A0A087WTM5_HUMAN Loading...

Ring finger protein 34

AlphaFold DB , UniProt , Accession A0A087WTM5, Species HUMAN (Homo sapiens, Human), Gene RNF34, Length 180 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
1M40.3Very low42.5Very low244 Ų244149.4 Ų149.4100%1.20281%0.814SS**  093.40-72.8155.7170.700105.6
2K42.8Very low42.5Very low196 Ų196145.4 Ų145.485%0.85281%0.806SS**  73.4123.991.1-127.5-173.2178.1-161.40112.2
3G40.3Very low42.6Very low64 Ų64152.5 Ų152.566%0.6681%0.812SS**  trans141.778.3175.700000110.2
4E41.2Very low42.8Very low152 Ų152150.6 Ų150.671%0.7182%0.818SS**  64.999.775.4-59.8-179.2102.600111.2
5L41.8Very low42.3Very low142 Ų142145.3 Ų145.374%0.74381%0.811SS**  74120.3100.9-83.1161.7000114
6M54.6Low42.4Very low194 Ų194145 Ų14596%0.95681%0.814SS**  trans-167.9123.8130.8-100.4164.6-177.800111
7D37.1Very low42.6Very low157 Ų157143.6 Ų143.684%0.8481%0.813SS**  trans-62.9154.1176.8-62.5-94.7000114.5
8G40.2Very low42.4Very low79 Ų79140.3 Ų140.381%0.81481%0.806SS**  trans-161.786.6171.300000111.2
9D38.9Very low42.3Very low127 Ų127143.3 Ų143.368%0.67981%0.812SS**  trans-58.6140-179.8-164.9-86.5000113.7
10Q44.3Very low42.1Very low184 Ų184142.3 Ų142.386%0.8681%0.809SS**  trans-163.791.7141.9-103.2158.2109.800109
11T46.2Very low41.8Very low104 Ų104143.6 Ų143.664%0.63881%0.808SS**  trans0.6115.3146.747.80000116.2
12S42.6Very low41.9Very low102 Ų102136.4 Ų136.471%0.71378%0.782SS**  55.2129.273.8-63.10000112.5
13R43.6Very low41.6Very low237 Ų237135.5 Ų135.589%0.89478%0.781SS**  cis-175.5148.526.1-116162.5172.7-176.3-5.1108.6
14S44.7Very low41.8Very low127 Ų127139.7 Ų139.789%0.88879%0.787SS**  trans-57.3140.7159.3-49.70000111.3
15G35.8Very low41.6Very low70 Ų70139.1 Ų139.172%0.72279%0.793SS**  trans-141.9107.1176.400000111.6
16V44.8Very low41.8Very low141 Ų141137.9 Ų137.986%0.85580%0.797SS**  trans-63.8152.5155.4178.50000108.5
17P44.4Very low41.2Very low122 Ų122133.2 Ų133.279%0.79279%0.789SS**  trans-131138.7140.528.7-12000113.3
18A39Very low41.4Very low84 Ų84132.9 Ų132.969%0.69479%0.787SS**  trans-79.5157.215500000109.5
19Q40.4Very low42Very low197 Ų197134.7 Ų134.792%0.92178%0.782SS**  179.1124.1129.5-97.1168.1-21.900113.2
20V38.2Very low42.4Very low123 Ų123137.1 Ų137.175%0.74579%0.79SS**  trans-71.4153151.3-84.90000108.8
21Q37.4Very low42.6Very low169 Ų169134.5 Ų134.579%0.7978%0.782SS**  174.6130.367.5-127.1161.132.500107
22S42.2Very low42.8Very low94 Ų94136.7 Ų136.766%0.65779%0.79SS**  84.5135.710368.20000119.1
23E35.3Very low43.2Very low176 Ų176138.7 Ų138.782%0.82279%0.792SS**  trans123101.9143.2-60.2-167145.700119.6
24I45.8Very low43.6Very low153 Ų153134.6 Ų134.679%0.78579%0.788SS**  trans19132.9138.159.5134.9000122.9
25T35.8Very low43.9Very low139 Ų139136.1 Ų136.185%0.85379%0.786SS**  -155.7128.3123.652.70000110.8
26S46.8Very low44.6Very low117 Ų117139.1 Ų139.182%0.81879%0.786SS**  trans-69.9145.2172-50.70000112.3
27A40.8Very low45Very low95 Ų95139.9 Ų139.979%0.78579%0.785SS**  trans-145.1103.415200000108
28N41.6Very low45.2Very low150 Ų150141.8 Ų141.880%0.80278%0.784SS**  trans-75.3129156.7-64.5-28.6000106.4
29T52.6Low45.8Very low117 Ų117144.6 Ų144.672%0.71879%0.787SS**  trans-120.8108.8150.3470000106.1
30E47.7Very low46.1Very low178 Ų178141.3 Ų141.383%0.83278%0.775SS**  trans-66116.6155.6-64.7163.7161.700105.1
31D48.1Very low46.8Very low129 Ų129142 Ų14269%0.6978%0.775SS**  trans-126.796.6162.8-71.3-54.7000105.5
32D50.6Low47.2Very low151 Ų151140.5 Ų140.581%0.80777%0.772SS**  trans-61.4116.7155.5-70.8-60000107.2
33D51.2Low47.7Very low143 Ų143143.7 Ų143.777%0.76578%0.777SS**  trans-129.9103.6156.9-79.2-48000106.8D35D33-D35 PolarHBondContact O-N 3.29Å
34D53.2Low48.1Very low152 Ų152144.4 Ų144.481%0.81378%0.78SS**  trans-51.8112.2158.1-72.8-62.6000108.3
35D49.9Very low48Very low158 Ų158145 Ų14585%0.84578%0.78SS**  trans-103.4100.8160.4-92.2-38.7000107.2D33 D37D33-D35 PolarHBondContact O-N 3.29Å; D35-D37 PolarHBondContact O-N 3.37Å
36D51.3Low48Very low133 Ų133146 Ų14671%0.71178%0.78SS**  trans-43.6121.7171.7-76.9-59.4000111.3E38D36-E38 HydrophobicContact CB-CG 4.25Å; D36-E38 PolarHBondContact O-N 2.93Å
37D53.1Low47.9Very low157 Ų157144.1 Ų144.184%0.8477%0.771SS**  trans-65.178.6157.1-78.4-51.5000107.8D35 D39D35-D37 PolarHBondContact O-N 3.37Å; D37-D39 PolarHBondContact O-N 2.84Å
38E48.7Very low48.1Very low163 Ų163148.9 Ų148.976%0.76278%0.777SS**  trans-71.980.3161.6-73.2-171.8165.100107.8D36 D40D36-E38 HydrophobicContact CB-CG 4.25Å; D36-E38 PolarHBondContact O-N 2.93Å; E38-D40 PolarHBondContact O-N 2.87Å
39D50.7Low47.9Very low142 Ų142149.5 Ų149.576%0.75978%0.781SS**  trans-60.483.3154.5-83.7-39.7000107.3D37 D41D37-D39 PolarHBondContact O-N 2.84Å; D39-D41 PolarHBondContact O-N 2.85Å
40D48.2Very low47.5Very low128 Ų128155.4 Ų155.468%0.68479%0.79SS**  trans-74.773.9170.4-139-5.2000107.8E38 D42E38-D40 PolarHBondContact O-N 2.87Å; D40-D42 PolarHBondContact O-N 2.94Å
41D51.6Low47.3Very low139 Ų139154.4 Ų154.474%0.74379%0.79SS**  trans-66.579.4161.2-93.4-38.6000107.7D39 E43D39-D41 PolarHBondContact O-N 2.85Å; D41-E43 PolarHBondContact O-N 3Å
42D45.8Very low47.4Very low136 Ų136153.6 Ų153.673%0.72779%0.792SS**  trans-67.980.2161.4-92.6-39.8000108.5D40 E44D40-D42 PolarHBondContact O-N 2.94Å; D42-E44 PolarHBondContact O-N 2.83Å
43E52.8Low47.2Very low162 Ų162149.9 Ų149.976%0.75779%0.789SS**  trans-66.981.5159.9-76.2-168.5137.700109.2D41 E45D41-E43 PolarHBondContact O-N 3Å; E43-E45 PolarHBondContact O-N 3.33Å
44E45Very low46.8Very low190 Ų190150.6 Ų150.689%0.88879%0.792SS**  trans-83.295.8152.4-82.9-145160.400109.5D42 N46D42-E44 PolarHBondContact O-N 2.83Å; E44-N46 PolarHBondContact O-N 3.3Å
45E42.8Very low46.5Very low167 Ų167149.1 Ų149.178%0.7879%0.794SS**  trans-56117.5169.9-59.9-168.6168.700111.4E43E43-E45 PolarHBondContact O-N 3.33Å
46N35.8Very low46.5Very low160 Ų160150 Ų15086%0.85679%0.79SS**  trans-117.289148-149.1-44.4000107.7E44 E48E44-N46 PolarHBondContact O-N 3.3Å; N46-E48 PolarHBondContact O-N 3.03Å
47A45.1Very low46.5Very low77 Ų77152.5 Ų152.564%0.63680%0.798SS**  trans-70.211517600000109.8
48E45.1Very low47Very low194 Ų194154.1 Ų154.191%0.90779%0.792SS**  trans-179.885.4141.3-99170.4179.700110.8N46N46-E48 PolarHBondContact O-N 3.03Å
49D37Very low48.5Very low163 Ų163152.6 Ų152.687%0.87279%0.794SS**  175125.8121.6-160.9-100.6000110
50R43.5Very low50.1Low242 Ų242152.4 Ų152.491%0.91378%0.782SS**  trans-82.7122.1-176.6-74.9161.673.9-146.17.8110.4
51N43.2Very low52Low156 Ų156146.7 Ų146.783%0.83475%0.753SS**  trans-151.2137.4147.8-151.121.7000112.2
52P50.2Low53.8Low112 Ų112141.2 Ų141.273%0.72773%0.725SS**  trans-94.1147.4-16735.4-26.2000113
53G46.2Very low55.8Low73 Ų73135.3 Ų135.375%0.75369%0.694SS**  trans73.483.7146.800000117.7
54L42.8Very low57.4Low158 Ų158132.7 Ų132.783%0.82769%0.693SS**  trans-156.2114.7141.5-83-179.7000106.3K56L54-K56 PolarHBondContact O-N 3.37Å
55S47.1Very low59.3Low122 Ų122128.2 Ų128.285%0.85368%0.675SS**  trans-65.178.8166.250.40000108.5E57S55-E57 VanDerWaalsContact C-N 3.35Å; S55-E57 PolarHBondContact O-N 2.74Å
56K50.1Low61.2Low177 Ų177120.9 Ų120.977%0.7764%0.641SS**  trans-63.9103.1161.9-83.2178.2175.8173.20105.1L54 R58L54-K56 PolarHBondContact O-N 3.37Å; K56-R58 VanDerWaalsContact C-N 3.34Å; K56-R58 PolarHBondContact O-N 3.05Å
57E52Low63.2Low184 Ų184118 Ų11886%0.8663%0.634SS**  trans-46.1105.6162.1-88.9163.574.800107S55 V59S55-E57 VanDerWaalsContact C-N 3.35Å; S55-E57 PolarHBondContact O-N 2.74Å; E57-V59 VanDerWaalsContact C-N 3.34Å; E57-V59 PolarHBondContact O-N 2.92Å
58R64.4Low65.1Low191 Ų191116.4 Ų116.472%0.72162%0.618SS**  trans-68.3101.3177.1-72.8-167.8-176.6-164.14.2105.7K56 R60K56-R58 VanDerWaalsContact C-N 3.34Å; K56-R58 PolarHBondContact O-N 3.05Å; R58-R60 PolarHBondContact O-N 3.3Å
59V79.3Confident66.8Low132 Ų132111.5 Ų111.580%0.860%0.598SS**  trans-57.5108.8169.8-177.90000106.1E57E57-V59 VanDerWaalsContact C-N 3.34Å; E57-V59 PolarHBondContact O-N 2.92Å
60R84.2Confident69.1Low138 Ų138109.6 Ų109.652%0.52159%0.588SS.*  trans-62.2152.6-179.5-21.9161.756.2113.1-7.4108.6R58 E82 R86R58-R60 PolarHBondContact O-N 3.3Å; R60-E82 WeakPolarHBondContact CA-OE2 3.32Å; R60-E82 HydrophobicContact CB-CG 4.41Å; R60-E82 WeakPolarHBondContact CB-OE2 3.44Å; R60-R86 VanDerWaalsContact CB-CZ 3.43Å; R60-R86 VanDerWaalsContact O-CZ 3.28Å; R60-R86 PolarHBondContact O-NH1 3.32Å; R60-R86 PolarHBondContact O-NH2 3.49Å
61A87.1Confident71Confident8 Ų8101.3 Ų101.37%0.06656%0.561CS.*  trans-70138.1-17700000112.8M75 Q79 E82 I83 R86A61-M75 HydrophobicContact CB-CE 4.03Å; A61-Q79 HydrophobicContact CB-CB 3.86Å; A61-Q79 HydrophobicContact CB-CG 4.06Å; A61-E82 HydrophobicContact CB-CB 4.35Å; A61-E82 PolarHBondContact N-OE2 3.23Å; A61-I83 HydrophobicContact CB-CD1 4.32Å; A61-I83 HydrophobicContact CB-CG1 3.95Å; A61-R86 VanDerWaalsContact O-CD 3.3Å; A61-R86 WeakPolarHBondContact O-CD 3.22Å; A61-R86 PolarHBondContact O-NH1 3.04Å
62S90.5Very high73.1Confident23 Ų2393.9 Ų93.916%0.16152%0.522CS..  trans-125.9160.9-178.670.50000112.2S64 D65S62-S64 PolarHBondContact O-N 3.03Å; S62-S64 PolarHBondContact OG-OG 2.83Å; S62-D65 WeakPolarHBondContact CA-OD2 3.38Å; S62-D65 WeakPolarHBondContact CB-OD2 3.38Å; S62-D65 PolarHBondContact N-OD2 3.12Å; S62-D65 WeakPolarHBondContact O-CB 3.31Å; S62-D65 PolarHBondContact O-N 3.23Å; S62-D65 VanDerWaalsContact O-N 3.16Å; S62-D65 PolarHBondContact OG-OD1 2.91Å; S62-D65 PolarHBondContact OG-OD2 2.88Å
63L87.9Confident74.9Confident13 Ų1394.3 Ų94.37%0.06851%0.514CS..G310 helixtrans-62-29.5173.7-79.1178.8000112.8D65 L66 I83 N87 L107 N111L63-D65 PolarHBondContact O-N 2.83Å; L63-L66 HydrophobicContact CD2-CD1 3.99Å; L63-L66 PolarHBondContact O-N 3.37Å; L63-I83 HydrophobicContact CD2-CG2 3.44Å; L63-I83 VanDerWaalsContact CD2-CG2 3.44Å; L63-I83 HydrophobicContact CG-CG2 3.83Å; L63-N87 VanDerWaalsContact CD1-CG 3.49Å; L63-N87 WeakPolarHBondContact CD1-ND2 3.34Å; L63-N87 WeakPolarHBondContact CD1-OD1 3.43Å; L63-N87 WeakPolarHBondContact CG-ND2 3.32Å; L63-L107 HydrophobicContact CD1-CD1 4.12Å; L63-L107 HydrophobicContact CD1-CD2 3.87Å; L63-L107 HydrophobicContact CD1-CG 3.71Å; L63-L107 HydrophobicContact CD2-CD2 3.86Å; L63-L107 HydrophobicContact CD2-CG 3.97Å; L63-L107 HydrophobicContact CG-CD2 4.16Å; L63-L107 HydrophobicContact CG-CG 4.37Å; L63-N111 HydrophobicContact CD1-CB 4.37Å
64S85.9Confident76.8Confident107 Ų10794 Ų9475%0.74851%0.511SS*.G310 helixtrans-69.1-14.1177.537.20000113.9S62 L66S62-S64 PolarHBondContact O-N 3.03Å; S62-S64 PolarHBondContact OG-OG 2.83Å; S64-L66 VanDerWaalsContact C-N 3.27Å
65D84.5Confident79Confident95 Ų9587.2 Ų87.251%0.50848%0.475SS..G310 helixtrans-82.6-7176.7-56.8-47.1000112.4S62 L63S62-D65 WeakPolarHBondContact CA-OD2 3.38Å; S62-D65 WeakPolarHBondContact CB-OD2 3.38Å; S62-D65 PolarHBondContact N-OD2 3.12Å; S62-D65 WeakPolarHBondContact O-CB 3.31Å; S62-D65 PolarHBondContact O-N 3.23Å; S62-D65 VanDerWaalsContact O-N 3.16Å; S62-D65 PolarHBondContact OG-OD1 2.91Å; S62-D65 PolarHBondContact OG-OD2 2.88Å; L63-D65 PolarHBondContact O-N 2.83Å
66L82.5Confident81.2Confident13 Ų1384 Ų847%0.06845%0.452CS..  trans-95.1129.9-178.3-56.5176.3000110.3L63 S64 D71 V72 M75 I83 V104 Y108L63-L66 HydrophobicContact CD2-CD1 3.99Å; L63-L66 PolarHBondContact O-N 3.37Å; S64-L66 VanDerWaalsContact C-N 3.27Å; L66-D71 HydrophobicContact CD2-CB 4.1Å; L66-V72 HydrophobicContact CD1-CG2 3.91Å; L66-V72 HydrophobicContact CD2-CG2 4.17Å; L66-M75 HydrophobicContact CD2-CE 4.12Å; L66-M75 HydrophobicContact CD2-SD 3.79Å; L66-I83 HydrophobicContact CD1-CD1 3.98Å; L66-I83 HydrophobicContact CD2-CD1 4.29Å; L66-I83 HydrophobicContact CG-CD1 4.23Å; L66-V104 HydrophobicContact CD1-CG1 3.95Å; L66-Y108 HydrophobicContact CB-CD2 3.77Å; L66-Y108 HydrophobicContact CB-CE2 3.71Å; L66-Y108 HydrophobicContact CD1-CD2 3.94Å
67S79.2Confident83.3Confident101 Ų10178.4 Ų78.471%0.70643%0.433SS*.  trans-114.4-13.5176.2-610000112.9D71S67-D71 PolarHBondContact N-OD2 2.88Å
68S84.2Confident85.3Confident43 Ų4376.4 Ų76.430%0.30142%0.417SS..SBendtrans-158.9165.6-177.167.10000112D70 D71S68-D70 VanDerWaalsContact C-N 3.29Å; S68-D70 PolarHBondContact O-N 2.93Å; S68-D71 PolarHBondContact N-OD2 3.14Å; S68-D71 WeakPolarHBondContact O-CB 3.37Å; S68-D71 PolarHBondContact O-N 2.69Å; S68-D71 VanDerWaalsContact OG-CG 3.23Å; S68-D71 PolarHBondContact OG-N 3.06Å; S68-D71 PolarHBondContact OG-OD2 3.38Å
69L82.2Confident86.6Confident91 Ų9171 Ų7148%0.47640%0.4SS..Hα-helixtrans-67.1-30.1175.2-60.5177.6000112.4D71 V72 E73 N105 Y108L69-D71 VanDerWaalsContact C-N 3.25Å; L69-D71 PolarHBondContact O-N 3.18Å; L69-V72 WeakPolarHBondContact O-CB 3.48Å; L69-V72 PolarHBondContact O-N 3.26Å; L69-V72 VanDerWaalsContact O-N 3.14Å; L69-E73 PolarHBondContact O-N 3.24Å; L69-N105 HydrophobicContact CD2-CB 4.35Å; L69-N105 WeakPolarHBondContact CD2-OD1 3.26Å; L69-Y108 HydrophobicContact CD2-CD1 4.13Å
70D84.1Confident87.4Confident123 Ų12364.7 Ų64.766%0.65836%0.362SS*.Hα-helixtrans-62.1-32.5174.5-76.3-98.1000112.3S68 V72 E73 G74S68-D70 VanDerWaalsContact C-N 3.29Å; S68-D70 PolarHBondContact O-N 2.93Å; D70-V72 PolarHBondContact O-N 3.22Å; D70-E73 PolarHBondContact O-N 3.47Å; D70-G74 PolarHBondContact O-N 3.41Å
71D84.2Confident87.9Confident68 Ų6862.2 Ų62.236%0.36436%0.355SS..Hα-helixtrans-63.6-34.9176.4-60.7-45.8000111.3L66 S67 S68 L69 G74 M75L66-D71 HydrophobicContact CD2-CB 4.1Å; S67-D71 PolarHBondContact N-OD2 2.88Å; S68-D71 PolarHBondContact N-OD2 3.14Å; S68-D71 WeakPolarHBondContact O-CB 3.37Å; S68-D71 PolarHBondContact O-N 2.69Å; S68-D71 VanDerWaalsContact OG-CG 3.23Å; S68-D71 PolarHBondContact OG-N 3.06Å; S68-D71 PolarHBondContact OG-OD2 3.38Å; L69-D71 VanDerWaalsContact C-N 3.25Å; L69-D71 PolarHBondContact O-N 3.18Å; D71-G74 PolarHBondContact O-N 3.06Å; D71-M75 WeakPolarHBondContact O-CG 3.49Å; D71-M75 PolarHBondContact O-N 3.15Å
72V86.2Confident88.3Confident0 Ų062.9 Ų62.90%036%0.357CS..Hα-helixtrans-68.3-41179.3-173.50000110.9L66 L69 D70 G74 M75 L80 V101 V104 N105L66-V72 HydrophobicContact CD1-CG2 3.91Å; L66-V72 HydrophobicContact CD2-CG2 4.17Å; L69-V72 WeakPolarHBondContact O-CB 3.48Å; L69-V72 PolarHBondContact O-N 3.26Å; L69-V72 VanDerWaalsContact O-N 3.14Å; D70-V72 PolarHBondContact O-N 3.22Å; V72-G74 VanDerWaalsContact C-N 3.3Å; V72-G74 PolarHBondContact O-N 2.84Å; V72-M75 PolarHBondContact O-N 3.23Å; V72-L80 HydrophobicContact CG1-CD2 3.82Å; V72-V101 HydrophobicContact CG1-CB 4.45Å; V72-V101 HydrophobicContact CG1-CG1 4.06Å; V72-V104 HydrophobicContact CG1-CB 3.79Å; V72-V104 HydrophobicContact CG1-CG1 3.58Å; V72-V104 HydrophobicContact CG2-CG1 4.12Å; V72-N105 WeakPolarHBondContact CB-OD1 3.31Å; V72-N105 WeakPolarHBondContact CG1-OD1 3.37Å; V72-N105 WeakPolarHBondContact CG2-OD1 3.24Å
73E87.9Confident88.4Confident121 Ų12161.8 Ų61.857%0.56535%0.349SS*.Hα-helixtrans-65.4-35.1177.5-65.7-172.6-174.300112.1L69 D70 M75 K97 V101L69-E73 PolarHBondContact O-N 3.24Å; D70-E73 PolarHBondContact O-N 3.47Å; E73-M75 VanDerWaalsContact C-N 3.3Å; E73-M75 PolarHBondContact O-N 2.75Å; E73-K97 WeakPolarHBondContact O-CE 3.47Å; E73-K97 PolarHBondContact O-NZ 2.78Å; E73-V101 HydrophobicContact CG-CG1 4.28Å
74G87.3Confident88.8Confident66 Ų6661.2 Ų61.268%0.6835%0.346SS*.Hα-helixtrans-73-13.8177.600000115.2D70 D71 V72D70-G74 PolarHBondContact O-N 3.41Å; D71-G74 PolarHBondContact O-N 3.06Å; V72-G74 VanDerWaalsContact C-N 3.3Å; V72-G74 PolarHBondContact O-N 2.84Å
75M88.2Confident89.2Confident16 Ų1658 Ų588%0.07933%0.326CS..SBendtrans-70.2151.3-176.4-57.4-164.297.300113.3A61 L66 D71 V72 E73 Q79 L80 I83 K97A61-M75 HydrophobicContact CB-CE 4.03Å; L66-M75 HydrophobicContact CD2-CE 4.12Å; L66-M75 HydrophobicContact CD2-SD 3.79Å; D71-M75 WeakPolarHBondContact O-CG 3.49Å; D71-M75 PolarHBondContact O-N 3.15Å; V72-M75 PolarHBondContact O-N 3.23Å; E73-M75 VanDerWaalsContact C-N 3.3Å; E73-M75 PolarHBondContact O-N 2.75Å; M75-Q79 HydrophobicContact CB-CB 4.25Å; M75-Q79 HydrophobicContact CE-CB 3.6Å; M75-Q79 HydrophobicContact CE-CG 4.41Å; M75-Q79 HydrophobicContact SD-CB 4.42Å; M75-L80 HydrophobicContact CB-CD2 3.92Å; M75-L80 HydrophobicContact CB-CG 3.89Å; M75-L80 HydrophobicContact CG-CD2 4.29Å; M75-L80 HydrophobicContact SD-CD2 3.89Å; M75-I83 HydrophobicContact CE-CD1 3.48Å; M75-I83 VanDerWaalsContact CE-CD1 3.48Å; M75-I83 HydrophobicContact CE-CG1 4.47Å; M75-I83 HydrophobicContact SD-CD1 3.6Å; M75-K97 VanDerWaalsContact O-CE 3.23Å; M75-K97 WeakPolarHBondContact O-CE 3.5Å; M75-K97 PolarHBondContact O-NZ 3.43Å
76S93.2Very high89.7Confident53 Ų5358.1 Ų58.137%0.37132%0.32SS..  trans-72.5156.1164.966.10000111.4R78 Q79 L80S76-R78 PolarHBondContact O-N 3.35Å; S76-Q79 PolarHBondContact O-N 2.99Å; S76-Q79 VanDerWaalsContact OG-CG 3.26Å; S76-Q79 WeakPolarHBondContact OG-CG 3.4Å; S76-Q79 PolarHBondContact OG-N 3.34Å; S76-Q79 PolarHBondContact OG-OE1 3.48Å; S76-L80 PolarHBondContact O-N 3.01Å
77V94.4Very high90.2Very high61 Ų6160.3 Ų60.337%0.3733%0.331SS..Hα-helixtrans-54.4-39.3175.6171.60000111.6L80 K81 K97 L100V77-L80 PolarHBondContact O-N 3.5Å; V77-K81 HydrophobicContact CG1-CD 4.18Å; V77-K81 HydrophobicContact CG1-CG 4.49Å; V77-K81 WeakPolarHBondContact O-CG 3.47Å; V77-K81 PolarHBondContact O-N 3.31Å; V77-K97 HydrophobicContact CG2-CB 4.18Å; V77-K97 HydrophobicContact CG2-CD 4.47Å; V77-K97 HydrophobicContact CG2-CG 4.26Å; V77-L100 HydrophobicContact CG1-CD1 3.73Å
78R93.4Very high91Very high141 Ų14164.9 Ų64.953%0.53234%0.339SS..Hα-helixtrans-60.7-46.2176.6-179.8178.3166160.35.5111.9S76 K81 E82S76-R78 PolarHBondContact O-N 3.35Å; R78-K81 PolarHBondContact O-N 2.88Å; R78-E82 IonicContact CZ-OE1 3.03Å; R78-E82 IonicContact NE-OE1 3.91Å; R78-E82 PolarHBondContact NE-OE1 3.4Å; R78-E82 IonicContact NH2-OE1 3.93Å; R78-E82 WeakPolarHBondContact O-CB 3.43Å; R78-E82 VanDerWaalsContact O-CG 3.32Å; R78-E82 WeakPolarHBondContact O-CG 3.32Å; R78-E82 PolarHBondContact O-N 3.37Å
79Q93.4Very high91.5Very high78 Ų7864.3 Ų64.336%0.36433%0.333SS..Hα-helixtrans-67-38.9179.4-69165.8-59.300112.1A61 M75 S76 E82 I83A61-Q79 HydrophobicContact CB-CB 3.86Å; A61-Q79 HydrophobicContact CB-CG 4.06Å; M75-Q79 HydrophobicContact CB-CB 4.25Å; M75-Q79 HydrophobicContact CE-CB 3.6Å; M75-Q79 HydrophobicContact CE-CG 4.41Å; M75-Q79 HydrophobicContact SD-CB 4.42Å; S76-Q79 PolarHBondContact O-N 2.99Å; S76-Q79 VanDerWaalsContact OG-CG 3.26Å; S76-Q79 WeakPolarHBondContact OG-CG 3.4Å; S76-Q79 PolarHBondContact OG-N 3.34Å; S76-Q79 PolarHBondContact OG-OE1 3.48Å; Q79-E82 PolarHBondContact O-N 2.98Å; Q79-I83 WeakPolarHBondContact O-CG1 3.3Å; Q79-I83 PolarHBondContact O-N 2.71Å
80L94.8Very high92.1Very high0 Ų065 Ų650%034%0.338CS..Hα-helixtrans-60.7-46.9174.1-66168.4000111.2V72 M75 S76 V77 E82 I83 L84 K97 L100 V101 V104V72-L80 HydrophobicContact CG1-CD2 3.82Å; M75-L80 HydrophobicContact CB-CD2 3.92Å; M75-L80 HydrophobicContact CB-CG 3.89Å; M75-L80 HydrophobicContact CG-CD2 4.29Å; M75-L80 HydrophobicContact SD-CD2 3.89Å; S76-L80 PolarHBondContact O-N 3.01Å; V77-L80 PolarHBondContact O-N 3.5Å; L80-E82 PolarHBondContact O-N 3.04Å; L80-I83 PolarHBondContact O-N 2.64Å; L80-L84 VanDerWaalsContact O-CG 3.32Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 2.97Å; L80-K97 HydrophobicContact CD1-CG 4.04Å; L80-L100 HydrophobicContact CB-CB 4.02Å; L80-L100 HydrophobicContact CB-CD1 4.48Å; L80-L100 HydrophobicContact CD1-CB 3.9Å; L80-V101 HydrophobicContact CD1-CG2 3.71Å; L80-V101 HydrophobicContact CD2-CG2 4.31Å; L80-V104 HydrophobicContact CB-CG2 4.32Å; L80-V104 HydrophobicContact CD2-CB 4.06Å; L80-V104 HydrophobicContact CD2-CG1 4.31Å; L80-V104 HydrophobicContact CD2-CG2 3.77Å
81K94.3Very high92.6Very high85 Ų8562.9 Ų62.937%0.3732%0.321SS..Hα-helixtrans-62.3-41.1175.4-71.9179.8178.2-177.20112V77 R78 I83 L84 A85 Y91 L100V77-K81 HydrophobicContact CG1-CD 4.18Å; V77-K81 HydrophobicContact CG1-CG 4.49Å; V77-K81 WeakPolarHBondContact O-CG 3.47Å; V77-K81 PolarHBondContact O-N 3.31Å; R78-K81 PolarHBondContact O-N 2.88Å; K81-I83 PolarHBondContact O-N 2.88Å; K81-L84 PolarHBondContact O-N 3.35Å; K81-A85 VanDerWaalsContact O-CB 3.24Å; K81-A85 WeakPolarHBondContact O-CB 3.26Å; K81-A85 PolarHBondContact O-N 3.06Å; K81-Y91 HydrophobicContact CB-CE1 4.43Å; K81-Y91 HydrophobicContact CB-CE2 4.24Å; K81-Y91 HydrophobicContact CD-CD2 4.38Å; K81-Y91 HydrophobicContact CD-CE2 3.94Å; K81-Y91 HydrophobicContact CG-CD2 4.03Å; K81-Y91 HydrophobicContact CG-CE2 3.85Å; K81-L100 HydrophobicContact CG-CD1 4.15Å; K81-L100 HydrophobicContact CG-CD2 4.35Å
82E95.2Very high93.1Very high23 Ų2363.7 Ų63.711%0.10733%0.332CS..Hα-helixtrans-60.5-43.4176.4-78.3173.6-171.400112.2R60 A61 R78 Q79 L80 R86R60-E82 WeakPolarHBondContact CA-OE2 3.32Å; R60-E82 HydrophobicContact CB-CG 4.41Å; R60-E82 WeakPolarHBondContact CB-OE2 3.44Å; A61-E82 HydrophobicContact CB-CB 4.35Å; A61-E82 PolarHBondContact N-OE2 3.23Å; R78-E82 IonicContact CZ-OE1 3.03Å; R78-E82 IonicContact NE-OE1 3.91Å; R78-E82 PolarHBondContact NE-OE1 3.4Å; R78-E82 IonicContact NH2-OE1 3.93Å; R78-E82 WeakPolarHBondContact O-CB 3.43Å; R78-E82 VanDerWaalsContact O-CG 3.32Å; R78-E82 WeakPolarHBondContact O-CG 3.32Å; R78-E82 PolarHBondContact O-N 3.37Å; Q79-E82 PolarHBondContact O-N 2.98Å; L80-E82 PolarHBondContact O-N 3.04Å; E82-R86 WeakPolarHBondContact O-CB 3.43Å; E82-R86 VanDerWaalsContact O-CG 3.32Å; E82-R86 WeakPolarHBondContact O-CG 3.48Å; E82-R86 PolarHBondContact O-N 2.78Å
83I94.6Very high93.4Very high0 Ų066.9 Ų66.90%037%0.365CS..Hα-helixtrans-63.3-48.6175.7-72.3-178.9000110.8A61 L63 L66 M75 Q79 L80 K81 R86 N87 V104 L107A61-I83 HydrophobicContact CB-CD1 4.32Å; A61-I83 HydrophobicContact CB-CG1 3.95Å; L63-I83 HydrophobicContact CD2-CG2 3.44Å; L63-I83 VanDerWaalsContact CD2-CG2 3.44Å; L63-I83 HydrophobicContact CG-CG2 3.83Å; L66-I83 HydrophobicContact CD1-CD1 3.98Å; L66-I83 HydrophobicContact CD2-CD1 4.29Å; L66-I83 HydrophobicContact CG-CD1 4.23Å; M75-I83 HydrophobicContact CE-CD1 3.48Å; M75-I83 VanDerWaalsContact CE-CD1 3.48Å; M75-I83 HydrophobicContact CE-CG1 4.47Å; M75-I83 HydrophobicContact SD-CD1 3.6Å; Q79-I83 WeakPolarHBondContact O-CG1 3.3Å; Q79-I83 PolarHBondContact O-N 2.71Å; L80-I83 PolarHBondContact O-N 2.64Å; K81-I83 PolarHBondContact O-N 2.88Å; I83-R86 PolarHBondContact O-N 3.33Å; I83-N87 PolarHBondContact O-N 3.49Å; I83-N87 PolarHBondContact O-ND2 3.34Å; I83-V104 HydrophobicContact CG2-CG1 4.14Å; I83-V104 HydrophobicContact CG2-CG2 4.25Å; I83-L107 HydrophobicContact CG2-CD2 4.17Å
84L95.2Very high93.7Very high0 Ų062.4 Ų62.40%035%0.346CS..Hα-helixtrans-63.3-44.1-179.5-66.4172.2000111.6L80 K81 R86 N87 F88 V89 Y91 L100 K103 V104 L107L80-L84 VanDerWaalsContact O-CG 3.32Å; L80-L84 WeakPolarHBondContact O-CG 3.41Å; L80-L84 PolarHBondContact O-N 2.97Å; K81-L84 PolarHBondContact O-N 3.35Å; L84-R86 PolarHBondContact O-N 2.89Å; L84-N87 CarbonylContact O-C 3.5Å; L84-N87 PolarHBondContact O-N 2.82Å; L84-F88 PolarHBondContact O-N 3.31Å; L84-V89 HydrophobicContact CB-CB 4.26Å; L84-V89 HydrophobicContact CD2-CB 3.89Å; L84-V89 HydrophobicContact CD2-CG1 3.79Å; L84-V89 PolarHBondContact O-N 2.95Å; L84-Y91 HydrophobicContact CB-CD1 3.67Å; L84-Y91 HydrophobicContact CB-CE1 4.31Å; L84-Y91 HydrophobicContact CD1-CD1 4.29Å; L84-Y91 HydrophobicContact CD1-CG 4.34Å; L84-L100 HydrophobicContact CD1-CD2 3.74Å; L84-K103 HydrophobicContact CD1-CB 4.12Å; L84-K103 HydrophobicContact CD1-CD 4.48Å; L84-K103 HydrophobicContact CD2-CB 3.88Å; L84-V104 HydrophobicContact CD1-CG2 4.03Å; L84-V104 HydrophobicContact CD2-CG2 3.65Å; L84-V104 HydrophobicContact CG-CG2 3.61Å; L84-L107 HydrophobicContact CD2-CD2 4.13Å
85A94.8Very high94Very high40 Ų4064.9 Ų64.933%0.33135%0.352SS..Hα-helixtrans-59.8-45.7177.500000112.2K81 N87 F88 Y91K81-A85 VanDerWaalsContact O-CB 3.24Å; K81-A85 WeakPolarHBondContact O-CB 3.26Å; K81-A85 PolarHBondContact O-N 3.06Å; A85-N87 PolarHBondContact O-N 3.21Å; A85-F88 PolarHBondContact O-N 2.79Å; A85-Y91 HydrophobicContact CB-CE1 4.06Å
86R93.9Very high94.4Very high98 Ų9869.3 Ų69.337%0.3737%0.372SS..Hα-helixtrans-64.1-25.7179.3-80.7173.3159.2-173-4.8113.9R60 A61 E82 I83 L84R60-R86 VanDerWaalsContact CB-CZ 3.43Å; R60-R86 VanDerWaalsContact O-CZ 3.28Å; R60-R86 PolarHBondContact O-NH1 3.32Å; R60-R86 PolarHBondContact O-NH2 3.49Å; A61-R86 VanDerWaalsContact O-CD 3.3Å; A61-R86 WeakPolarHBondContact O-CD 3.22Å; A61-R86 PolarHBondContact O-NH1 3.04Å; E82-R86 WeakPolarHBondContact O-CB 3.43Å; E82-R86 VanDerWaalsContact O-CG 3.32Å; E82-R86 WeakPolarHBondContact O-CG 3.48Å; E82-R86 PolarHBondContact O-N 2.78Å; I83-R86 PolarHBondContact O-N 3.33Å; L84-R86 PolarHBondContact O-N 2.89Å
87N94Very high94.5Very high59 Ų5970.9 Ų70.932%0.31637%0.373SS..THydrogen-bonded Turntrans-100.413.9177.7-68.1-83.8000112.4L63 I83 L84 A85 V89 L107L63-N87 VanDerWaalsContact CD1-CG 3.49Å; L63-N87 WeakPolarHBondContact CD1-ND2 3.34Å; L63-N87 WeakPolarHBondContact CD1-OD1 3.43Å; L63-N87 WeakPolarHBondContact CG-ND2 3.32Å; I83-N87 PolarHBondContact O-N 3.49Å; I83-N87 PolarHBondContact O-ND2 3.34Å; L84-N87 CarbonylContact O-C 3.5Å; L84-N87 PolarHBondContact O-N 2.82Å; A85-N87 PolarHBondContact O-N 3.21Å; N87-V89 HydrophobicContact CB-CG2 4.19Å; N87-V89 PolarHBondContact O-N 2.8Å; N87-V89 VanDerWaalsContact O-N 3.12Å; N87-L107 HydrophobicContact CB-CD1 4.12Å; N87-L107 HydrophobicContact CB-CD2 3.66Å; N87-L107 HydrophobicContact CB-CG 4.49Å
88F95.2Very high94.5Very high197 Ų19774.5 Ų74.586%0.86438%0.38SS*.THydrogen-bonded Turntrans54.830.7179.3-54.8-84.3000113.3L84 A85L84-F88 PolarHBondContact O-N 3.31Å; A85-F88 PolarHBondContact O-N 2.79Å
89V95.8Very high94.7Very high30 Ų3070 Ų7018%0.18237%0.365CS..  trans-92.1118.5176.7-179.10000109L84 N87 Y91 L107L84-V89 HydrophobicContact CB-CB 4.26Å; L84-V89 HydrophobicContact CD2-CB 3.89Å; L84-V89 HydrophobicContact CD2-CG1 3.79Å; L84-V89 PolarHBondContact O-N 2.95Å; N87-V89 HydrophobicContact CB-CG2 4.19Å; N87-V89 PolarHBondContact O-N 2.8Å; N87-V89 VanDerWaalsContact O-N 3.12Å; V89-Y91 WeakPolarHBondContact O-CD1 3.46Å; V89-Y91 PolarHBondContact O-N 3.48Å; V89-L107 HydrophobicContact CG2-CD1 4.01Å; V89-L107 HydrophobicContact CG2-CD2 4.02Å
90N95Very high94.8Very high107 Ų10766.5 Ų66.557%0.57235%0.349SS*.  trans-66129.2176.8-17323.8000111.6S92 K103N90-S92 PolarHBondContact ND2-OG 2.81Å; N90-S92 VanDerWaalsContact OD1-CB 3.31Å; N90-S92 WeakPolarHBondContact OD1-CB 3.37Å; N90-S92 PolarHBondContact OD1-N 3.16Å; N90-S92 PolarHBondContact OD1-OG 3.32Å; N90-S92 VanDerWaalsContact OD1-OG 3.05Å; N90-K103 PolarHBondContact O-NZ 2.65Å
91Y94.6Very high94.8Very high78 Ų7867.3 Ų67.331%0.30635%0.353SS..  trans-123.110.7174.759.9-96.9000112.8K81 L84 A85 V89 G93 C94 L100K81-Y91 HydrophobicContact CB-CE1 4.43Å; K81-Y91 HydrophobicContact CB-CE2 4.24Å; K81-Y91 HydrophobicContact CD-CD2 4.38Å; K81-Y91 HydrophobicContact CD-CE2 3.94Å; K81-Y91 HydrophobicContact CG-CD2 4.03Å; K81-Y91 HydrophobicContact CG-CE2 3.85Å; L84-Y91 HydrophobicContact CB-CD1 3.67Å; L84-Y91 HydrophobicContact CB-CE1 4.31Å; L84-Y91 HydrophobicContact CD1-CD1 4.29Å; L84-Y91 HydrophobicContact CD1-CG 4.34Å; A85-Y91 HydrophobicContact CB-CE1 4.06Å; V89-Y91 WeakPolarHBondContact O-CD1 3.46Å; V89-Y91 PolarHBondContact O-N 3.48Å; Y91-G93 PolarHBondContact O-N 2.78Å; Y91-C94 WeakPolarHBondContact O-CB 3.43Å; Y91-C94 PolarHBondContact O-N 3.39Å; Y91-C94 VanDerWaalsContact O-N 3.14Å; Y91-L100 HydrophobicContact CG-CD2 4.35Å
92S94.1Very high94.9Very high85 Ų8569 Ų6959%0.59436%0.363SS*.THydrogen-bonded Turntrans-55.8129.1169.970.10000109.5N90N90-S92 PolarHBondContact ND2-OG 2.81Å; N90-S92 VanDerWaalsContact OD1-CB 3.31Å; N90-S92 WeakPolarHBondContact OD1-CB 3.37Å; N90-S92 PolarHBondContact OD1-N 3.16Å; N90-S92 PolarHBondContact OD1-OG 3.32Å; N90-S92 VanDerWaalsContact OD1-OG 3.05Å
93G92.3Very high95Very high67 Ų6770.6 Ų70.669%0.69137%0.369SS*.THydrogen-bonded Turntrans86.84.7-179.400000115.4Y91 C95Y91-G93 PolarHBondContact O-N 2.78Å; G93-C95 PolarHBondContact O-N 3.3Å
94C94.6Very high95Very high26 Ų2670.6 Ų70.618%0.17637%0.369CS..  trans-75.7111162.9-67.20000109.5Y91 E99 L100 K103Y91-C94 WeakPolarHBondContact O-CB 3.43Å; Y91-C94 PolarHBondContact O-N 3.39Å; Y91-C94 VanDerWaalsContact O-N 3.14Å; C94-E99 WeakPolarHBondContact CA-OE2 3.43Å; C94-E99 HydrophobicContact CB-CB 4.12Å; C94-L100 HydrophobicContact CB-CD2 3.65Å; C94-L100 HydrophobicContact CB-CG 3.98Å; C94-K103 WeakPolarHBondContact SG-CE 3.49Å
95C93.2Very high95Very high118 Ų11872.3 Ų72.380%0.79738%0.378SS*.  trans-90-25.2179.4-64.50000112.1G93 E99G93-C95 PolarHBondContact O-N 3.3Å; C95-E99 PolarHBondContact N-OE2 3.44Å
96E96.1Very high95Very high109 Ų10977 Ų7751%0.50939%0.387SS..SBendtrans-124.6151.1-173.7-61.4-174.38500112.8W98 E99E96-W98 HydrophobicContact CB-CG 4.21Å; E96-W98 VanDerWaalsContact CB-NE1 3.29Å; E96-W98 PolarHBondContact O-N 3.43Å; E96-W98 PolarHBondContact OE1-NE1 3.41Å; E96-W98 PolarHBondContact OE2-NE1 3.19Å; E96-E99 HydrophobicContact CB-CG 4.42Å; E96-E99 PolarHBondContact N-OE2 2.78Å; E96-E99 PolarHBondContact O-N 3.44Å; E96-E99 VanDerWaalsContact O-N 3.15Å
97K94.9Very high95.1Very high87 Ų8773.2 Ų73.238%0.37838%0.375SS..Hα-helixtrans-56.9-37.8178.6176.5177.2166.1176.80111.5E73 M75 V77 L80 E99 L100 V101E73-K97 WeakPolarHBondContact O-CE 3.47Å; E73-K97 PolarHBondContact O-NZ 2.78Å; M75-K97 VanDerWaalsContact O-CE 3.23Å; M75-K97 WeakPolarHBondContact O-CE 3.5Å; M75-K97 PolarHBondContact O-NZ 3.43Å; V77-K97 HydrophobicContact CG2-CB 4.18Å; V77-K97 HydrophobicContact CG2-CD 4.47Å; V77-K97 HydrophobicContact CG2-CG 4.26Å; L80-K97 HydrophobicContact CD1-CG 4.04Å; K97-E99 VanDerWaalsContact C-N 3.27Å; K97-E99 PolarHBondContact O-N 3.45Å; K97-L100 WeakPolarHBondContact O-CB 3.43Å; K97-L100 PolarHBondContact O-N 2.96Å; K97-V101 HydrophobicContact CG-CG2 4.14Å; K97-V101 WeakPolarHBondContact O-CG2 3.25Å; K97-V101 PolarHBondContact O-N 3.27Å
98W95.6Very high95Very high136 Ų13672.1 Ų72.152%0.51537%0.366SS..Hα-helixtrans-63.4-32.6-177.672-99.2000112.4E96 V101 E102E96-W98 HydrophobicContact CB-CG 4.21Å; E96-W98 VanDerWaalsContact CB-NE1 3.29Å; E96-W98 PolarHBondContact O-N 3.43Å; E96-W98 PolarHBondContact OE1-NE1 3.41Å; E96-W98 PolarHBondContact OE2-NE1 3.19Å; W98-V101 PolarHBondContact O-N 2.93Å; W98-E102 WeakPolarHBondContact CZ3-OE2 3.23Å; W98-E102 WeakPolarHBondContact O-CB 3.11Å; W98-E102 PolarHBondContact O-N 2.91Å
99E96.8Very high94.8Very high48 Ų4868.8 Ų68.822%0.22435%0.351CS..Hα-helixtrans-68.3-37.7177.6-62.1179.2108.500111.5C94 C95 E96 K97 K103C94-E99 WeakPolarHBondContact CA-OE2 3.43Å; C94-E99 HydrophobicContact CB-CB 4.12Å; C95-E99 PolarHBondContact N-OE2 3.44Å; E96-E99 HydrophobicContact CB-CG 4.42Å; E96-E99 PolarHBondContact N-OE2 2.78Å; E96-E99 PolarHBondContact O-N 3.44Å; E96-E99 VanDerWaalsContact O-N 3.15Å; K97-E99 VanDerWaalsContact C-N 3.27Å; K97-E99 PolarHBondContact O-N 3.45Å; E99-K103 WeakPolarHBondContact O-CG 3.3Å; E99-K103 PolarHBondContact O-N 3.48Å
100L96.1Very high94.7Very high4 Ų471.6 Ų71.62%0.02136%0.363CS..Hα-helixtrans-67.5-43.5173.5-63.9173000110.8V77 L80 K81 L84 Y91 C94 K97 E102 K103 V104V77-L100 HydrophobicContact CG1-CD1 3.73Å; L80-L100 HydrophobicContact CB-CB 4.02Å; L80-L100 HydrophobicContact CB-CD1 4.48Å; L80-L100 HydrophobicContact CD1-CB 3.9Å; K81-L100 HydrophobicContact CG-CD1 4.15Å; K81-L100 HydrophobicContact CG-CD2 4.35Å; L84-L100 HydrophobicContact CD1-CD2 3.74Å; Y91-L100 HydrophobicContact CG-CD2 4.35Å; C94-L100 HydrophobicContact CB-CD2 3.65Å; C94-L100 HydrophobicContact CB-CG 3.98Å; K97-L100 WeakPolarHBondContact O-CB 3.43Å; K97-L100 PolarHBondContact O-N 2.96Å; L100-E102 VanDerWaalsContact C-N 3.33Å; L100-E102 PolarHBondContact O-N 3.5Å; L100-K103 PolarHBondContact O-N 2.91Å; L100-V104 WeakPolarHBondContact O-CG2 3.26Å; L100-V104 PolarHBondContact O-N 3.41Å
101V95.5Very high94.4Very high16 Ų1669.7 Ų69.710%0.09735%0.352CS..Hα-helixtrans-59.3-44.81751680000110.5V72 E73 L80 K97 W98 K103 V104 N105V72-V101 HydrophobicContact CG1-CB 4.45Å; V72-V101 HydrophobicContact CG1-CG1 4.06Å; E73-V101 HydrophobicContact CG-CG1 4.28Å; L80-V101 HydrophobicContact CD1-CG2 3.71Å; L80-V101 HydrophobicContact CD2-CG2 4.31Å; K97-V101 HydrophobicContact CG-CG2 4.14Å; K97-V101 WeakPolarHBondContact O-CG2 3.25Å; K97-V101 PolarHBondContact O-N 3.27Å; W98-V101 PolarHBondContact O-N 2.93Å; V101-K103 PolarHBondContact O-N 3.01Å; V101-V104 PolarHBondContact O-N 2.8Å; V101-N105 WeakPolarHBondContact CG1-ND2 3.43Å; V101-N105 VanDerWaalsContact O-CB 3.26Å; V101-N105 WeakPolarHBondContact O-CB 3.43Å; V101-N105 VanDerWaalsContact O-CG 3.3Å; V101-N105 PolarHBondContact O-N 3.42Å; V101-N105 PolarHBondContact O-ND2 3.31Å
102E95.6Very high94.2Very high121 Ų12171.1 Ų71.157%0.56536%0.362SS*.Hα-helixtrans-61.4-45.9177.5-173.6-179.5-157.600111.6W98 L100 N105 R106W98-E102 WeakPolarHBondContact CZ3-OE2 3.23Å; W98-E102 WeakPolarHBondContact O-CB 3.11Å; W98-E102 PolarHBondContact O-N 2.91Å; L100-E102 VanDerWaalsContact C-N 3.33Å; L100-E102 PolarHBondContact O-N 3.5Å; E102-N105 PolarHBondContact O-N 3.27Å; E102-R106 WeakPolarHBondContact O-CB 3.49Å; E102-R106 PolarHBondContact O-N 3.48Å
103K96.7Very high93.9Very high56 Ų5672.2 Ų72.224%0.24336%0.358CS..Hα-helixtrans-62.6-42.7176.5-78173.1175.8-88.30112.4L84 N90 C94 E99 L100 V101 R106 L107L84-K103 HydrophobicContact CD1-CB 4.12Å; L84-K103 HydrophobicContact CD1-CD 4.48Å; L84-K103 HydrophobicContact CD2-CB 3.88Å; N90-K103 PolarHBondContact O-NZ 2.65Å; C94-K103 WeakPolarHBondContact SG-CE 3.49Å; E99-K103 WeakPolarHBondContact O-CG 3.3Å; E99-K103 PolarHBondContact O-N 3.48Å; L100-K103 PolarHBondContact O-N 2.91Å; V101-K103 PolarHBondContact O-N 3.01Å; K103-R106 PolarHBondContact O-N 3.3Å; K103-L107 VanDerWaalsContact O-CB 3.3Å; K103-L107 WeakPolarHBondContact O-CB 3.36Å; K103-L107 PolarHBondContact O-N 3.37Å
104V95.8Very high93.7Very high0 Ų073.3 Ų73.30%035%0.348CS..Hα-helixtrans-68.9-40.7177.8174.60000111.1L66 V72 L80 I83 L84 L100 V101 R106 L107 Y108L66-V104 HydrophobicContact CD1-CG1 3.95Å; V72-V104 HydrophobicContact CG1-CB 3.79Å; V72-V104 HydrophobicContact CG1-CG1 3.58Å; V72-V104 HydrophobicContact CG2-CG1 4.12Å; L80-V104 HydrophobicContact CB-CG2 4.32Å; L80-V104 HydrophobicContact CD2-CB 4.06Å; L80-V104 HydrophobicContact CD2-CG1 4.31Å; L80-V104 HydrophobicContact CD2-CG2 3.77Å; I83-V104 HydrophobicContact CG2-CG1 4.14Å; I83-V104 HydrophobicContact CG2-CG2 4.25Å; L84-V104 HydrophobicContact CD1-CG2 4.03Å; L84-V104 HydrophobicContact CD2-CG2 3.65Å; L84-V104 HydrophobicContact CG-CG2 3.61Å; L100-V104 WeakPolarHBondContact O-CG2 3.26Å; L100-V104 PolarHBondContact O-N 3.41Å; V101-V104 PolarHBondContact O-N 2.8Å; V104-R106 VanDerWaalsContact C-N 3.35Å; V104-R106 PolarHBondContact O-N 3.02Å; V104-L107 PolarHBondContact O-N 3.14Å; V104-Y108 VanDerWaalsContact O-CB 3.31Å; V104-Y108 WeakPolarHBondContact O-CB 3.46Å; V104-Y108 PolarHBondContact O-N 3.47Å
105N94.8Very high93.3Very high36 Ų3678.7 Ų78.719%0.19337%0.37CS..Hα-helixtrans-60.7-44.2174.7-82.3-23.4000111.7L69 V72 V101 E102 Y108 K109L69-N105 HydrophobicContact CD2-CB 4.35Å; L69-N105 WeakPolarHBondContact CD2-OD1 3.26Å; V72-N105 WeakPolarHBondContact CB-OD1 3.31Å; V72-N105 WeakPolarHBondContact CG1-OD1 3.37Å; V72-N105 WeakPolarHBondContact CG2-OD1 3.24Å; V101-N105 WeakPolarHBondContact CG1-ND2 3.43Å; V101-N105 VanDerWaalsContact O-CB 3.26Å; V101-N105 WeakPolarHBondContact O-CB 3.43Å; V101-N105 VanDerWaalsContact O-CG 3.3Å; V101-N105 PolarHBondContact O-N 3.42Å; V101-N105 PolarHBondContact O-ND2 3.31Å; E102-N105 PolarHBondContact O-N 3.27Å; N105-Y108 PolarHBondContact O-N 3.32Å; N105-K109 WeakPolarHBondContact O-CB 3.4Å; N105-K109 PolarHBondContact O-N 3.3Å
106R95.1Very high93Very high138 Ų13880.2 Ų80.252%0.52136%0.363SS..Hα-helixtrans-60.7-49.3174.7-175.4178.669.3172.96.2111E102 K103 V104 Y108 K109 E110E102-R106 WeakPolarHBondContact O-CB 3.49Å; E102-R106 PolarHBondContact O-N 3.48Å; K103-R106 PolarHBondContact O-N 3.3Å; V104-R106 VanDerWaalsContact C-N 3.35Å; V104-R106 PolarHBondContact O-N 3.02Å; R106-Y108 VanDerWaalsContact C-N 3.35Å; R106-Y108 PolarHBondContact O-N 2.83Å; R106-K109 PolarHBondContact O-N 3.31Å; R106-E110 HydrophobicContact CG-CG 4.38Å; R106-E110 VanDerWaalsContact CG-OE1 3.26Å; R106-E110 WeakPolarHBondContact CG-OE1 3.24Å; R106-E110 IonicContact NE-OE1 2.87Å; R106-E110 WeakPolarHBondContact O-CB 3.36Å; R106-E110 VanDerWaalsContact O-CG 3.31Å; R106-E110 WeakPolarHBondContact O-CG 3.31Å; R106-E110 PolarHBondContact O-N 3.39Å
107L94.7Very high92.4Very high20 Ų2077.8 Ų77.811%0.10536%0.358CS..Hα-helixtrans-59.3-43.8178.3175.363.6000112.1L63 I83 L84 N87 V89 K103 V104 N111L63-L107 HydrophobicContact CD1-CD1 4.12Å; L63-L107 HydrophobicContact CD1-CD2 3.87Å; L63-L107 HydrophobicContact CD1-CG 3.71Å; L63-L107 HydrophobicContact CD2-CD2 3.86Å; L63-L107 HydrophobicContact CD2-CG 3.97Å; L63-L107 HydrophobicContact CG-CD2 4.16Å; L63-L107 HydrophobicContact CG-CG 4.37Å; I83-L107 HydrophobicContact CG2-CD2 4.17Å; L84-L107 HydrophobicContact CD2-CD2 4.13Å; N87-L107 HydrophobicContact CB-CD1 4.12Å; N87-L107 HydrophobicContact CB-CD2 3.66Å; N87-L107 HydrophobicContact CB-CG 4.49Å; V89-L107 HydrophobicContact CG2-CD1 4.01Å; V89-L107 HydrophobicContact CG2-CD2 4.02Å; K103-L107 VanDerWaalsContact O-CB 3.3Å; K103-L107 WeakPolarHBondContact O-CB 3.36Å; K103-L107 PolarHBondContact O-N 3.37Å; V104-L107 PolarHBondContact O-N 3.14Å; L107-N111 VanDerWaalsContact O-CB 3.25Å; L107-N111 WeakPolarHBondContact O-CB 3.44Å; L107-N111 PolarHBondContact O-N 3.37Å
108Y92.3Very high91.7Very high36 Ų3681.3 Ų81.314%0.14137%0.37CS..Hα-helixtrans-60.7-48177.7177.6-92.6000111.1L66 L69 V104 N105 R106 N111 E112L66-Y108 HydrophobicContact CB-CD2 3.77Å; L66-Y108 HydrophobicContact CB-CE2 3.71Å; L66-Y108 HydrophobicContact CD1-CD2 3.94Å; L69-Y108 HydrophobicContact CD2-CD1 4.13Å; V104-Y108 VanDerWaalsContact O-CB 3.31Å; V104-Y108 WeakPolarHBondContact O-CB 3.46Å; V104-Y108 PolarHBondContact O-N 3.47Å; N105-Y108 PolarHBondContact O-N 3.32Å; R106-Y108 VanDerWaalsContact C-N 3.35Å; R106-Y108 PolarHBondContact O-N 2.83Å; Y108-N111 PolarHBondContact O-N 3.4Å; Y108-E112 PolarHBondContact O-N 3.31Å; Y108-E112 PolarHBondContact OH-OE2 3.44Å
109K92.3Very high90.8Very high126 Ų12676 Ų7655%0.54836%0.358SS..Hα-helixtrans-64.6-45.8179.4-170.3180180-1700112.4N105 R106 N111 E112 E113N105-K109 WeakPolarHBondContact O-CB 3.4Å; N105-K109 PolarHBondContact O-N 3.3Å; R106-K109 PolarHBondContact O-N 3.31Å; K109-N111 VanDerWaalsContact C-N 3.27Å; K109-N111 PolarHBondContact O-N 3.18Å; K109-E112 PolarHBondContact O-N 2.82Å; K109-E113 VanDerWaalsContact CE-OE1 3.22Å; K109-E113 WeakPolarHBondContact CE-OE1 3.27Å; K109-E113 WeakPolarHBondContact O-CB 3.38Å; K109-E113 WeakPolarHBondContact O-CG 3.44Å; K109-E113 PolarHBondContact O-N 2.92Å
110E92.1Very high89.9Confident89 Ų8978.9 Ų78.942%0.41637%0.371SS..Hα-helixtrans-60.3-39.6175.9-74.1171.8-17800111.3R106 N114R106-E110 HydrophobicContact CG-CG 4.38Å; R106-E110 VanDerWaalsContact CG-OE1 3.26Å; R106-E110 WeakPolarHBondContact CG-OE1 3.24Å; R106-E110 IonicContact NE-OE1 2.87Å; R106-E110 WeakPolarHBondContact O-CB 3.36Å; R106-E110 VanDerWaalsContact O-CG 3.31Å; R106-E110 WeakPolarHBondContact O-CG 3.31Å; R106-E110 PolarHBondContact O-N 3.39Å; E110-N114 VanDerWaalsContact O-CB 3.27Å; E110-N114 WeakPolarHBondContact O-CB 3.38Å; E110-N114 VanDerWaalsContact O-CG 3.25Å; E110-N114 PolarHBondContact O-N 2.96Å; E110-N114 PolarHBondContact O-ND2 3.45Å
111N90.2Very high88.9Confident67 Ų6786.7 Ų86.736%0.35840%0.401SS..Hα-helixtrans-66.8-42.7176.8-172.950.6000112.2L63 L107 Y108 K109 N114 Q115L63-N111 HydrophobicContact CD1-CB 4.37Å; L107-N111 VanDerWaalsContact O-CB 3.25Å; L107-N111 WeakPolarHBondContact O-CB 3.44Å; L107-N111 PolarHBondContact O-N 3.37Å; Y108-N111 PolarHBondContact O-N 3.4Å; K109-N111 VanDerWaalsContact C-N 3.27Å; K109-N111 PolarHBondContact O-N 3.18Å; N111-N114 PolarHBondContact O-N 3.28Å; N111-Q115 VanDerWaalsContact O-CB 3.27Å; N111-Q115 WeakPolarHBondContact O-CB 3.27Å; N111-Q115 PolarHBondContact O-N 2.84Å
112E89.1Confident87.9Confident109 Ų10991.3 Ų91.351%0.50942%0.424SS..Hα-helixtrans-63.3-44.5176.6-168.3-176.1114.700111.5Y108 K109 Q115 K116Y108-E112 PolarHBondContact O-N 3.31Å; Y108-E112 PolarHBondContact OH-OE2 3.44Å; K109-E112 PolarHBondContact O-N 2.82Å; E112-Q115 PolarHBondContact O-N 2.84Å; E112-K116 WeakPolarHBondContact O-CB 3.48Å; E112-K116 PolarHBondContact O-N 3.48Å
113E88.8Confident86.8Confident107 Ų10792.1 Ų92.150%0.543%0.428SS..Hα-helixtrans-63.2-45176.6-73.5177.1-17800111.7K109 K116 S117K109-E113 VanDerWaalsContact CE-OE1 3.22Å; K109-E113 WeakPolarHBondContact CE-OE1 3.27Å; K109-E113 WeakPolarHBondContact O-CB 3.38Å; K109-E113 WeakPolarHBondContact O-CG 3.44Å; K109-E113 PolarHBondContact O-N 2.92Å; E113-K116 PolarHBondContact O-N 3.41Å; E113-S117 WeakPolarHBondContact O-CB 3.33Å; E113-S117 PolarHBondContact O-N 2.93Å
114N87.8Confident85.6Confident90 Ų9094 Ų9448%0.48144%0.44SS..Hα-helixtrans-62.4-48.1175.3-79.1-23.7000110.9E110 N111 K116 S117 Y118E110-N114 VanDerWaalsContact O-CB 3.27Å; E110-N114 WeakPolarHBondContact O-CB 3.38Å; E110-N114 VanDerWaalsContact O-CG 3.25Å; E110-N114 PolarHBondContact O-N 2.96Å; E110-N114 PolarHBondContact O-ND2 3.45Å; N111-N114 PolarHBondContact O-N 3.28Å; N114-K116 VanDerWaalsContact C-N 3.27Å; N114-K116 PolarHBondContact O-N 2.94Å; N114-S117 PolarHBondContact O-N 3.41Å; N114-Y118 HydrophobicContact CB-CD2 4.4Å; N114-Y118 WeakPolarHBondContact O-CB 3.4Å; N114-Y118 VanDerWaalsContact O-CD2 3.24Å; N114-Y118 WeakPolarHBondContact O-CD2 3.26Å; N114-Y118 PolarHBondContact O-N 3.29Å
115Q86.1Confident84.6Confident140 Ų14099 Ų9965%0.65446%0.463SS*.Hα-helixtrans-59.1-40.5179.4-174.6173.8100111.7N111 E112 G119N111-Q115 VanDerWaalsContact O-CB 3.27Å; N111-Q115 WeakPolarHBondContact O-CB 3.27Å; N111-Q115 PolarHBondContact O-N 2.84Å; E112-Q115 PolarHBondContact O-N 2.84Å; Q115-G119 PolarHBondContact O-N 3.37Å
116K86.2Confident83.6Confident150 Ų150102.3 Ų102.365%0.65248%0.481SS*.Hα-helixtrans-66.1-46.2175.4-172.7175.6-179.8-177.50112E112 E113 N114 G119 E120E112-K116 WeakPolarHBondContact O-CB 3.48Å; E112-K116 PolarHBondContact O-N 3.48Å; E113-K116 PolarHBondContact O-N 3.41Å; N114-K116 VanDerWaalsContact C-N 3.27Å; N114-K116 PolarHBondContact O-N 2.94Å; K116-G119 PolarHBondContact O-N 3.48Å; K116-E120 WeakPolarHBondContact O-CB 3.18Å; K116-E120 PolarHBondContact O-N 3.01Å
117S84.9Confident82.6Confident58 Ų58102.6 Ų102.641%0.40649%0.488SS..Hα-helixtrans-64.4-44.5179.4-173.30000112.3E113 N114 R121E113-S117 WeakPolarHBondContact O-CB 3.33Å; E113-S117 PolarHBondContact O-N 2.93Å; N114-S117 PolarHBondContact O-N 3.41Å; S117-R121 WeakPolarHBondContact O-CB 3.39Å; S117-R121 WeakPolarHBondContact O-CG 3.22Å; S117-R121 PolarHBondContact O-N 2.89Å
118Y79.5Confident81.7Confident160 Ų160108.1 Ų108.163%0.62751%0.514SS*.Hα-helixtrans-65.4-42175.1-84.7-80.5000111.6N114 R121 L122N114-Y118 HydrophobicContact CB-CD2 4.4Å; N114-Y118 WeakPolarHBondContact O-CB 3.4Å; N114-Y118 VanDerWaalsContact O-CD2 3.24Å; N114-Y118 WeakPolarHBondContact O-CD2 3.26Å; N114-Y118 PolarHBondContact O-N 3.29Å; Y118-R121 PolarHBondContact O-N 2.89Å; Y118-L122 WeakPolarHBondContact O-CB 3.32Å; Y118-L122 VanDerWaalsContact O-CG 3.26Å; Y118-L122 WeakPolarHBondContact O-CG 3.39Å; Y118-L122 PolarHBondContact O-N 2.9Å
119G76.7Confident81.2Confident24 Ų24110 Ų11025%0.24753%0.526CS..Hα-helixtrans-63.1-45177.700000113.1Q115 K116 L122 Q123Q115-G119 PolarHBondContact O-N 3.37Å; K116-G119 PolarHBondContact O-N 3.48Å; G119-L122 PolarHBondContact O-N 3.4Å; G119-Q123 WeakPolarHBondContact O-CG 3.37Å; G119-Q123 PolarHBondContact O-N 3.28Å
120E77.6Confident81Confident110 Ų110108.4 Ų108.451%0.51452%0.524SS..Hα-helixtrans-66.9-41.9177.7-173.6171.6-175.200111.6K116 L122 Q123 L124K116-E120 WeakPolarHBondContact O-CB 3.18Å; K116-E120 PolarHBondContact O-N 3.01Å; E120-L122 PolarHBondContact O-N 2.94Å; E120-Q123 PolarHBondContact O-N 3.1Å; E120-L124 HydrophobicContact CG-CD1 4.31Å; E120-L124 WeakPolarHBondContact O-CG 3.32Å; E120-L124 PolarHBondContact O-N 3.35Å
121R75.1Confident80.9Confident168 Ų168106.2 Ų106.263%0.63452%0.518SS*.Hα-helixtrans-62.5-41.2174.6-73.9176.367.1123.16.8112.4S117 Y118 Q125S117-R121 WeakPolarHBondContact O-CB 3.39Å; S117-R121 WeakPolarHBondContact O-CG 3.22Å; S117-R121 PolarHBondContact O-N 2.89Å; Y118-R121 PolarHBondContact O-N 2.89Å; R121-Q125 VanDerWaalsContact O-CB 3.25Å; R121-Q125 WeakPolarHBondContact O-CB 3.43Å; R121-Q125 PolarHBondContact O-N 2.86Å; R121-Q125 VanDerWaalsContact O-N 3.13Å
122L74.4Confident81.2Confident113 Ų113104.5 Ų104.559%0.59251%0.509SS*.Hα-helixtrans-66.4-41.8177.2-76.9167.9000111.7Y118 G119 E120 Q125 D126Y118-L122 WeakPolarHBondContact O-CB 3.32Å; Y118-L122 VanDerWaalsContact O-CG 3.26Å; Y118-L122 WeakPolarHBondContact O-CG 3.39Å; Y118-L122 PolarHBondContact O-N 2.9Å; G119-L122 PolarHBondContact O-N 3.4Å; E120-L122 PolarHBondContact O-N 2.94Å; L122-Q125 PolarHBondContact O-N 2.81Å; L122-D126 WeakPolarHBondContact O-CB 2.97Å; L122-D126 PolarHBondContact O-N 3.2Å
123Q73.9Confident81.5Confident137 Ų13799.3 Ų99.364%0.6448%0.484SS*.Hα-helixtrans-62.4-46.9178.1-75.5171.626.100112.1G119 E120 Q125 D126 E127G119-Q123 WeakPolarHBondContact O-CG 3.37Å; G119-Q123 PolarHBondContact O-N 3.28Å; E120-Q123 PolarHBondContact O-N 3.1Å; Q123-Q125 VanDerWaalsContact C-N 3.29Å; Q123-Q125 PolarHBondContact O-N 3.3Å; Q123-D126 PolarHBondContact O-N 3.06Å; Q123-E127 WeakPolarHBondContact O-CG 3.2Å; Q123-E127 PolarHBondContact O-N 2.98Å
124L71.3Confident81.8Confident95 Ų95100 Ų10050%0.49748%0.482SS..Hα-helixtrans-63.5-37.1178.2-68.3171000112.1E120 E128E120-L124 HydrophobicContact CG-CD1 4.31Å; E120-L124 WeakPolarHBondContact O-CG 3.32Å; E120-L124 PolarHBondContact O-N 3.35Å; L124-E128 WeakPolarHBondContact O-CG 3.26Å; L124-E128 PolarHBondContact O-N 3.46Å
125Q74.4Confident82.2Confident106 Ų10699.7 Ų99.750%0.49548%0.48SS..Hα-helixtrans-73.2-38.2-178.8-158.2161.641.200112R121 L122 Q123 E128 D129R121-Q125 VanDerWaalsContact O-CB 3.25Å; R121-Q125 WeakPolarHBondContact O-CB 3.43Å; R121-Q125 PolarHBondContact O-N 2.86Å; R121-Q125 VanDerWaalsContact O-N 3.13Å; L122-Q125 PolarHBondContact O-N 2.81Å; Q123-Q125 VanDerWaalsContact C-N 3.29Å; Q123-Q125 PolarHBondContact O-N 3.3Å; Q125-E128 PolarHBondContact O-N 2.86Å; Q125-D129 VanDerWaalsContact O-CB 3.26Å; Q125-D129 WeakPolarHBondContact O-CB 3.38Å; Q125-D129 PolarHBondContact O-N 3.02Å
126D73.7Confident82.7Confident106 Ų10695.2 Ų95.257%0.56746%0.464SS*.Hα-helixtrans-65.7-41.1177.7-156.854.5000111.6L122 Q123 E128 D129 D130L122-D126 WeakPolarHBondContact O-CB 2.97Å; L122-D126 PolarHBondContact O-N 3.2Å; Q123-D126 PolarHBondContact O-N 3.06Å; D126-E128 PolarHBondContact O-N 3.4Å; D126-D129 PolarHBondContact O-N 3.19Å; D126-D130 WeakPolarHBondContact O-CB 3.41Å; D126-D130 PolarHBondContact O-N 3.21Å
127E73.1Confident83.1Confident143 Ų14393.6 Ų93.667%0.66846%0.46SS*.Hα-helixtrans-64.4-38.8175.9-70.6-172.6131.900112.7Q123Q123-E127 WeakPolarHBondContact O-CG 3.2Å; Q123-E127 PolarHBondContact O-N 2.98Å
128E75.6Confident83.5Confident136 Ų13697 Ų9764%0.63647%0.473SS*.Hα-helixtrans-69.6-47.4175.9-75-179.4176.800111.1L124 Q125 D126 D130 S131L124-E128 WeakPolarHBondContact O-CG 3.26Å; L124-E128 PolarHBondContact O-N 3.46Å; Q125-E128 PolarHBondContact O-N 2.86Å; D126-E128 PolarHBondContact O-N 3.4Å; E128-D130 VanDerWaalsContact C-N 3.34Å; E128-D130 PolarHBondContact O-N 3.49Å; E128-S131 PolarHBondContact O-N 3.43Å; E128-S131 PolarHBondContact O-OG 2.95Å
129D83.3Confident84.3Confident76 Ų7690.6 Ų90.641%0.40645%0.454SS..Hα-helixtrans-66.5-32.9-176-76-16.4000112.9Q125 D126 S131 L132Q125-D129 VanDerWaalsContact O-CB 3.26Å; Q125-D129 WeakPolarHBondContact O-CB 3.38Å; Q125-D129 PolarHBondContact O-N 3.02Å; D126-D129 PolarHBondContact O-N 3.19Å; D129-S131 PolarHBondContact O-N 3.44Å; D129-L132 WeakPolarHBondContact O-CB 3.25Å; D129-L132 PolarHBondContact O-N 2.9Å
130D87.3Confident85.1Confident93 Ų9393.3 Ų93.350%0.49747%0.465SS..Hα-helixtrans-62.9-28.7179.6-105.3-16000112.8D126 E128 R134D126-D130 WeakPolarHBondContact O-CB 3.41Å; D126-D130 PolarHBondContact O-N 3.21Å; E128-D130 VanDerWaalsContact C-N 3.34Å; E128-D130 PolarHBondContact O-N 3.49Å; D130-R134 PolarHBondContact O-NH2 3.36Å; D130-R134 VanDerWaalsContact O-NH2 3.15Å; D130-R134 IonicContact OD1-CZ 3.88Å; D130-R134 IonicContact OD1-NH2 3.81Å; D130-R134 PolarHBondContact OD1-NH2 3.13Å
131S90.7Very high86Confident43 Ų4388.9 Ų88.930%0.30145%0.445SS..THydrogen-bonded Turntrans-84.1-11.4177.881.60000113.9E128 D129 V140 I141E128-S131 PolarHBondContact O-N 3.43Å; E128-S131 PolarHBondContact O-OG 2.95Å; D129-S131 PolarHBondContact O-N 3.44Å; S131-V140 CarbonylContact O-C 3.5Å; S131-V140 WeakPolarHBondContact O-CA 3.14Å; S131-I141 WeakPolarHBondContact O-CG1 3.47Å; S131-I141 PolarHBondContact O-N 2.83Å
132L94.9Very high87Confident30 Ų3082.4 Ų82.416%0.15742%0.423CS..BIsolated β-bridgetrans-83.5148.3-176.5-65179.6000112.9D129 R134 V140 I141D129-L132 WeakPolarHBondContact O-CB 3.25Å; D129-L132 PolarHBondContact O-N 2.9Å; L132-R134 PolarHBondContact O-N 3.38Å; L132-V140 HydrophobicContact CD2-CG1 4.36Å; L132-I141 WeakPolarHBondContact O-CD1 3.27Å; L132-I141 WeakPolarHBondContact O-CG1 3.4Å
133C95.9Very high88.1Confident0 Ų077 Ų770%040%0.395CS..  trans-58.1120.9174.81710000110.4I135 C136 M137 A139 T153 C154C133-I135 PolarHBondContact O-N 3.28Å; C133-I135 PolarHBondContact SG-N 3.07Å; C133-C136 PolarHBondContact O-N 2.99Å; C133-M137 WeakPolarHBondContact O-CA 3.39Å; C133-M137 PolarHBondContact O-N 3.41Å; C133-A139 WeakPolarHBondContact CB-O 3.35Å; C133-A139 PolarHBondContact N-O 2.9Å; C133-T153 WeakPolarHBondContact SG-CA 3.48Å; C133-C154 HydrophobicContact CB-CB 3.8Å; C133-C154 VanDerWaalsContact CB-N 3.31Å; C133-C154 PolarHBondContact SG-N 3.14Å
134R95.4Very high89.1Confident121 Ų12171.7 Ų71.746%0.45737%0.372SS..THydrogen-bonded Turntrans-67.92.7-178.4-53.5-56.6173.598.4-6.6115.1D130 L132 V152D130-R134 PolarHBondContact O-NH2 3.36Å; D130-R134 VanDerWaalsContact O-NH2 3.15Å; D130-R134 IonicContact OD1-CZ 3.88Å; D130-R134 IonicContact OD1-NH2 3.81Å; D130-R134 PolarHBondContact OD1-NH2 3.13Å; L132-R134 PolarHBondContact O-N 3.38Å; R134-V152 PolarHBondContact N-O 3.4Å
135I96.3Very high90.4Very high84 Ų8467.2 Ų67.243%0.43135%0.348SS..THydrogen-bonded Turntrans-107.6-42.8-179.3-50.3-60.2000111.2C133 T153 C157 M161 P165C133-I135 PolarHBondContact O-N 3.28Å; C133-I135 PolarHBondContact SG-N 3.07Å; I135-T153 HydrophobicContact CD1-CG2 4.33Å; I135-T153 HydrophobicContact CG1-CG2 3.5Å; I135-T153 VanDerWaalsContact CG1-CG2 3.5Å; I135-C157 HydrophobicContact CB-CB 3.95Å; I135-C157 HydrophobicContact CG1-CB 4.33Å; I135-C157 HydrophobicContact CG2-CB 4.13Å; I135-M161 HydrophobicContact CD1-SD 4.12Å; I135-M161 HydrophobicContact CG1-SD 3.87Å; I135-P165 HydrophobicContact CD1-CB 4.42Å; I135-P165 HydrophobicContact CD1-CG 4.34Å
136C96.1Very high91.4Very high46 Ų4664.7 Ų64.731%0.31134%0.338SS..THydrogen-bonded Turntrans-109.4-14.8-179.368.50000114.3C133 D138C133-C136 PolarHBondContact O-N 2.99Å; C136-D138 HydrophobicContact CB-CB 4.33Å; C136-D138 PolarHBondContact O-N 3.37Å; C136-D138 VanDerWaalsContact O-N 3.1Å
137M95Very high92.4Very high117 Ų11766.4 Ų66.458%0.57634%0.342SS*.SBendtrans47.636.2-175.7-58.7-59.6-159.800113.2C133C133-M137 WeakPolarHBondContact O-CA 3.39Å; C133-M137 PolarHBondContact O-N 3.41Å
138D94Very high93.5Very high128 Ų12861 Ų6168%0.68432%0.32SS*.SBendtrans-135.1-48.5-170.6172.946.5000111.4C136C136-D138 HydrophobicContact CB-CB 4.33Å; C136-D138 PolarHBondContact O-N 3.37Å; C136-D138 VanDerWaalsContact O-N 3.1Å
139A94.8Very high94.5Very high26 Ų2656.5 Ų56.522%0.21531%0.31CS..SBendtrans-103.6147.6176.500000111.1C133 C154C133-A139 WeakPolarHBondContact CB-O 3.35Å; C133-A139 PolarHBondContact N-O 2.9Å; A139-C154 HydrophobicContact CB-CB 3.63Å
140V94.8Very high95.2Very high82 Ų8255.8 Ų55.850%0.49730%0.304SS..BIsolated β-bridgetrans-59.6154.1174.8-62.80000112.5S131 L132 D142 C154S131-V140 CarbonylContact O-C 3.5Å; S131-V140 WeakPolarHBondContact O-CA 3.14Å; L132-V140 HydrophobicContact CD2-CG1 4.36Å; V140-D142 PolarHBondContact O-N 3Å; V140-D142 VanDerWaalsContact O-N 3.1Å; V140-C154 VanDerWaalsContact O-CB 3.27Å; V140-C154 WeakPolarHBondContact O-CB 3.46Å
141I96Very high95.6Very high16 Ų1655 Ų558%0.08230%0.298CS..  trans-69.3105.3171.9-62.2167.5000108.6S131 L132 M151S131-I141 WeakPolarHBondContact O-CG1 3.47Å; S131-I141 PolarHBondContact O-N 2.83Å; L132-I141 WeakPolarHBondContact O-CD1 3.27Å; L132-I141 WeakPolarHBondContact O-CG1 3.4Å; I141-M151 HydrophobicContact CG2-CB 4Å
142D96.8Very high95.8Very high33 Ų3353.9 Ų53.918%0.17629%0.29CS..  trans-125.89.4-179.369.57.7000112.5V140 C154 T155 H176 V177V140-D142 PolarHBondContact O-N 3Å; V140-D142 VanDerWaalsContact O-N 3.1Å; D142-C154 VanDerWaalsContact OD1-C 3.29Å; D142-C154 VanDerWaalsContact OD1-CA 3.24Å; D142-C154 WeakPolarHBondContact OD1-CA 3.49Å; D142-T155 WeakPolarHBondContact OD1-CB 3.29Å; D142-T155 PolarHBondContact OD1-N 3.31Å; D142-T155 PolarHBondContact OD1-OG1 3.19Å; D142-H176 VanDerWaalsContact CG-CD2 3.46Å; D142-H176 CarbonylContact O-C 3.54Å; D142-H176 WeakPolarHBondContact O-CA 3.24Å; D142-H176 IonicContact OD1-CD2 3.9Å; D142-H176 IonicContact OD2-CD2 3.37Å; D142-H176 PolarHBondContact OD2-CD2 3.18Å; D142-H176 IonicContact OD2-NE2 3.44Å; D142-H176 PolarHBondContact OD2-NE2 3.44Å; D142-V177 PolarHBondContact O-N 3.46Å
143C96.1Very high95.9Very high0 Ų052.5 Ų52.50%028%0.282CS..EExtended strand (participates in β ladder)trans-130.5136.3-172.1-174.50000112.9M151 T153 V175C143-M151 WeakPolarHBondContact O-CA 3.49Å; C143-T153 VanDerWaalsContact CB-O 3.29Å; C143-T153 WeakPolarHBondContact CB-O 3.07Å; C143-T153 PolarHBondContact N-O 3.48Å; C143-V175 WeakPolarHBondContact CA-O 3.5Å; C143-V175 PolarHBondContact SG-O 2.87Å; C143-V175 VanDerWaalsContact SG-O 3.4Å
144V96.8Very high96Very high25 Ų2552.6 Ų52.615%0.15228%0.283CS..EExtended strand (participates in β ladder)trans-105.5132.6169.865.10000110.7G149 M151 V175 V177V144-G149 WeakPolarHBondContact CG2-O 3.37Å; V144-M151 HydrophobicContact CB-CG 3.86Å; V144-M151 HydrophobicContact CG2-CG 4.01Å; V144-V175 HydrophobicContact CG1-CB 3.98Å; V144-V175 PolarHBondContact N-O 3.42Å; V144-V175 PolarHBondContact O-N 3.32Å; V144-V175 VanDerWaalsContact O-N 3.07Å; V144-V177 HydrophobicContact CB-CG2 4.13Å; V144-V177 HydrophobicContact CG1-CG2 3.68Å
145L97.5Very high96.1Very high0 Ų047.7 Ų47.70%027%0.266CS..EExtended strand (participates in β ladder)trans-93.2113.8178.2-56.8-179.7000110.6C148 G149 H150 M161 C164 V171 A174L145-C148 PolarHBondContact O-N 3.15Å; L145-C148 PolarHBondContact O-SG 3.32Å; L145-G149 PolarHBondContact O-N 3.5Å; L145-H150 PolarHBondContact N-O 3.18Å; L145-M161 HydrophobicContact CD1-CE 3.88Å; L145-C164 HydrophobicContact CD1-CB 4.09Å; L145-V171 HydrophobicContact CB-CG2 4.34Å; L145-V171 HydrophobicContact CD1-CG2 4.15Å; L145-V171 HydrophobicContact CD2-CG1 4.06Å; L145-V171 HydrophobicContact CD2-CG2 4.33Å; L145-A174 HydrophobicContact CD2-CB 4.25Å
146L95.8Very high96.2Very high53 Ų5351.1 Ų51.128%0.27728%0.278SS..EExtended strand (participates in β ladder)trans-93.6141.4178.1-65.8175.5000111.4V172 R173 V175L146-V172 PolarHBondContact O-N 3.4Å; L146-R173 HydrophobicContact CB-CB 4.35Å; L146-R173 PolarHBondContact N-O 2.78Å; L146-R173 PolarHBondContact O-N 2.76Å; L146-V175 HydrophobicContact CD1-CG2 3.88Å
147E94.8Very high96.2Very high142 Ų14249 Ų4966%0.66426%0.264SS*.THydrogen-bonded Turncis-93.3-1.310.5-64.3-172163.800115.4G149 V172E147-G149 PolarHBondContact O-N 3.4Å; E147-V172 HydrophobicContact CG-CG2 4.5Å
148C96.8Very high96.3Very high31 Ų3143.5 Ų43.521%0.20924%0.237CC..THydrogen-bonded Turntrans-75.2-19.1-172.568.60000116L145 H150 C167 Q169L145-C148 PolarHBondContact O-N 3.15Å; L145-C148 PolarHBondContact O-SG 3.32Å; C148-H150 PolarHBondContact O-N 3.15Å; C148-H150 PolarHBondContact SG-ND1 2.9Å; C148-C167 WeakPolarHBondContact CB-SG 3.34Å; C148-Q169 HydrophobicContact CB-CB 4.24Å
149G95.4Very high96.4Very high40 Ų4044.8 Ų44.841%0.41224%0.237SC..THydrogen-bonded Turntrans79.41.5175.400000116.5V144 L145 E147 M151V144-G149 WeakPolarHBondContact CG2-O 3.37Å; L145-G149 PolarHBondContact O-N 3.5Å; E147-G149 PolarHBondContact O-N 3.4Å; G149-M151 PolarHBondContact O-N 2.84Å
150H97.6Very high96.4Very high61 Ų6152.9 Ų52.928%0.28226%0.262SS..EExtended strand (participates in β ladder)trans-70.8127.3-179.1-65.5104.3000112.2L145 C148 C164 I166 C167L145-H150 PolarHBondContact N-O 3.18Å; C148-H150 PolarHBondContact O-N 3.15Å; C148-H150 PolarHBondContact SG-ND1 2.9Å; H150-C164 PolarHBondContact ND1-SG 2.73Å; H150-C164 VanDerWaalsContact ND1-SG 3.44Å; H150-I166 HydrophobicContact CB-CB 4.42Å; H150-I166 HydrophobicContact CB-CG1 4.23Å; H150-C167 PolarHBondContact CE1-SG 3.37Å; H150-C167 PolarHBondContact ND1-SG 3.44Å; H150-C167 VanDerWaalsContact ND1-SG 3.4Å
151M96Very high96.3Very high76 Ų7650.9 Ų50.937%0.37425%0.248SC..EExtended strand (participates in β ladder)trans-105.692.6175.2-66-175.471.900109.7I141 C143 V144 G149 V177I141-M151 HydrophobicContact CG2-CB 4Å; C143-M151 WeakPolarHBondContact O-CA 3.49Å; V144-M151 HydrophobicContact CB-CG 3.86Å; V144-M151 HydrophobicContact CG2-CG 4.01Å; G149-M151 PolarHBondContact O-N 2.84Å; M151-V177 HydrophobicContact CE-CB 4.09Å; M151-V177 HydrophobicContact CE-CG1 4.28Å; M151-V177 HydrophobicContact CE-CG2 4.26Å
152V96Very high96.3Very high21 Ų2153.6 Ų53.613%0.12727%0.268CS..EExtended strand (participates in β ladder)trans-137.5-3.3-174.5-61.90000113.2R134 P165 I166R134-V152 PolarHBondContact N-O 3.4Å; V152-P165 HydrophobicContact CG2-CG 3.55Å; V152-I166 HydrophobicContact CB-CG1 4.38Å; V152-I166 HydrophobicContact CG1-CD1 3.88Å; V152-I166 HydrophobicContact CG1-CG1 3.64Å; V152-I166 HydrophobicContact CG2-CG1 4.07Å
153T97.1Very high96.3Very high0 Ų057.2 Ų57.20%028%0.284CS..EExtended strand (participates in β ladder)trans-130.1154.5-175.964.60000112C133 I135 C143 M161C133-T153 WeakPolarHBondContact SG-CA 3.48Å; I135-T153 HydrophobicContact CD1-CG2 4.33Å; I135-T153 HydrophobicContact CG1-CG2 3.5Å; I135-T153 VanDerWaalsContact CG1-CG2 3.5Å; C143-T153 VanDerWaalsContact CB-O 3.29Å; C143-T153 WeakPolarHBondContact CB-O 3.07Å; C143-T153 PolarHBondContact N-O 3.48Å; T153-M161 HydrophobicContact CG2-CE 3.39Å; T153-M161 HydrophobicContact CG2-SD 3.99Å
154C97.5Very high96.3Very high2 Ų257.3 Ų57.31%0.01429%0.285CS..  trans-74.1164.6159.8720000110.2C133 A139 V140 D142 K156 C157 G158C133-C154 HydrophobicContact CB-CB 3.8Å; C133-C154 VanDerWaalsContact CB-N 3.31Å; C133-C154 PolarHBondContact SG-N 3.14Å; A139-C154 HydrophobicContact CB-CB 3.63Å; V140-C154 VanDerWaalsContact O-CB 3.27Å; V140-C154 WeakPolarHBondContact O-CB 3.46Å; D142-C154 VanDerWaalsContact OD1-C 3.29Å; D142-C154 VanDerWaalsContact OD1-CA 3.24Å; D142-C154 WeakPolarHBondContact OD1-CA 3.49Å; C154-K156 VanDerWaalsContact C-N 3.29Å; C154-K156 PolarHBondContact O-N 2.85Å; C154-C157 PolarHBondContact O-N 3.31Å; C154-C157 VanDerWaalsContact O-N 3.14Å; C154-C157 PolarHBondContact SG-N 3.24Å; C154-G158 PolarHBondContact O-N 2.8Å
155T96.8Very high96.3Very high18 Ų1859.2 Ų59.211%0.1130%0.297CS..Hα-helixtrans-66.5-31.7-174.3-68.90000112.1D142 K159 H176D142-T155 WeakPolarHBondContact OD1-CB 3.29Å; D142-T155 PolarHBondContact OD1-N 3.31Å; D142-T155 PolarHBondContact OD1-OG1 3.19Å; T155-K159 HydrophobicContact CG2-CD 4.09Å; T155-K159 HydrophobicContact CG2-CG 4.46Å; T155-K159 WeakPolarHBondContact O-CB 3.35Å; T155-K159 VanDerWaalsContact O-CG 3.23Å; T155-K159 WeakPolarHBondContact O-CG 3.38Å; T155-K159 PolarHBondContact O-N 2.77Å; T155-H176 HydrophobicContact CG2-CB 4.39Å; T155-H176 PolarHBondContact OG1-CD2 2.79Å; T155-H176 VanDerWaalsContact OG1-CD2 3.24Å
156K97.6Very high96.2Very high156 Ų15664 Ų6468%0.67832%0.322SS*.Hα-helixtrans-65.8-41174.8-64.1177.7-175170.90111.6C154 R160C154-K156 VanDerWaalsContact C-N 3.29Å; C154-K156 PolarHBondContact O-N 2.85Å; K156-R160 PolarHBondContact O-NE 3.48Å
157C97.9Very high96.3Very high3 Ų364 Ų642%0.0233%0.326CS..Hα-helixtrans-74-52.4177.5-710000110.5I135 C154 K159 R160 M161I135-C157 HydrophobicContact CB-CB 3.95Å; I135-C157 HydrophobicContact CG1-CB 4.33Å; I135-C157 HydrophobicContact CG2-CB 4.13Å; C154-C157 PolarHBondContact O-N 3.31Å; C154-C157 VanDerWaalsContact O-N 3.14Å; C154-C157 PolarHBondContact SG-N 3.24Å; C157-K159 VanDerWaalsContact C-N 3.26Å; C157-K159 PolarHBondContact O-N 3.26Å; C157-K159 VanDerWaalsContact O-N 3.15Å; C157-R160 PolarHBondContact O-N 3.39Å; C157-M161 WeakPolarHBondContact O-CG 3.44Å
158G96.5Very high96.4Very high1 Ų166.7 Ų66.71%0.0133%0.33CS..Hα-helixtrans-52.8-38.3-179.100000114.1C154 R160 M161C154-G158 PolarHBondContact O-N 2.8Å; G158-R160 VanDerWaalsContact C-N 3.27Å; G158-R160 PolarHBondContact O-N 3.24Å; G158-M161 PolarHBondContact O-N 3.42Å
159K95.6Very high96.4Very high154 Ų15469.6 Ų69.667%0.6734%0.34SS*.THydrogen-bonded Turntrans-66.2-21.8176.6-77.3176.2178.4177.40114.9T155 C157 A174T155-K159 HydrophobicContact CG2-CD 4.09Å; T155-K159 HydrophobicContact CG2-CG 4.46Å; T155-K159 WeakPolarHBondContact O-CB 3.35Å; T155-K159 VanDerWaalsContact O-CG 3.23Å; T155-K159 WeakPolarHBondContact O-CG 3.38Å; T155-K159 PolarHBondContact O-N 2.77Å; C157-K159 VanDerWaalsContact C-N 3.26Å; C157-K159 PolarHBondContact O-N 3.26Å; C157-K159 VanDerWaalsContact O-N 3.15Å; K159-A174 HydrophobicContact CG-CB 4.38Å
160R95.9Very high96.5Very high197 Ų19775.3 Ų75.374%0.74335%0.35SS*.THydrogen-bonded Turntrans-95.5-1.3-178.5-66.3-174.2-68.3173.93.5112.9K156 C157 G158K156-R160 PolarHBondContact O-NE 3.48Å; C157-R160 PolarHBondContact O-N 3.39Å; G158-R160 VanDerWaalsContact C-N 3.27Å; G158-R160 PolarHBondContact O-N 3.24Å
161M92.2Very high96.5Very high40 Ų4073.1 Ų73.120%0.19734%0.341CS..  trans-103.6137.8-172.1-36-150.2-54.400110.7I135 L145 T153 C157 G158 P165I135-M161 HydrophobicContact CD1-SD 4.12Å; I135-M161 HydrophobicContact CG1-SD 3.87Å; L145-M161 HydrophobicContact CD1-CE 3.88Å; T153-M161 HydrophobicContact CG2-CE 3.39Å; T153-M161 HydrophobicContact CG2-SD 3.99Å; C157-M161 WeakPolarHBondContact O-CG 3.44Å; G158-M161 PolarHBondContact O-N 3.42Å; M161-P165 VanDerWaalsContact CE-CD 3.49Å; M161-P165 HydrophobicContact CE-CG 4.04Å
162S95.4Very high96.4Very high73 Ų7373.5 Ų73.551%0.5135%0.348SS..SBendtrans-90.3-24.8173.952.30000112.8Y170 V171S162-Y170 WeakPolarHBondContact O-CA 3.23Å; S162-Y170 WeakPolarHBondContact O-CD2 3.32Å; S162-V171 PolarHBondContact O-N 3.22Å
163E97.1Very high96.4Very high109 Ų10978.8 Ų78.851%0.50937%0.365SS..BIsolated β-bridgetrans-133.4148-176.8-66.1178.3-17900110.8Q169E163-Q169 WeakPolarHBondContact CA-O 3.38Å
164C97.1Very high96.3Very high2 Ų279.9 Ų79.91%0.01438%0.375CS..  trans-69.5131173.5177.90000110.5L145 H150 I166 R168 Q169L145-C164 HydrophobicContact CD1-CB 4.09Å; H150-C164 PolarHBondContact ND1-SG 2.73Å; H150-C164 VanDerWaalsContact ND1-SG 3.44Å; C164-I166 PolarHBondContact O-N 3.24Å; C164-I166 PolarHBondContact SG-N 2.65Å; C164-R168 WeakPolarHBondContact O-CA 3.46Å; C164-R168 PolarHBondContact O-N 3.1Å; C164-Q169 PolarHBondContact N-O 3.34Å
165P95.6Very high96.2Very high65 Ų6582.5 Ų82.542%0.42239%0.39SS..THydrogen-bonded Turntrans-71.1-13-178.830.1-36.6000113I135 V152 M161I135-P165 HydrophobicContact CD1-CB 4.42Å; I135-P165 HydrophobicContact CD1-CG 4.34Å; V152-P165 HydrophobicContact CG2-CG 3.55Å; M161-P165 VanDerWaalsContact CE-CD 3.49Å; M161-P165 HydrophobicContact CE-CG 4.04Å
166I96.7Very high96.2Very high99 Ų9985.2 Ų85.251%0.50840%0.402SS..THydrogen-bonded Turntrans-91.4-55.6179.3-52.8-55.9000111.3H150 V152 C164H150-I166 HydrophobicContact CB-CB 4.42Å; H150-I166 HydrophobicContact CB-CG1 4.23Å; V152-I166 HydrophobicContact CB-CG1 4.38Å; V152-I166 HydrophobicContact CG1-CD1 3.88Å; V152-I166 HydrophobicContact CG1-CG1 3.64Å; V152-I166 HydrophobicContact CG2-CG1 4.07Å; C164-I166 PolarHBondContact O-N 3.24Å; C164-I166 PolarHBondContact SG-N 2.65Å
167C97.5Very high96.1Very high54 Ų5480.3 Ų80.337%0.36539%0.385SS..THydrogen-bonded Turntrans-109.6-0.7-173.266.10000114.7C148 H150 Q169C148-C167 WeakPolarHBondContact CB-SG 3.34Å; H150-C167 PolarHBondContact CE1-SG 3.37Å; H150-C167 PolarHBondContact ND1-SG 3.44Å; H150-C167 VanDerWaalsContact ND1-SG 3.4Å; C167-Q169 PolarHBondContact O-N 2.84Å; C167-Q169 VanDerWaalsContact SG-CB 3.58Å
168R96.3Very high95.7Very high199 Ų19988.3 Ų88.375%0.75142%0.419SS*.  trans58.212.5-178.5-53.5-179.5-178-139.90.7115C164C164-R168 WeakPolarHBondContact O-CA 3.46Å; C164-R168 PolarHBondContact O-N 3.1Å
169Q97.1Very high94.8Very high92 Ų9295.5 Ų95.543%0.4345%0.45SS..  trans-70.4142.1173.9-172.1172.2-24.600110.2C148 E163 C164 C167 V171C148-Q169 HydrophobicContact CB-CB 4.24Å; E163-Q169 WeakPolarHBondContact CA-O 3.38Å; C164-Q169 PolarHBondContact N-O 3.34Å; C167-Q169 PolarHBondContact O-N 2.84Å; C167-Q169 VanDerWaalsContact SG-CB 3.58Å; Q169-V171 PolarHBondContact O-N 3.07Å
170Y97.4Very high93.4Very high159 Ų15997.6 Ų97.662%0.62448%0.484SS*.BIsolated β-bridgetrans-59.7131.6177.1-172.7-97.1000111.3S162 V172S162-Y170 WeakPolarHBondContact O-CA 3.23Å; S162-Y170 WeakPolarHBondContact O-CD2 3.32Å; Y170-V172 HydrophobicContact CD1-CG2 4.47Å; Y170-V172 PolarHBondContact O-N 2.96Å
171V96.4Very high93.2Very high15 Ų1592.6 Ų92.69%0.09147%0.471CS..  trans-81.6106.8179.4179.80000108.7L145 S162 Q169L145-V171 HydrophobicContact CB-CG2 4.34Å; L145-V171 HydrophobicContact CD1-CG2 4.15Å; L145-V171 HydrophobicContact CD2-CG1 4.06Å; L145-V171 HydrophobicContact CD2-CG2 4.33Å; S162-V171 PolarHBondContact O-N 3.22Å; Q169-V171 PolarHBondContact O-N 3.07Å
172V95.4Very high93.3Very high84 Ų8495.4 Ų95.451%0.50949%0.486SS..SBendtrans-76.4-37.4175.5-177.80000110.3L146 E147 Y170L146-V172 PolarHBondContact O-N 3.4Å; E147-V172 HydrophobicContact CG-CG2 4.5Å; Y170-V172 HydrophobicContact CD1-CG2 4.47Å; Y170-V172 PolarHBondContact O-N 2.96Å
173R95Very high93.2Very high132 Ų13296.6 Ų96.650%0.49848%0.484SS..EExtended strand (participates in β ladder)trans-157.5140.2-178.5-163.1-175.4-52.592.95.8111.3L146 V175L146-R173 HydrophobicContact CB-CB 4.35Å; L146-R173 PolarHBondContact N-O 2.78Å; L146-R173 PolarHBondContact O-N 2.76Å; R173-V175 HydrophobicContact CG-CG2 3.99Å
174A95.9Very high92.9Very high24 Ų2495.9 Ų95.920%0.19848%0.483CS..EExtended strand (participates in β ladder)trans-105.7120.1169.700000109L145 K159L145-A174 HydrophobicContact CD2-CB 4.25Å; K159-A174 HydrophobicContact CG-CB 4.38Å
175V95.9Very high92.7Very high56 Ų56101.8 Ų101.834%0.33951%0.512SS..EExtended strand (participates in β ladder)trans-115.7131.7-177.4-177.90000109.3C143 V144 L146 R173C143-V175 WeakPolarHBondContact CA-O 3.5Å; C143-V175 PolarHBondContact SG-O 2.87Å; C143-V175 VanDerWaalsContact SG-O 3.4Å; V144-V175 HydrophobicContact CG1-CB 3.98Å; V144-V175 PolarHBondContact N-O 3.42Å; V144-V175 PolarHBondContact O-N 3.32Å; V144-V175 VanDerWaalsContact O-N 3.07Å; L146-V175 HydrophobicContact CD1-CG2 3.88Å; R173-V175 HydrophobicContact CG-CG2 3.99Å
176H96.1Very high92.5Very high76 Ų76104.2 Ų104.235%0.35252%0.518SS..EExtended strand (participates in β ladder)trans-76.5134.3174.1178.8-87.5000109.9D142 T155 F178D142-H176 VanDerWaalsContact CG-CD2 3.46Å; D142-H176 CarbonylContact O-C 3.54Å; D142-H176 WeakPolarHBondContact O-CA 3.24Å; D142-H176 IonicContact OD1-CD2 3.9Å; D142-H176 IonicContact OD2-CD2 3.37Å; D142-H176 PolarHBondContact OD2-CD2 3.18Å; D142-H176 IonicContact OD2-NE2 3.44Å; D142-H176 PolarHBondContact OD2-NE2 3.44Å; T155-H176 HydrophobicContact CG2-CB 4.39Å; T155-H176 PolarHBondContact OG1-CD2 2.79Å; T155-H176 VanDerWaalsContact OG1-CD2 3.24Å; H176-F178 AromaticContact CE1-CD1 3.64Å; H176-F178 AromaticContact CE1-CE1 3.35Å; H176-F178 WeakPolarHBondContact CE1-CE1 3.46Å; H176-F178 AromaticContact CE1-CZ 3.6Å; H176-F178 AromaticContact ND1-CE1 3.73Å; H176-F178 AromaticContact ND1-CE2 3.63Å; H176-F178 AromaticContact ND1-CZ 3.46Å; H176-F178 WeakPolarHBondContact ND1-CZ 3.35Å
177V94.6Very high92.2Very high52 Ų52104.6 Ų104.632%0.31552%0.519SS..  trans-119.8137.9-178.6-1770000108.5D142 V144 M151D142-V177 PolarHBondContact O-N 3.46Å; V144-V177 HydrophobicContact CB-CG2 4.13Å; V144-V177 HydrophobicContact CG1-CG2 3.68Å; M151-V177 HydrophobicContact CE-CB 4.09Å; M151-V177 HydrophobicContact CE-CG1 4.28Å; M151-V177 HydrophobicContact CE-CG2 4.26Å
178F90.9Very high91.8Very high171 Ų171108.5 Ų108.575%0.7553%0.531SS*.  trans-96.2121.8173.2-58-88.9000108.3H176H176-F178 AromaticContact CE1-CD1 3.64Å; H176-F178 AromaticContact CE1-CE1 3.35Å; H176-F178 WeakPolarHBondContact CE1-CE1 3.46Å; H176-F178 AromaticContact CE1-CZ 3.6Å; H176-F178 AromaticContact ND1-CE1 3.73Å; H176-F178 AromaticContact ND1-CE2 3.63Å; H176-F178 AromaticContact ND1-CZ 3.46Å; H176-F178 WeakPolarHBondContact ND1-CZ 3.35Å
179K77.8Confident91.4Very high153 Ų153100.9 Ų100.967%0.66551%0.512SS*.  trans-78.6132.6167.6-74.4-178.9175.5176.70108.2
180S64.4Low90.9Very high197 Ų197101.7 Ų101.7100%1.37852%0.52SS*.  trans-84.70177.1-59.80000112.3

Retrieved 180 of 180 residues in 44.8 ms (Link to these results)