A0A087Y505_POEFO Loading...

Golgi phosphoprotein 3

AlphaFold DB , UniProt , Accession A0A087Y505, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 294 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
1M37Very low35.7Very low232 Ų232156 Ų156100%1.14387%0.865SS**  0133.90-68.2-178.2-159.700108.2
2T34.9Very low36.1Very low134 Ų134153.8 Ų153.882%0.82286%0.858SS**  trans55103.714551.70000118
3S31.5Very low36.5Very low101 Ų101156.9 Ų156.971%0.70686%0.862SS**  85.111088.4162.50000113.3
4L33.2Very low37.1Very low172 Ų172162.1 Ų162.190%0.90186%0.863SS**  trans-160.5126.4132.7-108.7137.2000111
5T38.3Very low37.9Very low130 Ų130166.3 Ų166.380%0.79886%0.862SS**  trans-77.8132.9-173.918.40000112.4
6Q37.2Very low39.2Very low197 Ų197161.7 Ų161.792%0.92184%0.843SS**  trans-133127.6155-99.9-177.8-7.100110
7R35.6Very low39.7Very low251 Ų251161.8 Ų161.895%0.94784%0.839SS**  trans-71.9132.6-174.9-75.2171.7167169.4-5.3111.4
8T37.6Very low40.3Very low141 Ų141156.7 Ų156.787%0.86582%0.824SS**  trans-75.2134161.339.60000110.3
9S36Very low41.2Very low118 Ų118154.1 Ų154.183%0.82581%0.81SS**  trans-122.297.2160.81750000107.1
10G36.6Very low41.9Very low66 Ų66156.7 Ų156.768%0.6881%0.808SS**  trans-103116.5168.100000108.7V12G10-V12 PolarHBondContact O-N 3.31Å
11L34.7Very low42.6Very low174 Ų174152.8 Ų152.891%0.91180%0.795SS**  trans-79.1101.8165.2-100.7154.3000108Q13L11-Q13 PolarHBondContact O-N 3.44Å
12V40.6Very low43.4Very low129 Ų129144.4 Ų144.478%0.78276%0.762SS**  trans-79.2107.6170176.10000108G10 R14G10-V12 PolarHBondContact O-N 3.31Å; V12-R14 PolarHBondContact O-N 3.18Å
13Q41.8Very low44.1Very low195 Ų195141 Ų14191%0.91175%0.748SS**  trans-73.8103.2173-124.8172.6-5.300109.2L11 R15L11-Q13 PolarHBondContact O-N 3.44Å; Q13-R15 PolarHBondContact O-N 3.29Å
14R44.6Very low45.1Very low229 Ų229139 Ų13986%0.86474%0.737SS**  trans-65.3108.8169.3-92-179.9173169.7-2.5109.1V12 T16V12-R14 PolarHBondContact O-N 3.18Å; R14-T16 PolarHBondContact O-N 3.18Å
15R50Low45.9Very low226 Ų226133.3 Ų133.385%0.85372%0.715SS**  trans-68112.3160-85.7-178.4173.2172.1-2.9108Q13Q13-R15 PolarHBondContact O-N 3.29Å
16T57.3Low46.3Very low92 Ų92134.5 Ų134.556%0.56471%0.711SS**  trans-71.9149.5178300000111.8R14 A18 I19R14-T16 PolarHBondContact O-N 3.18Å; T16-A18 PolarHBondContact O-N 3.04Å; T16-I19 PolarHBondContact O-N 3.15Å; T16-I19 VanDerWaalsContact O-N 3.15Å
17E49.1Very low46.7Very low164 Ų164133.2 Ų133.277%0.76670%0.703SS**Hα-helixtrans-51.8-27.4-179.7-79.3169.3139.700113.8I19 R20 S21E17-I19 PolarHBondContact O-N 3.06Å; E17-R20 PolarHBondContact O-N 3.05Å; E17-S21 PolarHBondContact O-N 2.93Å; E17-S21 PolarHBondContact O-OG 2.98Å; E17-S21 VanDerWaalsContact O-OG 3.06Å
18A49.6Very low47Very low70 Ų70129 Ų12958%0.57969%0.694SS**Hα-helixtrans-55.6-33.1177.400000114.2T16 A22T16-A18 PolarHBondContact O-N 3.04Å; A18-A22 PolarHBondContact O-N 3.17Å; A18-A22 VanDerWaalsContact O-N 3.16Å
19I57.1Low47.3Very low106 Ų106132.9 Ų132.954%0.54469%0.693SS.*Hα-helixtrans-79.4-31.5179.1-59175.2000111.1T16 E17 A23T16-I19 PolarHBondContact O-N 3.15Å; T16-I19 VanDerWaalsContact O-N 3.15Å; E17-I19 PolarHBondContact O-N 3.06Å; I19-A23 PolarHBondContact O-N 3.23Å
20R56.6Low47.6Very low207 Ų207134.4 Ų134.478%0.78169%0.691SS**Hα-helixtrans-72.4-37.5173.9-78.3-176.7177.4170.7-1.2111.5E17 A23 A24E17-R20 PolarHBondContact O-N 3.05Å; R20-A23 PolarHBondContact O-N 3.16Å; R20-A24 WeakPolarHBondContact O-CB 3.42Å; R20-A24 PolarHBondContact O-N 3.03Å
21S55.8Low47.9Very low75 Ų75136.2 Ų136.252%0.52469%0.693SS.*Hα-helixtrans-66.7-37176-53.90000112.2E17 A24 A25E17-S21 PolarHBondContact O-N 2.93Å; E17-S21 PolarHBondContact O-OG 2.98Å; E17-S21 VanDerWaalsContact O-OG 3.06Å; S21-A24 PolarHBondContact O-N 3.47Å; S21-A25 VanDerWaalsContact O-CB 3.3Å; S21-A25 WeakPolarHBondContact O-CB 3.3Å; S21-A25 PolarHBondContact O-N 3.49Å
22A53.2Low48.2Very low56 Ų56130.5 Ų130.546%0.46368%0.677SS.*Hα-helixtrans-67-42.8175.200000112.5A18 A24 A25 E26A18-A22 PolarHBondContact O-N 3.17Å; A18-A22 VanDerWaalsContact O-N 3.16Å; A22-A24 VanDerWaalsContact C-N 3.34Å; A22-A24 PolarHBondContact O-N 3.36Å; A22-A25 PolarHBondContact O-N 3.49Å; A22-E26 PolarHBondContact O-N 3.08Å; A22-E26 VanDerWaalsContact O-N 3.08Å
23A50.9Low48.1Very low63 Ų63126.7 Ų126.752%0.52166%0.664SS.*Hα-helixtrans-71-26.1177.600000113.6I19 R20I19-A23 PolarHBondContact O-N 3.23Å; R20-A23 PolarHBondContact O-N 3.16Å
24A51.4Low48Very low57 Ų57126.5 Ų126.547%0.47166%0.663SS.*Hα-helixtrans-76.9-38.3172.100000111.9R20 S21 A22 E26 K27 E28R20-A24 WeakPolarHBondContact O-CB 3.42Å; R20-A24 PolarHBondContact O-N 3.03Å; S21-A24 PolarHBondContact O-N 3.47Å; A22-A24 VanDerWaalsContact C-N 3.34Å; A22-A24 PolarHBondContact O-N 3.36Å; A24-E26 PolarHBondContact O-N 3.47Å; A24-K27 PolarHBondContact O-N 3.16Å; A24-E28 PolarHBondContact O-N 3.22Å; A24-E28 VanDerWaalsContact O-N 3.16Å
25A50Low47.8Very low53 Ų53124 Ų12444%0.43866%0.661SS.*Hα-helixtrans-69.1-29.2177.500000113.5S21 A22 R29S21-A25 VanDerWaalsContact O-CB 3.3Å; S21-A25 WeakPolarHBondContact O-CB 3.3Å; S21-A25 PolarHBondContact O-N 3.49Å; A22-A25 PolarHBondContact O-N 3.49Å; A25-R29 WeakPolarHBondContact O-CG 3.49Å
26E46.9Very low47.2Very low155 Ų155119.1 Ų119.172%0.72465%0.652SS**Hα-helixtrans-75.1-28.2171.7-77-174.216400112.6A22 A24A22-E26 PolarHBondContact O-N 3.08Å; A22-E26 VanDerWaalsContact O-N 3.08Å; A24-E26 PolarHBondContact O-N 3.47Å
27K44.7Very low46.2Very low171 Ų171122.5 Ų122.574%0.74366%0.661SS**Hα-helixtrans-84.3-21.9-178.4-149.2178-175.9-174.50113.8A24A24-K27 PolarHBondContact O-N 3.16Å
28E42.7Very low45.7Very low162 Ų162117.9 Ų117.976%0.75765%0.651SS**Hα-helixtrans-86.9-15.3172.6-73.4-161.5164.300113.9A24 D30A24-E28 PolarHBondContact O-N 3.22Å; A24-E28 VanDerWaalsContact O-N 3.16Å; E28-D30 VanDerWaalsContact C-N 3.33Å
29R43.3Very low45.3Very low223 Ų223124.4 Ų124.484%0.84266%0.661SS**THydrogen-bonded Turntrans-78.5-13175.9-83-179.5173.7-178.5-2.3114.4A25A25-R29 WeakPolarHBondContact O-CG 3.49Å
30D42.3Very low44.4Very low150 Ų150129.9 Ų129.980%0.80268%0.675SS**THydrogen-bonded Turntrans-104.10.9-174.3-160.240.3000113.7E28E28-D30 VanDerWaalsContact C-N 3.33Å
31S44.3Very low43.2Very low103 Ų103122.4 Ų122.472%0.7266%0.661SS**SBendtrans-133.719-174.472.50000115.9
32G40.4Very low42.4Very low55 Ų55126.7 Ų126.757%0.56767%0.673SS**SBendtrans-140.811.3-179.300000115.7
33G38.4Very low41.7Very low49 Ų49132.8 Ų132.851%0.50569%0.692SS.*SBendtrans-95.5-7-166.100000117.5
34E39.9Very low41.1Very low190 Ų190138.2 Ų138.289%0.88871%0.707SS**SBendtrans-99.6-18.7-172.8-70.8-173.8163.700114.7
35E40.8Very low40.4Very low178 Ų178144 Ų14483%0.83272%0.724SS**SBendtrans-101.3-23-177.9-68.4-171167.200114.4
36D36.2Very low40Very low123 Ų123148.5 Ų148.566%0.65874%0.741SS**SBendtrans-94.2-17.6-177.7-110.1-14.2000114.1A38D36-A38 VanDerWaalsContact C-N 3.35Å
37E36.5Very low39.7Very low162 Ų162148.1 Ų148.176%0.75774%0.744SS**SBendtrans-74.1-27.2169.8-74.2-151.6158.300112.3R39 R40 G41E37-R39 PolarHBondContact O-N 3.44Å; E37-R40 PolarHBondContact O-N 3.37Å; E37-G41 PolarHBondContact O-N 3.24Å
38A39.3Very low39.3Very low67 Ų67150.1 Ų150.155%0.55475%0.753SS**THydrogen-bonded Turntrans-67.5-18.6177.700000113.6D36D36-A38 VanDerWaalsContact C-N 3.35Å
39R41.5Very low39Very low208 Ų208145.7 Ų145.779%0.78575%0.75SS**THydrogen-bonded Turntrans-100-13.1178.5-95.1-180174.1167.70.9114.9E37E37-R39 PolarHBondContact O-N 3.44Å
40R36.5Very low38.7Very low221 Ų221139.8 Ų139.883%0.83474%0.735SS**THydrogen-bonded Turntrans-98.5-11.1178.4-107.1179.6173-168.1-2.3114E37E37-R40 PolarHBondContact O-N 3.37Å
41G32.5Very low38.9Very low49 Ų49138.9 Ų138.951%0.50574%0.741SS.*SBendtrans-81.8-9.6177.800000115.7E37E37-G41 PolarHBondContact O-N 3.24Å
42E38.9Very low39.5Very low166 Ų166143 Ų14378%0.77675%0.746SS**SBendtrans-96.7-3-172.7-66.6-172.1168.200114.8
43E38.6Very low40.7Very low183 Ų183145.5 Ų145.586%0.85574%0.743SS**SBendtrans-106.6-1.4-178.3-65.6-170.3168.800114.6
44E38.2Very low42.6Very low178 Ų178146.3 Ų146.383%0.83274%0.738SS**SBendtrans-126.223.3-174.3-68.2-166.5176.600115.7
45E37.1Very low44.9Very low178 Ų178145.1 Ų145.183%0.83273%0.725SS**SBendtrans-102.8-2.1174.9-79.9-162.7154.500115.8
46D40.3Very low47.5Very low147 Ų147137.3 Ų137.379%0.78669%0.689SS**SBendtrans-93.24-178.4-95.8-5.9000115.2
47D41Very low50.4Low148 Ų148131.5 Ų131.579%0.79166%0.658SS**SBendtrans-124.233.1-175-153.430.4000114.6
48K37.6Very low53.3Low213 Ų213123.8 Ų123.893%0.92662%0.622SS**  trans-124.961.7168.1-91.2-178.3178.9167.80111.8
49G34.9Very low56Low69 Ų69120.6 Ų120.671%0.71160%0.596SS**SBendtrans-143.190.3168.500000110.5
50D37.4Very low58.6Low98 Ų98110.7 Ų110.752%0.52456%0.558SS.*  trans41.892.7169-151.311.2000117.5K52 E53D50-K52 PolarHBondContact O-N 3.08Å; D50-E53 HydrophobicContact CB-CG 4.1Å; D50-E53 PolarHBondContact O-N 2.87Å; D50-E53 VanDerWaalsContact O-N 3.13Å; D50-E53 WeakPolarHBondContact OD2-CG 3.38Å
51S47.2Very low61.5Low132 Ų132100.8 Ų100.892%0.92352%0.522SS*.THydrogen-bonded Turntrans-64.212.4175.550.40000115.2
52K55.7Low64.5Low189 Ų18998.5 Ų98.582%0.82250%0.498SS*.THydrogen-bonded Turntrans-116.9-6.3175.3-71-174.9179.1178.50114.5D50D50-K52 PolarHBondContact O-N 3.08Å
53E65.4Low67.1Low108 Ų10890.9 Ų90.951%0.50546%0.462SS..SBendtrans-89.1136.6-179.2-67.8-158.9135.200112.8D50 R55 R208D50-E53 HydrophobicContact CB-CG 4.1Å; D50-E53 PolarHBondContact O-N 2.87Å; D50-E53 VanDerWaalsContact O-N 3.13Å; D50-E53 WeakPolarHBondContact OD2-CG 3.38Å; E53-R55 PolarHBondContact O-N 2.95Å; E53-R208 IonicContact OE1-NH1 2.85Å; E53-R208 PolarHBondContact OE1-NH1 2.96Å
54T79.1Confident69.7Low65 Ų6582.2 Ų82.240%0.39942%0.422SS..  trans-62.2106.5174.2-55.80000109.9L56 K180 V182 I205T54-L56 HydrophobicContact CG2-CD2 4.17Å; T54-L56 PolarHBondContact O-N 3.43Å; T54-K180 HydrophobicContact CG2-CB 3.74Å; T54-K180 HydrophobicContact CG2-CD 4.28Å; T54-K180 HydrophobicContact CG2-CG 4.24Å; T54-V182 HydrophobicContact CG2-CG2 4.41Å; T54-I205 HydrophobicContact CG2-CD1 4.39Å
55R88.1Confident72.4Confident166 Ų16673.9 Ų73.963%0.62638%0.383SS*.  trans-76.7114.6-179.8-168.3172.9-180169.22.9111.4E53 K180E53-R55 PolarHBondContact O-N 2.95Å; R55-K180 PolarHBondContact O-NZ 2.95Å
56L95.1Very high74.9Confident13 Ų1365.6 Ų65.67%0.06835%0.346CS..  trans-96.6144.7176.1-59.1-176.8000111.8T54 E60 E61 L64 L177 K180 V182 I205 R231T54-L56 HydrophobicContact CG2-CD2 4.17Å; T54-L56 PolarHBondContact O-N 3.43Å; L56-E60 WeakPolarHBondContact CA-OE2 2.94Å; L56-E60 HydrophobicContact CB-CB 4.22Å; L56-E60 HydrophobicContact CD2-CB 4.5Å; L56-E61 HydrophobicContact CB-CG 3.76Å; L56-E61 HydrophobicContact CD1-CG 4.25Å; L56-L64 HydrophobicContact CD1-CD1 3.45Å; L56-L64 VanDerWaalsContact CD1-CD1 3.45Å; L56-L177 HydrophobicContact CD2-CD2 3.91Å; L56-K180 HydrophobicContact CD2-CD 3.85Å; L56-V182 HydrophobicContact CD2-CG2 4.11Å; L56-I205 HydrophobicContact CD1-CG2 3.8Å; L56-R231 PolarHBondContact O-NH2 2.69Å
57T97.1Very high77.2Confident2 Ų259.2 Ų59.21%0.01231%0.311CS..  trans-77.2160.8170.268.50000110.7M59 E60 E61 R231T57-M59 HydrophobicContact CG2-CE 4.13Å; T57-M59 PolarHBondContact O-N 3.44Å; T57-M59 WeakPolarHBondContact OG1-CE 3.35Å; T57-E60 PolarHBondContact N-OE2 2.88Å; T57-E60 WeakPolarHBondContact O-CB 3.17Å; T57-E60 PolarHBondContact O-N 2.79Å; T57-E60 VanDerWaalsContact O-N 3.1Å; T57-E60 VanDerWaalsContact OG1-CG 3.28Å; T57-E60 WeakPolarHBondContact OG1-CG 3.42Å; T57-E60 PolarHBondContact OG1-N 3.42Å; T57-E61 WeakPolarHBondContact O-CG 3.33Å; T57-E61 PolarHBondContact O-N 3.32Å; T57-R231 VanDerWaalsContact C-NH2 3.26Å
58L97.1Very high79.2Confident0 Ų056.6 Ų56.60%029%0.293CS..Hα-helixtrans-58.6-37.2176.5-75.9172.8000111.3E60 E61 V62 C88 V91 E92 L95 R231 L235L58-E60 VanDerWaalsContact C-N 3.34Å; L58-E60 PolarHBondContact O-N 2.79Å; L58-E61 PolarHBondContact O-N 3.36Å; L58-V62 WeakPolarHBondContact O-CB 3.42Å; L58-V62 WeakPolarHBondContact O-CG2 3.49Å; L58-V62 PolarHBondContact O-N 3.08Å; L58-C88 HydrophobicContact CB-CB 3.89Å; L58-V91 HydrophobicContact CD1-CB 4.1Å; L58-V91 HydrophobicContact CD1-CG1 3.72Å; L58-E92 WeakPolarHBondContact CG-OE2 3.48Å; L58-E92 PolarHBondContact N-OE2 2.98Å; L58-L95 HydrophobicContact CD1-CD1 4.28Å; L58-R231 HydrophobicContact CD2-CG 3.95Å; L58-R231 VanDerWaalsContact N-NH2 3.1Å; L58-L235 HydrophobicContact CD2-CB 3.91Å; L58-L235 HydrophobicContact CD2-CD1 4.48Å
59M96.8Very high81.2Confident0 Ų050.6 Ų50.60%027%0.271CS..Hα-helixtrans-59.8-44.9175.6-57.28174.900111.7T57 L63 L85 C88 M89 E92 L129 L173T57-M59 HydrophobicContact CG2-CE 4.13Å; T57-M59 PolarHBondContact O-N 3.44Å; T57-M59 WeakPolarHBondContact OG1-CE 3.35Å; M59-L63 VanDerWaalsContact O-CB 3.27Å; M59-L63 WeakPolarHBondContact O-CB 3.46Å; M59-L63 PolarHBondContact O-N 3.29Å; M59-L85 HydrophobicContact CB-CD2 3.89Å; M59-L85 HydrophobicContact CG-CD2 4.49Å; M59-L85 VanDerWaalsContact O-CD2 3.24Å; M59-L85 WeakPolarHBondContact O-CD2 3.34Å; M59-C88 HydrophobicContact CB-CB 4.46Å; M59-C88 HydrophobicContact CG-CB 3.73Å; M59-C88 HydrophobicContact SD-CB 4.04Å; M59-M89 HydrophobicContact CE-CG 4.1Å; M59-M89 HydrophobicContact CG-CE 4.27Å; M59-M89 HydrophobicContact CG-CG 3.68Å; M59-M89 HydrophobicContact SD-CB 4.38Å; M59-M89 HydrophobicContact SD-CG 3.78Å; M59-E92 HydrophobicContact SD-CB 4.22Å; M59-E92 HydrophobicContact SD-CG 4.42Å; M59-L129 HydrophobicContact CE-CD1 4.11Å; M59-L129 HydrophobicContact CE-CD2 3.44Å; M59-L129 VanDerWaalsContact CE-CD2 3.44Å; M59-L129 HydrophobicContact CE-CG 3.64Å; M59-L129 HydrophobicContact SD-CD2 4.04Å; M59-L173 HydrophobicContact CB-CD1 4.2Å; M59-L173 HydrophobicContact CB-CD2 3.75Å
60E96.4Very high82.9Confident0 Ų057.8 Ų57.80%028%0.277CS..Hα-helixtrans-67.5-40.6178.8-73.6166.4173.200111.9L56 T57 L58 L63 L64 L173 N176 L177 K180L56-E60 WeakPolarHBondContact CA-OE2 2.94Å; L56-E60 HydrophobicContact CB-CB 4.22Å; L56-E60 HydrophobicContact CD2-CB 4.5Å; T57-E60 PolarHBondContact N-OE2 2.88Å; T57-E60 WeakPolarHBondContact O-CB 3.17Å; T57-E60 PolarHBondContact O-N 2.79Å; T57-E60 VanDerWaalsContact O-N 3.1Å; T57-E60 VanDerWaalsContact OG1-CG 3.28Å; T57-E60 WeakPolarHBondContact OG1-CG 3.42Å; T57-E60 PolarHBondContact OG1-N 3.42Å; L58-E60 VanDerWaalsContact C-N 3.34Å; L58-E60 PolarHBondContact O-N 2.79Å; E60-L63 PolarHBondContact O-N 3.42Å; E60-L64 WeakPolarHBondContact O-CB 3.28Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.49Å; E60-L64 PolarHBondContact O-N 2.76Å; E60-L173 HydrophobicContact CG-CD2 4.17Å; E60-N176 WeakPolarHBondContact OE1-CB 3.46Å; E60-L177 HydrophobicContact CB-CD2 3.89Å; E60-L177 HydrophobicContact CB-CG 4.43Å; E60-L177 HydrophobicContact CG-CD2 3.97Å; E60-L177 HydrophobicContact CG-CG 4.13Å; E60-K180 WeakPolarHBondContact OE1-CE 3.49Å; E60-K180 IonicContact OE1-NZ 2.69Å; E60-K180 PolarHBondContact OE1-NZ 3.18Å; E60-K180 IonicContact OE2-NZ 2.96Å; E60-K180 PolarHBondContact OE2-NZ 3.39Å
61E96.6Very high84.4Confident13 Ų1357.7 Ų57.76%0.06127%0.273CS..Hα-helixtrans-64.3-48.2177-68.7-174126.500111.5L56 T57 L58 L63 L64 L65 L209 K212 R231 L235L56-E61 HydrophobicContact CB-CG 3.76Å; L56-E61 HydrophobicContact CD1-CG 4.25Å; T57-E61 WeakPolarHBondContact O-CG 3.33Å; T57-E61 PolarHBondContact O-N 3.32Å; L58-E61 PolarHBondContact O-N 3.36Å; E61-L63 VanDerWaalsContact C-N 3.3Å; E61-L63 PolarHBondContact O-N 2.97Å; E61-L64 PolarHBondContact O-N 2.89Å; E61-L65 WeakPolarHBondContact O-CG 3.37Å; E61-L65 PolarHBondContact O-N 2.71Å; E61-L209 HydrophobicContact CB-CD1 3.96Å; E61-L209 HydrophobicContact CB-CD2 4.04Å; E61-L209 HydrophobicContact CG-CD1 3.97Å; E61-L209 HydrophobicContact CG-CD2 4.35Å; E61-L209 WeakPolarHBondContact O-CD2 3.3Å; E61-K212 IonicContact OE1-NZ 3.37Å; E61-K212 PolarHBondContact OE1-NZ 3.48Å; E61-K212 IonicContact OE2-NZ 3.93Å; E61-R231 IonicContact OE2-NE 3.89Å; E61-R231 IonicContact OE2-NH2 2.84Å; E61-L235 HydrophobicContact CB-CD1 3.74Å
62V95.9Very high85.3Confident0 Ų051.6 Ų51.60%023%0.231CC..Hα-helixtrans-60.2-41.8175.3170.20000110.9L58 L64 L65 G66 L85 L235 A239 V244L58-V62 WeakPolarHBondContact O-CB 3.42Å; L58-V62 WeakPolarHBondContact O-CG2 3.49Å; L58-V62 PolarHBondContact O-N 3.08Å; V62-L64 PolarHBondContact O-N 3.48Å; V62-L65 PolarHBondContact O-N 2.66Å; V62-G66 PolarHBondContact O-N 3.38Å; V62-L85 HydrophobicContact CB-CD2 4.24Å; V62-L85 HydrophobicContact CG1-CD2 4.15Å; V62-L235 HydrophobicContact CG2-CD1 3.92Å; V62-A239 HydrophobicContact CG2-CB 4.49Å; V62-V244 HydrophobicContact CG1-CG2 3.89Å
63L94.1Very high85.8Confident7 Ų744.9 Ų44.94%0.03720%0.201CC..Hα-helixtrans-61.9-42.8176.4-172.969.3000112.1M59 E60 E61 L65 G66 L67 T74 W77 L173 L177M59-L63 VanDerWaalsContact O-CB 3.27Å; M59-L63 WeakPolarHBondContact O-CB 3.46Å; M59-L63 PolarHBondContact O-N 3.29Å; E60-L63 PolarHBondContact O-N 3.42Å; E61-L63 VanDerWaalsContact C-N 3.3Å; E61-L63 PolarHBondContact O-N 2.97Å; L63-L65 VanDerWaalsContact C-N 3.35Å; L63-L65 PolarHBondContact O-N 3.35Å; L63-G66 PolarHBondContact O-N 2.89Å; L63-L67 PolarHBondContact O-N 2.79Å; L63-T74 HydrophobicContact CD1-CG2 3.34Å; L63-T74 HydrophobicContact CG-CG2 4.29Å; L63-W77 HydrophobicContact CD1-CZ3 4.13Å; L63-L173 HydrophobicContact CD2-CB 3.56Å; L63-L173 HydrophobicContact CD2-CD1 4.11Å; L63-L173 HydrophobicContact CD2-CG 4.47Å; L63-L177 HydrophobicContact CD2-CD1 3.93Å
64L93.6Very high85.6Confident0 Ų040.2 Ų40.20%018%0.18CC..Hα-helixtrans-66.5-33.4178.7-76176.4000113.1L56 E60 E61 V62 G66 L67 L177 V182 L183 L200 I205 K206 L209L56-L64 HydrophobicContact CD1-CD1 3.45Å; L56-L64 VanDerWaalsContact CD1-CD1 3.45Å; E60-L64 WeakPolarHBondContact O-CB 3.28Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.49Å; E60-L64 PolarHBondContact O-N 2.76Å; E61-L64 PolarHBondContact O-N 2.89Å; V62-L64 PolarHBondContact O-N 3.48Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 2.79Å; L64-L67 HydrophobicContact CD2-CD2 4.16Å; L64-L67 PolarHBondContact O-N 3.27Å; L64-L177 HydrophobicContact CD1-CD2 4.09Å; L64-L177 HydrophobicContact CD2-CD1 3.98Å; L64-L177 HydrophobicContact CD2-CD2 4.43Å; L64-L177 HydrophobicContact CG-CD1 4.14Å; L64-L177 HydrophobicContact CG-CD2 4.25Å; L64-V182 HydrophobicContact CD1-CG1 4.01Å; L64-V182 HydrophobicContact CD2-CG1 3.84Å; L64-L183 HydrophobicContact CD2-CD2 4.36Å; L64-L200 HydrophobicContact CD2-CD1 4.31Å; L64-I205 HydrophobicContact CD1-CG2 4.48Å; L64-K206 VanDerWaalsContact O-CE 3.27Å; L64-K206 WeakPolarHBondContact O-CE 3.38Å; L64-L209 HydrophobicContact CB-CD2 3.87Å; L64-L209 HydrophobicContact CD1-CD2 4.39Å
65L93.4Very high84.6Confident3 Ų339.2 Ų39.22%0.01618%0.176CC..Hα-helixtrans-64.4-34.5173.1-69.1178.2000111.9E61 V62 L63 L209 V210 V213 L235 A239 V244 N247 A248E61-L65 WeakPolarHBondContact O-CG 3.37Å; E61-L65 PolarHBondContact O-N 2.71Å; V62-L65 PolarHBondContact O-N 2.66Å; L63-L65 VanDerWaalsContact C-N 3.35Å; L63-L65 PolarHBondContact O-N 3.35Å; L65-L209 HydrophobicContact CD2-CD2 4.04Å; L65-L209 HydrophobicContact CD2-CG 3.99Å; L65-L209 HydrophobicContact CG-CD2 4.05Å; L65-L209 HydrophobicContact CG-CG 4.38Å; L65-V210 HydrophobicContact CD2-CG2 4.08Å; L65-V213 HydrophobicContact CD1-CG2 4.44Å; L65-L235 HydrophobicContact CD1-CD1 4.34Å; L65-A239 HydrophobicContact CD1-CB 3.85Å; L65-V244 HydrophobicContact CB-CB 4.29Å; L65-V244 HydrophobicContact CB-CG2 4.02Å; L65-N247 VanDerWaalsContact O-CB 3.32Å; L65-N247 WeakPolarHBondContact O-CB 3.38Å; L65-N247 PolarHBondContact O-ND2 2.71Å; L65-A248 HydrophobicContact CD2-CB 4.11Å
66G89.8Confident83.3Confident5 Ų539.2 Ų39.25%0.05218%0.18CC..Hα-helixtrans-86.8-8176.900000115.6V62 L63 L64 T74 S75V62-G66 PolarHBondContact O-N 3.38Å; L63-G66 PolarHBondContact O-N 2.89Å; L64-G66 VanDerWaalsContact C-N 3.29Å; L64-G66 PolarHBondContact O-N 2.79Å; G66-T74 WeakPolarHBondContact O-CA 3.31Å; G66-S75 PolarHBondContact O-N 3.1Å
67L88.5Confident82.6Confident12 Ų1242.6 Ų42.66%0.06319%0.192CC..BIsolated β-bridgetrans-80.1134.5-176-167.277.3000111.3L63 L64 T74 L183 K206L63-L67 PolarHBondContact O-N 2.79Å; L64-L67 HydrophobicContact CD2-CD2 4.16Å; L64-L67 PolarHBondContact O-N 3.27Å; L67-T74 HydrophobicContact CD1-CG2 4.49Å; L67-L183 HydrophobicContact CD2-CD1 4.4Å; L67-L183 HydrophobicContact CD2-CD2 3.51Å; L67-K206 PolarHBondContact O-NZ 3.48Å
68K82.4Confident82.1Confident93 Ų9344.8 Ų44.840%0.40420%0.204SC..  trans-83.1137.3166.1-58.8-170.6173.4-176.40111.1R70 E71 G72 Y73 S75K68-R70 PolarHBondContact O-N 2.77Å; K68-E71 HydrophobicContact CB-CB 4.38Å; K68-E71 WeakPolarHBondContact CB-OE2 3.22Å; K68-G72 PolarHBondContact O-N 3.39Å; K68-Y73 PolarHBondContact N-O 2.76Å; K68-S75 WeakPolarHBondContact CE-OG 3.4Å; K68-S75 WeakPolarHBondContact CG-OG 3.42Å
69D79.6Confident81.6Confident87 Ų8751 Ų5147%0.46524%0.237SC..THydrogen-bonded Turntrans-62.2-42.6-169.5-64.5-12.4000113.4L200 K206D69-L200 HydrophobicContact CB-CD2 4.43Å; D69-L200 PolarHBondContact O-N 2.94Å; D69-K206 WeakPolarHBondContact OD1-CD 3.02Å; D69-K206 WeakPolarHBondContact OD1-CE 3.46Å; D69-K206 IonicContact OD1-NZ 3.28Å; D69-K206 PolarHBondContact OD1-NZ 3.24Å
70R71.3Confident81.3Confident221 Ų22153.8 Ų53.883%0.83426%0.256SS*.THydrogen-bonded Turntrans-88.9-39.8-174.1-77.4-172.7173.1-177.2-1.1113.3K68 G72K68-R70 PolarHBondContact O-N 2.77Å; R70-G72 VanDerWaalsContact C-N 3.32Å
71E69.9Low81Confident96 Ų9653.9 Ų53.945%0.44926%0.257SS..THydrogen-bonded Turntrans-77.9-21.7-173.2-61.888.6158.200112K68 Y73K68-E71 HydrophobicContact CB-CB 4.38Å; K68-E71 WeakPolarHBondContact CB-OE2 3.22Å; E71-Y73 WeakPolarHBondContact O-CD2 3.49Å; E71-Y73 PolarHBondContact O-N 3.39Å
72G65.9Low80.9Confident4 Ų454.1 Ų54.14%0.04126%0.259CS..  trans66.318.6176.700000114K68 R70 H198K68-G72 PolarHBondContact O-N 3.39Å; R70-G72 VanDerWaalsContact C-N 3.32Å; G72-H198 CarbonylContact C-O 3.49Å; G72-H198 VanDerWaalsContact CA-C 3.43Å; G72-H198 WeakPolarHBondContact CA-O 3.38Å
73Y66.6Low80.8Confident47 Ų4755 Ų5518%0.18427%0.266CS..SBendtrans-129.1149.7173.9-58.7-50.7000109.8K68 E71 S75 M195 T196 T197K68-Y73 PolarHBondContact N-O 2.76Å; E71-Y73 WeakPolarHBondContact O-CD2 3.49Å; E71-Y73 PolarHBondContact O-N 3.39Å; Y73-S75 PolarHBondContact O-N 3.49Å; Y73-M195 HydrophobicContact CE2-CE 3.4Å; Y73-M195 HydrophobicContact CE2-SD 4Å; Y73-M195 VanDerWaalsContact OH-CE 3.25Å; Y73-M195 WeakPolarHBondContact OH-CE 3.3Å; Y73-M195 WeakPolarHBondContact OH-CG 3.48Å; Y73-M195 PolarHBondContact OH-SD 3.43Å; Y73-T196 VanDerWaalsContact OH-C 3.23Å; Y73-T196 PolarHBondContact OH-O 3.31Å; Y73-T197 HydrophobicContact CE1-CG2 4.33Å; Y73-T197 HydrophobicContact CE2-CG2 3.5Å; Y73-T197 VanDerWaalsContact OH-CA 3.3Å; Y73-T197 WeakPolarHBondContact OH-CA 3.48Å; Y73-T197 WeakPolarHBondContact OH-CG2 3.38Å; Y73-T197 PolarHBondContact OH-N 3.34Å
74T60.2Low80.9Confident10 Ų1054.7 Ų54.76%0.06126%0.264CS..BIsolated β-bridgetrans-62.9131.3168.449.40000108.7L63 G66 L67 F76 I81L63-T74 HydrophobicContact CD1-CG2 3.34Å; L63-T74 HydrophobicContact CG-CG2 4.29Å; G66-T74 WeakPolarHBondContact O-CA 3.31Å; L67-T74 HydrophobicContact CD1-CG2 4.49Å; T74-F76 PolarHBondContact O-N 3.33Å; T74-F76 VanDerWaalsContact O-N 3.08Å; T74-I81 HydrophobicContact CG2-CD1 4.48Å
75S57.3Low81Confident45 Ų4554.7 Ų54.732%0.31526%0.264SS..SBendtrans-49.2-40.4-176.8-55.20000112.2G66 K68 Y73G66-S75 PolarHBondContact O-N 3.1Å; K68-S75 WeakPolarHBondContact CE-OG 3.4Å; K68-S75 WeakPolarHBondContact CG-OG 3.42Å; Y73-S75 PolarHBondContact O-N 3.49Å
76F62.5Low81.2Confident166 Ų16655 Ų5573%0.72827%0.265SS*.  trans-149.8113.8174.2-67.8-80.7000109T74 N78T74-F76 PolarHBondContact O-N 3.33Å; T74-F76 VanDerWaalsContact O-N 3.08Å; F76-N78 PolarHBondContact O-N 3.42Å
77W79.9Confident81.6Confident83 Ų8354.8 Ų54.831%0.31426%0.263SS..  trans-79.5106.5164.5-176.2-84.4000107.2L63 I81 L85 V169 R170L63-W77 HydrophobicContact CD1-CZ3 4.13Å; W77-I81 HydrophobicContact CD2-CG2 4.18Å; W77-I81 HydrophobicContact CE3-CG2 4.18Å; W77-I81 HydrophobicContact CG-CG2 4.45Å; W77-L85 HydrophobicContact CH2-CD1 3.28Å; W77-L85 HydrophobicContact CZ2-CD1 4.26Å; W77-L85 HydrophobicContact CZ3-CD1 3.56Å; W77-V169 HydrophobicContact CH2-CB 4.44Å; W77-V169 HydrophobicContact CH2-CG1 4.23Å; W77-R170 HydrophobicContact CD2-CB 4.45Å; W77-R170 HydrophobicContact CE3-CB 4.02Å; W77-R170 HydrophobicContact CE3-CG 4.12Å; W77-R170 HydrophobicContact CH2-CB 3.98Å; W77-R170 HydrophobicContact CZ2-CB 4.44Å; W77-R170 HydrophobicContact CZ3-CB 3.77Å; W77-R170 HydrophobicContact CZ3-CG 4.15Å
78N85.8Confident82Confident48 Ų4854.2 Ų54.226%0.25726%0.26SS..  trans-118.7178.1-177.965.626.2000111.2F76 C80 I81 S82F76-N78 PolarHBondContact O-N 3.42Å; N78-C80 VanDerWaalsContact C-N 3.29Å; N78-C80 PolarHBondContact O-N 3.37Å; N78-C80 WeakPolarHBondContact OD1-CA 3.3Å; N78-C80 WeakPolarHBondContact OD1-CB 3.23Å; N78-C80 PolarHBondContact OD1-N 3.15Å; N78-C80 VanDerWaalsContact OD1-N 3.09Å; N78-I81 WeakPolarHBondContact O-CG2 3.27Å; N78-I81 WeakPolarHBondContact OD1-CG2 3.2Å; N78-I81 PolarHBondContact OD1-N 3.37Å; N78-S82 WeakPolarHBondContact O-CB 3.3Å; N78-S82 PolarHBondContact O-N 2.72Å; N78-S82 VanDerWaalsContact O-N 3.07Å
79D86.4Confident82.8Confident131 Ų13149.8 Ų49.870%0.70124%0.241SC*.Hα-helixtrans-67.6-30.7179.9-63.1-23.8000112S82 S83D79-S82 PolarHBondContact O-N 2.97Å; D79-S83 WeakPolarHBondContact O-CB 3.23Å; D79-S83 PolarHBondContact O-N 2.89Å; D79-S83 PolarHBondContact O-OG 2.69Å
80C91.1Very high83.7Confident59 Ų5945.6 Ų45.640%0.39922%0.218SC..Hα-helixtrans-64.4-50.2177.3-56.10000112.1N78 S82 S83 G84N78-C80 VanDerWaalsContact C-N 3.29Å; N78-C80 PolarHBondContact O-N 3.37Å; N78-C80 WeakPolarHBondContact OD1-CA 3.3Å; N78-C80 WeakPolarHBondContact OD1-CB 3.23Å; N78-C80 PolarHBondContact OD1-N 3.15Å; N78-C80 VanDerWaalsContact OD1-N 3.09Å; C80-S82 VanDerWaalsContact C-N 3.34Å; C80-S83 PolarHBondContact O-OG 3.27Å; C80-S83 VanDerWaalsContact O-OG 3.04Å; C80-G84 WeakPolarHBondContact O-CA 3.48Å; C80-G84 PolarHBondContact O-N 3Å
81I91.2Very high84.9Confident2 Ų235.2 Ų35.21%0.0118%0.179CC..Hα-helixtrans-68.3-36.7176.4-164.9173.3000110.8T74 W77 N78 G84 L85 V244T74-I81 HydrophobicContact CG2-CD1 4.48Å; W77-I81 HydrophobicContact CD2-CG2 4.18Å; W77-I81 HydrophobicContact CE3-CG2 4.18Å; W77-I81 HydrophobicContact CG-CG2 4.45Å; N78-I81 WeakPolarHBondContact O-CG2 3.27Å; N78-I81 WeakPolarHBondContact OD1-CG2 3.2Å; N78-I81 PolarHBondContact OD1-N 3.37Å; I81-G84 PolarHBondContact O-N 2.66Å; I81-L85 HydrophobicContact CG1-CD1 4.18Å; I81-L85 HydrophobicContact CG1-CG 4.24Å; I81-L85 WeakPolarHBondContact O-CB 3.34Å; I81-L85 WeakPolarHBondContact O-CG 3.41Å; I81-L85 PolarHBondContact O-N 3.27Å; I81-V244 HydrophobicContact CD1-CG1 4.05Å
82S92.7Very high86.2Confident17 Ų1730.7 Ų30.712%0.11916%0.158CC..Hα-helixtrans-60.6-50.8178-173.40000111.4N78 D79 C80 R86N78-S82 WeakPolarHBondContact O-CB 3.3Å; N78-S82 PolarHBondContact O-N 2.72Å; N78-S82 VanDerWaalsContact O-N 3.07Å; D79-S82 PolarHBondContact O-N 2.97Å; C80-S82 VanDerWaalsContact C-N 3.34Å; S82-R86 WeakPolarHBondContact O-CD 3.48Å; S82-R86 PolarHBondContact O-NH1 3.32Å; S82-R86 PolarHBondContact OG-NH1 2.69Å
83S94.6Very high87.8Confident20 Ų2030.5 Ų30.514%0.1416%0.156CC..Hα-helixtrans-67.9-43.3177.357.10000111.9D79 C80 L85 R86 G87 F292D79-S83 WeakPolarHBondContact O-CB 3.23Å; D79-S83 PolarHBondContact O-N 2.89Å; D79-S83 PolarHBondContact O-OG 2.69Å; C80-S83 PolarHBondContact O-OG 3.27Å; C80-S83 VanDerWaalsContact O-OG 3.04Å; S83-L85 VanDerWaalsContact C-N 3.3Å; S83-L85 PolarHBondContact O-N 3.05Å; S83-R86 WeakPolarHBondContact O-CA 3.47Å; S83-R86 WeakPolarHBondContact O-CB 3.35Å; S83-R86 PolarHBondContact O-N 3.3Å; S83-G87 PolarHBondContact O-N 2.94Å; S83-F292 WeakPolarHBondContact O-CZ 3.33Å
84G95.6Very high89.2Confident0 Ų028.6 Ų28.60%015%0.15CC..Hα-helixtrans-56.7-39.1176.500000113.4C80 I81 R86 G87 C88 S242C80-G84 WeakPolarHBondContact O-CA 3.48Å; C80-G84 PolarHBondContact O-N 3Å; I81-G84 PolarHBondContact O-N 2.66Å; G84-R86 VanDerWaalsContact C-N 3.34Å; G84-R86 PolarHBondContact O-N 3.46Å; G84-G87 WeakPolarHBondContact O-CA 3.47Å; G84-G87 PolarHBondContact O-N 3.2Å; G84-C88 PolarHBondContact O-N 3.36Å; G84-C88 PolarHBondContact O-SG 3.2Å; G84-S242 WeakPolarHBondContact CA-OG 3.48Å
85L96.7Very high90.9Very high0 Ų030.4 Ų30.40%016%0.16CC..Hα-helixtrans-65.7-33173.9-70.2171.1000112.8M59 V62 W77 I81 S83 C88 M89 L173M59-L85 HydrophobicContact CB-CD2 3.89Å; M59-L85 HydrophobicContact CG-CD2 4.49Å; M59-L85 VanDerWaalsContact O-CD2 3.24Å; M59-L85 WeakPolarHBondContact O-CD2 3.34Å; V62-L85 HydrophobicContact CB-CD2 4.24Å; V62-L85 HydrophobicContact CG1-CD2 4.15Å; W77-L85 HydrophobicContact CH2-CD1 3.28Å; W77-L85 HydrophobicContact CZ2-CD1 4.26Å; W77-L85 HydrophobicContact CZ3-CD1 3.56Å; I81-L85 HydrophobicContact CG1-CD1 4.18Å; I81-L85 HydrophobicContact CG1-CG 4.24Å; I81-L85 WeakPolarHBondContact O-CB 3.34Å; I81-L85 WeakPolarHBondContact O-CG 3.41Å; I81-L85 PolarHBondContact O-N 3.27Å; S83-L85 VanDerWaalsContact C-N 3.3Å; S83-L85 PolarHBondContact O-N 3.05Å; L85-C88 WeakPolarHBondContact O-CB 3.48Å; L85-C88 PolarHBondContact O-N 3.44Å; L85-M89 WeakPolarHBondContact O-CG 3.39Å; L85-M89 PolarHBondContact O-N 2.83Å; L85-L173 HydrophobicContact CD1-CD1 3.94Å; L85-L173 HydrophobicContact CD2-CD1 4.18Å
86R97.6Very high92.7Very high9 Ų931 Ų313%0.03416%0.155CC..Hα-helixtrans-71-37.7173.5-83.170.7-178.8-173.4-6.2110.7S82 S83 G84 C88 M89 L90 I149 L152 L166S82-R86 WeakPolarHBondContact O-CD 3.48Å; S82-R86 PolarHBondContact O-NH1 3.32Å; S82-R86 PolarHBondContact OG-NH1 2.69Å; S83-R86 WeakPolarHBondContact O-CA 3.47Å; S83-R86 WeakPolarHBondContact O-CB 3.35Å; S83-R86 PolarHBondContact O-N 3.3Å; G84-R86 VanDerWaalsContact C-N 3.34Å; G84-R86 PolarHBondContact O-N 3.46Å; R86-C88 VanDerWaalsContact C-N 3.32Å; R86-C88 PolarHBondContact O-N 2.92Å; R86-M89 WeakPolarHBondContact O-CB 3.28Å; R86-M89 PolarHBondContact O-N 3.48Å; R86-L90 PolarHBondContact O-N 2.8Å; R86-L90 VanDerWaalsContact O-N 3.13Å; R86-I149 HydrophobicContact CB-CG2 4.32Å; R86-L152 HydrophobicContact CB-CB 4.39Å; R86-L152 HydrophobicContact CG-CB 3.47Å; R86-L152 VanDerWaalsContact CG-CB 3.47Å; R86-L152 PolarHBondContact NE-O 3.14Å; R86-L152 VanDerWaalsContact NE-O 3.15Å; R86-L166 PolarHBondContact NH2-O 3.25Å; R86-L166 VanDerWaalsContact NH2-O 3.1Å
87G97.3Very high94.3Very high0 Ų024.5 Ų24.50%013%0.134CC..Hα-helixtrans-55.1-47.7167.600000111.9S83 G84 M89 L90 V91S83-G87 PolarHBondContact O-N 2.94Å; G84-G87 WeakPolarHBondContact O-CA 3.47Å; G84-G87 PolarHBondContact O-N 3.2Å; G87-M89 VanDerWaalsContact C-N 3.32Å; G87-M89 PolarHBondContact O-N 3.29Å; G87-L90 PolarHBondContact O-N 2.96Å; G87-V91 WeakPolarHBondContact O-CG2 3.27Å; G87-V91 PolarHBondContact O-N 3.12Å
88C98.1Very high95.1Very high0 Ų023 Ų230%013%0.129CC..Hα-helixtrans-57.1-42.7175.2-65.80000112.4L58 M59 G84 L85 R86 L90 V91 E92 L238L58-C88 HydrophobicContact CB-CB 3.89Å; M59-C88 HydrophobicContact CB-CB 4.46Å; M59-C88 HydrophobicContact CG-CB 3.73Å; M59-C88 HydrophobicContact SD-CB 4.04Å; G84-C88 PolarHBondContact O-N 3.36Å; G84-C88 PolarHBondContact O-SG 3.2Å; L85-C88 WeakPolarHBondContact O-CB 3.48Å; L85-C88 PolarHBondContact O-N 3.44Å; R86-C88 VanDerWaalsContact C-N 3.32Å; R86-C88 PolarHBondContact O-N 2.92Å; C88-L90 PolarHBondContact O-N 3.42Å; C88-V91 PolarHBondContact O-N 2.97Å; C88-E92 WeakPolarHBondContact O-CB 3.41Å; C88-E92 PolarHBondContact O-N 3.35Å; C88-L238 HydrophobicContact CB-CD1 4.33Å
89M98Very high95.7Very high0 Ų020.9 Ų20.90%012%0.118CC..Hα-helixtrans-61.1-45.4178-67.9170.6-171.400112M59 L85 R86 G87 E92 L93 L128 L129 L166 V169M59-M89 HydrophobicContact CE-CG 4.1Å; M59-M89 HydrophobicContact CG-CE 4.27Å; M59-M89 HydrophobicContact CG-CG 3.68Å; M59-M89 HydrophobicContact SD-CB 4.38Å; M59-M89 HydrophobicContact SD-CG 3.78Å; L85-M89 WeakPolarHBondContact O-CG 3.39Å; L85-M89 PolarHBondContact O-N 2.83Å; R86-M89 WeakPolarHBondContact O-CB 3.28Å; R86-M89 PolarHBondContact O-N 3.48Å; G87-M89 VanDerWaalsContact C-N 3.32Å; G87-M89 PolarHBondContact O-N 3.29Å; M89-E92 PolarHBondContact O-N 3.03Å; M89-L93 WeakPolarHBondContact O-CB 3.34Å; M89-L93 WeakPolarHBondContact O-CG 3.47Å; M89-L93 PolarHBondContact O-N 2.95Å; M89-L128 HydrophobicContact CE-CB 3.99Å; M89-L128 HydrophobicContact CE-CD1 4.07Å; M89-L128 HydrophobicContact CE-CD2 4.21Å; M89-L128 HydrophobicContact CE-CG 4.33Å; M89-L129 HydrophobicContact CB-CD2 3.99Å; M89-L129 HydrophobicContact CG-CD2 4.11Å; M89-L166 HydrophobicContact CE-CD1 3.96Å; M89-L166 HydrophobicContact SD-CD1 3.4Å; M89-L166 WeakPolarHBondContact SD-CD1 3.42Å; M89-V169 HydrophobicContact CE-CG1 3.95Å
90L98.1Very high96.2Very high0 Ų019 Ų190%010%0.104CC..Hα-helixtrans-63.4-45.5178.3-65.7-179.4000111.2R86 G87 C88 L93 A94 I99 I136 V145 W148 I149 L152 L284 V288R86-L90 PolarHBondContact O-N 2.8Å; R86-L90 VanDerWaalsContact O-N 3.13Å; G87-L90 PolarHBondContact O-N 2.96Å; C88-L90 PolarHBondContact O-N 3.42Å; L90-L93 PolarHBondContact O-N 3.45Å; L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.5Å; L90-I99 HydrophobicContact CB-CD1 4.43Å; L90-I99 HydrophobicContact CD2-CD1 4.01Å; L90-I99 WeakPolarHBondContact O-CD1 3.24Å; L90-I136 HydrophobicContact CD2-CD1 3.95Å; L90-V145 HydrophobicContact CD1-CG1 4Å; L90-W148 HydrophobicContact CD1-CB 3.96Å; L90-W148 HydrophobicContact CD2-CB 4.23Å; L90-I149 HydrophobicContact CD1-CD1 4.47Å; L90-I149 HydrophobicContact CD1-CG1 3.82Å; L90-L152 HydrophobicContact CD2-CD1 4.46Å; L90-L284 HydrophobicContact CB-CD2 4.33Å; L90-L284 WeakPolarHBondContact O-CD2 3.38Å; L90-V288 HydrophobicContact CB-CG2 3.91Å; L90-V288 HydrophobicContact CD1-CG2 4.32Å
91V98Very high96.3Very high2 Ų216.6 Ų16.61%0.0129%0.087CC..Hα-helixtrans-63.7-43.7177.2177.10000111.5L58 G87 C88 L93 A94 L95 S234 L238 M285 V288L58-V91 HydrophobicContact CD1-CB 4.1Å; L58-V91 HydrophobicContact CD1-CG1 3.72Å; G87-V91 WeakPolarHBondContact O-CG2 3.27Å; G87-V91 PolarHBondContact O-N 3.12Å; C88-V91 PolarHBondContact O-N 2.97Å; V91-L93 PolarHBondContact O-N 3.42Å; V91-A94 WeakPolarHBondContact O-CA 3.24Å; V91-A94 VanDerWaalsContact O-CB 3.28Å; V91-A94 WeakPolarHBondContact O-CB 3.27Å; V91-A94 PolarHBondContact O-N 2.8Å; V91-A94 VanDerWaalsContact O-N 3.08Å; V91-L95 HydrophobicContact CG1-CD1 3.95Å; V91-L95 HydrophobicContact CG1-CG 4.15Å; V91-L95 WeakPolarHBondContact O-CG 3.47Å; V91-L95 PolarHBondContact O-N 3.13Å; V91-S234 WeakPolarHBondContact CG1-OG 3.3Å; V91-L238 HydrophobicContact CB-CD1 4.39Å; V91-L238 HydrophobicContact CG2-CD1 4.07Å; V91-M285 HydrophobicContact CG1-CB 4.48Å; V91-M285 HydrophobicContact CG1-CG 4.22Å; V91-V288 HydrophobicContact CG2-CB 3.84Å; V91-V288 HydrophobicContact CG2-CG1 3.91Å; V91-V288 HydrophobicContact CG2-CG2 3.85Å
92E97.6Very high96.4Very high1 Ų119.2 Ų19.21%0.00510%0.1CC..Hα-helixtrans-61.9-41.8178.9-172.774.5-14100111.4L58 M59 C88 M89 A94 L95 R96 L129 R231L58-E92 WeakPolarHBondContact CG-OE2 3.48Å; L58-E92 PolarHBondContact N-OE2 2.98Å; M59-E92 HydrophobicContact SD-CB 4.22Å; M59-E92 HydrophobicContact SD-CG 4.42Å; C88-E92 WeakPolarHBondContact O-CB 3.41Å; C88-E92 PolarHBondContact O-N 3.35Å; M89-E92 PolarHBondContact O-N 3.03Å; E92-A94 VanDerWaalsContact C-N 3.32Å; E92-A94 PolarHBondContact O-N 2.75Å; E92-L95 PolarHBondContact O-N 3.49Å; E92-R96 WeakPolarHBondContact O-CB 3.23Å; E92-R96 VanDerWaalsContact O-CG 3.23Å; E92-R96 WeakPolarHBondContact O-CG 3.39Å; E92-R96 PolarHBondContact O-N 2.81Å; E92-R96 VanDerWaalsContact O-N 3.08Å; E92-R96 IonicContact OE1-CZ 2.66Å; E92-R96 IonicContact OE1-NE 3.44Å; E92-R96 PolarHBondContact OE1-NE 2.91Å; E92-R96 IonicContact OE1-NH2 3.35Å; E92-R96 PolarHBondContact OE1-NH2 3.25Å; E92-L129 HydrophobicContact CB-CD1 4.49Å; E92-L129 HydrophobicContact CB-CD2 4.12Å; E92-L129 HydrophobicContact CG-CD1 3.63Å; E92-L129 HydrophobicContact CG-CD2 4.12Å; E92-R231 VanDerWaalsContact CD-NH1 3.32Å; E92-R231 IonicContact OE1-CZ 2.84Å; E92-R231 IonicContact OE1-NH1 2.87Å; E92-R231 PolarHBondContact OE1-NH1 3.08Å; E92-R231 VanDerWaalsContact OE1-NH1 3.12Å; E92-R231 IonicContact OE1-NH2 3.8Å; E92-R231 IonicContact OE2-CZ 3.7Å; E92-R231 IonicContact OE2-NH1 3.39Å; E92-R231 PolarHBondContact OE2-NH1 2.91Å; E92-R231 IonicContact OE2-NH2 3.12Å; E92-R231 PolarHBondContact OE2-NH2 3.44Å
93L97.8Very high96.1Very high0 Ų022.2 Ų22.20%013%0.126CC..Hα-helixtrans-63.6-37.1172.1-72.4174.1000112.2M89 L90 V91 R96 G97 R98 I99 T124 L129 A132 L133 I136M89-L93 WeakPolarHBondContact O-CB 3.34Å; M89-L93 WeakPolarHBondContact O-CG 3.47Å; M89-L93 PolarHBondContact O-N 2.95Å; L90-L93 PolarHBondContact O-N 3.45Å; V91-L93 PolarHBondContact O-N 3.42Å; L93-R96 PolarHBondContact O-N 2.85Å; L93-G97 PolarHBondContact O-N 3.49Å; L93-R98 HydrophobicContact CB-CB 4.27Å; L93-R98 HydrophobicContact CD2-CB 4Å; L93-R98 HydrophobicContact CD2-CG 4.1Å; L93-R98 WeakPolarHBondContact O-CB 3.47Å; L93-R98 PolarHBondContact O-N 3.17Å; L93-I99 HydrophobicContact CB-CD1 3.71Å; L93-I99 HydrophobicContact CB-CG1 3.74Å; L93-I99 HydrophobicContact CB-CG2 4.33Å; L93-I99 HydrophobicContact CD1-CD1 4.26Å; L93-I99 HydrophobicContact CD1-CG2 4.47Å; L93-T124 HydrophobicContact CD2-CG2 3.97Å; L93-L129 HydrophobicContact CD2-CB 4.08Å; L93-L129 HydrophobicContact CD2-CD2 4.41Å; L93-L129 HydrophobicContact CG-CD2 4.15Å; L93-A132 HydrophobicContact CD1-CB 4.31Å; L93-L133 HydrophobicContact CD1-CB 4.4Å; L93-L133 HydrophobicContact CD2-CB 4.2Å; L93-L133 HydrophobicContact CD2-CD2 4.48Å; L93-I136 HydrophobicContact CD1-CD1 4.08Å
94A97.1Very high95.3Very high8 Ų824.4 Ų24.47%0.06614%0.14CC..Hα-helixtrans-65.8-47.6177.300000112L90 V91 E92 R96 G97 I99 L284L90-A94 WeakPolarHBondContact O-CB 3.37Å; L90-A94 PolarHBondContact O-N 3.5Å; V91-A94 WeakPolarHBondContact O-CA 3.24Å; V91-A94 VanDerWaalsContact O-CB 3.28Å; V91-A94 WeakPolarHBondContact O-CB 3.27Å; V91-A94 PolarHBondContact O-N 2.8Å; V91-A94 VanDerWaalsContact O-N 3.08Å; E92-A94 VanDerWaalsContact C-N 3.32Å; E92-A94 PolarHBondContact O-N 2.75Å; A94-R96 PolarHBondContact O-N 2.86Å; A94-G97 PolarHBondContact O-N 2.93Å; A94-I99 HydrophobicContact CB-CG1 4.38Å; A94-L284 HydrophobicContact CB-CB 4.05Å; A94-L284 HydrophobicContact CB-CD2 3.39Å; A94-L284 HydrophobicContact CB-CG 4.32Å
95L95.6Very high94.2Very high48 Ų4826.6 Ų26.625%0.25116%0.163SC..Hα-helixtrans-63.9-32.5179-67.2176.6000111.1L58 V91 E92 G97 K230 R231L58-L95 HydrophobicContact CD1-CD1 4.28Å; V91-L95 HydrophobicContact CG1-CD1 3.95Å; V91-L95 HydrophobicContact CG1-CG 4.15Å; V91-L95 WeakPolarHBondContact O-CG 3.47Å; V91-L95 PolarHBondContact O-N 3.13Å; E92-L95 PolarHBondContact O-N 3.49Å; L95-G97 PolarHBondContact O-N 3.23Å; L95-K230 HydrophobicContact CD2-CB 4.02Å; L95-R231 HydrophobicContact CD1-CB 4.19Å; L95-R231 HydrophobicContact CD1-CG 4.45Å
96R95.7Very high92.6Very high57 Ų5734.2 Ų34.222%0.21521%0.209CC..THydrogen-bonded Turntrans-80.46.4172.6-64.5176.2-168.9-150.58.5113.9E92 L93 A94 R98 T124E92-R96 WeakPolarHBondContact O-CB 3.23Å; E92-R96 VanDerWaalsContact O-CG 3.23Å; E92-R96 WeakPolarHBondContact O-CG 3.39Å; E92-R96 PolarHBondContact O-N 2.81Å; E92-R96 VanDerWaalsContact O-N 3.08Å; E92-R96 IonicContact OE1-CZ 2.66Å; E92-R96 IonicContact OE1-NE 3.44Å; E92-R96 PolarHBondContact OE1-NE 2.91Å; E92-R96 IonicContact OE1-NH2 3.35Å; E92-R96 PolarHBondContact OE1-NH2 3.25Å; L93-R96 PolarHBondContact O-N 2.85Å; A94-R96 PolarHBondContact O-N 2.86Å; R96-R98 HydrophobicContact CB-CG 4.13Å; R96-R98 PolarHBondContact O-N 3.3Å; R96-R98 PolarHBondContact O-NH1 3.27Å; R96-T124 PolarHBondContact NH1-O 3.49Å
97G95.8Very high91.2Very high29 Ų2945.2 Ų45.230%0.29925%0.25SS..THydrogen-bonded Turntrans6420.9179.400000114.9L93 A94 L95L93-G97 PolarHBondContact O-N 3.49Å; A94-G97 PolarHBondContact O-N 2.93Å; L95-G97 PolarHBondContact O-N 3.23Å
98R97.1Very high90.1Very high51 Ų5155.5 Ų55.519%0.19229%0.289CS..SBendtrans-82-38179.5-61.1-57.9-171.5-94.46.8112.3L93 R96 K119 S120 A122 P123 T124 L133L93-R98 HydrophobicContact CB-CB 4.27Å; L93-R98 HydrophobicContact CD2-CB 4Å; L93-R98 HydrophobicContact CD2-CG 4.1Å; L93-R98 WeakPolarHBondContact O-CB 3.47Å; L93-R98 PolarHBondContact O-N 3.17Å; R96-R98 HydrophobicContact CB-CG 4.13Å; R96-R98 PolarHBondContact O-N 3.3Å; R96-R98 PolarHBondContact O-NH1 3.27Å; R98-K119 PolarHBondContact O-N 3.18Å; R98-S120 WeakPolarHBondContact CD-O 3.44Å; R98-S120 PolarHBondContact O-N 3.1Å; R98-S120 VanDerWaalsContact O-N 3.08Å; R98-A122 PolarHBondContact NE-O 3.16Å; R98-P123 PolarHBondContact NH2-O 2.69Å; R98-T124 HydrophobicContact CG-CG2 4.03Å; R98-L133 HydrophobicContact CB-CD1 4Å; R98-L133 HydrophobicContact CB-CD2 4.21Å; R98-L133 HydrophobicContact CG-CD2 4.21Å
99I97.6Very high89.3Confident5 Ų559.8 Ų59.83%0.02631%0.308CS..EExtended strand (participates in β ladder)trans-128.4154.5179.868.1177.5000110.6L90 L93 A94 V116 I117 L133 I136 L284L90-I99 HydrophobicContact CB-CD1 4.43Å; L90-I99 HydrophobicContact CD2-CD1 4.01Å; L90-I99 WeakPolarHBondContact O-CD1 3.24Å; L93-I99 HydrophobicContact CB-CD1 3.71Å; L93-I99 HydrophobicContact CB-CG1 3.74Å; L93-I99 HydrophobicContact CB-CG2 4.33Å; L93-I99 HydrophobicContact CD1-CD1 4.26Å; L93-I99 HydrophobicContact CD1-CG2 4.47Å; A94-I99 HydrophobicContact CB-CG1 4.38Å; I99-V116 HydrophobicContact CB-CG1 4.05Å; I99-V116 HydrophobicContact CD1-CG1 3.92Å; I99-V116 HydrophobicContact CG1-CG1 4.41Å; I99-I117 CarbonylContact C-O 3.59Å; I99-I117 WeakPolarHBondContact CA-O 2.92Å; I99-L133 HydrophobicContact CG2-CD1 3.9Å; I99-I136 HydrophobicContact CD1-CD1 4.28Å; I99-I136 HydrophobicContact CG2-CD1 4.16Å; I99-I136 HydrophobicContact CG2-CG2 4.18Å; I99-L284 HydrophobicContact CD1-CD1 4.28Å; I99-L284 HydrophobicContact CD1-CD2 3.63Å; I99-L284 HydrophobicContact CG1-CD1 4.33Å; I99-L284 HydrophobicContact CG1-CD2 3.89Å
100Q96.1Very high88.9Confident90 Ų9062.3 Ų62.342%0.42133%0.326SS..EExtended strand (participates in β ladder)trans-143.8163.6176.266.5-175.912.400110.3I117 K119Q100-I117 HydrophobicContact CG-CB 4.29Å; Q100-I117 PolarHBondContact N-O 3.25Å; Q100-I117 PolarHBondContact O-N 2.97Å; Q100-K119 HydrophobicContact CG-CB 4.39Å
101L94.9Very high88.5Confident9 Ų962.4 Ų62.45%0.04733%0.326CS..EExtended strand (participates in β ladder)trans-84140.8174.8-158.264.5000109.6A103 L111 R114 V145 E283 L284 A287L101-A103 PolarHBondContact O-N 3.36Å; L101-L111 HydrophobicContact CD2-CD2 3.71Å; L101-R114 HydrophobicContact CD1-CB 3.84Å; L101-R114 HydrophobicContact CD2-CB 3.88Å; L101-R114 HydrophobicContact CD2-CG 4.48Å; L101-R114 HydrophobicContact CG-CB 3.6Å; L101-V145 HydrophobicContact CD1-CG2 4.08Å; L101-E283 HydrophobicContact CB-CB 4.4Å; L101-E283 HydrophobicContact CD2-CB 4.18Å; L101-L284 HydrophobicContact CB-CD1 4.31Å; L101-L284 HydrophobicContact CD1-CD1 4.26Å; L101-A287 HydrophobicContact CD1-CB 4.43Å; L101-A287 HydrophobicContact CD2-CB 4Å
102E93.4Very high88.2Confident58 Ų5863.2 Ų63.227%0.27133%0.33SS..PPolyproline II helixtrans-48.5127.4174.6179.5-164.2-177.300109.2K109 R114 K115 I117E102-K109 IonicContact OE1-NZ 3.81Å; E102-K109 PolarHBondContact OE1-NZ 2.93Å; E102-K109 IonicContact OE2-NZ 3.78Å; E102-K109 PolarHBondContact OE2-NZ 3.21Å; E102-R114 HydrophobicContact CB-CB 4.47Å; E102-R114 PolarHBondContact O-NE 2.93Å; E102-R114 PolarHBondContact O-NH2 2.87Å; E102-K115 HydrophobicContact CB-CB 4.36Å; E102-K115 WeakPolarHBondContact CB-O 3.33Å; E102-K115 PolarHBondContact N-O 3.45Å; E102-K115 PolarHBondContact OE2-N 3.18Å; E102-I117 HydrophobicContact CB-CG1 4.18Å
103A86.3Confident88Confident80 Ų8065.4 Ų65.466%0.66135%0.348SS*.PPolyproline II helixtrans-53.8143.8-176.800000112.3L101 G105L101-A103 PolarHBondContact O-N 3.36Å; A103-G105 PolarHBondContact O-N 2.69Å
104C76.9Confident87.8Confident65 Ų6565.7 Ų65.744%0.43935%0.349SS..  trans-66.597.4178.7-163.80000109.8
105G72.1Confident87.8Confident46 Ų4668.3 Ų68.347%0.47436%0.359SS..  trans-68.3177.6177.100000112.9A103 R107 R108A103-G105 PolarHBondContact O-N 2.69Å; G105-R107 PolarHBondContact O-N 2.97Å; G105-R108 PolarHBondContact O-N 3.2Å
106V63.6Low87.9Confident160 Ų16066.1 Ų66.197%0.9735%0.348SS*.THydrogen-bonded Turntrans-52.7-29.5-175.3-170.60000113.6R108V106-R108 VanDerWaalsContact C-N 3.33Å; V106-R108 PolarHBondContact O-N 3.43Å
107R68.6Low87.9Confident240 Ų24066 Ų6691%0.90635%0.351SS*.THydrogen-bonded Turntrans-812-179.8-98.5-176.6176.4172.3-0.8115.7G105 K109G105-R107 PolarHBondContact O-N 2.97Å; R107-K109 PolarHBondContact O-N 2.88Å
108R73.9Confident88Confident217 Ų21766.6 Ų66.682%0.81935%0.35SS*.  trans41.768.7-177.5-70.3-172.5177.8176.8-0.8113G105 V106G105-R108 PolarHBondContact O-N 3.2Å; V106-R108 VanDerWaalsContact C-N 3.33Å; V106-R108 PolarHBondContact O-N 3.43Å
109K80.7Confident88Confident90 Ų9070.8 Ų70.839%0.39137%0.37SS..  trans-62.6143.1173.9-65.5176.3-179.11710109.6E102 R107 A113 R114E102-K109 IonicContact OE1-NZ 3.81Å; E102-K109 PolarHBondContact OE1-NZ 2.93Å; E102-K109 IonicContact OE2-NZ 3.78Å; E102-K109 PolarHBondContact OE2-NZ 3.21Å; R107-K109 PolarHBondContact O-N 2.88Å; K109-A113 HydrophobicContact CB-CB 4.46Å; K109-R114 HydrophobicContact CB-CG 3.82Å; K109-R114 HydrophobicContact CD-CG 4.44Å
110S89.5Confident87.9Confident53 Ų5372.4 Ų72.437%0.37138%0.381SS..  trans-60.4154.5169.357.10000111.2L112 A113 R114 E273S110-L112 VanDerWaalsContact C-N 3.26Å; S110-L112 PolarHBondContact O-N 2.84Å; S110-A113 PolarHBondContact O-N 2.87Å; S110-A113 VanDerWaalsContact OG-CB 3.27Å; S110-A113 WeakPolarHBondContact OG-CB 3.42Å; S110-R114 WeakPolarHBondContact O-CG 3.17Å; S110-R114 PolarHBondContact O-N 3.24Å; S110-E273 WeakPolarHBondContact CA-OE1 3.49Å; S110-E273 VanDerWaalsContact CB-OE1 3.24Å; S110-E273 WeakPolarHBondContact CB-OE1 3.27Å
111L89.7Confident87.8Confident1 Ų172.7 Ų72.71%0.00539%0.386CS..G310 helixtrans-50.4-46.8178.3-78.2173.5000112.5L101 A113 R114 P272 E273 S276 E283 W286 A287L101-L111 HydrophobicContact CD2-CD2 3.71Å; L111-A113 VanDerWaalsContact C-N 3.28Å; L111-A113 PolarHBondContact O-N 3.22Å; L111-R114 PolarHBondContact O-N 3.22Å; L111-P272 HydrophobicContact CD1-CB 4.06Å; L111-P272 WeakPolarHBondContact CD1-O 3.37Å; L111-E273 HydrophobicContact CD1-CG 4.48Å; L111-E273 WeakPolarHBondContact CG-OE2 3.28Å; L111-E273 PolarHBondContact N-OE1 3.17Å; L111-E273 PolarHBondContact N-OE2 3.25Å; L111-S276 WeakPolarHBondContact CD1-OG 3.42Å; L111-E283 HydrophobicContact CD2-CB 4.37Å; L111-W286 HydrophobicContact CD1-CB 4.12Å; L111-A287 HydrophobicContact CB-CB 4.19Å; L111-A287 HydrophobicContact CD2-CB 4.4Å
112L93.1Very high87.9Confident20 Ų2074 Ų7411%0.10540%0.398CS..G310 helixtrans-71.7-21-177.5-64.3179.6000113.9S110 T144 A287 A290 A291 K294S110-L112 VanDerWaalsContact C-N 3.26Å; S110-L112 PolarHBondContact O-N 2.84Å; L112-T144 WeakPolarHBondContact O-CB 3.47Å; L112-T144 VanDerWaalsContact O-CG2 3.26Å; L112-T144 WeakPolarHBondContact O-CG2 3.49Å; L112-A287 WeakPolarHBondContact CD2-O 3.3Å; L112-A290 HydrophobicContact CD1-CB 4.36Å; L112-A290 HydrophobicContact CD2-CB 3.78Å; L112-A290 HydrophobicContact CG-CB 4.03Å; L112-A291 HydrophobicContact CD2-CB 4.05Å; L112-K294 HydrophobicContact CD1-CD 3.61Å; L112-K294 HydrophobicContact CD1-CG 4.48Å
113A92.8Very high88Confident46 Ų4676 Ų7638%0.3842%0.416SS..G310 helixtrans-86.3-15.1176.900000112.9K109 S110 L111K109-A113 HydrophobicContact CB-CB 4.46Å; S110-A113 PolarHBondContact O-N 2.87Å; S110-A113 VanDerWaalsContact OG-CB 3.27Å; S110-A113 WeakPolarHBondContact OG-CB 3.42Å; L111-A113 VanDerWaalsContact C-N 3.28Å; L111-A113 PolarHBondContact O-N 3.22Å
114R94.3Very high88.4Confident6 Ų673.2 Ų73.22%0.02339%0.391CS..SBendtrans-77.3146.8178.4-66.3164.266.5-177.8-2.1110.2L101 E102 K109 S110 L111 E283L101-R114 HydrophobicContact CD1-CB 3.84Å; L101-R114 HydrophobicContact CD2-CB 3.88Å; L101-R114 HydrophobicContact CD2-CG 4.48Å; L101-R114 HydrophobicContact CG-CB 3.6Å; E102-R114 HydrophobicContact CB-CB 4.47Å; E102-R114 PolarHBondContact O-NE 2.93Å; E102-R114 PolarHBondContact O-NH2 2.87Å; K109-R114 HydrophobicContact CB-CG 3.82Å; K109-R114 HydrophobicContact CD-CG 4.44Å; S110-R114 WeakPolarHBondContact O-CG 3.17Å; S110-R114 PolarHBondContact O-N 3.24Å; L111-R114 PolarHBondContact O-N 3.22Å; R114-E283 IonicContact CZ-OE1 3.33Å; R114-E283 IonicContact CZ-OE2 3.84Å; R114-E283 IonicContact NH1-OE1 2.89Å; R114-E283 PolarHBondContact NH1-OE1 3.2Å; R114-E283 IonicContact NH1-OE2 2.6Å; R114-E283 PolarHBondContact NH1-OE2 2.83Å; R114-E283 VanDerWaalsContact NH2-CD 3.31Å; R114-E283 IonicContact NH2-OE1 2.79Å; R114-E283 PolarHBondContact NH2-OE1 3.37Å; R114-E283 IonicContact NH2-OE2 2.89Å; R114-E283 PolarHBondContact NH2-OE2 3.42Å
115K95.8Very high89.1Confident63 Ų6373.7 Ų73.727%0.27441%0.407SS..BIsolated β-bridgetrans-91.1149.9-176.9-56.3-56.3-163.7154.40111.8E102 I117 P142 E143 T144E102-K115 HydrophobicContact CB-CB 4.36Å; E102-K115 WeakPolarHBondContact CB-O 3.33Å; E102-K115 PolarHBondContact N-O 3.45Å; E102-K115 PolarHBondContact OE2-N 3.18Å; K115-I117 HydrophobicContact CB-CD1 4.47Å; K115-P142 HydrophobicContact CB-CB 3.76Å; K115-P142 WeakPolarHBondContact CD-O 3.4Å; K115-P142 VanDerWaalsContact CE-O 3.3Å; K115-P142 WeakPolarHBondContact CE-O 3.23Å; K115-P142 HydrophobicContact CG-CB 4.34Å; K115-P142 PolarHBondContact NZ-O 3.44Å; K115-E143 CarbonylContact C-O 3.59Å; K115-E143 WeakPolarHBondContact CA-O 3.42Å; K115-E143 IonicContact NZ-OE2 2.67Å; K115-E143 PolarHBondContact NZ-OE2 3.34Å; K115-T144 HydrophobicContact CD-CG2 3.72Å
116V97.3Very high90.2Very high3 Ų371.9 Ų71.92%0.01839%0.386CS..EExtended strand (participates in β ladder)trans-82.3128.5173.1-179.90000108.9I99 I136 E143 V145 L284I99-V116 HydrophobicContact CB-CG1 4.05Å; I99-V116 HydrophobicContact CD1-CG1 3.92Å; I99-V116 HydrophobicContact CG1-CG1 4.41Å; V116-I136 HydrophobicContact CG1-CG2 4.18Å; V116-E143 PolarHBondContact N-O 3.4Å; V116-V145 HydrophobicContact CG2-CB 4.47Å; V116-V145 HydrophobicContact CG2-CG2 3.6Å; V116-L284 HydrophobicContact CB-CD1 4.46Å; V116-L284 HydrophobicContact CG1-CD1 4.02Å; V116-L284 HydrophobicContact CG2-CD1 3.97Å
117I97.1Very high91.7Very high55 Ų5568.6 Ų68.628%0.28237%0.366SS..EExtended strand (participates in β ladder)trans-117.8131.6-177.5-53.6-60.6000109.1I99 Q100 E102 K115 K119 P142I99-I117 CarbonylContact C-O 3.59Å; I99-I117 WeakPolarHBondContact CA-O 2.92Å; Q100-I117 HydrophobicContact CG-CB 4.29Å; Q100-I117 PolarHBondContact N-O 3.25Å; Q100-I117 PolarHBondContact O-N 2.97Å; E102-I117 HydrophobicContact CB-CG1 4.18Å; K115-I117 HydrophobicContact CB-CD1 4.47Å; I117-K119 PolarHBondContact O-N 3.35Å; I117-P142 HydrophobicContact CD1-CB 3.86Å; I117-P142 HydrophobicContact CD1-CG 3.79Å
118C97Very high93Very high41 Ų4157.2 Ų57.228%0.27732%0.323SS..EExtended strand (participates in β ladder)trans-71.4120.9170.5-172.10000109.8I136C118-I136 HydrophobicContact CB-CG2 4.32Å
119K96.3Very high94.2Very high139 Ų13946.9 Ų46.960%0.60428%0.284SS*.  trans-94.3-40.2176.4-176.6-176.8177.3-174.90111.4R98 Q100 I117R98-K119 PolarHBondContact O-N 3.18Å; Q100-K119 HydrophobicContact CG-CB 4.39Å; I117-K119 PolarHBondContact O-N 3.35Å
120S96.5Very high95Very high39 Ų3944.9 Ų44.927%0.27328%0.278SS..  trans-145.8134.6-178.9174.80000110.1R98 A122R98-S120 WeakPolarHBondContact CD-O 3.44Å; R98-S120 PolarHBondContact O-N 3.1Å; R98-S120 VanDerWaalsContact O-N 3.08Å; S120-A122 PolarHBondContact OG-N 3.13Å
121D94.9Very high95.4Very high95 Ų9545.1 Ų45.151%0.50827%0.273SS..  trans-99.711.9178.867.9-17.9000113.2K137D121-K137 HydrophobicContact CB-CD 3.99Å; D121-K137 IonicContact OD2-NZ 2.69Å; D121-K137 PolarHBondContact OD2-NZ 3.24Å
122A96.7Very high95.8Very high36 Ų3645.1 Ų45.130%0.29827%0.273SS..  trans-60.2133.3176.500000110.5R98 S120R98-A122 PolarHBondContact NE-O 3.16Å; S120-A122 PolarHBondContact OG-N 3.13Å
123P95.1Very high96Very high102 Ų10244.4 Ų44.466%0.66227%0.269SS*.  trans-59.5146.6-179.925.9-34.2000110.7R98R98-P123 PolarHBondContact NH2-O 2.69Å
124T93.9Very high96.2Very high21 Ų2148.6 Ų48.613%0.12928%0.279CS..  trans-96.7-15.3-179.169.40000112.1L93 R96 R98 D126 L129 D130L93-T124 HydrophobicContact CD2-CG2 3.97Å; R96-T124 PolarHBondContact NH1-O 3.49Å; R98-T124 HydrophobicContact CG-CG2 4.03Å; T124-D126 VanDerWaalsContact C-N 3.27Å; T124-D126 PolarHBondContact OG1-N 2.81Å; T124-L129 HydrophobicContact CG2-CB 4.33Å; T124-L129 VanDerWaalsContact OG1-CB 3.3Å; T124-L129 WeakPolarHBondContact OG1-CB 3.28Å; T124-D130 WeakPolarHBondContact CA-OD1 3.26Å; T124-D130 WeakPolarHBondContact CB-OD1 3.45Å; T124-D130 PolarHBondContact N-OD1 3.13Å; T124-D130 PolarHBondContact OG1-OD1 3.38Å
125G92.1Very high96.4Very high75 Ų7549.5 Ų49.577%0.77328%0.283SS*.SBendtrans80.67.2-175.900000113.5D130G125-D130 PolarHBondContact N-OD2 3.47Å
126D95.4Very high96.4Very high8 Ų846.9 Ų46.94%0.04327%0.272CS..  trans-118.2122.2173.4-177.9-58.3000108.7T124 L128 L129 D130 N176T124-D126 VanDerWaalsContact C-N 3.27Å; T124-D126 PolarHBondContact OG1-N 2.81Å; D126-L128 PolarHBondContact O-N 2.87Å; D126-L128 WeakPolarHBondContact OD1-CB 3.16Å; D126-L128 PolarHBondContact OD1-N 3.23Å; D126-L129 HydrophobicContact CB-CB 4.09Å; D126-L129 HydrophobicContact CB-CD1 3.87Å; D126-L129 HydrophobicContact CB-CG 3.98Å; D126-L129 PolarHBondContact O-N 2.94Å; D126-L129 PolarHBondContact OD1-N 3.25Å; D126-D130 WeakPolarHBondContact O-CB 3.46Å; D126-D130 VanDerWaalsContact O-CG 3.23Å; D126-D130 PolarHBondContact O-N 3.43Å; D126-N176 PolarHBondContact OD2-ND2 2.99Å
127V95.3Very high96.4Very high91 Ų9151.8 Ų51.855%0.55229%0.294SS*.Hα-helixtrans-60.4-33.9-172.7-164.80000112.2E131 R172V127-E131 WeakPolarHBondContact O-CB 3.36Å; V127-E131 PolarHBondContact O-N 2.59Å; V127-E131 VanDerWaalsContact O-N 3.16Å; V127-R172 PolarHBondContact O-NH2 3.21Å; V127-R172 VanDerWaalsContact O-NH2 3.13Å
128L96.8Very high96.3Very high1 Ų154 Ų541%0.00531%0.306CS..Hα-helixtrans-75.2-42.6-179.7-72.6164.5000111.3M89 D126 D130 A132 L166 V169 R172 L173M89-L128 HydrophobicContact CE-CB 3.99Å; M89-L128 HydrophobicContact CE-CD1 4.07Å; M89-L128 HydrophobicContact CE-CD2 4.21Å; M89-L128 HydrophobicContact CE-CG 4.33Å; D126-L128 PolarHBondContact O-N 2.87Å; D126-L128 WeakPolarHBondContact OD1-CB 3.16Å; D126-L128 PolarHBondContact OD1-N 3.23Å; L128-D130 VanDerWaalsContact C-N 3.35Å; L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.27Å; L128-L166 HydrophobicContact CD2-CD1 4.41Å; L128-V169 HydrophobicContact CD1-CG1 4.17Å; L128-V169 HydrophobicContact CD2-CG1 4.48Å; L128-V169 HydrophobicContact CD2-CG2 3.96Å; L128-R172 HydrophobicContact CD1-CB 4.17Å; L128-R172 HydrophobicContact CD2-CB 4.47Å; L128-R172 HydrophobicContact CG-CB 4.37Å; L128-L173 HydrophobicContact CD1-CD2 3.61Å; L128-L173 HydrophobicContact CD1-CG 3.72Å
129L97.7Very high96.3Very high0 Ų052.6 Ų52.60%030%0.296CS..Hα-helixtrans-64.8-40.9176.2-65.5-178.5000111.4M59 M89 E92 L93 T124 D126 A132 L133M59-L129 HydrophobicContact CE-CD1 4.11Å; M59-L129 HydrophobicContact CE-CD2 3.44Å; M59-L129 VanDerWaalsContact CE-CD2 3.44Å; M59-L129 HydrophobicContact CE-CG 3.64Å; M59-L129 HydrophobicContact SD-CD2 4.04Å; M89-L129 HydrophobicContact CB-CD2 3.99Å; M89-L129 HydrophobicContact CG-CD2 4.11Å; E92-L129 HydrophobicContact CB-CD1 4.49Å; E92-L129 HydrophobicContact CB-CD2 4.12Å; E92-L129 HydrophobicContact CG-CD1 3.63Å; E92-L129 HydrophobicContact CG-CD2 4.12Å; L93-L129 HydrophobicContact CD2-CB 4.08Å; L93-L129 HydrophobicContact CD2-CD2 4.41Å; L93-L129 HydrophobicContact CG-CD2 4.15Å; T124-L129 HydrophobicContact CG2-CB 4.33Å; T124-L129 VanDerWaalsContact OG1-CB 3.3Å; T124-L129 WeakPolarHBondContact OG1-CB 3.28Å; D126-L129 HydrophobicContact CB-CB 4.09Å; D126-L129 HydrophobicContact CB-CD1 3.87Å; D126-L129 HydrophobicContact CB-CG 3.98Å; D126-L129 PolarHBondContact O-N 2.94Å; D126-L129 PolarHBondContact OD1-N 3.25Å; L129-A132 PolarHBondContact O-N 3.28Å; L129-L133 VanDerWaalsContact O-CB 3.23Å; L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 PolarHBondContact O-N 3.02Å
130D97.7Very high96.1Very high47 Ų4753.5 Ų53.525%0.25130%0.303SS..Hα-helixtrans-69.1-36.4-179.1-69.5-16.9000111.9T124 G125 D126 L128 K134T124-D130 WeakPolarHBondContact CA-OD1 3.26Å; T124-D130 WeakPolarHBondContact CB-OD1 3.45Å; T124-D130 PolarHBondContact N-OD1 3.13Å; T124-D130 PolarHBondContact OG1-OD1 3.38Å; G125-D130 PolarHBondContact N-OD2 3.47Å; D126-D130 WeakPolarHBondContact O-CB 3.46Å; D126-D130 VanDerWaalsContact O-CG 3.23Å; D126-D130 PolarHBondContact O-N 3.43Å; L128-D130 VanDerWaalsContact C-N 3.35Å; D130-K134 WeakPolarHBondContact O-CB 3.49Å; D130-K134 PolarHBondContact O-N 3.16Å
131E97.6Very high95.9Very high59 Ų5956.1 Ų56.128%0.27632%0.318SS..Hα-helixtrans-67.4-45.7173.1-171.9176.4166.700111.9V127 L133 K134 H135 L166 R172V127-E131 WeakPolarHBondContact O-CB 3.36Å; V127-E131 PolarHBondContact O-N 2.59Å; V127-E131 VanDerWaalsContact O-N 3.16Å; E131-L133 VanDerWaalsContact C-N 3.35Å; E131-L133 PolarHBondContact O-N 3.2Å; E131-K134 WeakPolarHBondContact O-CB 3.44Å; E131-K134 PolarHBondContact O-N 2.79Å; E131-H135 PolarHBondContact O-CD2 2.83Å; E131-H135 PolarHBondContact O-N 3.2Å; E131-L166 HydrophobicContact CB-CD2 4.01Å; E131-L166 HydrophobicContact CG-CD2 3.54Å; E131-L166 WeakPolarHBondContact OE1-CD2 3.38Å; E131-R172 IonicContact OE1-NH1 2.94Å; E131-R172 IonicContact OE2-CZ 3.98Å; E131-R172 IonicContact OE2-NH1 2.81Å; E131-R172 PolarHBondContact OE2-NH1 3.25Å; E131-R172 IonicContact OE2-NH2 2.69Å; E131-R172 PolarHBondContact OE2-NH2 2.95Å
132A97.8Very high96Very high0 Ų053 Ų530%030%0.304CS..Hα-helixtrans-60.8-43.5174.600000111.7L93 L128 L129 K134 H135 I136 L152 L166L93-A132 HydrophobicContact CD1-CB 4.31Å; L128-A132 WeakPolarHBondContact O-CB 3.47Å; L128-A132 PolarHBondContact O-N 3.27Å; L129-A132 PolarHBondContact O-N 3.28Å; A132-K134 VanDerWaalsContact C-N 3.34Å; A132-K134 PolarHBondContact O-N 3.35Å; A132-H135 WeakPolarHBondContact O-CB 3.46Å; A132-H135 PolarHBondContact O-N 3.37Å; A132-I136 VanDerWaalsContact O-CG1 3.27Å; A132-I136 WeakPolarHBondContact O-CG1 3.29Å; A132-I136 PolarHBondContact O-N 3.39Å; A132-L152 HydrophobicContact CB-CD1 4.24Å; A132-L152 HydrophobicContact CB-CD2 4.25Å; A132-L166 HydrophobicContact CB-CD1 4.44Å
133L97.9Very high96Very high6 Ų652.8 Ų52.83%0.03130%0.296CS..Hα-helixtrans-63.1-40.4178-177.158.7000111.8L93 R98 I99 L129 E131 I136 K137L93-L133 HydrophobicContact CD1-CB 4.4Å; L93-L133 HydrophobicContact CD2-CB 4.2Å; L93-L133 HydrophobicContact CD2-CD2 4.48Å; R98-L133 HydrophobicContact CB-CD1 4Å; R98-L133 HydrophobicContact CB-CD2 4.21Å; R98-L133 HydrophobicContact CG-CD2 4.21Å; I99-L133 HydrophobicContact CG2-CD1 3.9Å; L129-L133 VanDerWaalsContact O-CB 3.23Å; L129-L133 WeakPolarHBondContact O-CB 3.5Å; L129-L133 PolarHBondContact O-N 3.02Å; E131-L133 VanDerWaalsContact C-N 3.35Å; E131-L133 PolarHBondContact O-N 3.2Å; L133-I136 PolarHBondContact O-N 2.97Å; L133-K137 WeakPolarHBondContact O-CB 3.22Å; L133-K137 PolarHBondContact O-N 2.66Å
134K97.5Very high96.1Very high133 Ų13349.1 Ų49.158%0.57827%0.272SS*.Hα-helixtrans-60.1-47.4174.4-176.9-179.2179.2-176.50111.4D130 E131 A132 I136 K137 D138D130-K134 WeakPolarHBondContact O-CB 3.49Å; D130-K134 PolarHBondContact O-N 3.16Å; E131-K134 WeakPolarHBondContact O-CB 3.44Å; E131-K134 PolarHBondContact O-N 2.79Å; A132-K134 VanDerWaalsContact C-N 3.34Å; A132-K134 PolarHBondContact O-N 3.35Å; K134-I136 VanDerWaalsContact C-N 3.34Å; K134-I136 PolarHBondContact O-N 3.25Å; K134-K137 PolarHBondContact O-N 3.41Å; K134-D138 PolarHBondContact O-N 3.03Å
135H97.3Very high96.2Very high25 Ų2548.1 Ų48.112%0.11627%0.266CS..Hα-helixtrans-58.6-45.7175.7-73.8-36.6000112.4E131 A132 K137 D138 T139 W148 Y164E131-H135 PolarHBondContact O-CD2 2.83Å; E131-H135 PolarHBondContact O-N 3.2Å; A132-H135 WeakPolarHBondContact O-CB 3.46Å; A132-H135 PolarHBondContact O-N 3.37Å; H135-K137 VanDerWaalsContact C-N 3.31Å; H135-K137 PolarHBondContact O-N 3.5Å; H135-D138 PolarHBondContact O-N 3.16Å; H135-T139 WeakPolarHBondContact O-CB 3.41Å; H135-T139 PolarHBondContact O-N 3.34Å; H135-T139 PolarHBondContact O-OG1 2.96Å; H135-W148 HydrophobicContact CB-CH2 4.34Å; H135-W148 HydrophobicContact CB-CZ3 4.01Å; H135-W148 WeakPolarHBondContact O-CH2 3.4Å; H135-Y164 HydrophobicContact CB-CD1 3.65Å; H135-Y164 HydrophobicContact CB-CE1 3.91Å; H135-Y164 AromaticContact CG-CD1 3.56Å; H135-Y164 AromaticContact ND1-CD1 3.62Å; H135-Y164 AromaticContact ND1-CE1 3.9Å
136I97.3Very high96.4Very high9 Ų949 Ų495%0.04625%0.25CC..Hα-helixtrans-61.5-40.6178.5-66.2165.1000111.6L90 L93 I99 V116 C118 A132 L133 K134 W148L90-I136 HydrophobicContact CD2-CD1 3.95Å; L93-I136 HydrophobicContact CD1-CD1 4.08Å; I99-I136 HydrophobicContact CD1-CD1 4.28Å; I99-I136 HydrophobicContact CG2-CD1 4.16Å; I99-I136 HydrophobicContact CG2-CG2 4.18Å; V116-I136 HydrophobicContact CG1-CG2 4.18Å; C118-I136 HydrophobicContact CB-CG2 4.32Å; A132-I136 VanDerWaalsContact O-CG1 3.27Å; A132-I136 WeakPolarHBondContact O-CG1 3.29Å; A132-I136 PolarHBondContact O-N 3.39Å; L133-I136 PolarHBondContact O-N 2.97Å; K134-I136 VanDerWaalsContact C-N 3.34Å; K134-I136 PolarHBondContact O-N 3.25Å; I136-W148 VanDerWaalsContact CA-CH2 3.42Å; I136-W148 HydrophobicContact CB-CH2 4.2Å; I136-W148 HydrophobicContact CB-CZ2 4.04Å; I136-W148 HydrophobicContact CG1-CD2 3.84Å; I136-W148 HydrophobicContact CG1-CE3 3.9Å; I136-W148 HydrophobicContact CG1-CH2 3.8Å; I136-W148 HydrophobicContact CG1-CZ2 3.72Å; I136-W148 HydrophobicContact CG1-CZ3 3.89Å; I136-W148 HydrophobicContact CG2-CZ2 4.32Å
137K96.6Very high96.4Very high106 Ų10649.6 Ų49.646%0.46126%0.255SS..Hα-helixtrans-65.1-45.5177.8176.3-177.7174.3174.10112.5D121 L133 K134 H135 T139D121-K137 HydrophobicContact CB-CD 3.99Å; D121-K137 IonicContact OD2-NZ 2.69Å; D121-K137 PolarHBondContact OD2-NZ 3.24Å; L133-K137 WeakPolarHBondContact O-CB 3.22Å; L133-K137 PolarHBondContact O-N 2.66Å; K134-K137 PolarHBondContact O-N 3.41Å; H135-K137 VanDerWaalsContact C-N 3.31Å; H135-K137 PolarHBondContact O-N 3.5Å; K137-T139 VanDerWaalsContact C-N 3.29Å; K137-T139 PolarHBondContact O-N 3.13Å
138D95.8Very high96.6Very high102 Ų10245.3 Ų45.355%0.54523%0.229SC..Hα-helixtrans-80.2-12.2-171.6-66-16.1000112.7K134 H135K134-D138 PolarHBondContact O-N 3.03Å; H135-D138 PolarHBondContact O-N 3.16Å
139T95.9Very high96.6Very high11 Ų1145.8 Ų45.87%0.06723%0.231CC..  trans-86.3116.5-175.3-61.60000112.4H135 K137 E143 W148 Y164H135-T139 WeakPolarHBondContact O-CB 3.41Å; H135-T139 PolarHBondContact O-N 3.34Å; H135-T139 PolarHBondContact O-OG1 2.96Å; K137-T139 VanDerWaalsContact C-N 3.29Å; K137-T139 PolarHBondContact O-N 3.13Å; T139-E143 HydrophobicContact CG2-CG 4.07Å; T139-W148 HydrophobicContact CG2-CH2 4.14Å; T139-W148 HydrophobicContact CG2-CZ2 4.07Å; T139-W148 VanDerWaalsContact OG1-CH2 3.31Å; T139-W148 WeakPolarHBondContact OG1-CH2 3.37Å; T139-Y164 VanDerWaalsContact OG1-CE1 3.22Å; T139-Y164 WeakPolarHBondContact OG1-CE1 3.39Å; T139-Y164 VanDerWaalsContact OG1-CZ 3.32Å; T139-Y164 PolarHBondContact OG1-OH 3.04Å
140Q92.1Very high96.5Very high158 Ų15849 Ų4974%0.73825%0.246SC*.SBendtrans-131.8129.9172.5-163.671.123.600110.1
141P93.3Very high96.4Very high93 Ų9346.9 Ų46.960%0.60424%0.235SC*.SBendcis-71.4158.3-0.931.9-36.3000113.3
142P95.6Very high96.4Very high31 Ų3144 Ų4420%0.20122%0.222CC..  trans-59.2147.6178.4-27.737.5000113.6K115 I117K115-P142 HydrophobicContact CB-CB 3.76Å; K115-P142 WeakPolarHBondContact CD-O 3.4Å; K115-P142 VanDerWaalsContact CE-O 3.3Å; K115-P142 WeakPolarHBondContact CE-O 3.23Å; K115-P142 HydrophobicContact CG-CB 4.34Å; K115-P142 PolarHBondContact NZ-O 3.44Å; I117-P142 HydrophobicContact CD1-CB 3.86Å; I117-P142 HydrophobicContact CD1-CG 3.79Å
143E96.8Very high96.3Very high30 Ų3044.5 Ų44.514%0.1423%0.225CC..  trans-106.9160.2-177.8-63.6-65.7-168.500113.8K115 V116 T139 W148 L151 K161K115-E143 CarbonylContact C-O 3.59Å; K115-E143 WeakPolarHBondContact CA-O 3.42Å; K115-E143 IonicContact NZ-OE2 2.67Å; K115-E143 PolarHBondContact NZ-OE2 3.34Å; V116-E143 PolarHBondContact N-O 3.4Å; T139-E143 HydrophobicContact CG2-CG 4.07Å; E143-W148 HydrophobicContact CB-CZ2 4.36Å; E143-W148 PolarHBondContact O-NE1 2.84Å; E143-L151 HydrophobicContact CG-CD1 4.45Å; E143-K161 IonicContact OE1-NZ 2.8Å; E143-K161 PolarHBondContact OE1-NZ 3.45Å
144T97.1Very high96.1Very high26 Ų2645.4 Ų45.416%0.1624%0.235CC..BIsolated β-bridgetrans-76.3163.9178.557.30000110.9L112 K115 Q146 S147 W148L112-T144 WeakPolarHBondContact O-CB 3.47Å; L112-T144 VanDerWaalsContact O-CG2 3.26Å; L112-T144 WeakPolarHBondContact O-CG2 3.49Å; K115-T144 HydrophobicContact CD-CG2 3.72Å; T144-Q146 VanDerWaalsContact C-N 3.33Å; T144-Q146 PolarHBondContact O-N 2.85Å; T144-S147 PolarHBondContact O-N 3.22Å; T144-S147 WeakPolarHBondContact OG1-CB 3.4Å; T144-S147 PolarHBondContact OG1-N 2.6Å; T144-W148 PolarHBondContact O-N 3.18Å
145V96.9Very high95.8Very high0 Ų043.6 Ų43.60%023%0.229CC..Hα-helixtrans-55.7-47176172.50000111.8L90 L101 V116 S147 W148 I149 L284 A287 V288 A291L90-V145 HydrophobicContact CD1-CG1 4Å; L101-V145 HydrophobicContact CD1-CG2 4.08Å; V116-V145 HydrophobicContact CG2-CB 4.47Å; V116-V145 HydrophobicContact CG2-CG2 3.6Å; V145-S147 PolarHBondContact O-N 2.75Å; V145-W148 PolarHBondContact O-N 3.17Å; V145-W148 VanDerWaalsContact O-N 3.16Å; V145-I149 HydrophobicContact CG1-CD1 4.11Å; V145-I149 WeakPolarHBondContact O-CG1 3.37Å; V145-I149 PolarHBondContact O-N 2.89Å; V145-L284 HydrophobicContact CG2-CD1 4.44Å; V145-A287 HydrophobicContact CB-CB 4.45Å; V145-A287 HydrophobicContact CG2-CB 3.81Å; V145-V288 HydrophobicContact CG1-CB 4.29Å; V145-V288 HydrophobicContact CG1-CG2 3.61Å; V145-A291 HydrophobicContact CG1-CB 4.41Å
146Q96.1Very high95.5Very high93 Ų9343.7 Ų43.744%0.43523%0.231SC..Hα-helixtrans-59.2-46.6177.9-176.6-179.2-11.200111.6T144 W148 I149 E150T144-Q146 VanDerWaalsContact C-N 3.33Å; T144-Q146 PolarHBondContact O-N 2.85Å; Q146-W148 VanDerWaalsContact C-N 3.28Å; Q146-W148 PolarHBondContact O-N 3.03Å; Q146-I149 PolarHBondContact O-N 2.92Å; Q146-E150 WeakPolarHBondContact CG-OE1 3.33Å; Q146-E150 PolarHBondContact NE2-OE1 3.44Å; Q146-E150 VanDerWaalsContact NE2-OE1 3.08Å; Q146-E150 WeakPolarHBondContact O-CG 3.25Å; Q146-E150 PolarHBondContact O-N 3.04Å
147S96.5Very high95.2Very high20 Ų2055 Ų5514%0.1427%0.274CS..Hα-helixtrans-62.2-37.5177.9-1790000111.7T144 V145 E150 L151T144-S147 PolarHBondContact O-N 3.22Å; T144-S147 WeakPolarHBondContact OG1-CB 3.4Å; T144-S147 PolarHBondContact OG1-N 2.6Å; V145-S147 PolarHBondContact O-N 2.75Å; S147-E150 PolarHBondContact O-N 3.02Å; S147-L151 VanDerWaalsContact O-CB 3.27Å; S147-L151 WeakPolarHBondContact O-CB 3.42Å; S147-L151 WeakPolarHBondContact O-CG 3.07Å; S147-L151 PolarHBondContact O-N 3.44Å
148W97.8Very high95Very high1 Ų153 Ų530%0.00427%0.268CS..Hα-helixtrans-63.9-41.1175.4-81.6115.3000113L90 H135 I136 T139 E143 T144 V145 Q146 L151 L152 Y164L90-W148 HydrophobicContact CD1-CB 3.96Å; L90-W148 HydrophobicContact CD2-CB 4.23Å; H135-W148 HydrophobicContact CB-CH2 4.34Å; H135-W148 HydrophobicContact CB-CZ3 4.01Å; H135-W148 WeakPolarHBondContact O-CH2 3.4Å; I136-W148 VanDerWaalsContact CA-CH2 3.42Å; I136-W148 HydrophobicContact CB-CH2 4.2Å; I136-W148 HydrophobicContact CB-CZ2 4.04Å; I136-W148 HydrophobicContact CG1-CD2 3.84Å; I136-W148 HydrophobicContact CG1-CE3 3.9Å; I136-W148 HydrophobicContact CG1-CH2 3.8Å; I136-W148 HydrophobicContact CG1-CZ2 3.72Å; I136-W148 HydrophobicContact CG1-CZ3 3.89Å; I136-W148 HydrophobicContact CG2-CZ2 4.32Å; T139-W148 HydrophobicContact CG2-CH2 4.14Å; T139-W148 HydrophobicContact CG2-CZ2 4.07Å; T139-W148 VanDerWaalsContact OG1-CH2 3.31Å; T139-W148 WeakPolarHBondContact OG1-CH2 3.37Å; E143-W148 HydrophobicContact CB-CZ2 4.36Å; E143-W148 PolarHBondContact O-NE1 2.84Å; T144-W148 PolarHBondContact O-N 3.18Å; V145-W148 PolarHBondContact O-N 3.17Å; V145-W148 VanDerWaalsContact O-N 3.16Å; Q146-W148 VanDerWaalsContact C-N 3.28Å; Q146-W148 PolarHBondContact O-N 3.03Å; W148-L151 HydrophobicContact CE3-CD1 4.41Å; W148-L151 HydrophobicContact CZ3-CD1 4.48Å; W148-L151 PolarHBondContact O-N 2.98Å; W148-L152 HydrophobicContact CE3-CG 4.33Å; W148-L152 WeakPolarHBondContact O-CB 3.5Å; W148-L152 WeakPolarHBondContact O-CG 3.5Å; W148-L152 PolarHBondContact O-N 2.63Å; W148-Y164 HydrophobicContact CH2-CE1 4.39Å; W148-Y164 HydrophobicContact CZ3-CD1 4.19Å; W148-Y164 HydrophobicContact CZ3-CE1 4.43Å
149I96.9Very high94.8Very high12 Ų1253 Ų536%0.06227%0.273CS..Hα-helixtrans-60.9-49.9175.7-65168.8000109.7R86 L90 V145 Q146 L151 L152 S153 A291 F292R86-I149 HydrophobicContact CB-CG2 4.32Å; L90-I149 HydrophobicContact CD1-CD1 4.47Å; L90-I149 HydrophobicContact CD1-CG1 3.82Å; V145-I149 HydrophobicContact CG1-CD1 4.11Å; V145-I149 WeakPolarHBondContact O-CG1 3.37Å; V145-I149 PolarHBondContact O-N 2.89Å; Q146-I149 PolarHBondContact O-N 2.92Å; I149-L151 PolarHBondContact O-N 3.37Å; I149-L152 PolarHBondContact O-N 3.02Å; I149-S153 VanDerWaalsContact O-CB 3.28Å; I149-S153 WeakPolarHBondContact O-CB 3.45Å; I149-S153 PolarHBondContact O-N 3.21Å; I149-S153 PolarHBondContact O-OG 3.48Å; I149-S153 VanDerWaalsContact O-OG 3.04Å; I149-A291 HydrophobicContact CD1-CB 4.04Å; I149-F292 HydrophobicContact CD1-CE2 3.99Å; I149-F292 HydrophobicContact CD1-CZ 4.11Å
150E95.8Very high94.7Very high67 Ų6759.2 Ų59.231%0.31331%0.305SS..Hα-helixtrans-59.8-44.3178.3-69.4170-167.600112.2Q146 S147 S153 G154 E155Q146-E150 WeakPolarHBondContact CG-OE1 3.33Å; Q146-E150 PolarHBondContact NE2-OE1 3.44Å; Q146-E150 VanDerWaalsContact NE2-OE1 3.08Å; Q146-E150 WeakPolarHBondContact O-CG 3.25Å; Q146-E150 PolarHBondContact O-N 3.04Å; S147-E150 PolarHBondContact O-N 3.02Å; E150-S153 PolarHBondContact O-N 3.43Å; E150-G154 PolarHBondContact O-N 2.87Å; E150-E155 HydrophobicContact CB-CB 4.3Å; E150-E155 PolarHBondContact O-N 3.42Å
151L96.9Very high94.8Very high2 Ų253.9 Ų53.91%0.0128%0.28CS..Hα-helixtrans-65.1-47-179.4-72.5173.8000112.4E143 S147 W148 I149 S153 G154 T156 K161 Y164 Q165E143-L151 HydrophobicContact CG-CD1 4.45Å; S147-L151 VanDerWaalsContact O-CB 3.27Å; S147-L151 WeakPolarHBondContact O-CB 3.42Å; S147-L151 WeakPolarHBondContact O-CG 3.07Å; S147-L151 PolarHBondContact O-N 3.44Å; W148-L151 HydrophobicContact CE3-CD1 4.41Å; W148-L151 HydrophobicContact CZ3-CD1 4.48Å; W148-L151 PolarHBondContact O-N 2.98Å; I149-L151 PolarHBondContact O-N 3.37Å; L151-S153 VanDerWaalsContact C-N 3.3Å; L151-S153 PolarHBondContact O-N 3.43Å; L151-G154 PolarHBondContact O-N 2.83Å; L151-T156 HydrophobicContact CD2-CG2 3.79Å; L151-K161 HydrophobicContact CD1-CD 4.41Å; L151-K161 HydrophobicContact CD2-CB 3.67Å; L151-K161 HydrophobicContact CD2-CD 3.67Å; L151-K161 HydrophobicContact CD2-CG 4.28Å; L151-Y164 HydrophobicContact CD2-CD2 4.16Å; L151-Y164 CarbonylContact O-C 3.58Å; L151-Q165 WeakPolarHBondContact O-CA 3.43Å; L151-Q165 PolarHBondContact O-N 3.37Å
152L97.2Very high94.7Very high0 Ų053.6 Ų53.60%027%0.273CS..Hα-helixtrans-72.9-24.4-179-64.6172.8000112.3R86 L90 A132 W148 I149 L166R86-L152 HydrophobicContact CB-CB 4.39Å; R86-L152 HydrophobicContact CG-CB 3.47Å; R86-L152 VanDerWaalsContact CG-CB 3.47Å; R86-L152 PolarHBondContact NE-O 3.14Å; R86-L152 VanDerWaalsContact NE-O 3.15Å; L90-L152 HydrophobicContact CD2-CD1 4.46Å; A132-L152 HydrophobicContact CB-CD1 4.24Å; A132-L152 HydrophobicContact CB-CD2 4.25Å; W148-L152 HydrophobicContact CE3-CG 4.33Å; W148-L152 WeakPolarHBondContact O-CB 3.5Å; W148-L152 WeakPolarHBondContact O-CG 3.5Å; W148-L152 PolarHBondContact O-N 2.63Å; I149-L152 PolarHBondContact O-N 3.02Å; L152-L166 HydrophobicContact CB-CD1 4.39Å; L152-L166 HydrophobicContact CB-CG 4.4Å; L152-L166 HydrophobicContact CD2-CD1 4.1Å; L152-L166 HydrophobicContact CD2-CD2 4.36Å; L152-L166 HydrophobicContact CD2-CG 3.92Å; L152-L166 PolarHBondContact O-N 2.73Å; L152-L166 VanDerWaalsContact O-N 3.07Å
153S94.6Very high94.6Very high10 Ų1057.6 Ų57.67%0.0729%0.289CS..Hα-helixtrans-80.5-25.2171.1-66.50000112.6I149 E150 L151 Q165I149-S153 VanDerWaalsContact O-CB 3.28Å; I149-S153 WeakPolarHBondContact O-CB 3.45Å; I149-S153 PolarHBondContact O-N 3.21Å; I149-S153 PolarHBondContact O-OG 3.48Å; I149-S153 VanDerWaalsContact O-OG 3.04Å; E150-S153 PolarHBondContact O-N 3.43Å; L151-S153 VanDerWaalsContact C-N 3.3Å; L151-S153 PolarHBondContact O-N 3.43Å; S153-Q165 PolarHBondContact O-NE2 2.97Å; S153-Q165 VanDerWaalsContact O-NE2 3.15Å
154G93.6Very high94.6Very high24 Ų2457.4 Ų57.425%0.24729%0.287CS..THydrogen-bonded Turntrans84.725.8-175.500000113.7E150 L151 T156E150-G154 PolarHBondContact O-N 2.87Å; L151-G154 PolarHBondContact O-N 2.83Å; G154-T156 PolarHBondContact O-N 2.7Å
155E92Very high94.6Very high95 Ų9559.5 Ų59.544%0.44430%0.295SS..  trans-85.16.1178.4-67169.7-162.600112.4E150E150-E155 HydrophobicContact CB-CB 4.3Å; E150-E155 PolarHBondContact O-N 3.42Å
156T91.5Very high94.5Very high28 Ų2859.6 Ų59.617%0.17230%0.295CS..  trans-86.1139.7176.6-165.70000112.2L151 G154 N158 K161 L162L151-T156 HydrophobicContact CD2-CG2 3.79Å; G154-T156 PolarHBondContact O-N 2.7Å; T156-N158 PolarHBondContact OG1-N 3.47Å; T156-K161 HydrophobicContact CG2-CB 4.06Å; T156-L162 HydrophobicContact CG2-CD2 4.33Å
157W90.7Very high94.4Very high246 Ų24662.9 Ų62.993%0.93230%0.304SS*.  trans-92.4-0.8172.6-64.794.8000113.6P159W157-P159 VanDerWaalsContact O-CD 3.28Å; W157-P159 WeakPolarHBondContact O-CD 3.45Å
158N92.3Very high94.3Very high64 Ų6467.3 Ų67.334%0.34233%0.326SS..  trans-80.2115.2-179.3-178.1-14.2000110.7T156 L160 K161 L162T156-N158 PolarHBondContact OG1-N 3.47Å; N158-L160 PolarHBondContact O-N 2.92Å; N158-L160 VanDerWaalsContact O-N 3.16Å; N158-L160 WeakPolarHBondContact OD1-CB 3.2Å; N158-L160 PolarHBondContact OD1-N 3.08Å; N158-K161 HydrophobicContact CB-CB 4.16Å; N158-K161 HydrophobicContact CB-CG 4.28Å; N158-K161 PolarHBondContact O-N 2.87Å; N158-L162 PolarHBondContact O-N 3.3Å
159P92.2Very high94.1Very high102 Ų10267.5 Ų67.566%0.66233%0.327SS*.G310 helixtrans-58.1-33.8-177.6-25.335.9000113.8W157 K161 L162W157-P159 VanDerWaalsContact O-CD 3.28Å; W157-P159 WeakPolarHBondContact O-CD 3.45Å; P159-K161 PolarHBondContact O-N 3.2Å; P159-L162 PolarHBondContact O-N 3.27Å
160L93.2Very high93.8Very high141 Ų14170.7 Ų70.774%0.73834%0.338SS*.G310 helixtrans-69.4-18.3179.1-60.5178000112.4N158 H163N158-L160 PolarHBondContact O-N 2.92Å; N158-L160 VanDerWaalsContact O-N 3.16Å; N158-L160 WeakPolarHBondContact OD1-CB 3.2Å; N158-L160 PolarHBondContact OD1-N 3.08Å; L160-H163 PolarHBondContact O-CE1 3.16Å; L160-H163 PolarHBondContact O-ND1 2.88Å
161K93.2Very high93.6Very high47 Ų4772.6 Ų72.620%0.20435%0.347CS..G310 helixtrans-109.42.2-177-64.4-162.3177.9-175.70113.7E143 L151 T156 N158 P159 H163 Y164E143-K161 IonicContact OE1-NZ 2.8Å; E143-K161 PolarHBondContact OE1-NZ 3.45Å; L151-K161 HydrophobicContact CD1-CD 4.41Å; L151-K161 HydrophobicContact CD2-CB 3.67Å; L151-K161 HydrophobicContact CD2-CD 3.67Å; L151-K161 HydrophobicContact CD2-CG 4.28Å; T156-K161 HydrophobicContact CG2-CB 4.06Å; N158-K161 HydrophobicContact CB-CB 4.16Å; N158-K161 HydrophobicContact CB-CG 4.28Å; N158-K161 PolarHBondContact O-N 2.87Å; P159-K161 PolarHBondContact O-N 3.2Å; K161-H163 PolarHBondContact O-N 3.02Å; K161-Y164 HydrophobicContact CB-CD2 3.8Å; K161-Y164 HydrophobicContact CB-CE2 4.12Å; K161-Y164 HydrophobicContact CG-CD2 4.2Å; K161-Y164 HydrophobicContact CG-CE2 4.02Å; K161-Y164 VanDerWaalsContact O-CD2 3.27Å; K161-Y164 WeakPolarHBondContact O-CD2 3.38Å; K161-Y164 PolarHBondContact O-N 3.41Å
162L91.8Very high93.5Very high87 Ų8775 Ų7546%0.45536%0.356SS..G310 helixtrans-64.1-23.1177.5-68.3176.1000113.4T156 N158 P159 Y164 Q165T156-L162 HydrophobicContact CG2-CD2 4.33Å; N158-L162 PolarHBondContact O-N 3.3Å; P159-L162 PolarHBondContact O-N 3.27Å; L162-Y164 PolarHBondContact O-N 2.9Å; L162-Q165 PolarHBondContact O-N 3.16Å
163H93.8Very high93.3Very high115 Ų11575 Ų7553%0.53236%0.356SS..G310 helixtrans-73.9-9.2179.771.4-89.5000113.9L160 K161 Q165L160-H163 PolarHBondContact O-CE1 3.16Å; L160-H163 PolarHBondContact O-ND1 2.88Å; K161-H163 PolarHBondContact O-N 3.02Å; H163-Q165 VanDerWaalsContact C-N 3.32Å
164Y96.2Very high93.2Very high26 Ų2674.9 Ų74.910%0.10236%0.356CS..G310 helixtrans-78.4-15.3176.2-71.4-69.7000113.5H135 T139 W148 L151 K161 L162 L166H135-Y164 HydrophobicContact CB-CD1 3.65Å; H135-Y164 HydrophobicContact CB-CE1 3.91Å; H135-Y164 AromaticContact CG-CD1 3.56Å; H135-Y164 AromaticContact ND1-CD1 3.62Å; H135-Y164 AromaticContact ND1-CE1 3.9Å; T139-Y164 VanDerWaalsContact OG1-CE1 3.22Å; T139-Y164 WeakPolarHBondContact OG1-CE1 3.39Å; T139-Y164 VanDerWaalsContact OG1-CZ 3.32Å; T139-Y164 PolarHBondContact OG1-OH 3.04Å; W148-Y164 HydrophobicContact CH2-CE1 4.39Å; W148-Y164 HydrophobicContact CZ3-CD1 4.19Å; W148-Y164 HydrophobicContact CZ3-CE1 4.43Å; L151-Y164 HydrophobicContact CD2-CD2 4.16Å; L151-Y164 CarbonylContact O-C 3.58Å; K161-Y164 HydrophobicContact CB-CD2 3.8Å; K161-Y164 HydrophobicContact CB-CE2 4.12Å; K161-Y164 HydrophobicContact CG-CD2 4.2Å; K161-Y164 HydrophobicContact CG-CE2 4.02Å; K161-Y164 VanDerWaalsContact O-CD2 3.27Å; K161-Y164 WeakPolarHBondContact O-CD2 3.38Å; K161-Y164 PolarHBondContact O-N 3.41Å; L162-Y164 PolarHBondContact O-N 2.9Å; Y164-L166 PolarHBondContact O-N 2.67Å
165Q96.9Very high93.1Very high69 Ų6979.7 Ų79.732%0.32237%0.37SS..PPolyproline II helixtrans-65122.6-177-178.6-176.436.800111L151 S153 L162 H163 R167L151-Q165 WeakPolarHBondContact O-CA 3.43Å; L151-Q165 PolarHBondContact O-N 3.37Å; S153-Q165 PolarHBondContact O-NE2 2.97Å; S153-Q165 VanDerWaalsContact O-NE2 3.15Å; L162-Q165 PolarHBondContact O-N 3.16Å; H163-Q165 VanDerWaalsContact C-N 3.32Å; Q165-R167 PolarHBondContact O-N 3.34Å
166L96.1Very high93.3Very high3 Ų376 Ų762%0.01635%0.354CS..PPolyproline II helixtrans-74.1117.6170-61.5-180000109.5R86 M89 L128 E131 A132 L152 Y164 V169R86-L166 PolarHBondContact NH2-O 3.25Å; R86-L166 VanDerWaalsContact NH2-O 3.1Å; M89-L166 HydrophobicContact CE-CD1 3.96Å; M89-L166 HydrophobicContact SD-CD1 3.4Å; M89-L166 WeakPolarHBondContact SD-CD1 3.42Å; L128-L166 HydrophobicContact CD2-CD1 4.41Å; E131-L166 HydrophobicContact CB-CD2 4.01Å; E131-L166 HydrophobicContact CG-CD2 3.54Å; E131-L166 WeakPolarHBondContact OE1-CD2 3.38Å; A132-L166 HydrophobicContact CB-CD1 4.44Å; L152-L166 HydrophobicContact CB-CD1 4.39Å; L152-L166 HydrophobicContact CB-CG 4.4Å; L152-L166 HydrophobicContact CD2-CD1 4.1Å; L152-L166 HydrophobicContact CD2-CD2 4.36Å; L152-L166 HydrophobicContact CD2-CG 3.92Å; L152-L166 PolarHBondContact O-N 2.73Å; L152-L166 VanDerWaalsContact O-N 3.07Å; Y164-L166 PolarHBondContact O-N 2.67Å; L166-V169 HydrophobicContact CB-CG2 3.73Å; L166-V169 WeakPolarHBondContact O-CG2 3.42Å
167R93.9Very high93.4Very high162 Ų16274.7 Ų74.761%0.61135%0.346SS*.PPolyproline II helixtrans-96.1153.4-179.4-62.1-176.3179-177.60.5111.8Q165 V169Q165-R167 PolarHBondContact O-N 3.34Å; R167-V169 PolarHBondContact O-N 3.32Å
168N93Very high93.5Very high113 Ų11365 Ų6560%0.60431%0.313SS*.SBendtrans54.737.3175-48.9-27.2000112.9R170 E171 R172N168-R170 VanDerWaalsContact C-N 3.29Å; N168-R170 PolarHBondContact O-N 3.07Å; N168-E171 WeakPolarHBondContact CA-OE2 3.48Å; N168-E171 HydrophobicContact CB-CB 4.43Å; N168-E171 WeakPolarHBondContact CB-OE2 3.35Å; N168-E171 PolarHBondContact O-N 3.4Å; N168-R172 WeakPolarHBondContact O-CB 3.29Å; N168-R172 WeakPolarHBondContact O-CD 3.33Å; N168-R172 WeakPolarHBondContact O-CG 3.2Å; N168-R172 PolarHBondContact O-N 3.23Å
169V94.5Very high93.5Very high5 Ų568 Ų683%0.0333%0.326CS..Hα-helixtrans-61.5-40.9-175.11740000110.9W77 M89 L128 L166 R167 R172 L173W77-V169 HydrophobicContact CH2-CB 4.44Å; W77-V169 HydrophobicContact CH2-CG1 4.23Å; M89-V169 HydrophobicContact CE-CG1 3.95Å; L128-V169 HydrophobicContact CD1-CG1 4.17Å; L128-V169 HydrophobicContact CD2-CG1 4.48Å; L128-V169 HydrophobicContact CD2-CG2 3.96Å; L166-V169 HydrophobicContact CB-CG2 3.73Å; L166-V169 WeakPolarHBondContact O-CG2 3.42Å; R167-V169 PolarHBondContact O-N 3.32Å; V169-R172 PolarHBondContact O-N 3.48Å; V169-L173 HydrophobicContact CG1-CD1 3.81Å; V169-L173 HydrophobicContact CG1-CG 4.21Å; V169-L173 WeakPolarHBondContact O-CB 3.03Å; V169-L173 VanDerWaalsContact O-CG 3.29Å; V169-L173 WeakPolarHBondContact O-CG 3.28Å; V169-L173 PolarHBondContact O-N 3.29Å
170R91Very high93.6Very high78 Ų7866.3 Ų66.329%0.29431%0.308SS..Hα-helixtrans-60.3-49.4178.3179.4177.6163.3179.7-6.7111.6W77 N168 R172 L173 A174W77-R170 HydrophobicContact CD2-CB 4.45Å; W77-R170 HydrophobicContact CE3-CB 4.02Å; W77-R170 HydrophobicContact CE3-CG 4.12Å; W77-R170 HydrophobicContact CH2-CB 3.98Å; W77-R170 HydrophobicContact CZ2-CB 4.44Å; W77-R170 HydrophobicContact CZ3-CB 3.77Å; W77-R170 HydrophobicContact CZ3-CG 4.15Å; N168-R170 VanDerWaalsContact C-N 3.29Å; N168-R170 PolarHBondContact O-N 3.07Å; R170-R172 VanDerWaalsContact C-N 3.35Å; R170-L173 PolarHBondContact O-N 3.45Å; R170-A174 WeakPolarHBondContact O-CB 3.07Å; R170-A174 PolarHBondContact O-N 2.9Å
171E90.2Very high93.6Very high108 Ų10861.6 Ų61.651%0.50529%0.293SS..Hα-helixtrans-65.5-39.9-179.1-62.777.3-172.400111.2N168 A174 K175N168-E171 WeakPolarHBondContact CA-OE2 3.48Å; N168-E171 HydrophobicContact CB-CB 4.43Å; N168-E171 WeakPolarHBondContact CB-OE2 3.35Å; N168-E171 PolarHBondContact O-N 3.4Å; E171-A174 PolarHBondContact O-N 3.22Å; E171-K175 WeakPolarHBondContact O-CB 3.26Å; E171-K175 PolarHBondContact O-N 3.27Å
172R94.8Very high93.6Very high51 Ų5159.3 Ų59.319%0.19228%0.283CS..Hα-helixtrans-68-42178-70.9168.367.8175.42.8112.1V127 L128 E131 N168 V169 R170 K175 N176V127-R172 PolarHBondContact O-NH2 3.21Å; V127-R172 VanDerWaalsContact O-NH2 3.13Å; L128-R172 HydrophobicContact CD1-CB 4.17Å; L128-R172 HydrophobicContact CD2-CB 4.47Å; L128-R172 HydrophobicContact CG-CB 4.37Å; E131-R172 IonicContact OE1-NH1 2.94Å; E131-R172 IonicContact OE2-CZ 3.98Å; E131-R172 IonicContact OE2-NH1 2.81Å; E131-R172 PolarHBondContact OE2-NH1 3.25Å; E131-R172 IonicContact OE2-NH2 2.69Å; E131-R172 PolarHBondContact OE2-NH2 2.95Å; N168-R172 WeakPolarHBondContact O-CB 3.29Å; N168-R172 WeakPolarHBondContact O-CD 3.33Å; N168-R172 WeakPolarHBondContact O-CG 3.2Å; N168-R172 PolarHBondContact O-N 3.23Å; V169-R172 PolarHBondContact O-N 3.48Å; R170-R172 VanDerWaalsContact C-N 3.35Å; R172-K175 WeakPolarHBondContact O-CB 3.4Å; R172-K175 PolarHBondContact O-N 2.94Å; R172-N176 PolarHBondContact O-N 3.3Å; R172-N176 PolarHBondContact O-OD1 3.45Å
173L94.5Very high93.6Very high0 Ų055.4 Ų55.40%026%0.263CS..Hα-helixtrans-65.7-42.1174.2-71.6174000111.7M59 E60 L63 L85 L128 V169 R170 K175 N176 L177M59-L173 HydrophobicContact CB-CD1 4.2Å; M59-L173 HydrophobicContact CB-CD2 3.75Å; E60-L173 HydrophobicContact CG-CD2 4.17Å; L63-L173 HydrophobicContact CD2-CB 3.56Å; L63-L173 HydrophobicContact CD2-CD1 4.11Å; L63-L173 HydrophobicContact CD2-CG 4.47Å; L85-L173 HydrophobicContact CD1-CD1 3.94Å; L85-L173 HydrophobicContact CD2-CD1 4.18Å; L128-L173 HydrophobicContact CD1-CD2 3.61Å; L128-L173 HydrophobicContact CD1-CG 3.72Å; V169-L173 HydrophobicContact CG1-CD1 3.81Å; V169-L173 HydrophobicContact CG1-CG 4.21Å; V169-L173 WeakPolarHBondContact O-CB 3.03Å; V169-L173 VanDerWaalsContact O-CG 3.29Å; V169-L173 WeakPolarHBondContact O-CG 3.28Å; V169-L173 PolarHBondContact O-N 3.29Å; R170-L173 PolarHBondContact O-N 3.45Å; L173-K175 VanDerWaalsContact C-N 3.3Å; L173-K175 PolarHBondContact O-N 2.87Å; L173-N176 PolarHBondContact O-N 2.84Å; L173-L177 WeakPolarHBondContact O-CG 3.27Å; L173-L177 PolarHBondContact O-N 2.96Å
174A91.8Very high93.5Very high9 Ų952.1 Ų52.17%0.07425%0.251CS..Hα-helixtrans-59.6-43.7174.500000111R170 E171 N176 L177 V178 H198R170-A174 WeakPolarHBondContact O-CB 3.07Å; R170-A174 PolarHBondContact O-N 2.9Å; E171-A174 PolarHBondContact O-N 3.22Å; A174-N176 PolarHBondContact O-N 3.15Å; A174-L177 PolarHBondContact O-N 3.42Å; A174-V178 VanDerWaalsContact O-CG2 3.32Å; A174-V178 WeakPolarHBondContact O-CG2 3.27Å; A174-V178 PolarHBondContact O-N 3.04Å; A174-H198 HydrophobicContact CB-CB 4.46Å
175K92.3Very high93.3Very high124 Ų12454.9 Ų54.954%0.53927%0.271SS..Hα-helixtrans-59.6-46.4175.1-168.2-171.7-180-139.30112.2E171 R172 L173 L177 V178 E179E171-K175 WeakPolarHBondContact O-CB 3.26Å; E171-K175 PolarHBondContact O-N 3.27Å; R172-K175 WeakPolarHBondContact O-CB 3.4Å; R172-K175 PolarHBondContact O-N 2.94Å; L173-K175 VanDerWaalsContact C-N 3.3Å; L173-K175 PolarHBondContact O-N 2.87Å; K175-L177 VanDerWaalsContact C-N 3.31Å; K175-L177 PolarHBondContact O-N 3.24Å; K175-V178 WeakPolarHBondContact O-CB 3.29Å; K175-V178 PolarHBondContact O-N 2.95Å; K175-V178 VanDerWaalsContact O-N 3.16Å; K175-E179 WeakPolarHBondContact CE-OE1 3.45Å; K175-E179 IonicContact NZ-OE1 3.54Å; K175-E179 PolarHBondContact NZ-OE1 3.26Å; K175-E179 VanDerWaalsContact NZ-OE1 3.08Å; K175-E179 WeakPolarHBondContact O-CG 3.34Å; K175-E179 PolarHBondContact O-N 3.49Å
176N94.5Very high92.8Very high18 Ų1856 Ų5610%0.09628%0.276CS..Hα-helixtrans-59.3-43.1176.1-72.12.3000111.5E60 D126 R172 L173 A174 V178 E179 K180E60-N176 WeakPolarHBondContact OE1-CB 3.46Å; D126-N176 PolarHBondContact OD2-ND2 2.99Å; R172-N176 PolarHBondContact O-N 3.3Å; R172-N176 PolarHBondContact O-OD1 3.45Å; L173-N176 PolarHBondContact O-N 2.84Å; A174-N176 PolarHBondContact O-N 3.15Å; N176-V178 VanDerWaalsContact C-N 3.32Å; N176-V178 PolarHBondContact O-N 2.98Å; N176-E179 PolarHBondContact O-N 3.42Å; N176-K180 WeakPolarHBondContact O-CB 3.35Å; N176-K180 VanDerWaalsContact O-CG 3.28Å; N176-K180 WeakPolarHBondContact O-CG 3.44Å; N176-K180 PolarHBondContact O-N 2.91Å
177L93.7Very high92.4Very high1 Ų162.2 Ų62.21%0.00530%0.303CS..Hα-helixtrans-66.6-31.5177.3-73.1173.4000113L56 E60 L63 L64 L173 A174 K175 G181 V182 L183L56-L177 HydrophobicContact CD2-CD2 3.91Å; E60-L177 HydrophobicContact CB-CD2 3.89Å; E60-L177 HydrophobicContact CB-CG 4.43Å; E60-L177 HydrophobicContact CG-CD2 3.97Å; E60-L177 HydrophobicContact CG-CG 4.13Å; L63-L177 HydrophobicContact CD2-CD1 3.93Å; L64-L177 HydrophobicContact CD1-CD2 4.09Å; L64-L177 HydrophobicContact CD2-CD1 3.98Å; L64-L177 HydrophobicContact CD2-CD2 4.43Å; L64-L177 HydrophobicContact CG-CD1 4.14Å; L64-L177 HydrophobicContact CG-CD2 4.25Å; L173-L177 WeakPolarHBondContact O-CG 3.27Å; L173-L177 PolarHBondContact O-N 2.96Å; A174-L177 PolarHBondContact O-N 3.42Å; K175-L177 VanDerWaalsContact C-N 3.31Å; K175-L177 PolarHBondContact O-N 3.24Å; L177-G181 PolarHBondContact O-N 3.46Å; L177-V182 HydrophobicContact CB-CB 4.38Å; L177-V182 HydrophobicContact CD2-CB 4.13Å; L177-V182 HydrophobicContact CD2-CG1 4.36Å; L177-V182 HydrophobicContact CD2-CG2 4.13Å; L177-V182 WeakPolarHBondContact O-CB 3.24Å; L177-V182 PolarHBondContact O-N 3.44Å; L177-L183 HydrophobicContact CB-CB 4.43Å; L177-L183 HydrophobicContact CB-CD1 3.72Å; L177-L183 HydrophobicContact CB-CG 3.78Å; L177-L183 HydrophobicContact CD1-CD1 3.78Å; L177-L183 HydrophobicContact CD1-CG 4.3Å; L177-L183 HydrophobicContact CG-CD1 4.42Å; L177-L183 PolarHBondContact O-N 2.88Å
178V93.5Very high91.9Very high42 Ų4257.7 Ų57.726%0.25529%0.289SS..Hα-helixtrans-69.2-46171.1172.30000110.9A174 K175 N176 K180 G181 L183A174-V178 VanDerWaalsContact O-CG2 3.32Å; A174-V178 WeakPolarHBondContact O-CG2 3.27Å; A174-V178 PolarHBondContact O-N 3.04Å; K175-V178 WeakPolarHBondContact O-CB 3.29Å; K175-V178 PolarHBondContact O-N 2.95Å; K175-V178 VanDerWaalsContact O-N 3.16Å; N176-V178 VanDerWaalsContact C-N 3.32Å; N176-V178 PolarHBondContact O-N 2.98Å; V178-K180 PolarHBondContact O-N 3.42Å; V178-G181 PolarHBondContact O-N 3.1Å; V178-L183 WeakPolarHBondContact CA-O 3.47Å; V178-L183 HydrophobicContact CG2-CB 3.81Å
179E93.1Very high91.5Very high128 Ų12857.9 Ų57.960%0.59829%0.289SS*.Hα-helixtrans-60.3-30.8176.4-71.7175.5-171.900111.7K175 N176 G181K175-E179 WeakPolarHBondContact CE-OE1 3.45Å; K175-E179 IonicContact NZ-OE1 3.54Å; K175-E179 PolarHBondContact NZ-OE1 3.26Å; K175-E179 VanDerWaalsContact NZ-OE1 3.08Å; K175-E179 WeakPolarHBondContact O-CG 3.34Å; K175-E179 PolarHBondContact O-N 3.49Å; N176-E179 PolarHBondContact O-N 3.42Å; E179-G181 VanDerWaalsContact C-N 3.33Å
180K94Very high91.1Very high65 Ų6561.6 Ų61.628%0.28331%0.305SS..THydrogen-bonded Turntrans-83.6-0.9174.4-70.1179.3-171.8-173.80114.6T54 R55 L56 E60 N176 V178 V182T54-K180 HydrophobicContact CG2-CB 3.74Å; T54-K180 HydrophobicContact CG2-CD 4.28Å; T54-K180 HydrophobicContact CG2-CG 4.24Å; R55-K180 PolarHBondContact O-NZ 2.95Å; L56-K180 HydrophobicContact CD2-CD 3.85Å; E60-K180 WeakPolarHBondContact OE1-CE 3.49Å; E60-K180 IonicContact OE1-NZ 2.69Å; E60-K180 PolarHBondContact OE1-NZ 3.18Å; E60-K180 IonicContact OE2-NZ 2.96Å; E60-K180 PolarHBondContact OE2-NZ 3.39Å; N176-K180 WeakPolarHBondContact O-CB 3.35Å; N176-K180 VanDerWaalsContact O-CG 3.28Å; N176-K180 WeakPolarHBondContact O-CG 3.44Å; N176-K180 PolarHBondContact O-N 2.91Å; V178-K180 PolarHBondContact O-N 3.42Å; K180-V182 VanDerWaalsContact C-N 3.31Å; K180-V182 HydrophobicContact CB-CG2 4.22Å; K180-V182 PolarHBondContact O-N 2.97Å
181G92.5Very high90.8Very high42 Ų4266.3 Ų66.343%0.43334%0.336SS..THydrogen-bonded Turntrans69.223.6179.100000114.6L177 V178 E179L177-G181 PolarHBondContact O-N 3.46Å; V178-G181 PolarHBondContact O-N 3.1Å; E179-G181 VanDerWaalsContact C-N 3.33Å
182V93.1Very high90.9Very high0 Ų068.7 Ų68.70%035%0.351CS..SBendtrans-87.3-44.2175.4-174.70000110.7T54 L56 L64 L177 K180 L200 T201 N202 I205T54-V182 HydrophobicContact CG2-CG2 4.41Å; L56-V182 HydrophobicContact CD2-CG2 4.11Å; L64-V182 HydrophobicContact CD1-CG1 4.01Å; L64-V182 HydrophobicContact CD2-CG1 3.84Å; L177-V182 HydrophobicContact CB-CB 4.38Å; L177-V182 HydrophobicContact CD2-CB 4.13Å; L177-V182 HydrophobicContact CD2-CG1 4.36Å; L177-V182 HydrophobicContact CD2-CG2 4.13Å; L177-V182 WeakPolarHBondContact O-CB 3.24Å; L177-V182 PolarHBondContact O-N 3.44Å; K180-V182 VanDerWaalsContact C-N 3.31Å; K180-V182 HydrophobicContact CB-CG2 4.22Å; K180-V182 PolarHBondContact O-N 2.97Å; V182-L200 HydrophobicContact CG1-CD1 3.82Å; V182-T201 PolarHBondContact O-N 3.21Å; V182-T201 PolarHBondContact O-OG1 3.04Å; V182-N202 PolarHBondContact O-N 3.37Å; V182-I205 HydrophobicContact CG1-CG2 4.47Å; V182-I205 HydrophobicContact CG2-CD1 3.92Å
183L93.1Very high90.5Very high5 Ų571.5 Ų71.53%0.02637%0.365CS..BIsolated β-bridgetrans-109.7159.6176.8-54.5-178.4000110.3L64 L67 L177 V178 H198 P199 L200L64-L183 HydrophobicContact CD2-CD2 4.36Å; L67-L183 HydrophobicContact CD2-CD1 4.4Å; L67-L183 HydrophobicContact CD2-CD2 3.51Å; L177-L183 HydrophobicContact CB-CB 4.43Å; L177-L183 HydrophobicContact CB-CD1 3.72Å; L177-L183 HydrophobicContact CB-CG 3.78Å; L177-L183 HydrophobicContact CD1-CD1 3.78Å; L177-L183 HydrophobicContact CD1-CG 4.3Å; L177-L183 HydrophobicContact CG-CD1 4.42Å; L177-L183 PolarHBondContact O-N 2.88Å; V178-L183 WeakPolarHBondContact CA-O 3.47Å; V178-L183 HydrophobicContact CG2-CB 3.81Å; L183-H198 HydrophobicContact CB-CB 4.32Å; L183-H198 HydrophobicContact CD1-CB 3.94Å; L183-P199 WeakPolarHBondContact CA-O 3.48Å; L183-L200 HydrophobicContact CD2-CB 4.23Å; L183-L200 HydrophobicContact CD2-CD1 3.87Å
184T91.4Very high90.1Very high46 Ų4675.6 Ų75.628%0.28239%0.387SS..  trans-107.8175.316349.20000111H198 P199 T201T184-H198 WeakPolarHBondContact O-CA 3.41Å; T184-H198 PolarHBondContact O-ND1 2.95Å; T184-P199 PolarHBondContact N-O 3.28Å; T184-T201 HydrophobicContact CG2-CG2 3.21Å; T184-T201 WeakPolarHBondContact OG1-CG2 3.46Å
185T90.5Very high89.7Confident84 Ų8478.2 Ų78.252%0.51540%0.398SS..  trans-112.8116.6169.6-59.80000107.4T196 H198T185-T196 HydrophobicContact CG2-CG2 3.38Å; T185-H198 PolarHBondContact OG1-ND1 3.34Å
186E87.4Confident89.4Confident92 Ų9275.9 Ų75.943%0.4339%0.394SS..EExtended strand (participates in β ladder)trans-117.4135.3175.8-70.8-175.8-172.600109.6T196 T197 P199E186-T196 CarbonylContact O-C 3.52Å; E186-T196 WeakPolarHBondContact O-CA 3.23Å; E186-T197 PolarHBondContact N-O 3Å; E186-T197 PolarHBondContact O-N 3.35Å; E186-T197 PolarHBondContact O-OG1 3.22Å; E186-P199 HydrophobicContact CB-CG 4.27Å; E186-P199 VanDerWaalsContact CD-CG 3.47Å; E186-P199 HydrophobicContact CG-CG 3.85Å
187K87.3Confident89Confident133 Ų13375 Ų7558%0.57839%0.39SS*.EExtended strand (participates in β ladder)trans-92.1106172-172-178175.5-168.50108D194K187-D194 WeakPolarHBondContact CE-OD2 3.42Å; K187-D194 HydrophobicContact CG-CB 4.47Å; K187-D194 IonicContact NZ-OD2 2.66Å; K187-D194 PolarHBondContact NZ-OD2 3.48Å
188Q83.1Confident88.7Confident68 Ų6876.9 Ų76.932%0.31840%0.398SS..EExtended strand (participates in β ladder)trans-90.3123.2173.9-70.6-168.9-9.500109.9F190 D194 M195 T197Q188-F190 HydrophobicContact CB-CD2 4.38Å; Q188-F190 HydrophobicContact CB-CE2 3.67Å; Q188-F190 HydrophobicContact CB-CZ 4.27Å; Q188-D194 WeakPolarHBondContact O-CA 3.37Å; Q188-M195 PolarHBondContact N-O 3.12Å; Q188-M195 PolarHBondContact O-N 3.17Å; Q188-T197 HydrophobicContact CB-CG2 4.33Å; Q188-T197 VanDerWaalsContact CD-CG2 3.46Å; Q188-T197 HydrophobicContact CG-CG2 3.88Å
189N86.3Confident88.6Confident116 Ų11675.5 Ų75.562%0.6239%0.39SS*.EExtended strand (participates in β ladder)trans-92.9109.9176.9-51.6-41.3000108.1D194N189-D194 PolarHBondContact OD1-OD1 2.96Å; N189-D194 VanDerWaalsContact OD1-OD1 3.06Å
190F84.3Confident88.5Confident84 Ų8470.6 Ų70.637%0.36837%0.368SS..  trans-88.6160.9169.5-63.2-95.8000109.2Q188 L192 F193 M195Q188-F190 HydrophobicContact CB-CD2 4.38Å; Q188-F190 HydrophobicContact CB-CE2 3.67Å; Q188-F190 HydrophobicContact CB-CZ 4.27Å; F190-L192 PolarHBondContact O-N 3.45Å; F190-F193 CarbonylContact C-O 3.57Å; F190-F193 VanDerWaalsContact CA-O 3.29Å; F190-F193 WeakPolarHBondContact CA-O 3.41Å; F190-F193 HydrophobicContact CB-CD1 4.34Å; F190-F193 HydrophobicContact CB-CD2 4.27Å; F190-F193 HydrophobicContact CB-CE1 4.16Å; F190-F193 HydrophobicContact CB-CE2 4.09Å; F190-F193 HydrophobicContact CB-CG 4.39Å; F190-F193 HydrophobicContact CB-CZ 4.03Å; F190-F193 WeakPolarHBondContact CB-O 3.44Å; F190-F193 HydrophobicContact CD1-CZ 4.43Å; F190-F193 HydrophobicContact CD2-CD2 4.06Å; F190-F193 AromaticContact CD2-CE2 3.58Å; F190-F193 HydrophobicContact CD2-CE2 3.58Å; F190-F193 HydrophobicContact CD2-CZ 4.11Å; F190-F193 HydrophobicContact CE2-CE2 4.24Å; F190-F193 HydrophobicContact CG-CD2 4.41Å; F190-F193 AromaticContact CG-CE2 3.86Å; F190-F193 HydrophobicContact CG-CE2 3.86Å; F190-F193 AromaticContact CG-CZ 3.92Å; F190-F193 HydrophobicContact CG-CZ 3.92Å; F190-F193 PolarHBondContact N-O 3.03Å; F190-F193 PolarHBondContact O-N 3.31Å; F190-F193 VanDerWaalsContact O-O 3.12Å; F190-M195 HydrophobicContact CD2-CB 4.02Å; F190-M195 HydrophobicContact CD2-CE 4.4Å; F190-M195 HydrophobicContact CE2-CB 3.78Å; F190-M195 HydrophobicContact CE2-CE 3.45Å; F190-M195 VanDerWaalsContact CE2-CE 3.45Å; F190-M195 HydrophobicContact CZ-CE 3.64Å
191L86.6Confident88.3Confident177 Ų17771 Ų7193%0.92738%0.376SS*.SBendtrans-53.5-29.4-177.4-176.163.7000113.5
192L90.3Very high88.2Confident157 Ų15771.2 Ų71.282%0.82237%0.367SS*.SBendtrans-117-10.2-174.2-61.6177.8000114.5F190F190-L192 PolarHBondContact O-N 3.45Å
193F86.5Confident88.1Confident111 Ų11173.9 Ų73.949%0.48739%0.386SS..  trans-164.7157.5-176.758.8-88.8000111.1F190 M195F190-F193 CarbonylContact C-O 3.57Å; F190-F193 VanDerWaalsContact CA-O 3.29Å; F190-F193 WeakPolarHBondContact CA-O 3.41Å; F190-F193 HydrophobicContact CB-CD1 4.34Å; F190-F193 HydrophobicContact CB-CD2 4.27Å; F190-F193 HydrophobicContact CB-CE1 4.16Å; F190-F193 HydrophobicContact CB-CE2 4.09Å; F190-F193 HydrophobicContact CB-CG 4.39Å; F190-F193 HydrophobicContact CB-CZ 4.03Å; F190-F193 WeakPolarHBondContact CB-O 3.44Å; F190-F193 HydrophobicContact CD1-CZ 4.43Å; F190-F193 HydrophobicContact CD2-CD2 4.06Å; F190-F193 AromaticContact CD2-CE2 3.58Å; F190-F193 HydrophobicContact CD2-CE2 3.58Å; F190-F193 HydrophobicContact CD2-CZ 4.11Å; F190-F193 HydrophobicContact CE2-CE2 4.24Å; F190-F193 HydrophobicContact CG-CD2 4.41Å; F190-F193 AromaticContact CG-CE2 3.86Å; F190-F193 HydrophobicContact CG-CE2 3.86Å; F190-F193 AromaticContact CG-CZ 3.92Å; F190-F193 HydrophobicContact CG-CZ 3.92Å; F190-F193 PolarHBondContact N-O 3.03Å; F190-F193 PolarHBondContact O-N 3.31Å; F190-F193 VanDerWaalsContact O-O 3.12Å; F193-M195 HydrophobicContact CD2-CB 4.1Å; F193-M195 HydrophobicContact CE2-CB 3.95Å; F193-M195 HydrophobicContact CE2-SD 4.34Å
194D86.4Confident88.1Confident86 Ų8677 Ų7746%0.4641%0.405SS..EExtended strand (participates in β ladder)trans-97.1138168.4-61.6-21.7000109.3K187 Q188 N189K187-D194 WeakPolarHBondContact CE-OD2 3.42Å; K187-D194 HydrophobicContact CG-CB 4.47Å; K187-D194 IonicContact NZ-OD2 2.66Å; K187-D194 PolarHBondContact NZ-OD2 3.48Å; Q188-D194 WeakPolarHBondContact O-CA 3.37Å; N189-D194 PolarHBondContact OD1-OD1 2.96Å; N189-D194 VanDerWaalsContact OD1-OD1 3.06Å
195M84.1Confident88.2Confident63 Ų6375.7 Ų75.731%0.3140%0.396SS..EExtended strand (participates in β ladder)trans-128.8135.5177.1-162.8176.846.200109.9Y73 Q188 F190 F193 T197Y73-M195 HydrophobicContact CE2-CE 3.4Å; Y73-M195 HydrophobicContact CE2-SD 4Å; Y73-M195 VanDerWaalsContact OH-CE 3.25Å; Y73-M195 WeakPolarHBondContact OH-CE 3.3Å; Y73-M195 WeakPolarHBondContact OH-CG 3.48Å; Y73-M195 PolarHBondContact OH-SD 3.43Å; Q188-M195 PolarHBondContact N-O 3.12Å; Q188-M195 PolarHBondContact O-N 3.17Å; F190-M195 HydrophobicContact CD2-CB 4.02Å; F190-M195 HydrophobicContact CD2-CE 4.4Å; F190-M195 HydrophobicContact CE2-CB 3.78Å; F190-M195 HydrophobicContact CE2-CE 3.45Å; F190-M195 VanDerWaalsContact CE2-CE 3.45Å; F190-M195 HydrophobicContact CZ-CE 3.64Å; F193-M195 HydrophobicContact CD2-CB 4.1Å; F193-M195 HydrophobicContact CE2-CB 3.95Å; F193-M195 HydrophobicContact CE2-SD 4.34Å; M195-T197 HydrophobicContact CE-CG2 4.42Å
196T85.4Confident88.3Confident75 Ų7573 Ų7346%0.4638%0.378SS..EExtended strand (participates in β ladder)trans-87.1118.5174.2-57.90000108.8Y73 T185 E186Y73-T196 VanDerWaalsContact OH-C 3.23Å; Y73-T196 PolarHBondContact OH-O 3.31Å; T185-T196 HydrophobicContact CG2-CG2 3.38Å; E186-T196 CarbonylContact O-C 3.52Å; E186-T196 WeakPolarHBondContact O-CA 3.23Å
197T85.9Confident88.6Confident1 Ų174.9 Ų74.91%0.00639%0.386CS..EExtended strand (participates in β ladder)trans-102.8157.7175.354.10000110.7Y73 E186 Q188 M195 P199Y73-T197 HydrophobicContact CE1-CG2 4.33Å; Y73-T197 HydrophobicContact CE2-CG2 3.5Å; Y73-T197 VanDerWaalsContact OH-CA 3.3Å; Y73-T197 WeakPolarHBondContact OH-CA 3.48Å; Y73-T197 WeakPolarHBondContact OH-CG2 3.38Å; Y73-T197 PolarHBondContact OH-N 3.34Å; E186-T197 PolarHBondContact N-O 3Å; E186-T197 PolarHBondContact O-N 3.35Å; E186-T197 PolarHBondContact O-OG1 3.22Å; Q188-T197 HydrophobicContact CB-CG2 4.33Å; Q188-T197 VanDerWaalsContact CD-CG2 3.46Å; Q188-T197 HydrophobicContact CG-CG2 3.88Å; M195-T197 HydrophobicContact CE-CG2 4.42Å; T197-P199 VanDerWaalsContact C-CD 3.49Å; T197-P199 WeakPolarHBondContact O-CD 3.25Å
198H89.1Confident88.9Confident39 Ų3974.4 Ų74.418%0.18138%0.381CS..  trans-123.269.7175.5-60.5-68000112.1G72 A174 L183 T184 T185G72-H198 CarbonylContact C-O 3.49Å; G72-H198 VanDerWaalsContact CA-C 3.43Å; G72-H198 WeakPolarHBondContact CA-O 3.38Å; A174-H198 HydrophobicContact CB-CB 4.46Å; L183-H198 HydrophobicContact CB-CB 4.32Å; L183-H198 HydrophobicContact CD1-CB 3.94Å; T184-H198 WeakPolarHBondContact O-CA 3.41Å; T184-H198 PolarHBondContact O-ND1 2.95Å; T185-H198 PolarHBondContact OG1-ND1 3.34Å
199P89.7Confident89.5Confident13 Ų1371.5 Ų71.58%0.08437%0.367CS..  trans-66.9153.7-177.427.7-31.4000112L183 T184 E186 T197 T201L183-P199 WeakPolarHBondContact CA-O 3.48Å; T184-P199 PolarHBondContact N-O 3.28Å; E186-P199 HydrophobicContact CB-CG 4.27Å; E186-P199 VanDerWaalsContact CD-CG 3.47Å; E186-P199 HydrophobicContact CG-CG 3.85Å; T197-P199 VanDerWaalsContact C-CD 3.49Å; T197-P199 WeakPolarHBondContact O-CD 3.25Å; P199-T201 PolarHBondContact O-N 2.87Å
200L91.3Very high90Very high25 Ų2567 Ų6713%0.13134%0.344CS..BIsolated β-bridgetrans-75.4122.1179.1-177.670.9000109.9L64 D69 V182 L183 K206L64-L200 HydrophobicContact CD2-CD1 4.31Å; D69-L200 HydrophobicContact CB-CD2 4.43Å; D69-L200 PolarHBondContact O-N 2.94Å; V182-L200 HydrophobicContact CG1-CD1 3.82Å; L183-L200 HydrophobicContact CD2-CB 4.23Å; L183-L200 HydrophobicContact CD2-CD1 3.87Å; L200-K206 HydrophobicContact CD1-CB 4.45Å; L200-K206 HydrophobicContact CD2-CB 3.85Å; L200-K206 HydrophobicContact CD2-CD 3.57Å; L200-K206 HydrophobicContact CD2-CG 4.34Å
201T90.6Very high90.5Very high73 Ų7368.6 Ų68.645%0.44835%0.351SS..  trans-103.5-38.5174.6500000112.8V182 T184 P199 S203V182-T201 PolarHBondContact O-N 3.21Å; V182-T201 PolarHBondContact O-OG1 3.04Å; T184-T201 HydrophobicContact CG2-CG2 3.21Å; T184-T201 WeakPolarHBondContact OG1-CG2 3.46Å; P199-T201 PolarHBondContact O-N 2.87Å; T201-S203 PolarHBondContact O-N 3.43Å
202N89.9Confident91Very high47 Ų4763.4 Ų63.425%0.25132%0.321SS..  trans-92.478.5175.8-163.2-29.9000111.1V182 T204 I205V182-N202 PolarHBondContact O-N 3.37Å; N202-T204 PolarHBondContact O-N 3.45Å; N202-T204 WeakPolarHBondContact OD1-CB 3.48Å; N202-T204 PolarHBondContact OD1-N 2.97Å; N202-I205 HydrophobicContact CB-CD1 4.19Å; N202-I205 HydrophobicContact CB-CG1 4.45Å; N202-I205 VanDerWaalsContact ND2-CD1 3.26Å; N202-I205 WeakPolarHBondContact ND2-CD1 3.5Å; N202-I205 PolarHBondContact O-N 3.28Å; N202-I205 PolarHBondContact OD1-N 3.45Å; N202-I205 VanDerWaalsContact OD1-N 3.12Å
203S90.8Very high91.3Very high57 Ų5756 Ų5640%0.39928%0.282SS..Hα-helixtrans-61.2-28176.158.90000112.7T201 I205 K206 Q207T201-S203 PolarHBondContact O-N 3.43Å; S203-I205 VanDerWaalsContact C-N 3.35Å; S203-I205 PolarHBondContact O-N 3.49Å; S203-K206 PolarHBondContact O-N 2.91Å; S203-Q207 WeakPolarHBondContact O-CB 3.45Å; S203-Q207 VanDerWaalsContact O-CG 3.3Å; S203-Q207 WeakPolarHBondContact O-CG 3.29Å; S203-Q207 PolarHBondContact O-N 3.21Å
204T93Very high91.8Very high70 Ų7052 Ų5243%0.42927%0.265SS..Hα-helixtrans-64.2-37179.8-46.20000112.4N202 R208N202-T204 PolarHBondContact O-N 3.45Å; N202-T204 WeakPolarHBondContact OD1-CB 3.48Å; N202-T204 PolarHBondContact OD1-N 2.97Å; T204-R208 WeakPolarHBondContact O-CB 3.44Å; T204-R208 WeakPolarHBondContact O-CG 3.33Å; T204-R208 PolarHBondContact O-N 2.83Å
205I93.4Very high92.2Very high18 Ų1848.9 Ų48.99%0.09225%0.248CC..Hα-helixtrans-66.4-46.4176.1-73.4174.1000110.3T54 L56 L64 V182 N202 S203 Q207 R208 L209T54-I205 HydrophobicContact CG2-CD1 4.39Å; L56-I205 HydrophobicContact CD1-CG2 3.8Å; L64-I205 HydrophobicContact CD1-CG2 4.48Å; V182-I205 HydrophobicContact CG1-CG2 4.47Å; V182-I205 HydrophobicContact CG2-CD1 3.92Å; N202-I205 HydrophobicContact CB-CD1 4.19Å; N202-I205 HydrophobicContact CB-CG1 4.45Å; N202-I205 VanDerWaalsContact ND2-CD1 3.26Å; N202-I205 WeakPolarHBondContact ND2-CD1 3.5Å; N202-I205 PolarHBondContact O-N 3.28Å; N202-I205 PolarHBondContact OD1-N 3.45Å; N202-I205 VanDerWaalsContact OD1-N 3.12Å; S203-I205 VanDerWaalsContact C-N 3.35Å; S203-I205 PolarHBondContact O-N 3.49Å; I205-Q207 PolarHBondContact O-N 3.06Å; I205-R208 PolarHBondContact O-N 3.34Å; I205-L209 WeakPolarHBondContact O-CB 3.37Å; I205-L209 PolarHBondContact O-N 3.37Å
206K92.6Very high92.8Very high29 Ų2946.6 Ų46.613%0.12624%0.238CC..Hα-helixtrans-63.3-43.4178.1-173.7176.6175.4-176.30111.7L64 L67 D69 L200 S203 R208 L209 V210L64-K206 VanDerWaalsContact O-CE 3.27Å; L64-K206 WeakPolarHBondContact O-CE 3.38Å; L67-K206 PolarHBondContact O-NZ 3.48Å; D69-K206 WeakPolarHBondContact OD1-CD 3.02Å; D69-K206 WeakPolarHBondContact OD1-CE 3.46Å; D69-K206 IonicContact OD1-NZ 3.28Å; D69-K206 PolarHBondContact OD1-NZ 3.24Å; L200-K206 HydrophobicContact CD1-CB 4.45Å; L200-K206 HydrophobicContact CD2-CB 3.85Å; L200-K206 HydrophobicContact CD2-CD 3.57Å; L200-K206 HydrophobicContact CD2-CG 4.34Å; S203-K206 PolarHBondContact O-N 2.91Å; K206-R208 VanDerWaalsContact C-N 3.33Å; K206-R208 PolarHBondContact O-N 3.48Å; K206-L209 WeakPolarHBondContact O-CB 3.47Å; K206-L209 PolarHBondContact O-N 3.14Å; K206-V210 WeakPolarHBondContact O-CG2 3.28Å; K206-V210 PolarHBondContact O-N 3.48Å
207Q93.6Very high93.3Very high131 Ų13143 Ų4361%0.61222%0.216SC*.Hα-helixtrans-61.5-40.7175.8-74.2174.7-19.400112.2S203 I205 V210 K211S203-Q207 WeakPolarHBondContact O-CB 3.45Å; S203-Q207 VanDerWaalsContact O-CG 3.3Å; S203-Q207 WeakPolarHBondContact O-CG 3.29Å; S203-Q207 PolarHBondContact O-N 3.21Å; I205-Q207 PolarHBondContact O-N 3.06Å; Q207-V210 PolarHBondContact O-N 3.05Å; Q207-K211 VanDerWaalsContact O-CB 3.31Å; Q207-K211 WeakPolarHBondContact O-CB 3.48Å; Q207-K211 PolarHBondContact O-N 3Å
208R94.6Very high93.8Very high123 Ų12344 Ų4446%0.46422%0.221SC..Hα-helixtrans-62.9-42.5173.4-84.6-174.5-98.2174.1-8.5112.1E53 T204 I205 K206 K211 K212E53-R208 IonicContact OE1-NH1 2.85Å; E53-R208 PolarHBondContact OE1-NH1 2.96Å; T204-R208 WeakPolarHBondContact O-CB 3.44Å; T204-R208 WeakPolarHBondContact O-CG 3.33Å; T204-R208 PolarHBondContact O-N 2.83Å; I205-R208 PolarHBondContact O-N 3.34Å; K206-R208 VanDerWaalsContact C-N 3.33Å; K206-R208 PolarHBondContact O-N 3.48Å; R208-K211 PolarHBondContact O-N 2.86Å; R208-K212 VanDerWaalsContact O-CB 3.29Å; R208-K212 WeakPolarHBondContact O-CB 3.5Å; R208-K212 PolarHBondContact O-N 2.88Å
209L95.4Very high94.1Very high6 Ų649.6 Ų49.63%0.03125%0.248CC..Hα-helixtrans-61.2-49.5176.317461.1000111.5E61 L64 L65 I205 K206 K211 K212 V213 L235E61-L209 HydrophobicContact CB-CD1 3.96Å; E61-L209 HydrophobicContact CB-CD2 4.04Å; E61-L209 HydrophobicContact CG-CD1 3.97Å; E61-L209 HydrophobicContact CG-CD2 4.35Å; E61-L209 WeakPolarHBondContact O-CD2 3.3Å; L64-L209 HydrophobicContact CB-CD2 3.87Å; L64-L209 HydrophobicContact CD1-CD2 4.39Å; L65-L209 HydrophobicContact CD2-CD2 4.04Å; L65-L209 HydrophobicContact CD2-CG 3.99Å; L65-L209 HydrophobicContact CG-CD2 4.05Å; L65-L209 HydrophobicContact CG-CG 4.38Å; I205-L209 WeakPolarHBondContact O-CB 3.37Å; I205-L209 PolarHBondContact O-N 3.37Å; K206-L209 WeakPolarHBondContact O-CB 3.47Å; K206-L209 PolarHBondContact O-N 3.14Å; L209-K211 PolarHBondContact O-N 3.45Å; L209-K212 WeakPolarHBondContact O-CB 3.31Å; L209-K212 PolarHBondContact O-N 3.09Å; L209-V213 WeakPolarHBondContact O-CG2 3.4Å; L209-V213 PolarHBondContact O-N 3.02Å; L209-L235 HydrophobicContact CD1-CD2 3.77Å
210V95.9Very high94.3Very high22 Ų2255.5 Ų55.513%0.13327%0.272CS..Hα-helixtrans-58.7-48.81771700000110.4L65 K206 Q207 K212 V213 Q214 A248L65-V210 HydrophobicContact CD2-CG2 4.08Å; K206-V210 WeakPolarHBondContact O-CG2 3.28Å; K206-V210 PolarHBondContact O-N 3.48Å; Q207-V210 PolarHBondContact O-N 3.05Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.18Å; V210-V213 PolarHBondContact O-N 2.79Å; V210-Q214 HydrophobicContact CG1-CG 4.3Å; V210-Q214 VanDerWaalsContact O-CG 3.31Å; V210-Q214 WeakPolarHBondContact O-CG 3.28Å; V210-Q214 PolarHBondContact O-N 2.94Å; V210-A248 HydrophobicContact CG1-CB 4.37Å
211K95.8Very high94.5Very high118 Ų11856.1 Ų56.151%0.51327%0.273SS..Hα-helixtrans-61-40.7177.6-174.6170.5-177.7173.50112.3Q207 R208 L209 V213 Q214 D215Q207-K211 VanDerWaalsContact O-CB 3.31Å; Q207-K211 WeakPolarHBondContact O-CB 3.48Å; Q207-K211 PolarHBondContact O-N 3Å; R208-K211 PolarHBondContact O-N 2.86Å; L209-K211 PolarHBondContact O-N 3.45Å; K211-V213 VanDerWaalsContact C-N 3.33Å; K211-V213 PolarHBondContact O-N 3.36Å; K211-Q214 PolarHBondContact O-N 3.18Å; K211-D215 VanDerWaalsContact O-CB 3.31Å; K211-D215 WeakPolarHBondContact O-CB 3.4Å; K211-D215 PolarHBondContact O-N 3.04Å
212K96.1Very high94.6Very high67 Ų6754.4 Ų54.429%0.29126%0.262SS..Hα-helixtrans-58.1-45.4175.9-179.3-179.465173.80111.3E61 R208 L209 V210 S216 V232E61-K212 IonicContact OE1-NZ 3.37Å; E61-K212 PolarHBondContact OE1-NZ 3.48Å; E61-K212 IonicContact OE2-NZ 3.93Å; R208-K212 VanDerWaalsContact O-CB 3.29Å; R208-K212 WeakPolarHBondContact O-CB 3.5Å; R208-K212 PolarHBondContact O-N 2.88Å; L209-K212 WeakPolarHBondContact O-CB 3.31Å; L209-K212 PolarHBondContact O-N 3.09Å; V210-K212 VanDerWaalsContact C-N 3.33Å; V210-K212 PolarHBondContact O-N 3.18Å; K212-S216 WeakPolarHBondContact O-CB 3.39Å; K212-S216 PolarHBondContact O-N 3.39Å; K212-S216 PolarHBondContact O-OG 3.2Å; K212-V232 HydrophobicContact CD-CG2 4.33Å
213V96.8Very high94.5Very high1 Ų159 Ų591%0.00629%0.286CS..Hα-helixtrans-65.2-47.5177.8174.20000110.8L65 L209 V210 K211 S216 V217 L235 I236 L245 A248 F249L65-V213 HydrophobicContact CD1-CG2 4.44Å; L209-V213 WeakPolarHBondContact O-CG2 3.4Å; L209-V213 PolarHBondContact O-N 3.02Å; V210-V213 PolarHBondContact O-N 2.79Å; K211-V213 VanDerWaalsContact C-N 3.33Å; K211-V213 PolarHBondContact O-N 3.36Å; V213-S216 PolarHBondContact O-N 3.32Å; V213-V217 PolarHBondContact O-N 3.42Å; V213-L235 HydrophobicContact CG2-CD2 3.8Å; V213-L235 HydrophobicContact CG2-CG 4.31Å; V213-I236 HydrophobicContact CG1-CG1 4.43Å; V213-L245 HydrophobicContact CG1-CD1 3.58Å; V213-A248 HydrophobicContact CG1-CB 4.2Å; V213-F249 HydrophobicContact CG1-CE1 4.09Å
214Q96.9Very high94.5Very high29 Ų2959.3 Ų59.314%0.13628%0.283CS..Hα-helixtrans-59.7-53.8177.9-69.4173.6-11.400112V210 K211 S216 V217 L218 A248 F249 L252V210-Q214 HydrophobicContact CG1-CG 4.3Å; V210-Q214 VanDerWaalsContact O-CG 3.31Å; V210-Q214 WeakPolarHBondContact O-CG 3.28Å; V210-Q214 PolarHBondContact O-N 2.94Å; K211-Q214 PolarHBondContact O-N 3.18Å; Q214-S216 PolarHBondContact O-N 2.94Å; Q214-V217 CarbonylContact O-C 3.47Å; Q214-V217 WeakPolarHBondContact O-CG2 3.41Å; Q214-V217 PolarHBondContact O-N 3.37Å; Q214-V217 VanDerWaalsContact O-N 3.1Å; Q214-L218 HydrophobicContact CB-CD1 4.43Å; Q214-L218 VanDerWaalsContact O-CB 3.28Å; Q214-L218 WeakPolarHBondContact O-CB 2.92Å; Q214-L218 VanDerWaalsContact O-CG 3.3Å; Q214-L218 WeakPolarHBondContact O-CG 3.46Å; Q214-L218 PolarHBondContact O-N 3.17Å; Q214-A248 PolarHBondContact NE2-O 3.44Å; Q214-F249 HydrophobicContact CG-CD1 4.3Å; Q214-L252 HydrophobicContact CB-CD2 4.49Å; Q214-L252 HydrophobicContact CG-CD1 4.28Å; Q214-L252 HydrophobicContact CG-CD2 4.02Å; Q214-L252 HydrophobicContact CG-CG 4.33Å
215D96.5Very high94.3Very high20 Ų2056.4 Ų56.411%0.10727%0.266CS..Hα-helixtrans-56.6-38.3-179.4-71-2.2000111K211 V217 L218 E219 K220K211-D215 VanDerWaalsContact O-CB 3.31Å; K211-D215 WeakPolarHBondContact O-CB 3.4Å; K211-D215 PolarHBondContact O-N 3.04Å; D215-V217 VanDerWaalsContact C-N 3.28Å; D215-V217 PolarHBondContact O-N 3.19Å; D215-L218 CarbonylContact O-C 3.56Å; D215-L218 PolarHBondContact O-N 2.8Å; D215-E219 PolarHBondContact O-N 3.18Å; D215-E219 VanDerWaalsContact O-N 3.17Å; D215-K220 HydrophobicContact CB-CD 4.16Å; D215-K220 HydrophobicContact CB-CG 4.41Å; D215-K220 WeakPolarHBondContact O-CA 3.49Å; D215-K220 WeakPolarHBondContact O-CB 3.46Å; D215-K220 PolarHBondContact O-N 3.17Å; D215-K220 IonicContact OD2-NZ 3.86Å
216S96.3Very high94.1Very high14 Ų1458.2 Ų58.210%0.09827%0.274CS..Hα-helixtrans-64.8-30.3-178.3-60.20000113.3K212 V213 Q214 W221 V232K212-S216 WeakPolarHBondContact O-CB 3.39Å; K212-S216 PolarHBondContact O-N 3.39Å; K212-S216 PolarHBondContact O-OG 3.2Å; V213-S216 PolarHBondContact O-N 3.32Å; Q214-S216 PolarHBondContact O-N 2.94Å; S216-W221 WeakPolarHBondContact O-CA 3.49Å; S216-V232 VanDerWaalsContact OG-CG1 3.22Å; S216-V232 WeakPolarHBondContact OG-CG1 3.11Å
217V96Very high94Very high0 Ų065.7 Ų65.70%030%0.301CS..Hα-helixtrans-101.8-0.9175.5-57.20000112.9V213 Q214 D215 I236 F249 R263 V264V213-V217 PolarHBondContact O-N 3.42Å; Q214-V217 CarbonylContact O-C 3.47Å; Q214-V217 WeakPolarHBondContact O-CG2 3.41Å; Q214-V217 PolarHBondContact O-N 3.37Å; Q214-V217 VanDerWaalsContact O-N 3.1Å; D215-V217 VanDerWaalsContact C-N 3.28Å; D215-V217 PolarHBondContact O-N 3.19Å; V217-I236 HydrophobicContact CG1-CD1 3.91Å; V217-F249 HydrophobicContact CG2-CE1 3.83Å; V217-F249 HydrophobicContact CG2-CZ 3.73Å; V217-R263 WeakPolarHBondContact O-CD 3.08Å; V217-R263 PolarHBondContact O-NH1 2.73Å; V217-V264 HydrophobicContact CG1-CG2 4.01Å
218L95.9Very high93.9Very high22 Ų2260.4 Ų60.412%0.11528%0.277CS..THydrogen-bonded Turntrans-119.2-96.1-180-63.8177.8000111.1Q214 D215 K220 W221 L252 Q256 L259 R263Q214-L218 HydrophobicContact CB-CD1 4.43Å; Q214-L218 VanDerWaalsContact O-CB 3.28Å; Q214-L218 WeakPolarHBondContact O-CB 2.92Å; Q214-L218 VanDerWaalsContact O-CG 3.3Å; Q214-L218 WeakPolarHBondContact O-CG 3.46Å; Q214-L218 PolarHBondContact O-N 3.17Å; D215-L218 CarbonylContact O-C 3.56Å; D215-L218 PolarHBondContact O-N 2.8Å; L218-K220 PolarHBondContact O-N 3.1Å; L218-W221 WeakPolarHBondContact O-CB 3.37Å; L218-W221 PolarHBondContact O-N 3.05Å; L218-L252 HydrophobicContact CD1-CD1 4.16Å; L218-L252 HydrophobicContact CD1-CD2 3.97Å; L218-Q256 HydrophobicContact CD1-CB 4.2Å; L218-Q256 HydrophobicContact CD2-CB 4.44Å; L218-L259 HydrophobicContact CD2-CB 4.46Å; L218-L259 HydrophobicContact CD2-CD2 4.27Å; L218-L259 HydrophobicContact CD2-CG 4.36Å; L218-R263 VanDerWaalsContact CA-NH1 3.3Å; L218-R263 PolarHBondContact O-NH1 3.35Å
219E94.6Very high93.9Very high157 Ų15759 Ų5973%0.73428%0.278SS*.THydrogen-bonded Turntrans-66.6-36.6-171-62.5-176.1175.700113.3D215D215-E219 PolarHBondContact O-N 3.18Å; D215-E219 VanDerWaalsContact O-N 3.17Å
220K94.6Very high93.8Very high137 Ų13762.8 Ų62.860%0.59630%0.295SS*.THydrogen-bonded Turntrans-101.115.6-176.8-60.7177.7-178.2163.80112.7D215 L218 V222D215-K220 HydrophobicContact CB-CD 4.16Å; D215-K220 HydrophobicContact CB-CG 4.41Å; D215-K220 WeakPolarHBondContact O-CA 3.49Å; D215-K220 WeakPolarHBondContact O-CB 3.46Å; D215-K220 PolarHBondContact O-N 3.17Å; D215-K220 IonicContact OD2-NZ 3.86Å; L218-K220 PolarHBondContact O-N 3.1Å; K220-V222 PolarHBondContact O-N 3.01Å
221W95.4Very high93.7Very high38 Ų3863.8 Ų63.814%0.14430%0.296CS..  trans-59.8134.6179.9173.9-103.2000111.8S216 L218 N223 M228 R263 L267S216-W221 WeakPolarHBondContact O-CA 3.49Å; L218-W221 WeakPolarHBondContact O-CB 3.37Å; L218-W221 PolarHBondContact O-N 3.05Å; W221-N223 PolarHBondContact NE1-OD1 3.42Å; W221-M228 HydrophobicContact CZ3-SD 4.36Å; W221-R263 HydrophobicContact CD2-CB 4.3Å; W221-R263 HydrophobicContact CD2-CG 4.02Å; W221-R263 HydrophobicContact CE3-CB 4.11Å; W221-R263 HydrophobicContact CE3-CG 4.33Å; W221-R263 VanDerWaalsContact CG-CZ 3.45Å; W221-R263 HydrophobicContact CH2-CB 3.91Å; W221-R263 HydrophobicContact CH2-CG 4.32Å; W221-R263 HydrophobicContact CZ2-CB 4.14Å; W221-R263 HydrophobicContact CZ2-CG 4.04Å; W221-R263 HydrophobicContact CZ3-CB 3.9Å; W221-R263 HydrophobicContact CZ3-CG 4.46Å; W221-L267 HydrophobicContact CH2-CD1 4.33Å; W221-L267 HydrophobicContact CH2-CD2 3.76Å; W221-L267 HydrophobicContact CH2-CG 3.83Å; W221-L267 HydrophobicContact CZ3-CD1 4.01Å; W221-L267 HydrophobicContact CZ3-CD2 4.13Å; W221-L267 HydrophobicContact CZ3-CG 4.04Å
222V92.2Very high93.7Very high36 Ų3658.9 Ų58.922%0.21828%0.276CS..  trans-123.1130.5173.2-170.90000108.3K220 D224 R227 M228K220-V222 PolarHBondContact O-N 3.01Å; V222-D224 PolarHBondContact O-N 3.48Å; V222-R227 HydrophobicContact CG1-CB 3.78Å; V222-R227 HydrophobicContact CG1-CG 4.47Å; V222-M228 HydrophobicContact CB-CG 4.48Å
223N89.1Confident93.7Very high143 Ų14355.9 Ų55.977%0.76526%0.263SS*.SBendtrans-66.8-20.3-179-69.3-35.6000113.6W221 P225W221-N223 PolarHBondContact NE1-OD1 3.42Å; N223-P225 WeakPolarHBondContact O-CD 3.32Å
224D89.7Confident93.7Very high64 Ų6455.9 Ų55.934%0.34226%0.263SS..SBendtrans-99.3110.7174.4-179.86.9000109.6V222 H226 R227V222-D224 PolarHBondContact O-N 3.48Å; D224-H226 PolarHBondContact O-N 3.06Å; D224-H226 VanDerWaalsContact O-N 3.16Å; D224-H226 IonicContact OD1-CD2 2.7Å; D224-H226 IonicContact OD1-CG 3.08Å; D224-H226 PolarHBondContact OD1-N 3.24Å; D224-H226 VanDerWaalsContact OD1-N 3.13Å; D224-R227 HydrophobicContact CB-CG 4.14Å; D224-R227 PolarHBondContact O-N 3.03Å; D224-R227 VanDerWaalsContact O-N 3.1Å
225P88.9Confident93.7Very high10 Ų1054.5 Ų54.57%0.06526%0.257CS..G310 helixtrans-57.9-27.1-179.7-23.733.2000113.8N223 R227 M228 L233 L267 L270N223-P225 WeakPolarHBondContact O-CD 3.32Å; P225-R227 PolarHBondContact O-N 3.43Å; P225-M228 WeakPolarHBondContact O-CB 3.38Å; P225-M228 PolarHBondContact O-N 3.29Å; P225-L233 HydrophobicContact CB-CD2 4.29Å; P225-L267 HydrophobicContact CB-CD2 4.24Å; P225-L267 HydrophobicContact CG-CD2 4.01Å; P225-L270 HydrophobicContact CB-CD1 3.97Å; P225-L270 HydrophobicContact CG-CD1 3.45Å; P225-L270 VanDerWaalsContact CG-CD1 3.45Å; P225-L270 HydrophobicContact CG-CD2 4.19Å; P225-L270 HydrophobicContact CG-CG 4.46Å
226H89Confident93.7Very high56 Ų5653.6 Ų53.626%0.25925%0.252SS..G310 helixtrans-74.2-15-179.7-65.9-66.9000114.1D224 M228 E275 K278 W286D224-H226 PolarHBondContact O-N 3.06Å; D224-H226 VanDerWaalsContact O-N 3.16Å; D224-H226 IonicContact OD1-CD2 2.7Å; D224-H226 IonicContact OD1-CG 3.08Å; D224-H226 PolarHBondContact OD1-N 3.24Å; D224-H226 VanDerWaalsContact OD1-N 3.13Å; H226-M228 VanDerWaalsContact C-N 3.35Å; H226-E275 IonicContact CD2-OE2 2.73Å; H226-E275 PolarHBondContact CE1-O 2.97Å; H226-E275 VanDerWaalsContact CE1-O 3.24Å; H226-E275 IonicContact CE1-OE2 3.51Å; H226-E275 IonicContact NE2-OE2 3.15Å; H226-E275 PolarHBondContact NE2-OE2 2.79Å; H226-K278 WeakPolarHBondContact CD2-CD 3.25Å; H226-K278 WeakPolarHBondContact NE2-CD 3.49Å; H226-K278 PolarHBondContact NE2-NZ 3.4Å; H226-W286 AromaticContact CE1-CZ2 3.95Å; H226-W286 AromaticContact CE1-NE1 3.91Å
227R90.8Very high93.7Very high186 Ų18653.1 Ų53.170%0.70225%0.248SC*.G310 helixtrans-87.1-10.4173.4-65.7-179.962.2-162.5-3.4112.5V222 D224 P225V222-R227 HydrophobicContact CG1-CB 3.78Å; V222-R227 HydrophobicContact CG1-CG 4.47Å; D224-R227 HydrophobicContact CB-CG 4.14Å; D224-R227 PolarHBondContact O-N 3.03Å; D224-R227 VanDerWaalsContact O-N 3.1Å; P225-R227 PolarHBondContact O-N 3.43Å
228M92.1Very high93.8Very high19 Ų1953.3 Ų53.39%0.09425%0.249CC..SBendtrans-76.8149.6171.1-60.2-178.667.400109.7W221 V222 P225 H226 K230 V232 L233 I236W221-M228 HydrophobicContact CZ3-SD 4.36Å; V222-M228 HydrophobicContact CB-CG 4.48Å; P225-M228 WeakPolarHBondContact O-CB 3.38Å; P225-M228 PolarHBondContact O-N 3.29Å; H226-M228 VanDerWaalsContact C-N 3.35Å; M228-K230 PolarHBondContact O-N 3.43Å; M228-V232 HydrophobicContact CE-CG1 4.5Å; M228-L233 HydrophobicContact SD-CD1 4.45Å; M228-I236 HydrophobicContact CE-CD1 3.95Å
229D93.1Very high93.8Very high93 Ų9352.2 Ų52.250%0.49724%0.244SC..  trans-57.3125.4168.1171.812.7000109.3R231 V232 L233D229-R231 PolarHBondContact O-N 3.48Å; D229-R231 PolarHBondContact OD1-N 3.34Å; D229-V232 HydrophobicContact CB-CB 4.15Å; D229-V232 HydrophobicContact CB-CG2 4.05Å; D229-V232 PolarHBondContact O-N 3.47Å; D229-L233 PolarHBondContact O-N 3.03Å
230K93.4Very high93.8Very high87 Ų8748.4 Ų48.438%0.37823%0.226SC..Hα-helixtrans-55.6-35.8-179.9-64.4170.7-178.7171.20111.4L95 M228 S234 N280 N282 M285L95-K230 HydrophobicContact CD2-CB 4.02Å; M228-K230 PolarHBondContact O-N 3.43Å; K230-S234 VanDerWaalsContact O-CB 3.3Å; K230-S234 WeakPolarHBondContact O-CB 3.42Å; K230-S234 PolarHBondContact O-N 2.79Å; K230-S234 PolarHBondContact O-OG 2.75Å; K230-N280 WeakPolarHBondContact CE-O 3.41Å; K230-N280 PolarHBondContact NZ-O 3.08Å; K230-N282 HydrophobicContact CD-CB 4.46Å; K230-M285 HydrophobicContact CB-SD 4.21Å
231R95.1Very high93.8Very high42 Ų4243.4 Ų43.416%0.15821%0.208CC..Hα-helixtrans-66.2-45.4177-174.2-179.9-171.773.57.9111.2L56 T57 L58 E61 E92 L95 D229 S234 L235L56-R231 PolarHBondContact O-NH2 2.69Å; T57-R231 VanDerWaalsContact C-NH2 3.26Å; L58-R231 HydrophobicContact CD2-CG 3.95Å; L58-R231 VanDerWaalsContact N-NH2 3.1Å; E61-R231 IonicContact OE2-NE 3.89Å; E61-R231 IonicContact OE2-NH2 2.84Å; E92-R231 VanDerWaalsContact CD-NH1 3.32Å; E92-R231 IonicContact OE1-CZ 2.84Å; E92-R231 IonicContact OE1-NH1 2.87Å; E92-R231 PolarHBondContact OE1-NH1 3.08Å; E92-R231 VanDerWaalsContact OE1-NH1 3.12Å; E92-R231 IonicContact OE1-NH2 3.8Å; E92-R231 IonicContact OE2-CZ 3.7Å; E92-R231 IonicContact OE2-NH1 3.39Å; E92-R231 PolarHBondContact OE2-NH1 2.91Å; E92-R231 IonicContact OE2-NH2 3.12Å; E92-R231 PolarHBondContact OE2-NH2 3.44Å; L95-R231 HydrophobicContact CD1-CB 4.19Å; L95-R231 HydrophobicContact CD1-CG 4.45Å; D229-R231 PolarHBondContact O-N 3.48Å; D229-R231 PolarHBondContact OD1-N 3.34Å; R231-S234 PolarHBondContact O-N 3.45Å; R231-L235 WeakPolarHBondContact O-CB 3.13Å; R231-L235 PolarHBondContact O-N 3.4Å
232V95.5Very high93.7Very high15 Ų1541.6 Ų41.69%0.09120%0.201CC..Hα-helixtrans-66.4-44.2178.1171.40000111.5K212 S216 M228 D229 S234 L235 I236K212-V232 HydrophobicContact CD-CG2 4.33Å; S216-V232 VanDerWaalsContact OG-CG1 3.22Å; S216-V232 WeakPolarHBondContact OG-CG1 3.11Å; M228-V232 HydrophobicContact CE-CG1 4.5Å; D229-V232 HydrophobicContact CB-CB 4.15Å; D229-V232 HydrophobicContact CB-CG2 4.05Å; D229-V232 PolarHBondContact O-N 3.47Å; V232-S234 VanDerWaalsContact C-N 3.32Å; V232-S234 PolarHBondContact O-N 2.96Å; V232-L235 WeakPolarHBondContact O-CB 3.3Å; V232-L235 PolarHBondContact O-N 3.36Å; V232-I236 HydrophobicContact CG1-CD1 3.99Å; V232-I236 WeakPolarHBondContact O-CG1 3.4Å; V232-I236 PolarHBondContact O-N 3.1Å
233L95.8Very high93.8Very high4 Ų444.8 Ų44.82%0.02122%0.217CC..Hα-helixtrans-58.8-45.6175.6178.960.8000111.1P225 M228 D229 L235 I236 L237 L267 M285 W286P225-L233 HydrophobicContact CB-CD2 4.29Å; M228-L233 HydrophobicContact SD-CD1 4.45Å; D229-L233 PolarHBondContact O-N 3.03Å; L233-L235 PolarHBondContact O-N 3.41Å; L233-I236 PolarHBondContact O-N 3.15Å; L233-L237 HydrophobicContact CD1-CD1 3.98Å; L233-L237 HydrophobicContact CD1-CG 4.31Å; L233-L237 HydrophobicContact CG-CD1 4.07Å; L233-L237 WeakPolarHBondContact O-CG 3.38Å; L233-L237 PolarHBondContact O-N 2.93Å; L233-L237 VanDerWaalsContact O-N 3.09Å; L233-L267 HydrophobicContact CD1-CD1 4.03Å; L233-L267 HydrophobicContact CD1-CD2 4.12Å; L233-M285 HydrophobicContact CD2-CE 4.01Å; L233-W286 HydrophobicContact CD2-CH2 4.12Å; L233-W286 HydrophobicContact CD2-CZ2 4.04Å
234S96.6Very high94Very high1 Ų138.4 Ų38.41%0.00718%0.183CC..Hα-helixtrans-60.6-43.9175.6-59.40000112.2V91 K230 R231 V232 I236 L237 L238 M285V91-S234 WeakPolarHBondContact CG1-OG 3.3Å; K230-S234 VanDerWaalsContact O-CB 3.3Å; K230-S234 WeakPolarHBondContact O-CB 3.42Å; K230-S234 PolarHBondContact O-N 2.79Å; K230-S234 PolarHBondContact O-OG 2.75Å; R231-S234 PolarHBondContact O-N 3.45Å; V232-S234 VanDerWaalsContact C-N 3.32Å; V232-S234 PolarHBondContact O-N 2.96Å; S234-I236 PolarHBondContact O-N 3.43Å; S234-L237 PolarHBondContact O-N 3.45Å; S234-L238 VanDerWaalsContact O-CB 3.23Å; S234-L238 WeakPolarHBondContact O-CB 3.48Å; S234-L238 VanDerWaalsContact O-CG 3.3Å; S234-L238 WeakPolarHBondContact O-CG 3.46Å; S234-L238 PolarHBondContact O-N 3.48Å; S234-M285 VanDerWaalsContact OG-CG 3.27Å; S234-M285 WeakPolarHBondContact OG-CG 3.2Å; S234-M285 PolarHBondContact OG-SD 3.23Å
235L97.3Very high94.2Very high1 Ų135.5 Ų35.51%0.00517%0.167CC..Hα-helixtrans-59.2-45.6177.817562.9000111.3L58 E61 V62 L65 L209 V213 R231 V232 L233 A239L58-L235 HydrophobicContact CD2-CB 3.91Å; L58-L235 HydrophobicContact CD2-CD1 4.48Å; E61-L235 HydrophobicContact CB-CD1 3.74Å; V62-L235 HydrophobicContact CG2-CD1 3.92Å; L65-L235 HydrophobicContact CD1-CD1 4.34Å; L209-L235 HydrophobicContact CD1-CD2 3.77Å; V213-L235 HydrophobicContact CG2-CD2 3.8Å; V213-L235 HydrophobicContact CG2-CG 4.31Å; R231-L235 WeakPolarHBondContact O-CB 3.13Å; R231-L235 PolarHBondContact O-N 3.4Å; V232-L235 WeakPolarHBondContact O-CB 3.3Å; V232-L235 PolarHBondContact O-N 3.36Å; L233-L235 PolarHBondContact O-N 3.41Å; L235-A239 WeakPolarHBondContact O-CB 3.43Å; L235-A239 PolarHBondContact O-N 3.24Å
236I96.9Very high94.4Very high1 Ų140 Ų401%0.00519%0.188CC..Hα-helixtrans-63-50.9179.6-66.6162.7000110.6V213 V217 M228 V232 L233 S234 A239 H240 L245 V264 L267V213-I236 HydrophobicContact CG1-CG1 4.43Å; V217-I236 HydrophobicContact CG1-CD1 3.91Å; M228-I236 HydrophobicContact CE-CD1 3.95Å; V232-I236 HydrophobicContact CG1-CD1 3.99Å; V232-I236 WeakPolarHBondContact O-CG1 3.4Å; V232-I236 PolarHBondContact O-N 3.1Å; L233-I236 PolarHBondContact O-N 3.15Å; S234-I236 PolarHBondContact O-N 3.43Å; I236-A239 PolarHBondContact O-N 3.4Å; I236-H240 WeakPolarHBondContact O-CB 3.27Å; I236-H240 PolarHBondContact O-N 3.06Å; I236-L245 HydrophobicContact CG2-CD2 4.25Å; I236-V264 HydrophobicContact CG2-CG2 4.15Å; I236-L267 HydrophobicContact CG2-CD1 4.19Å
237L96.3Very high94.6Very high4 Ų441.2 Ų41.22%0.02120%0.196CC..Hα-helixtrans-64.9-44.1-177.2-67.2172.8000111.7L233 S234 H240 S241 L267 L268 V289L233-L237 HydrophobicContact CD1-CD1 3.98Å; L233-L237 HydrophobicContact CD1-CG 4.31Å; L233-L237 HydrophobicContact CG-CD1 4.07Å; L233-L237 WeakPolarHBondContact O-CG 3.38Å; L233-L237 PolarHBondContact O-N 2.93Å; L233-L237 VanDerWaalsContact O-N 3.09Å; S234-L237 PolarHBondContact O-N 3.45Å; L237-H240 WeakPolarHBondContact O-CB 3.44Å; L237-H240 PolarHBondContact O-N 2.89Å; L237-S241 PolarHBondContact O-N 2.88Å; L237-S241 PolarHBondContact O-OG 2.92Å; L237-L267 HydrophobicContact CD2-CB 4.15Å; L237-L268 HydrophobicContact CD2-CD2 3.85Å; L237-V289 HydrophobicContact CB-CG2 4.3Å; L237-V289 HydrophobicContact CD1-CG1 4.11Å; L237-V289 HydrophobicContact CD1-CG2 3.57Å
238L96.7Very high94.8Very high3 Ų332.3 Ų32.32%0.01616%0.162CC..Hα-helixtrans-73.7-34.2179.6-68.9165.8000112.5C88 V91 S234 H240 S241 S242 V288 F292C88-L238 HydrophobicContact CB-CD1 4.33Å; V91-L238 HydrophobicContact CB-CD1 4.39Å; V91-L238 HydrophobicContact CG2-CD1 4.07Å; S234-L238 VanDerWaalsContact O-CB 3.23Å; S234-L238 WeakPolarHBondContact O-CB 3.48Å; S234-L238 VanDerWaalsContact O-CG 3.3Å; S234-L238 WeakPolarHBondContact O-CG 3.46Å; S234-L238 PolarHBondContact O-N 3.48Å; L238-H240 VanDerWaalsContact C-N 3.28Å; L238-H240 PolarHBondContact O-N 3.19Å; L238-S241 PolarHBondContact O-N 3.06Å; L238-S242 WeakPolarHBondContact O-CB 3.21Å; L238-S242 PolarHBondContact O-N 3.46Å; L238-S242 PolarHBondContact O-OG 3.08Å; L238-V288 HydrophobicContact CD2-CG1 3.96Å; L238-F292 HydrophobicContact CD2-CD2 4.1Å; L238-F292 HydrophobicContact CD2-CE2 3.78Å
239A96Very high94.9Very high0 Ų031.4 Ų31.40%016%0.158CC..Hα-helixtrans-64.3-36.2172.500000111.4V62 L65 L235 I236 S242 D243 V244 L245V62-A239 HydrophobicContact CG2-CB 4.49Å; L65-A239 HydrophobicContact CD1-CB 3.85Å; L235-A239 WeakPolarHBondContact O-CB 3.43Å; L235-A239 PolarHBondContact O-N 3.24Å; I236-A239 PolarHBondContact O-N 3.4Å; A239-S242 PolarHBondContact O-N 2.93Å; A239-D243 PolarHBondContact O-N 2.85Å; A239-V244 HydrophobicContact CB-CG2 4.03Å; A239-V244 WeakPolarHBondContact O-CG2 3.39Å; A239-V244 PolarHBondContact O-N 2.91Å; A239-L245 HydrophobicContact CB-CB 4.1Å; A239-L245 HydrophobicContact CB-CD1 4.24Å; A239-L245 PolarHBondContact O-N 3.17Å
240H95.5Very high94.8Very high77 Ų7730.7 Ų30.736%0.35617%0.165SC..Hα-helixtrans-65.4-51.8171.8176.3-91.6000111.1I236 L237 L238 S242 D243 L245 L268I236-H240 WeakPolarHBondContact O-CB 3.27Å; I236-H240 PolarHBondContact O-N 3.06Å; L237-H240 WeakPolarHBondContact O-CB 3.44Å; L237-H240 PolarHBondContact O-N 2.89Å; L238-H240 VanDerWaalsContact C-N 3.28Å; L238-H240 PolarHBondContact O-N 3.19Å; H240-S242 PolarHBondContact O-N 3.48Å; H240-S242 VanDerWaalsContact O-N 3.13Å; H240-D243 PolarHBondContact O-N 3.25Å; H240-L245 HydrophobicContact CB-CB 4.38Å; H240-L245 HydrophobicContact CB-CD2 3.86Å; H240-L268 WeakPolarHBondContact CE1-CD1 3.37Å; H240-L268 WeakPolarHBondContact NE2-CD1 3.48Å
241S94Very high94.8Very high31 Ų3131 Ų3122%0.21718%0.176CC..Hα-helixtrans-60-24.2176.9-59.80000113.7L237 L238 F292L237-S241 PolarHBondContact O-N 2.88Å; L237-S241 PolarHBondContact O-OG 2.92Å; L238-S241 PolarHBondContact O-N 3.06Å; S241-F292 WeakPolarHBondContact OG-CB 3.22Å
242S94.1Very high94.8Very high0 Ų030.1 Ų30.10%017%0.174CC..THydrogen-bonded Turntrans-89.5-0.1177.3-56.10000113.9G84 L238 A239 H240 V244G84-S242 WeakPolarHBondContact CA-OG 3.48Å; L238-S242 WeakPolarHBondContact O-CB 3.21Å; L238-S242 PolarHBondContact O-N 3.46Å; L238-S242 PolarHBondContact O-OG 3.08Å; A239-S242 PolarHBondContact O-N 2.93Å; H240-S242 PolarHBondContact O-N 3.48Å; H240-S242 VanDerWaalsContact O-N 3.13Å; S242-V244 VanDerWaalsContact C-N 3.31Å; S242-V244 PolarHBondContact O-N 2.92Å
243D93.1Very high94.8Very high104 Ų10435.9 Ų35.956%0.55620%0.2SC*.THydrogen-bonded Turntrans58.437.4-177.8-161.432.7000113.8A239 H240A239-D243 PolarHBondContact O-N 2.85Å; H240-D243 PolarHBondContact O-N 3.25Å
244V94.1Very high94.8Very high8 Ų841.9 Ų41.95%0.04823%0.232CC..  trans-124.3-5178.9-59.70000114V62 L65 I81 A239 S242 N247V62-V244 HydrophobicContact CG1-CG2 3.89Å; L65-V244 HydrophobicContact CB-CB 4.29Å; L65-V244 HydrophobicContact CB-CG2 4.02Å; I81-V244 HydrophobicContact CD1-CG1 4.05Å; A239-V244 HydrophobicContact CB-CG2 4.03Å; A239-V244 WeakPolarHBondContact O-CG2 3.39Å; A239-V244 PolarHBondContact O-N 2.91Å; S242-V244 VanDerWaalsContact C-N 3.31Å; S242-V244 PolarHBondContact O-N 2.92Å; V244-N247 WeakPolarHBondContact O-CB 3.31Å; V244-N247 PolarHBondContact O-N 3.27Å; V244-N247 PolarHBondContact O-ND2 3.3Å
245L95Very high94.9Very high3 Ų348.5 Ų48.52%0.01627%0.267CS..SBendtrans-65.4-39-178.5-177.861.6000112.5V213 I236 A239 H240 N247 A248 F249 V264V213-L245 HydrophobicContact CG1-CD1 3.58Å; I236-L245 HydrophobicContact CG2-CD2 4.25Å; A239-L245 HydrophobicContact CB-CB 4.1Å; A239-L245 HydrophobicContact CB-CD1 4.24Å; A239-L245 PolarHBondContact O-N 3.17Å; H240-L245 HydrophobicContact CB-CB 4.38Å; H240-L245 HydrophobicContact CB-CD2 3.86Å; L245-N247 PolarHBondContact O-N 2.89Å; L245-N247 VanDerWaalsContact O-N 3.16Å; L245-A248 VanDerWaalsContact O-CB 3.28Å; L245-A248 WeakPolarHBondContact O-CB 3.28Å; L245-A248 PolarHBondContact O-N 3.49Å; L245-F249 HydrophobicContact CD1-CE1 4.4Å; L245-F249 HydrophobicContact CD1-CE2 4.45Å; L245-F249 HydrophobicContact CD1-CZ 4.02Å; L245-F249 HydrophobicContact CD2-CE2 4.2Å; L245-F249 HydrophobicContact CD2-CZ 4.33Å; L245-F249 HydrophobicContact CG-CE2 4.03Å; L245-F249 HydrophobicContact CG-CZ 4.11Å; L245-V264 HydrophobicContact CD2-CG1 3.76Å; L245-V264 HydrophobicContact CD2-CG2 3.97Å
246E92.8Very high94.8Very high105 Ų10552.5 Ų52.549%0.49129%0.286SS..Hα-helixtrans-59.9-29.1-179.3-66.9-167.9173.400112.6A248 F249 A250E246-A248 PolarHBondContact O-N 3.03Å; E246-F249 CarbonylContact O-C 3.59Å; E246-F249 PolarHBondContact O-N 3.33Å; E246-A250 PolarHBondContact O-N 3.38Å
247N92.8Very high94.9Very high81 Ų8155.7 Ų55.743%0.43330%0.299SS..Hα-helixtrans-61-29.6174.7-60.4-44.8000112.4L65 V244 L245 F249L65-N247 VanDerWaalsContact O-CB 3.32Å; L65-N247 WeakPolarHBondContact O-CB 3.38Å; L65-N247 PolarHBondContact O-ND2 2.71Å; V244-N247 WeakPolarHBondContact O-CB 3.31Å; V244-N247 PolarHBondContact O-N 3.27Å; V244-N247 PolarHBondContact O-ND2 3.3Å; L245-N247 PolarHBondContact O-N 2.89Å; L245-N247 VanDerWaalsContact O-N 3.16Å; N247-F249 VanDerWaalsContact C-N 3.33Å
248A93.8Very high94.9Very high0 Ų060.5 Ų60.50%032%0.324CS..Hα-helixtrans-74.8-25.3174.500000112.1L65 V210 V213 Q214 L245 E246L65-A248 HydrophobicContact CD2-CB 4.11Å; V210-A248 HydrophobicContact CG1-CB 4.37Å; V213-A248 HydrophobicContact CG1-CB 4.2Å; Q214-A248 PolarHBondContact NE2-O 3.44Å; L245-A248 VanDerWaalsContact O-CB 3.28Å; L245-A248 WeakPolarHBondContact O-CB 3.28Å; L245-A248 PolarHBondContact O-N 3.49Å; E246-A248 PolarHBondContact O-N 3.03Å
249F94.6Very high94.9Very high0 Ų063.9 Ų63.90%034%0.342CS..Hα-helixtrans-97-18-177.5-61.9-17.4000113.5V213 Q214 V217 L245 E246 N247 P251 L252 Y257 M261 V264V213-F249 HydrophobicContact CG1-CE1 4.09Å; Q214-F249 HydrophobicContact CG-CD1 4.3Å; V217-F249 HydrophobicContact CG2-CE1 3.83Å; V217-F249 HydrophobicContact CG2-CZ 3.73Å; L245-F249 HydrophobicContact CD1-CE1 4.4Å; L245-F249 HydrophobicContact CD1-CE2 4.45Å; L245-F249 HydrophobicContact CD1-CZ 4.02Å; L245-F249 HydrophobicContact CD2-CE2 4.2Å; L245-F249 HydrophobicContact CD2-CZ 4.33Å; L245-F249 HydrophobicContact CG-CE2 4.03Å; L245-F249 HydrophobicContact CG-CZ 4.11Å; E246-F249 CarbonylContact O-C 3.59Å; E246-F249 PolarHBondContact O-N 3.33Å; N247-F249 VanDerWaalsContact C-N 3.33Å; F249-P251 VanDerWaalsContact O-N 3.09Å; F249-L252 HydrophobicContact CB-CD1 3.99Å; F249-L252 HydrophobicContact CD1-CD1 3.81Å; F249-L252 HydrophobicContact CG-CD1 4.08Å; F249-L252 VanDerWaalsContact O-CB 3.25Å; F249-L252 WeakPolarHBondContact O-CB 3.31Å; F249-L252 WeakPolarHBondContact O-CG 3.42Å; F249-L252 PolarHBondContact O-N 3.5Å; F249-Y257 HydrophobicContact CB-CD2 3.68Å; F249-Y257 HydrophobicContact CB-CE2 3.78Å; F249-M261 HydrophobicContact CD2-CG 4.05Å; F249-M261 HydrophobicContact CD2-SD 3.54Å; F249-M261 VanDerWaalsContact CD2-SD 3.54Å; F249-M261 HydrophobicContact CE2-CG 4.36Å; F249-M261 HydrophobicContact CE2-SD 3.63Å; F249-V264 HydrophobicContact CE2-CG2 3.92Å; F249-V264 HydrophobicContact CZ-CG2 3.91Å
250A92Very high94.9Very high78 Ų7863.9 Ų63.965%0.64534%0.342SS*.THydrogen-bonded Turntrans-49.5-33.417700000115.4E246E246-A250 PolarHBondContact O-N 3.38Å
251P92.8Very high95Very high93 Ų9362.4 Ų62.460%0.60434%0.336SS*.THydrogen-bonded Turntrans-82.2-4.9176.3-14.531.8000115.5F249F249-P251 VanDerWaalsContact O-N 3.09Å
252L95.1Very high95.1Very high23 Ų2368 Ų6812%0.1236%0.356CS..SBendtrans-74.7158.1-178.4-66.3176.4000111.7Q214 L218 F249 Q256Q214-L252 HydrophobicContact CB-CD2 4.49Å; Q214-L252 HydrophobicContact CG-CD1 4.28Å; Q214-L252 HydrophobicContact CG-CD2 4.02Å; Q214-L252 HydrophobicContact CG-CG 4.33Å; L218-L252 HydrophobicContact CD1-CD1 4.16Å; L218-L252 HydrophobicContact CD1-CD2 3.97Å; F249-L252 HydrophobicContact CB-CD1 3.99Å; F249-L252 HydrophobicContact CD1-CD1 3.81Å; F249-L252 HydrophobicContact CG-CD1 4.08Å; F249-L252 VanDerWaalsContact O-CB 3.25Å; F249-L252 WeakPolarHBondContact O-CB 3.31Å; F249-L252 WeakPolarHBondContact O-CG 3.42Å; F249-L252 PolarHBondContact O-N 3.5Å; L252-Q256 HydrophobicContact CB-CB 4.19Å; L252-Q256 HydrophobicContact CD1-CB 4.49Å; L252-Q256 HydrophobicContact CD2-CB 4.38Å
253Q96.4Very high95.2Very high137 Ų13770.6 Ų70.664%0.6437%0.366SS*.  trans-72152.4166.7-60.3-62.6-44.100110.3D255 Q256 Y257Q253-D255 VanDerWaalsContact C-N 3.32Å; Q253-D255 PolarHBondContact O-N 3.46Å; Q253-Q256 CarbonylContact O-C 3.57Å; Q253-Q256 WeakPolarHBondContact O-CA 3.34Å; Q253-Q256 WeakPolarHBondContact O-CB 3.36Å; Q253-Q256 PolarHBondContact O-N 3.05Å; Q253-Y257 PolarHBondContact O-N 3.28Å
254D96Very high95.4Very high130 Ų13065.7 Ų65.770%0.69534%0.34SS*.Hα-helixtrans-48.8-48.4-176.7-63.8-0.3000112.9Q256 Y257 D258D254-Q256 VanDerWaalsContact C-N 3.31Å; D254-Q256 PolarHBondContact O-N 3.21Å; D254-Y257 WeakPolarHBondContact O-CB 3.39Å; D254-Y257 PolarHBondContact O-N 2.69Å; D254-D258 PolarHBondContact O-N 3.2Å
255D96.8Very high95.4Very high140 Ų14070.5 Ų70.575%0.74936%0.361SS*.Hα-helixtrans-60.9-37.8178.9-66-21.9000113Q253 L259Q253-D255 VanDerWaalsContact C-N 3.32Å; Q253-D255 PolarHBondContact O-N 3.46Å; D255-L259 WeakPolarHBondContact O-CB 3.46Å; D255-L259 PolarHBondContact O-N 2.83Å; D255-L259 VanDerWaalsContact O-N 3.17Å
256Q96.9Very high95.4Very high85 Ų8573.5 Ų73.540%0.39738%0.38SS..Hα-helixtrans-76.2-37178.6-67.6-176.5-44.500111.3L218 L252 Q253 D254 G260L218-Q256 HydrophobicContact CD1-CB 4.2Å; L218-Q256 HydrophobicContact CD2-CB 4.44Å; L252-Q256 HydrophobicContact CB-CB 4.19Å; L252-Q256 HydrophobicContact CD1-CB 4.49Å; L252-Q256 HydrophobicContact CD2-CB 4.38Å; Q253-Q256 CarbonylContact O-C 3.57Å; Q253-Q256 WeakPolarHBondContact O-CA 3.34Å; Q253-Q256 WeakPolarHBondContact O-CB 3.36Å; Q253-Q256 PolarHBondContact O-N 3.05Å; D254-Q256 VanDerWaalsContact C-N 3.31Å; D254-Q256 PolarHBondContact O-N 3.21Å; Q256-G260 PolarHBondContact O-N 3.4Å
257Y97.3Very high95.5Very high68 Ų6868.8 Ų68.827%0.26736%0.358SS..Hα-helixtrans-59.5-52.3174.4179.5-87.3000110.4F249 Q253 D254 L259 G260 M261F249-Y257 HydrophobicContact CB-CD2 3.68Å; F249-Y257 HydrophobicContact CB-CE2 3.78Å; Q253-Y257 PolarHBondContact O-N 3.28Å; D254-Y257 WeakPolarHBondContact O-CB 3.39Å; D254-Y257 PolarHBondContact O-N 2.69Å; Y257-L259 PolarHBondContact O-N 3.04Å; Y257-G260 PolarHBondContact O-N 2.9Å; Y257-M261 HydrophobicContact CD1-CG 4.27Å; Y257-M261 HydrophobicContact CE1-CG 3.84Å; Y257-M261 HydrophobicContact CE2-CG 4.32Å; Y257-M261 WeakPolarHBondContact O-CB 3.46Å; Y257-M261 WeakPolarHBondContact O-CG 3.34Å; Y257-M261 PolarHBondContact O-N 3.38Å
258D96.7Very high95.5Very high104 Ų10466.9 Ų66.956%0.55635%0.348SS*.Hα-helixtrans-61.1-43.8-179.9-75.5-14.4000111.8D254 K262D254-D258 PolarHBondContact O-N 3.2Å; D258-K262 VanDerWaalsContact O-CB 3.24Å; D258-K262 WeakPolarHBondContact O-CB 3.24Å; D258-K262 PolarHBondContact O-N 3.49Å
259L97.2Very high95.5Very high74 Ų7473 Ų7339%0.38738%0.376SS..Hα-helixtrans-64.7-44177-179.661000112.2L218 D255 Y257 K262 R263L218-L259 HydrophobicContact CD2-CB 4.46Å; L218-L259 HydrophobicContact CD2-CD2 4.27Å; L218-L259 HydrophobicContact CD2-CG 4.36Å; D255-L259 WeakPolarHBondContact O-CB 3.46Å; D255-L259 PolarHBondContact O-N 2.83Å; D255-L259 VanDerWaalsContact O-N 3.17Å; Y257-L259 PolarHBondContact O-N 3.04Å; L259-K262 PolarHBondContact O-N 3.48Å; L259-R263 WeakPolarHBondContact O-CG 3.34Å; L259-R263 PolarHBondContact O-N 2.9Å; L259-R263 VanDerWaalsContact O-N 3.1Å
260G96.4Very high95.4Very high0 Ų074.7 Ų74.70%039%0.386CS..Hα-helixtrans-61.8-49.9178.100000111.4Q256 Y257 K262 R263 V264Q256-G260 PolarHBondContact O-N 3.4Å; Y257-G260 PolarHBondContact O-N 2.9Å; G260-K262 PolarHBondContact O-N 3.13Å; G260-R263 PolarHBondContact O-N 3.48Å; G260-V264 WeakPolarHBondContact O-CG2 3.41Å; G260-V264 PolarHBondContact O-N 2.88Å
261M96.3Very high95.5Very high47 Ų4775.8 Ų75.823%0.23238%0.377CS..Hα-helixtrans-62.7-39.8177.5-75.7-57.8-68.500112.4F249 Y257 R263 V264 H265F249-M261 HydrophobicContact CD2-CG 4.05Å; F249-M261 HydrophobicContact CD2-SD 3.54Å; F249-M261 VanDerWaalsContact CD2-SD 3.54Å; F249-M261 HydrophobicContact CE2-CG 4.36Å; F249-M261 HydrophobicContact CE2-SD 3.63Å; Y257-M261 HydrophobicContact CD1-CG 4.27Å; Y257-M261 HydrophobicContact CE1-CG 3.84Å; Y257-M261 HydrophobicContact CE2-CG 4.32Å; Y257-M261 WeakPolarHBondContact O-CB 3.46Å; Y257-M261 WeakPolarHBondContact O-CG 3.34Å; Y257-M261 PolarHBondContact O-N 3.38Å; M261-R263 VanDerWaalsContact C-N 3.32Å; M261-R263 PolarHBondContact O-N 2.97Å; M261-V264 PolarHBondContact O-N 2.87Å; M261-H265 WeakPolarHBondContact O-CB 3.46Å; M261-H265 PolarHBondContact O-N 2.86Å
262K96.9Very high95.5Very high148 Ų14872.1 Ų72.164%0.64335%0.353SS*.Hα-helixtrans-58.8-43.3174.3-177.4177.8-179.2177.20112D258 L259 G260 H265 T266D258-K262 VanDerWaalsContact O-CB 3.24Å; D258-K262 WeakPolarHBondContact O-CB 3.24Å; D258-K262 PolarHBondContact O-N 3.49Å; L259-K262 PolarHBondContact O-N 3.48Å; G260-K262 PolarHBondContact O-N 3.13Å; K262-H265 WeakPolarHBondContact O-CB 3.17Å; K262-H265 PolarHBondContact O-N 3.35Å; K262-T266 PolarHBondContact O-N 3.37Å; K262-T266 PolarHBondContact O-OG1 2.87Å; K262-T266 VanDerWaalsContact O-OG1 3.08Å
263R96.6Very high95.3Very high54 Ų5474.8 Ų74.820%0.20437%0.365CS..Hα-helixtrans-70.3-38.9178.7-75.5169.1171.3-179.4-3.5112.4V217 L218 W221 L259 G260 M261 H265 T266 L267V217-R263 WeakPolarHBondContact O-CD 3.08Å; V217-R263 PolarHBondContact O-NH1 2.73Å; L218-R263 VanDerWaalsContact CA-NH1 3.3Å; L218-R263 PolarHBondContact O-NH1 3.35Å; W221-R263 HydrophobicContact CD2-CB 4.3Å; W221-R263 HydrophobicContact CD2-CG 4.02Å; W221-R263 HydrophobicContact CE3-CB 4.11Å; W221-R263 HydrophobicContact CE3-CG 4.33Å; W221-R263 VanDerWaalsContact CG-CZ 3.45Å; W221-R263 HydrophobicContact CH2-CB 3.91Å; W221-R263 HydrophobicContact CH2-CG 4.32Å; W221-R263 HydrophobicContact CZ2-CB 4.14Å; W221-R263 HydrophobicContact CZ2-CG 4.04Å; W221-R263 HydrophobicContact CZ3-CB 3.9Å; W221-R263 HydrophobicContact CZ3-CG 4.46Å; L259-R263 WeakPolarHBondContact O-CG 3.34Å; L259-R263 PolarHBondContact O-N 2.9Å; L259-R263 VanDerWaalsContact O-N 3.1Å; G260-R263 PolarHBondContact O-N 3.48Å; M261-R263 VanDerWaalsContact C-N 3.32Å; M261-R263 PolarHBondContact O-N 2.97Å; R263-H265 VanDerWaalsContact C-N 3.3Å; R263-H265 PolarHBondContact O-N 3.01Å; R263-T266 WeakPolarHBondContact O-CB 3.48Å; R263-T266 PolarHBondContact O-N 3.31Å; R263-L267 PolarHBondContact O-N 3.18Å
264V96Very high95.1Very high2 Ų273.7 Ų73.71%0.01236%0.358CS..Hα-helixtrans-59.4-43.6170.9171.20000110.4V217 I236 L245 F249 G260 M261 T266 L267 L268V217-V264 HydrophobicContact CG1-CG2 4.01Å; I236-V264 HydrophobicContact CG2-CG2 4.15Å; L245-V264 HydrophobicContact CD2-CG1 3.76Å; L245-V264 HydrophobicContact CD2-CG2 3.97Å; F249-V264 HydrophobicContact CE2-CG2 3.92Å; F249-V264 HydrophobicContact CZ-CG2 3.91Å; G260-V264 WeakPolarHBondContact O-CG2 3.41Å; G260-V264 PolarHBondContact O-N 2.88Å; M261-V264 PolarHBondContact O-N 2.87Å; V264-T266 VanDerWaalsContact C-N 3.33Å; V264-T266 PolarHBondContact O-N 3.19Å; V264-L267 WeakPolarHBondContact O-CB 3.48Å; V264-L267 PolarHBondContact O-N 3.45Å; V264-L268 HydrophobicContact CG1-CD1 3.95Å; V264-L268 HydrophobicContact CG1-CG 4.42Å; V264-L268 WeakPolarHBondContact O-CG 3.34Å; V264-L268 PolarHBondContact O-N 2.93Å
265H95Very high94.9Very high108 Ų10868.3 Ų68.350%0.533%0.329SS..Hα-helixtrans-59.9-43.4175.8-16162.2000112M261 K262 R263 L267 L268 E269M261-H265 WeakPolarHBondContact O-CB 3.46Å; M261-H265 PolarHBondContact O-N 2.86Å; K262-H265 WeakPolarHBondContact O-CB 3.17Å; K262-H265 PolarHBondContact O-N 3.35Å; R263-H265 VanDerWaalsContact C-N 3.3Å; R263-H265 PolarHBondContact O-N 3.01Å; H265-L267 VanDerWaalsContact C-N 3.26Å; H265-L267 PolarHBondContact O-N 3.25Å; H265-L268 PolarHBondContact O-N 3.46Å; H265-E269 IonicContact CD2-OE1 2.59Å; H265-E269 PolarHBondContact CD2-OE1 3.33Å; H265-E269 IonicContact NE2-OE1 3.65Å; H265-E269 PolarHBondContact NE2-OE1 3.4Å; H265-E269 WeakPolarHBondContact O-CG 3.48Å; H265-E269 PolarHBondContact O-N 3.42Å
266T94.8Very high94.7Very high67 Ų6762.1 Ų62.141%0.41130%0.297SS..Hα-helixtrans-57.8-36.8173.1-54.60000112.7K262 R263 V264K262-T266 PolarHBondContact O-N 3.37Å; K262-T266 PolarHBondContact O-OG1 2.87Å; K262-T266 VanDerWaalsContact O-OG1 3.08Å; R263-T266 WeakPolarHBondContact O-CB 3.48Å; R263-T266 PolarHBondContact O-N 3.31Å; V264-T266 VanDerWaalsContact C-N 3.33Å; V264-T266 PolarHBondContact O-N 3.19Å
267L94.5Very high94.3Very high5 Ų562.6 Ų62.63%0.02631%0.309CS..Hα-helixtrans-69.5-34.2174.8-65.8178.1000112.6W221 P225 L233 I236 L237 R263 V264 H265 L270W221-L267 HydrophobicContact CH2-CD1 4.33Å; W221-L267 HydrophobicContact CH2-CD2 3.76Å; W221-L267 HydrophobicContact CH2-CG 3.83Å; W221-L267 HydrophobicContact CZ3-CD1 4.01Å; W221-L267 HydrophobicContact CZ3-CD2 4.13Å; W221-L267 HydrophobicContact CZ3-CG 4.04Å; P225-L267 HydrophobicContact CB-CD2 4.24Å; P225-L267 HydrophobicContact CG-CD2 4.01Å; L233-L267 HydrophobicContact CD1-CD1 4.03Å; L233-L267 HydrophobicContact CD1-CD2 4.12Å; I236-L267 HydrophobicContact CG2-CD1 4.19Å; L237-L267 HydrophobicContact CD2-CB 4.15Å; R263-L267 PolarHBondContact O-N 3.18Å; V264-L267 WeakPolarHBondContact O-CB 3.48Å; V264-L267 PolarHBondContact O-N 3.45Å; H265-L267 VanDerWaalsContact C-N 3.26Å; H265-L267 PolarHBondContact O-N 3.25Å; L267-L270 HydrophobicContact CD2-CD1 4.04Å; L267-L270 WeakPolarHBondContact O-CB 3.36Å; L267-L270 WeakPolarHBondContact O-CD1 3.36Å; L267-L270 VanDerWaalsContact O-CG 3.25Å; L267-L270 WeakPolarHBondContact O-CG 3.32Å; L267-L270 PolarHBondContact O-N 3.1Å
268L93.1Very high93.9Very high42 Ų4263.1 Ų63.122%0.2231%0.313CS..Hα-helixtrans-75.7-27179.6-66.2166.7000112.7L237 H240 V264 H265 L270L237-L268 HydrophobicContact CD2-CD2 3.85Å; H240-L268 WeakPolarHBondContact CE1-CD1 3.37Å; H240-L268 WeakPolarHBondContact NE2-CD1 3.48Å; V264-L268 HydrophobicContact CG1-CD1 3.95Å; V264-L268 HydrophobicContact CG1-CG 4.42Å; V264-L268 WeakPolarHBondContact O-CG 3.34Å; V264-L268 PolarHBondContact O-N 2.93Å; H265-L268 PolarHBondContact O-N 3.46Å; L268-L270 PolarHBondContact O-N 3.17Å
269E93.6Very high93.3Very high127 Ų12763.4 Ų63.459%0.59332%0.32SS*.THydrogen-bonded Turntrans-75-9.3174.2-71.4178.4154.500113.2H265H265-E269 IonicContact CD2-OE1 2.59Å; H265-E269 PolarHBondContact CD2-OE1 3.33Å; H265-E269 IonicContact NE2-OE1 3.65Å; H265-E269 PolarHBondContact NE2-OE1 3.4Å; H265-E269 WeakPolarHBondContact O-CG 3.48Å; H265-E269 PolarHBondContact O-N 3.42Å
270L93Very high92.5Very high37 Ų3766.5 Ų66.519%0.19434%0.337CS..SBendtrans-62.8139176.1-62.9174.1000110.8P225 L267 L268 P272 E275 W286P225-L270 HydrophobicContact CB-CD1 3.97Å; P225-L270 HydrophobicContact CG-CD1 3.45Å; P225-L270 VanDerWaalsContact CG-CD1 3.45Å; P225-L270 HydrophobicContact CG-CD2 4.19Å; P225-L270 HydrophobicContact CG-CG 4.46Å; L267-L270 HydrophobicContact CD2-CD1 4.04Å; L267-L270 WeakPolarHBondContact O-CB 3.36Å; L267-L270 WeakPolarHBondContact O-CD1 3.36Å; L267-L270 VanDerWaalsContact O-CG 3.25Å; L267-L270 WeakPolarHBondContact O-CG 3.32Å; L267-L270 PolarHBondContact O-N 3.1Å; L268-L270 PolarHBondContact O-N 3.17Å; L270-P272 VanDerWaalsContact O-CD 3.23Å; L270-P272 WeakPolarHBondContact O-CD 3.47Å; L270-E275 HydrophobicContact CB-CG 4.04Å; L270-W286 HydrophobicContact CD1-CH2 3.97Å; L270-W286 HydrophobicContact CD1-CZ3 4.44Å
271E93.3Very high92.1Very high101 Ų10167.5 Ų67.547%0.47235%0.346SS..  trans-87109.3176.6-71177.3-131.900110.3E273 K274 E275E271-E273 PolarHBondContact O-N 2.93Å; E271-E273 VanDerWaalsContact O-N 3.14Å; E271-K274 HydrophobicContact CB-CB 4.18Å; E271-K274 HydrophobicContact CB-CD 4.08Å; E271-K274 HydrophobicContact CB-CG 4.15Å; E271-K274 HydrophobicContact CG-CD 4.49Å; E271-K274 PolarHBondContact O-N 3.07Å; E271-K274 IonicContact OE1-NZ 2.66Å; E271-K274 PolarHBondContact OE1-NZ 2.96Å; E271-K274 VanDerWaalsContact OE2-CD 3.24Å; E271-K274 WeakPolarHBondContact OE2-CD 3.43Å; E271-K274 WeakPolarHBondContact OE2-CE 3.43Å; E271-K274 IonicContact OE2-NZ 3.44Å; E271-K274 PolarHBondContact OE2-NZ 3.32Å; E271-E275 PolarHBondContact O-N 3.44Å
272P93.6Very high91.8Very high16 Ų1666.6 Ų66.610%0.10434%0.342CS..Hα-helixtrans-60-34.4-172.2-26.737.3000113.5L111 L270 K274 E275 S276 W286 V289 A290L111-P272 HydrophobicContact CD1-CB 4.06Å; L111-P272 WeakPolarHBondContact CD1-O 3.37Å; L270-P272 VanDerWaalsContact O-CD 3.23Å; L270-P272 WeakPolarHBondContact O-CD 3.47Å; P272-K274 VanDerWaalsContact C-N 3.34Å; P272-K274 PolarHBondContact O-N 3.31Å; P272-E275 PolarHBondContact O-N 3.42Å; P272-S276 VanDerWaalsContact O-CB 3.23Å; P272-S276 WeakPolarHBondContact O-CB 3.49Å; P272-S276 PolarHBondContact O-N 3.45Å; P272-S276 PolarHBondContact O-OG 2.67Å; P272-W286 HydrophobicContact CB-CB 4.36Å; P272-W286 HydrophobicContact CB-CE3 4.17Å; P272-V289 HydrophobicContact CG-CG1 4.22Å; P272-A290 HydrophobicContact CB-CB 3.83Å; P272-A290 HydrophobicContact CG-CB 4Å
273E91.4Very high91.7Very high78 Ų7862.6 Ų62.636%0.36433%0.325SS..Hα-helixtrans-59.6-43.5175.8-65.7-72.9175.300111.5S110 L111 E271 S276S110-E273 WeakPolarHBondContact CA-OE1 3.49Å; S110-E273 VanDerWaalsContact CB-OE1 3.24Å; S110-E273 WeakPolarHBondContact CB-OE1 3.27Å; L111-E273 HydrophobicContact CD1-CG 4.48Å; L111-E273 WeakPolarHBondContact CG-OE2 3.28Å; L111-E273 PolarHBondContact N-OE1 3.17Å; L111-E273 PolarHBondContact N-OE2 3.25Å; E271-E273 PolarHBondContact O-N 2.93Å; E271-E273 VanDerWaalsContact O-N 3.14Å; E273-S276 PolarHBondContact O-OG 3.33Å
274K91.8Very high91.6Very high115 Ų11560.1 Ų60.150%0.532%0.316SS..Hα-helixtrans-70.4-47.4177.8-69.9-179179.3156.80110.9E271 P272 S276 S277E271-K274 HydrophobicContact CB-CB 4.18Å; E271-K274 HydrophobicContact CB-CD 4.08Å; E271-K274 HydrophobicContact CB-CG 4.15Å; E271-K274 HydrophobicContact CG-CD 4.49Å; E271-K274 PolarHBondContact O-N 3.07Å; E271-K274 IonicContact OE1-NZ 2.66Å; E271-K274 PolarHBondContact OE1-NZ 2.96Å; E271-K274 VanDerWaalsContact OE2-CD 3.24Å; E271-K274 WeakPolarHBondContact OE2-CD 3.43Å; E271-K274 WeakPolarHBondContact OE2-CE 3.43Å; E271-K274 IonicContact OE2-NZ 3.44Å; E271-K274 PolarHBondContact OE2-NZ 3.32Å; P272-K274 VanDerWaalsContact C-N 3.34Å; P272-K274 PolarHBondContact O-N 3.31Å; K274-S276 VanDerWaalsContact C-N 3.3Å; K274-S276 PolarHBondContact O-N 2.66Å; K274-S277 PolarHBondContact O-N 3.39Å; K274-S277 VanDerWaalsContact O-N 3.15Å; K274-S277 PolarHBondContact O-OG 3.09Å
275E92.4Very high91.6Very high16 Ų1660.2 Ų60.28%0.07532%0.317CS..Hα-helixtrans-65.6-33.3-177.2-61.5-55.9110.300112.5H226 L270 E271 P272 S277 K278 A281 W286H226-E275 IonicContact CD2-OE2 2.73Å; H226-E275 PolarHBondContact CE1-O 2.97Å; H226-E275 VanDerWaalsContact CE1-O 3.24Å; H226-E275 IonicContact CE1-OE2 3.51Å; H226-E275 IonicContact NE2-OE2 3.15Å; H226-E275 PolarHBondContact NE2-OE2 2.79Å; L270-E275 HydrophobicContact CB-CG 4.04Å; E271-E275 PolarHBondContact O-N 3.44Å; P272-E275 PolarHBondContact O-N 3.42Å; E275-S277 VanDerWaalsContact C-N 3.27Å; E275-S277 PolarHBondContact O-N 2.81Å; E275-K278 PolarHBondContact O-N 3.36Å; E275-K278 IonicContact OE1-NZ 3.33Å; E275-K278 PolarHBondContact OE1-NZ 3.16Å; E275-K278 IonicContact OE2-NZ 2.76Å; E275-K278 PolarHBondContact OE2-NZ 2.9Å; E275-A281 WeakPolarHBondContact O-CB 3.44Å; E275-W286 HydrophobicContact CB-CD2 3.84Å; E275-W286 HydrophobicContact CB-CE3 4.05Å; E275-W286 HydrophobicContact CB-CH2 3.76Å; E275-W286 HydrophobicContact CB-CZ2 3.53Å; E275-W286 HydrophobicContact CB-CZ3 4.01Å; E275-W286 HydrophobicContact CG-CH2 3.92Å; E275-W286 HydrophobicContact CG-CZ2 4.14Å; E275-W286 HydrophobicContact CG-CZ3 4.19Å
276S91.4Very high91.6Very high10 Ų1055.2 Ų55.27%0.0729%0.293CS..Hα-helixtrans-68.5-23.6176.172.90000114.3L111 P272 E273 K274 K278L111-S276 WeakPolarHBondContact CD1-OG 3.42Å; P272-S276 VanDerWaalsContact O-CB 3.23Å; P272-S276 WeakPolarHBondContact O-CB 3.49Å; P272-S276 PolarHBondContact O-N 3.45Å; P272-S276 PolarHBondContact O-OG 2.67Å; E273-S276 PolarHBondContact O-OG 3.33Å; K274-S276 VanDerWaalsContact C-N 3.3Å; K274-S276 PolarHBondContact O-N 2.66Å; S276-K278 VanDerWaalsContact C-N 3.29Å
277S88.9Confident91.7Very high95 Ų9552 Ų5266%0.66427%0.274SS*.THydrogen-bonded Turntrans-81.1-10.7-178.573.60000113.6K274 E275K274-S277 PolarHBondContact O-N 3.39Å; K274-S277 VanDerWaalsContact O-N 3.15Å; K274-S277 PolarHBondContact O-OG 3.09Å; E275-S277 VanDerWaalsContact C-N 3.27Å; E275-S277 PolarHBondContact O-N 2.81Å
278K89.6Confident91.8Very high79 Ų7951.8 Ų51.834%0.34327%0.273SS..SBendtrans-74.3151.5179.2-74168.8172.8174.60111H226 E275 S276 A281H226-K278 WeakPolarHBondContact CD2-CD 3.25Å; H226-K278 WeakPolarHBondContact NE2-CD 3.49Å; H226-K278 PolarHBondContact NE2-NZ 3.4Å; E275-K278 PolarHBondContact O-N 3.36Å; E275-K278 IonicContact OE1-NZ 3.33Å; E275-K278 PolarHBondContact OE1-NZ 3.16Å; E275-K278 IonicContact OE2-NZ 2.76Å; E275-K278 PolarHBondContact OE2-NZ 2.9Å; S276-K278 VanDerWaalsContact C-N 3.29Å; K278-A281 VanDerWaalsContact O-CB 3.28Å; K278-A281 WeakPolarHBondContact O-CB 3.46Å; K278-A281 PolarHBondContact O-N 2.92Å
279P83.1Confident91.8Very high110 Ų11050.5 Ų50.571%0.71427%0.266SS*.THydrogen-bonded Turntrans-59.3144.5-179.325.4-34.4000111.1A281P279-A281 PolarHBondContact O-N 3.22Å; P279-A281 VanDerWaalsContact O-N 3.1Å
280N80.6Confident91.9Very high139 Ų13944.7 Ų44.774%0.74324%0.24SC*.THydrogen-bonded Turntrans6112.3179.6-57.9-17.7000115.6K230K230-N280 WeakPolarHBondContact CE-O 3.41Å; K230-N280 PolarHBondContact NZ-O 3.08Å
281A87.2Confident92Very high21 Ų2143.9 Ų43.917%0.17424%0.239CC..  trans-68.5144.2173.200000111.4E275 K278 P279 E283E275-A281 WeakPolarHBondContact O-CB 3.44Å; K278-A281 VanDerWaalsContact O-CB 3.28Å; K278-A281 WeakPolarHBondContact O-CB 3.46Å; K278-A281 PolarHBondContact O-N 2.92Å; P279-A281 PolarHBondContact O-N 3.22Å; P279-A281 VanDerWaalsContact O-N 3.1Å; A281-E283 PolarHBondContact O-N 2.91Å
282N90.9Very high91.9Very high29 Ų2941.3 Ų41.316%0.15523%0.226CC..  trans-86.9100.3167.6-172.3-52.2000108.1K230 L284 M285 W286K230-N282 HydrophobicContact CD-CB 4.46Å; N282-L284 PolarHBondContact O-N 3.3Å; N282-L284 PolarHBondContact OD1-N 2.92Å; N282-M285 HydrophobicContact CB-CB 3.85Å; N282-M285 WeakPolarHBondContact O-CB 3.43Å; N282-M285 PolarHBondContact O-N 2.81Å; N282-M285 PolarHBondContact OD1-N 3.43Å; N282-W286 VanDerWaalsContact O-CD1 3.23Å; N282-W286 PolarHBondContact O-N 2.69Å
283E93.9Very high91.5Very high63 Ų6344 Ų4429%0.29424%0.243SC..Hα-helixtrans-60.9-33.9-176.6-61.1-179.3123.400112.6L101 L111 R114 A281 W286 A287L101-E283 HydrophobicContact CB-CB 4.4Å; L101-E283 HydrophobicContact CD2-CB 4.18Å; L111-E283 HydrophobicContact CD2-CB 4.37Å; R114-E283 IonicContact CZ-OE1 3.33Å; R114-E283 IonicContact CZ-OE2 3.84Å; R114-E283 IonicContact NH1-OE1 2.89Å; R114-E283 PolarHBondContact NH1-OE1 3.2Å; R114-E283 IonicContact NH1-OE2 2.6Å; R114-E283 PolarHBondContact NH1-OE2 2.83Å; R114-E283 VanDerWaalsContact NH2-CD 3.31Å; R114-E283 IonicContact NH2-OE1 2.79Å; R114-E283 PolarHBondContact NH2-OE1 3.37Å; R114-E283 IonicContact NH2-OE2 2.89Å; R114-E283 PolarHBondContact NH2-OE2 3.42Å; A281-E283 PolarHBondContact O-N 2.91Å; E283-W286 PolarHBondContact O-N 3.18Å; E283-A287 WeakPolarHBondContact O-CB 3.01Å; E283-A287 PolarHBondContact O-N 2.9Å
284L95.1Very high90Very high3 Ų350.2 Ų50.22%0.01627%0.268CS..Hα-helixtrans-71-39179.8-164.7117.3000111.4L90 A94 I99 L101 V116 V145 N282 W286 A287 V288L90-L284 HydrophobicContact CB-CD2 4.33Å; L90-L284 WeakPolarHBondContact O-CD2 3.38Å; A94-L284 HydrophobicContact CB-CB 4.05Å; A94-L284 HydrophobicContact CB-CD2 3.39Å; A94-L284 HydrophobicContact CB-CG 4.32Å; I99-L284 HydrophobicContact CD1-CD1 4.28Å; I99-L284 HydrophobicContact CD1-CD2 3.63Å; I99-L284 HydrophobicContact CG1-CD1 4.33Å; I99-L284 HydrophobicContact CG1-CD2 3.89Å; L101-L284 HydrophobicContact CB-CD1 4.31Å; L101-L284 HydrophobicContact CD1-CD1 4.26Å; V116-L284 HydrophobicContact CB-CD1 4.46Å; V116-L284 HydrophobicContact CG1-CD1 4.02Å; V116-L284 HydrophobicContact CG2-CD1 3.97Å; V145-L284 HydrophobicContact CG2-CD1 4.44Å; N282-L284 PolarHBondContact O-N 3.3Å; N282-L284 PolarHBondContact OD1-N 2.92Å; L284-W286 VanDerWaalsContact C-N 3.35Å; L284-W286 PolarHBondContact O-N 3.2Å; L284-A287 PolarHBondContact O-N 2.91Å; L284-V288 WeakPolarHBondContact O-CG2 2.96Å; L284-V288 PolarHBondContact O-N 2.69Å
285M95.7Very high89.9Confident4 Ų447 Ų472%0.0226%0.257CS..Hα-helixtrans-55.9-50.1171.4-179.1-165.381.800110.8V91 K230 L233 S234 N282 A287 V288 V289V91-M285 HydrophobicContact CG1-CB 4.48Å; V91-M285 HydrophobicContact CG1-CG 4.22Å; K230-M285 HydrophobicContact CB-SD 4.21Å; L233-M285 HydrophobicContact CD2-CE 4.01Å; S234-M285 VanDerWaalsContact OG-CG 3.27Å; S234-M285 WeakPolarHBondContact OG-CG 3.2Å; S234-M285 PolarHBondContact OG-SD 3.23Å; N282-M285 HydrophobicContact CB-CB 3.85Å; N282-M285 WeakPolarHBondContact O-CB 3.43Å; N282-M285 PolarHBondContact O-N 2.81Å; N282-M285 PolarHBondContact OD1-N 3.43Å; M285-A287 VanDerWaalsContact C-N 3.33Å; M285-A287 PolarHBondContact O-N 2.83Å; M285-V288 WeakPolarHBondContact O-CB 3.35Å; M285-V288 PolarHBondContact O-N 3.38Å; M285-V289 WeakPolarHBondContact O-CG2 3.09Å; M285-V289 PolarHBondContact O-N 3.36Å
286W95.6Very high89.8Confident2 Ų248.6 Ų48.61%0.00827%0.266CS..Hα-helixtrans-66-33.2177.6-71.1115.3000113.2L111 H226 L233 L270 P272 E275 N282 E283 L284 V288 V289 A290L111-W286 HydrophobicContact CD1-CB 4.12Å; H226-W286 AromaticContact CE1-CZ2 3.95Å; H226-W286 AromaticContact CE1-NE1 3.91Å; L233-W286 HydrophobicContact CD2-CH2 4.12Å; L233-W286 HydrophobicContact CD2-CZ2 4.04Å; L270-W286 HydrophobicContact CD1-CH2 3.97Å; L270-W286 HydrophobicContact CD1-CZ3 4.44Å; P272-W286 HydrophobicContact CB-CB 4.36Å; P272-W286 HydrophobicContact CB-CE3 4.17Å; E275-W286 HydrophobicContact CB-CD2 3.84Å; E275-W286 HydrophobicContact CB-CE3 4.05Å; E275-W286 HydrophobicContact CB-CH2 3.76Å; E275-W286 HydrophobicContact CB-CZ2 3.53Å; E275-W286 HydrophobicContact CB-CZ3 4.01Å; E275-W286 HydrophobicContact CG-CH2 3.92Å; E275-W286 HydrophobicContact CG-CZ2 4.14Å; E275-W286 HydrophobicContact CG-CZ3 4.19Å; N282-W286 VanDerWaalsContact O-CD1 3.23Å; N282-W286 PolarHBondContact O-N 2.69Å; E283-W286 PolarHBondContact O-N 3.18Å; L284-W286 VanDerWaalsContact C-N 3.35Å; L284-W286 PolarHBondContact O-N 3.2Å; W286-V288 VanDerWaalsContact C-N 3.34Å; W286-V289 HydrophobicContact CE3-CB 4.37Å; W286-V289 HydrophobicContact CE3-CG1 4.42Å; W286-V289 HydrophobicContact CE3-CG2 4.49Å; W286-V289 PolarHBondContact O-N 3.36Å; W286-A290 VanDerWaalsContact O-CB 3.29Å; W286-A290 WeakPolarHBondContact O-CB 2.94Å; W286-A290 PolarHBondContact O-N 3.06Å
287A96.1Very high89.7Confident0 Ų050.7 Ų50.70%028%0.277CS..Hα-helixtrans-66.7-34.7173.400000112.4L101 L111 L112 V145 E283 L284 M285 A291L101-A287 HydrophobicContact CD1-CB 4.43Å; L101-A287 HydrophobicContact CD2-CB 4Å; L111-A287 HydrophobicContact CB-CB 4.19Å; L111-A287 HydrophobicContact CD2-CB 4.4Å; L112-A287 WeakPolarHBondContact CD2-O 3.3Å; V145-A287 HydrophobicContact CB-CB 4.45Å; V145-A287 HydrophobicContact CG2-CB 3.81Å; E283-A287 WeakPolarHBondContact O-CB 3.01Å; E283-A287 PolarHBondContact O-N 2.9Å; L284-A287 PolarHBondContact O-N 2.91Å; M285-A287 VanDerWaalsContact C-N 3.33Å; M285-A287 PolarHBondContact O-N 2.83Å; A287-A291 PolarHBondContact O-N 3.27Å; A287-A291 VanDerWaalsContact O-N 3.17Å
288V96.7Very high89.7Confident0 Ų048.1 Ų48.10%025%0.254CS..Hα-helixtrans-66.7-47171.7174.60000110.3L90 V91 V145 L238 L284 M285 W286 A290 A291 F292L90-V288 HydrophobicContact CB-CG2 3.91Å; L90-V288 HydrophobicContact CD1-CG2 4.32Å; V91-V288 HydrophobicContact CG2-CB 3.84Å; V91-V288 HydrophobicContact CG2-CG1 3.91Å; V91-V288 HydrophobicContact CG2-CG2 3.85Å; V145-V288 HydrophobicContact CG1-CB 4.29Å; V145-V288 HydrophobicContact CG1-CG2 3.61Å; L238-V288 HydrophobicContact CD2-CG1 3.96Å; L284-V288 WeakPolarHBondContact O-CG2 2.96Å; L284-V288 PolarHBondContact O-N 2.69Å; M285-V288 WeakPolarHBondContact O-CB 3.35Å; M285-V288 PolarHBondContact O-N 3.38Å; W286-V288 VanDerWaalsContact C-N 3.34Å; V288-A290 VanDerWaalsContact C-N 3.29Å; V288-A290 PolarHBondContact O-N 3.23Å; V288-A291 WeakPolarHBondContact O-CB 3.49Å; V288-A291 PolarHBondContact O-N 3.44Å; V288-F292 HydrophobicContact CG1-CD2 4.11Å; V288-F292 HydrophobicContact CG1-CE2 3.75Å; V288-F292 VanDerWaalsContact O-CD2 3.25Å; V288-F292 WeakPolarHBondContact O-CD2 3.29Å; V288-F292 PolarHBondContact O-N 3.08Å
289V94.9Very high89.7Confident15 Ų1546.2 Ų46.29%0.09125%0.249CC..Hα-helixtrans-56.7-46175.2174.90000110.7L237 P272 M285 W286 A291 F292 T293L237-V289 HydrophobicContact CB-CG2 4.3Å; L237-V289 HydrophobicContact CD1-CG1 4.11Å; L237-V289 HydrophobicContact CD1-CG2 3.57Å; P272-V289 HydrophobicContact CG-CG1 4.22Å; M285-V289 WeakPolarHBondContact O-CG2 3.09Å; M285-V289 PolarHBondContact O-N 3.36Å; W286-V289 HydrophobicContact CE3-CB 4.37Å; W286-V289 HydrophobicContact CE3-CG1 4.42Å; W286-V289 HydrophobicContact CE3-CG2 4.49Å; W286-V289 PolarHBondContact O-N 3.36Å; V289-A291 PolarHBondContact O-N 2.79Å; V289-F292 PolarHBondContact O-N 2.84Å; V289-T293 HydrophobicContact CG1-CG2 4.27Å; V289-T293 WeakPolarHBondContact O-CG2 3.09Å; V289-T293 PolarHBondContact O-N 3.3Å; V289-T293 PolarHBondContact O-OG1 3.35Å
290A95Very high90.2Very high5 Ų541.9 Ų41.94%0.04122%0.218CC..Hα-helixtrans-58.1-30.9177.400000113.4L112 P272 W286 V288 F292 T293L112-A290 HydrophobicContact CD1-CB 4.36Å; L112-A290 HydrophobicContact CD2-CB 3.78Å; L112-A290 HydrophobicContact CG-CB 4.03Å; P272-A290 HydrophobicContact CB-CB 3.83Å; P272-A290 HydrophobicContact CG-CB 4Å; W286-A290 VanDerWaalsContact O-CB 3.29Å; W286-A290 WeakPolarHBondContact O-CB 2.94Å; W286-A290 PolarHBondContact O-N 3.06Å; V288-A290 VanDerWaalsContact C-N 3.29Å; V288-A290 PolarHBondContact O-N 3.23Å; A290-F292 VanDerWaalsContact C-N 3.33Å; A290-T293 WeakPolarHBondContact CA-OG1 3.25Å; A290-T293 PolarHBondContact O-OG1 2.99Å; A290-T293 VanDerWaalsContact O-OG1 3.05Å
291A94.9Very high90.9Very high20 Ų2035 Ų3517%0.16518%0.18CC..Hα-helixtrans-75.1-20.9179.400000113L112 V145 I149 A287 V288 V289L112-A291 HydrophobicContact CD2-CB 4.05Å; V145-A291 HydrophobicContact CG1-CB 4.41Å; I149-A291 HydrophobicContact CD1-CB 4.04Å; A287-A291 PolarHBondContact O-N 3.27Å; A287-A291 VanDerWaalsContact O-N 3.17Å; V288-A291 WeakPolarHBondContact O-CB 3.49Å; V288-A291 PolarHBondContact O-N 3.44Å; V289-A291 PolarHBondContact O-N 2.79Å
292F91.6Very high91.1Very high48 Ų4836.1 Ų36.121%0.21118%0.181CC..Hα-helixtrans-98.2-12.2175.7-70.2-75000113.8S83 I149 L238 S241 V288 V289 A290S83-F292 WeakPolarHBondContact O-CZ 3.33Å; I149-F292 HydrophobicContact CD1-CE2 3.99Å; I149-F292 HydrophobicContact CD1-CZ 4.11Å; L238-F292 HydrophobicContact CD2-CD2 4.1Å; L238-F292 HydrophobicContact CD2-CE2 3.78Å; S241-F292 WeakPolarHBondContact OG-CB 3.22Å; V288-F292 HydrophobicContact CG1-CD2 4.11Å; V288-F292 HydrophobicContact CG1-CE2 3.75Å; V288-F292 VanDerWaalsContact O-CD2 3.25Å; V288-F292 WeakPolarHBondContact O-CD2 3.29Å; V288-F292 PolarHBondContact O-N 3.08Å; V289-F292 PolarHBondContact O-N 2.84Å; A290-F292 VanDerWaalsContact C-N 3.33Å
293T83.8Confident91.2Very high73 Ų7336.7 Ų36.745%0.44818%0.183SC..  trans-91-10.917852.80000114.3V289 A290V289-T293 HydrophobicContact CG1-CG2 4.27Å; V289-T293 WeakPolarHBondContact O-CG2 3.09Å; V289-T293 PolarHBondContact O-N 3.3Å; V289-T293 PolarHBondContact O-OG1 3.35Å; A290-T293 WeakPolarHBondContact CA-OG1 3.25Å; A290-T293 PolarHBondContact O-OG1 2.99Å; A290-T293 VanDerWaalsContact O-OG1 3.05Å
294K60.8Low90.9Very high207 Ų20734.3 Ų34.390%0.917%0.173SC*.  trans-107.80179.9-77.5-166.1-176.7179.80111.1L112L112-K294 HydrophobicContact CD1-CD 3.61Å; L112-K294 HydrophobicContact CD1-CG 4.48Å

Retrieved 294 of 294 residues in 555.7 ms (Link to these results)