact CB-CB 4.29Å; A147-A180 HydrophobicContact CB-CB 4.07Å; A147-A180 VanDerWaalsContact O-CA 3.24Å; A147-A180 WeakPolarHBondContact O-CA 3.32Å; A147-A180 PolarHBondContact O-N 3.09Å; A147-N185 PolarHBondContact O-ND2 3.39Å; A147-V188 HydrophobicContact CB-CG1 4.13Å
148W91.9Very high87Confident47 Ų4765.7 Ų65.718%0.17830%0.303CS..Hα-helixtrans-69.9-44.4176.9179.1-102000112.6Y133 I135 L140 H144 R145 A146 L179 N183 N185Y133-W148 HydrophobicContact CD2-CZ3 4.23Å; Y133-W148 WeakPolarHBondContact O-CH2 3.32Å; I135-W148 HydrophobicContact CB-CZ2 4.5Å; I135-W148 HydrophobicContact CD1-CD2 3.51Å; I135-W148 HydrophobicContact CD1-CE3 3.21Å; I135-W148 HydrophobicContact CD1-CG 4.32Å; I135-W148 HydrophobicContact CD1-CH2 3.6Å; I135-W148 HydrophobicContact CD1-CZ2 3.9Å; I135-W148 HydrophobicContact CD1-CZ3 3.27Å; I135-W148 HydrophobicContact CG1-CE3 4.42Å; I135-W148 HydrophobicContact CG1-CH2 4Å; I135-W148 HydrophobicContact CG1-CZ2 4.23Å; I135-W148 HydrophobicContact CG1-CZ3 4.12Å; L140-W148 HydrophobicContact CD1-CB 4.12Å; L140-W148 HydrophobicContact CD1-CG 4.37Å; H144-W148 WeakPolarHBondContact O-CB 3.41Å; H144-W148 PolarHBondContact O-N 2.97Å; R145-W148 PolarHBondContact O-N 3.04Å; A146-W148 PolarHBondContact O-N 3.42Å; W148-L179 HydrophobicContact CB-CB 4.44Å; W148-L179 HydrophobicContact CE3-CB 4.22Å; W148-L179 HydrophobicContact CE3-CD2 3.91Å; W148-L179 HydrophobicContact CZ3-CD2 4.28Å; W148-N183 WeakPolarHBondContact CZ3-ND2 3.35Å; W148-N183 VanDerWaalsContact CZ3-OD1 3.24Å; W148-N183 WeakPolarHBondContact CZ3-OD1 3.37Å; W148-N183 PolarHBondContact O-ND2 3.37Å; W148-N185 PolarHBondContact O-ND2 3.18Å
149W89.1Confident87.4Confident123 Ų12361.3 Ų61.347%0.46629%0.288SS..Hα-helixtrans-85.7-27.3-175.9-70.3-58.5000114.5R145 K151R145-W149 HydrophobicContact CB-CE3 3.8Å; R145-W149 HydrophobicContact CB-CH2 4Å; R145-W149 HydrophobicContact CB-CZ3 3.27Å; R145-W149 VanDerWaalsContact CD-CH2 3.5Å; R145-W149 VanDerWaalsContact CD-CZ3 3.48Å; R145-W149 HydrophobicContact CG-CE3 4.33Å; R145-W149 HydrophobicContact CG-CH2 3.6Å; R145-W149 HydrophobicContact CG-CZ3 3.42Å; R145-W149 VanDerWaalsContact CG-CZ3 3.42Å; R145-W149 PolarHBondContact O-N 3.45Å; W149-K151 PolarHBondContact O-N 3.25Å
150G88.2Confident87.9Confident16 Ų1662.1 Ų62.117%0.16529%0.291CS..  trans69.6-20.5179.700000115.5A146 V152 N185A146-G150 PolarHBondContact O-N 3.24Å; G150-V152 PolarHBondContact O-N 2.96Å; G150-N185 VanDerWaalsContact CA-CG 3.42Å; G150-N185 WeakPolarHBondContact CA-OD1 3.47Å; G150-N185 PolarHBondContact N-ND2 2.91Å
151K82.6Confident88Confident198 Ų19862.8 Ų62.886%0.86130%0.295SS*.  trans-81.746.8-179-60.6-176.7-177.5-177.10113W149W149-K151 PolarHBondContact O-N 3.25Å
152V84.3Confident87.8Confident28 Ų2869.1 Ų69.117%0.1731%0.314CS..SBendtrans-117.5124.4178.6-175.10000108.7A146 G150 R154 D156 L157 M160A146-V152 HydrophobicContact CB-CB 4.26Å; A146-V152 HydrophobicContact CB-CG1 4.45Å; A146-V152 HydrophobicContact CB-CG2 3.67Å; G150-V152 PolarHBondContact O-N 2.96Å; V152-R154 PolarHBondContact O-N 3.13Å; V152-D156 HydrophobicContact CG1-CB 3.87Å; V152-L157 HydrophobicContact CB-CD1 4.34Å; V152-L157 HydrophobicContact CB-CD2 4.36Å; V152-L157 HydrophobicContact CB-CG 4.03Å; V152-L157 HydrophobicContact CG1-CD2 4.35Å; V152-L157 HydrophobicContact CG1-CG 3.89Å; V152-M160 HydrophobicContact CG1-CE 4.41Å
153P87.5Confident87.2Confident70 Ų7068.8 Ų68.846%0.45532%0.319SS..  trans-52.3136.7177-26.334.5000111.3K155 D156 L157P153-K155 HydrophobicContact CB-CG 3.99Å; P153-K155 PolarHBondContact O-N 2.84Å; P153-D156 WeakPolarHBondContact CD-OD2 3.45Å; P153-D156 WeakPolarHBondContact CG-OD2 3.47Å; P153-D156 PolarHBondContact O-N 3.21Å; P153-L157 PolarHBondContact O-N 3.34Å
154R85.2Confident86.9Confident117 Ų11770.6 Ų70.644%0.44233%0.331SS..Hα-helixtrans-50.8-37.4-178.1-173.5176.9176.987.5-3.4113.1V152 D156 L157 I158 D194V152-R154 PolarHBondContact O-N 3.13Å; R154-D156 VanDerWaalsContact C-N 3.33Å; R154-D156 PolarHBondContact O-N 2.96Å; R154-L157 PolarHBondContact O-N 3.13Å; R154-I158 HydrophobicContact CG-CD1 4.13Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.44Å; R154-I158 PolarHBondContact O-N 3.21Å; R154-D194 IonicContact NH2-OD2 2.9Å; R154-D194 PolarHBondContact NH2-OD2 3.02Å
155K86.9Confident86.7Confident147 Ų14775.2 Ų75.264%0.63936%0.355SS*.Hα-helixtrans-58.9-41.3176.160173.9-172.6178.50112.8P153 I158 V159P153-K155 HydrophobicContact CB-CG 3.99Å; P153-K155 PolarHBondContact O-N 2.84Å; K155-I158 PolarHBondContact O-N 3.43Å; K155-V159 WeakPolarHBondContact O-CG2 3.48Å; K155-V159 PolarHBondContact O-N 2.97Å; K155-V159 VanDerWaalsContact O-N 3.13Å
156D86.2Confident86.6Confident67 Ų6772.4 Ų72.436%0.35835%0.346SS..Hα-helixtrans-75.5-37.1-176.4-58.5-27.5000109.8V152 P153 R154 I158 V159 M160V152-D156 HydrophobicContact CG1-CB 3.87Å; P153-D156 WeakPolarHBondContact CD-OD2 3.45Å; P153-D156 WeakPolarHBondContact CG-OD2 3.47Å; P153-D156 PolarHBondContact O-N 3.21Å; R154-D156 VanDerWaalsContact C-N 3.33Å; R154-D156 PolarHBondContact O-N 2.96Å; D156-I158 PolarHBondContact O-N 3.39Å; D156-V159 PolarHBondContact O-N 3.35Å; D156-M160 WeakPolarHBondContact O-CG 3.46Å; D156-M160 PolarHBondContact O-N 2.84Å
157L85.4Confident86.6Confident5 Ų574 Ų743%0.02635%0.354CS..Hα-helixtrans-59.2-44.9170-76.5164.8000111.8A146 V152 P153 R154 V159 M160 L161 V188 L191A146-L157 HydrophobicContact CB-CD2 3.64Å; V152-L157 HydrophobicContact CB-CD1 4.34Å; V152-L157 HydrophobicContact CB-CD2 4.36Å; V152-L157 HydrophobicContact CB-CG 4.03Å; V152-L157 HydrophobicContact CG1-CD2 4.35Å; V152-L157 HydrophobicContact CG1-CG 3.89Å; P153-L157 PolarHBondContact O-N 3.34Å; R154-L157 PolarHBondContact O-N 3.13Å; L157-V159 VanDerWaalsContact C-N 3.3Å; L157-V159 PolarHBondContact O-N 3.46Å; L157-M160 PolarHBondContact O-N 3.14Å; L157-L161 WeakPolarHBondContact O-CB 3.4Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 2.93Å; L157-V188 HydrophobicContact CD1-CG2 3.9Å; L157-V188 HydrophobicContact CD2-CG1 4.4Å; L157-L191 HydrophobicContact CB-CD2 3.49Å; L157-L191 VanDerWaalsContact CB-CD2 3.49Å; L157-L191 HydrophobicContact CD1-CD2 4.16Å; L157-L191 HydrophobicContact CG-CD2 4.38Å
158I85.7Confident86.6Confident45 Ų4578.4 Ų78.423%0.23137%0.373CS..Hα-helixtrans-60.3-41.6177.8-70.8164.9000111.2R154 K155 D156 L161 R162 L191R154-I158 HydrophobicContact CG-CD1 4.13Å; R154-I158 VanDerWaalsContact O-CG1 3.31Å; R154-I158 WeakPolarHBondContact O-CG1 3.44Å; R154-I158 PolarHBondContact O-N 3.21Å; K155-I158 PolarHBondContact O-N 3.43Å; D156-I158 PolarHBondContact O-N 3.39Å; I158-L161 PolarHBondContact O-N 3.01Å; I158-R162 PolarHBondContact O-N 3Å; I158-L191 HydrophobicContact CG1-CD1 4.07Å; I158-L191 HydrophobicContact CG1-CD2 4.31Å
159V86.2Confident86.6Confident82 Ų8281.7 Ų81.750%0.49739%0.386SS..Hα-helixtrans-63.3-47.3176.21740000110.5K155 D156 L157 L161 R162K155-V159 WeakPolarHBondContact O-CG2 3.48Å; K155-V159 PolarHBondContact O-N 2.97Å; K155-V159 VanDerWaalsContact O-N 3.13Å; D156-V159 PolarHBondContact O-N 3.35Å; L157-V159 VanDerWaalsContact C-N 3.3Å; L157-V159 PolarHBondContact O-N 3.46Å; V159-L161 VanDerWaalsContact C-N 3.25Å; V159-L161 PolarHBondContact O-N 3.45Å; V159-R162 WeakPolarHBondContact O-CB 3.35Å; V159-R162 PolarHBondContact O-N 3.37Å
160M85.9Confident86.8Confident52 Ų5276.6 Ų76.626%0.25637%0.367SS..Hα-helixtrans-58.1-37.6177.7-69.3-178.7-165.800112.9K142 A146 V152 D156 L157 R162 D163 T164K142-M160 HydrophobicContact CB-SD 4.45Å; A146-M160 HydrophobicContact CB-SD 4.02Å; V152-M160 HydrophobicContact CG1-CE 4.41Å; D156-M160 WeakPolarHBondContact O-CG 3.46Å; D156-M160 PolarHBondContact O-N 2.84Å; L157-M160 PolarHBondContact O-N 3.14Å; M160-R162 VanDerWaalsContact C-N 3.28Å; M160-R162 PolarHBondContact O-N 3.36Å; M160-D163 PolarHBondContact O-N 3.36Å; M160-T164 VanDerWaalsContact O-CB 3.22Å; M160-T164 WeakPolarHBondContact O-CB 3.36Å; M160-T164 PolarHBondContact O-N 2.85Å; M160-T164 VanDerWaalsContact O-N 3.16Å; M160-T164 PolarHBondContact O-OG1 3.19Å
161L85.3Confident86.9Confident19 Ų1982.6 Ų82.610%0.09939%0.389CS..Hα-helixtrans-75.2-10.6179.9-66169.6000113.7L143 L157 I158 V159 M166 L191 L192L143-L161 HydrophobicContact CD1-CD2 3.59Å; L143-L161 HydrophobicContact CD1-CG 4.21Å; L143-L161 HydrophobicContact CD2-CD2 3.72Å; L143-L161 HydrophobicContact CG-CD2 4.32Å; L157-L161 WeakPolarHBondContact O-CB 3.4Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 2.93Å; I158-L161 PolarHBondContact O-N 3.01Å; V159-L161 VanDerWaalsContact C-N 3.25Å; V159-L161 PolarHBondContact O-N 3.45Å; L161-M166 HydrophobicContact CB-SD 4.43Å; L161-M166 HydrophobicContact CD1-CE 4.2Å; L161-M166 HydrophobicContact CD2-CB 4.33Å; L161-M166 HydrophobicContact CD2-CE 3.7Å; L161-M166 HydrophobicContact CD2-CG 3.55Å; L161-M166 HydrophobicContact CD2-SD 3.86Å; L161-L191 HydrophobicContact CD1-CD2 3.65Å; L161-L191 HydrophobicContact CD1-CG 3.8Å; L161-L192 HydrophobicContact CD2-CD2 3.84Å
162R83.2Confident87.3Confident195 Ų19577.3 Ų77.374%0.73637%0.367SS*.Hα-helixtrans-75.1-40.2171.5-71.7-178.7-179.1-147.10.2111.8I158 V159 M160I158-R162 PolarHBondContact O-N 3Å; V159-R162 WeakPolarHBondContact O-CB 3.35Å; V159-R162 PolarHBondContact O-N 3.37Å; M160-R162 VanDerWaalsContact C-N 3.28Å; M160-R162 PolarHBondContact O-N 3.36Å
163D78Confident87.8Confident139 Ų13980.9 Ų80.974%0.74338%0.38SS*.Hα-helixtrans-101.8-7.4-169.9-54.7-31.7000112.9M160M160-D163 PolarHBondContact O-N 3.36Å
164T84.1Confident88.2Confident42 Ų4277.8 Ų77.826%0.25836%0.36SS..SBendtrans-121.7135.1-175.5-45.20000110.9L143 M160 M166L143-T164 HydrophobicContact CB-CG2 4.3Å; L143-T164 HydrophobicContact CD2-CG2 4.33Å; M160-T164 VanDerWaalsContact O-CB 3.22Å; M160-T164 WeakPolarHBondContact O-CB 3.36Å; M160-T164 PolarHBondContact O-N 2.85Å; M160-T164 VanDerWaalsContact O-N 3.16Å; M160-T164 PolarHBondContact O-OG1 3.19Å; T164-M166 PolarHBondContact O-N 2.84Å; T164-M166 VanDerWaalsContact O-N 3.17Å
165D88.5Confident88.7Confident99 Ų9972.3 Ų72.353%0.52934%0.339SS..  trans-60.7117.9166.6178.17.3000110.1N167 K168D165-N167 PolarHBondContact O-N 3.16Å; D165-N167 PolarHBondContact OD1-N 3.09Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.36Å; D165-K168 PolarHBondContact O-N 3.15Å
166M88.3Confident89.1Confident26 Ų2665.3 Ų65.313%0.12831%0.309CS..THydrogen-bonded Turntrans-63.2-26.1-179.2-56.4-167.747.200113.2L161 T164 K168 L192 R195 C197L161-M166 HydrophobicContact CB-SD 4.43Å; L161-M166 HydrophobicContact CD1-CE 4.2Å; L161-M166 HydrophobicContact CD2-CB 4.33Å; L161-M166 HydrophobicContact CD2-CE 3.7Å; L161-M166 HydrophobicContact CD2-CG 3.55Å; L161-M166 HydrophobicContact CD2-SD 3.86Å; T164-M166 PolarHBondContact O-N 2.84Å; T164-M166 VanDerWaalsContact O-N 3.17Å; M166-K168 VanDerWaalsContact C-N 3.35Å; M166-L192 HydrophobicContact CE-CB 4.26Å; M166-L192 HydrophobicContact CE-CD2 3.46Å; M166-L192 VanDerWaalsContact CE-CD2 3.46Å; M166-L192 HydrophobicContact CE-CG 4.44Å; M166-R195 HydrophobicContact CE-CB 3.32Å; M166-R195 HydrophobicContact CE-CG 3.95Å; M166-R195 HydrophobicContact SD-CB 3.46Å; M166-R195 WeakPolarHBondContact SD-CB 3.41Å; M166-R195 HydrophobicContact SD-CG 4Å; M166-C197 HydrophobicContact CE-CB 4.29Å
167N92.4Very high89.7Confident36 Ų3662.3 Ų62.319%0.19329%0.293CS..THydrogen-bonded Turntrans-95.67179.5-56.3-54.1000112.1D165 R169 Q198D165-N167 PolarHBondContact O-N 3.16Å; D165-N167 PolarHBondContact OD1-N 3.09Å; N167-R169 PolarHBondContact O-N 3.05Å; N167-Q198 PolarHBondContact OD1-N 3.2Å
168K92.8Very high90.3Very high93 Ų9362.1 Ų62.140%0.40429%0.292SS..  trans-54.8134.4176.5-170.5176.2-173.5-172.40110.2D141 H144 D165 M166D141-K168 VanDerWaalsContact OD2-CD 3.31Å; D141-K168 WeakPolarHBondContact OD2-CD 3.42Å; D141-K168 WeakPolarHBondContact OD2-CE 3.46Å; D141-K168 IonicContact OD2-NZ 3.75Å; D141-K168 PolarHBondContact OD2-NZ 3Å; H144-K168 PolarHBondContact CE1-O 3.09Å; H144-K168 VanDerWaalsContact CE1-O 3.28Å; H144-K168 PolarHBondContact NE2-O 3.43Å; D165-K168 HydrophobicContact CB-CB 4.3Å; D165-K168 WeakPolarHBondContact O-CB 3.36Å; D165-K168 PolarHBondContact O-N 3.15Å; M166-K168 VanDerWaalsContact C-N 3.35Å
169R93.4Very high90.8Very high117 Ų11760 Ų6044%0.44228%0.281SS..  trans-101.3137.6-178.5-62.8172.379.2-176.718109.8N167 K173 R174 T175 V201 L202N167-R169 PolarHBondContact O-N 3.05Å; R169-K173 PolarHBondContact NE-O 3.48Å; R169-K173 VanDerWaalsContact NH2-CB 3.33Å; R169-R174 WeakPolarHBondContact CA-O 3.47Å; R169-T175 HydrophobicContact CG-CG2 4.18Å; R169-V201 HydrophobicContact CG-CG1 4.45Å; R169-L202 PolarHBondContact NH2-O 3.21Å
170D91.8Very high91.3Very high16 Ų1656 Ų569%0.08626%0.257CS..  trans-77.8-176.7168.771.56.5000111.3E172 K173 R174D170-E172 PolarHBondContact O-N 2.96Å; D170-E172 VanDerWaalsContact OD1-C 3.27Å; D170-E172 WeakPolarHBondContact OD1-CA 3.36Å; D170-E172 PolarHBondContact OD1-N 2.64Å; D170-K173 WeakPolarHBondContact O-CA 3.32Å; D170-K173 PolarHBondContact O-N 2.88Å; D170-K173 PolarHBondContact OD1-N 3.3Å; D170-K173 VanDerWaalsContact OD1-N 3.16Å; D170-R174 PolarHBondContact N-O 3.39Å; D170-R174 WeakPolarHBondContact OD1-CB 3.44Å; D170-R174 PolarHBondContact OD1-N 3.22Å; D170-R174 IonicContact OD1-NE 3.61Å; D170-R174 IonicContact OD2-CZ 2.64Å; D170-R174 IonicContact OD2-NE 2.8Å; D170-R174 PolarHBondContact OD2-NE 3.27Å; D170-R174 IonicContact OD2-NH2 2.73Å; D170-R174 PolarHBondContact OD2-NH2 2.85Å
171K90.7Very high91.8Very high141 Ų14153.6 Ų53.661%0.61325%0.245SC*.THydrogen-bonded Turntrans-59.8-26.9179.1-61.6179.9-169.3161.20113.2D139 K173D139-K171 IonicContact OD1-NZ 3.24Å; D139-K171 PolarHBondContact OD1-NZ 3.13Å; K171-K173 PolarHBondContact O-N 2.91Å
172E91.2Very high92.4Very high88 Ų8852.7 Ų52.741%0.41124%0.24SC..THydrogen-bonded Turntrans-90.515.4176.7-65.7-57.6139.800112.7D170 R174 N204D170-E172 PolarHBondContact O-N 2.96Å; D170-E172 VanDerWaalsContact OD1-C 3.27Å; D170-E172 WeakPolarHBondContact OD1-CA 3.36Å; D170-E172 PolarHBondContact OD1-N 2.64Å; E172-R174 HydrophobicContact CB-CG 4.02Å; E172-R174 PolarHBondContact O-N 2.95Å; E172-R174 VanDerWaalsContact O-N 3.17Å; E172-N204 WeakPolarHBondContact CA-ND2 3.44Å; E172-N204 WeakPolarHBondContact O-CB 3.49Å; E172-N204 PolarHBondContact O-N 3.35Å; E172-N204 PolarHBondContact OE2-ND2 2.89Å
173K94.9Very high92.9Very high102 Ų10245 Ų4544%0.44321%0.213SC..SBendtrans63.512.9-179-73.8-178.3-158.6168.70114.7R169 D170 K171 N204R169-K173 PolarHBondContact NE-O 3.48Å; R169-K173 VanDerWaalsContact NH2-CB 3.33Å; D170-K173 WeakPolarHBondContact O-CA 3.32Å; D170-K173 PolarHBondContact O-N 2.88Å; D170-K173 PolarHBondContact OD1-N 3.3Å; D170-K173 VanDerWaalsContact OD1-N 3.16Å; K171-K173 PolarHBondContact O-N 2.91Å; K173-N204 WeakPolarHBondContact CB-OD1 3.37Å; K173-N204 WeakPolarHBondContact CD-OD1 3.31Å; K173-N204 VanDerWaalsContact CE-OD1 3.24Å; K173-N204 WeakPolarHBondContact CE-OD1 3.49Å; K173-N204 WeakPolarHBondContact CG-OD1 3.5Å
174R95.6Very high93.7Very high6 Ų639.4 Ų39.42%0.02319%0.189CC..  trans-84.2140.5-177-53.8173.2-61.1-151.2-1.6110.8Y133 H134 H144 R169 D170 E172 H178 L179 D203Y133-R174 HydrophobicContact CE1-CG 4.04Å; H134-R174 PolarHBondContact O-NH1 3.49Å; H144-R174 PolarHBondContact NE2-O 3.3Å; R169-R174 WeakPolarHBondContact CA-O 3.47Å; D170-R174 PolarHBondContact N-O 3.39Å; D170-R174 WeakPolarHBondContact OD1-CB 3.44Å; D170-R174 PolarHBondContact OD1-N 3.22Å; D170-R174 IonicContact OD1-NE 3.61Å; D170-R174 IonicContact OD2-CZ 2.64Å; D170-R174 IonicContact OD2-NE 2.8Å; D170-R174 PolarHBondContact OD2-NE 3.27Å; D170-R174 IonicContact OD2-NH2 2.73Å; D170-R174 PolarHBondContact OD2-NH2 2.85Å; E172-R174 HydrophobicContact CB-CG 4.02Å; E172-R174 PolarHBondContact O-N 2.95Å; E172-R174 VanDerWaalsContact O-N 3.17Å; R174-H178 HydrophobicContact CB-CB 4.14Å; R174-L179 HydrophobicContact CB-CD2 4.49Å; R174-D203 HydrophobicContact CG-CB 4Å
175T96.5Very high94.3Very high2 Ų238.9 Ų38.91%0.01218%0.184CC..  trans-91.1168.4169.465.50000110.9R169 L177 H178 L179 V201R169-T175 HydrophobicContact CG-CG2 4.18Å; T175-L177 PolarHBondContact O-N 3.35Å; T175-L177 PolarHBondContact OG1-N 3.2Å; T175-H178 PolarHBondContact N-ND1 3.23Å; T175-H178 WeakPolarHBondContact O-CB 3.37Å; T175-H178 PolarHBondContact O-N 2.98Å; T175-H178 VanDerWaalsContact O-N 3.11Å; T175-H178 PolarHBondContact OG1-N 2.91Å; T175-H178 PolarHBondContact OG1-ND1 3.37Å; T175-L179 PolarHBondContact O-N 3.5Å; T175-V201 HydrophobicContact CG2-CB 3.91Å; T175-V201 HydrophobicContact CG2-CG1 3.62Å; T175-V201 HydrophobicContact CG2-CG2 4.19Å
176A95.8Very high94.7Very high0 Ų035.2 Ų35.20%017%0.167CC..Hα-helixtrans-54.5-36.6170.400000112L143 A147 H178 L179 A180 L192L143-A176 HydrophobicContact CD1-CB 4.47Å; L143-A176 HydrophobicContact CD2-CB 3.92Å; L143-A176 HydrophobicContact CG-CB 3.76Å; A147-A176 HydrophobicContact CB-CB 3.88Å; A147-A176 VanDerWaalsContact CB-O 3.28Å; A147-A176 WeakPolarHBondContact CB-O 3.35Å; A176-H178 VanDerWaalsContact C-N 3.35Å; A176-H178 PolarHBondContact O-N 3.22Å; A176-L179 PolarHBondContact O-N 3.43Å; A176-A180 PolarHBondContact O-N 3.2Å; A176-L192 HydrophobicContact CB-CD1 4.04Å; A176-L192 HydrophobicContact CB-CD2 4.42Å
177L97.8Very high95Very high3 Ų340.5 Ų40.52%0.01619%0.191CC..Hα-helixtrans-61-41.4177.4-171.567.8000112.1T175 L179 S181 V189 L192 L199 A209 L225T175-L177 PolarHBondContact O-N 3.35Å; T175-L177 PolarHBondContact OG1-N 3.2Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.19Å; L177-S181 WeakPolarHBondContact O-CB 3.28Å; L177-S181 PolarHBondContact O-N 3.05Å; L177-S181 PolarHBondContact O-OG 3.34Å; L177-V189 HydrophobicContact CD1-CG1 4.11Å; L177-V189 HydrophobicContact CD1-CG2 4.5Å; L177-L192 HydrophobicContact CB-CD1 4.1Å; L177-L192 HydrophobicContact CD1-CB 4.19Å; L177-L192 HydrophobicContact CD1-CD1 4.07Å; L177-L199 HydrophobicContact CD2-CD2 4.03Å; L177-A209 HydrophobicContact CB-CB 4.38Å; L177-A209 HydrophobicContact CD2-CB 3.83Å; L177-A209 HydrophobicContact CG-CB 3.71Å; L177-L225 HydrophobicContact CD1-CD2 4.15Å; L177-L225 HydrophobicContact CD2-CD2 3.94Å; L177-L225 HydrophobicContact CG-CD2 4.28Å
178H97.8Very high95.1Very high1 Ų138.9 Ų38.91%0.00518%0.182CC..Hα-helixtrans-59.9-45.4176.7-72.986.1000111.9Y133 R174 T175 A176 A182 V201 R207 A209Y133-H178 HydrophobicContact CE2-CB 4.1Å; Y133-H178 PolarHBondContact OH-CD2 2.92Å; R174-H178 HydrophobicContact CB-CB 4.14Å; T175-H178 PolarHBondContact N-ND1 3.23Å; T175-H178 WeakPolarHBondContact O-CB 3.37Å; T175-H178 PolarHBondContact O-N 2.98Å; T175-H178 VanDerWaalsContact O-N 3.11Å; T175-H178 PolarHBondContact OG1-N 2.91Å; T175-H178 PolarHBondContact OG1-ND1 3.37Å; A176-H178 VanDerWaalsContact C-N 3.35Å; A176-H178 PolarHBondContact O-N 3.22Å; H178-A182 VanDerWaalsContact O-CB 3.25Å; H178-A182 WeakPolarHBondContact O-CB 3.39Å; H178-A182 PolarHBondContact O-N 3.02Å; H178-V201 PolarHBondContact CE1-O 3.14Å; H178-V201 PolarHBondContact NE2-O 2.97Å; H178-V201 VanDerWaalsContact NE2-O 3.09Å; H178-R207 PolarHBondContact NE2-O 3.05Å; H178-R207 VanDerWaalsContact NE2-O 3.11Å; H178-A209 PolarHBondContact CD2-N 2.82Å; H178-A209 PolarHBondContact NE2-N 3.28Å
179L96.1Very high95.3Very high0 Ų034.4 Ų34.40%016%0.163CC..Hα-helixtrans-69.6-43.9-176.8-61.3-179.2000111.8Y133 I135 L140 H144 A147 W148 R174 T175 A176 L177 N183Y133-L179 HydrophobicContact CD2-CD2 3.78Å; Y133-L179 HydrophobicContact CE2-CD2 4.14Å; Y133-L179 HydrophobicContact CG-CD2 4.43Å; I135-L179 HydrophobicContact CD1-CD2 3.55Å; L140-L179 HydrophobicContact CD1-CD1 4.18Å; L140-L179 HydrophobicContact CD2-CD1 3.89Å; H144-L179 HydrophobicContact CB-CD1 3.54Å; H144-L179 WeakPolarHBondContact O-CD1 3.47Å; A147-L179 HydrophobicContact CB-CB 4.29Å; W148-L179 HydrophobicContact CB-CB 4.44Å; W148-L179 HydrophobicContact CE3-CB 4.22Å; W148-L179 HydrophobicContact CE3-CD2 3.91Å; W148-L179 HydrophobicContact CZ3-CD2 4.28Å; R174-L179 HydrophobicContact CB-CD2 4.49Å; T175-L179 PolarHBondContact O-N 3.5Å; A176-L179 PolarHBondContact O-N 3.43Å; L177-L179 VanDerWaalsContact C-N 3.34Å; L177-L179 PolarHBondContact O-N 3.19Å; L179-N183 WeakPolarHBondContact O-CB 3.49Å; L179-N183 PolarHBondContact O-N 3.46Å
180A96.9Very high95.4Very high0 Ų031.7 Ų31.70%016%0.155CC..Hα-helixtrans-63.4-45.1176.400000111.6A147 A176 N183 G184 N185 V188 V189A147-A180 HydrophobicContact CB-CB 4.07Å; A147-A180 VanDerWaalsContact O-CA 3.24Å; A147-A180 WeakPolarHBondContact O-CA 3.32Å; A147-A180 PolarHBondContact O-N 3.09Å; A176-A180 PolarHBondContact O-N 3.2Å; A180-N183 PolarHBondContact O-N 3.13Å; A180-G184 PolarHBondContact O-N 2.98Å; A180-G184 VanDerWaalsContact O-N 3.13Å; A180-N185 HydrophobicContact CB-CB 4.22Å; A180-N185 PolarHBondContact O-N 3.43Å; A180-V188 HydrophobicContact CB-CB 4.02Å; A180-V188 HydrophobicContact CB-CG1 4.03Å; A180-V189 HydrophobicContact CB-CG2 3.67Å
181S97.7Very high95.6Very high0 Ų031.1 Ų31.10%015%0.152CC..Hα-helixtrans-66.7-38.2-179-55.60000112.4L177 N183L177-S181 WeakPolarHBondContact O-CB 3.28Å; L177-S181 PolarHBondContact O-N 3.05Å; L177-S181 PolarHBondContact O-OG 3.34Å; S181-N183 VanDerWaalsContact C-N 3.25Å; S181-N183 PolarHBondContact O-N 3.09Å
182A96.3Very high95.8Very high0 Ų024.5 Ų24.50%012%0.124CC..Hα-helixtrans-71.4-18.4177.200000113.7R132 Y133 H178 K212 C216R132-A182 PolarHBondContact NH1-O 2.97Å; Y133-A182 HydrophobicContact CD2-CB 3.78Å; Y133-A182 HydrophobicContact CE2-CB 3.77Å; H178-A182 VanDerWaalsContact O-CB 3.25Å; H178-A182 WeakPolarHBondContact O-CB 3.39Å; H178-A182 PolarHBondContact O-N 3.02Å; A182-K212 HydrophobicContact CB-CB 4.3Å; A182-C216 WeakPolarHBondContact O-CB 3.42Å; A182-C216 PolarHBondContact O-SG 3.21Å
183N94.8Very high96Very high33 Ų3320.6 Ų20.618%0.17611%0.106CC..THydrogen-bonded Turntrans-109.75.3-178.2-7716.5000113.6W148 L179 A180 S181 N185W148-N183 WeakPolarHBondContact CZ3-ND2 3.35Å; W148-N183 VanDerWaalsContact CZ3-OD1 3.24Å; W148-N183 WeakPolarHBondContact CZ3-OD1 3.37Å; W148-N183 PolarHBondContact O-ND2 3.37Å; L179-N183 WeakPolarHBondContact O-CB 3.49Å; L179-N183 PolarHBondContact O-N 3.46Å; A180-N183 PolarHBondContact O-N 3.13Å; S181-N183 VanDerWaalsContact C-N 3.25Å; S181-N183 PolarHBondContact O-N 3.09Å; N183-N185 PolarHBondContact O-N 3.17Å
184G95.4Very high95.9Very high22 Ų2219.6 Ų19.623%0.22711%0.105CC..THydrogen-bonded Turntrans68.821.5179.200000113.8A180 S186 E218A180-G184 PolarHBondContact O-N 2.98Å; A180-G184 VanDerWaalsContact O-N 3.13Å; G184-S186 PolarHBondContact O-N 3.21Å; G184-E218 WeakPolarHBondContact CA-OE2 3.4Å
185N96.4Very high95.8Very high31 Ų3125.9 Ų25.917%0.16613%0.129CC..  trans-80.769.6-178.5-66.2-36.8000110.3A147 W148 G150 A180 N183 E187 V188 V189A147-N185 PolarHBondContact O-ND2 3.39Å; W148-N185 PolarHBondContact O-ND2 3.18Å; G150-N185 VanDerWaalsContact CA-CG 3.42Å; G150-N185 WeakPolarHBondContact CA-OD1 3.47Å; G150-N185 PolarHBondContact N-ND2 2.91Å; A180-N185 HydrophobicContact CB-CB 4.22Å; A180-N185 PolarHBondContact O-N 3.43Å; N183-N185 PolarHBondContact O-N 3.17Å; N185-E187 VanDerWaalsContact C-N 3.32Å; N185-E187 PolarHBondContact O-N 3.18Å; N185-V188 HydrophobicContact CB-CB 4.33Å; N185-V188 HydrophobicContact CB-CG2 4.17Å; N185-V188 PolarHBondContact O-N 3.18Å; N185-V189 PolarHBondContact O-N 2.81Å
186S95.9Very high95.6Very high22 Ų2236.7 Ų36.715%0.15417%0.169CC..Hα-helixtrans-59.6-37.2-169.852.50000113.7G184 V188 V189 Q190 E220 M224G184-S186 PolarHBondContact O-N 3.21Å; S186-V188 VanDerWaalsContact C-N 3.3Å; S186-V188 PolarHBondContact O-N 3.03Å; S186-V189 PolarHBondContact O-N 3.05Å; S186-Q190 WeakPolarHBondContact O-CB 3.34Å; S186-Q190 PolarHBondContact O-N 2.98Å; S186-E220 VanDerWaalsContact CB-CD 3.45Å; S186-E220 WeakPolarHBondContact CB-OE2 3.37Å; S186-E220 PolarHBondContact OG-OE2 3.19Å; S186-M224 VanDerWaalsContact CB-CE 3.47Å
187E94.4Very high95.5Very high137 Ų13737.2 Ų37.264%0.6417%0.173SC*.Hα-helixtrans-60.7-38.2175.1-64.1-173.3174.300113N185 L191N185-E187 VanDerWaalsContact C-N 3.32Å; N185-E187 PolarHBondContact O-N 3.18Å; E187-L191 PolarHBondContact O-N 3.11Å; E187-L191 VanDerWaalsContact O-N 3.13Å
188V95.6Very high95.5Very high2 Ų242.8 Ų42.81%0.01220%0.199CC..Hα-helixtrans-72.7-43.2176.8-174.10000109.8A147 L157 A180 N185 S186 Q190 L191 L192A147-V188 HydrophobicContact CB-CG1 4.13Å; L157-V188 HydrophobicContact CD1-CG2 3.9Å; L157-V188 HydrophobicContact CD2-CG1 4.4Å; A180-V188 HydrophobicContact CB-CB 4.02Å; A180-V188 HydrophobicContact CB-CG1 4.03Å; N185-V188 HydrophobicContact CB-CB 4.33Å; N185-V188 HydrophobicContact CB-CG2 4.17Å; N185-V188 PolarHBondContact O-N 3.18Å; S186-V188 VanDerWaalsContact C-N 3.3Å; S186-V188 PolarHBondContact O-N 3.03Å; V188-Q190 PolarHBondContact O-N 2.94Å; V188-L191 PolarHBondContact O-N 3.47Å; V188-L192 HydrophobicContact CG1-CD1 4.1Å; V188-L192 HydrophobicContact CG1-CG 4.28Å; V188-L192 VanDerWaalsContact O-CG 3.26Å; V188-L192 WeakPolarHBondContact O-CG 3.38Å; V188-L192 PolarHBondContact O-N 2.93Å
189V97.1Very high95.5Very high0 Ų044 Ų440%021%0.205CC..Hα-helixtrans-56-52174.7173.50000110.1L177 A180 N185 S186 L191 L192 L193 C221 M224L177-V189 HydrophobicContact CD1-CG1 4.11Å; L177-V189 HydrophobicContact CD1-CG2 4.5Å; A180-V189 HydrophobicContact CB-CG2 3.67Å; N185-V189 PolarHBondContact O-N 2.81Å; S186-V189 PolarHBondContact O-N 3.05Å; V189-L191 VanDerWaalsContact C-N 3.32Å; V189-L191 PolarHBondContact O-N 3.45Å; V189-L192 PolarHBondContact O-N 3.3Å; V189-L192 VanDerWaalsContact O-N 3.09Å; V189-L193 HydrophobicContact CG1-CD1 3.67Å; V189-L193 HydrophobicContact CG1-CG 4.14Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.43Å; V189-L193 PolarHBondContact O-N 3Å; V189-C221 HydrophobicContact CG2-CB 4.49Å; V189-M224 HydrophobicContact CB-CE 3.84Å; V189-M224 HydrophobicContact CG1-CB 4.48Å; V189-M224 HydrophobicContact CG1-CE 3.73Å
190Q95.6Very high95.6Very high60 Ų6047.3 Ų47.328%0.2822%0.223SC..Hα-helixtrans-54.8-46.8178.3-174.662.95600111.8S186 V188 L192 L193 D194 M224S186-Q190 WeakPolarHBondContact O-CB 3.34Å; S186-Q190 PolarHBondContact O-N 2.98Å; V188-Q190 PolarHBondContact O-N 2.94Å; Q190-L192 PolarHBondContact O-N 3.22Å; Q190-L193 PolarHBondContact O-N 3.01Å; Q190-D194 PolarHBondContact NE2-OD1 2.96Å; Q190-D194 WeakPolarHBondContact O-CB 3.21Å; Q190-D194 PolarHBondContact O-N 3.42Å; Q190-M224 HydrophobicContact CB-SD 4.05Å; Q190-M224 PolarHBondContact OE1-SD 2.88Å; Q190-M224 VanDerWaalsContact OE1-SD 3.35Å
191L94.3Very high95.6Very high4 Ų448 Ų482%0.02123%0.227CC..Hα-helixtrans-63.2-39.9178.4-179.664.7000112.8L157 I158 L161 E187 V188 V189 L193 R195L157-L191 HydrophobicContact CB-CD2 3.49Å; L157-L191 VanDerWaalsContact CB-CD2 3.49Å; L157-L191 HydrophobicContact CD1-CD2 4.16Å; L157-L191 HydrophobicContact CG-CD2 4.38Å; I158-L191 HydrophobicContact CG1-CD1 4.07Å; I158-L191 HydrophobicContact CG1-CD2 4.31Å; L161-L191 HydrophobicContact CD1-CD2 3.65Å; L161-L191 HydrophobicContact CD1-CG 3.8Å; E187-L191 PolarHBondContact O-N 3.11Å; E187-L191 VanDerWaalsContact O-N 3.13Å; V188-L191 PolarHBondContact O-N 3.47Å; V189-L191 VanDerWaalsContact C-N 3.32Å; V189-L191 PolarHBondContact O-N 3.45Å; L191-L193 VanDerWaalsContact C-N 3.33Å; L191-R195 WeakPolarHBondContact O-CG 3.33Å; L191-R195 PolarHBondContact O-N 3.21Å
192L95.3Very high95.6Very high2 Ų250.7 Ų50.71%0.0124%0.241CC..Hα-helixtrans-65.5-39177.1-67173.7000111.1L161 M166 A176 L177 V188 V189 Q190 R195 R196 C197L161-L192 HydrophobicContact CD2-CD2 3.84Å; M166-L192 HydrophobicContact CE-CB 4.26Å; M166-L192 HydrophobicContact CE-CD2 3.46Å; M166-L192 VanDerWaalsContact CE-CD2 3.46Å; M166-L192 HydrophobicContact CE-CG 4.44Å; A176-L192 HydrophobicContact CB-CD1 4.04Å; A176-L192 HydrophobicContact CB-CD2 4.42Å; L177-L192 HydrophobicContact CB-CD1 4.1Å; L177-L192 HydrophobicContact CD1-CB 4.19Å; L177-L192 HydrophobicContact CD1-CD1 4.07Å; V188-L192 HydrophobicContact CG1-CD1 4.1Å; V188-L192 HydrophobicContact CG1-CG 4.28Å; V188-L192 VanDerWaalsContact O-CG 3.26Å; V188-L192 WeakPolarHBondContact O-CG 3.38Å; V188-L192 PolarHBondContact O-N 2.93Å; V189-L192 PolarHBondContact O-N 3.3Å; V189-L192 VanDerWaalsContact O-N 3.09Å; Q190-L192 PolarHBondContact O-N 3.22Å; L192-R195 PolarHBondContact O-N 2.9Å; L192-R196 PolarHBondContact O-N 3.25Å; L192-C197 HydrophobicContact CB-CB 4.47Å; L192-C197 WeakPolarHBondContact O-CB 3.37Å; L192-C197 PolarHBondContact O-N 2.96Å; L192-C197 PolarHBondContact O-SG 3.11Å; L192-C197 VanDerWaalsContact O-SG 3.35Å
193L96Very high95.6Very high6 Ų651 Ų513%0.03124%0.243CC..Hα-helixtrans-68.2-44176.9-66.1176.7000112.4V189 Q190 L191 R195 R196 L199 M224 L225 H228V189-L193 HydrophobicContact CG1-CD1 3.67Å; V189-L193 HydrophobicContact CG1-CG 4.14Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.43Å; V189-L193 PolarHBondContact O-N 3Å; Q190-L193 PolarHBondContact O-N 3.01Å; L191-L193 VanDerWaalsContact C-N 3.33Å; L193-R195 PolarHBondContact O-N 3.49Å; L193-R195 VanDerWaalsContact O-N 3.08Å; L193-R196 WeakPolarHBondContact O-CA 3.27Å; L193-R196 PolarHBondContact O-N 3.15Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; L193-M224 HydrophobicContact CD1-CB 3.83Å; L193-L225 HydrophobicContact CD2-CD2 4.17Å; L193-H228 HydrophobicContact CD1-CB 4.46Å; L193-H228 HydrophobicContact CD2-CB 4.07Å
194D93.8Very high95.6Very high81 Ų8152.3 Ų52.343%0.43325%0.25SC..Hα-helixtrans-54.5-31.5175.3-68.5-18.2000111.6R154 Q190R154-D194 IonicContact NH2-OD2 2.9Å; R154-D194 PolarHBondContact NH2-OD2 3.02Å; Q190-D194 PolarHBondContact NE2-OD1 2.96Å; Q190-D194 WeakPolarHBondContact O-CB 3.21Å; Q190-D194 PolarHBondContact O-N 3.42Å
195R92.1Very high95.5Very high137 Ų13754 Ų5452%0.51725%0.251SS..THydrogen-bonded Turntrans-91.37.1179.4-67-73.3-174.6-173.9-1.5113.9M166 L191 L192 L193M166-R195 HydrophobicContact CE-CB 3.32Å; M166-R195 HydrophobicContact CE-CG 3.95Å; M166-R195 HydrophobicContact SD-CB 3.46Å; M166-R195 WeakPolarHBondContact SD-CB 3.41Å; M166-R195 HydrophobicContact SD-CG 4Å; L191-R195 WeakPolarHBondContact O-CG 3.33Å; L191-R195 PolarHBondContact O-N 3.21Å; L192-R195 PolarHBondContact O-N 2.9Å; L193-R195 PolarHBondContact O-N 3.49Å; L193-R195 VanDerWaalsContact O-N 3.08Å
196R92.7Very high95.5Very high230 Ų23058.1 Ų58.187%0.86827%0.267SS*.THydrogen-bonded Turntrans58.145.9177.7-53.8-176.2177.7-167.8-1113.5L192 L193L192-R196 PolarHBondContact O-N 3.25Å; L193-R196 WeakPolarHBondContact O-CA 3.27Å; L193-R196 PolarHBondContact O-N 3.15Å
197C94.4Very high95.6Very high11 Ų1157.8 Ų57.87%0.07426%0.263CS..  trans-60.7159.8170.570.40000111.9M166 L192 L199M166-C197 HydrophobicContact CE-CB 4.29Å; L192-C197 HydrophobicContact CB-CB 4.47Å; L192-C197 WeakPolarHBondContact O-CB 3.37Å; L192-C197 PolarHBondContact O-N 2.96Å; L192-C197 PolarHBondContact O-SG 3.11Å; L192-C197 VanDerWaalsContact O-SG 3.35Å; C197-L199 PolarHBondContact O-N 3.3Å
198Q97.2Very high95.8Very high120 Ų12051.3 Ų51.356%0.56123%0.232SC*.  trans-73.7120.1176.5-66.7179.212.400110.2N167 V201N167-Q198 PolarHBondContact OD1-N 3.2Å; Q198-V201 HydrophobicContact CB-CG2 3.49Å; Q198-V201 VanDerWaalsContact CB-CG2 3.49Å
199L97.3Very high95.9Very high26 Ų2651.2 Ų51.214%0.13623%0.232CC..THydrogen-bonded Turntrans-80.7-31.4-175.1-52.2-175.7000113.4L177 L193 C197 L225 H228 A230L177-L199 HydrophobicContact CD2-CD2 4.03Å; L193-L199 HydrophobicContact CD2-CD2 3.22Å; C197-L199 PolarHBondContact O-N 3.3Å; L199-L225 HydrophobicContact CD2-CD2 4.46Å; L199-H228 HydrophobicContact CD1-CB 4.06Å; L199-H228 WeakPolarHBondContact CD1-O 3.41Å; L199-A230 HydrophobicContact CB-CB 4.13Å; L199-A230 HydrophobicContact CD1-CB 4.15Å
200N97.6Very high96Very high69 Ų6951.2 Ų51.237%0.36923%0.232SC..THydrogen-bonded Turntrans-101.822.2-168.7-62.4-21.9000112.8D231 I234N200-D231 WeakPolarHBondContact OD1-CB 3.42Å; N200-D231 PolarHBondContact OD1-N 3Å; N200-I234 HydrophobicContact CB-CD1 3.6Å
201V97.9Very high96.1Very high16 Ų1648.4 Ų48.410%0.09722%0.219CC..  trans-68.7144.7172.6-175.80000108.7R169 T175 H178 Q198R169-V201 HydrophobicContact CG-CG1 4.45Å; T175-V201 HydrophobicContact CG2-CB 3.91Å; T175-V201 HydrophobicContact CG2-CG1 3.62Å; T175-V201 HydrophobicContact CG2-CG2 4.19Å; H178-V201 PolarHBondContact CE1-O 3.14Å; H178-V201 PolarHBondContact NE2-O 2.97Å; H178-V201 VanDerWaalsContact NE2-O 3.09Å; Q198-V201 HydrophobicContact CB-CG2 3.49Å; Q198-V201 VanDerWaalsContact CB-CG2 3.49Å
202L97.8Very high96.2Very high56 Ų5648.2 Ų48.229%0.29322%0.218SC..  trans-107134.7-176-50.8-177.4000111.6R169 K206 R207 T208 I234R169-L202 PolarHBondContact NH2-O 3.21Å; L202-K206 HydrophobicContact CD1-CB 4.37Å; L202-R207 WeakPolarHBondContact CA-O 3.19Å; L202-T208 HydrophobicContact CD2-CG2 3.75Å; L202-I234 HydrophobicContact CD2-CG2 3.8Å
203D95.8Very high96.3Very high6 Ų648.1 Ų48.13%0.03222%0.218CC..  trans-71.9-178.1167.482.8-7.1000112.1Y133 R174 K205 K206 R207Y133-D203 WeakPolarHBondContact CE1-OD2 3.37Å; Y133-D203 PolarHBondContact OH-OD2 3.32Å; R174-D203 HydrophobicContact CG-CB 4Å; D203-K205 PolarHBondContact O-N 3.25Å; D203-K205 VanDerWaalsContact OD1-C 3.27Å; D203-K205 WeakPolarHBondContact OD1-CA 3.35Å; D203-K205 PolarHBondContact OD1-N 3.06Å; D203-K206 PolarHBondContact O-N 3.45Å; D203-K206 PolarHBondContact OD1-N 2.98Å; D203-K206 VanDerWaalsContact OD1-N 3.12Å; D203-R207 PolarHBondContact N-O 3.32Å; D203-R207 WeakPolarHBondContact OD1-CB 3.49Å; D203-R207 PolarHBondContact OD1-N 3.03Å; D203-R207 IonicContact OD1-NE 3.54Å; D203-R207 IonicContact OD2-CZ 2.7Å; D203-R207 VanDerWaalsContact OD2-CZ 3.29Å; D203-R207 IonicContact OD2-NE 2.73Å; D203-R207 PolarHBondContact OD2-NE 2.9Å; D203-R207 IonicContact OD2-NH2 3.13Å; D203-R207 PolarHBondContact OD2-NH2 2.95Å
204N94.4Very high96.4Very high61 Ų6148 Ų4833%0.32622%0.217SC..THydrogen-bonded Turntrans-60.2-26.4178.3-96.1-4.3000114.6E172 K173 K206E172-N204 WeakPolarHBondContact CA-ND2 3.44Å; E172-N204 WeakPolarHBondContact O-CB 3.49Å; E172-N204 PolarHBondContact O-N 3.35Å; E172-N204 PolarHBondContact OE2-ND2 2.89Å; K173-N204 WeakPolarHBondContact CB-OD1 3.37Å; K173-N204 WeakPolarHBondContact CD-OD1 3.31Å; K173-N204 VanDerWaalsContact CE-OD1 3.24Å; K173-N204 WeakPolarHBondContact CE-OD1 3.49Å; K173-N204 WeakPolarHBondContact CG-OD1 3.5Å; N204-K206 VanDerWaalsContact C-N 3.29Å
205K94.3Very high96.6Very high56 Ų5644.4 Ų44.424%0.24320%0.197CC..THydrogen-bonded Turntrans-94.718.4175.2-60.5-162.3177.4-173.60112.3D203 R207 E237D203-K205 PolarHBondContact O-N 3.25Å; D203-K205 VanDerWaalsContact OD1-C 3.27Å; D203-K205 WeakPolarHBondContact OD1-CA 3.35Å; D203-K205 PolarHBondContact OD1-N 3.06Å; K205-R207 HydrophobicContact CB-CG 4.28Å; K205-R207 PolarHBondContact O-N 3.12Å; K205-E237 HydrophobicContact CB-CG 4.21Å; K205-E237 VanDerWaalsContact CB-OE1 3.3Å; K205-E237 WeakPolarHBondContact CB-OE1 3.4Å; K205-E237 VanDerWaalsContact CD-OE1 3.27Å; K205-E237 WeakPolarHBondContact CD-OE1 3.42Å; K205-E237 WeakPolarHBondContact CG-OE1 3.21Å; K205-E237 WeakPolarHBondContact O-CB 3.37Å; K205-E237 WeakPolarHBondContact O-CG 3.33Å; K205-E237 PolarHBondContact O-N 3.34Å
206K96.8Very high96.7Very high118 Ų11838.5 Ų38.551%0.51318%0.177SC..SBendtrans58.622.8-176-55.2-174.6179-176.80115L202 D203 N204 E237L202-K206 HydrophobicContact CD1-CB 4.37Å; D203-K206 PolarHBondContact O-N 3.45Å; D203-K206 PolarHBondContact OD1-N 2.98Å; D203-K206 VanDerWaalsContact OD1-N 3.12Å; N204-K206 VanDerWaalsContact C-N 3.29Å; K206-E237 HydrophobicContact CB-CB 4.41Å; K206-E237 HydrophobicContact CD-CB 4.4Å; K206-E237 HydrophobicContact CG-CB 4.31Å
207R97.3Very high96.9Very high15 Ų1533 Ų336%0.05716%0.161CC..  trans-87.3143.1178.9-61.6172.9-64.5-169.3-7.6110.3H178 L202 D203 K205 I211 K212 Q215 D236H178-R207 PolarHBondContact NE2-O 3.05Å; H178-R207 VanDerWaalsContact NE2-O 3.11Å; L202-R207 WeakPolarHBondContact CA-O 3.19Å; D203-R207 PolarHBondContact N-O 3.32Å; D203-R207 WeakPolarHBondContact OD1-CB 3.49Å; D203-R207 PolarHBondContact OD1-N 3.03Å; D203-R207 IonicContact OD1-NE 3.54Å; D203-R207 IonicContact OD2-CZ 2.7Å; D203-R207 VanDerWaalsContact OD2-CZ 3.29Å; D203-R207 IonicContact OD2-NE 2.73Å; D203-R207 PolarHBondContact OD2-NE 2.9Å; D203-R207 IonicContact OD2-NH2 3.13Å; D203-R207 PolarHBondContact OD2-NH2 2.95Å; K205-R207 HydrophobicContact CB-CG 4.28Å; K205-R207 PolarHBondContact O-N 3.12Å; R207-I211 HydrophobicContact CB-CB 4.27Å; R207-I211 HydrophobicContact CB-CG2 3.96Å; R207-I211 HydrophobicContact CG-CG2 3.91Å; R207-K212 HydrophobicContact CB-CD 4.24Å; R207-K212 HydrophobicContact CB-CG 4.3Å; R207-K212 VanDerWaalsContact NH1-NZ 3.1Å; R207-Q215 VanDerWaalsContact NH1-OE1 3.13Å; R207-D236 HydrophobicContact CG-CB 3.66Å
208T98.2Very high97Very high1 Ų134.5 Ų34.51%0.00617%0.167CC..  trans-83166.1169.461.10000111.1L202 L210 I211 K212 I234L202-T208 HydrophobicContact CD2-CG2 3.75Å; T208-L210 PolarHBondContact O-N 2.94Å; T208-I211 PolarHBondContact O-N 3.47Å; T208-I211 PolarHBondContact OG1-N 3.29Å; T208-K212 WeakPolarHBondContact O-CG 3.32Å; T208-K212 PolarHBondContact O-N 2.99Å; T208-K212 VanDerWaalsContact O-N 3.13Å; T208-I234 HydrophobicContact CG2-CB 4.02Å; T208-I234 HydrophobicContact CG2-CD1 4Å; T208-I234 HydrophobicContact CG2-CG2 3.85Å
209A98.1Very high97Very high0 Ų032.5 Ų32.50%016%0.16CC..Hα-helixtrans-58.3-33.3171.300000112.5L177 H178 K212 A213 L225L177-A209 HydrophobicContact CB-CB 4.38Å; L177-A209 HydrophobicContact CD2-CB 3.83Å; L177-A209 HydrophobicContact CG-CB 3.71Å; H178-A209 PolarHBondContact CD2-N 2.82Å; H178-A209 PolarHBondContact NE2-N 3.28Å; A209-K212 PolarHBondContact O-N 2.87Å; A209-A213 PolarHBondContact O-N 3.17Å; A209-L225 HydrophobicContact CB-CD1 4.41Å
210L98.6Very high97Very high1 Ų137.1 Ų37.11%0.00518%0.181CC..Hα-helixtrans-63-50.8175.2175.663.9000112T208 K212 A213 I214 V222 L225 L226 A230 R232 A242T208-L210 PolarHBondContact O-N 2.94Å; L210-K212 PolarHBondContact O-N 3.21Å; L210-A213 PolarHBondContact O-N 2.83Å; L210-I214 HydrophobicContact CD1-CD1 4Å; L210-I214 HydrophobicContact CD1-CG1 4.47Å; L210-I214 HydrophobicContact CG-CD1 4.04Å; L210-I214 WeakPolarHBondContact O-CG1 3.37Å; L210-I214 PolarHBondContact O-N 3.06Å; L210-I214 VanDerWaalsContact O-N 3.08Å; L210-V222 HydrophobicContact CD1-CB 4.47Å; L210-V222 HydrophobicContact CD1-CG1 3.69Å; L210-L225 HydrophobicContact CB-CD1 4.32Å; L210-L225 HydrophobicContact CD1-CB 4.2Å; L210-L226 HydrophobicContact CD1-CD2 4.06Å; L210-L226 HydrophobicContact CD1-CG 4.06Å; L210-L226 HydrophobicContact CD2-CD2 3.85Å; L210-A230 HydrophobicContact CB-CB 4.35Å; L210-A230 HydrophobicContact CD2-CB 4.22Å; L210-R232 HydrophobicContact CD2-CB 3.92Å; L210-A242 HydrophobicContact CD2-CB 4.35Å
211I98.1Very high97Very high1 Ų133.9 Ų33.91%0.00516%0.164CC..Hα-helixtrans-56.5-41.9176.5-74.7174000110.4R207 T208 I214 Q215 I234 D236 A242 Y245R207-I211 HydrophobicContact CB-CB 4.27Å; R207-I211 HydrophobicContact CB-CG2 3.96Å; R207-I211 HydrophobicContact CG-CG2 3.91Å; T208-I211 PolarHBondContact O-N 3.47Å; T208-I211 PolarHBondContact OG1-N 3.29Å; I211-I214 PolarHBondContact O-N 3.31Å; I211-Q215 VanDerWaalsContact O-CB 3.32Å; I211-Q215 WeakPolarHBondContact O-CB 3.46Å; I211-Q215 PolarHBondContact O-N 3.35Å; I211-I234 WeakPolarHBondContact CD1-O 3.47Å; I211-D236 HydrophobicContact CD1-CB 4.44Å; I211-A242 HydrophobicContact CG1-CB 4.45Å; I211-Y245 HydrophobicContact CG2-CD2 3.61Å; I211-Y245 HydrophobicContact CG2-CE2 3.38Å; I211-Y245 HydrophobicContact CG2-CG 4.3Å
212K97.3Very high97.1Very high0 Ų033.1 Ų33.10%016%0.159CC..Hα-helixtrans-67-41179.6-69.9-59.3-46172.80113.8P131 Y133 A182 R207 T208 A209 L210 I214 Q215 C216P131-K212 WeakPolarHBondContact O-CE 3.4Å; P131-K212 PolarHBondContact O-NZ 2.84Å; Y133-K212 HydrophobicContact CE1-CD 4.17Å; Y133-K212 HydrophobicContact CE2-CD 4.37Å; Y133-K212 HydrophobicContact CE2-CG 4.23Å; Y133-K212 VanDerWaalsContact OH-CG 3.29Å; Y133-K212 WeakPolarHBondContact OH-CG 3.46Å; A182-K212 HydrophobicContact CB-CB 4.3Å; R207-K212 HydrophobicContact CB-CD 4.24Å; R207-K212 HydrophobicContact CB-CG 4.3Å; R207-K212 VanDerWaalsContact NH1-NZ 3.1Å; T208-K212 WeakPolarHBondContact O-CG 3.32Å; T208-K212 PolarHBondContact O-N 2.99Å; T208-K212 VanDerWaalsContact O-N 3.13Å; A209-K212 PolarHBondContact O-N 2.87Å; L210-K212 PolarHBondContact O-N 3.21Å; K212-I214 VanDerWaalsContact C-N 3.32Å; K212-Q215 PolarHBondContact O-N 3.14Å; K212-C216 WeakPolarHBondContact O-CB 3.48Å; K212-C216 PolarHBondContact O-N 3.11Å; K212-C216 PolarHBondContact O-SG 2.73Å
213A98Very high97.1Very high0 Ų033.9 Ų33.90%016%0.163CC..Hα-helixtrans-59.8-44.4174.300000111.1A209 L210 C216 Q217 E218 C221 V222 L225A209-A213 PolarHBondContact O-N 3.17Å; L210-A213 PolarHBondContact O-N 2.83Å; A213-C216 CarbonylContact O-C 3.53Å; A213-C216 PolarHBondContact O-N 3.23Å; A213-Q217 PolarHBondContact O-N 3.37Å; A213-E218 PolarHBondContact O-N 3.15Å; A213-C221 HydrophobicContact CB-CB 4.12Å; A213-V222 HydrophobicContact CB-CG2 3.5Å; A213-L225 HydrophobicContact CB-CD1 4.29Å
214I98.1Very high97.2Very high3 Ų334.4 Ų34.42%0.01517%0.165CC..Hα-helixtrans-65.1-45.6177.7-63.1162.1000110.9L210 I211 K212 C216 Q217 V222 A242 A246 N249 M254 L258L210-I214 HydrophobicContact CD1-CD1 4Å; L210-I214 HydrophobicContact CD1-CG1 4.47Å; L210-I214 HydrophobicContact CG-CD1 4.04Å; L210-I214 WeakPolarHBondContact O-CG1 3.37Å; L210-I214 PolarHBondContact O-N 3.06Å; L210-I214 VanDerWaalsContact O-N 3.08Å; I211-I214 PolarHBondContact O-N 3.31Å; K212-I214 VanDerWaalsContact C-N 3.32Å; I214-C216 PolarHBondContact O-N 2.96Å; I214-Q217 PolarHBondContact O-N 2.98Å; I214-V222 HydrophobicContact CB-CG2 4.46Å; I214-V222 HydrophobicContact CD1-CG1 4.36Å; I214-V222 HydrophobicContact CG1-CB 4.44Å; I214-V222 HydrophobicContact CG1-CG1 3.94Å; I214-V222 HydrophobicContact CG1-CG2 3.58Å; I214-A242 HydrophobicContact CD1-CB 3.52Å; I214-A246 HydrophobicContact CG2-CB 4.18Å; I214-N249 PolarHBondContact O-ND2 3.22Å; I214-M254 HydrophobicContact CG1-CG 4.26Å; I214-M254 HydrophobicContact CG1-SD 4.38Å; I214-M254 HydrophobicContact CG2-CG 4.23Å; I214-L258 HydrophobicContact CD1-CD1 4Å; I214-L258 HydrophobicContact CD1-CD2 4Å
215Q95.9Very high97.4Very high5 Ų531.5 Ų31.52%0.02315%0.15CC..Hα-helixtrans-59.4-37178.7-168.4-179.816.300111.6A127 E130 P131 R207 I211 K212 Y245A127-Q215 PolarHBondContact O-NE2 3.49Å; E130-Q215 PolarHBondContact O-NE2 2.92Å; P131-Q215 HydrophobicContact CB-CG 4.02Å; P131-Q215 WeakPolarHBondContact CB-O 3.38Å; R207-Q215 VanDerWaalsContact NH1-OE1 3.13Å; I211-Q215 VanDerWaalsContact O-CB 3.32Å; I211-Q215 WeakPolarHBondContact O-CB 3.46Å; I211-Q215 PolarHBondContact O-N 3.35Å; K212-Q215 PolarHBondContact O-N 3.14Å; Q215-Y245 HydrophobicContact CB-CD1 3.95Å; Q215-Y245 HydrophobicContact CB-CE1 4.16Å; Q215-Y245 HydrophobicContact CG-CD1 3.86Å; Q215-Y245 HydrophobicContact CG-CE1 3.77Å
216C95.6Very high97.6Very high13 Ų1329 Ų299%0.08814%0.14CC..THydrogen-bonded Turntrans-84.4-3.2175.3-69.20000114.6P131 A182 K212 A213 I214 E218P131-C216 VanDerWaalsContact C-SG 3.53Å; P131-C216 PolarHBondContact O-SG 2.7Å; A182-C216 WeakPolarHBondContact O-CB 3.42Å; A182-C216 PolarHBondContact O-SG 3.21Å; K212-C216 WeakPolarHBondContact O-CB 3.48Å; K212-C216 PolarHBondContact O-N 3.11Å; K212-C216 PolarHBondContact O-SG 2.73Å; A213-C216 CarbonylContact O-C 3.53Å; A213-C216 PolarHBondContact O-N 3.23Å; I214-C216 PolarHBondContact O-N 2.96Å; C216-E218 VanDerWaalsContact C-N 3.35Å; C216-E218 HydrophobicContact CB-CG 3.67Å
217Q96.1Very high97.6Very high116 Ų11629.5 Ų29.554%0.54214%0.143SC..THydrogen-bonded Turntrans58.640.9-176.1-60.31716800113.3A213 I214 D219A213-Q217 PolarHBondContact O-N 3.37Å; I214-Q217 PolarHBondContact O-N 2.98Å; Q217-D219 PolarHBondContact O-N 3.34Å
218E97.6Very high97.7Very high42 Ų4232.6 Ų32.620%0.19616%0.159CC..  trans-96.972.2-180-55-67.4177.100110.3R132 G184 A213 C216 E220 C221 V222R132-E218 IonicContact CZ-OE1 3.66Å; R132-E218 IonicContact NH1-OE1 3.27Å; R132-E218 PolarHBondContact NH1-OE1 3.04Å; R132-E218 IonicContact NH2-OE1 3.86Å; R132-E218 PolarHBondContact NH2-OE1 3.31Å; G184-E218 WeakPolarHBondContact CA-OE2 3.4Å; A213-E218 PolarHBondContact O-N 3.15Å; C216-E218 VanDerWaalsContact C-N 3.35Å; C216-E218 HydrophobicContact CB-CG 3.67Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 3.41Å; E218-C221 HydrophobicContact CB-CB 4.32Å; E218-C221 WeakPolarHBondContact O-CB 3.39Å; E218-C221 PolarHBondContact O-N 2.88Å; E218-V222 PolarHBondContact O-N 2.95Å; E218-V222 VanDerWaalsContact O-N 3.14Å
219D96.7Very high97.6Very high77 Ų7734.8 Ų34.841%0.41218%0.181SC..Hα-helixtrans-54.2-41.6-167.6-66.5-13.1000114.9Q217 C221 V222 L223 M254Q217-D219 PolarHBondContact O-N 3.34Å; D219-C221 VanDerWaalsContact C-N 3.3Å; D219-C221 PolarHBondContact O-N 3.28Å; D219-V222 WeakPolarHBondContact O-CB 3.36Å; D219-V222 PolarHBondContact O-N 3.29Å; D219-V222 VanDerWaalsContact O-N 3.17Å; D219-L223 WeakPolarHBondContact O-CG 3.36Å; D219-L223 PolarHBondContact O-N 3.41Å; D219-M254 HydrophobicContact CB-CE 4.13Å; D219-M254 WeakPolarHBondContact OD1-CE 3.35Å
220E97.5Very high97.6Very high123 Ų12334.8 Ų34.858%0.57518%0.181SC*.Hα-helixtrans-60.8-42.2179.3-171.5-179.6-159.700111.1S186 E218 L223 M224S186-E220 VanDerWaalsContact CB-CD 3.45Å; S186-E220 WeakPolarHBondContact CB-OE2 3.37Å; S186-E220 PolarHBondContact OG-OE2 3.19Å; E218-E220 VanDerWaalsContact C-N 3.34Å; E218-E220 PolarHBondContact O-N 3.41Å; E220-L223 PolarHBondContact O-N 2.9Å; E220-M224 HydrophobicContact CG-CE 4.29Å; E220-M224 WeakPolarHBondContact O-CG 3.49Å; E220-M224 PolarHBondContact O-N 3.22Å; E220-M224 VanDerWaalsContact O-N 3.12Å
221C98.1Very high97.6Very high1 Ų136.8 Ų36.81%0.00719%0.192CC..Hα-helixtrans-66.4-39.3176.4-67.30000111.5V189 A213 E218 D219 M224 L225V189-C221 HydrophobicContact CG2-CB 4.49Å; A213-C221 HydrophobicContact CB-CB 4.12Å; E218-C221 HydrophobicContact CB-CB 4.32Å; E218-C221 WeakPolarHBondContact O-CB 3.39Å; E218-C221 PolarHBondContact O-N 2.88Å; D219-C221 VanDerWaalsContact C-N 3.3Å; D219-C221 PolarHBondContact O-N 3.28Å; C221-M224 HydrophobicContact CB-CE 4.49Å; C221-L225 WeakPolarHBondContact O-CB 3.3Å; C221-L225 WeakPolarHBondContact O-CD1 3.41Å; C221-L225 WeakPolarHBondContact O-CG 3.34Å; C221-L225 PolarHBondContact O-N 2.9Å
222V98.4Very high97.6Very high0 Ų039.1 Ų39.10%020%0.2CC..Hα-helixtrans-61.1-48.7177.2178.90000111.1L210 A213 I214 E218 D219 M224 L225 L226 M254L210-V222 HydrophobicContact CD1-CB 4.47Å; L210-V222 HydrophobicContact CD1-CG1 3.69Å; A213-V222 HydrophobicContact CB-CG2 3.5Å; I214-V222 HydrophobicContact CB-CG2 4.46Å; I214-V222 HydrophobicContact CD1-CG1 4.36Å; I214-V222 HydrophobicContact CG1-CB 4.44Å; I214-V222 HydrophobicContact CG1-CG1 3.94Å; I214-V222 HydrophobicContact CG1-CG2 3.58Å; E218-V222 PolarHBondContact O-N 2.95Å; E218-V222 VanDerWaalsContact O-N 3.14Å; D219-V222 WeakPolarHBondContact O-CB 3.36Å; D219-V222 PolarHBondContact O-N 3.29Å; D219-V222 VanDerWaalsContact O-N 3.17Å; V222-M224 PolarHBondContact O-N 3.33Å; V222-L225 PolarHBondContact O-N 2.98Å; V222-L226 HydrophobicContact CG1-CD1 3.81Å; V222-L226 HydrophobicContact CG1-CG 4.25Å; V222-L226 WeakPolarHBondContact O-CG 3.36Å; V222-L226 PolarHBondContact O-N 3.1Å; V222-M254 HydrophobicContact CB-CE 3.76Å; V222-M254 HydrophobicContact CB-SD 3.97Å; V222-M254 HydrophobicContact CG1-CE 3.81Å; V222-M254 HydrophobicContact CG1-SD 3.29Å; V222-M254 WeakPolarHBondContact CG1-SD 3.47Å; V222-M254 HydrophobicContact CG2-CE 3.87Å; V222-M254 HydrophobicContact CG2-SD 4.27Å
223L98.2Very high97.6Very high73 Ų7341.9 Ų41.938%0.38222%0.215SC..Hα-helixtrans-61.6-46.7-179.2-68.3175.5000111.5D219 E220 L225 L226 E227 A257D219-L223 WeakPolarHBondContact O-CG 3.36Å; D219-L223 PolarHBondContact O-N 3.41Å; E220-L223 PolarHBondContact O-N 2.9Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.39Å; L223-L226 PolarHBondContact O-N 3.5Å; L223-E227 WeakPolarHBondContact O-CB 3.39Å; L223-E227 VanDerWaalsContact O-CG 3.31Å; L223-E227 WeakPolarHBondContact O-CG 3.34Å; L223-E227 PolarHBondContact O-N 2.95Å; L223-A257 HydrophobicContact CD2-CB 4.49Å
224M98.2Very high97.6Very high16 Ų1643.4 Ų43.48%0.07922%0.223CC..Hα-helixtrans-58.4-42.8176.3-71.9-173.2-65.600112.3S186 V189 Q190 L193 E220 C221 V222 E227 H228S186-M224 VanDerWaalsContact CB-CE 3.47Å; V189-M224 HydrophobicContact CB-CE 3.84Å; V189-M224 HydrophobicContact CG1-CB 4.48Å; V189-M224 HydrophobicContact CG1-CE 3.73Å; Q190-M224 HydrophobicContact CB-SD 4.05Å; Q190-M224 PolarHBondContact OE1-SD 2.88Å; Q190-M224 VanDerWaalsContact OE1-SD 3.35Å; L193-M224 HydrophobicContact CD1-CB 3.83Å; E220-M224 HydrophobicContact CG-CE 4.29Å; E220-M224 WeakPolarHBondContact O-CG 3.49Å; E220-M224 PolarHBondContact O-N 3.22Å; E220-M224 VanDerWaalsContact O-N 3.12Å; C221-M224 HydrophobicContact CB-CE 4.49Å; V222-M224 PolarHBondContact O-N 3.33Å; M224-E227 PolarHBondContact O-N 3.4Å; M224-H228 PolarHBondContact O-N 3.47Å; M224-H228 VanDerWaalsContact O-N 3.14Å; M224-H228 PolarHBondContact O-ND1 3.34Å
225L98.4Very high97.6Very high0 Ų046.3 Ų46.30%024%0.242CC..Hα-helixtrans-64.3-43.3178.5-73.5166.9000111.8L177 L193 L199 A209 L210 A213 C221 V222 L223 H228 G229 A230L177-L225 HydrophobicContact CD1-CD2 4.15Å; L177-L225 HydrophobicContact CD2-CD2 3.94Å; L177-L225 HydrophobicContact CG-CD2 4.28Å; L193-L225 HydrophobicContact CD2-CD2 4.17Å; L199-L225 HydrophobicContact CD2-CD2 4.46Å; A209-L225 HydrophobicContact CB-CD1 4.41Å; L210-L225 HydrophobicContact CB-CD1 4.32Å; L210-L225 HydrophobicContact CD1-CB 4.2Å; A213-L225 HydrophobicContact CB-CD1 4.29Å; C221-L225 WeakPolarHBondContact O-CB 3.3Å; C221-L225 WeakPolarHBondContact O-CD1 3.41Å; C221-L225 WeakPolarHBondContact O-CG 3.34Å; C221-L225 PolarHBondContact O-N 2.9Å; V222-L225 PolarHBondContact O-N 2.98Å; L223-L225 VanDerWaalsContact C-N 3.31Å; L223-L225 PolarHBondContact O-N 3.39Å; L225-H228 PolarHBondContact O-N 3.46Å; L225-G229 PolarHBondContact O-N 3.48Å; L225-A230 HydrophobicContact CB-CB 3.96Å; L225-A230 WeakPolarHBondContact O-CB 3.36Å; L225-A230 PolarHBondContact O-N 3.16Å
226L98.1Very high97.6Very high5 Ų546.3 Ų46.33%0.02624%0.242CC..Hα-helixtrans-65.4-42.8177.9-70.1173.6000111.9L210 V222 L223 H228 G229 R232 L258 Y261L210-L226 HydrophobicContact CD1-CD2 4.06Å; L210-L226 HydrophobicContact CD1-CG 4.06Å; L210-L226 HydrophobicContact CD2-CD2 3.85Å; V222-L226 HydrophobicContact CG1-CD1 3.81Å; V222-L226 HydrophobicContact CG1-CG 4.25Å; V222-L226 WeakPolarHBondContact O-CG 3.36Å; V222-L226 PolarHBondContact O-N 3.1Å; L223-L226 PolarHBondContact O-N 3.5Å; L226-H228 PolarHBondContact O-N 2.95Å; L226-G229 PolarHBondContact O-N 2.94Å; L226-R232 HydrophobicContact CD2-CB 4.3Å; L226-L258 HydrophobicContact CD1-CD2 4.14Å; L226-L258 HydrophobicContact CD2-CD2 4.12Å; L226-Y261 HydrophobicContact CB-CD1 4.05Å; L226-Y261 HydrophobicContact CB-CD2 4Å; L226-Y261 HydrophobicContact CB-CE1 4.08Å; L226-Y261 HydrophobicContact CB-CE2 4.03Å; L226-Y261 HydrophobicContact CB-CG 4.01Å; L226-Y261 HydrophobicContact CD1-CD2 3.86Å; L226-Y261 HydrophobicContact CD1-CE2 4.28Å; L226-Y261 HydrophobicContact CD1-CG 4.34Å; L226-Y261 HydrophobicContact CD2-CG 4.4Å; L226-Y261 HydrophobicContact CG-CD2 4.41Å; L226-Y261 HydrophobicContact CG-CG 4.49Å
227E97.8Very high97.6Very high127 Ų12748.4 Ų48.459%0.59325%0.251SS*.Hα-helixtrans-60.9-32.2176.4-74.6174.6178.200112.6L223 M224 G229 Y261L223-E227 WeakPolarHBondContact O-CB 3.39Å; L223-E227 VanDerWaalsContact O-CG 3.31Å; L223-E227 WeakPolarHBondContact O-CG 3.34Å; L223-E227 PolarHBondContact O-N 2.95Å; M224-E227 PolarHBondContact O-N 3.4Å; E227-G229 VanDerWaalsContact C-N 3.3Å; E227-Y261 VanDerWaalsContact CG-OH 3.3Å; E227-Y261 WeakPolarHBondContact CG-OH 3.21Å
228H98Very high97.5Very high81 Ų8145.4 Ų45.438%0.37524%0.235SC..THydrogen-bonded Turntrans-87.44.9176-70.674.2000113.6L193 L199 M224 L225 L226L193-H228 HydrophobicContact CD1-CB 4.46Å; L193-H228 HydrophobicContact CD2-CB 4.07Å; L199-H228 HydrophobicContact CD1-CB 4.06Å; L199-H228 WeakPolarHBondContact CD1-O 3.41Å; M224-H228 PolarHBondContact O-N 3.47Å; M224-H228 VanDerWaalsContact O-N 3.14Å; M224-H228 PolarHBondContact O-ND1 3.34Å; L225-H228 PolarHBondContact O-N 3.46Å; L226-H228 PolarHBondContact O-N 2.95Å
229G96.9Very high97.5Very high46 Ų4643.9 Ų43.947%0.47423%0.231SC..THydrogen-bonded Turntrans86.322.3172.700000115.3L225 L226 E227 D231L225-G229 PolarHBondContact O-N 3.48Å; L226-G229 PolarHBondContact O-N 2.94Å; E227-G229 VanDerWaalsContact C-N 3.3Å; G229-D231 PolarHBondContact O-N 3.36Å
230A98Very high97.5Very high0 Ų040.3 Ų40.30%021%0.212CC..  trans-56137.517300000111.2L199 L210 L225 R232L199-A230 HydrophobicContact CB-CB 4.13Å; L199-A230 HydrophobicContact CD1-CB 4.15Å; L210-A230 HydrophobicContact CB-CB 4.35Å; L210-A230 HydrophobicContact CD2-CB 4.22Å; L225-A230 HydrophobicContact CB-CB 3.96Å; L225-A230 WeakPolarHBondContact O-CB 3.36Å; L225-A230 PolarHBondContact O-N 3.16Å; A230-R232 PolarHBondContact O-N 2.81Å; A230-R232 PolarHBondContact O-NH1 3.28Å
231D98.3Very high97.5Very high43 Ų4334.7 Ų34.723%0.2319%0.186CC..  trans-78.5112.4-176.3-165.9-12.4000112.2N200 G229 N233 I234N200-D231 WeakPolarHBondContact OD1-CB 3.42Å; N200-D231 PolarHBondContact OD1-N 3Å; G229-D231 PolarHBondContact O-N 3.36Å; D231-N233 VanDerWaalsContact C-N 3.34Å; D231-N233 PolarHBondContact OD1-N 3.26Å; D231-I234 HydrophobicContact CB-CD1 3.68Å; D231-I234 HydrophobicContact CB-CG1 3.82Å
232R97.8Very high97.5Very high50 Ų5034.7 Ų34.719%0.18919%0.185CC..THydrogen-bonded Turntrans-78.7-12.7179.569-84.786.2-144.110.3114.8L210 L226 A230 A242 L258 Y261 A263L210-R232 HydrophobicContact CD2-CB 3.92Å; L226-R232 HydrophobicContact CD2-CB 4.3Å; A230-R232 PolarHBondContact O-N 2.81Å; A230-R232 PolarHBondContact O-NH1 3.28Å; R232-A242 HydrophobicContact CB-CB 4.26Å; R232-A242 WeakPolarHBondContact O-CB 3.43Å; R232-L258 HydrophobicContact CB-CD2 4.08Å; R232-Y261 VanDerWaalsContact CD-O 3.27Å; R232-Y261 WeakPolarHBondContact CD-O 3.29Å; R232-A263 HydrophobicContact CG-CB 3.77Å
233N98.3Very high97.5Very high58 Ų5834.7 Ų34.731%0.3119%0.185SC..THydrogen-bonded Turntrans-101.8-2-175.5-64-35.9000113.1D231 P235 G262 A263 D264D231-N233 VanDerWaalsContact C-N 3.34Å; D231-N233 PolarHBondContact OD1-N 3.26Å; N233-P235 VanDerWaalsContact O-CD 3.29Å; N233-P235 WeakPolarHBondContact O-CD 3.39Å; N233-G262 PolarHBondContact ND2-O 3.41Å; N233-A263 WeakPolarHBondContact OD1-CA 3.31Å; N233-D264 PolarHBondContact OD1-N 3.03Å
234I98.3Very high97.5Very high33 Ų3331.2 Ų31.217%0.16917%0.167CC..  trans-66.9121.5173.1-65.9176.5000108.7N200 L202 T208 I211 D231N200-I234 HydrophobicContact CB-CD1 3.6Å; L202-I234 HydrophobicContact CD2-CG2 3.8Å; T208-I234 HydrophobicContact CG2-CB 4.02Å; T208-I234 HydrophobicContact CG2-CD1 4Å; T208-I234 HydrophobicContact CG2-CG2 3.85Å; I211-I234 WeakPolarHBondContact CD1-O 3.47Å; D231-I234 HydrophobicContact CB-CD1 3.68Å; D231-I234 HydrophobicContact CB-CG1 3.82Å
235P97.4Very high97.5Very high63 Ų6330.5 Ų30.541%0.40916%0.164SC..  trans-83.6150.8176.532.7-32.7000111.9N233 N240 T241N233-P235 VanDerWaalsContact O-CD 3.29Å; N233-P235 WeakPolarHBondContact O-CD 3.39Å; P235-N240 WeakPolarHBondContact CA-O 3.49Å; P235-T241 HydrophobicContact CB-CG2 4.42Å
236D96.6Very high97.5Very high6 Ų630.5 Ų30.53%0.03216%0.164CC..  trans-75.2-172.3168.776-2.1000112.8R207 I211 Y238 G239 N240 Y245R207-D236 HydrophobicContact CG-CB 3.66Å; I211-D236 HydrophobicContact CD1-CB 4.44Å; D236-Y238 PolarHBondContact O-N 3.19Å; D236-Y238 VanDerWaalsContact OD1-CA 3.29Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.49Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.29Å; D236-Y238 PolarHBondContact OD1-N 3.3Å; D236-G239 PolarHBondContact O-N 3.05Å; D236-G239 VanDerWaalsContact O-N 3.08Å; D236-G239 PolarHBondContact OD1-N 2.91Å; D236-N240 PolarHBondContact N-O 3.47Å; D236-N240 PolarHBondContact OD1-N 3.19Å; D236-Y245 PolarHBondContact OD2-OH 2.92Å
237E95.6Very high97.5Very high56 Ų5630.2 Ų30.226%0.26216%0.162SC..THydrogen-bonded Turntrans-63.7-18.1178.272179.9156.100114.2K205 K206 K270K205-E237 HydrophobicContact CB-CG 4.21Å; K205-E237 VanDerWaalsContact CB-OE1 3.3Å; K205-E237 WeakPolarHBondContact CB-OE1 3.4Å; K205-E237 VanDerWaalsContact CD-OE1 3.27Å; K205-E237 WeakPolarHBondContact CD-OE1 3.42Å; K205-E237 WeakPolarHBondContact CG-OE1 3.21Å; K205-E237 WeakPolarHBondContact O-CB 3.37Å; K205-E237 WeakPolarHBondContact O-CG 3.33Å; K205-E237 PolarHBondContact O-N 3.34Å; K206-E237 HydrophobicContact CB-CB 4.41Å; K206-E237 HydrophobicContact CD-CB 4.4Å; K206-E237 HydrophobicContact CG-CB 4.31Å; E237-K270 WeakPolarHBondContact O-CD 3.45Å; E237-K270 WeakPolarHBondContact O-CE 3.42Å; E237-K270 PolarHBondContact O-NZ 3.36Å
238Y94.3Very high97.4Very high53 Ų5326 Ų2621%0.20814%0.141CC..THydrogen-bonded Turntrans-97.20.5177.5-53.9-85.3000112.2S126 A127 D236 N240 K270S126-Y238 PolarHBondContact OG-OH 3.34Å; A127-Y238 HydrophobicContact CB-CD1 4.35Å; A127-Y238 HydrophobicContact CB-CD2 3.31Å; A127-Y238 HydrophobicContact CB-CE2 3.7Å; A127-Y238 HydrophobicContact CB-CG 3.72Å; D236-Y238 PolarHBondContact O-N 3.19Å; D236-Y238 VanDerWaalsContact OD1-CA 3.29Å; D236-Y238 WeakPolarHBondContact OD1-CA 3.49Å; D236-Y238 WeakPolarHBondContact OD1-CB 3.29Å; D236-Y238 PolarHBondContact OD1-N 3.3Å; Y238-N240 VanDerWaalsContact C-N 3.28Å; Y238-N240 WeakPolarHBondContact CB-ND2 3.5Å; Y238-K270 VanDerWaalsContact O-CB 3.27Å; Y238-K270 WeakPolarHBondContact O-CB 3.43Å; Y238-K270 WeakPolarHBondContact O-CG 2.99Å; Y238-K270 PolarHBondContact O-N 3.47Å
239G95.9Very high97.3Very high11 Ų1124 Ų2411%0.11313%0.133CC..SBendtrans82.23.8-174.800000113.6D236 N269D236-G239 PolarHBondContact O-N 3.05Å; D236-G239 VanDerWaalsContact O-N 3.08Å; D236-G239 PolarHBondContact OD1-N 2.91Å; G239-N269 WeakPolarHBondContact O-CA 3.2Å
240N97.1Very high97.2Very high2 Ų225.5 Ų25.51%0.01113%0.128CC..  trans-79.2127-179.3-65.9-49.9000110.3P235 D236 Y238 H244 Y245 N269P235-N240 WeakPolarHBondContact CA-O 3.49Å; D236-N240 PolarHBondContact N-O 3.47Å; D236-N240 PolarHBondContact OD1-N 3.19Å; Y238-N240 VanDerWaalsContact C-N 3.28Å; Y238-N240 WeakPolarHBondContact CB-ND2 3.5Å; N240-H244 HydrophobicContact CB-CB 3.89Å; N240-Y245 HydrophobicContact CB-CD2 4.28Å; N240-Y245 HydrophobicContact CB-CE2 3.9Å; N240-N269 VanDerWaalsContact OD1-CB 3.31Å; N240-N269 WeakPolarHBondContact OD1-CB 3.48Å; N240-N269 PolarHBondContact OD1-ND2 3.16Å
241T98.3Very high97.1Very high5 Ų526.9 Ų26.93%0.03114%0.136CC..  trans-88.4173.6173.463.50000111.3P235 L243 H244 Y245 S267P235-T241 HydrophobicContact CB-CG2 4.42Å; T241-L243 PolarHBondContact O-N 3.49Å; T241-L243 VanDerWaalsContact O-N 3.15Å; T241-H244 PolarHBondContact N-ND1 2.79Å; T241-H244 WeakPolarHBondContact O-CB 3.43Å; T241-H244 PolarHBondContact O-N 2.89Å; T241-H244 PolarHBondContact OG1-ND1 3.15Å; T241-Y245 WeakPolarHBondContact O-CD2 3.5Å; T241-Y245 PolarHBondContact O-N 2.95Å; T241-S267 PolarHBondContact OG1-OG 3.09Å
242A98.3Very high97.1Very high0 Ų029.5 Ų29.50%015%0.145CC..Hα-helixtrans-50.5-38.3173.100000112.7L210 I211 I214 R232 Y245 A246 L258L210-A242 HydrophobicContact CD2-CB 4.35Å; I211-A242 HydrophobicContact CG1-CB 4.45Å; I214-A242 HydrophobicContact CD1-CB 3.52Å; R232-A242 HydrophobicContact CB-CB 4.26Å; R232-A242 WeakPolarHBondContact O-CB 3.43Å; A242-Y245 PolarHBondContact O-N 3.25Å; A242-A246 PolarHBondContact O-N 3.07Å; A242-A246 VanDerWaalsContact O-N 3.15Å; A242-L258 HydrophobicContact CB-CD1 4.16Å; A242-L258 HydrophobicContact CB-CD2 3.85Å; A242-L258 WeakPolarHBondContact O-CD1 3.36Å
243L98.5Very high97.1Very high0 Ų032.1 Ų32.10%016%0.162CC..Hα-helixtrans-67.8-39.6179.6-174.657.7000112T241 Y245 A246 I247 A255 L258 L259 A263 P275T241-L243 PolarHBondContact O-N 3.49Å; T241-L243 VanDerWaalsContact O-N 3.15Å; L243-Y245 VanDerWaalsContact C-N 3.3Å; L243-Y245 PolarHBondContact O-N 3.36Å; L243-A246 PolarHBondContact O-N 3Å; L243-I247 HydrophobicContact CD1-CD1 4.49Å; L243-I247 HydrophobicContact CD1-CG1 4.4Å; L243-I247 HydrophobicContact CG-CG1 4.5Å; L243-I247 VanDerWaalsContact O-CG1 3.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 3.36Å; L243-A255 HydrophobicContact CD1-CB 3.91Å; L243-L258 HydrophobicContact CB-CD1 4.5Å; L243-L258 HydrophobicContact CD1-CB 4.45Å; L243-L258 HydrophobicContact CD1-CD1 4.4Å; L243-L259 HydrophobicContact CD2-CD2 3.8Å; L243-L259 HydrophobicContact CD2-CG 4.49Å; L243-A263 HydrophobicContact CB-CB 4.39Å; L243-A263 HydrophobicContact CD2-CB 4.4Å; L243-P275 HydrophobicContact CB-CG 4.42Å; L243-P275 HydrophobicContact CD2-CB 4.03Å; L243-P275 HydrophobicContact CD2-CG 3.69Å; L243-P275 HydrophobicContact CG-CB 4.02Å; L243-P275 HydrophobicContact CG-CG 3.89Å
244H98.2Very high97.1Very high0 Ų029.8 Ų29.80%015%0.149CC..Hα-helixtrans-58-43.7175.6-70.683.3000111.7N240 T241 I247 Y248 S267 L273 L278N240-H244 HydrophobicContact CB-CB 3.89Å; T241-H244 PolarHBondContact N-ND1 2.79Å; T241-H244 WeakPolarHBondContact O-CB 3.43Å; T241-H244 PolarHBondContact O-N 2.89Å; T241-H244 PolarHBondContact OG1-ND1 3.15Å; H244-I247 PolarHBondContact O-N 2.91Å; H244-Y248 WeakPolarHBondContact O-CB 3.39Å; H244-Y248 PolarHBondContact O-N 2.8Å; H244-S267 PolarHBondContact CE1-O 2.88Å; H244-S267 PolarHBondContact CE1-OG 2.79Å; H244-S267 PolarHBondContact NE2-O 3.06Å; H244-L273 PolarHBondContact NE2-O 3.35Å; H244-L278 HydrophobicContact CB-CD2 3.82Å; H244-L278 WeakPolarHBondContact O-CD2 3.19Å
245Y97.8Very high97.1Very high1 Ų128.2 Ų28.20%0.00414%0.141CC..Hα-helixtrans-64-41.7176.7-81.6-80.8000112.9A127 F128 I211 Q215 D236 N240 T241 A242 L243 I247 Y248 N249A127-Y245 WeakPolarHBondContact O-CE1 3.48Å; A127-Y245 PolarHBondContact O-OH 3.08Å; F128-Y245 AromaticContact CD1-CD1 3.64Å; F128-Y245 HydrophobicContact CD1-CD1 3.64Å; F128-Y245 AromaticContact CD1-CE1 3.59Å; F128-Y245 HydrophobicContact CD1-CE1 3.59Å; F128-Y245 HydrophobicContact CD1-CG 4.48Å; F128-Y245 AromaticContact CE1-CD1 3.83Å; F128-Y245 HydrophobicContact CE1-CD1 3.83Å; F128-Y245 AromaticContact CE1-CE1 3.9Å; F128-Y245 HydrophobicContact CE1-CE1 3.9Å; F128-Y245 HydrophobicContact CE1-CG 4.24Å; F128-Y245 HydrophobicContact CG-CE1 4.48Å; I211-Y245 HydrophobicContact CG2-CD2 3.61Å; I211-Y245 HydrophobicContact CG2-CE2 3.38Å; I211-Y245 HydrophobicContact CG2-CG 4.3Å; Q215-Y245 HydrophobicContact CB-CD1 3.95Å; Q215-Y245 HydrophobicContact CB-CE1 4.16Å; Q215-Y245 HydrophobicContact CG-CD1 3.86Å; Q215-Y245 HydrophobicContact CG-CE1 3.77Å; D236-Y245 PolarHBondContact OD2-OH 2.92Å; N240-Y245 HydrophobicContact CB-CD2 4.28Å; N240-Y245 HydrophobicContact CB-CE2 3.9Å; T241-Y245 WeakPolarHBondContact O-CD2 3.5Å; T241-Y245 PolarHBondContact O-N 2.95Å; A242-Y245 PolarHBondContact O-N 3.25Å; L243-Y245 VanDerWaalsContact C-N 3.3Å; L243-Y245 PolarHBondContact O-N 3.36Å; Y245-I247 VanDerWaalsContact C-N 3.32Å; Y245-I247 PolarHBondContact O-N 2.98Å; Y245-Y248 PolarHBondContact O-N 2.99Å; Y245-N249 WeakPolarHBondContact O-CB 3.46Å; Y245-N249 PolarHBondContact O-N 3.18Å
246A98Very high97.1Very high0 Ų031.3 Ų31.30%015%0.148CC..Hα-helixtrans-62.5-40.1175.600000112I214 A242 L243 N249 E250 D251 M254 A255 L258I214-A246 HydrophobicContact CG2-CB 4.18Å; A242-A246 PolarHBondContact O-N 3.07Å; A242-A246 VanDerWaalsContact O-N 3.15Å; L243-A246 PolarHBondContact O-N 3Å; A246-N249 PolarHBondContact O-N 2.91Å; A246-E250 PolarHBondContact O-N 3.27Å; A246-D251 PolarHBondContact O-N 3.25Å; A246-M254 HydrophobicContact CB-CB 4.13Å; A246-M254 HydrophobicContact CB-CG 3.99Å; A246-A255 HydrophobicContact CB-CB 4.3Å; A246-L258 HydrophobicContact CB-CD1 3.76Å
247I97.9Very high97.2Very high0 Ų032 Ų320%016%0.155CC..Hα-helixtrans-66.2-45.3175.9-63.7-55.1000111.5L243 H244 Y245 N249 E250 A255 P275 L278 V287 L291L243-I247 HydrophobicContact CD1-CD1 4.49Å; L243-I247 HydrophobicContact CD1-CG1 4.4Å; L243-I247 HydrophobicContact CG-CG1 4.5Å; L243-I247 VanDerWaalsContact O-CG1 3.3Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 3.36Å; H244-I247 PolarHBondContact O-N 2.91Å; Y245-I247 VanDerWaalsContact C-N 3.32Å; Y245-I247 PolarHBondContact O-N 2.98Å; I247-N249 VanDerWaalsContact C-N 3.27Å; I247-N249 PolarHBondContact O-N 2.85Å; I247-E250 WeakPolarHBondContact O-CA 3.17Å; I247-E250 PolarHBondContact O-N 3.08Å; I247-A255 HydrophobicContact CD1-CB 4.06Å; I247-P275 HydrophobicContact CG1-CB 4.06Å; I247-P275 WeakPolarHBondContact CG2-O 3.5Å; I247-L278 HydrophobicContact CG2-CG 4.48Å; I247-V287 HydrophobicContact CD1-CB 3.72Å; I247-V287 HydrophobicContact CD1-CG1 4.29Å; I247-V287 HydrophobicContact CD1-CG2 4.12Å; I247-V287 HydrophobicContact CG2-CG2 3.86Å; I247-L291 HydrophobicContact CD1-CD1 3.66Å; I247-L291 HydrophobicContact CD1-CD2 4.2Å; I247-L291 HydrophobicContact CD1-CG 4.02Å; I247-L291 HydrophobicContact CG1-CD1 4.15Å
248Y96.1Very high97.3Very high37 Ų3729.3 Ų29.315%0.14514%0.142CC..Hα-helixtrans-58.2-41.1177.6-178.1-89.1000111.9F128 H244 Y245 E250 E282 K284F128-Y248 HydrophobicContact CB-CD1 3.69Å; F128-Y248 HydrophobicContact CB-CD2 4.15Å; F128-Y248 HydrophobicContact CB-CE1 3.31Å; F128-Y248 HydrophobicContact CB-CE2 3.81Å; F128-Y248 HydrophobicContact CB-CG 4.09Å; F128-Y248 AromaticContact CD1-CD1 3.55Å; F128-Y248 HydrophobicContact CD1-CD1 3.55Å; F128-Y248 AromaticContact CD1-CD2 3.71Å; F128-Y248 HydrophobicContact CD1-CD2 3.71Å; F128-Y248 HydrophobicContact CD1-CE1 4.12Å; F128-Y248 HydrophobicContact CD1-CE2 4.25Å; F128-Y248 AromaticContact CD1-CG 3.32Å; F128-Y248 HydrophobicContact CD1-CG 3.32Å; F128-Y248 AromaticContact CD2-CD2 3.77Å; F128-Y248 HydrophobicContact CD2-CD2 3.77Å; F128-Y248 AromaticContact CD2-CE2 3.76Å; F128-Y248 HydrophobicContact CD2-CE2 3.76Å; F128-Y248 HydrophobicContact CD2-CG 4.26Å; F128-Y248 HydrophobicContact CE1-CD1 4.4Å; F128-Y248 HydrophobicContact CE1-CD2 4.01Å; F128-Y248 AromaticContact CE1-CG 3.74Å; F128-Y248 HydrophobicContact CE1-CG 3.74Å; F128-Y248 HydrophobicContact CE2-CD2 4.1Å; F128-Y248 HydrophobicContact CE2-CE2 4.43Å; F128-Y248 AromaticContact CG-CD1 3.74Å; F128-Y248 HydrophobicContact CG-CD1 3.74Å; F128-Y248 AromaticContact CG-CD2 3.59Å; F128-Y248 HydrophobicContact CG-CD2 3.59Å; F128-Y248 AromaticContact CG-CE1 3.82Å; F128-Y248 HydrophobicContact CG-CE1 3.82Å; F128-Y248 AromaticContact CG-CE2 3.67Å; F128-Y248 HydrophobicContact CG-CE2 3.67Å; F128-Y248 AromaticContact CG-CG 3.62Å; F128-Y248 HydrophobicContact CG-CG 3.62Å; F128-Y248 AromaticContact CG-CZ 3.77Å; F128-Y248 HydrophobicContact CZ-CD2 4.2Å; F128-Y248 HydrophobicContact CZ-CG 4.38Å; H244-Y248 WeakPolarHBondContact O-CB 3.39Å; H244-Y248 PolarHBondContact O-N 2.8Å; Y245-Y248 PolarHBondContact O-N 2.99Å; Y248-E250 PolarHBondContact O-N 3.35Å; Y248-E282 HydrophobicContact CD2-CG 3.87Å; Y248-E282 HydrophobicContact CE2-CG 4.23Å; Y248-E282 WeakPolarHBondContact CE2-OE2 3.44Å; Y248-K284 VanDerWaalsContact O-CE 3.28Å; Y248-K284 WeakPolarHBondContact O-CE 3.44Å
249N94.8Very high97.5Very high39 Ų3928.4 Ų28.421%0.20914%0.141CC..THydrogen-bonded Turntrans-72.4-3.4176.2-71-10.9000113.8I214 Y245 A246 I247 D251I214-N249 PolarHBondContact O-ND2 3.22Å; Y245-N249 WeakPolarHBondContact O-CB 3.46Å; Y245-N249 PolarHBondContact O-N 3.18Å; A246-N249 PolarHBondContact O-N 2.91Å; I247-N249 VanDerWaalsContact C-N 3.27Å; I247-N249 PolarHBondContact O-N 2.85Å; N249-D251 HydrophobicContact CB-CB 4.4Å; N249-D251 PolarHBondContact O-N 3.05Å
250E95.9Very high97.6Very high78 Ų7834.9 Ų34.936%0.36417%0.172SC..THydrogen-bonded Turntrans58.823.5-172-157.7164.9-172.100113.6A246 I247 Y248 K252 K284 V287A246-E250 PolarHBondContact O-N 3.27Å; I247-E250 WeakPolarHBondContact O-CA 3.17Å; I247-E250 PolarHBondContact O-N 3.08Å; Y248-E250 PolarHBondContact O-N 3.35Å; E250-K252 PolarHBondContact O-N 2.84Å; E250-K252 VanDerWaalsContact O-N 3.15Å; E250-K284 HydrophobicContact CB-CD 4.04Å; E250-K284 HydrophobicContact CG-CB 4.18Å; E250-K284 HydrophobicContact CG-CD 4.2Å; E250-K284 IonicContact OE2-NZ 2.84Å; E250-V287 HydrophobicContact CG-CG1 4.38Å
251D96.8Very high97.6Very high30 Ų3038.9 Ų38.916%0.1619%0.188CC..  trans-88.389.9-177.6-169.3-16.7000111.5A246 N249 L253 M254 A255A246-D251 PolarHBondContact O-N 3.25Å; N249-D251 HydrophobicContact CB-CB 4.4Å; N249-D251 PolarHBondContact O-N 3.05Å; D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.15Å; D251-L253 PolarHBondContact OD1-N 2.96Å; D251-M254 HydrophobicContact CB-CB 3.94Å; D251-M254 PolarHBondContact O-N 2.96Å; D251-M254 PolarHBondContact OD1-N 2.8Å; D251-M254 VanDerWaalsContact OD2-CB 3.28Å; D251-M254 WeakPolarHBondContact OD2-CB 3.34Å; D251-A255 WeakPolarHBondContact O-CB 3.3Å; D251-A255 PolarHBondContact O-N 2.81Å
252K97.3Very high97.6Very high97 Ų9740.8 Ų40.842%0.42221%0.208SC..Hα-helixtrans-62.4-32.9176.3179.8-178.9168.9-169.50113.2E250 K256 V287 F290E250-K252 PolarHBondContact O-N 2.84Å; E250-K252 VanDerWaalsContact O-N 3.15Å; K252-K256 WeakPolarHBondContact O-CB 3.4Å; K252-K256 PolarHBondContact O-N 3.36Å; K252-V287 HydrophobicContact CB-CG1 4.12Å; K252-F290 HydrophobicContact CD-CB 4.19Å; K252-F290 HydrophobicContact CD-CG 4.45Å; K252-F290 HydrophobicContact CG-CB 4.05Å; K252-F290 HydrophobicContact CG-CD1 4.37Å; K252-F290 HydrophobicContact CG-CD2 4.14Å; K252-F290 HydrophobicContact CG-CG 3.92Å
253L96.9Very high97.6Very high106 Ų10641.3 Ų41.356%0.55521%0.212SC*.Hα-helixtrans-72.7-43.5-178.1-66.4179.1000109.9W27 D251 K256 A257W27-L253 HydrophobicContact CH2-CD1 3.78Å; D251-L253 VanDerWaalsContact C-N 3.29Å; D251-L253 PolarHBondContact O-N 3.15Å; D251-L253 PolarHBondContact OD1-N 2.96Å; L253-K256 WeakPolarHBondContact O-CB 3.39Å; L253-K256 PolarHBondContact O-N 3.26Å; L253-A257 PolarHBondContact O-N 3.08Å
254M98.3Very high97.6Very high9 Ų944.9 Ų44.94%0.04423%0.232CC..Hα-helixtrans-64.3-44174.4-168.955.466.600112I214 D219 V222 A246 D251 K256 A257 L258I214-M254 HydrophobicContact CG1-CG 4.26Å; I214-M254 HydrophobicContact CG1-SD 4.38Å; I214-M254 HydrophobicContact CG2-CG 4.23Å; D219-M254 HydrophobicContact CB-CE 4.13Å; D219-M254 WeakPolarHBondContact OD1-CE 3.35Å; V222-M254 HydrophobicContact CB-CE 3.76Å; V222-M254 HydrophobicContact CB-SD 3.97Å; V222-M254 HydrophobicContact CG1-CE 3.81Å; V222-M254 HydrophobicContact CG1-SD 3.29Å; V222-M254 WeakPolarHBondContact CG1-SD 3.47Å; V222-M254 HydrophobicContact CG2-CE 3.87Å; V222-M254 HydrophobicContact CG2-SD 4.27Å; A246-M254 HydrophobicContact CB-CB 4.13Å; A246-M254 HydrophobicContact CB-CG 3.99Å; D251-M254 HydrophobicContact CB-CB 3.94Å; D251-M254 PolarHBondContact O-N 2.96Å; D251-M254 PolarHBondContact OD1-N 2.8Å; D251-M254 VanDerWaalsContact OD2-CB 3.28Å; D251-M254 WeakPolarHBondContact OD2-CB 3.34Å; M254-K256 VanDerWaalsContact C-N 3.26Å; M254-K256 PolarHBondContact O-N 3.04Å; M254-A257 PolarHBondContact O-N 3.23Å; M254-A257 VanDerWaalsContact O-N 3.11Å; M254-L258 HydrophobicContact CG-CD1 4.18Å; M254-L258 WeakPolarHBondContact O-CG 3.47Å; M254-L258 PolarHBondContact O-N 3.29Å
255A98.3Very high97.6Very high0 Ų046.4 Ų46.40%024%0.239CC..Hα-helixtrans-57.6-40.1173.700000111.8L243 A246 I247 D251 L259 F290L243-A255 HydrophobicContact CD1-CB 3.91Å; A246-A255 HydrophobicContact CB-CB 4.3Å; I247-A255 HydrophobicContact CD1-CB 4.06Å; D251-A255 WeakPolarHBondContact O-CB 3.3Å; D251-A255 PolarHBondContact O-N 2.81Å; A255-L259 VanDerWaalsContact O-CG 3.32Å; A255-L259 WeakPolarHBondContact O-CG 3.27Å; A255-L259 PolarHBondContact O-N 2.91Å; A255-L259 VanDerWaalsContact O-N 3.09Å; A255-F290 HydrophobicContact CB-CD1 4.29Å; A255-F290 HydrophobicContact CB-CE1 3.94Å
256K98.2Very high97.6Very high127 Ų12749 Ų4955%0.55225%0.251SS*.Hα-helixtrans-64.4-43.1174.8-177-174.4174.9-170.70112.2K252 L253 M254 L260 F290K252-K256 WeakPolarHBondContact O-CB 3.4Å; K252-K256 PolarHBondContact O-N 3.36Å; L253-K256 WeakPolarHBondContact O-CB 3.39Å; L253-K256 PolarHBondContact O-N 3.26Å; M254-K256 VanDerWaalsContact C-N 3.26Å; M254-K256 PolarHBondContact O-N 3.04Å; K256-L260 PolarHBondContact O-N 3.35Å; K256-L260 VanDerWaalsContact O-N 3.09Å; K256-F290 HydrophobicContact CB-CE1 4.49Å; K256-F290 HydrophobicContact CB-CE2 4.2Å; K256-F290 HydrophobicContact CB-CZ 3.73Å; K256-F290 HydrophobicContact CG-CE2 4.43Å; K256-F290 HydrophobicContact CG-CZ 4.23Å
257A98Very high97.5Very high20 Ų2049.7 Ų49.717%0.16526%0.256CS..Hα-helixtrans-61.9-49.617700000110.7L223 L253 M254 L259 L260 Y261L223-A257 HydrophobicContact CD2-CB 4.49Å; L253-A257 PolarHBondContact O-N 3.08Å; M254-A257 PolarHBondContact O-N 3.23Å; M254-A257 VanDerWaalsContact O-N 3.11Å; A257-L259 PolarHBondContact O-N 3.32Å; A257-L260 WeakPolarHBondContact O-CB 3.49Å; A257-L260 PolarHBondContact O-N 3.12Å; A257-Y261 WeakPolarHBondContact O-CD2 3.32Å; A257-Y261 PolarHBondContact O-N 2.96Å
258L98.5Very high97.4Very high0 Ų055.4 Ų55.40%028%0.281CS..Hα-helixtrans-57.2-45.2179.2-70.9168.6000112.7I214 L226 R232 A242 L243 A246 M254 L260 Y261 G262 A263I214-L258 HydrophobicContact CD1-CD1 4Å; I214-L258 HydrophobicContact CD1-CD2 4Å; L226-L258 HydrophobicContact CD1-CD2 4.14Å; L226-L258 HydrophobicContact CD2-CD2 4.12Å; R232-L258 HydrophobicContact CB-CD2 4.08Å; A242-L258 HydrophobicContact CB-CD1 4.16Å; A242-L258 HydrophobicContact CB-CD2 3.85Å; A242-L258 WeakPolarHBondContact O-CD1 3.36Å; L243-L258 HydrophobicContact CB-CD1 4.5Å; L243-L258 HydrophobicContact CD1-CB 4.45Å; L243-L258 HydrophobicContact CD1-CD1 4.4Å; A246-L258 HydrophobicContact CB-CD1 3.76Å; M254-L258 HydrophobicContact CG-CD1 4.18Å; M254-L258 WeakPolarHBondContact O-CG 3.47Å; M254-L258 PolarHBondContact O-N 3.29Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.5Å; L258-Y261 CarbonylContact O-C 3.47Å; L258-Y261 PolarHBondContact O-N 3.17Å; L258-G262 PolarHBondContact O-N 3.14Å; L258-A263 HydrophobicContact CB-CB 3.86Å; L258-A263 WeakPolarHBondContact O-CB 3.43Å; L258-A263 PolarHBondContact O-N 3.04Å
259L98.2Very high97.3Very high35 Ų3554 Ų5418%0.18328%0.276CS..Hα-helixtrans-64.7-35.5176.2-69.4176.8000112.6L243 A255 A257 Y261 G262 A263 I265 F290 K294L243-L259 HydrophobicContact CD2-CD2 3.8Å; L243-L259 HydrophobicContact CD2-CG 4.49Å; A255-L259 VanDerWaalsContact O-CG 3.32Å; A255-L259 WeakPolarHBondContact O-CG 3.27Å; A255-L259 PolarHBondContact O-N 2.91Å; A255-L259 VanDerWaalsContact O-N 3.09Å; A257-L259 PolarHBondContact O-N 3.32Å; L259-Y261 VanDerWaalsContact C-N 3.27Å; L259-Y261 PolarHBondContact O-N 2.98Å; L259-G262 PolarHBondContact O-N 2.99Å; L259-G262 VanDerWaalsContact O-N 3.14Å; L259-A263 HydrophobicContact CD2-CB 4.45Å; L259-I265 HydrophobicContact CD1-CD1 4.24Å; L259-I265 HydrophobicContact CD2-CB 3.85Å; L259-I265 HydrophobicContact CD2-CD1 4.29Å; L259-I265 HydrophobicContact CD2-CG1 4.19Å; L259-F290 HydrophobicContact CD1-CE1 3.75Å; L259-F290 HydrophobicContact CD1-CZ 3.96Å; L259-K294 HydrophobicContact CD1-CB 4.34Å; L259-K294 HydrophobicContact CD1-CG 3.97Å
260L97.9Very high97.2Very high146 Ų14659.8 Ų59.876%0.76430%0.299SS*.Hα-helixtrans-63.5-35.7174.6-177.766.8000111.7K256 A257 L258 G262K256-L260 PolarHBondContact O-N 3.35Å; K256-L260 VanDerWaalsContact O-N 3.09Å; A257-L260 WeakPolarHBondContact O-CB 3.49Å; A257-L260 PolarHBondContact O-N 3.12Å; L258-L260 VanDerWaalsContact C-N 3.33Å; L258-L260 PolarHBondContact O-N 3.5Å; L260-G262 VanDerWaalsContact C-N 3.26Å; L260-G262 PolarHBondContact O-N 3.47Å
261Y97.9Very high96.9Very high87 Ų8757.2 Ų57.234%0.34129%0.29SS..THydrogen-bonded Turntrans-84.610.2175.5-78.8-84.9000113.8L226 E227 R232 A257 L258 L259L226-Y261 HydrophobicContact CB-CD1 4.05Å; L226-Y261 HydrophobicContact CB-CD2 4Å; L226-Y261 HydrophobicContact CB-CE1 4.08Å; L226-Y261 HydrophobicContact CB-CE2 4.03Å; L226-Y261 HydrophobicContact CB-CG 4.01Å; L226-Y261 HydrophobicContact CD1-CD2 3.86Å; L226-Y261 HydrophobicContact CD1-CE2 4.28Å; L226-Y261 HydrophobicContact CD1-CG 4.34Å; L226-Y261 HydrophobicContact CD2-CG 4.4Å; L226-Y261 HydrophobicContact CG-CD2 4.41Å; L226-Y261 HydrophobicContact CG-CG 4.49Å; E227-Y261 VanDerWaalsContact CG-OH 3.3Å; E227-Y261 WeakPolarHBondContact CG-OH 3.21Å; R232-Y261 VanDerWaalsContact CD-O 3.27Å; R232-Y261 WeakPolarHBondContact CD-O 3.29Å; A257-Y261 WeakPolarHBondContact O-CD2 3.32Å; A257-Y261 PolarHBondContact O-N 2.96Å; L258-Y261 CarbonylContact O-C 3.47Å; L258-Y261 PolarHBondContact O-N 3.17Å; L259-Y261 VanDerWaalsContact C-N 3.27Å; L259-Y261 PolarHBondContact O-N 2.98Å
262G97.4Very high96.6Very high45 Ų4556.5 Ų56.546%0.46429%0.29SS..THydrogen-bonded Turntrans83.830.3174.100000115.1N233 L258 L259 L260N233-G262 PolarHBondContact ND2-O 3.41Å; L258-G262 PolarHBondContact O-N 3.14Å; L259-G262 PolarHBondContact O-N 2.99Å; L259-G262 VanDerWaalsContact O-N 3.14Å; L260-G262 VanDerWaalsContact C-N 3.26Å; L260-G262 PolarHBondContact O-N 3.47Å
263A98.3Very high96.5Very high10 Ų1052.1 Ų52.18%0.08327%0.271CS..  trans-62.8138.816700000111.4R232 N233 L243 L258 L259 I265R232-A263 HydrophobicContact CG-CB 3.77Å; N233-A263 WeakPolarHBondContact OD1-CA 3.31Å; L243-A263 HydrophobicContact CB-CB 4.39Å; L243-A263 HydrophobicContact CD2-CB 4.4Å; L258-A263 HydrophobicContact CB-CB 3.86Å; L258-A263 WeakPolarHBondContact O-CB 3.43Å; L258-A263 PolarHBondContact O-N 3.04Å; L259-A263 HydrophobicContact CD2-CB 4.45Å; A263-I265 PolarHBondContact O-N 2.96Å
264D98.1Very high96.5Very high76 Ų7647.1 Ų47.141%0.40625%0.245SC..  trans-75.8110.4176.6-179.310.6000111.1N233 E266 S267N233-D264 PolarHBondContact OD1-N 3.03Å; D264-E266 PolarHBondContact O-N 3.22Å; D264-E266 PolarHBondContact OD1-N 3.19Å; D264-S267 PolarHBondContact O-N 3.4Å; D264-S267 PolarHBondContact O-OG 3.22Å; D264-S267 PolarHBondContact OD1-N 2.65Å; D264-S267 PolarHBondContact OD2-N 3.36Å
265I98.2Very high96.5Very high31 Ų3146.7 Ų46.716%0.15924%0.243CC..THydrogen-bonded Turntrans-69.1-18.6179.1-162.9169.6000113.1L259 A263 P275 L291 K294 A296L259-I265 HydrophobicContact CD1-CD1 4.24Å; L259-I265 HydrophobicContact CD2-CB 3.85Å; L259-I265 HydrophobicContact CD2-CD1 4.29Å; L259-I265 HydrophobicContact CD2-CG1 4.19Å; A263-I265 PolarHBondContact O-N 2.96Å; I265-P275 WeakPolarHBondContact O-CD 3.15Å; I265-P275 WeakPolarHBondContact O-CG 3.49Å; I265-L291 HydrophobicContact CD1-CD2 3.86Å; I265-L291 HydrophobicContact CG1-CD2 3.91Å; I265-K294 HydrophobicContact CD1-CB 3.81Å; I265-A296 HydrophobicContact CD1-CB 3.81Å; I265-A296 HydrophobicContact CG1-CB 4.08Å
266E97.9Very high96.5Very high56 Ų5646.7 Ų46.726%0.26224%0.243SC..THydrogen-bonded Turntrans-107.95.4-177.1-59.2-53.5143.900113.4D264 K268 A296 N297D264-E266 PolarHBondContact O-N 3.22Å; D264-E266 PolarHBondContact OD1-N 3.19Å; E266-K268 PolarHBondContact O-N 2.93Å; E266-A296 WeakPolarHBondContact OE1-CA 3.29Å; E266-N297 PolarHBondContact OE1-N 3Å; E266-N297 WeakPolarHBondContact OE2-CB 3.5Å
267S97Very high96.4Very high14 Ų1440.7 Ų40.710%0.09822%0.217CC..  trans-55.7132.517853.90000111.1T241 H244 D264 T274 P275T241-S267 PolarHBondContact OG1-OG 3.09Å; H244-S267 PolarHBondContact CE1-O 2.88Å; H244-S267 PolarHBondContact CE1-OG 2.79Å; H244-S267 PolarHBondContact NE2-O 3.06Å; D264-S267 PolarHBondContact O-N 3.4Å; D264-S267 PolarHBondContact O-OG 3.22Å; D264-S267 PolarHBondContact OD1-N 2.65Å; D264-S267 PolarHBondContact OD2-N 3.36Å; S267-T274 WeakPolarHBondContact O-CA 3.31Å; S267-P275 WeakPolarHBondContact O-CD 3.49Å
268K95.7Very high96.3Very high120 Ų12039.8 Ų39.852%0.52221%0.209SC..  trans-102.5131.8178.4-68.8-171.7178.9-163.50111.3E266 L273 T274 L301E266-K268 PolarHBondContact O-N 2.93Å; K268-L273 WeakPolarHBondContact CA-O 3.28Å; K268-T274 HydrophobicContact CG-CG2 3.83Å; K268-L301 PolarHBondContact NZ-O 2.78Å
269N94.8Very high96.2Very high9 Ų939.8 Ų39.85%0.04821%0.209CC..  trans-77.3178.1167.974.412.4000111.9G239 N240 C271 G272 L273G239-N269 WeakPolarHBondContact O-CA 3.2Å; N240-N269 VanDerWaalsContact OD1-CB 3.31Å; N240-N269 WeakPolarHBondContact OD1-CB 3.48Å; N240-N269 PolarHBondContact OD1-ND2 3.16Å; N269-C271 PolarHBondContact O-N 3Å; N269-C271 VanDerWaalsContact O-N 3.12Å; N269-C271 WeakPolarHBondContact OD1-CA 3.48Å; N269-C271 WeakPolarHBondContact OD1-CB 3.45Å; N269-C271 PolarHBondContact OD1-N 3.15Å; N269-G272 WeakPolarHBondContact O-CA 3.34Å; N269-G272 PolarHBondContact O-N 3.35Å; N269-G272 PolarHBondContact OD1-N 3.21Å; N269-L273 PolarHBondContact N-O 3.12Å; N269-L273 WeakPolarHBondContact OD1-CB 3.38Å; N269-L273 PolarHBondContact OD1-N 3.45Å
270K92.4Very high96.1Very high159 Ų15938.1 Ų38.169%0.69120%0.2SC*.THydrogen-bonded Turntrans-63.1-18.8-178.9-75-175.8173.8179.50114.3E237 Y238 G272E237-K270 WeakPolarHBondContact O-CD 3.45Å; E237-K270 WeakPolarHBondContact O-CE 3.42Å; E237-K270 PolarHBondContact O-NZ 3.36Å; Y238-K270 VanDerWaalsContact O-CB 3.27Å; Y238-K270 WeakPolarHBondContact O-CB 3.43Å; Y238-K270 WeakPolarHBondContact O-CG 2.99Å; Y238-K270 PolarHBondContact O-N 3.47Å; K270-G272 VanDerWaalsContact C-N 3.25Å
271C88.2Confident95.9Very high25 Ų2532.5 Ų32.517%0.16917%0.17CC..THydrogen-bonded Turntrans-86.82.9174.3-61.20000112.5Y123 N269 L273 R303Y123-C271 HydrophobicContact CD2-CB 3.77Å; Y123-C271 WeakPolarHBondContact CD2-SG 3.44Å; Y123-C271 HydrophobicContact CE2-CB 4.09Å; N269-C271 PolarHBondContact O-N 3Å; N269-C271 VanDerWaalsContact O-N 3.12Å; N269-C271 WeakPolarHBondContact OD1-CA 3.48Å; N269-C271 WeakPolarHBondContact OD1-CB 3.45Å; N269-C271 PolarHBondContact OD1-N 3.15Å; C271-L273 HydrophobicContact CB-CD1 4.41Å; C271-L273 HydrophobicContact CB-CG 4.11Å; C271-L273 PolarHBondContact O-N 3.4Å; C271-R303 WeakPolarHBondContact O-CB 3.43Å; C271-R303 WeakPolarHBondContact O-CG 3.29Å
272G91.4Very high95.7Very high15 Ų1530 Ų3016%0.15516%0.161CC..SBendtrans75.910.1-176.600000113.6N269 K270N269-G272 WeakPolarHBondContact O-CA 3.34Å; N269-G272 PolarHBondContact O-N 3.35Å; N269-G272 PolarHBondContact OD1-N 3.21Å; K270-G272 VanDerWaalsContact C-N 3.25Å
273L94.6Very high95.5Very high5 Ų532.6 Ų32.63%0.02616%0.161CC..  trans-83.7129.6179.9-54.3-179.1000109.6Y123 H244 K268 N269 C271 L277 L278 D302Y123-L273 HydrophobicContact CD2-CD1 3.73Å; Y123-L273 HydrophobicContact CE2-CD1 3.48Å; Y123-L273 VanDerWaalsContact CE2-CD1 3.48Å; H244-L273 PolarHBondContact NE2-O 3.35Å; K268-L273 WeakPolarHBondContact CA-O 3.28Å; N269-L273 PolarHBondContact N-O 3.12Å; N269-L273 WeakPolarHBondContact OD1-CB 3.38Å; N269-L273 PolarHBondContact OD1-N 3.45Å; C271-L273 HydrophobicContact CB-CD1 4.41Å; C271-L273 HydrophobicContact CB-CG 4.11Å; C271-L273 PolarHBondContact O-N 3.4Å; L273-L277 HydrophobicContact CB-CB 4.24Å; L273-L277 HydrophobicContact CD2-CB 3.96Å; L273-L278 HydrophobicContact CB-CB 4.48Å; L273-L278 HydrophobicContact CD1-CD1 4.29Å; L273-D302 HydrophobicContact CD2-CB 3.87Å
274T97.5Very high95.4Very high1 Ų134.5 Ų34.51%0.00617%0.168CC..  trans-80167.3162.361.80000110.2S267 K268 L276 L277 L278 V300S267-T274 WeakPolarHBondContact O-CA 3.31Å; K268-T274 HydrophobicContact CG-CG2 3.83Å; T274-L276 PolarHBondContact O-N 3.48Å; T274-L276 VanDerWaalsContact O-N 3.11Å; T274-L277 PolarHBondContact O-N 3.11Å; T274-L277 WeakPolarHBondContact OG1-CG 3.5Å; T274-L277 PolarHBondContact OG1-N 3.26Å; T274-L278 WeakPolarHBondContact O-CB 3.27Å; T274-L278 PolarHBondContact O-N 3.13Å; T274-V300 HydrophobicContact CG2-CB 4.37Å; T274-V300 HydrophobicContact CG2-CG1 3.71Å; T274-V300 HydrophobicContact CG2-CG2 4.4Å
275P97.8Very high95.2Very high0 Ų034.2 Ų34.20%016%0.164CC..Hα-helixtrans-48.3-37.6170-31.334.1000113.5L243 I247 I265 S267 G279 L291L243-P275 HydrophobicContact CB-CG 4.42Å; L243-P275 HydrophobicContact CD2-CB 4.03Å; L243-P275 HydrophobicContact CD2-CG 3.69Å; L243-P275 HydrophobicContact CG-CB 4.02Å; L243-P275 HydrophobicContact CG-CG 3.89Å; I247-P275 HydrophobicContact CG1-CB 4.06Å; I247-P275 WeakPolarHBondContact CG2-O 3.5Å; I265-P275 WeakPolarHBondContact O-CD 3.15Å; I265-P275 WeakPolarHBondContact O-CG 3.49Å; S267-P275 WeakPolarHBondContact O-CD 3.49Å; P275-G279 PolarHBondContact O-N 3.28Å; P275-L291 HydrophobicContact CB-CD1 4.12Å; P275-L291 WeakPolarHBondContact O-CD1 3.39Å
276L97.8Very high95.1Very high0 Ų037.5 Ų37.50%018%0.179CC..Hα-helixtrans-66.3-52.8175.9179.470.5000111.6T274 L278 G279 V280 V288 L291 I292 A296 L298T274-L276 PolarHBondContact O-N 3.48Å; T274-L276 VanDerWaalsContact O-N 3.11Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.91Å; L276-G279 PolarHBondContact O-N 2.93Å; L276-G279 VanDerWaalsContact O-N 3.13Å; L276-V280 WeakPolarHBondContact O-CG2 3.41Å; L276-V280 PolarHBondContact O-N 3.09Å; L276-V288 HydrophobicContact CD1-CG1 4.15Å; L276-L291 HydrophobicContact CB-CD1 4.22Å; L276-L291 HydrophobicContact CD1-CB 3.99Å; L276-L291 HydrophobicContact CD1-CD1 4.41Å; L276-I292 HydrophobicContact CD1-CG1 4.16Å; L276-A296 HydrophobicContact CB-CB 4.23Å; L276-A296 HydrophobicContact CD2-CB 4.25Å; L276-L298 HydrophobicContact CD2-CD2 3.56Å
277L96.6Very high95.1Very high1 Ų134.8 Ų34.81%0.00517%0.166CC..Hα-helixtrans-63.3-35.5-178.8-59.8177.7000111.5L273 T274 V280 H281 V300 D302 A308 L311L273-L277 HydrophobicContact CB-CB 4.24Å; L273-L277 HydrophobicContact CD2-CB 3.96Å; T274-L277 PolarHBondContact O-N 3.11Å; T274-L277 WeakPolarHBondContact OG1-CG 3.5Å; T274-L277 PolarHBondContact OG1-N 3.26Å; L277-V280 PolarHBondContact O-N 3.25Å; L277-H281 WeakPolarHBondContact O-CB 3.02Å; L277-H281 PolarHBondContact O-N 3.25Å; L277-V300 HydrophobicContact CD1-CB 4.35Å; L277-V300 HydrophobicContact CD1-CG1 4.04Å; L277-D302 HydrophobicContact CD1-CB 4.23Å; L277-A308 HydrophobicContact CD2-CB 3.82Å; L277-L311 HydrophobicContact CB-CD1 3.98Å; L277-L311 HydrophobicContact CD2-CD1 3.7Å; L277-L311 HydrophobicContact CG-CD1 4.25Å
278L96.2Very high95.1Very high0 Ų034.1 Ų34.10%016%0.161CC..Hα-helixtrans-61.6-48.4171.9178.861.4000111.4Y123 F128 H244 I247 L273 T274 L276 V280 H281 E282Y123-L278 HydrophobicContact CE1-CD1 4.14Å; Y123-L278 WeakPolarHBondContact OH-CD1 3.41Å; F128-L278 HydrophobicContact CZ-CD2 4.28Å; H244-L278 HydrophobicContact CB-CD2 3.82Å; H244-L278 WeakPolarHBondContact O-CD2 3.19Å; I247-L278 HydrophobicContact CG2-CG 4.48Å; L273-L278 HydrophobicContact CB-CB 4.48Å; L273-L278 HydrophobicContact CD1-CD1 4.29Å; T274-L278 WeakPolarHBondContact O-CB 3.27Å; T274-L278 PolarHBondContact O-N 3.13Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.91Å; L278-V280 PolarHBondContact O-N 2.92Å; L278-H281 PolarHBondContact O-N 3.26Å; L278-E282 HydrophobicContact CD1-CG 3.76Å; L278-E282 HydrophobicContact CG-CG 4.29Å; L278-E282 WeakPolarHBondContact O-CB 3.15Å; L278-E282 WeakPolarHBondContact O-CG 3.24Å; L278-E282 PolarHBondContact O-N 3.47Å
279G96.4Very high95.2Very high0 Ų032.8 Ų32.80%016%0.156CC..Hα-helixtrans-60.2-35.4177.300000112.7P275 L276 Q283 K284 V288P275-G279 PolarHBondContact O-N 3.28Å; L276-G279 PolarHBondContact O-N 2.93Å; L276-G279 VanDerWaalsContact O-N 3.13Å; G279-Q283 PolarHBondContact O-N 2.85Å; G279-K284 PolarHBondContact O-N 2.96Å; G279-V288 WeakPolarHBondContact O-CG2 3.49Å
280V96Very high95.3Very high0 Ų033.2 Ų33.20%016%0.157CC..Hα-helixtrans-67.4-48.8173.81730000111L276 L277 L278 E282 Q283 V288 A308 L311 A312 I320L276-V280 WeakPolarHBondContact O-CG2 3.41Å; L276-V280 PolarHBondContact O-N 3.09Å; L277-V280 PolarHBondContact O-N 3.25Å; L278-V280 PolarHBondContact O-N 2.92Å; V280-E282 PolarHBondContact O-N 3.43Å; V280-Q283 PolarHBondContact O-N 2.96Å; V280-V288 HydrophobicContact CG2-CG1 4.24Å; V280-V288 HydrophobicContact CG2-CG2 4.05Å; V280-A308 HydrophobicContact CG2-CB 4.49Å; V280-L311 HydrophobicContact CG1-CB 3.85Å; V280-A312 HydrophobicContact CG1-CB 3.7Å; V280-I320 HydrophobicContact CG1-CG2 4.21Å; V280-I320 HydrophobicContact CG2-CG2 3.99Å
281H93.6Very high95.6Very high29 Ų2925.6 Ų25.613%0.13412%0.124CC..Hα-helixtrans-58.3-47179.8-177.6-93.4000112.2Y123 L277 L278 Q283Y123-H281 AromaticContact CD1-CE1 3.56Å; Y123-H281 AromaticContact CD1-ND1 3.89Å; Y123-H281 AromaticContact CG-CE1 3.98Å; L277-H281 WeakPolarHBondContact O-CB 3.02Å; L277-H281 PolarHBondContact O-N 3.25Å; L278-H281 PolarHBondContact O-N 3.26Å; H281-Q283 PolarHBondContact O-N 3.31Å
282E93.3Very high96Very high34 Ų3425.2 Ų25.216%0.15912%0.12CC..THydrogen-bonded Turntrans-79.32.1177.8-59.6-52131.800113.5Y123 H125 Y248 L278 V280 K284Y123-E282 WeakPolarHBondContact CE1-OE1 3.41Å; H125-E282 IonicContact CE1-OE1 3.23Å; H125-E282 PolarHBondContact CE1-OE1 3.09Å; H125-E282 IonicContact CE1-OE2 3.7Å; H125-E282 PolarHBondContact CE1-OE2 2.92Å; H125-E282 IonicContact ND1-OE1 3.55Å; H125-E282 IonicContact ND1-OE2 3.97Å; Y248-E282 HydrophobicContact CD2-CG 3.87Å; Y248-E282 HydrophobicContact CE2-CG 4.23Å; Y248-E282 WeakPolarHBondContact CE2-OE2 3.44Å; L278-E282 HydrophobicContact CD1-CG 3.76Å; L278-E282 HydrophobicContact CG-CG 4.29Å; L278-E282 WeakPolarHBondContact O-CB 3.15Å; L278-E282 WeakPolarHBondContact O-CG 3.24Å; L278-E282 PolarHBondContact O-N 3.47Å; V280-E282 PolarHBondContact O-N 3.43Å; E282-K284 VanDerWaalsContact C-N 3.28Å; E282-K284 HydrophobicContact CB-CD 4.27Å; E282-K284 HydrophobicContact CB-CG 3.65Å; E282-K284 WeakPolarHBondContact O-CD 3.38Å; E282-K284 PolarHBondContact O-N 3.37Å
283Q94.9Very high96.3Very high99 Ų9931.9 Ų31.946%0.46315%0.145SC..THydrogen-bonded Turntrans57.833.5179.3-53.2-18049.200114.5G279 V280 H281 Q285 C315 I320G279-Q283 PolarHBondContact O-N 2.85Å; V280-Q283 PolarHBondContact O-N 2.96Å; H281-Q283 PolarHBondContact O-N 3.31Å; Q283-Q285 PolarHBondContact O-N 2.85Å; Q283-Q285 VanDerWaalsContact O-N 3.07Å; Q283-C315 HydrophobicContact CG-CB 4.03Å; Q283-C315 PolarHBondContact NE2-O 3.25Å; Q283-I320 HydrophobicContact CB-CD1 4.43Å
284K94.8Very high96.4Very high50 Ų5036.9 Ų36.922%0.21717%0.166CC..  trans-85.975.2-176.1-54.1-55.6-166.2168.80111.7Y248 E250 G279 E282 Q286 V287 V288Y248-K284 VanDerWaalsContact O-CE 3.28Å; Y248-K284 WeakPolarHBondContact O-CE 3.44Å; E250-K284 HydrophobicContact CB-CD 4.04Å; E250-K284 HydrophobicContact CG-CB 4.18Å; E250-K284 HydrophobicContact CG-CD 4.2Å; E250-K284 IonicContact OE2-NZ 2.84Å; G279-K284 PolarHBondContact O-N 2.96Å; E282-K284 VanDerWaalsContact C-N 3.28Å; E282-K284 HydrophobicContact CB-CD 4.27Å; E282-K284 HydrophobicContact CB-CG 3.65Å; E282-K284 WeakPolarHBondContact O-CD 3.38Å; E282-K284 PolarHBondContact O-N 3.37Å; K284-Q286 VanDerWaalsContact C-N 3.29Å; K284-Q286 PolarHBondContact O-N 2.65Å; K284-Q286 VanDerWaalsContact O-N 3.16Å; K284-V287 HydrophobicContact CB-CG2 3.34Å; K284-V287 HydrophobicContact CG-CG2 4.41Å; K284-V287 WeakPolarHBondContact O-CG2 3.43Å; K284-V287 PolarHBondContact O-N 3.39Å; K284-V288 WeakPolarHBondContact O-CG2 3.14Å; K284-V288 PolarHBondContact O-N 3.49Å
285Q95.1Very high96.3Very high70 Ų7046 Ų4633%0.32721%0.206SC..Hα-helixtrans-52.7-41.5-171.1-171.7-174.2-2.300113.9Q283 V288 K289 I320 L323Q283-Q285 PolarHBondContact O-N 2.85Å; Q283-Q285 VanDerWaalsContact O-N 3.07Å; Q285-V288 PolarHBondContact O-N 2.98Å; Q285-K289 WeakPolarHBondContact O-CB 3.48Å; Q285-K289 PolarHBondContact O-N 2.92Å; Q285-I320 HydrophobicContact CB-CG1 4.39Å; Q285-I320 HydrophobicContact CG-CG1 4.47Å; Q285-L323 HydrophobicContact CG-CD1 3.67Å
286Q96Very high96.2Very high100 Ų10046.2 Ų46.247%0.46721%0.208SC..Hα-helixtrans-66.9-41.3-174.7-65.9-56.7-35.600112.8K284 F290K284-Q286 VanDerWaalsContact C-N 3.29Å; K284-Q286 PolarHBondContact O-N 2.65Å; K284-Q286 VanDerWaalsContact O-N 3.16Å; Q286-F290 WeakPolarHBondContact O-CB 3.28Å; Q286-F290 PolarHBondContact O-N 2.9Å; Q286-F290 VanDerWaalsContact O-N 3.14Å
287V97Very high96Very high0 Ų049.8 Ų49.80%023%0.227CC..Hα-helixtrans-78.9-33.2178.8-64.50000111.7I247 E250 K252 K284 F290 L291I247-V287 HydrophobicContact CD1-CB 3.72Å; I247-V287 HydrophobicContact CD1-CG1 4.29Å; I247-V287 HydrophobicContact CD1-CG2 4.12Å; I247-V287 HydrophobicContact CG2-CG2 3.86Å; E250-V287 HydrophobicContact CG-CG1 4.38Å; K252-V287 HydrophobicContact CB-CG1 4.12Å; K284-V287 HydrophobicContact CB-CG2 3.34Å; K284-V287 HydrophobicContact CG-CG2 4.41Å; K284-V287 WeakPolarHBondContact O-CG2 3.43Å; K284-V287 PolarHBondContact O-N 3.39Å; V287-F290 WeakPolarHBondContact O-CB 3.47Å; V287-F290 PolarHBondContact O-N 3.38Å; V287-F290 VanDerWaalsContact O-N 3.15Å; V287-L291 WeakPolarHBondContact O-CG 3.46Å; V287-L291 PolarHBondContact O-N 3.41Å
288V97.6Very high95.8Very high0 Ų051.2 Ų51.20%023%0.234CC..Hα-helixtrans-58.8-51.1170.2171.10000110.4L276 G279 V280 K284 Q285 F290 L291 I292 I320L276-V288 HydrophobicContact CD1-CG1 4.15Å; G279-V288 WeakPolarHBondContact O-CG2 3.49Å; V280-V288 HydrophobicContact CG2-CG1 4.24Å; V280-V288 HydrophobicContact CG2-CG2 4.05Å; K284-V288 WeakPolarHBondContact O-CG2 3.14Å; K284-V288 PolarHBondContact O-N 3.49Å; Q285-V288 PolarHBondContact O-N 2.98Å; V288-F290 PolarHBondContact O-N 3.5Å; V288-L291 PolarHBondContact O-N 3.29Å; V288-L291 VanDerWaalsContact O-N 3.13Å; V288-I292 HydrophobicContact CG1-CD1 3.92Å; V288-I292 HydrophobicContact CG1-CG1 4.43Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.24Å; V288-I320 HydrophobicContact CG1-CG2 4.21Å; V288-I320 HydrophobicContact CG2-CD1 4.34Å
289K97.4Very high95.5Very high92 Ų9256.9 Ų56.940%0.427%0.265SS..Hα-helixtrans-57.9-35.6176-173171.1-172.5165.80112.2Q285 K293 L323Q285-K289 WeakPolarHBondContact O-CB 3.48Å; Q285-K289 PolarHBondContact O-N 2.92Å; K289-K293 WeakPolarHBondContact O-CG 3.49Å; K289-K293 PolarHBondContact O-N 2.8Å; K289-L323 HydrophobicContact CB-CD1 4.11Å; K289-L323 HydrophobicContact CD-CD2 4.04Å; K289-L323 HydrophobicContact CG-CD2 4.22Å
290F97.9Very high95.3Very high17 Ų1757.5 Ų57.58%0.07527%0.268CS..Hα-helixtrans-68.8-44.9176170-106.7000112.6K252 A255 K256 L259 Q286 V287 V288 K293 K294K252-F290 HydrophobicContact CD-CB 4.19Å; K252-F290 HydrophobicContact CD-CG 4.45Å; K252-F290 HydrophobicContact CG-CB 4.05Å; K252-F290 HydrophobicContact CG-CD1 4.37Å; K252-F290 HydrophobicContact CG-CD2 4.14Å; K252-F290 HydrophobicContact CG-CG 3.92Å; A255-F290 HydrophobicContact CB-CD1 4.29Å; A255-F290 HydrophobicContact CB-CE1 3.94Å; K256-F290 HydrophobicContact CB-CE1 4.49Å; K256-F290 HydrophobicContact CB-CE2 4.2Å; K256-F290 HydrophobicContact CB-CZ 3.73Å; K256-F290 HydrophobicContact CG-CE2 4.43Å; K256-F290 HydrophobicContact CG-CZ 4.23Å; L259-F290 HydrophobicContact CD1-CE1 3.75Å; L259-F290 HydrophobicContact CD1-CZ 3.96Å; Q286-F290 WeakPolarHBondContact O-CB 3.28Å; Q286-F290 PolarHBondContact O-N 2.9Å; Q286-F290 VanDerWaalsContact O-N 3.14Å; V287-F290 WeakPolarHBondContact O-CB 3.47Å; V287-F290 PolarHBondContact O-N 3.38Å; V287-F290 VanDerWaalsContact O-N 3.15Å; V288-F290 PolarHBondContact O-N 3.5Å; F290-K293 WeakPolarHBondContact O-CB 3.41Å; F290-K293 PolarHBondContact O-N 3.35Å; F290-K294 HydrophobicContact CD2-CG 4.4Å; F290-K294 HydrophobicContact CE1-CG 4.22Å; F290-K294 HydrophobicContact CE2-CD 4.41Å; F290-K294 HydrophobicContact CE2-CG 3.9Å; F290-K294 HydrophobicContact CZ-CD 4.41Å; F290-K294 HydrophobicContact CZ-CG 3.79Å; F290-K294 WeakPolarHBondContact O-CG 3.46Å; F290-K294 PolarHBondContact O-N 3.23Å
291L97.8Very high95.1Very high0 Ų061.2 Ų61.20%029%0.288CS..Hα-helixtrans-64.6-40.8178.6-70.7174.8000112I247 I265 P275 L276 V287 V288 K293 K294 K295 A296I247-L291 HydrophobicContact CD1-CD1 3.66Å; I247-L291 HydrophobicContact CD1-CD2 4.2Å; I247-L291 HydrophobicContact CD1-CG 4.02Å; I247-L291 HydrophobicContact CG1-CD1 4.15Å; I265-L291 HydrophobicContact CD1-CD2 3.86Å; I265-L291 HydrophobicContact CG1-CD2 3.91Å; P275-L291 HydrophobicContact CB-CD1 4.12Å; P275-L291 WeakPolarHBondContact O-CD1 3.39Å; L276-L291 HydrophobicContact CB-CD1 4.22Å; L276-L291 HydrophobicContact CD1-CB 3.99Å; L276-L291 HydrophobicContact CD1-CD1 4.41Å; V287-L291 WeakPolarHBondContact O-CG 3.46Å; V287-L291 PolarHBondContact O-N 3.41Å; V288-L291 PolarHBondContact O-N 3.29Å; V288-L291 VanDerWaalsContact O-N 3.13Å; L291-K293 VanDerWaalsContact C-N 3.33Å; L291-K293 PolarHBondContact O-N 3.22Å; L291-K294 CarbonylContact O-C 3.38Å; L291-K294 WeakPolarHBondContact O-CA 3.48Å; L291-K294 WeakPolarHBondContact O-CB 3.32Å; L291-K294 PolarHBondContact O-N 3.39Å; L291-K295 PolarHBondContact O-N 2.99Å; L291-A296 HydrophobicContact CB-CB 4.1Å; L291-A296 WeakPolarHBondContact O-CB 3.49Å; L291-A296 PolarHBondContact O-N 3.33Å; L291-A296 VanDerWaalsContact O-N 3.1Å
292I96.6Very high94.9Very high17 Ų1760.4 Ų60.49%0.08728%0.284CS..Hα-helixtrans-57-47.4172.4-66.2174.3000110.4L276 V288 K294 K295 L298 L323 L324 Q327L276-I292 HydrophobicContact CD1-CG1 4.16Å; V288-I292 HydrophobicContact CG1-CD1 3.92Å; V288-I292 HydrophobicContact CG1-CG1 4.43Å; V288-I292 WeakPolarHBondContact O-CG1 3.39Å; V288-I292 PolarHBondContact O-N 3.24Å; I292-K294 PolarHBondContact O-N 3.13Å; I292-K295 WeakPolarHBondContact O-CA 3.47Å; I292-K295 PolarHBondContact O-N 2.97Å; I292-L298 HydrophobicContact CG1-CD2 4.09Å; I292-L323 HydrophobicContact CD1-CB 4.47Å; I292-L324 HydrophobicContact CD1-CD2 3.99Å; I292-Q327 VanDerWaalsContact CG2-CD 3.46Å; I292-Q327 HydrophobicContact CG2-CG 3.6Å
293K97Very high94.8Very high155 Ų15564.4 Ų64.467%0.67430%0.298SS*.Hα-helixtrans-62.1-25.5175.3-74.8-179.5177.1-165.70113.5K289 F290 L291K289-K293 WeakPolarHBondContact O-CG 3.49Å; K289-K293 PolarHBondContact O-N 2.8Å; F290-K293 WeakPolarHBondContact O-CB 3.41Å; F290-K293 PolarHBondContact O-N 3.35Å; L291-K293 VanDerWaalsContact C-N 3.33Å; L291-K293 PolarHBondContact O-N 3.22Å
294K97.1Very high94.5Very high109 Ų10963.1 Ų63.147%0.47429%0.289SS..THydrogen-bonded Turntrans-86.39.3174.1-69.7-63.4-173.4177.30113.4L259 I265 F290 L291 I292 A296L259-K294 HydrophobicContact CD1-CB 4.34Å; L259-K294 HydrophobicContact CD1-CG 3.97Å; I265-K294 HydrophobicContact CD1-CB 3.81Å; F290-K294 HydrophobicContact CD2-CG 4.4Å; F290-K294 HydrophobicContact CE1-CG 4.22Å; F290-K294 HydrophobicContact CE2-CD 4.41Å; F290-K294 HydrophobicContact CE2-CG 3.9Å; F290-K294 HydrophobicContact CZ-CD 4.41Å; F290-K294 HydrophobicContact CZ-CG 3.79Å; F290-K294 WeakPolarHBondContact O-CG 3.46Å; F290-K294 PolarHBondContact O-N 3.23Å; L291-K294 CarbonylContact O-C 3.38Å; L291-K294 WeakPolarHBondContact O-CA 3.48Å; L291-K294 WeakPolarHBondContact O-CB 3.32Å; L291-K294 PolarHBondContact O-N 3.39Å; I292-K294 PolarHBondContact O-N 3.13Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.9Å
295K94.9Very high94.3Very high192 Ų19261.1 Ų61.184%0.83528%0.283SS*.THydrogen-bonded Turntrans60.235.7178.8-55.7-176.2174.8-174.80112.9L291 I292L291-K295 PolarHBondContact O-N 2.99Å; I292-K295 WeakPolarHBondContact O-CA 3.47Å; I292-K295 PolarHBondContact O-N 2.97Å
296A95.9Very high94.1Very high5 Ų559.2 Ų59.24%0.04127%0.273CS..  trans-55.7141.1166.800000109.8I265 E266 L276 L291 K294 L298I265-A296 HydrophobicContact CD1-CB 3.81Å; I265-A296 HydrophobicContact CG1-CB 4.08Å; E266-A296 WeakPolarHBondContact OE1-CA 3.29Å; L276-A296 HydrophobicContact CB-CB 4.23Å; L276-A296 HydrophobicContact CD2-CB 4.25Å; L291-A296 HydrophobicContact CB-CB 4.1Å; L291-A296 WeakPolarHBondContact O-CB 3.49Å; L291-A296 PolarHBondContact O-N 3.33Å; L291-A296 VanDerWaalsContact O-N 3.1Å; K294-A296 VanDerWaalsContact C-N 3.29Å; K294-A296 PolarHBondContact O-N 2.9Å; A296-L298 PolarHBondContact O-N 3.29Å
297N94.6Very high94Very high75 Ų7555.1 Ų55.140%0.40126%0.255SS..  trans-68.7119-176.1-177.95.7000110.9E266 N299 V300E266-N297 PolarHBondContact OE1-N 3Å; E266-N297 WeakPolarHBondContact OE2-CB 3.5Å; N297-N299 WeakPolarHBondContact OD1-CB 3.43Å; N297-N299 PolarHBondContact OD1-N 2.76Å; N297-V300 HydrophobicContact CB-CG2 3.62Å; N297-V300 WeakPolarHBondContact ND2-CG2 3.16Å; N297-V300 WeakPolarHBondContact O-CG2 3.32Å
298L92.8Very high93.9Very high31 Ų3155.2 Ų55.216%0.16226%0.256CS..THydrogen-bonded Turntrans-81.1-19.3-179.7-57.3-177000113.1L276 I292 A296 V300 L324 Q327 V329L276-L298 HydrophobicContact CD2-CD2 3.56Å; I292-L298 HydrophobicContact CG1-CD2 4.09Å; A296-L298 PolarHBondContact O-N 3.29Å; L298-V300 PolarHBondContact O-N 3.34Å; L298-L324 HydrophobicContact CD2-CD2 4.14Å; L298-Q327 HydrophobicContact CD1-CB 3.45Å; L298-Q327 VanDerWaalsContact CD1-CB 3.45Å; L298-Q327 HydrophobicContact CD1-CG 3.91Å; L298-V329 HydrophobicContact CB-CG1 4.22Å; L298-V329 HydrophobicContact CD1-CG1 3.75Å
299N89.7Confident93.8Very high120 Ų12055.5 Ų55.564%0.64226%0.257SS*.THydrogen-bonded Turntrans-888.7-176.7-61.4-26000112.4N297N297-N299 WeakPolarHBondContact OD1-CB 3.43Å; N297-N299 PolarHBondContact OD1-N 2.76Å
300V91.6Very high93.6Very high13 Ų1351.1 Ų51.18%0.07924%0.238CC..  trans-73.4136.8178.5-172.10000109.8T274 L277 N297 L298T274-V300 HydrophobicContact CG2-CB 4.37Å; T274-V300 HydrophobicContact CG2-CG1 3.71Å; T274-V300 HydrophobicContact CG2-CG2 4.4Å; L277-V300 HydrophobicContact CD1-CB 4.35Å; L277-V300 HydrophobicContact CD1-CG1 4.04Å; N297-V300 HydrophobicContact CB-CG2 3.62Å; N297-V300 WeakPolarHBondContact ND2-CG2 3.16Å; N297-V300 WeakPolarHBondContact O-CG2 3.32Å; L298-V300 PolarHBondContact O-N 3.34Å
301L92.1Very high93.4Very high78 Ų7850.3 Ų50.341%0.40824%0.235SC..  trans-102.8140.8176.4-50.5-178.8000110.6K268 R306 T307K268-L301 PolarHBondContact NZ-O 2.78Å; L301-R306 WeakPolarHBondContact CA-O 3.45Å; L301-T307 HydrophobicContact CD2-CG2 3.66Å
302D89.6Confident93.2Very high11 Ų1150.3 Ų50.36%0.05924%0.235CC..  trans-75.2-176.6167.980.8-10.8000111.8L273 L277 Y304 G305 R306 L311L273-D302 HydrophobicContact CD2-CB 3.87Å; L277-D302 HydrophobicContact CD1-CB 4.23Å; D302-Y304 PolarHBondContact O-N 2.89Å; D302-Y304 VanDerWaalsContact O-N 3.09Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.47Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.41Å; D302-Y304 PolarHBondContact OD1-N 3.17Å; D302-G305 PolarHBondContact O-N 3.26Å; D302-G305 PolarHBondContact OD1-N 3.07Å; D302-G305 VanDerWaalsContact OD1-N 3.16Å; D302-R306 PolarHBondContact N-O 3.04Å; D302-R306 VanDerWaalsContact N-O 3.15Å; D302-R306 WeakPolarHBondContact OD1-CB 3.41Å; D302-R306 PolarHBondContact OD1-N 3.35Å; D302-R306 IonicContact OD1-NE 3.68Å; D302-R306 IonicContact OD2-CZ 3.29Å; D302-R306 IonicContact OD2-NE 2.95Å; D302-R306 PolarHBondContact OD2-NE 3.01Å; D302-R306 IonicContact OD2-NH2 2.82Å; D302-R306 PolarHBondContact OD2-NH2 2.85Å; D302-L311 HydrophobicContact CB-CD1 4.38Å
303R89.9Confident93.1Very high118 Ų11849.5 Ų49.545%0.44523%0.231SC..THydrogen-bonded Turntrans-62.1-14.4178.768.8178.9-76.3-153.5-3.7114.9D122 C271D122-R303 IonicContact OD2-CZ 3.21Å; D122-R303 IonicContact OD2-NH1 2.73Å; D122-R303 PolarHBondContact OD2-NH1 3.25Å; D122-R303 IonicContact OD2-NH2 3.74Å; C271-R303 WeakPolarHBondContact O-CB 3.43Å; C271-R303 WeakPolarHBondContact O-CG 3.29Å
304Y89Confident92.8Very high72 Ų7242.4 Ų42.428%0.28220%0.201SC..THydrogen-bonded Turntrans-103.37.6178.6-58.3-73.2000112.1G121 D302 R306 L336G121-Y304 PolarHBondContact O-OH 3.32Å; D302-Y304 PolarHBondContact O-N 2.89Å; D302-Y304 VanDerWaalsContact O-N 3.09Å; D302-Y304 WeakPolarHBondContact OD1-CA 3.47Å; D302-Y304 WeakPolarHBondContact OD1-CB 3.41Å; D302-Y304 PolarHBondContact OD1-N 3.17Å; Y304-R306 PolarHBondContact O-N 2.93Å; Y304-L336 WeakPolarHBondContact O-CB 3.49Å; Y304-L336 VanDerWaalsContact O-CG 3.28Å; Y304-L336 WeakPolarHBondContact O-CG 3.25Å; Y304-L336 PolarHBondContact O-N 2.92Å; Y304-L336 VanDerWaalsContact O-N 3.09Å
305G90.6Very high92.4Very high9 Ų938.2 Ų38.29%0.09318%0.184CC..  trans73.414.1-176.500000113.6D302D302-G305 PolarHBondContact O-N 3.26Å; D302-G305 PolarHBondContact OD1-N 3.07Å; D302-G305 VanDerWaalsContact OD1-N 3.16Å
306R91.6Very high92.2Very high29 Ų2930.3 Ų30.311%0.10916%0.157CC..  trans-83132.4-177.3-60.2178.9-62.7177.61.7110.1L301 D302 Y304 I310 L311 D335L301-R306 WeakPolarHBondContact CA-O 3.45Å; D302-R306 PolarHBondContact N-O 3.04Å; D302-R306 VanDerWaalsContact N-O 3.15Å; D302-R306 WeakPolarHBondContact OD1-CB 3.41Å; D302-R306 PolarHBondContact OD1-N 3.35Å; D302-R306 IonicContact OD1-NE 3.68Å; D302-R306 IonicContact OD2-CZ 3.29Å; D302-R306 IonicContact OD2-NE 2.95Å; D302-R306 PolarHBondContact OD2-NE 3.01Å; D302-R306 IonicContact OD2-NH2 2.82Å; D302-R306 PolarHBondContact OD2-NH2 2.85Å; Y304-R306 PolarHBondContact O-N 2.93Å; R306-I310 HydrophobicContact CB-CB 4.14Å; R306-I310 HydrophobicContact CB-CG2 3.94Å; R306-I310 HydrophobicContact CG-CG2 3.86Å; R306-L311 HydrophobicContact CB-CD2 4.04Å; R306-L311 HydrophobicContact CB-CG 3.99Å; R306-L311 VanDerWaalsContact NE-CD2 3.31Å; R306-L311 VanDerWaalsContact NH2-CD2 3.28Å; R306-D335 HydrophobicContact CG-CB 3.71Å
307T93.8Very high92.1Very high15 Ų1530.7 Ų30.79%0.09216%0.16CC..  trans-72166.1169.565.20000110.9L301 L309 I310 L311L301-T307 HydrophobicContact CD2-CG2 3.66Å; T307-L309 PolarHBondContact O-N 3.34Å; T307-L309 PolarHBondContact OG1-N 2.84Å; T307-I310 PolarHBondContact O-N 3.42Å; T307-I310 WeakPolarHBondContact OG1-CG1 3.04Å; T307-I310 PolarHBondContact OG1-N 3.49Å; T307-L311 WeakPolarHBondContact O-CG 3.34Å; T307-L311 PolarHBondContact O-N 3.24Å
308A94.7Very high92Very high2 Ų228.5 Ų28.52%0.01715%0.152CC..Hα-helixtrans-54.6-34.717200000112.6L277 V280 A312 L324L277-A308 HydrophobicContact CD2-CB 3.82Å; V280-A308 HydrophobicContact CG2-CB 4.49Å; A308-A312 WeakPolarHBondContact O-CB 3.43Å; A308-A312 PolarHBondContact O-N 3.22Å; A308-L324 HydrophobicContact CB-CD1 4.02Å; A308-L324 HydrophobicContact CB-CD2 4.15Å; A308-L324 WeakPolarHBondContact O-CD1 3.39Å
309L95.4Very high92.2Very high5 Ų529.9 Ų29.93%0.02617%0.165CC..Hα-helixtrans-68.4-50177.9-178.967.2000111.5T307 L311 A312 V313 V321 L324 L325 V329 V331 A341 L357T307-L309 PolarHBondContact O-N 3.34Å; T307-L309 PolarHBondContact OG1-N 2.84Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.29Å; L309-A312 PolarHBondContact O-N 2.95Å; L309-V313 WeakPolarHBondContact O-CG2 3.13Å; L309-V313 PolarHBondContact O-N 3.38Å; L309-V321 HydrophobicContact CD1-CG1 4.07Å; L309-L324 HydrophobicContact CD1-CB 4.41Å; L309-L325 HydrophobicContact CD1-CD2 4.2Å; L309-L325 HydrophobicContact CD1-CG 4.43Å; L309-L325 HydrophobicContact CD2-CD2 4.39Å; L309-V329 HydrophobicContact CB-CG2 4.47Å; L309-V329 HydrophobicContact CD2-CG2 4.15Å; L309-V331 HydrophobicContact CD2-CB 4.16Å; L309-V331 HydrophobicContact CD2-CG1 3.78Å; L309-A341 HydrophobicContact CD2-CB 3.97Å; L309-A341 HydrophobicContact CG-CB 3.95Å; L309-L357 HydrophobicContact CD2-CD2 4.42Å
310I93.6Very high92.5Very high1 Ų124.2 Ų24.21%0.00513%0.134CC..Hα-helixtrans-57.8-46.2178.1-65.1171.3000109.6R306 T307 A312 V313 C314 D335 A341 Y344R306-I310 HydrophobicContact CB-CB 4.14Å; R306-I310 HydrophobicContact CB-CG2 3.94Å; R306-I310 HydrophobicContact CG-CG2 3.86Å; T307-I310 PolarHBondContact O-N 3.42Å; T307-I310 WeakPolarHBondContact OG1-CG1 3.04Å; T307-I310 PolarHBondContact OG1-N 3.49Å; I310-A312 PolarHBondContact O-N 3.14Å; I310-V313 PolarHBondContact O-N 3.11Å; I310-C314 PolarHBondContact O-N 3.42Å; I310-C314 PolarHBondContact O-SG 3.4Å; I310-D335 HydrophobicContact CD1-CB 4.23Å; I310-A341 HydrophobicContact CG1-CB 4.04Å; I310-Y344 HydrophobicContact CG2-CD2 3.7Å; I310-Y344 HydrophobicContact CG2-CE2 3.78Å
311L92.9Very high92.7Very high0 Ų023.6 Ų23.60%013%0.13CC..Hα-helixtrans-57-47.4175.5-73.1178.5000112.9L277 V280 D302 R306 T307 L309 V313 C314 C315L277-L311 HydrophobicContact CB-CD1 3.98Å; L277-L311 HydrophobicContact CD2-CD1 3.7Å; L277-L311 HydrophobicContact CG-CD1 4.25Å; V280-L311 HydrophobicContact CG1-CB 3.85Å; D302-L311 HydrophobicContact CB-CD1 4.38Å; R306-L311 HydrophobicContact CB-CD2 4.04Å; R306-L311 HydrophobicContact CB-CG 3.99Å; R306-L311 VanDerWaalsContact NE-CD2 3.31Å; R306-L311 VanDerWaalsContact NH2-CD2 3.28Å; T307-L311 WeakPolarHBondContact O-CG 3.34Å; T307-L311 PolarHBondContact O-N 3.24Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.29Å; L311-V313 VanDerWaalsContact C-N 3.26Å; L311-V313 PolarHBondContact O-N 2.82Å; L311-C314 PolarHBondContact O-N 2.85Å; L311-C315 WeakPolarHBondContact O-CB 3.44Å; L311-C315 PolarHBondContact O-N 3.49Å; L311-C315 PolarHBondContact O-SG 2.99Å
312A94.5Very high92.8Very high0 Ų023.1 Ų23.10%013%0.128CC..Hα-helixtrans-60.9-37.1179.900000112.2V280 A308 L309 I310 G316 S317 I320 V321 L324V280-A312 HydrophobicContact CG1-CB 3.7Å; A308-A312 WeakPolarHBondContact O-CB 3.43Å; A308-A312 PolarHBondContact O-N 3.22Å; L309-A312 PolarHBondContact O-N 2.95Å; I310-A312 PolarHBondContact O-N 3.14Å; A312-G316 PolarHBondContact O-N 2.63Å; A312-S317 PolarHBondContact O-N 3.01Å; A312-I320 HydrophobicContact CB-CB 4.3Å; A312-I320 HydrophobicContact CB-CG2 3.74Å; A312-V321 HydrophobicContact CB-CG2 3.79Å; A312-L324 HydrophobicContact CB-CD1 3.95Å
313V94.2Very high93.1Very high0 Ų023.2 Ų23.20%013%0.129CC..Hα-helixtrans-68.3-47.4174.7175.20000111.5L309 I310 L311 C315 G316 V321 A341 A345 H350 I353L309-V313 WeakPolarHBondContact O-CG2 3.13Å; L309-V313 PolarHBondContact O-N 3.38Å; I310-V313 PolarHBondContact O-N 3.11Å; L311-V313 VanDerWaalsContact C-N 3.26Å; L311-V313 PolarHBondContact O-N 2.82Å; V313-C315 PolarHBondContact O-N 2.97Å; V313-G316 WeakPolarHBondContact O-CA 3.18Å; V313-G316 PolarHBondContact O-N 2.94Å; V313-V321 HydrophobicContact CG2-CG2 3.81Å; V313-A341 WeakPolarHBondContact CG1-O 3.44Å; V313-A341 HydrophobicContact CG2-CB 4.04Å; V313-A345 HydrophobicContact CG1-CB 3.67Å; V313-H350 PolarHBondContact O-CD2 3.5Å; V313-I353 HydrophobicContact CB-CG2 4.37Å; V313-I353 HydrophobicContact CG1-CG2 4.05Å; V313-I353 HydrophobicContact CG2-CG2 3.67Å
314C90.7Very high93.3Very high6 Ų617.6 Ų17.64%0.04111%0.108CC..Hα-helixtrans-58.4-38177.9-62.40000111.2W120 I310 L311 G316W120-C314 HydrophobicContact CH2-CB 3.36Å; W120-C314 HydrophobicContact CZ2-CB 3.81Å; W120-C314 VanDerWaalsContact CZ2-O 3.27Å; W120-C314 WeakPolarHBondContact CZ2-O 3.43Å; W120-C314 HydrophobicContact CZ3-CB 4.3Å; I310-C314 PolarHBondContact O-N 3.42Å; I310-C314 PolarHBondContact O-SG 3.4Å; L311-C314 PolarHBondContact O-N 2.85Å; C314-G316 PolarHBondContact O-N 3.28Å
315C89.1Confident93.5Very high20 Ų2014.5 Ų14.514%0.13510%0.096CC..THydrogen-bonded Turntrans-75.6-8.7176-64.10000113.7Q283 L311 V313Q283-C315 HydrophobicContact CG-CB 4.03Å; Q283-C315 PolarHBondContact NE2-O 3.25Å; L311-C315 WeakPolarHBondContact O-CB 3.44Å; L311-C315 PolarHBondContact O-N 3.49Å; L311-C315 PolarHBondContact O-SG 2.99Å; V313-C315 PolarHBondContact O-N 2.97Å
316G90.5Very high93.6Very high26 Ų2619.5 Ų19.527%0.26812%0.117SC..THydrogen-bonded Turntrans73.919.9178.900000114.9A312 V313 C314 A318A312-G316 PolarHBondContact O-N 2.63Å; V313-G316 WeakPolarHBondContact O-CA 3.18Å; V313-G316 PolarHBondContact O-N 2.94Å; C314-G316 PolarHBondContact O-N 3.28Å; G316-A318 PolarHBondContact O-N 3.49Å
317S92.4Very high93.6Very high14 Ų1422.3 Ų22.310%0.09813%0.131CC..  trans-92.486.7-174.4-168.80000112.5A312 S319 I320 V321A312-S317 PolarHBondContact O-N 3.01Å; S317-S319 PolarHBondContact O-N 3.28Å; S317-I320 PolarHBondContact O-N 3.45Å; S317-I320 VanDerWaalsContact O-N 3.11Å; S317-I320 WeakPolarHBondContact OG-CG1 3.27Å; S317-V321 WeakPolarHBondContact O-CG2 3.19Å; S317-V321 PolarHBondContact O-N 3.23Å
318A94.3Very high93.2Very high29 Ų2927 Ų2724%0.2416%0.156CC..Hα-helixtrans-54.9-36.5177.400000113.1G316 V321 N322 V352 I353 L356G316-A318 PolarHBondContact O-N 3.49Å; A318-V321 PolarHBondContact O-N 3.45Å; A318-N322 WeakPolarHBondContact O-CB 3.49Å; A318-N322 PolarHBondContact O-N 3.35Å; A318-V352 HydrophobicContact CB-CG1 4.02Å; A318-I353 HydrophobicContact CB-CG1 4.01Å; A318-L356 HydrophobicContact CB-CD1 3.97Å
319S95.3Very high93Very high60 Ų6027.7 Ų27.742%0.4216%0.16SC..Hα-helixtrans-63-42177.5-58.40000112.9S317 L323S317-S319 PolarHBondContact O-N 3.28Å; S319-L323 WeakPolarHBondContact O-CG 3.43Å; S319-L323 PolarHBondContact O-N 3.03Å
320I95.8Very high92.6Very high0 Ų031.3 Ų31.30%018%0.179CC..Hα-helixtrans-75.4-38.4178.5-67.1175.2000110.4V280 Q283 Q285 V288 A312 S317 N322 L323 L324V280-I320 HydrophobicContact CG1-CG2 4.21Å; V280-I320 HydrophobicContact CG2-CG2 3.99Å; Q283-I320 HydrophobicContact CB-CD1 4.43Å; Q285-I320 HydrophobicContact CB-CG1 4.39Å; Q285-I320 HydrophobicContact CG-CG1 4.47Å; V288-I320 HydrophobicContact CG1-CG2 4.21Å; V288-I320 HydrophobicContact CG2-CD1 4.34Å; A312-I320 HydrophobicContact CB-CB 4.3Å; A312-I320 HydrophobicContact CB-CG2 3.74Å; S317-I320 PolarHBondContact O-N 3.45Å; S317-I320 VanDerWaalsContact O-N 3.11Å; S317-I320 WeakPolarHBondContact OG-CG1 3.27Å; I320-N322 VanDerWaalsContact C-N 3.32Å; I320-N322 PolarHBondContact O-N 2.67Å; I320-L323 WeakPolarHBondContact O-CB 3.3Å; I320-L323 PolarHBondContact O-N 3.06Å; I320-L324 HydrophobicContact CG2-CD1 3.98Å; I320-L324 HydrophobicContact CG2-CG 4.33Å; I320-L324 WeakPolarHBondContact O-CG 3.45Å; I320-L324 PolarHBondContact O-N 3.29Å
321V96.1Very high92.4Very high0 Ų033.4 Ų33.40%019%0.192CC..Hα-helixtrans-54.1-50.8171.9169.50000110.3L309 A312 V313 S317 A318 L323 L324 L325 I353 L356L309-V321 HydrophobicContact CD1-CG1 4.07Å; A312-V321 HydrophobicContact CB-CG2 3.79Å; V313-V321 HydrophobicContact CG2-CG2 3.81Å; S317-V321 WeakPolarHBondContact O-CG2 3.19Å; S317-V321 PolarHBondContact O-N 3.23Å; A318-V321 PolarHBondContact O-N 3.45Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.27Å; V321-L324 PolarHBondContact O-N 3.03Å; V321-L324 VanDerWaalsContact O-N 3.13Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.22Å; V321-L325 VanDerWaalsContact O-CG 3.32Å; V321-L325 WeakPolarHBondContact O-CG 3.29Å; V321-L325 PolarHBondContact O-N 3.35Å; V321-I353 HydrophobicContact CG1-CG2 4.34Å; V321-I353 HydrophobicContact CG2-CD1 4.27Å; V321-I353 HydrophobicContact CG2-CG2 4.23Å; V321-L356 HydrophobicContact CG1-CD1 4.47Å
322N95Very high92.3Very high69 Ų6937.2 Ų37.237%0.36922%0.219SC..Hα-helixtrans-60.3-43.1179.1-168.350000112.2A318 I320 L324 L325 E326 L356A318-N322 WeakPolarHBondContact O-CB 3.49Å; A318-N322 PolarHBondContact O-N 3.35Å; I320-N322 VanDerWaalsContact C-N 3.32Å; I320-N322 PolarHBondContact O-N 2.67Å; N322-L324 VanDerWaalsContact C-N 3.29Å; N322-L324 PolarHBondContact O-N 2.87Å; N322-L325 PolarHBondContact O-N 2.98Å; N322-E326 PolarHBondContact ND2-OE1 3.15Å; N322-E326 WeakPolarHBondContact O-CG 3.47Å; N322-E326 PolarHBondContact O-N 3.13Å; N322-L356 HydrophobicContact CB-CD1 4.48Å
323L95.4Very high92.1Very high13 Ų1338.9 Ų38.97%0.06823%0.23CC..Hα-helixtrans-59.9-36.6175.6-75.2172000113.2Q285 K289 I292 S319 I320 V321Q285-L323 HydrophobicContact CG-CD1 3.67Å; K289-L323 HydrophobicContact CB-CD1 4.11Å; K289-L323 HydrophobicContact CD-CD2 4.04Å; K289-L323 HydrophobicContact CG-CD2 4.22Å; I292-L323 HydrophobicContact CD1-CB 4.47Å; S319-L323 WeakPolarHBondContact O-CG 3.43Å; S319-L323 PolarHBondContact O-N 3.03Å; I320-L323 WeakPolarHBondContact O-CB 3.3Å; I320-L323 PolarHBondContact O-N 3.06Å; V321-L323 VanDerWaalsContact C-N 3.35Å; V321-L323 PolarHBondContact O-N 3.27Å
324L94.9Very high92.1Very high0 Ų044.8 Ų44.80%026%0.258CS..Hα-helixtrans-75.1-41.2178.4-69.1170.9000111.5I292 L298 A308 L309 A312 I320 V321 N322 E326 Q327 V329I292-L324 HydrophobicContact CD1-CD2 3.99Å; L298-L324 HydrophobicContact CD2-CD2 4.14Å; A308-L324 HydrophobicContact CB-CD1 4.02Å; A308-L324 HydrophobicContact CB-CD2 4.15Å; A308-L324 WeakPolarHBondContact O-CD1 3.39Å; L309-L324 HydrophobicContact CD1-CB 4.41Å; A312-L324 HydrophobicContact CB-CD1 3.95Å; I320-L324 HydrophobicContact CG2-CD1 3.98Å; I320-L324 HydrophobicContact CG2-CG 4.33Å; I320-L324 WeakPolarHBondContact O-CG 3.45Å; I320-L324 PolarHBondContact O-N 3.29Å; V321-L324 PolarHBondContact O-N 3.03Å; V321-L324 VanDerWaalsContact O-N 3.13Å; N322-L324 VanDerWaalsContact C-N 3.29Å; N322-L324 PolarHBondContact O-N 2.87Å; L324-E326 VanDerWaalsContact C-N 3.27Å; L324-E326 PolarHBondContact O-N 3.24Å; L324-Q327 WeakPolarHBondContact O-CB 3.01Å; L324-Q327 PolarHBondContact O-N 2.96Å; L324-V329 HydrophobicContact CB-CG2 4.37Å; L324-V329 WeakPolarHBondContact O-CG1 3.31Å; L324-V329 WeakPolarHBondContact O-CG2 3.26Å
325L93.4Very high92.2Very high6 Ų645.2 Ų45.23%0.03126%0.26CS..Hα-helixtrans-60.8-36.1176.2-67.7175.4000111.9L309 V321 N322 Q327 N328 V329 V331 L356 L357 Y360L309-L325 HydrophobicContact CD1-CD2 4.2Å; L309-L325 HydrophobicContact CD1-CG 4.43Å; L309-L325 HydrophobicContact CD2-CD2 4.39Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.22Å; V321-L325 VanDerWaalsContact O-CG 3.32Å; V321-L325 WeakPolarHBondContact O-CG 3.29Å; V321-L325 PolarHBondContact O-N 3.35Å; N322-L325 PolarHBondContact O-N 2.98Å; L325-Q327 PolarHBondContact O-N 3.23Å; L325-Q327 VanDerWaalsContact O-N 3.08Å; L325-N328 PolarHBondContact O-N 3.38Å; L325-N328 VanDerWaalsContact O-N 3.14Å; L325-V329 HydrophobicContact CD2-CG2 4.38Å; L325-V331 HydrophobicContact CD2-CG1 3.56Å; L325-L356 HydrophobicContact CD1-CB 4.37Å; L325-L357 HydrophobicContact CD1-CD2 4.27Å; L325-L357 HydrophobicContact CD2-CD2 4.1Å; L325-Y360 HydrophobicContact CB-CD2 3.88Å; L325-Y360 HydrophobicContact CB-CE2 4.1Å; L325-Y360 HydrophobicContact CB-CG 4.35Å; L325-Y360 HydrophobicContact CD1-CG 4.37Å; L325-Y360 HydrophobicContact CD2-CD1 3.87Å; L325-Y360 HydrophobicContact CD2-CD2 4.18Å; L325-Y360 HydrophobicContact CD2-CE1 4.1Å; L325-Y360 HydrophobicContact CD2-CE2 4.41Å; L325-Y360 HydrophobicContact CD2-CG 3.88Å; L325-Y360 HydrophobicContact CG-CD2 4.43Å; L325-Y360 HydrophobicContact CG-CG 4.42Å; L325-Y360 WeakPolarHBondContact O-CE2 3.03Å
326E92.1Very high92.3Very high114 Ų11451 Ų5153%0.53329%0.289SS..THydrogen-bonded Turntrans-58.8-18.2172.1-73.8171.4-169.400113.7N322 L324N322-E326 PolarHBondContact ND2-OE1 3.15Å; N322-E326 WeakPolarHBondContact O-CG 3.47Å; N322-E326 PolarHBondContact O-N 3.13Å; L324-E326 VanDerWaalsContact C-N 3.27Å; L324-E326 PolarHBondContact O-N 3.24Å
327Q91.9Very high92.3Very high89 Ų8953.2 Ų53.242%0.41630%0.3SS..THydrogen-bonded Turntrans-94.812.2179.3-55.2-54.8-66.600114.1I292 L298 L324 L325 V329I292-Q327 VanDerWaalsContact CG2-CD 3.46Å; I292-Q327 HydrophobicContact CG2-CG 3.6Å; L298-Q327 HydrophobicContact CD1-CB 3.45Å; L298-Q327 VanDerWaalsContact CD1-CB 3.45Å; L298-Q327 HydrophobicContact CD1-CG 3.91Å; L324-Q327 WeakPolarHBondContact O-CB 3.01Å; L324-Q327 PolarHBondContact O-N 2.96Å; L325-Q327 PolarHBondContact O-N 3.23Å; L325-Q327 VanDerWaalsContact O-N 3.08Å; Q327-V329 VanDerWaalsContact C-N 3.28Å; Q327-V329 HydrophobicContact CB-CG1 4.36Å; Q327-V329 PolarHBondContact O-N 2.9Å
328N85.6Confident92.3Very high113 Ų11353.9 Ų53.960%0.60431%0.309SS*.THydrogen-bonded Turntrans56.237.3-177.5-58.8-56.1000114.2L325 Y360L325-N328 PolarHBondContact O-N 3.38Å; L325-N328 VanDerWaalsContact O-N 3.14Å; N328-Y360 VanDerWaalsContact CA-OH 3.29Å; N328-Y360 WeakPolarHBondContact CA-OH 3.5Å
329V88.9Confident92.3Very high17 Ų1755.8 Ų55.810%0.10331%0.313CS..  trans-64.9150.8176.3-63.80000111.5L298 L309 L324 L325 Q327 V331L298-V329 HydrophobicContact CB-CG1 4.22Å; L298-V329 HydrophobicContact CD1-CG1 3.75Å; L309-V329 HydrophobicContact CB-CG2 4.47Å; L309-V329 HydrophobicContact CD2-CG2 4.15Å; L324-V329 HydrophobicContact CB-CG2 4.37Å; L324-V329 WeakPolarHBondContact O-CG1 3.31Å; L324-V329 WeakPolarHBondContact O-CG2 3.26Å; L325-V329 HydrophobicContact CD2-CG2 4.38Å; Q327-V329 VanDerWaalsContact C-N 3.28Å; Q327-V329 HydrophobicContact CB-CG1 4.36Å; Q327-V329 PolarHBondContact O-N 2.9Å; V329-V331 PolarHBondContact O-N 2.94Å
330D88.4Confident92.2Very high80 Ų8054 Ų5443%0.42830%0.299SS..  trans-69.5119.3171.9175.727.6000110.4S332 S333D330-S332 WeakPolarHBondContact OD1-CB 3.24Å; D330-S332 PolarHBondContact OD1-N 3.01Å; D330-S332 PolarHBondContact OD1-OG 3.16Å; D330-S332 PolarHBondContact OD2-OG 3.02Å; D330-S333 PolarHBondContact OD2-N 3.28Å; D330-S333 VanDerWaalsContact OD2-N 3.12Å; D330-S333 PolarHBondContact OD2-OG 2.82Å
331V89.5Confident92Very high45 Ų4554 Ų5427%0.27330%0.3SS..SBendtrans-89.7-11.3179.3-61.40000113L309 L325 V329 L357 Y360L309-V331 HydrophobicContact CD2-CB 4.16Å; L309-V331 HydrophobicContact CD2-CG1 3.78Å; L325-V331 HydrophobicContact CD2-CG1 3.56Å; V329-V331 PolarHBondContact O-N 2.94Å; V331-L357 HydrophobicContact CG1-CD2 4.49Å; V331-Y360 HydrophobicContact CG1-CD1 3.76Å; V331-Y360 HydrophobicContact CG1-CE1 3.57Å; V331-Y360 HydrophobicContact CG2-CE1 4.42Å
332S90.1Very high91.9Very high81 Ų8159.5 Ų59.557%0.56632%0.32SS*.SBendtrans-93.1-10.4-177.470.10000113.8D330 Q334D330-S332 WeakPolarHBondContact OD1-CB 3.24Å; D330-S332 PolarHBondContact OD1-N 3.01Å; D330-S332 PolarHBondContact OD1-OG 3.16Å; D330-S332 PolarHBondContact OD2-OG 3.02Å; S332-Q334 PolarHBondContact O-N 3.06Å
333S91.4Very high91.8Very high35 Ų3560.1 Ų60.125%0.24532%0.321CS..  trans-51.7137.8174.9-74.10000112D330D330-S333 PolarHBondContact OD2-N 3.28Å; D330-S333 VanDerWaalsContact OD2-N 3.12Å; D330-S333 PolarHBondContact OD2-OG 2.82Å
334Q93.1Very high91.6Very high123 Ų12361 Ų6158%0.57532%0.324SS*.BIsolated β-bridgetrans-110.9147.1177.7-70.6177.6-32.300110.3S332 G338 Q339 T340S332-Q334 PolarHBondContact O-N 3.06Å; Q334-G338 PolarHBondContact NE2-O 3.47Å; Q334-G338 VanDerWaalsContact NE2-O 3.15Å; Q334-Q339 WeakPolarHBondContact CA-O 3.28Å; Q334-T340 HydrophobicContact CG-CG2 3.67Å
335D92.3Very high91.5Very high15 Ų1561 Ų618%0.0832%0.324CS..  trans-82.5-174.6170.677.8-4.3000112.5R306 I310 S337 G338 Q339 Y344R306-D335 HydrophobicContact CG-CB 3.71Å; I310-D335 HydrophobicContact CD1-CB 4.23Å; D335-S337 PolarHBondContact O-N 3.45Å; D335-S337 VanDerWaalsContact O-N 3.13Å; D335-S337 WeakPolarHBondContact OD1-CA 3.4Å; D335-S337 WeakPolarHBondContact OD1-CB 3.47Å; D335-S337 PolarHBondContact OD1-N 2.95Å; D335-S337 PolarHBondContact OD1-OG 3.19Å; D335-S337 PolarHBondContact OD2-OG 2.76Å; D335-G338 PolarHBondContact O-N 3.43Å; D335-G338 PolarHBondContact OD1-N 3Å; D335-Q339 PolarHBondContact N-O 3.17Å; D335-Q339 PolarHBondContact OD1-N 3.43Å; D335-Y344 PolarHBondContact OD2-OH 3.16Å
336L92.2Very high91.5Very high143 Ų14364.7 Ų64.775%0.74935%0.346SS*.THydrogen-bonded Turntrans-63.9-16.4179.3-67.3177.9000114Y304 G338Y304-L336 WeakPolarHBondContact O-CB 3.49Å; Y304-L336 VanDerWaalsContact O-CG 3.28Å; Y304-L336 WeakPolarHBondContact O-CG 3.25Å; Y304-L336 PolarHBondContact O-N 2.92Å; Y304-L336 VanDerWaalsContact O-N 3.09Å; L336-G338 VanDerWaalsContact C-N 3.35Å
337S91Very high91.4Very high71 Ų7161.6 Ų61.650%0.49734%0.337SS..THydrogen-bonded Turntrans-92.12.4174.673.70000113.2D335 Q339D335-S337 PolarHBondContact O-N 3.45Å; D335-S337 VanDerWaalsContact O-N 3.13Å; D335-S337 WeakPolarHBondContact OD1-CA 3.4Å; D335-S337 WeakPolarHBondContact OD1-CB 3.47Å; D335-S337 PolarHBondContact OD1-N 2.95Å; D335-S337 PolarHBondContact OD1-OG 3.19Å; D335-S337 PolarHBondContact OD2-OG 2.76Å; S337-Q339 PolarHBondContact O-N 3.06Å; S337-Q339 WeakPolarHBondContact OG-CG 3.33Å
338G92.3Very high91.1Very high28 Ų2857.9 Ų57.929%0.28932%0.321SS..SBendtrans75.711.6-176.400000113.5Q334 D335 L336Q334-G338 PolarHBondContact NE2-O 3.47Å; Q334-G338 VanDerWaalsContact NE2-O 3.15Å; D335-G338 PolarHBondContact O-N 3.43Å; D335-G338 PolarHBondContact OD1-N 3Å; L336-G338 VanDerWaalsContact C-N 3.35Å
339Q92.4Very high91.3Very high70 Ų7059.2 Ų59.233%0.32732%0.323SS..  trans-91.4135.6-176.9-63.9-65.6-65.400111.1Q334 D335 S337 E343 Y344Q334-Q339 WeakPolarHBondContact CA-O 3.28Å; D335-Q339 PolarHBondContact N-O 3.17Å; D335-Q339 PolarHBondContact OD1-N 3.43Å; S337-Q339 PolarHBondContact O-N 3.06Å; S337-Q339 WeakPolarHBondContact OG-CG 3.33Å; Q339-E343 WeakPolarHBondContact CA-OE2 3.32Å; Q339-Y344 HydrophobicContact CB-CD2 3.94Å; Q339-Y344 HydrophobicContact CB-CE2 3.36Å; Q339-Y344 HydrophobicContact CG-CE2 4.27Å
340T93.9Very high91.4Very high22 Ų2260.5 Ų60.514%0.13533%0.328CS..BIsolated β-bridgetrans-91.5164.2175.262.80000111.5Q334 R342 E343 Y344Q334-T340 HydrophobicContact CG-CG2 3.67Å; T340-R342 PolarHBondContact O-N 3.41Å; T340-E343 PolarHBondContact N-OE2 3.33Å; T340-E343 PolarHBondContact O-N 2.7Å; T340-E343 VanDerWaalsContact OG1-CD 3.29Å; T340-E343 WeakPolarHBondContact OG1-CG 3.15Å; T340-E343 PolarHBondContact OG1-N 2.98Å; T340-E343 PolarHBondContact OG1-OE2 3.37Å; T340-Y344 WeakPolarHBondContact O-CD2 3.34Å; T340-Y344 PolarHBondContact O-N 3.26Å
341A92.4Very high91.5Very high1 Ų163 Ų631%0.00834%0.337CS..Hα-helixtrans-56.4-37174.200000112.4L309 I310 V313 A345 L357L309-A341 HydrophobicContact CD2-CB 3.97Å; L309-A341 HydrophobicContact CG-CB 3.95Å; I310-A341 HydrophobicContact CG1-CB 4.04Å; V313-A341 WeakPolarHBondContact CG1-O 3.44Å; V313-A341 HydrophobicContact CG2-CB 4.04Å; A341-A345 PolarHBondContact O-N 3.04Å; A341-L357 HydrophobicContact CB-CD1 4.48Å
342R93.4Very high91.8Very high115 Ų11565.1 Ų65.143%0.43435%0.35SS..Hα-helixtrans-67.7-42178.9-173.7-179.7178.792.8-0.5112.1T340 Y344 A345 V346 L357 S358T340-R342 PolarHBondContact O-N 3.41Å; R342-Y344 VanDerWaalsContact C-N 3.32Å; R342-Y344 PolarHBondContact O-N 3.09Å; R342-A345 WeakPolarHBondContact O-CB 3.24Å; R342-A345 PolarHBondContact O-N 2.89Å; R342-V346 HydrophobicContact CG-CG2 4.49Å; R342-V346 WeakPolarHBondContact O-CG2 3.15Å; R342-V346 PolarHBondContact O-N 2.87Å; R342-L357 HydrophobicContact CB-CD1 4.25Å; R342-S358 PolarHBondContact NH1-OG 3.25Å
343E92.2Very high91.9Very high81 Ų8161.4 Ų61.438%0.37932%0.323SS..Hα-helixtrans-64.3-39179.2-70.9160.3158.800111.4Q339 T340 V346 S347Q339-E343 WeakPolarHBondContact CA-OE2 3.32Å; T340-E343 PolarHBondContact N-OE2 3.33Å; T340-E343 PolarHBondContact O-N 2.7Å; T340-E343 VanDerWaalsContact OG1-CD 3.29Å; T340-E343 WeakPolarHBondContact OG1-CG 3.15Å; T340-E343 PolarHBondContact OG1-N 2.98Å; T340-E343 PolarHBondContact OG1-OE2 3.37Å; E343-V346 PolarHBondContact O-N 2.73Å; E343-S347 WeakPolarHBondContact O-CB 3.31Å; E343-S347 PolarHBondContact O-N 3.23Å; E343-S347 PolarHBondContact O-OG 3.25Å
344Y92.3Very high92Very high33 Ų3360.8 Ų60.813%0.12932%0.319CS..Hα-helixtrans-63.5-40.8171-82.3-64.9000113.2V117 I310 D335 Q339 T340 R342 V346 S347 S348V117-Y344 HydrophobicContact CG1-CD1 3.87Å; V117-Y344 HydrophobicContact CG1-CE1 3.99Å; I310-Y344 HydrophobicContact CG2-CD2 3.7Å; I310-Y344 HydrophobicContact CG2-CE2 3.78Å; D335-Y344 PolarHBondContact OD2-OH 3.16Å; Q339-Y344 HydrophobicContact CB-CD2 3.94Å; Q339-Y344 HydrophobicContact CB-CE2 3.36Å; Q339-Y344 HydrophobicContact CG-CE2 4.27Å; T340-Y344 WeakPolarHBondContact O-CD2 3.34Å; T340-Y344 PolarHBondContact O-N 3.26Å; R342-Y344 VanDerWaalsContact C-N 3.32Å; R342-Y344 PolarHBondContact O-N 3.09Å; Y344-V346 PolarHBondContact O-N 3.33Å; Y344-S347 WeakPolarHBondContact CA-OG 3.44Å; Y344-S347 PolarHBondContact O-OG 2.96Å; Y344-S347 VanDerWaalsContact O-OG 3.1Å; Y344-S348 WeakPolarHBondContact O-CB 3.36Å; Y344-S348 PolarHBondContact O-N 3.5Å; Y344-S348 PolarHBondContact O-OG 3.35Å
345A92.9Very high92Very high0 Ų060.7 Ų60.70%032%0.318CS..Hα-helixtrans-63.6-42.2178.100000111.6V313 A341 R342 H349 H350 I353 C354 L357V313-A345 HydrophobicContact CG1-CB 3.67Å; A341-A345 PolarHBondContact O-N 3.04Å; R342-A345 WeakPolarHBondContact O-CB 3.24Å; R342-A345 PolarHBondContact O-N 2.89Å; A345-H349 PolarHBondContact O-N 3.13Å; A345-H350 PolarHBondContact O-N 3.4Å; A345-I353 HydrophobicContact CB-CB 4.33Å; A345-I353 HydrophobicContact CB-CG2 3.85Å; A345-C354 VanDerWaalsContact C-SG 3.59Å; A345-C354 VanDerWaalsContact CB-SG 3.52Å; A345-L357 HydrophobicContact CB-CD1 4.26Å
346V92.3Very high92Very high82 Ų8261.8 Ų61.850%0.49732%0.324SS..Hα-helixtrans-68.6-49179.2172.80000111.1R342 E343 Y344 S348 H349R342-V346 HydrophobicContact CG-CG2 4.49Å; R342-V346 WeakPolarHBondContact O-CG2 3.15Å; R342-V346 PolarHBondContact O-N 2.87Å; E343-V346 PolarHBondContact O-N 2.73Å; Y344-V346 PolarHBondContact O-N 3.33Å; V346-S348 VanDerWaalsContact C-N 3.29Å; V346-S348 PolarHBondContact O-N 3Å; V346-H349 PolarHBondContact O-N 2.86Å; V346-H349 VanDerWaalsContact O-N 3.16Å; V346-H349 PolarHBondContact O-ND1 3.29Å
347S90.6Very high92Very high49 Ų4955.6 Ų55.634%0.34329%0.292SS..Hα-helixtrans-64.6-32.8-179.755.50000112.9V117 E343 Y344 H349V117-S347 VanDerWaalsContact CG2-C 3.45Å; V117-S347 VanDerWaalsContact CG2-O 3.32Å; V117-S347 WeakPolarHBondContact CG2-O 3.36Å; E343-S347 WeakPolarHBondContact O-CB 3.31Å; E343-S347 PolarHBondContact O-N 3.23Å; E343-S347 PolarHBondContact O-OG 3.25Å; Y344-S347 WeakPolarHBondContact CA-OG 3.44Å; Y344-S347 PolarHBondContact O-OG 2.96Å; Y344-S347 VanDerWaalsContact O-OG 3.1Å; S347-H349 VanDerWaalsContact C-N 3.31Å
348S86.7Confident92Very high12 Ų1253.6 Ų53.68%0.08428%0.278CS..THydrogen-bonded Turntrans-86.70.9177.8-54.50000113.7V117 Y344 V346 H350V117-S348 VanDerWaalsContact CG2-OG 3.29Å; V117-S348 WeakPolarHBondContact CG2-OG 3.42Å; Y344-S348 WeakPolarHBondContact O-CB 3.36Å; Y344-S348 PolarHBondContact O-N 3.5Å; Y344-S348 PolarHBondContact O-OG 3.35Å; V346-S348 VanDerWaalsContact C-N 3.29Å; V346-S348 PolarHBondContact O-N 3Å; S348-H350 VanDerWaalsContact C-N 3.27Å; S348-H350 WeakPolarHBondContact CB-CD2 3.43Å; S348-H350 WeakPolarHBondContact CB-NE2 3.22Å; S348-H350 PolarHBondContact O-N 3.24Å
349H89.6Confident91.9Very high140 Ų14055.8 Ų55.865%0.64828%0.283SS*.THydrogen-bonded Turntrans56.135.8-175.8-51.7-54.1000114.1A345 V346 S347 H351A345-H349 PolarHBondContact O-N 3.13Å; V346-H349 PolarHBondContact O-N 2.86Å; V346-H349 VanDerWaalsContact O-N 3.16Å; V346-H349 PolarHBondContact O-ND1 3.29Å; S347-H349 VanDerWaalsContact C-N 3.31Å; H349-H351 VanDerWaalsContact C-N 3.31Å; H349-H351 PolarHBondContact O-CD2 2.89Å; H349-H351 PolarHBondContact O-N 3.37Å
350H90.9Very high91.8Very high45 Ų4553.7 Ų53.721%0.20827%0.272CS..  trans-83.872.1175.6-66.2-41.4000111.2V313 A345 S348 V352 I353 C354V313-H350 PolarHBondContact O-CD2 3.5Å; A345-H350 PolarHBondContact O-N 3.4Å; S348-H350 VanDerWaalsContact C-N 3.27Å; S348-H350 WeakPolarHBondContact CB-CD2 3.43Å; S348-H350 WeakPolarHBondContact CB-NE2 3.22Å; S348-H350 PolarHBondContact O-N 3.24Å; H350-V352 VanDerWaalsContact C-N 3.34Å; H350-V352 PolarHBondContact O-N 3.42Å; H350-I353 HydrophobicContact CB-CB 3.92Å; H350-I353 HydrophobicContact CB-CD1 3.89Å; H350-I353 HydrophobicContact CB-CG1 4.07Å; H350-I353 WeakPolarHBondContact O-CB 3.34Å; H350-I353 PolarHBondContact O-N 3.4Å; H350-C354 PolarHBondContact O-N 3.05Å
351H91.1Very high91.4Very high132 Ų13258.6 Ų58.661%0.61129%0.292SS*.Hα-helixtrans-50.3-47.6-175.3-62.3-72.2000113.9H349 I353 C354 E355H349-H351 VanDerWaalsContact C-N 3.31Å; H349-H351 PolarHBondContact O-CD2 2.89Å; H349-H351 PolarHBondContact O-N 3.37Å; H351-I353 VanDerWaalsContact C-N 3.28Å; H351-I353 PolarHBondContact O-N 3.41Å; H351-C354 WeakPolarHBondContact O-CB 3.5Å; H351-C354 PolarHBondContact O-N 3.39Å; H351-C354 VanDerWaalsContact O-N 3.14Å; H351-E355 PolarHBondContact O-N 2.97Å
352V93.8Very high91.1Very high89 Ų8964.5 Ų64.554%0.53932%0.319SS..Hα-helixtrans-60.4-38178.6-179.90000111.9A318 H350 E355 L356A318-V352 HydrophobicContact CB-CG1 4.02Å; H350-V352 VanDerWaalsContact C-N 3.34Å; H350-V352 PolarHBondContact O-N 3.42Å; V352-E355 PolarHBondContact O-N 3.22Å; V352-L356 HydrophobicContact CG1-CD1 4.41Å; V352-L356 VanDerWaalsContact O-CG 3.32Å; V352-L356 WeakPolarHBondContact O-CG 3.35Å; V352-L356 PolarHBondContact O-N 2.76Å
353I93.6Very high90.7Very high3 Ų365.7 Ų65.72%0.01533%0.327CS..Hα-helixtrans-71.6-38.3178.5-63.3-178.6000110.4V313 A318 V321 A345 H350 H351 E355 L356 L357V313-I353 HydrophobicContact CB-CG2 4.37Å; V313-I353 HydrophobicContact CG1-CG2 4.05Å; V313-I353 HydrophobicContact CG2-CG2 3.67Å; A318-I353 HydrophobicContact CB-CG1 4.01Å; V321-I353 HydrophobicContact CG1-CG2 4.34Å; V321-I353 HydrophobicContact CG2-CD1 4.27Å; V321-I353 HydrophobicContact CG2-CG2 4.23Å; A345-I353 HydrophobicContact CB-CB 4.33Å; A345-I353 HydrophobicContact CB-CG2 3.85Å; H350-I353 HydrophobicContact CB-CB 3.92Å; H350-I353 HydrophobicContact CB-CD1 3.89Å; H350-I353 HydrophobicContact CB-CG1 4.07Å; H350-I353 WeakPolarHBondContact O-CB 3.34Å; H350-I353 PolarHBondContact O-N 3.4Å; H351-I353 VanDerWaalsContact C-N 3.28Å; H351-I353 PolarHBondContact O-N 3.41Å; I353-E355 VanDerWaalsContact C-N 3.31Å; I353-E355 PolarHBondContact O-N 3.19Å; I353-L356 PolarHBondContact O-N 3.44Å; I353-L357 HydrophobicContact CG2-CD1 4.07Å; I353-L357 HydrophobicContact CG2-CG 4.39Å; I353-L357 WeakPolarHBondContact O-CB 3.24Å; I353-L357 VanDerWaalsContact O-CG 3.31Å; I353-L357 WeakPolarHBondContact O-CG 3.47Å; I353-L357 PolarHBondContact O-N 2.87Å
354C92.8Very high90.2Very high22 Ų2265.3 Ų65.315%0.14933%0.326CS..Hα-helixtrans-59.8-41.8173.6-67.20000112A345 H350 H351 S358A345-C354 VanDerWaalsContact C-SG 3.59Å; A345-C354 VanDerWaalsContact CB-SG 3.52Å; H350-C354 PolarHBondContact O-N 3.05Å; H351-C354 WeakPolarHBondContact O-CB 3.5Å; H351-C354 PolarHBondContact O-N 3.39Å; H351-C354 VanDerWaalsContact O-N 3.14Å; C354-S358 WeakPolarHBondContact O-CB 3.33Å; C354-S358 PolarHBondContact O-N 2.98Å; C354-S358 PolarHBondContact O-OG 2.83Å
355E92.9Very high89.5Confident121 Ų12169 Ų6957%0.56535%0.345SS*.Hα-helixtrans-62.4-52.4174.4-71.6173-178.800110.6H351 V352 I353 L357 S358 D359H351-E355 PolarHBondContact O-N 2.97Å; V352-E355 PolarHBondContact O-N 3.22Å; I353-E355 VanDerWaalsContact C-N 3.31Å; I353-E355 PolarHBondContact O-N 3.19Å; E355-L357 VanDerWaalsContact C-N 3.28Å; E355-L357 PolarHBondContact O-N 3.29Å; E355-S358 WeakPolarHBondContact O-CA 3.41Å; E355-S358 WeakPolarHBondContact O-CB 3.4Å; E355-S358 PolarHBondContact O-N 2.95Å; E355-D359 PolarHBondContact O-N 2.85Å
356L93.7Very high88.8Confident39 Ų3974.5 Ų74.520%0.20437%0.374CS..Hα-helixtrans-54-42.9177.9-73.1172.3000113.1A318 V321 N322 L325 V352 I353 S358 Y360A318-L356 HydrophobicContact CB-CD1 3.97Å; V321-L356 HydrophobicContact CG1-CD1 4.47Å; N322-L356 HydrophobicContact CB-CD1 4.48Å; L325-L356 HydrophobicContact CD1-CB 4.37Å; V352-L356 HydrophobicContact CG1-CD1 4.41Å; V352-L356 VanDerWaalsContact O-CG 3.32Å; V352-L356 WeakPolarHBondContact O-CG 3.35Å; V352-L356 PolarHBondContact O-N 2.76Å; I353-L356 PolarHBondContact O-N 3.44Å; L356-S358 VanDerWaalsContact C-N 3.35Å; L356-Y360 WeakPolarHBondContact O-CB 3.47Å; L356-Y360 PolarHBondContact O-N 2.73Å; L356-Y360 VanDerWaalsContact O-N 3.09Å
357L92Very high88Confident12 Ų1276.1 Ų76.16%0.06338%0.375CS..Hα-helixtrans-69.4-32.2177.4-69.5173.2000112.6L309 L325 V331 A341 R342 A345 I353 E355 K361L309-L357 HydrophobicContact CD2-CD2 4.42Å; L325-L357 HydrophobicContact CD1-CD2 4.27Å; L325-L357 HydrophobicContact CD2-CD2 4.1Å; V331-L357 HydrophobicContact CG1-CD2 4.49Å; A341-L357 HydrophobicContact CB-CD1 4.48Å; R342-L357 HydrophobicContact CB-CD1 4.25Å; A345-L357 HydrophobicContact CB-CD1 4.26Å; I353-L357 HydrophobicContact CG2-CD1 4.07Å; I353-L357 HydrophobicContact CG2-CG 4.39Å; I353-L357 WeakPolarHBondContact O-CB 3.24Å; I353-L357 VanDerWaalsContact O-CG 3.31Å; I353-L357 WeakPolarHBondContact O-CG 3.47Å; I353-L357 PolarHBondContact O-N 2.87Å; E355-L357 VanDerWaalsContact C-N 3.28Å; E355-L357 PolarHBondContact O-N 3.29Å; L357-K361 PolarHBondContact O-N 3.29Å
358S90.7Very high87.2Confident30 Ų3077.8 Ų77.821%0.2138%0.379CS..Hα-helixtrans-72.4-49.6177.5-54.60000110.6R342 C354 E355 L356 Y360 K361 E362R342-S358 PolarHBondContact NH1-OG 3.25Å; C354-S358 WeakPolarHBondContact O-CB 3.33Å; C354-S358 PolarHBondContact O-N 2.98Å; C354-S358 PolarHBondContact O-OG 2.83Å; E355-S358 WeakPolarHBondContact O-CA 3.41Å; E355-S358 WeakPolarHBondContact O-CB 3.4Å; E355-S358 PolarHBondContact O-N 2.95Å; L356-S358 VanDerWaalsContact C-N 3.35Å; S358-Y360 VanDerWaalsContact C-N 3.26Å; S358-Y360 PolarHBondContact O-N 2.64Å; S358-K361 WeakPolarHBondContact O-CB 3.39Å; S358-K361 PolarHBondContact O-N 3.38Å; S358-E362 PolarHBondContact O-N 3.49Å
359D90.9Very high86.4Confident74 Ų7480.1 Ų80.140%0.39640%0.395SS..Hα-helixtrans-56.5-41176.7-70.84.3000111.9E355 E362 K363E355-D359 PolarHBondContact O-N 2.85Å; D359-E362 PolarHBondContact O-N 3.3Å; D359-K363 WeakPolarHBondContact O-CB 3.3Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.33Å; D359-K363 PolarHBondContact O-N 2.88Å
360Y90.4Very high85.4Confident25 Ų2576.8 Ų76.810%0.09839%0.387CS..Hα-helixtrans-65.1-41.9177.7179.4-97.7000112.1L325 N328 V331 L356 S358 K363 Q364L325-Y360 HydrophobicContact CB-CD2 3.88Å; L325-Y360 HydrophobicContact CB-CE2 4.1Å; L325-Y360 HydrophobicContact CB-CG 4.35Å; L325-Y360 HydrophobicContact CD1-CG 4.37Å; L325-Y360 HydrophobicContact CD2-CD1 3.87Å; L325-Y360 HydrophobicContact CD2-CD2 4.18Å; L325-Y360 HydrophobicContact CD2-CE1 4.1Å; L325-Y360 HydrophobicContact CD2-CE2 4.41Å; L325-Y360 HydrophobicContact CD2-CG 3.88Å; L325-Y360 HydrophobicContact CG-CD2 4.43Å; L325-Y360 HydrophobicContact CG-CG 4.42Å; L325-Y360 WeakPolarHBondContact O-CE2 3.03Å; N328-Y360 VanDerWaalsContact CA-OH 3.29Å; N328-Y360 WeakPolarHBondContact CA-OH 3.5Å; V331-Y360 HydrophobicContact CG1-CD1 3.76Å; V331-Y360 HydrophobicContact CG1-CE1 3.57Å; V331-Y360 HydrophobicContact CG2-CE1 4.42Å; L356-Y360 WeakPolarHBondContact O-CB 3.47Å; L356-Y360 PolarHBondContact O-N 2.73Å; L356-Y360 VanDerWaalsContact O-N 3.09Å; S358-Y360 VanDerWaalsContact C-N 3.26Å; S358-Y360 PolarHBondContact O-N 2.64Å; Y360-K363 PolarHBondContact O-N 3.39Å; Y360-Q364 HydrophobicContact CD1-CG 4.48Å; Y360-Q364 HydrophobicContact CE1-CG 4.05Å; Y360-Q364 VanDerWaalsContact CZ-NE2 3.3Å; Y360-Q364 PolarHBondContact O-N 3.07Å; Y360-Q364 PolarHBondContact OH-NE2 3.06Å
361K84.6Confident84.1Confident126 Ų12680.4 Ų80.455%0.54840%0.404SS..Hα-helixtrans-64-43.2177.3-170176.9-179.6178.50111.2L357 S358 Q364 M365L357-K361 PolarHBondContact O-N 3.29Å; S358-K361 WeakPolarHBondContact O-CB 3.39Å; S358-K361 PolarHBondContact O-N 3.38Å; K361-Q364 PolarHBondContact O-N 2.89Å; K361-M365 HydrophobicContact CG-CE 4.34Å; K361-M365 VanDerWaalsContact O-CG 3.25Å; K361-M365 WeakPolarHBondContact O-CG 3.41Å; K361-M365 PolarHBondContact O-N 3.15Å
362E85.8Confident82.6Confident124 Ų12480.2 Ų80.258%0.57941%0.408SS*.Hα-helixtrans-61-45.6175.6-70.4177.9-172.600111.9S358 D359 Q364 M365 L366S358-E362 PolarHBondContact O-N 3.49Å; D359-E362 PolarHBondContact O-N 3.3Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-Q364 PolarHBondContact O-N 3.12Å; E362-M365 PolarHBondContact O-N 3.49Å; E362-L366 WeakPolarHBondContact O-CG 3.43Å; E362-L366 PolarHBondContact O-N 2.8Å
363K85.1Confident80.8Confident140 Ų14080.1 Ų80.161%0.60941%0.411SS*.Hα-helixtrans-60.2-40.3176.2-74.3170.1-174.5170.30112.6D359 Y360 K367D359-K363 WeakPolarHBondContact O-CB 3.3Å; D359-K363 VanDerWaalsContact O-CG 3.26Å; D359-K363 WeakPolarHBondContact O-CG 3.33Å; D359-K363 PolarHBondContact O-N 2.88Å; Y360-K363 PolarHBondContact O-N 3.39Å; K363-K367 WeakPolarHBondContact O-CB 3.46Å; K363-K367 PolarHBondContact O-N 2.91Å
364Q81.9Confident78.8Confident74 Ų7486.8 Ų86.835%0.34645%0.447SS..Hα-helixtrans-65.7-42.1175-78.1-146-600112.4Y360 K361 E362 L366 K367 I368Y360-Q364 HydrophobicContact CD1-CG 4.48Å; Y360-Q364 HydrophobicContact CE1-CG 4.05Å; Y360-Q364 VanDerWaalsContact CZ-NE2 3.3Å; Y360-Q364 PolarHBondContact O-N 3.07Å; Y360-Q364 PolarHBondContact OH-NE2 3.06Å; K361-Q364 PolarHBondContact O-N 2.89Å; E362-Q364 VanDerWaalsContact C-N 3.33Å; E362-Q364 PolarHBondContact O-N 3.12Å; Q364-L366 VanDerWaalsContact C-N 3.34Å; Q364-L366 PolarHBondContact O-N 3.01Å; Q364-K367 WeakPolarHBondContact O-CB 3.41Å; Q364-K367 PolarHBondContact O-N 3.5Å; Q364-I368 WeakPolarHBondContact O-CG1 3.34Å; Q364-I368 PolarHBondContact O-N 3.1Å
365M77.4Confident76.7Confident110 Ų11091.5 Ų91.554%0.54248%0.477SS..Hα-helixtrans-62-41.7177.8-66.9-68168.200111.9K361 E362 K367 I368 S369K361-M365 HydrophobicContact CG-CE 4.34Å; K361-M365 VanDerWaalsContact O-CG 3.25Å; K361-M365 WeakPolarHBondContact O-CG 3.41Å; K361-M365 PolarHBondContact O-N 3.15Å; E362-M365 PolarHBondContact O-N 3.49Å; M365-K367 VanDerWaalsContact C-N 3.35Å; M365-I368 PolarHBondContact O-N 3.17Å; M365-S369 PolarHBondContact O-N 3.04Å
366L77.4Confident74.7Confident115 Ų11588.8 Ų88.860%0.60248%0.482SS*.Hα-helixtrans-63.4-40.9174.8-69.7170.6000111.8E362 Q364 I368 S369 S370E362-L366 WeakPolarHBondContact O-CG 3.43Å; E362-L366 PolarHBondContact O-N 2.8Å; Q364-L366 VanDerWaalsContact C-N 3.34Å; Q364-L366 PolarHBondContact O-N 3.01Å; L366-I368 PolarHBondContact O-N 3.44Å; L366-S369 WeakPolarHBondContact CA-OG 3.39Å; L366-S369 PolarHBondContact O-N 3.05Å; L366-S369 PolarHBondContact O-OG 3.47Å; L366-S370 PolarHBondContact O-N 3.17Å; L366-S370 PolarHBondContact O-OG 3.5Å
367K76.6Confident72.6Confident117 Ų11796.6 Ų96.651%0.50951%0.514SS..Hα-helixtrans-60.7-45.6176-161.7175180-173.20112.2K363 Q364 M365 S369 S370 E371K363-K367 WeakPolarHBondContact O-CB 3.46Å; K363-K367 PolarHBondContact O-N 2.91Å; Q364-K367 WeakPolarHBondContact O-CB 3.41Å; Q364-K367 PolarHBondContact O-N 3.5Å; M365-K367 VanDerWaalsContact C-N 3.35Å; K367-S369 VanDerWaalsContact C-N 3.34Å; K367-S369 PolarHBondContact O-N 2.95Å; K367-S370 PolarHBondContact O-N 2.68Å; K367-S370 PolarHBondContact O-OG 3.43Å; K367-E371 WeakPolarHBondContact O-CG 3.35Å; K367-E371 PolarHBondContact O-N 3.43Å
368I73.9Confident70.3Confident84 Ų84105.9 Ų105.943%0.43156%0.557SS.*Hα-helixtrans-62.5-40.9176.3-63.9162.4000111.2Q364 M365 L366 S370 E371 N372Q364-I368 WeakPolarHBondContact O-CG1 3.34Å; Q364-I368 PolarHBondContact O-N 3.1Å; M365-I368 PolarHBondContact O-N 3.17Å; L366-I368 PolarHBondContact O-N 3.44Å; I368-S370 PolarHBondContact O-N 3.4Å; I368-E371 PolarHBondContact O-N 3.15Å; I368-N372 PolarHBondContact O-N 3.45Å; I368-N372 VanDerWaalsContact O-N 3.1Å; I368-N372 PolarHBondContact O-ND2 3.05Å
369S69.3Low68.2Low61 Ų61108.4 Ų108.443%0.42758%0.58SS.*Hα-helixtrans-66-35178.871.30000113.3M365 L366 K367 S373M365-S369 PolarHBondContact O-N 3.04Å; L366-S369 WeakPolarHBondContact CA-OG 3.39Å; L366-S369 PolarHBondContact O-N 3.05Å; L366-S369 PolarHBondContact O-OG 3.47Å; K367-S369 VanDerWaalsContact C-N 3.34Å; K367-S369 PolarHBondContact O-N 2.95Å; S369-S373 PolarHBondContact O-N 3.11Å; S369-S373 PolarHBondContact O-OG 3.37Å
370S68.3Low65.9Low69 Ų69114.4 Ų114.448%0.48361%0.606SS.*Hα-helixtrans-75.2-35.2177.155.50000113.1L366 K367 I368 S373L366-S370 PolarHBondContact O-N 3.17Å; L366-S370 PolarHBondContact O-OG 3.5Å; K367-S370 PolarHBondContact O-N 2.68Å; K367-S370 PolarHBondContact O-OG 3.43Å; I368-S370 PolarHBondContact O-N 3.4Å; S370-S373 PolarHBondContact O-N 3.14Å
371E63.2Low63.7Low121 Ų121126.1 Ų126.157%0.56566%0.661SS**Hα-helixtrans-66.7-37.8174.1-73.4171.6-176.600111.6K367 I368 S373 N374K367-E371 WeakPolarHBondContact O-CG 3.35Å; K367-E371 PolarHBondContact O-N 3.43Å; I368-E371 PolarHBondContact O-N 3.15Å; E371-S373 PolarHBondContact O-N 3.3Å; E371-N374 PolarHBondContact O-N 3.42Å
372N59.7Low62.7Low128 Ų128126.1 Ų126.168%0.68467%0.667SS**THydrogen-bonded Turntrans-73.4-13.6175.1-70.2-17.7000114.1I368 N374I368-N372 PolarHBondContact O-N 3.45Å; I368-N372 VanDerWaalsContact O-N 3.1Å; I368-N372 PolarHBondContact O-ND2 3.05Å; N372-N374 VanDerWaalsContact C-N 3.34Å
373S57.5Low61.4Low87 Ų87126.2 Ų126.261%0.60867%0.671SS**THydrogen-bonded Turntrans-87.8-1.4177.4-56.50000113.3S369 S370 E371 P375S369-S373 PolarHBondContact O-N 3.11Å; S369-S373 PolarHBondContact O-OG 3.37Å; S370-S373 PolarHBondContact O-N 3.14Å; E371-S373 PolarHBondContact O-N 3.3Å; S373-P375 WeakPolarHBondContact O-CD 3.46Å
374N51.9Low60.1Low143 Ų143125.4 Ų125.477%0.76568%0.675SS**  trans-112.867.2178.1-109.42.2000112.4E371 N372 G376E371-N374 PolarHBondContact O-N 3.42Å; N372-N374 VanDerWaalsContact C-N 3.34Å; N374-G376 PolarHBondContact O-N 2.72Å
375P48.3Very low58.9Low122 Ų122128.5 Ų128.579%0.79269%0.694SS**  trans-83.988.3164.633.5-28.2000108.3S373S373-P375 WeakPolarHBondContact O-CD 3.46Å
376G51.3Low57.7Low64 Ų64129.6 Ų129.666%0.6670%0.704SS**  trans-177.483.7-179.200000115.3N374N374-G376 PolarHBondContact O-N 2.72Å
377K48.4Very low56.4Low203 Ų203130.6 Ų130.688%0.88371%0.711SS**SBendtrans148.475.8135.8-80.5179.5-178.4-169.30111
378E43.4Very low54.9Low206 Ų206131.6 Ų131.696%0.96373%0.725SS**SBendtrans-147.872.6141.5-73.9-162.6172.100107.5
379A47.4Very low53.5Low84 Ų84135.2 Ų135.269%0.69475%0.748SS**SBendtrans-150.7126.9154.500000106.1
380E42.3Very low52.2Low200 Ų200141.4 Ų141.494%0.93577%0.774SS**  trans75.2116.8179.8-54.417517400112.9
381E44.3Very low50.7Low270 Ų270148 Ų148100%1.26280%0.801SS**  cis-151.6036.3-157.3172.9-158.800111.7

Retrieved 381 of 381 residues in 238.2 ms (Link to these results)