A0A077Z3K1_TRITR Loading...

Protein CBG08672

AlphaFold DB , UniProt , Accession A0A077Z3K1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 152 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M32.6Very low27.4Very low243 Ų243139.3 Ų139.3100%1.19781%0.814SS**  0135.50-87.2160.9126.500108.1
2E35.2Very low27.3Very low188 Ų188142.3 Ų142.388%0.87981%0.813SS**  trans60.689.8177.2-127.5109.9117.300120.6
3S24.9Very low27.2Very low95 Ų95144.2 Ų144.266%0.66481%0.807SS**  trans-79.9116.9159.4145.70000109.1
4S27.9Very low27.1Very low110 Ų110140.6 Ų140.677%0.76980%0.797SS**  trans-108.296.6165.4-160.50000109.6T6S4-T6 PolarHBondContact O-N 3.4Å
5K24.7Very low27.6Very low188 Ų188138.7 Ų138.782%0.81778%0.782SS**  trans-78108.1172.7-69.7174.5178.8176.70107.9
6T29.2Very low27.5Very low129 Ų129139.8 Ų139.879%0.79179%0.785SS**  trans-97.7105.8169.8-34.60000109.2S4S4-T6 PolarHBondContact O-N 3.4Å
7S24.1Very low27.8Very low107 Ų107137.2 Ų137.275%0.74877%0.773SS**  trans-68.7122.7-175.1-150.10000111.2I9S7-I9 PolarHBondContact O-N 2.89Å
8C25.4Very low27.7Very low128 Ų128139.2 Ų139.287%0.86577%0.773SS**  trans-82.5103.8171.3-74.20000109.5S10C8-S10 PolarHBondContact O-N 3.24Å
9I26.9Very low27.8Very low154 Ų154138.7 Ų138.779%0.7977%0.767SS**  trans-79.5102.7171.9-59.1172.4000107.7S7 A11S7-I9 PolarHBondContact O-N 2.89Å; I9-A11 PolarHBondContact O-N 3.06Å; I9-A11 VanDerWaalsContact O-N 3.14Å
10S24.7Very low27.7Very low111 Ų111140.3 Ų140.378%0.77677%0.771SS**  trans-74.394.3168.5169.70000109.3C8 H12C8-S10 PolarHBondContact O-N 3.24Å; S10-H12 PolarHBondContact O-N 3.3Å
11A26.2Very low27.7Very low79 Ų79140.4 Ų140.465%0.65377%0.77SS**  trans-78103.4170.300000109.8I9 F13I9-A11 PolarHBondContact O-N 3.06Å; I9-A11 VanDerWaalsContact O-N 3.14Å; A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.27Å
12H25.5Very low27.4Very low175 Ų175139.5 Ų139.581%0.8175%0.753SS**  trans-78.284.1172.9-161.8-92.5000109S10 S14S10-H12 PolarHBondContact O-N 3.3Å; H12-S14 PolarHBondContact O-N 3.2Å
13F26.4Very low27Very low168 Ų168137.3 Ų137.374%0.73776%0.756SS**  trans-89.999.6-177.7-139.7-96.7000110.1A11 I15A11-F13 VanDerWaalsContact C-N 3.34Å; A11-F13 PolarHBondContact O-N 3.27Å; F13-I15 HydrophobicContact CD1-CD1 3.34Å; F13-I15 HydrophobicContact CD1-CG1 3.41Å; F13-I15 VanDerWaalsContact CD1-CG1 3.41Å; F13-I15 HydrophobicContact CE1-CD1 3.58Å; F13-I15 HydrophobicContact CE1-CG1 3.57Å; F13-I15 PolarHBondContact O-N 3.19Å
14S25.8Very low27.1Very low94 Ų94139.9 Ų139.966%0.65776%0.758SS**  trans-82.784.7176.9-176.50000109.7H12 N16H12-S14 PolarHBondContact O-N 3.2Å; S14-N16 PolarHBondContact O-N 3.26Å
15I33.8Very low27Very low112 Ų112143.3 Ų143.357%0.57476%0.762SS**  trans-89.7100.3170.1-70.5158.4000108.5F13 T17F13-I15 HydrophobicContact CD1-CD1 3.34Å; F13-I15 HydrophobicContact CD1-CG1 3.41Å; F13-I15 VanDerWaalsContact CD1-CG1 3.41Å; F13-I15 HydrophobicContact CE1-CD1 3.58Å; F13-I15 HydrophobicContact CE1-CG1 3.57Å; F13-I15 PolarHBondContact O-N 3.19Å; I15-T17 WeakPolarHBondContact CG2-OG1 2.91Å; I15-T17 PolarHBondContact O-N 3.26Å
16N26.7Very low27.2Very low155 Ų155143.3 Ų143.383%0.82976%0.762SS**  trans-64.885.1158.8-77.9-33.7000108.4S14S14-N16 PolarHBondContact O-N 3.26Å
17T31.9Very low27.1Very low96 Ų96144 Ų14459%0.58976%0.761SS**  trans-149.1113.2166.5-39.80000109.9I15 I19I15-T17 WeakPolarHBondContact CG2-OG1 2.91Å; I15-T17 PolarHBondContact O-N 3.26Å; T17-I19 PolarHBondContact O-N 3.19Å
18F26.5Very low27.3Very low174 Ų174144.6 Ų144.676%0.76376%0.755SS**  trans-63.8125.7169.4-86.2-103.2000109.1
19I30.1Very low27.5Very low130 Ų130141 Ų14167%0.66774%0.739SS**  trans-131.2105.2161.4-51.3179000107.2T17 L21T17-I19 PolarHBondContact O-N 3.19Å; I19-L21 HydrophobicContact CG2-CD1 3.68Å; I19-L21 HydrophobicContact CG2-CG 3.89Å
20M24.7Very low27.8Very low170 Ų170140.9 Ų140.984%0.83773%0.73SS**  trans-70.9117.9163.1-117.6-162.7179.600107.2
21L28.1Very low28.2Very low143 Ų143138.6 Ų138.675%0.74971%0.712SS**  trans-121.5109167.5-85.4152.7000108.5I19I19-L21 HydrophobicContact CG2-CD1 3.68Å; I19-L21 HydrophobicContact CG2-CG 3.89Å
22R26.8Very low28.6Very low224 Ų224140.7 Ų140.785%0.84571%0.708SS**  trans-76.6120.8177.7-164.5-173.7-80.1-167.6-4107.4E24R22-E24 PolarHBondContact O-N 3.17Å; R22-E24 VanDerWaalsContact O-N 3.09Å
23C26.2Very low28.9Very low141 Ų141137.7 Ų137.795%0.95370%0.704SS**  trans-77.792.1178.3-79.50000110.5
24E27.1Very low29.4Very low150 Ų150134.7 Ų134.770%0.70170%0.699SS**SBendtrans-125.6103.3158.8-150.5172.7157.200105.3R22 F26R22-E24 PolarHBondContact O-N 3.17Å; R22-E24 VanDerWaalsContact O-N 3.09Å; E24-F26 VanDerWaalsContact O-CD2 3.24Å; E24-F26 WeakPolarHBondContact O-CD2 3.49Å; E24-F26 PolarHBondContact O-N 2.78Å; E24-F26 VanDerWaalsContact O-N 3.16Å
25Q25.8Very low30.1Very low182 Ų182136.2 Ų136.285%0.8571%0.71SS**SBendtrans51.936158.2-109.1-174.1-16.900121.6
26F29.2Very low30.2Very low188 Ų188135 Ų13583%0.82572%0.724SS**  trans-139.8144.7176.2-71.8-76.9000118.4E24E24-F26 VanDerWaalsContact O-CD2 3.24Å; E24-F26 WeakPolarHBondContact O-CD2 3.49Å; E24-F26 PolarHBondContact O-N 2.78Å; E24-F26 VanDerWaalsContact O-N 3.16Å
27N26.3Very low30.5Very low142 Ų142137.5 Ų137.576%0.75972%0.722SS**  trans-54.9124.1-178.8-70.7-51.4000113.2G29N27-G29 PolarHBondContact O-N 3.02Å
28L29.1Very low30.5Very low120 Ų120141.4 Ų141.463%0.62873%0.731SS**  trans-83.2101.9169.4-87.7153.2000109.5
29G29.2Very low30.8Very low52 Ų52139 Ų13954%0.53673%0.725SS.*  trans-99113.1162.600000109.6N27N27-G29 PolarHBondContact O-N 3.02Å
30Y32.6Very low30.9Very low153 Ų153135.9 Ų135.960%0.672%0.715SS**EExtended strand (participates in β ladder)trans-100.4126.8167.6-177.7-104000109.1Q32 C41Y30-Q32 HydrophobicContact CD1-CB 4.45Å; Y30-Q32 HydrophobicContact CE1-CB 3.72Å; Y30-Q32 HydrophobicContact CE1-CG 4.05Å; Y30-C41 PolarHBondContact O-N 3.29Å
31V34.5Very low31.1Very low63 Ų63131.6 Ų131.638%0.38270%0.701SS.*EExtended strand (participates in β ladder)trans-120.9105.9178.9176.20000108.9K38 I39V31-K38 HydrophobicContact CG1-CB 3.41Å; V31-K38 VanDerWaalsContact CG1-CB 3.41Å; V31-K38 HydrophobicContact CG1-CD 4Å; V31-K38 HydrophobicContact CG1-CG 3.49Å; V31-K38 VanDerWaalsContact CG1-CG 3.49Å; V31-I39 VanDerWaalsContact CA-O 3.29Å; V31-I39 WeakPolarHBondContact CA-O 3.38Å
32Q33.8Very low31.4Very low122 Ų122132.5 Ų132.557%0.5770%0.696SS**EExtended strand (participates in β ladder)trans-86.1138.6178.2-156.7168.513.500110.5Y30Y30-Q32 HydrophobicContact CD1-CB 4.45Å; Y30-Q32 HydrophobicContact CE1-CB 3.72Å; Y30-Q32 HydrophobicContact CE1-CG 4.05Å
33P33.1Very low32Very low113 Ų113128 Ų12873%0.73469%0.687SS**EExtended strand (participates in β ladder)trans-90.3123.6-173.633.3-29.9000111.1
34V35.1Very low32.5Very low105 Ų105127.6 Ų127.664%0.63668%0.68SS**EExtended strand (participates in β ladder)trans-138.6112.3160.1-171.90000108.3G36 R37V34-G36 PolarHBondContact O-N 3.16Å; V34-R37 PolarHBondContact O-N 3.04Å; V34-R37 VanDerWaalsContact O-N 3.12Å
35S41.9Very low33.1Very low125 Ų125124.4 Ų124.487%0.87469%0.687SS**THydrogen-bonded Turntrans49.645.9169.7-58.20000116.1R37S35-R37 PolarHBondContact O-N 3.17Å
36G36.2Very low33.8Very low86 Ų86123.6 Ų123.689%0.88768%0.681SS**THydrogen-bonded Turntrans79.28.817600000115.9V34V34-G36 PolarHBondContact O-N 3.16Å
37R32.7Very low34.2Very low208 Ų208119.2 Ų119.279%0.78567%0.674SS**EExtended strand (participates in β ladder)trans-109.3127.7175.8-63.9-175.2178.3-171.6-0.6110.9V34 S35V34-R37 PolarHBondContact O-N 3.04Å; V34-R37 VanDerWaalsContact O-N 3.12Å; S35-R37 PolarHBondContact O-N 3.17Å
38K32.2Very low34.7Very low178 Ų178118.3 Ų118.377%0.77468%0.676SS**EExtended strand (participates in β ladder)trans-95.8128.7178.6-67.9-172.1176.1176.20109.7V31V31-K38 HydrophobicContact CG1-CB 3.41Å; V31-K38 VanDerWaalsContact CG1-CB 3.41Å; V31-K38 HydrophobicContact CG1-CD 4Å; V31-K38 HydrophobicContact CG1-CG 3.49Å; V31-K38 VanDerWaalsContact CG1-CG 3.49Å
39I32.8Very low35.1Very low123 Ų123120.5 Ų120.563%0.63169%0.686SS**EExtended strand (participates in β ladder)trans-115.3113168.3-62.2169.5000107.5V31V31-I39 VanDerWaalsContact CA-O 3.29Å; V31-I39 WeakPolarHBondContact CA-O 3.38Å
40S32Very low35.4Very low65 Ų65123.5 Ų123.546%0.45570%0.699SS.*EExtended strand (participates in β ladder)trans-97.6125.7178.6410000110.8
41C29.4Very low35.5Very low81 Ų81119.6 Ų119.655%0.54770%0.698SS.*EExtended strand (participates in β ladder)trans-113.5136.5174.8-670000111.4Y30Y30-C41 PolarHBondContact O-N 3.29Å
42Y32.6Very low35.3Very low162 Ų162122 Ų12264%0.63572%0.715SS**  trans-108.9138.6177.9-58.6-92.1000109.6
43I40.3Very low35.2Very low129 Ų129120.7 Ų120.766%0.66271%0.712SS**  trans-97106.1175.2-61.7172.8000108.5
44T36.3Very low35.1Very low132 Ų132121.9 Ų121.981%0.8171%0.708SS**  trans-100131.517038.80000110.2
45G40.3Very low35Very low83 Ų83123.7 Ų123.786%0.85671%0.709SS**SBendtrans89.526.2158.400000118.8
46K41.4Very low34.6Very low166 Ų166123.2 Ų123.272%0.72271%0.706SS**  trans-126.5132.6171.6-66.3-170.3178.91800112.7
47S36Very low34.5Very low96 Ų96125.1 Ų125.167%0.67169%0.69SS**  trans-54.7146.3-176.748.50000113.2I49S47-I49 PolarHBondContact O-N 2.79Å
48P38Very low34.7Very low123 Ų123123.1 Ų123.180%0.79969%0.694SS**  trans-59.8127.3-18025.1-33.7000111.3
49I37Very low34.8Very low165 Ų165119.5 Ų119.585%0.84669%0.69SS**  trans-96.4105.9173-60.7168.6000107.2S47S47-I49 PolarHBondContact O-N 2.79Å
50S35.1Very low35.2Very low115 Ų115123 Ų12380%0.80470%0.7SS**  trans-107.8117.6172.7-61.20000108.6
51A34.4Very low35.5Very low71 Ų71127.7 Ų127.759%0.58772%0.715SS**  trans-122.7128.9177.800000110.2L53A51-L53 PolarHBondContact O-N 2.98Å
52P30.8Very low35.9Very low114 Ų114126.9 Ų126.974%0.7471%0.714SS**  trans-69.2119.7176.825.8-30.6000110.5Q54P52-Q54 PolarHBondContact O-N 2.94Å; P52-Q54 VanDerWaalsContact O-N 3.07Å
53L31.2Very low36.2Very low95 Ų95125 Ų12550%0.49772%0.715SS.*THydrogen-bonded Turntrans-39.7100.3163.6-118.289.4000110.8A51 L85 F87A51-L53 PolarHBondContact O-N 2.98Å; L53-L85 HydrophobicContact CD1-CD1 3.85Å; L53-L85 HydrophobicContact CD2-CD1 4.37Å; L53-L85 HydrophobicContact CG-CD1 3.78Å; L53-F87 HydrophobicContact CB-CE1 3.6Å; L53-F87 HydrophobicContact CB-CZ 3.37Å; L53-F87 HydrophobicContact CD2-CD1 4.47Å; L53-F87 HydrophobicContact CD2-CE1 3.55Å; L53-F87 HydrophobicContact CD2-CZ 3.55Å; L53-F87 HydrophobicContact CG-CE1 4.04Å; L53-F87 HydrophobicContact CG-CZ 3.7Å; L53-F87 WeakPolarHBondContact O-CE1 3.18Å; L53-F87 WeakPolarHBondContact O-CZ 3.33Å
54Q32.4Very low35.9Very low138 Ų138123.8 Ų123.865%0.64571%0.709SS**THydrogen-bonded Turntrans1691.9149.7-96.7-168.95.300116.4P52 F87P52-Q54 PolarHBondContact O-N 2.94Å; P52-Q54 VanDerWaalsContact O-N 3.07Å; Q54-F87 HydrophobicContact CB-CE2 4.21Å; Q54-F87 HydrophobicContact CB-CZ 4.19Å; Q54-F87 HydrophobicContact CG-CD1 4.45Å; Q54-F87 HydrophobicContact CG-CD2 3.63Å; Q54-F87 HydrophobicContact CG-CE1 3.91Å; Q54-F87 HydrophobicContact CG-CE2 3.03Å; Q54-F87 HydrophobicContact CG-CG 4.35Å; Q54-F87 HydrophobicContact CG-CZ 3.23Å
55Q32.2Very low36.2Very low142 Ų142119.6 Ų119.666%0.66468%0.683SS**  trans-128129.5-176.2-68.4-178.2-13.600112.8F57Q55-F57 HydrophobicContact CB-CD2 4.28Å; Q55-F57 HydrophobicContact CB-CE1 4.32Å; Q55-F57 HydrophobicContact CB-CE2 3.65Å; Q55-F57 HydrophobicContact CB-CZ 3.67Å; Q55-F57 WeakPolarHBondContact O-CD2 3.4Å; Q55-F57 WeakPolarHBondContact O-CE2 3.23Å; Q55-F57 PolarHBondContact O-N 3.48Å
56S33Very low35.9Very low116 Ų116119.8 Ų119.881%0.81167%0.668SS**  trans-67.692.9170.655.30000108.9L58S56-L58 PolarHBondContact O-N 2.9Å
57F35.2Very low35.6Very low126 Ų126116.1 Ų116.155%0.55366%0.656SS**  trans-79.3102.6172.3-65-77000108.7Q55 C59Q55-F57 HydrophobicContact CB-CD2 4.28Å; Q55-F57 HydrophobicContact CB-CE1 4.32Å; Q55-F57 HydrophobicContact CB-CE2 3.65Å; Q55-F57 HydrophobicContact CB-CZ 3.67Å; Q55-F57 WeakPolarHBondContact O-CD2 3.4Å; Q55-F57 WeakPolarHBondContact O-CE2 3.23Å; Q55-F57 PolarHBondContact O-N 3.48Å; F57-C59 PolarHBondContact O-N 3.42Å
58L36.8Very low35.7Very low165 Ų165116.1 Ų116.186%0.86466%0.656SS**  trans-70.883157.8-134.289.6000106.3S56 K60S56-L58 PolarHBondContact O-N 2.9Å; L58-K60 PolarHBondContact O-N 3.46Å
59C34.9Very low35.8Very low102 Ų102113.8 Ų113.869%0.68964%0.636SS**  trans-66.292.1168.3-95.20000107.7F57 H61F57-C59 PolarHBondContact O-N 3.42Å; C59-H61 PolarHBondContact O-N 3.45Å
60K39.3Very low36.2Very low196 Ų196112.1 Ų112.185%0.85264%0.636SS**  trans-73.87.9169.6-144.4-177.6-177.3-175.80112.3L58 A62L58-K60 PolarHBondContact O-N 3.46Å; K60-A62 PolarHBondContact O-N 3.32Å
61H38.6Very low36.8Very low165 Ų165112.4 Ų112.476%0.76463%0.634SS**SBendtrans-90.198.6164.9-6797.2000107.5C59 L63C59-H61 PolarHBondContact O-N 3.45Å; H61-L63 PolarHBondContact O-N 2.85Å
62A37.5Very low37.3Very low63 Ų63114.4 Ų114.452%0.52164%0.639SS.*  trans-51.1106.7163.800000107.2K60 N64 I78K60-A62 PolarHBondContact O-N 3.32Å; A62-N64 VanDerWaalsContact C-N 3.27Å; A62-N64 PolarHBondContact O-N 3.45Å; A62-I78 HydrophobicContact CB-CG2 4.4Å
63L40.5Very low37.7Very low124 Ų124111.1 Ų111.165%0.64963%0.626SS**  trans-67.399169-167.377000105.1H61 V65H61-L63 PolarHBondContact O-N 2.85Å; L63-V65 HydrophobicContact CB-CG2 4.35Å; L63-V65 HydrophobicContact CD2-CG2 3.53Å; L63-V65 HydrophobicContact CG-CG2 3.69Å; L63-V65 PolarHBondContact O-N 3.48Å
64N33.3Very low38.2Very low103 Ų103111.9 Ų111.955%0.55163%0.63SS**  trans-7582.8178.8-14429.1000107.3A62 T66A62-N64 VanDerWaalsContact C-N 3.27Å; A62-N64 PolarHBondContact O-N 3.45Å; N64-T66 PolarHBondContact O-N 3.29Å
65V41.7Very low38.4Very low44 Ų44109.2 Ų109.227%0.26763%0.626SS.*EExtended strand (participates in β ladder)trans-86.393.4172.8-1670000106.1L63 L67L63-V65 HydrophobicContact CB-CG2 4.35Å; L63-V65 HydrophobicContact CD2-CG2 3.53Å; L63-V65 HydrophobicContact CG-CG2 3.69Å; L63-V65 PolarHBondContact O-N 3.48Å; V65-L67 HydrophobicContact CG1-CD1 4.29Å; V65-L67 PolarHBondContact O-N 2.83Å; V65-L67 VanDerWaalsContact O-N 3.11Å
66T35.2Very low38.7Very low86 Ų86107.1 Ų107.153%0.52862%0.619SS.*EExtended strand (participates in β ladder)trans-63.9106.4167.347.90000107.6N64 S68 D76N64-T66 PolarHBondContact O-N 3.29Å; T66-S68 PolarHBondContact O-N 3.07Å; T66-D76 VanDerWaalsContact CG2-OD1 3.3Å; T66-D76 WeakPolarHBondContact CG2-OD1 3.34Å
67L35.3Very low38.9Very low89 Ų89104.6 Ų104.647%0.46660%0.599SS.*EExtended strand (participates in β ladder)trans-76.1107.2168.4-88.978.8000107.7V65 N69 N74 C75 V77V65-L67 HydrophobicContact CG1-CD1 4.29Å; V65-L67 PolarHBondContact O-N 2.83Å; V65-L67 VanDerWaalsContact O-N 3.11Å; L67-N69 PolarHBondContact O-N 3.27Å; L67-N74 WeakPolarHBondContact O-CA 3.46Å; L67-C75 WeakPolarHBondContact CB-O 3.42Å; L67-C75 PolarHBondContact N-O 2.92Å; L67-C75 PolarHBondContact O-N 2.87Å; L67-V77 HydrophobicContact CD1-CB 4.18Å; L67-V77 HydrophobicContact CD1-CG2 4.17Å
68S37.4Very low39Very low96 Ų96103.5 Ų103.567%0.67160%0.597SS**  trans-83109.2166.6-173.20000108.8T66 N74T66-S68 PolarHBondContact O-N 3.07Å; S68-N74 WeakPolarHBondContact CA-OD1 3.18Å
69N40.1Very low39Very low74 Ų74100.4 Ų100.440%0.39658%0.581SS.*  trans-102.8120.5164.3-171.6-30.5000107.5L67 T71 T72L67-N69 PolarHBondContact O-N 3.27Å; N69-T71 PolarHBondContact O-N 2.92Å; N69-T71 PolarHBondContact OD1-N 3.47Å; N69-T71 PolarHBondContact OD1-OG1 3.37Å; N69-T72 VanDerWaalsContact CG-OG1 3.3Å; N69-T72 PolarHBondContact ND2-OG1 3.49Å; N69-T72 PolarHBondContact O-N 3.4Å
70P45.7Very low39Very low130 Ų130104.4 Ų104.484%0.84459%0.59SS**THydrogen-bonded Turntrans-62.4-11.3-178.925.2-33.9000113.6
71T47.4Very low38.8Very low122 Ų122104.1 Ų104.175%0.74859%0.585SS**THydrogen-bonded Turntrans-113.3-9.6-171.8-260000114.1N69N69-T71 PolarHBondContact O-N 2.92Å; N69-T71 PolarHBondContact OD1-N 3.47Å; N69-T71 PolarHBondContact OD1-OG1 3.37Å
72T44.6Very low38.6Very low113 Ų113105.5 Ų105.569%0.69359%0.588SS**THydrogen-bonded Turntrans-144.610.1-171.318.70000116.6N69N69-T72 VanDerWaalsContact CG-OG1 3.3Å; N69-T72 PolarHBondContact ND2-OG1 3.49Å; N69-T72 PolarHBondContact O-N 3.4Å
73G40.6Very low38.5Very low45 Ų45106.3 Ų106.346%0.46460%0.595SS.*  trans77.7160.4179.100000112.8C75G73-C75 PolarHBondContact O-N 2.95Å
74N39.9Very low38.1Very low110 Ų110108.7 Ų108.759%0.58860%0.6SS**  trans-73122.9-171.4-62.6-22.1000110.9L67 S68L67-N74 WeakPolarHBondContact O-CA 3.46Å; S68-N74 WeakPolarHBondContact CA-OD1 3.18Å
75C37.3Very low38.1Very low82 Ų82107.9 Ų107.955%0.55460%0.596SS**EExtended strand (participates in β ladder)trans-103.2119.2169.3-83.50000109.2L67 G73 V77L67-C75 WeakPolarHBondContact CB-O 3.42Å; L67-C75 PolarHBondContact N-O 2.92Å; L67-C75 PolarHBondContact O-N 2.87Å; G73-C75 PolarHBondContact O-N 2.95Å; C75-V77 PolarHBondContact O-N 3.43Å
76D38.1Very low37.5Very low99 Ų99114.8 Ų114.853%0.52962%0.624SS.*EExtended strand (participates in β ladder)trans-79.3107.8170.5-74.8-22.8000109T66T66-D76 VanDerWaalsContact CG2-OD1 3.3Å; T66-D76 WeakPolarHBondContact CG2-OD1 3.34Å
77V36.9Very low37.3Very low63 Ų63114.4 Ų114.438%0.38262%0.615SS.*EExtended strand (participates in β ladder)trans-106.1113176.2-178.20000108.7L67 C75 L79L67-V77 HydrophobicContact CD1-CB 4.18Å; L67-V77 HydrophobicContact CD1-CG2 4.17Å; C75-V77 PolarHBondContact O-N 3.43Å; V77-L79 HydrophobicContact CG1-CG 4.42Å; V77-L79 PolarHBondContact O-N 3.41Å
78I37.9Very low37.1Very low102 Ų102119.3 Ų119.352%0.52364%0.638SS.*  trans-88.1106.9174.4-57.7172.7000108.3A62A62-I78 HydrophobicContact CB-CG2 4.4Å
79L37Very low36.5Very low100 Ų100125.5 Ų125.552%0.52465%0.647SS.*  trans-87.4115.4172.6-78.5142.3000110.1V77 Y81V77-L79 HydrophobicContact CG1-CG 4.42Å; V77-L79 PolarHBondContact O-N 3.41Å; L79-Y81 HydrophobicContact CB-CD2 4.33Å; L79-Y81 HydrophobicContact CB-CE2 3.82Å; L79-Y81 HydrophobicContact CD2-CE2 4.37Å
80Q34.2Very low35.9Very low186 Ų186128.5 Ų128.587%0.86967%0.669SS**  trans-95.4114.7165.9-75.6-173.921.900109.8
81Y36.4Very low35.3Very low190 Ų190128.5 Ų128.575%0.74567%0.666SS**  trans-92.9126.9172.4-72.3-88.8000110.5L79L79-Y81 HydrophobicContact CB-CD2 4.33Å; L79-Y81 HydrophobicContact CB-CE2 3.82Å; L79-Y81 HydrophobicContact CD2-CE2 4.37Å
82K33.9Very low34.4Very low194 Ų194132.8 Ų132.884%0.84367%0.67SS**  trans-121.593.1171-170176.8-173.8175.90108.9
83A35.8Very low33.9Very low80 Ų80133.6 Ų133.666%0.66167%0.668SS**  trans-91.8131.5176.200000111.1
84K30.9Very low33.5Very low175 Ų175138.6 Ų138.676%0.76169%0.685SS**  trans-112.5124.6164.8-78.8-176.5174.3-177.90107.5
85L34.2Very low33.3Very low86 Ų86140.1 Ų140.145%0.4569%0.691SS.*  trans-129.4135.9178.1-76.1161.4000110.9L53L53-L85 HydrophobicContact CD1-CD1 3.85Å; L53-L85 HydrophobicContact CD2-CD1 4.37Å; L53-L85 HydrophobicContact CG-CD1 3.78Å
86H28.9Very low33.1Very low188 Ų188144 Ų14487%0.8770%0.701SS**  trans-99.4141.8175.6-100.2-117.4000110
87F31.4Very low33Very low78 Ų78143 Ų14334%0.34271%0.707SS.*  trans-101.8125.8-180-70.4-94.2000111.3L53 Q54L53-F87 HydrophobicContact CB-CE1 3.6Å; L53-F87 HydrophobicContact CB-CZ 3.37Å; L53-F87 HydrophobicContact CD2-CD1 4.47Å; L53-F87 HydrophobicContact CD2-CE1 3.55Å; L53-F87 HydrophobicContact CD2-CZ 3.55Å; L53-F87 HydrophobicContact CG-CE1 4.04Å; L53-F87 HydrophobicContact CG-CZ 3.7Å; L53-F87 WeakPolarHBondContact O-CE1 3.18Å; L53-F87 WeakPolarHBondContact O-CZ 3.33Å; Q54-F87 HydrophobicContact CB-CE2 4.21Å; Q54-F87 HydrophobicContact CB-CZ 4.19Å; Q54-F87 HydrophobicContact CG-CD1 4.45Å; Q54-F87 HydrophobicContact CG-CD2 3.63Å; Q54-F87 HydrophobicContact CG-CE1 3.91Å; Q54-F87 HydrophobicContact CG-CE2 3.03Å; Q54-F87 HydrophobicContact CG-CG 4.35Å; Q54-F87 HydrophobicContact CG-CZ 3.23Å
88M30.3Very low32.8Very low192 Ų192150.1 Ų150.195%0.94673%0.729SS**  trans-106.2117.9155.6-69-158.979.200107.8
89W25.6Very low32.7Very low227 Ų227149.8 Ų149.886%0.8673%0.727SS**  trans-70.4132.5176.8-85.337.6000110.5
90T27.6Very low32.7Very low137 Ų137150.3 Ų150.384%0.8474%0.738SS**  trans179.4140.2138.726.10000109.6
91V31.7Very low33Very low129 Ų129146.8 Ų146.878%0.78273%0.725SS**  trans93.4108.4171.5-162.70000116.5
92Y28.3Very low33.3Very low213 Ų213148.2 Ų148.284%0.83573%0.729SS**  trans-62.7112.5176.2-162.6-95.5000111.3
93I35.2Very low33.9Very low129 Ų129143 Ų14366%0.66272%0.717SS**  trans-141.2115.7167.6-52.5179.2000107.4I95I93-I95 HydrophobicContact CG2-CG1 4.2Å; I93-I95 PolarHBondContact O-N 2.89Å; I93-I95 VanDerWaalsContact O-N 3.13Å
94D31.7Very low34.2Very low151 Ų151146.2 Ų146.281%0.80772%0.716SS**  trans-54.4108.3168.1-92.9-51.9000109.4
95I36.8Very low34.9Very low141 Ų141144.1 Ų144.172%0.72371%0.709SS**  trans-119.5106170.5-55.5175.9000106.6I93 A97I93-I95 HydrophobicContact CG2-CG1 4.2Å; I93-I95 PolarHBondContact O-N 2.89Å; I93-I95 VanDerWaalsContact O-N 3.13Å; I95-A97 PolarHBondContact O-N 3.1Å
96E33.3Very low35.9Very low163 Ų163145.8 Ų145.876%0.76272%0.717SS**  trans-46.7101.1175.6-67178.9158.100110.8Y98E96-Y98 HydrophobicContact CB-CD2 4.29Å; E96-Y98 HydrophobicContact CB-CE2 4.33Å; E96-Y98 PolarHBondContact O-N 3.24Å
97A34.3Very low37.1Very low80 Ų80138.9 Ų138.966%0.66170%0.697SS**  trans-76.987.617600000109I95 L99I95-A97 PolarHBondContact O-N 3.1Å; A97-L99 HydrophobicContact CB-CD1 4.08Å; A97-L99 WeakPolarHBondContact O-CD1 3.46Å; A97-L99 PolarHBondContact O-N 3.26Å
98Y33.8Very low38.2Very low212 Ų212140.7 Ų140.783%0.83171%0.709SS**  trans-72.888161.2-84.4-91.4000108.1E96E96-Y98 HydrophobicContact CB-CD2 4.29Å; E96-Y98 HydrophobicContact CB-CE2 4.33Å; E96-Y98 PolarHBondContact O-N 3.24Å
99L36.4Very low39.5Very low94 Ų94137.1 Ų137.149%0.49269%0.694SS.*  trans-55137178.5-8989.1000111A97 D101 K104A97-L99 HydrophobicContact CB-CD1 4.08Å; A97-L99 WeakPolarHBondContact O-CD1 3.46Å; A97-L99 PolarHBondContact O-N 3.26Å; L99-D101 PolarHBondContact O-N 3.34Å; L99-K104 HydrophobicContact CD2-CD 4.4Å
100C36.3Very low41.1Very low111 Ų111129.1 Ų129.175%0.7568%0.676SS**  trans-59.769.8149.1-90.80000109.9R102 S103C100-R102 PolarHBondContact O-N 3.03Å; C100-S103 PolarHBondContact O-N 3.41Å; C100-S103 VanDerWaalsContact O-N 3.16Å
101D40.3Very low42.5Very low113 Ų113126.5 Ų126.560%0.60466%0.663SS**Hα-helixtrans-60.2-27.6180-108-29.9000111.7L99 S103L99-D101 PolarHBondContact O-N 3.34Å; D101-S103 VanDerWaalsContact C-N 3.33Å; D101-S103 PolarHBondContact O-N 2.98Å
102R41.7Very low43.8Very low219 Ų219125.2 Ų125.283%0.82665%0.651SS**Hα-helixtrans-71.5-18.1178.1-84.9-165.3171.8161.80.5115.8C100C100-R102 PolarHBondContact O-N 3.03Å
103S46.9Very low45.5Very low85 Ų85122.2 Ų122.259%0.59464%0.642SS**Hα-helixtrans-98-15.8-176.9-1580000113.8C100 D101C100-S103 PolarHBondContact O-N 3.41Å; C100-S103 VanDerWaalsContact O-N 3.16Å; D101-S103 VanDerWaalsContact C-N 3.33Å; D101-S103 PolarHBondContact O-N 2.98Å
104K42.7Very low46.7Very low148 Ų148119.1 Ų119.164%0.64363%0.632SS**Hα-helixtrans-72.9-37.8175-120.1-179.3179.4179.20111.4L99 I106 L108L99-K104 HydrophobicContact CD2-CD 4.4Å; K104-I106 PolarHBondContact O-N 3.28Å; K104-L108 WeakPolarHBondContact O-CB 3.31Å; K104-L108 PolarHBondContact O-N 2.74Å; K104-L108 VanDerWaalsContact O-N 3.09Å
105E45.7Very low48.1Very low131 Ų131114.8 Ų114.861%0.61262%0.617SS**Hα-helixtrans-64.9-40.9179.6-65.8-172.615300112.1L108 L109E105-L108 PolarHBondContact O-N 3.43Å; E105-L109 VanDerWaalsContact O-CB 3.26Å; E105-L109 WeakPolarHBondContact O-CB 3.38Å; E105-L109 VanDerWaalsContact O-CD1 3.28Å; E105-L109 WeakPolarHBondContact O-CD1 3.32Å; E105-L109 PolarHBondContact O-N 3.38Å
106I55.9Low49.6Very low121 Ų121111.4 Ų111.462%0.62161%0.606SS**Hα-helixtrans-69.8-38.5-176.6-54.8171.3000111.3K104 A110K104-I106 PolarHBondContact O-N 3.28Å; I106-A110 VanDerWaalsContact O-CB 3.26Å; I106-A110 WeakPolarHBondContact O-CB 3.35Å; I106-A110 PolarHBondContact O-N 2.98Å
107G53.6Low51.7Low42 Ų42107.7 Ų107.743%0.43360%0.595SS.*Hα-helixtrans-69-44176.400000112.5A110 S111G107-A110 PolarHBondContact O-N 3Å; G107-S111 PolarHBondContact O-N 3Å
108L53.2Low53.8Low117 Ų117110.1 Ų110.161%0.61360%0.595SS**Hα-helixtrans-67.5-42.4177.3-155.597.4000111.2K104 E105 A110 S111 L112K104-L108 WeakPolarHBondContact O-CB 3.31Å; K104-L108 PolarHBondContact O-N 2.74Å; K104-L108 VanDerWaalsContact O-N 3.09Å; E105-L108 PolarHBondContact O-N 3.43Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.34Å; L108-S111 PolarHBondContact O-N 3.04Å; L108-L112 HydrophobicContact CD2-CD1 3.58Å; L108-L112 HydrophobicContact CG-CD1 3.88Å; L108-L112 HydrophobicContact CG-CG 4.45Å; L108-L112 WeakPolarHBondContact O-CB 3.42Å; L108-L112 WeakPolarHBondContact O-CD1 3.29Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.12Å; L108-L112 PolarHBondContact O-N 2.79Å
109L58.8Low56Low117 Ų117102.9 Ų102.961%0.61358%0.575SS**Hα-helixtrans-62.3-38.4173.6-102.5101.7000111.8E105 K113E105-L109 VanDerWaalsContact O-CB 3.26Å; E105-L109 WeakPolarHBondContact O-CB 3.38Å; E105-L109 VanDerWaalsContact O-CD1 3.28Å; E105-L109 WeakPolarHBondContact O-CD1 3.32Å; E105-L109 PolarHBondContact O-N 3.38Å; L109-K113 WeakPolarHBondContact O-CA 3.48Å; L109-K113 WeakPolarHBondContact O-CB 3.48Å; L109-K113 PolarHBondContact O-N 3.46Å
110A59.1Low58.3Low59 Ų59101.4 Ų101.449%0.48857%0.572SS.*Hα-helixtrans-66.8-41.6177.900000112.1I106 G107 L108 S114I106-A110 VanDerWaalsContact O-CB 3.26Å; I106-A110 WeakPolarHBondContact O-CB 3.35Å; I106-A110 PolarHBondContact O-N 2.98Å; G107-A110 PolarHBondContact O-N 3Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-A110 PolarHBondContact O-N 3.34Å; A110-S114 PolarHBondContact O-N 3.4Å; A110-S114 VanDerWaalsContact O-N 3.12Å; A110-S114 PolarHBondContact O-OG 3.24Å
111S56.3Low60.7Low81 Ų8198 Ų9857%0.56656%0.556SS**Hα-helixtrans-70-39.8173.8-790000112.8G107 L108 S114 A115G107-S111 PolarHBondContact O-N 3Å; L108-S111 PolarHBondContact O-N 3.04Å; S111-S114 WeakPolarHBondContact CA-OG 3.37Å; S111-S114 PolarHBondContact O-N 3.02Å; S111-S114 PolarHBondContact O-OG 3.48Å; S111-S114 VanDerWaalsContact O-OG 3.13Å; S111-A115 WeakPolarHBondContact O-CB 3.32Å; S111-A115 PolarHBondContact O-N 3.15Å
112L59Low63.1Low102 Ų10299.5 Ų99.553%0.53456%0.558SS.*Hα-helixtrans-66.3-38174.3-77.5163.1000111.3L108 A115 S116L108-L112 HydrophobicContact CD2-CD1 3.58Å; L108-L112 HydrophobicContact CG-CD1 3.88Å; L108-L112 HydrophobicContact CG-CG 4.45Å; L108-L112 WeakPolarHBondContact O-CB 3.42Å; L108-L112 WeakPolarHBondContact O-CD1 3.29Å; L108-L112 VanDerWaalsContact O-CG 3.24Å; L108-L112 WeakPolarHBondContact O-CG 3.12Å; L108-L112 PolarHBondContact O-N 2.79Å; L112-A115 PolarHBondContact O-N 3.48Å; L112-S116 WeakPolarHBondContact O-CB 3.24Å; L112-S116 PolarHBondContact O-N 3.47Å
113K65.1Low65.5Low151 Ų15194.4 Ų94.466%0.65755%0.546SS*.Hα-helixtrans-65.8-40.9177.8-172.9171.2-178.170.70111.2L109 S116 T117L109-K113 WeakPolarHBondContact O-CA 3.48Å; L109-K113 WeakPolarHBondContact O-CB 3.48Å; L109-K113 PolarHBondContact O-N 3.46Å; K113-S116 PolarHBondContact O-N 3.01Å; K113-T117 VanDerWaalsContact O-CG2 3.32Å; K113-T117 WeakPolarHBondContact O-CG2 3.21Å; K113-T117 PolarHBondContact O-N 2.86Å; K113-T117 PolarHBondContact O-OG1 3.03Å
114S60.3Low67.6Low64 Ų6495.9 Ų95.945%0.44855%0.546SS..Hα-helixtrans-70.9-37.4177.534.80000112.7A110 S111 T117 I118A110-S114 PolarHBondContact O-N 3.4Å; A110-S114 VanDerWaalsContact O-N 3.12Å; A110-S114 PolarHBondContact O-OG 3.24Å; S111-S114 WeakPolarHBondContact CA-OG 3.37Å; S111-S114 PolarHBondContact O-N 3.02Å; S111-S114 PolarHBondContact O-OG 3.48Å; S111-S114 VanDerWaalsContact O-OG 3.13Å; S114-T117 WeakPolarHBondContact CA-OG1 3.47Å; S114-T117 PolarHBondContact O-OG1 3.02Å; S114-I118 WeakPolarHBondContact O-CD1 3.43Å; S114-I118 WeakPolarHBondContact O-CG1 3.07Å; S114-I118 PolarHBondContact O-N 3.18Å
115A61.2Low70Confident60 Ų6091.4 Ų91.450%0.49654%0.537SS..Hα-helixtrans-69.3-37.9171.900000113S111 L112 I118 S119S111-A115 WeakPolarHBondContact O-CB 3.32Å; S111-A115 PolarHBondContact O-N 3.15Å; L112-A115 PolarHBondContact O-N 3.48Å; A115-I118 PolarHBondContact O-N 3.45Å; A115-S119 PolarHBondContact O-N 3.49Å; A115-S119 VanDerWaalsContact O-N 3.15Å; A115-S119 PolarHBondContact O-OG 2.97Å
116S68.9Low72.2Confident70 Ų7088.3 Ų88.349%0.4953%0.527SS..Hα-helixtrans-68.5-37.9178.4178.70000112L112 K113 I118 S119 C120L112-S116 WeakPolarHBondContact O-CB 3.24Å; L112-S116 PolarHBondContact O-N 3.47Å; K113-S116 PolarHBondContact O-N 3.01Å; S116-I118 VanDerWaalsContact C-N 3.34Å; S116-I118 PolarHBondContact O-N 3.3Å; S116-S119 WeakPolarHBondContact CA-OG 3.45Å; S116-S119 PolarHBondContact O-N 2.76Å; S116-S119 PolarHBondContact O-OG 3.33Å; S116-C120 WeakPolarHBondContact O-CB 3.39Å; S116-C120 PolarHBondContact O-N 3.16Å
117T77Confident74Confident85 Ų8586.2 Ų86.252%0.52152%0.522SS..Hα-helixtrans-65.4-37.1176.845.10000112.7K113 S114 G121K113-T117 VanDerWaalsContact O-CG2 3.32Å; K113-T117 WeakPolarHBondContact O-CG2 3.21Å; K113-T117 PolarHBondContact O-N 2.86Å; K113-T117 PolarHBondContact O-OG1 3.03Å; S114-T117 WeakPolarHBondContact CA-OG1 3.47Å; S114-T117 PolarHBondContact O-OG1 3.02Å; T117-G121 PolarHBondContact O-N 3.48Å
118I77.6Confident75.9Confident131 Ų13186.6 Ų86.667%0.67252%0.521SS*.Hα-helixtrans-69.9-46.3178.8-65.1166.1000110.3S114 A115 S116 G121 F122S114-I118 WeakPolarHBondContact O-CD1 3.43Å; S114-I118 WeakPolarHBondContact O-CG1 3.07Å; S114-I118 PolarHBondContact O-N 3.18Å; A115-I118 PolarHBondContact O-N 3.45Å; S116-I118 VanDerWaalsContact C-N 3.34Å; S116-I118 PolarHBondContact O-N 3.3Å; I118-G121 PolarHBondContact O-N 3.03Å; I118-F122 PolarHBondContact O-N 3.34Å
119S81.1Confident77.8Confident59 Ų5985.4 Ų85.441%0.41352%0.518SS..Hα-helixtrans-65.8-41.1177.8520000112.5A115 S116 F122 I123A115-S119 PolarHBondContact O-N 3.49Å; A115-S119 VanDerWaalsContact O-N 3.15Å; A115-S119 PolarHBondContact O-OG 2.97Å; S116-S119 WeakPolarHBondContact CA-OG 3.45Å; S116-S119 PolarHBondContact O-N 2.76Å; S116-S119 PolarHBondContact O-OG 3.33Å; S119-F122 PolarHBondContact O-N 2.76Å; S119-I123 WeakPolarHBondContact O-CG1 3.28Å; S119-I123 PolarHBondContact O-N 2.76Å
120C84.7Confident79.4Confident63 Ų6382.6 Ų82.643%0.42651%0.508SS..Hα-helixtrans-61.7-45174.6-173.20000111.5S116 F122 I123 L124S116-C120 WeakPolarHBondContact O-CB 3.39Å; S116-C120 PolarHBondContact O-N 3.16Å; C120-F122 VanDerWaalsContact C-N 3.33Å; C120-F122 PolarHBondContact O-N 3.09Å; C120-I123 PolarHBondContact O-N 2.82Å; C120-L124 WeakPolarHBondContact O-CB 3.26Å; C120-L124 VanDerWaalsContact O-CG 3.29Å; C120-L124 WeakPolarHBondContact O-CG 3.32Å; C120-L124 PolarHBondContact O-N 3.12Å
121G86.8Confident80.9Confident40 Ų4083.7 Ų83.741%0.41251%0.509SS..Hα-helixtrans-59.2-41.6175.400000113T117 I118 A125T117-G121 PolarHBondContact O-N 3.48Å; I118-G121 PolarHBondContact O-N 3.03Å; G121-A125 WeakPolarHBondContact O-CB 3.47Å; G121-A125 PolarHBondContact O-N 2.97Å
122F90.3Very high82.6Confident144 Ų14485.1 Ų85.163%0.63251%0.509SS*.Hα-helixtrans-64.7-47.1177.1-175.9-98000112.4I118 S119 C120 L124 A125 V126I118-F122 PolarHBondContact O-N 3.34Å; S119-F122 PolarHBondContact O-N 2.76Å; C120-F122 VanDerWaalsContact C-N 3.33Å; C120-F122 PolarHBondContact O-N 3.09Å; F122-L124 VanDerWaalsContact C-N 3.33Å; F122-L124 PolarHBondContact O-N 3.46Å; F122-A125 PolarHBondContact O-N 3.05Å; F122-V126 HydrophobicContact CD1-CG2 4.22Å; F122-V126 HydrophobicContact CE1-CG2 3.82Å; F122-V126 HydrophobicContact CE2-CG2 4.43Å; F122-V126 HydrophobicContact CZ-CG2 3.93Å; F122-V126 WeakPolarHBondContact O-CG2 3.44Å; F122-V126 PolarHBondContact O-N 3.13Å
123I91.2Very high84.1Confident112 Ų11284.5 Ų84.557%0.57451%0.509SS*.Hα-helixtrans-61.8-43.2179.3-66.2167000110.6S119 C120 A125 V126 C127S119-I123 WeakPolarHBondContact O-CG1 3.28Å; S119-I123 PolarHBondContact O-N 2.76Å; C120-I123 PolarHBondContact O-N 2.82Å; I123-A125 PolarHBondContact O-N 3.37Å; I123-V126 PolarHBondContact O-N 2.74Å; I123-C127 WeakPolarHBondContact O-CB 3.49Å; I123-C127 PolarHBondContact O-N 3.45Å
124L92Very high85.2Confident116 Ų11682.7 Ų82.761%0.60751%0.506SS*.Hα-helixtrans-62.5-41177.1-70.9172.4000112.1C120 F122 C127 A128C120-L124 WeakPolarHBondContact O-CB 3.26Å; C120-L124 VanDerWaalsContact O-CG 3.29Å; C120-L124 WeakPolarHBondContact O-CG 3.32Å; C120-L124 PolarHBondContact O-N 3.12Å; F122-L124 VanDerWaalsContact C-N 3.33Å; F122-L124 PolarHBondContact O-N 3.46Å; L124-C127 PolarHBondContact O-N 3.02Å; L124-A128 WeakPolarHBondContact O-CB 3.05Å; L124-A128 PolarHBondContact O-N 3.47Å
125A91.4Very high86.4Confident55 Ų5585 Ų8546%0.45551%0.509SS..Hα-helixtrans-63.2-45.6176.500000111.9G121 F122 I123 C127 A128 V129G121-A125 WeakPolarHBondContact O-CB 3.47Å; G121-A125 PolarHBondContact O-N 2.97Å; F122-A125 PolarHBondContact O-N 3.05Å; I123-A125 PolarHBondContact O-N 3.37Å; A125-C127 PolarHBondContact O-N 2.96Å; A125-A128 PolarHBondContact O-N 2.91Å; A125-V129 WeakPolarHBondContact O-CG2 3.43Å; A125-V129 PolarHBondContact O-N 3.13Å; A125-V129 VanDerWaalsContact O-N 3.1Å
126V93.8Very high87.6Confident66 Ų6685.3 Ų85.340%0.451%0.507SS..Hα-helixtrans-62.7-43.8176.7174.10000110.8F122 I123 A128 V129 C130F122-V126 HydrophobicContact CD1-CG2 4.22Å; F122-V126 HydrophobicContact CE1-CG2 3.82Å; F122-V126 HydrophobicContact CE2-CG2 4.43Å; F122-V126 HydrophobicContact CZ-CG2 3.93Å; F122-V126 WeakPolarHBondContact O-CG2 3.44Å; F122-V126 PolarHBondContact O-N 3.13Å; I123-V126 PolarHBondContact O-N 2.74Å; V126-A128 VanDerWaalsContact C-N 3.33Å; V126-A128 PolarHBondContact O-N 3Å; V126-V129 PolarHBondContact O-N 3.07Å; V126-C130 WeakPolarHBondContact O-CB 3.49Å; V126-C130 PolarHBondContact O-N 3.2Å; V126-C130 PolarHBondContact O-SG 3.21Å
127C92.8Very high88.2Confident76 Ų7683.7 Ų83.751%0.51450%0.499SS..Hα-helixtrans-61.7-40.7178.5-1360000112I123 L124 A125 C130 T131I123-C127 WeakPolarHBondContact O-CB 3.49Å; I123-C127 PolarHBondContact O-N 3.45Å; L124-C127 PolarHBondContact O-N 3.02Å; A125-C127 PolarHBondContact O-N 2.96Å; C127-C130 PolarHBondContact O-N 3.23Å; C127-T131 WeakPolarHBondContact O-CG2 3.26Å; C127-T131 PolarHBondContact O-N 3.5Å; C127-T131 PolarHBondContact O-OG1 2.96Å; C127-T131 VanDerWaalsContact O-OG1 3.07Å
128A93.9Very high88.4Confident51 Ų5186.5 Ų86.542%0.42150%0.504SS..Hα-helixtrans-61.9-44.4175.200000112.1L124 A125 V126 T131 I132L124-A128 WeakPolarHBondContact O-CB 3.05Å; L124-A128 PolarHBondContact O-N 3.47Å; A125-A128 PolarHBondContact O-N 2.91Å; V126-A128 VanDerWaalsContact C-N 3.33Å; V126-A128 PolarHBondContact O-N 3Å; A128-T131 PolarHBondContact O-OG1 3.09Å; A128-I132 WeakPolarHBondContact O-CD1 3.5Å; A128-I132 VanDerWaalsContact O-CG1 3.32Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 2.93Å
129V92.7Very high88.1Confident91 Ų9188.6 Ų88.655%0.55250%0.503SS*.Hα-helixtrans-65.4-45.2176.61770000111.2A125 V126 T131 I132 V133A125-V129 WeakPolarHBondContact O-CG2 3.43Å; A125-V129 PolarHBondContact O-N 3.13Å; A125-V129 VanDerWaalsContact O-N 3.1Å; V126-V129 PolarHBondContact O-N 3.07Å; V129-T131 PolarHBondContact O-N 2.83Å; V129-I132 PolarHBondContact O-N 2.91Å; V129-V133 HydrophobicContact CG1-CG2 4.36Å; V129-V133 WeakPolarHBondContact O-CG2 3.4Å; V129-V133 PolarHBondContact O-N 3.48Å
130C92.2Very high87.7Confident59 Ų5990 Ų9040%0.39951%0.51SS..Hα-helixtrans-60.6-43.6179.3-71.20000112.1V126 C127 I132 V133 I134V126-C130 WeakPolarHBondContact O-CB 3.49Å; V126-C130 PolarHBondContact O-N 3.2Å; V126-C130 PolarHBondContact O-SG 3.21Å; C127-C130 PolarHBondContact O-N 3.23Å; C130-I132 PolarHBondContact O-N 2.96Å; C130-V133 PolarHBondContact O-N 3.33Å; C130-I134 HydrophobicContact CB-CD1 4.49Å; C130-I134 WeakPolarHBondContact O-CB 3.38Å; C130-I134 WeakPolarHBondContact O-CD1 3.08Å; C130-I134 WeakPolarHBondContact O-CG1 3.45Å; C130-I134 PolarHBondContact O-N 2.92Å
131T91.5Very high86.5Confident82 Ų8295.7 Ų95.750%0.50352%0.522SS..Hα-helixtrans-62.2-41178.2510000112.2C127 A128 V129 H135C127-T131 WeakPolarHBondContact O-CG2 3.26Å; C127-T131 PolarHBondContact O-N 3.5Å; C127-T131 PolarHBondContact O-OG1 2.96Å; C127-T131 VanDerWaalsContact O-OG1 3.07Å; A128-T131 PolarHBondContact O-OG1 3.09Å; V129-T131 PolarHBondContact O-N 2.83Å; T131-H135 WeakPolarHBondContact O-CB 3.08Å; T131-H135 PolarHBondContact O-N 2.97Å
132I91.7Very high85.1Confident110 Ų110100.9 Ų100.956%0.56453%0.533SS*.Hα-helixtrans-63.1-46.4175.8-65.1165.7000111A128 V129 C130 H135 S136A128-I132 WeakPolarHBondContact O-CD1 3.5Å; A128-I132 VanDerWaalsContact O-CG1 3.32Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 2.93Å; V129-I132 PolarHBondContact O-N 2.91Å; C130-I132 PolarHBondContact O-N 2.96Å; I132-H135 PolarHBondContact O-N 3.42Å; I132-S136 VanDerWaalsContact O-CB 3.31Å; I132-S136 WeakPolarHBondContact O-CB 3.45Å; I132-S136 PolarHBondContact O-N 3.45Å; I132-S136 PolarHBondContact O-OG 3.16Å
133V90.7Very high83.3Confident89 Ų8999 Ų9954%0.53953%0.534SS..Hα-helixtrans-65.7-46.1-179.3174.10000111V129 C130 H135 S136 A137V129-V133 HydrophobicContact CG1-CG2 4.36Å; V129-V133 WeakPolarHBondContact O-CG2 3.4Å; V129-V133 PolarHBondContact O-N 3.48Å; C130-V133 PolarHBondContact O-N 3.33Å; V133-H135 VanDerWaalsContact C-N 3.34Å; V133-H135 PolarHBondContact O-N 3.27Å; V133-S136 PolarHBondContact O-N 3.27Å; V133-A137 WeakPolarHBondContact O-CB 3.3Å; V133-A137 PolarHBondContact O-N 3.11Å
134I88.4Confident81.6Confident113 Ų11397.7 Ų97.758%0.57954%0.54SS*.Hα-helixtrans-62.3-42.9177.4-68.7166000110.3C130 S136 A137 K138C130-I134 HydrophobicContact CB-CD1 4.49Å; C130-I134 WeakPolarHBondContact O-CB 3.38Å; C130-I134 WeakPolarHBondContact O-CD1 3.08Å; C130-I134 WeakPolarHBondContact O-CG1 3.45Å; C130-I134 PolarHBondContact O-N 2.92Å; I134-S136 VanDerWaalsContact C-N 3.32Å; I134-S136 PolarHBondContact O-N 2.88Å; I134-A137 PolarHBondContact O-N 3.5Å; I134-K138 VanDerWaalsContact O-CB 3.23Å; I134-K138 WeakPolarHBondContact O-CB 3.05Å; I134-K138 PolarHBondContact O-N 3.36Å
135H85.3Confident79.7Confident113 Ų113101.3 Ų101.352%0.52355%0.546SS..Hα-helixtrans-68.9-34.1-179.9-157.1-56000112T131 I132 V133 R139T131-H135 WeakPolarHBondContact O-CB 3.08Å; T131-H135 PolarHBondContact O-N 2.97Å; I132-H135 PolarHBondContact O-N 3.42Å; V133-H135 VanDerWaalsContact C-N 3.34Å; V133-H135 PolarHBondContact O-N 3.27Å; H135-R139 PolarHBondContact O-N 3.05Å
136S85.1Confident77.8Confident66 Ų66106.1 Ų106.146%0.46256%0.559SS.*Hα-helixtrans-69.8-45.6174.7-58.30000111.5I132 V133 I134 R139 T140I132-S136 VanDerWaalsContact O-CB 3.31Å; I132-S136 WeakPolarHBondContact O-CB 3.45Å; I132-S136 PolarHBondContact O-N 3.45Å; I132-S136 PolarHBondContact O-OG 3.16Å; V133-S136 PolarHBondContact O-N 3.27Å; I134-S136 VanDerWaalsContact C-N 3.32Å; I134-S136 PolarHBondContact O-N 2.88Å; S136-R139 PolarHBondContact O-N 3.28Å; S136-T140 PolarHBondContact O-N 3Å; S136-T140 PolarHBondContact O-OG1 3.41Å
137A82.9Confident75.9Confident37 Ų37107 Ų10731%0.30657%0.565SS.*Hα-helixtrans-63.7-42.8174.800000111.6V133 I134 R139 T140 W141V133-A137 WeakPolarHBondContact O-CB 3.3Å; V133-A137 PolarHBondContact O-N 3.11Å; I134-A137 PolarHBondContact O-N 3.5Å; A137-R139 PolarHBondContact O-N 3.21Å; A137-T140 WeakPolarHBondContact CA-OG1 3.24Å; A137-T140 PolarHBondContact O-N 3.46Å; A137-T140 PolarHBondContact O-OG1 3.28Å; A137-W141 WeakPolarHBondContact O-CB 3.5Å; A137-W141 PolarHBondContact O-N 3.18Å
138K80.6Confident74Confident144 Ų144113.4 Ų113.463%0.62658%0.581SS**Hα-helixtrans-58.5-38176.3-173174.8-179.91770111.3I134 F142I134-K138 VanDerWaalsContact O-CB 3.23Å; I134-K138 WeakPolarHBondContact O-CB 3.05Å; I134-K138 PolarHBondContact O-N 3.36Å; K138-F142 WeakPolarHBondContact O-CB 3.48Å; K138-F142 PolarHBondContact O-N 3.29Å
139R71.2Confident72Confident175 Ų175119.7 Ų119.766%0.6660%0.603SS**Hα-helixtrans-66.2-51.8173.4-76.7-168.9-179.9-179.83.4111.4H135 S136 A137 W141 F142 T143H135-R139 PolarHBondContact O-N 3.05Å; S136-R139 PolarHBondContact O-N 3.28Å; A137-R139 PolarHBondContact O-N 3.21Å; R139-W141 VanDerWaalsContact C-N 3.3Å; R139-W141 PolarHBondContact O-N 3.36Å; R139-F142 PolarHBondContact O-N 3.45Å; R139-F142 VanDerWaalsContact O-N 3.16Å; R139-T143 PolarHBondContact O-N 3.14Å; R139-T143 PolarHBondContact O-OG1 3.28Å
140T72.9Confident69.7Low89 Ų89121.5 Ų121.555%0.54662%0.615SS.*Hα-helixtrans-60.8-37.9-176.955.20000113S136 A137 A144S136-T140 PolarHBondContact O-N 3Å; S136-T140 PolarHBondContact O-OG1 3.41Å; A137-T140 WeakPolarHBondContact CA-OG1 3.24Å; A137-T140 PolarHBondContact O-N 3.46Å; A137-T140 PolarHBondContact O-OG1 3.28Å; T140-A144 WeakPolarHBondContact O-CB 3.33Å; T140-A144 PolarHBondContact O-N 3.03Å
141W60Low67.7Low181 Ų181127.4 Ų127.469%0.68664%0.641SS**Hα-helixtrans-74.7-29.5178.3-75.571.1000113.5A137 R139A137-W141 WeakPolarHBondContact O-CB 3.5Å; A137-W141 PolarHBondContact O-N 3.18Å; R139-W141 VanDerWaalsContact C-N 3.3Å; R139-W141 PolarHBondContact O-N 3.36Å
142F56.4Low65.6Low149 Ų149134.2 Ų134.265%0.65468%0.675SS**Hα-helixtrans-77.3-37.1176.1-129.7-90.6000111.9K138 R139 A144 R145K138-F142 WeakPolarHBondContact O-CB 3.48Å; K138-F142 PolarHBondContact O-N 3.29Å; R139-F142 PolarHBondContact O-N 3.45Å; R139-F142 VanDerWaalsContact O-N 3.16Å; F142-A144 VanDerWaalsContact C-N 3.34Å; F142-R145 PolarHBondContact O-N 3.37Å
143T53.4Low64.3Low104 Ų104135.4 Ų135.464%0.63868%0.68SS**Hα-helixtrans-70-31.9175.8-21.30000112.1R139 R145R139-T143 PolarHBondContact O-N 3.14Å; R139-T143 PolarHBondContact O-OG1 3.28Å; T143-R145 PolarHBondContact O-N 3.24Å
144A54.1Low63Low86 Ų86137.8 Ų137.871%0.71169%0.688SS**THydrogen-bonded Turntrans-69.8-12.7175.800000113.9T140 F142T140-A144 WeakPolarHBondContact O-CB 3.33Å; T140-A144 PolarHBondContact O-N 3.03Å; F142-A144 VanDerWaalsContact C-N 3.34Å
145R53.1Low61.5Low191 Ų191139.2 Ų139.272%0.72169%0.694SS**THydrogen-bonded Turntrans-102.38.7-179.2-79.1-167.4-177.1167.32.1115F142 T143 P147F142-R145 PolarHBondContact O-N 3.37Å; T143-R145 PolarHBondContact O-N 3.24Å; R145-P147 WeakPolarHBondContact O-CD 3.29Å
146Q50.4Low60.1Low157 Ų157140.8 Ų140.873%0.73470%0.704SS**  trans-96.287.6166.1-72.4-169.5-16.900109.3Y148Q146-Y148 PolarHBondContact O-N 3.47Å
147P54.5Low58.6Low83 Ų83145.4 Ų145.454%0.53972%0.719SS.*  trans-65.8117.2163.330.3-31.4000106.7R145 M149R145-P147 WeakPolarHBondContact O-CD 3.29Å; P147-M149 PolarHBondContact O-N 3.46Å
148Y53.1Low57Low212 Ų212152.7 Ų152.783%0.83175%0.746SS**  trans10.682.7144.14.6-88.6000113Q146 T150Q146-Y148 PolarHBondContact O-N 3.47Å; Y148-T150 VanDerWaalsContact C-N 3.28Å; Y148-T150 PolarHBondContact O-N 3.36Å
149M51.6Low55.3Low182 Ų182153.3 Ų153.390%0.89776%0.755SS**  trans-70.9102.1154.9-89-158.6161.200105.5P147 L151P147-M149 PolarHBondContact O-N 3.46Å; M149-L151 PolarHBondContact O-N 3.18Å
150T45.1Very low54Low129 Ų129151.6 Ų151.679%0.79176%0.762SS**  trans-31.3113.2165.345.90000111.8Y148 N152Y148-T150 VanDerWaalsContact C-N 3.28Å; Y148-T150 PolarHBondContact O-N 3.36Å; T150-N152 PolarHBondContact O-N 3.12Å
151L49.2Very low52.5Low183 Ų183156.8 Ų156.896%0.95878%0.78SS**  trans-72.6108154.8-133.188.2000106.3M149M149-L151 PolarHBondContact O-N 3.18Å
152N48.9Very low51.8Low225 Ų225154.6 Ų154.6100%1.20379%0.789SS**  trans-128.70160.2-171.468.8000107.8T150T150-N152 PolarHBondContact O-N 3.12Å

Retrieved 152 of 152 residues in 87.7 ms (Link to these results)