A0A077YXC8_TRITR Loading...

Ribosome-recycling factor, mitochondrial

AlphaFold DB , UniProt , Accession A0A077YXC8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 239 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
1M34.4Very low39.5Very low228 Ų228154.3 Ų154.3100%1.12383%0.826SS**  0106.80-91.473.5179.100108
2M34.2Very low39.4Very low148 Ų148162.1 Ų162.173%0.72984%0.835SS**  100.4132.179-150.1-176.1165.300109.7
3W34.6Very low39.4Very low209 Ų209161.5 Ų161.579%0.79283%0.826SS**  trans96.597164.1-58.692.9000120.2
4L34.8Very low39.9Very low165 Ų165160.2 Ų160.286%0.86483%0.829SS**  trans-59.8150.1138.4-92.397.2000110.4
5C40.2Very low39.4Very low125 Ų125163.8 Ų163.885%0.84583%0.828SS**  trans-145.9132.1148.1-149.40000111.6
6N42.5Very low39.6Very low142 Ų142165.5 Ų165.576%0.75983%0.832SS**  trans-97.1155.7-176.3-175.920.6000110
7R42.5Very low39.6Very low242 Ų242160.8 Ų160.891%0.91382%0.816SS**  trans164.5130.4159.4-94.1168.1-147.3-1348.5106.7
8G41.3Very low39.5Very low73 Ų73165 Ų16575%0.75382%0.82SS**  cis126119.618.700000108.9
9A48.1Very low39.6Very low97 Ų97162.3 Ų162.380%0.80281%0.814SS**  trans156.1114.2158.900000108.5
10V43.7Very low39.7Very low128 Ų128164.2 Ų164.278%0.77682%0.816SS**  cis86.8114.837-175.50000114.9
11L37.8Very low39.9Very low140 Ų140162.7 Ų162.773%0.73382%0.816SS**  trans76.2115.5152.7-74.2160.3000121.5
12R38.5Very low40.1Very low248 Ų248158.3 Ų158.394%0.93680%0.802SS**  -170.8135.7103.6-100.5175.5-148.1-118.82113.3
13H39.9Very low40.5Very low154 Ų154157 Ų15771%0.71380%0.803SS**  trans-65.9141170-83.9-110.3000112.4
14V45.9Very low40.4Very low144 Ų144152 Ų15287%0.87380%0.8SS**  trans-142.6126.3143.1177.30000107.7
15W32.5Very low40.7Very low214 Ų214150.9 Ų150.981%0.81179%0.794SS**  trans-101.6127.9177.2-111.154.9000108.4
16E42.6Very low40.3Very low191 Ų191150.8 Ų150.889%0.89379%0.794SS**  trans-153.8127.5147.5-77.5-161.8155.400109.1
17P39.1Very low40.2Very low86 Ų86149.3 Ų149.356%0.55879%0.789SS**  trans-121.4108.5179.535.1-19.4000112.5
18W37.8Very low39.8Very low236 Ų236142.7 Ų142.789%0.89478%0.779SS**  trans-149.4126.6155.3-72.690000111.8
19T42.2Very low39.3Very low114 Ų114143.3 Ų143.370%0.69977%0.772SS**  trans55.9109.3144.761.10000119.2
20K42.1Very low38.8Very low199 Ų199145.3 Ų145.387%0.86577%0.768SS**  -170.2130.1121.7-99.2157.3-166.2-176.70111T22K20-T22 PolarHBondContact O-N 2.95Å
21V43.7Very low38.4Very low134 Ų134148.7 Ų148.781%0.81277%0.772SS**  trans-45.1113.7174.8175.70000110.5T23V21-T23 PolarHBondContact O-N 2.81Å; V21-T23 VanDerWaalsContact O-N 3.15Å
22T37.7Very low38.4Very low135 Ų135147.3 Ų147.383%0.82877%0.765SS**  trans-78.889.7168.945.30000108.5K20 S24K20-T22 PolarHBondContact O-N 2.95Å; T22-S24 PolarHBondContact O-N 3.1Å
23T42.6Very low38.6Very low120 Ų120139.6 Ų139.674%0.73675%0.754SS**  trans-68.5110.8162.4-33.50000106.9V21 L25V21-T23 PolarHBondContact O-N 2.81Å; V21-T23 VanDerWaalsContact O-N 3.15Å; T23-L25 PolarHBondContact O-N 2.89Å
24S33.7Very low38.8Very low106 Ų106139.3 Ų139.374%0.74176%0.757SS**  trans-62.9102.1175.460.90000109T22 C26T22-S24 PolarHBondContact O-N 3.1Å; S24-C26 PolarHBondContact O-N 3.01Å
25L40Very low38.7Very low141 Ų141139.3 Ų139.374%0.73875%0.752SS**  trans-58.9103.8162.9-82.8156000107.5T23 V27T23-L25 PolarHBondContact O-N 2.89Å; L25-V27 HydrophobicContact CB-CG2 4.38Å; L25-V27 PolarHBondContact O-N 3.26Å
26C32.6Very low39.1Very low123 Ų123138.9 Ų138.983%0.83176%0.755SS**  trans-70.186.6164.9-172.40000106.9S24 C28S24-C26 PolarHBondContact O-N 3.01Å; C26-C28 VanDerWaalsContact C-N 3.31Å; C26-C28 PolarHBondContact O-N 3.34Å
27V40.6Very low39.1Very low110 Ų110133.5 Ų133.567%0.66775%0.751SS**  trans-64.794.1172.9-179.40000107.3L25 S29L25-V27 HydrophobicContact CB-CG2 4.38Å; L25-V27 PolarHBondContact O-N 3.26Å; V27-S29 PolarHBondContact O-N 3.02Å; V27-S29 PolarHBondContact O-OG 2.93Å
28C33Very low39.3Very low103 Ų103132.2 Ų132.270%0.69675%0.754SS**  trans-60.1106.6167.2-138.90000106.4C26 L30C26-C28 VanDerWaalsContact C-N 3.31Å; C26-C28 PolarHBondContact O-N 3.34Å; C28-L30 PolarHBondContact O-N 3.49Å
29S31.6Very low39.7Very low86 Ų86130.9 Ų130.960%0.60175%0.754SS**  trans-72.591.7-162.4-65.90000111V27 K31V27-S29 PolarHBondContact O-N 3.02Å; V27-S29 PolarHBondContact O-OG 2.93Å; S29-K31 PolarHBondContact O-N 3.31Å
30L36.7Very low40.3Very low140 Ų140135.2 Ų135.273%0.73376%0.763SS**  trans-72.482.9147.7-134.988.9000106.3C28 L32C28-L30 PolarHBondContact O-N 3.49Å; L30-L32 HydrophobicContact CD2-CD1 4.03Å; L30-L32 HydrophobicContact CD2-CG 4.39Å; L30-L32 PolarHBondContact O-N 3.18Å
31K36.1Very low40.8Very low198 Ų198136.3 Ų136.386%0.86176%0.762SS**  trans-67.477.8167.9-86177.8178.7167.90108.1S29 A33S29-K31 PolarHBondContact O-N 3.31Å; K31-A33 PolarHBondContact O-N 3.35Å
32L37.8Very low41.5Very low112 Ų112139.7 Ų139.759%0.58677%0.766SS**  trans-71.1112152.4-80.7159.4000105.6L30 I34L30-L32 HydrophobicContact CD2-CD1 4.03Å; L30-L32 HydrophobicContact CD2-CG 4.39Å; L30-L32 PolarHBondContact O-N 3.18Å; L32-I34 PolarHBondContact O-N 3.03Å
33A43Very low42.6Very low85 Ų85138.3 Ų138.370%0.70275%0.751SS**  trans-50.7113.3169.300000108.4K31 D35K31-A33 PolarHBondContact O-N 3.35Å; A33-D35 VanDerWaalsContact C-N 3.3Å; A33-D35 PolarHBondContact O-N 2.78Å; A33-D35 VanDerWaalsContact O-N 3.1Å
34I44.9Very low43.9Very low149 Ų149135.7 Ų135.776%0.76474%0.735SS**  trans-75.295.4163.8-62173.2000104.3L32 K36L32-I34 PolarHBondContact O-N 3.03Å; I34-K36 VanDerWaalsContact C-N 3.25Å; I34-K36 PolarHBondContact O-N 2.79Å
35D43.3Very low45.9Very low143 Ų143140.1 Ų140.177%0.76574%0.741SS**  trans-58.495.1166-85.8-39.9000108.4A33 G37A33-D35 VanDerWaalsContact C-N 3.3Å; A33-D35 PolarHBondContact O-N 2.78Å; A33-D35 VanDerWaalsContact O-N 3.1Å; D35-G37 VanDerWaalsContact C-N 3.27Å; D35-G37 PolarHBondContact O-N 3.05Å
36K41.2Very low47.6Very low205 Ų205134.8 Ų134.889%0.89171%0.713SS**THydrogen-bonded Turntrans-66.586.8166.1-70.5178.6175.9179.60107.4I34I34-K36 VanDerWaalsContact C-N 3.25Å; I34-K36 PolarHBondContact O-N 2.79Å
37G42.3Very low49.9Very low78 Ų78134.2 Ų134.280%0.80470%0.702SS**THydrogen-bonded Turntrans155-8.5169.200000118.3D35D35-G37 VanDerWaalsContact C-N 3.27Å; D35-G37 PolarHBondContact O-N 3.05Å
38G41.8Very low51.8Low59 Ų59135.1 Ų135.161%0.60870%0.698SS**  trans-79.9125179.700000112.9K40G38-K40 PolarHBondContact O-N 3.37Å
39K47.4Very low54.2Low208 Ų208138.4 Ų138.490%0.90470%0.701SS**  trans-46.1114.8162.5-92.3174.8175.2173.20108.2R41K39-R41 PolarHBondContact O-N 3.02Å
40K54.5Low56.5Low206 Ų206138.3 Ų138.390%0.89669%0.691SS**  trans-54.8106.5171.6-75.9-176177.7-179.40107.4G38 K42G38-K40 PolarHBondContact O-N 3.37Å; K40-K42 PolarHBondContact O-N 3.25Å
41R53.1Low58.7Low221 Ų221132.1 Ų132.183%0.83466%0.659SS**  trans-55.8129.1169.7-73.2-177.2-178.4165.70.7106.5K39 M43K39-R41 PolarHBondContact O-N 3.02Å; R41-M43 VanDerWaalsContact C-N 3.35Å; R41-M43 PolarHBondContact O-N 3.3Å
42K57.3Low61Low206 Ų206126.9 Ų126.990%0.89664%0.637SS**  trans-64.6101.7173.5-74.6-177.5179.1-179.60106.3K40K40-K42 PolarHBondContact O-N 3.25Å
43M60.5Low63.1Low105 Ų105128.2 Ų128.252%0.51764%0.64SS.*  trans-67.3135.2173.5-61.8-69.5-165.700107.9R41 K45 Q210R41-M43 VanDerWaalsContact C-N 3.35Å; R41-M43 PolarHBondContact O-N 3.3Å; M43-K45 PolarHBondContact O-N 3.11Å; M43-Q210 VanDerWaalsContact CE-OE1 3.27Å; M43-Q210 VanDerWaalsContact CG-OE1 3.26Å; M43-Q210 PolarHBondContact SD-OE1 3.4Å; M43-Q210 VanDerWaalsContact SD-OE1 3.34Å
44V70.1Confident64.9Low66 Ų66126.9 Ų126.940%0.462%0.618SS.*  trans-70.1119171.2-178.70000106.5L46 D203 S207V44-L46 HydrophobicContact CG1-CD2 3.9Å; V44-L46 PolarHBondContact O-N 2.97Å; V44-L46 VanDerWaalsContact O-N 3.13Å; V44-D203 HydrophobicContact CG2-CB 4.1Å; V44-S207 PolarHBondContact N-OG 3.44Å; V44-S207 PolarHBondContact O-OG 2.96Å
45K75.8Confident66.7Low199 Ų199120 Ų12087%0.86558%0.583SS**  trans-70.3105.7169-67.9-177.1179.5-177.90106.4M43M43-K45 PolarHBondContact O-N 3.11Å
46L75.3Confident68.9Low29 Ų29118 Ų11815%0.15257%0.572CS.*  trans-83.8136.4174.1-62.6175000108.5V44 E50 I51 V204 S207 L208V44-L46 HydrophobicContact CG1-CD2 3.9Å; V44-L46 PolarHBondContact O-N 2.97Å; V44-L46 VanDerWaalsContact O-N 3.13Å; L46-E50 WeakPolarHBondContact CA-OE2 3.41Å; L46-E50 VanDerWaalsContact CD2-OE2 3.25Å; L46-E50 WeakPolarHBondContact CD2-OE2 3.28Å; L46-I51 HydrophobicContact CB-CD1 4.16Å; L46-I51 HydrophobicContact CB-CG1 3.8Å; L46-I51 HydrophobicContact CD1-CG1 4.24Å; L46-V204 HydrophobicContact CD1-CG1 4.02Å; L46-V204 HydrophobicContact CD2-CG1 4.29Å; L46-V204 HydrophobicContact CD2-CG2 4.43Å; L46-S207 VanDerWaalsContact CD1-CB 3.47Å; L46-L208 HydrophobicContact CD1-CD2 3.99Å; L46-L208 HydrophobicContact CD1-CG 4.05Å
47D81.9Confident71.2Confident111 Ų111108.7 Ų108.759%0.59453%0.532SS*.  trans-72.1153.4170.9-74.7-28.2000110K49 E50 I51D47-K49 PolarHBondContact O-N 3.12Å; D47-K49 VanDerWaalsContact O-N 3.08Å; D47-E50 HydrophobicContact CB-CG 4.31Å; D47-E50 PolarHBondContact N-OE2 2.75Å; D47-E50 WeakPolarHBondContact O-CB 3.25Å; D47-E50 PolarHBondContact O-N 3.18Å; D47-I51 PolarHBondContact O-N 2.75Å
48E79.7Confident73.5Confident128 Ų128110.3 Ų110.360%0.59853%0.526SS*.Hα-helixtrans-54.5-34.4-178.9-170.2178.6172.500112.3I51 Q52 I57E48-I51 PolarHBondContact O-N 3.13Å; E48-Q52 VanDerWaalsContact O-CG 3.26Å; E48-Q52 WeakPolarHBondContact O-CG 3.36Å; E48-Q52 PolarHBondContact O-N 3.29Å; E48-Q52 PolarHBondContact OE1-NE2 3.33Å; E48-I57 HydrophobicContact CG-CD1 4.15Å
49K83.1Confident76Confident173 Ų173109.3 Ų109.375%0.75251%0.51SS*.Hα-helixtrans-66.5-38177.3-62.1-179.1-178.2177.50113D47 I51 Q52 Q53D47-K49 PolarHBondContact O-N 3.12Å; D47-K49 VanDerWaalsContact O-N 3.08Å; K49-I51 VanDerWaalsContact C-N 3.33Å; K49-Q52 PolarHBondContact O-N 3.04Å; K49-Q53 PolarHBondContact O-N 3.48Å
50E81.1Confident78.2Confident84 Ų8499.5 Ų99.539%0.39347%0.467SS..Hα-helixtrans-69.4-37.2178.3-61.6-179.3155.200110.4L46 D47 Q53 Y54L46-E50 WeakPolarHBondContact CA-OE2 3.41Å; L46-E50 VanDerWaalsContact CD2-OE2 3.25Å; L46-E50 WeakPolarHBondContact CD2-OE2 3.28Å; D47-E50 HydrophobicContact CB-CG 4.31Å; D47-E50 PolarHBondContact N-OE2 2.75Å; D47-E50 WeakPolarHBondContact O-CB 3.25Å; D47-E50 PolarHBondContact O-N 3.18Å; E50-Q53 WeakPolarHBondContact O-CB 3.41Å; E50-Q53 PolarHBondContact O-N 3.46Å; E50-Y54 WeakPolarHBondContact O-CD2 3.32Å
51I82.1Confident80.1Confident10 Ų1091.9 Ų91.95%0.05144%0.436CS..Hα-helixtrans-66.7-44.9175.9-58.4175.6000110.3L46 D47 E48 K49 Q53 Y54 L55 I57 L208 H211L46-I51 HydrophobicContact CB-CD1 4.16Å; L46-I51 HydrophobicContact CB-CG1 3.8Å; L46-I51 HydrophobicContact CD1-CG1 4.24Å; D47-I51 PolarHBondContact O-N 2.75Å; E48-I51 PolarHBondContact O-N 3.13Å; K49-I51 VanDerWaalsContact C-N 3.33Å; I51-Q53 PolarHBondContact O-N 3.32Å; I51-Y54 PolarHBondContact O-N 3.01Å; I51-L55 HydrophobicContact CG2-CB 4.38Å; I51-L55 HydrophobicContact CG2-CD1 4.35Å; I51-L55 PolarHBondContact O-N 3.25Å; I51-I57 HydrophobicContact CB-CD1 3.84Å; I51-I57 HydrophobicContact CG2-CD1 3.48Å; I51-I57 VanDerWaalsContact CG2-CD1 3.48Å; I51-I57 HydrophobicContact CG2-CG1 3.88Å; I51-L208 HydrophobicContact CB-CD2 4.13Å; I51-L208 HydrophobicContact CG1-CD2 4.03Å; I51-L208 HydrophobicContact CG2-CD2 3.8Å; I51-H211 HydrophobicContact CD1-CB 4.39Å
52Q84.8Confident82.1Confident88 Ų8884 Ų8441%0.41142%0.418SS..Hα-helixtrans-58-29.9178.8-76.6175500113.2E48 K49 Y54 L55 I57E48-Q52 VanDerWaalsContact O-CG 3.26Å; E48-Q52 WeakPolarHBondContact O-CG 3.36Å; E48-Q52 PolarHBondContact O-N 3.29Å; E48-Q52 PolarHBondContact OE1-NE2 3.33Å; K49-Q52 PolarHBondContact O-N 3.04Å; Q52-Y54 VanDerWaalsContact C-N 3.27Å; Q52-Y54 PolarHBondContact O-N 2.92Å; Q52-L55 WeakPolarHBondContact CA-O 3.16Å; Q52-I57 HydrophobicContact CG-CB 4.43Å; Q52-I57 HydrophobicContact CG-CD1 3.56Å; Q52-I57 HydrophobicContact CG-CG1 3.96Å
53Q81.9Confident84Confident139 Ų13977.7 Ų77.765%0.6539%0.392SS*.Hα-helixtrans-63.2-33.6176.8-172.6177.92.600112.7K49 E50 I51K49-Q53 PolarHBondContact O-N 3.48Å; E50-Q53 WeakPolarHBondContact O-CB 3.41Å; E50-Q53 PolarHBondContact O-N 3.46Å; I51-Q53 PolarHBondContact O-N 3.32Å
54Y80.4Confident85.6Confident57 Ų5772.8 Ų72.822%0.22437%0.368CS..Hα-helixtrans-103.1-31-175.2-58.3-69000113.1E50 I51 Q52 K196 L200 V204 L208E50-Y54 WeakPolarHBondContact O-CD2 3.32Å; I51-Y54 PolarHBondContact O-N 3.01Å; Q52-Y54 VanDerWaalsContact C-N 3.27Å; Q52-Y54 PolarHBondContact O-N 2.92Å; Y54-K196 PolarHBondContact O-NZ 2.94Å; Y54-L200 HydrophobicContact CD1-CD2 3.43Å; Y54-L200 VanDerWaalsContact CD1-CD2 3.43Å; Y54-L200 HydrophobicContact CD1-CG 4.2Å; Y54-L200 HydrophobicContact CD2-CD2 3.89Å; Y54-L200 HydrophobicContact CE1-CD2 3.29Å; Y54-L200 HydrophobicContact CE1-CG 4.24Å; Y54-L200 HydrophobicContact CE2-CD2 3.79Å; Y54-L200 HydrophobicContact CG-CD2 3.72Å; Y54-L200 VanDerWaalsContact CZ-CD2 3.49Å; Y54-V204 HydrophobicContact CE2-CG1 4.27Å; Y54-L208 HydrophobicContact CD2-CD1 4.23Å; Y54-L208 HydrophobicContact CG-CD1 4.27Å
55L83Confident86.9Confident6 Ų674.8 Ų74.83%0.03137%0.373CS..SBendtrans-127.7130-175.7-76.7175.9000110.9I51 Q52 I57 Y189 M193 L208 L212I51-L55 HydrophobicContact CG2-CB 4.38Å; I51-L55 HydrophobicContact CG2-CD1 4.35Å; I51-L55 PolarHBondContact O-N 3.25Å; Q52-L55 WeakPolarHBondContact CA-O 3.16Å; L55-I57 VanDerWaalsContact C-N 3.33Å; L55-I57 PolarHBondContact O-N 3.25Å; L55-Y189 HydrophobicContact CD2-CD1 4.41Å; L55-M193 HydrophobicContact CD1-CG 4.3Å; L55-M193 HydrophobicContact CD1-SD 3.76Å; L55-M193 HydrophobicContact CD2-CG 3.45Å; L55-M193 VanDerWaalsContact CD2-CG 3.45Å; L55-M193 HydrophobicContact CD2-SD 3.95Å; L55-M193 HydrophobicContact CG-CG 4.06Å; L55-M193 HydrophobicContact CG-SD 4.18Å; L55-L208 HydrophobicContact CD1-CB 4.45Å; L55-L208 HydrophobicContact CD1-CD2 4.09Å; L55-L212 HydrophobicContact CD1-CD2 3.94Å; L55-L212 HydrophobicContact CD1-CG 4.19Å
56D88.7Confident87.9Confident100 Ų10067.3 Ų67.354%0.53535%0.348SS..  trans-73.187.5170.4-58.5-39000109.7T58 S59 M60D56-T58 VanDerWaalsContact C-N 3.26Å; D56-T58 PolarHBondContact O-N 3.05Å; D56-S59 WeakPolarHBondContact CB-OG 3.45Å; D56-S59 PolarHBondContact O-OG 3.05Å; D56-M60 PolarHBondContact O-N 3.35Å
57I89.7Confident88.9Confident10 Ų1067 Ų675%0.05135%0.346CS..Hα-helixtrans-62.6-37-177.8-55.8-178.7000111.1E48 I51 Q52 L55 M60 N61E48-I57 HydrophobicContact CG-CD1 4.15Å; I51-I57 HydrophobicContact CB-CD1 3.84Å; I51-I57 HydrophobicContact CG2-CD1 3.48Å; I51-I57 VanDerWaalsContact CG2-CD1 3.48Å; I51-I57 HydrophobicContact CG2-CG1 3.88Å; Q52-I57 HydrophobicContact CG-CB 4.43Å; Q52-I57 HydrophobicContact CG-CD1 3.56Å; Q52-I57 HydrophobicContact CG-CG1 3.96Å; L55-I57 VanDerWaalsContact C-N 3.33Å; L55-I57 PolarHBondContact O-N 3.25Å; I57-M60 HydrophobicContact CG2-CE 4.35Å; I57-M60 PolarHBondContact O-N 3.43Å; I57-N61 WeakPolarHBondContact O-CB 3.36Å; I57-N61 PolarHBondContact O-N 3.04Å
58T92.2Very high89.6Confident111 Ų11162.4 Ų62.468%0.68132%0.321SS*.Hα-helixtrans-64-45.6-177.450.70000112.2D56 A62D56-T58 VanDerWaalsContact C-N 3.26Å; D56-T58 PolarHBondContact O-N 3.05Å; T58-A62 WeakPolarHBondContact O-CB 3.34Å; T58-A62 PolarHBondContact O-N 3.38Å; T58-A62 VanDerWaalsContact O-N 3.09Å
59S93.2Very high90.4Very high38 Ų3858.1 Ų58.127%0.26631%0.308SS..Hα-helixtrans-69.3-40.4177.657.80000111.6D56 N61 A62 E63 Y189D56-S59 WeakPolarHBondContact CB-OG 3.45Å; D56-S59 PolarHBondContact O-OG 3.05Å; S59-N61 PolarHBondContact O-N 3.27Å; S59-A62 PolarHBondContact O-N 2.93Å; S59-E63 WeakPolarHBondContact O-CG 3.47Å; S59-E63 PolarHBondContact O-N 2.91Å; S59-Y189 PolarHBondContact OG-OH 3.33Å
60M93Very high91Very high2 Ų254.1 Ų54.11%0.0129%0.29CS..Hα-helixtrans-59-49.8175.7-178.2-173.860.300111.7D56 I57 A62 E63 M64 Y189 L212 T215D56-M60 PolarHBondContact O-N 3.35Å; I57-M60 HydrophobicContact CG2-CE 4.35Å; I57-M60 PolarHBondContact O-N 3.43Å; M60-A62 VanDerWaalsContact C-N 3.32Å; M60-A62 PolarHBondContact O-N 2.9Å; M60-E63 PolarHBondContact O-N 2.97Å; M60-M64 VanDerWaalsContact O-CG 3.27Å; M60-M64 WeakPolarHBondContact O-CG 3.32Å; M60-M64 PolarHBondContact O-N 2.86Å; M60-Y189 VanDerWaalsContact CA-CZ 3.49Å; M60-Y189 WeakPolarHBondContact CA-OH 3.38Å; M60-Y189 HydrophobicContact CB-CD1 4.27Å; M60-Y189 HydrophobicContact CB-CD2 4.3Å; M60-Y189 HydrophobicContact CB-CE1 3.79Å; M60-Y189 HydrophobicContact CB-CE2 3.89Å; M60-Y189 HydrophobicContact CG-CD2 3.95Å; M60-Y189 HydrophobicContact CG-CE1 4.44Å; M60-Y189 HydrophobicContact CG-CE2 3.91Å; M60-Y189 HydrophobicContact CG-CG 4.32Å; M60-Y189 PolarHBondContact N-OH 3.21Å; M60-L212 HydrophobicContact CE-CD2 4.29Å; M60-L212 HydrophobicContact SD-CD2 3.26Å; M60-L212 WeakPolarHBondContact SD-CD2 3.37Å; M60-T215 HydrophobicContact CE-CG2 3.87Å
61N94.6Very high91.7Very high46 Ų4650.1 Ų50.125%0.24627%0.272CS..Hα-helixtrans-63.5-39.7179.6-73.6-16.1000111.4I57 S59 M64 E65I57-N61 WeakPolarHBondContact O-CB 3.36Å; I57-N61 PolarHBondContact O-N 3.04Å; S59-N61 PolarHBondContact O-N 3.27Å; N61-M64 PolarHBondContact O-N 2.98Å; N61-E65 WeakPolarHBondContact O-CB 3.49Å; N61-E65 VanDerWaalsContact O-CG 3.28Å; N61-E65 WeakPolarHBondContact O-CG 3.25Å; N61-E65 PolarHBondContact O-N 3.2Å
62A96.1Very high92.4Very high55 Ų5555.1 Ų55.146%0.45529%0.293SS..Hα-helixtrans-62.4-42.2176.100000112.6T58 S59 M60 E65 A66T58-A62 WeakPolarHBondContact O-CB 3.34Å; T58-A62 PolarHBondContact O-N 3.38Å; T58-A62 VanDerWaalsContact O-N 3.09Å; S59-A62 PolarHBondContact O-N 2.93Å; M60-A62 VanDerWaalsContact C-N 3.32Å; M60-A62 PolarHBondContact O-N 2.9Å; A62-E65 PolarHBondContact O-N 2.95Å; A62-A66 WeakPolarHBondContact O-CB 3.46Å; A62-A66 PolarHBondContact O-N 3.29Å
63E95.9Very high92.8Very high74 Ų7459 Ų5935%0.34630%0.304SS..Hα-helixtrans-64.4-44.3175.6-74.3177.1-143.600111.9S59 M60 E65 A66 E67 V185 Y189S59-E63 WeakPolarHBondContact O-CG 3.47Å; S59-E63 PolarHBondContact O-N 2.91Å; M60-E63 PolarHBondContact O-N 2.97Å; E63-E65 PolarHBondContact O-N 3.44Å; E63-A66 WeakPolarHBondContact O-CB 3.39Å; E63-A66 PolarHBondContact O-N 2.86Å; E63-E67 PolarHBondContact O-N 3.4Å; E63-E67 VanDerWaalsContact O-N 3.12Å; E63-V185 HydrophobicContact CB-CG1 3.98Å; E63-Y189 VanDerWaalsContact CD-OH 3.28Å; E63-Y189 PolarHBondContact OE1-OH 2.94Å
64M95.1Very high93.3Very high2 Ų253.8 Ų53.81%0.0128%0.279CS..Hα-helixtrans-64.2-40.3177.2-65.3-65.4-170.500112M60 N61 E67 L68 L182 V185 M186 Y219M60-M64 VanDerWaalsContact O-CG 3.27Å; M60-M64 WeakPolarHBondContact O-CG 3.32Å; M60-M64 PolarHBondContact O-N 2.86Å; N61-M64 PolarHBondContact O-N 2.98Å; M64-E67 PolarHBondContact O-N 3.46Å; M64-L68 PolarHBondContact O-N 3.21Å; M64-L68 VanDerWaalsContact O-N 3.16Å; M64-L182 HydrophobicContact CB-CD2 4.24Å; M64-L182 HydrophobicContact CG-CD2 4.43Å; M64-L182 HydrophobicContact SD-CB 4.26Å; M64-L182 HydrophobicContact SD-CD2 3.37Å; M64-L182 WeakPolarHBondContact SD-CD2 3.49Å; M64-L182 HydrophobicContact SD-CG 4.41Å; M64-V185 HydrophobicContact CE-CB 3.83Å; M64-V185 HydrophobicContact CE-CG1 3.54Å; M64-V185 HydrophobicContact CG-CG1 4.27Å; M64-V185 HydrophobicContact SD-CB 3.9Å; M64-V185 HydrophobicContact SD-CG1 3.76Å; M64-M186 HydrophobicContact CE-CB 4.21Å; M64-Y219 HydrophobicContact CB-CD1 3.95Å; M64-Y219 HydrophobicContact CB-CD2 3.77Å; M64-Y219 HydrophobicContact CB-CE1 3.99Å; M64-Y219 HydrophobicContact CB-CE2 3.81Å; M64-Y219 HydrophobicContact CB-CG 3.87Å; M64-Y219 HydrophobicContact CG-CD2 4.11Å; M64-Y219 HydrophobicContact CG-CE2 4.28Å
65E96.6Very high93.9Very high108 Ų10851.4 Ų51.451%0.50527%0.27SS..Hα-helixtrans-66-37.7174.9-76.1176.9-174.600112.5N61 A62 E63 E67 L68 A69 Y219N61-E65 WeakPolarHBondContact O-CB 3.49Å; N61-E65 VanDerWaalsContact O-CG 3.28Å; N61-E65 WeakPolarHBondContact O-CG 3.25Å; N61-E65 PolarHBondContact O-N 3.2Å; A62-E65 PolarHBondContact O-N 2.95Å; E63-E65 PolarHBondContact O-N 3.44Å; E65-E67 VanDerWaalsContact C-N 3.32Å; E65-E67 PolarHBondContact O-N 2.95Å; E65-L68 PolarHBondContact O-N 3.19Å; E65-A69 WeakPolarHBondContact O-CB 3.5Å; E65-A69 PolarHBondContact O-N 3.4Å; E65-Y219 HydrophobicContact CG-CE1 3.65Å; E65-Y219 PolarHBondContact OE1-OH 3.15Å
66A97.4Very high94.2Very high43 Ų4355 Ų5536%0.35530%0.296SS..Hα-helixtrans-61.9-39.4174.500000111.7A62 E63 A69 K70A62-A66 WeakPolarHBondContact O-CB 3.46Å; A62-A66 PolarHBondContact O-N 3.29Å; E63-A66 WeakPolarHBondContact O-CB 3.39Å; E63-A66 PolarHBondContact O-N 2.86Å; A66-A69 PolarHBondContact O-N 3.3Å; A66-K70 VanDerWaalsContact O-CG 3.32Å; A66-K70 WeakPolarHBondContact O-CG 3.47Å; A66-K70 PolarHBondContact O-N 2.84Å
67E96.6Very high94.1Very high21 Ų2156.7 Ų56.710%0.09830%0.3CS..Hα-helixtrans-65.8-40.6174.9-69.2-51.6135.300112.7E63 M64 E65 A69 K70 L71 R181 L182 V185E63-E67 PolarHBondContact O-N 3.4Å; E63-E67 VanDerWaalsContact O-N 3.12Å; M64-E67 PolarHBondContact O-N 3.46Å; E65-E67 VanDerWaalsContact C-N 3.32Å; E65-E67 PolarHBondContact O-N 2.95Å; E67-A69 VanDerWaalsContact C-N 3.35Å; E67-K70 WeakPolarHBondContact O-CB 3.35Å; E67-K70 PolarHBondContact O-N 3.08Å; E67-K70 IonicContact OE1-NZ 3.47Å; E67-K70 PolarHBondContact OE1-NZ 3.49Å; E67-K70 IonicContact OE2-NZ 2.68Å; E67-L71 PolarHBondContact O-N 3.15Å; E67-R181 HydrophobicContact CG-CB 4.21Å; E67-R181 WeakPolarHBondContact OE2-CB 3.46Å; E67-R181 WeakPolarHBondContact OE2-CD 3.4Å; E67-R181 IonicContact OE2-NH1 2.72Å; E67-L182 HydrophobicContact CB-CD2 4.01Å; E67-V185 HydrophobicContact CG-CG2 4.38Å
68L95.9Very high93.9Very high16 Ų1660.6 Ų60.68%0.08432%0.319CS..Hα-helixtrans-64.8-38172.2-73.7-171.2000112.4M64 E65 K70 L71 K72 Y219 K222M64-L68 PolarHBondContact O-N 3.21Å; M64-L68 VanDerWaalsContact O-N 3.16Å; E65-L68 PolarHBondContact O-N 3.19Å; L68-K70 VanDerWaalsContact C-N 3.35Å; L68-L71 WeakPolarHBondContact O-CB 3.37Å; L68-L71 PolarHBondContact O-N 3.39Å; L68-K72 WeakPolarHBondContact O-CG 3.38Å; L68-K72 PolarHBondContact O-N 2.73Å; L68-Y219 HydrophobicContact CD1-CD1 3.6Å; L68-Y219 HydrophobicContact CD1-CE1 4.28Å; L68-Y219 HydrophobicContact CG-CD1 4.23Å; L68-K222 HydrophobicContact CD1-CB 3.87Å; L68-K222 HydrophobicContact CD1-CD 4.04Å
69A97Very high93.5Very high37 Ų3755.7 Ų55.731%0.30629%0.288SS..Hα-helixtrans-64.9-39.217600000111.6E65 A66 E67 K72 R73E65-A69 WeakPolarHBondContact O-CB 3.5Å; E65-A69 PolarHBondContact O-N 3.4Å; A66-A69 PolarHBondContact O-N 3.3Å; E67-A69 VanDerWaalsContact C-N 3.35Å; A69-K72 PolarHBondContact O-N 3.41Å; A69-R73 WeakPolarHBondContact O-CG 3.26Å; A69-R73 PolarHBondContact O-N 3.44Å
70K96.8Very high92.9Very high89 Ų8955.5 Ų55.539%0.38729%0.287SS..Hα-helixtrans-60.3-45.4172-72.3170.9-171.2172.80111.3A66 E67 L68 K72 R73 Q74A66-K70 VanDerWaalsContact O-CG 3.32Å; A66-K70 WeakPolarHBondContact O-CG 3.47Å; A66-K70 PolarHBondContact O-N 2.84Å; E67-K70 WeakPolarHBondContact O-CB 3.35Å; E67-K70 PolarHBondContact O-N 3.08Å; E67-K70 IonicContact OE1-NZ 3.47Å; E67-K70 PolarHBondContact OE1-NZ 3.49Å; E67-K70 IonicContact OE2-NZ 2.68Å; L68-K70 VanDerWaalsContact C-N 3.35Å; K70-K72 PolarHBondContact O-N 3.06Å; K70-R73 PolarHBondContact O-N 3.14Å; K70-Q74 WeakPolarHBondContact O-CG 3.23Å; K70-Q74 PolarHBondContact O-N 3.35Å
71L95.8Very high91.9Very high1 Ų157.6 Ų57.61%0.00530%0.297CS..Hα-helixtrans-58.1-46.3176.6-178.565.3000111.7E67 L68 R73 Q74 Y75 L174 C178E67-L71 PolarHBondContact O-N 3.15Å; L68-L71 WeakPolarHBondContact O-CB 3.37Å; L68-L71 PolarHBondContact O-N 3.39Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.33Å; L71-Q74 PolarHBondContact O-N 2.93Å; L71-Y75 HydrophobicContact CD1-CD1 4.17Å; L71-Y75 HydrophobicContact CD1-CE1 3.65Å; L71-Y75 HydrophobicContact CD1-CE2 4.24Å; L71-Y75 HydrophobicContact CD2-CE2 4.25Å; L71-Y75 HydrophobicContact CG-CD2 4.41Å; L71-Y75 HydrophobicContact CG-CE1 4.3Å; L71-Y75 HydrophobicContact CG-CE2 4.03Å; L71-Y75 PolarHBondContact O-N 2.9Å; L71-L174 HydrophobicContact CD1-CB 4.07Å; L71-C178 HydrophobicContact CB-CB 4.35Å; L71-C178 HydrophobicContact CD1-CB 4.07Å; L71-C178 HydrophobicContact CD2-CB 4.05Å; L71-C178 HydrophobicContact CG-CB 4.38Å
72K94.7Very high90.5Very high115 Ų11561.1 Ų61.150%0.531%0.312SS..Hα-helixtrans-58-43.5176.1-71.7179.1-179.7-179.90112.2L68 A69 K70 Y75 S76 L226L68-K72 WeakPolarHBondContact O-CG 3.38Å; L68-K72 PolarHBondContact O-N 2.73Å; A69-K72 PolarHBondContact O-N 3.41Å; K70-K72 PolarHBondContact O-N 3.06Å; K72-Y75 PolarHBondContact O-N 3.22Å; K72-S76 PolarHBondContact O-N 3.39Å; K72-S76 PolarHBondContact O-OG 2.91Å; K72-L226 HydrophobicContact CG-CD1 4.12Å
73R94.1Very high88.9Confident168 Ų16862.1 Ų62.163%0.63431%0.31SS*.Hα-helixtrans-62.6-44.5176.3-69.3174.8-173169.92.8111.8A69 K70 L71 Y75 S76 Q77A69-R73 WeakPolarHBondContact O-CG 3.26Å; A69-R73 PolarHBondContact O-N 3.44Å; K70-R73 PolarHBondContact O-N 3.14Å; L71-R73 VanDerWaalsContact C-N 3.33Å; L71-R73 PolarHBondContact O-N 3.33Å; R73-Y75 VanDerWaalsContact C-N 3.34Å; R73-Y75 PolarHBondContact O-N 3.18Å; R73-S76 PolarHBondContact O-N 2.93Å; R73-Q77 WeakPolarHBondContact O-CG 3.47Å; R73-Q77 PolarHBondContact O-N 2.89Å
74Q93.4Very high87.4Confident30 Ų3060.6 Ų60.614%0.1431%0.305CS..Hα-helixtrans-61.5-41.7177.4-70.4179-62.300111.6K70 L71 Q77 Q78 L174K70-Q74 WeakPolarHBondContact O-CG 3.23Å; K70-Q74 PolarHBondContact O-N 3.35Å; L71-Q74 PolarHBondContact O-N 2.93Å; Q74-Q77 PolarHBondContact O-N 3.27Å; Q74-Q78 WeakPolarHBondContact O-CB 3.24Å; Q74-Q78 PolarHBondContact O-N 3.5Å; Q74-L174 HydrophobicContact CB-CD1 4.26Å; Q74-L174 HydrophobicContact CB-CD2 4.37Å
75Y92.8Very high86.4Confident7 Ų762.3 Ų62.33%0.02731%0.314CS..Hα-helixtrans-61.5-44.8174.6-73.4-8.6000112.4L71 K72 R73 Q77 L79 A171 L174 L226 K230L71-Y75 HydrophobicContact CD1-CD1 4.17Å; L71-Y75 HydrophobicContact CD1-CE1 3.65Å; L71-Y75 HydrophobicContact CD1-CE2 4.24Å; L71-Y75 HydrophobicContact CD2-CE2 4.25Å; L71-Y75 HydrophobicContact CG-CD2 4.41Å; L71-Y75 HydrophobicContact CG-CE1 4.3Å; L71-Y75 HydrophobicContact CG-CE2 4.03Å; L71-Y75 PolarHBondContact O-N 2.9Å; K72-Y75 PolarHBondContact O-N 3.22Å; R73-Y75 VanDerWaalsContact C-N 3.34Å; R73-Y75 PolarHBondContact O-N 3.18Å; Y75-Q77 VanDerWaalsContact C-N 3.31Å; Y75-Q77 PolarHBondContact O-N 3.49Å; Y75-L79 HydrophobicContact CD1-CD1 3.27Å; Y75-L79 HydrophobicContact CD1-CG 4.21Å; Y75-L79 HydrophobicContact CE1-CD1 3.67Å; Y75-L79 HydrophobicContact CG-CD1 3.87Å; Y75-L79 CarbonylContact O-C 3.6Å; Y75-L79 WeakPolarHBondContact O-CA 3.34Å; Y75-L79 VanDerWaalsContact O-CB 3.31Å; Y75-L79 WeakPolarHBondContact O-CB 3.36Å; Y75-L79 PolarHBondContact O-N 3.42Å; Y75-A171 HydrophobicContact CE1-CB 4.35Å; Y75-A171 PolarHBondContact OH-O 3.12Å; Y75-L174 HydrophobicContact CD1-CB 4.4Å; Y75-L174 HydrophobicContact CD1-CD1 3.72Å; Y75-L174 HydrophobicContact CE1-CB 3.78Å; Y75-L174 HydrophobicContact CE1-CD1 3.86Å; Y75-L226 HydrophobicContact CE2-CB 4.28Å; Y75-K230 HydrophobicContact CD2-CG 3.79Å; Y75-K230 HydrophobicContact CE2-CG 4.15Å; Y75-K230 HydrophobicContact CG-CG 4.44Å
76S88.8Confident85.4Confident81 Ų8158.5 Ų58.557%0.56630%0.304SS*.Hα-helixtrans-63.3-36.3177-59.20000113K72 R73 S80 N83K72-S76 PolarHBondContact O-N 3.39Å; K72-S76 PolarHBondContact O-OG 2.91Å; R73-S76 PolarHBondContact O-N 2.93Å; S76-S80 VanDerWaalsContact O-CB 3.3Å; S76-S80 WeakPolarHBondContact O-CB 3.13Å; S76-N83 PolarHBondContact O-ND2 3.44Å
77Q85.6Confident84.5Confident136 Ų13658.6 Ų58.664%0.63631%0.305SS*.Hα-helixtrans-79.8-39.7-178.4-71.5174-11.900113.4R73 Q74 Y75 N83R73-Q77 WeakPolarHBondContact O-CG 3.47Å; R73-Q77 PolarHBondContact O-N 2.89Å; Q74-Q77 PolarHBondContact O-N 3.27Å; Y75-Q77 VanDerWaalsContact C-N 3.31Å; Y75-Q77 PolarHBondContact O-N 3.49Å; Q77-N83 PolarHBondContact O-ND2 2.85Å
78Q86.8Confident83.9Confident93 Ų9357.6 Ų57.644%0.43530%0.3SS..Hα-helixtrans-102.8-28.4-171.2-61.2-171.8-2.600113.9Q74 N170Q74-Q78 WeakPolarHBondContact O-CB 3.24Å; Q74-Q78 PolarHBondContact O-N 3.5Å; Q78-N170 PolarHBondContact OE1-ND2 3.21Å
79L84.3Confident83.2Confident8 Ų860.6 Ų60.64%0.04231%0.314CS..SBendtrans-111.714.4-171.7-51.4179.8000112.8Y75 M81 M167 N170 A171 L174Y75-L79 HydrophobicContact CD1-CD1 3.27Å; Y75-L79 HydrophobicContact CD1-CG 4.21Å; Y75-L79 HydrophobicContact CE1-CD1 3.67Å; Y75-L79 HydrophobicContact CG-CD1 3.87Å; Y75-L79 CarbonylContact O-C 3.6Å; Y75-L79 WeakPolarHBondContact O-CA 3.34Å; Y75-L79 VanDerWaalsContact O-CB 3.31Å; Y75-L79 WeakPolarHBondContact O-CB 3.36Å; Y75-L79 PolarHBondContact O-N 3.42Å; L79-M81 PolarHBondContact O-N 3.02Å; L79-M167 HydrophobicContact CD2-CB 4.19Å; L79-M167 WeakPolarHBondContact CD2-O 3.36Å; L79-N170 HydrophobicContact CD2-CB 4.03Å; L79-A171 HydrophobicContact CD1-CB 3.48Å; L79-A171 VanDerWaalsContact CD1-CB 3.48Å; L79-L174 HydrophobicContact CD1-CD1 4.35Å; L79-L174 HydrophobicContact CG-CD1 4.43Å
80S79.9Confident82.6Confident33 Ų3363.8 Ų63.823%0.23133%0.33CS..  trans-79.5121.3172.1172.80000109.9S76 Q82 N83S76-S80 VanDerWaalsContact O-CB 3.3Å; S76-S80 WeakPolarHBondContact O-CB 3.13Å; S80-Q82 PolarHBondContact O-N 3.36Å; S80-Q82 VanDerWaalsContact O-N 3.13Å; S80-Q82 PolarHBondContact OG-N 2.95Å; S80-N83 WeakPolarHBondContact CB-OD1 3.48Å; S80-N83 PolarHBondContact O-N 3.14Å; S80-N83 VanDerWaalsContact O-N 3.11Å; S80-N83 PolarHBondContact OG-OD1 3.41Å
81M70.9Confident82.2Confident46 Ų4660.6 Ų60.623%0.22732%0.317CS..THydrogen-bonded Turntrans-58.6-22.5172-59.9-56-56.600112.7L79 N83 P159 R164 M167 L234L79-M81 PolarHBondContact O-N 3.02Å; M81-N83 VanDerWaalsContact C-N 3.33Å; M81-P159 HydrophobicContact CE-CB 3.87Å; M81-P159 HydrophobicContact CE-CG 3.18Å; M81-R164 HydrophobicContact CE-CG 3.96Å; M81-M167 HydrophobicContact CE-CE 3.54Å; M81-M167 HydrophobicContact SD-CE 3.2Å; M81-M167 WeakPolarHBondContact SD-CE 3.28Å; M81-M167 HydrophobicContact SD-SD 3.85Å; M81-L234 HydrophobicContact CG-CD2 3.91Å; M81-L234 HydrophobicContact SD-CD2 3.28Å; M81-L234 WeakPolarHBondContact SD-CD2 3.46Å
82Q65.2Low81.9Confident120 Ų12066.8 Ų66.856%0.56135%0.346SS*.THydrogen-bonded Turntrans-82.4-10.6-178.5-59.9178.1-8.200112.8S80 V84 L112S80-Q82 PolarHBondContact O-N 3.36Å; S80-Q82 VanDerWaalsContact O-N 3.13Å; S80-Q82 PolarHBondContact OG-N 2.95Å; Q82-V84 PolarHBondContact O-N 3.35Å; Q82-L112 HydrophobicContact CB-CD1 4.22Å
83N63.8Low81.6Confident76 Ų7661.3 Ų61.341%0.40632%0.322SS..THydrogen-bonded Turntrans-79.949.4-174.2-71.47.1000113S76 Q77 S80 M81 L85S76-N83 PolarHBondContact O-ND2 3.44Å; Q77-N83 PolarHBondContact O-ND2 2.85Å; S80-N83 WeakPolarHBondContact CB-OD1 3.48Å; S80-N83 PolarHBondContact O-N 3.14Å; S80-N83 VanDerWaalsContact O-N 3.11Å; S80-N83 PolarHBondContact OG-OD1 3.41Å; M81-N83 VanDerWaalsContact C-N 3.33Å; N83-L85 VanDerWaalsContact C-N 3.29Å
84V64.5Low81.3Confident43 Ų4359.4 Ų59.426%0.26132%0.318SS..THydrogen-bonded Turntrans-79.2-21.9159-162.40000110.3Q82 G86 A87 F88 L156Q82-V84 PolarHBondContact O-N 3.35Å; V84-G86 PolarHBondContact O-N 2.82Å; V84-A87 VanDerWaalsContact O-CB 3.31Å; V84-A87 WeakPolarHBondContact O-CB 3.26Å; V84-A87 PolarHBondContact O-N 3.22Å; V84-F88 HydrophobicContact CG1-CD2 4.39Å; V84-F88 HydrophobicContact CG1-CE2 3.83Å; V84-F88 WeakPolarHBondContact O-CD2 3.49Å; V84-L156 HydrophobicContact CB-CD1 3.89Å; V84-L156 HydrophobicContact CB-CD2 4.41Å; V84-L156 HydrophobicContact CG1-CD1 4.33Å; V84-L156 HydrophobicContact CG1-CD2 3.94Å; V84-L156 HydrophobicContact CG2-CD1 4.04Å
85L74.1Confident80.9Confident37 Ų3759.2 Ų59.219%0.19432%0.319CS..Hα-helixtrans-51.2-42.7175.6-69.7179.6000112.7N83 A87 F88 E89 I110 L112N83-L85 VanDerWaalsContact C-N 3.29Å; L85-A87 PolarHBondContact O-N 3.1Å; L85-F88 PolarHBondContact O-N 2.94Å; L85-E89 WeakPolarHBondContact O-CG 3.42Å; L85-E89 PolarHBondContact O-N 3.5Å; L85-I110 HydrophobicContact CD2-CB 4.46Å; L85-I110 HydrophobicContact CD2-CG2 3.5Å; L85-L112 HydrophobicContact CD1-CD1 3.98Å; L85-L112 HydrophobicContact CD1-CG 3.93Å; L85-L112 HydrophobicContact CD2-CD2 3.79Å; L85-L112 HydrophobicContact CD2-CG 3.81Å; L85-L112 HydrophobicContact CG-CD1 4.06Å; L85-L112 HydrophobicContact CG-CD2 4.11Å; L85-L112 HydrophobicContact CG-CG 3.88Å
86G74.8Confident80.3Confident28 Ų2863 Ų6329%0.28935%0.345SS..Hα-helixtrans-60.8-29.1178.700000113.9V84 T90V84-G86 PolarHBondContact O-N 2.82Å; G86-T90 PolarHBondContact O-N 2.74Å; G86-T90 PolarHBondContact O-OG1 3.38Å
87A78.6Confident79.9Confident46 Ų4663.4 Ų63.438%0.3836%0.362SS..Hα-helixtrans-67-44174.100000110.8V84 L85 L91 M141V84-A87 VanDerWaalsContact O-CB 3.31Å; V84-A87 WeakPolarHBondContact O-CB 3.26Å; V84-A87 PolarHBondContact O-N 3.22Å; L85-A87 PolarHBondContact O-N 3.1Å; A87-L91 WeakPolarHBondContact O-CG 3.43Å; A87-M141 HydrophobicContact CB-SD 4.5Å
88F83.1Confident79.6Confident0 Ų059 Ų590%035%0.346CS..Hα-helixtrans-68.8-38.1176.1-65.6-80.7000112.6V84 L85 T90 L91 L104 I110 A118 I120 M141 V154 L156V84-F88 HydrophobicContact CG1-CD2 4.39Å; V84-F88 HydrophobicContact CG1-CE2 3.83Å; V84-F88 WeakPolarHBondContact O-CD2 3.49Å; L85-F88 PolarHBondContact O-N 2.94Å; F88-T90 PolarHBondContact O-N 3.05Å; F88-L91 HydrophobicContact CD1-CD1 3.99Å; F88-L91 WeakPolarHBondContact O-CB 3.27Å; F88-L91 PolarHBondContact O-N 3.2Å; F88-L91 VanDerWaalsContact O-N 3.14Å; F88-L104 HydrophobicContact CB-CD2 4.31Å; F88-L104 WeakPolarHBondContact O-CD2 3.36Å; F88-I110 HydrophobicContact CB-CD1 3.81Å; F88-I110 HydrophobicContact CB-CG2 4.32Å; F88-A118 HydrophobicContact CE2-CB 4.29Å; F88-I120 HydrophobicContact CD1-CD1 4.14Å; F88-I120 HydrophobicContact CE1-CD1 4.44Å; F88-M141 HydrophobicContact CD1-CE 3.89Å; F88-M141 HydrophobicContact CE1-CE 3.22Å; F88-M141 HydrophobicContact CE1-SD 4.47Å; F88-M141 HydrophobicContact CE2-CE 4.31Å; F88-M141 HydrophobicContact CZ-CE 3.46Å; F88-M141 VanDerWaalsContact CZ-CE 3.46Å; F88-M141 HydrophobicContact CZ-SD 4.27Å; F88-V154 HydrophobicContact CE1-CB 4.43Å; F88-V154 HydrophobicContact CE1-CG1 4Å; F88-V154 HydrophobicContact CE1-CG2 4.5Å; F88-V154 HydrophobicContact CZ-CB 4.32Å; F88-V154 HydrophobicContact CZ-CG1 3.8Å; F88-L156 HydrophobicContact CE2-CD2 3.43Å; F88-L156 VanDerWaalsContact CE2-CD2 3.43Å; F88-L156 HydrophobicContact CZ-CD2 3.61Å
89E82.3Confident79.2Confident79 Ų7964.6 Ų64.637%0.36937%0.369SS..Hα-helixtrans-62.5-31.7178.8-73.4169.7-168.900112.6L85 L91 N105 I110L85-E89 WeakPolarHBondContact O-CG 3.42Å; L85-E89 PolarHBondContact O-N 3.5Å; E89-L91 VanDerWaalsContact C-N 3.32Å; E89-N105 HydrophobicContact CG-CB 4.44Å; E89-I110 HydrophobicContact CG-CD1 3.99Å
90T85.1Confident79.3Confident103 Ų10371.3 Ų71.363%0.63240%0.4SS*.THydrogen-bonded Turntrans-84.8-5.5179.7-46.40000112.4G86 F88 E92G86-T90 PolarHBondContact O-N 2.74Å; G86-T90 PolarHBondContact O-OG1 3.38Å; F88-T90 PolarHBondContact O-N 3.05Å; T90-E92 PolarHBondContact O-N 3.29Å
91L87.6Confident79.6Confident23 Ų2372.4 Ų72.412%0.1241%0.407CS..  trans-69.3127.5-179.1-64-178.2000111.3A87 F88 E89 L104 I136A87-L91 WeakPolarHBondContact O-CG 3.43Å; F88-L91 HydrophobicContact CD1-CD1 3.99Å; F88-L91 WeakPolarHBondContact O-CB 3.27Å; F88-L91 PolarHBondContact O-N 3.2Å; F88-L91 VanDerWaalsContact O-N 3.14Å; E89-L91 VanDerWaalsContact C-N 3.32Å; L91-L104 HydrophobicContact CB-CB 4.3Å; L91-L104 HydrophobicContact CD1-CD2 4.46Å; L91-L104 PolarHBondContact O-N 3.45Å; L91-I136 HydrophobicContact CD1-CG1 4.27Å
92E89Confident80.5Confident131 Ų13172.6 Ų72.661%0.61241%0.41SS*.EExtended strand (participates in β ladder)trans-84.3123.3173.5-72.6-177.5-170.100110.8T90 P101T90-E92 PolarHBondContact O-N 3.29Å; E92-P101 HydrophobicContact CB-CB 3.93Å; E92-P101 HydrophobicContact CG-CB 4.22Å
93V89Confident81.6Confident0 Ų070.9 Ų70.90%040%0.404CS..EExtended strand (participates in β ladder)trans-115.3135.8177.8-176.20000108.6P95 V102 L104 I107 A131 I132 A135V93-P95 WeakPolarHBondContact O-CD 3.49Å; V93-V102 PolarHBondContact N-O 3.5Å; V93-V102 PolarHBondContact O-N 3.08Å; V93-L104 HydrophobicContact CG2-CB 3.98Å; V93-L104 HydrophobicContact CG2-CD1 3.72Å; V93-L104 HydrophobicContact CG2-CG 4.43Å; V93-I107 HydrophobicContact CB-CD1 4.11Å; V93-I107 HydrophobicContact CG1-CD1 4.25Å; V93-A131 HydrophobicContact CG1-CB 3.59Å; V93-I132 HydrophobicContact CG1-CG1 4.08Å; V93-I132 HydrophobicContact CG2-CG1 4.43Å; V93-A135 HydrophobicContact CG2-CB 3.79Å
94K88Confident82.8Confident127 Ų12767.3 Ų67.355%0.55239%0.385SS*.  trans-104.886.9172-68.5-175.5179.6-1760109.4P101 A131K94-P101 HydrophobicContact CG-CB 4.09Å; K94-A131 VanDerWaalsContact O-CB 3.28Å; K94-A131 WeakPolarHBondContact O-CB 3.47Å
95P84.3Confident84Confident26 Ų2669.5 Ų69.517%0.16940%0.396CS..  trans-65.2150.4176.426.2-32.9000110.9V93 G97 S98 I107 A128V93-P95 WeakPolarHBondContact O-CD 3.49Å; P95-G97 PolarHBondContact O-N 3.45Å; P95-S98 WeakPolarHBondContact CD-OG 3.38Å; P95-S98 VanDerWaalsContact CG-OG 3.27Å; P95-S98 WeakPolarHBondContact CG-OG 3.3Å; P95-S98 PolarHBondContact O-N 2.98Å; P95-S98 VanDerWaalsContact O-N 3.16Å; P95-S98 PolarHBondContact O-OG 3.39Å; P95-I107 HydrophobicContact CB-CD1 4.42Å; P95-I107 HydrophobicContact CG-CD1 3.83Å; P95-A128 HydrophobicContact CB-CB 4.18Å
96P80.8Confident84.6Confident86 Ų8672.3 Ų72.356%0.55842%0.418SS*.THydrogen-bonded Turntrans-58.4129.3177.225.8-33.3000110.1E127P96-E127 HydrophobicContact CG-CB 4.49Å
97G79.3Confident85.3Confident90 Ų9072 Ų7293%0.92841%0.41SS*.THydrogen-bonded Turntrans96.5-16.1-178.600000115.4P95P95-G97 PolarHBondContact O-N 3.45Å
98S79.3Confident85.8Confident44 Ų4470 Ų7031%0.30839%0.393SS..  trans-88.3136.2170.868.80000111.1P95 E100P95-S98 WeakPolarHBondContact CD-OG 3.38Å; P95-S98 VanDerWaalsContact CG-OG 3.27Å; P95-S98 WeakPolarHBondContact CG-OG 3.3Å; P95-S98 PolarHBondContact O-N 2.98Å; P95-S98 VanDerWaalsContact O-N 3.16Å; P95-S98 PolarHBondContact O-OG 3.39Å; S98-E100 PolarHBondContact OG-O 3.19Å
99K79.4Confident86.2Confident210 Ų21075.9 Ų75.991%0.91342%0.421SS*.SBendtrans-81.9-27.8173.2-68.4-176.9-179.3178.20112.1
100E86.7Confident86.5Confident149 Ų14973 Ų7370%0.69641%0.407SS*.SBendtrans-108.4146.3-174.3-64.7-176.5175.500111.2S98S98-E100 PolarHBondContact OG-O 3.19Å
101P86.5Confident86.7Confident56 Ų5670.9 Ų70.936%0.36440%0.395SS..  trans-64.9136.1170.627.7-31.2000110.5E92 K94E92-P101 HydrophobicContact CB-CB 3.93Å; E92-P101 HydrophobicContact CG-CB 4.22Å; K94-P101 HydrophobicContact CG-CB 4.09Å
102V88.6Confident86.6Confident50 Ų5072.3 Ų72.330%0.30340%0.402SS..EExtended strand (participates in β ladder)trans-116.3144.8177.2-179.70000108.6V93 I107V93-V102 PolarHBondContact N-O 3.5Å; V93-V102 PolarHBondContact O-N 3.08Å; V102-I107 HydrophobicContact CB-CD1 3.99Å; V102-I107 HydrophobicContact CG1-CD1 4.05Å; V102-I107 HydrophobicContact CG1-CG1 4.03Å
103L89Confident86.6Confident84 Ų8471.8 Ų71.844%0.4440%0.398SS..EExtended strand (participates in β ladder)trans-64.4138.6176.4-67.3164.9000110.9N105 S106L103-N105 PolarHBondContact O-N 2.96Å; L103-N105 VanDerWaalsContact O-N 3.15Å; L103-S106 WeakPolarHBondContact O-CB 3.42Å; L103-S106 PolarHBondContact O-N 3.36Å
104L88.9Confident86.4Confident1 Ų175.8 Ų75.81%0.00542%0.419CS..Hα-helixtrans-54.5-37.3-179.3-17965.9000112.3F88 L91 V93 S106 I107 A108 I110 I120 I132F88-L104 HydrophobicContact CB-CD2 4.31Å; F88-L104 WeakPolarHBondContact O-CD2 3.36Å; L91-L104 HydrophobicContact CB-CB 4.3Å; L91-L104 HydrophobicContact CD1-CD2 4.46Å; L91-L104 PolarHBondContact O-N 3.45Å; V93-L104 HydrophobicContact CG2-CB 3.98Å; V93-L104 HydrophobicContact CG2-CD1 3.72Å; V93-L104 HydrophobicContact CG2-CG 4.43Å; L104-S106 PolarHBondContact O-N 3.39Å; L104-I107 PolarHBondContact O-N 3.41Å; L104-I107 VanDerWaalsContact O-N 3.1Å; L104-A108 HydrophobicContact CD1-CB 4.15Å; L104-A108 PolarHBondContact O-N 2.95Å; L104-I110 HydrophobicContact CD2-CD1 3.94Å; L104-I110 HydrophobicContact CD2-CG1 4.41Å; L104-I110 HydrophobicContact CG-CD1 4.17Å; L104-I120 HydrophobicContact CD1-CG2 4.5Å; L104-I120 HydrophobicContact CD2-CD1 4.24Å; L104-I132 HydrophobicContact CD1-CB 4.31Å; L104-I132 HydrophobicContact CD1-CD1 4.09Å; L104-I132 HydrophobicContact CD1-CG1 3.74Å; L104-I132 HydrophobicContact CD1-CG2 3.76Å
105N89.3Confident86Confident90 Ų9074.4 Ų74.448%0.48142%0.423SS..Hα-helixtrans-62.5-27.3180-169.324.5000113.7E89 L103 I107 A108E89-N105 HydrophobicContact CG-CB 4.44Å; L103-N105 PolarHBondContact O-N 2.96Å; L103-N105 VanDerWaalsContact O-N 3.15Å; N105-I107 VanDerWaalsContact C-N 3.33Å; N105-A108 CarbonylContact C-O 3.28Å; N105-A108 WeakPolarHBondContact CA-O 3.27Å
106S87.9Confident86Confident95 Ų9579.5 Ų79.566%0.66444%0.439SS*.Hα-helixtrans-76.5-24.6177.2-57.80000112.6L103 L104L103-S106 WeakPolarHBondContact O-CB 3.42Å; L103-S106 PolarHBondContact O-N 3.36Å; L104-S106 PolarHBondContact O-N 3.39Å
107I88.6Confident86.4Confident22 Ų2278.2 Ų78.211%0.11343%0.426CS..Hα-helixtrans-97.5-41-176-63.7171.3000110.3V93 P95 V102 L104 N105 S124 S125 A128 I132V93-I107 HydrophobicContact CB-CD1 4.11Å; V93-I107 HydrophobicContact CG1-CD1 4.25Å; P95-I107 HydrophobicContact CB-CD1 4.42Å; P95-I107 HydrophobicContact CG-CD1 3.83Å; V102-I107 HydrophobicContact CB-CD1 3.99Å; V102-I107 HydrophobicContact CG1-CD1 4.05Å; V102-I107 HydrophobicContact CG1-CG1 4.03Å; L104-I107 PolarHBondContact O-N 3.41Å; L104-I107 VanDerWaalsContact O-N 3.1Å; N105-I107 VanDerWaalsContact C-N 3.33Å; I107-S124 PolarHBondContact O-OG 3.16Å; I107-S125 WeakPolarHBondContact CG2-OG 3.35Å; I107-S125 PolarHBondContact O-OG 3.25Å; I107-A128 HydrophobicContact CG2-CB 4.05Å; I107-I132 HydrophobicContact CG2-CD1 4.47Å
108A89.4Confident86.8Confident3 Ų374 Ų743%0.02538%0.382CS..SBendtrans-132.5146.4-171.800000111.7L104 N105 I120 N121 F122 I132L104-A108 HydrophobicContact CD1-CB 4.15Å; L104-A108 PolarHBondContact O-N 2.95Å; N105-A108 CarbonylContact C-O 3.28Å; N105-A108 WeakPolarHBondContact CA-O 3.27Å; A108-I120 HydrophobicContact CB-CG2 3.63Å; A108-N121 CarbonylContact C-O 3.59Å; A108-N121 VanDerWaalsContact CA-O 3.29Å; A108-N121 WeakPolarHBondContact CA-O 3.36Å; A108-N121 WeakPolarHBondContact CB-O 3.42Å; A108-F122 HydrophobicContact CB-CB 4.05Å; A108-I132 HydrophobicContact CB-CD1 4.39Å
109Q90.4Very high87.4Confident124 Ų12472.7 Ų72.758%0.57937%0.372SS*.EExtended strand (participates in β ladder)trans-88.1123.8174.7-172.3-1785.700110T111 N121Q109-T111 HydrophobicContact CG-CG2 4.28Å; Q109-N121 HydrophobicContact CB-CB 4.48Å; Q109-N121 PolarHBondContact N-O 2.88Å; Q109-N121 PolarHBondContact O-N 3.08Å
110I89.5Confident88Confident18 Ų1862.7 Ų62.79%0.09233%0.329CS..EExtended strand (participates in β ladder)trans-104.1125.5-178.7-48.2162.2000108.7L85 F88 E89 L104 I120L85-I110 HydrophobicContact CD2-CB 4.46Å; L85-I110 HydrophobicContact CD2-CG2 3.5Å; F88-I110 HydrophobicContact CB-CD1 3.81Å; F88-I110 HydrophobicContact CB-CG2 4.32Å; E89-I110 HydrophobicContact CG-CD1 3.99Å; L104-I110 HydrophobicContact CD2-CD1 3.94Å; L104-I110 HydrophobicContact CD2-CG1 4.41Å; L104-I110 HydrophobicContact CG-CD1 4.17Å; I110-I120 HydrophobicContact CG1-CG1 4.43Å; I110-I120 HydrophobicContact CG2-CG1 4.25Å
111T89.2Confident88.2Confident59 Ų5958.3 Ų58.336%0.36231%0.31SS..EExtended strand (participates in β ladder)trans-135.8158.6178.258.10000110.6Q109 V119Q109-T111 HydrophobicContact CG-CG2 4.28Å; T111-V119 PolarHBondContact N-O 3.36Å; T111-V119 PolarHBondContact O-N 3.04Å; T111-V119 PolarHBondContact OG1-O 3.37Å
112L86.7Confident88.4Confident53 Ų5355.8 Ų55.828%0.27729%0.294SS..EExtended strand (participates in β ladder)trans-99.3123.4171.9-66.2173.9000109.1Q82 L85 A118 L156Q82-L112 HydrophobicContact CB-CD1 4.22Å; L85-L112 HydrophobicContact CD1-CD1 3.98Å; L85-L112 HydrophobicContact CD1-CG 3.93Å; L85-L112 HydrophobicContact CD2-CD2 3.79Å; L85-L112 HydrophobicContact CD2-CG 3.81Å; L85-L112 HydrophobicContact CG-CD1 4.06Å; L85-L112 HydrophobicContact CG-CD2 4.11Å; L85-L112 HydrophobicContact CG-CG 3.88Å; L112-A118 HydrophobicContact CD2-CB 4.1Å; L112-L156 HydrophobicContact CD2-CD1 3.91Å
113K87.4Confident88.4Confident121 Ų12156 Ų5653%0.52630%0.301SS..EExtended strand (participates in β ladder)trans-80.2-44.2169.1177.6172.4-178.2176.90110.7M117 V119 Y153K113-M117 HydrophobicContact CD-CE 4.37Å; K113-M117 PolarHBondContact N-O 3.4Å; K113-V119 HydrophobicContact CB-CG2 3.54Å; K113-V119 HydrophobicContact CD-CG2 4.42Å; K113-Y153 HydrophobicContact CD-CE1 4.14Å
114N84.7Confident88.2Confident83 Ų8356.6 Ų56.644%0.44431%0.312SS..EExtended strand (participates in β ladder)trans-138.5159.7176.9-74.7-30.8000107.7R116 M117N114-R116 PolarHBondContact O-N 3.37Å; N114-M117 PolarHBondContact N-O 3.17Å; N114-M117 CarbonylContact O-C 3.52Å; N114-M117 PolarHBondContact O-N 2.92Å; N114-M117 VanDerWaalsContact O-O 3.05Å
115P81.2Confident88Confident98 Ų9858 Ų5864%0.63632%0.322SS*.THydrogen-bonded Turntrans-59.9-9.6175.225-35.5000114
116R83.3Confident87.8Confident134 Ų13457.2 Ų57.251%0.50632%0.322SS..THydrogen-bonded Turntrans-110.8-2.4176.8-58.2-174.1-170.1159.810.3114.1N114 P155 L156N114-R116 PolarHBondContact O-N 3.37Å; R116-P155 CarbonylContact O-C 3.59Å; R116-P155 WeakPolarHBondContact O-CA 3.47Å; R116-L156 PolarHBondContact O-N 2.61Å
117M88.2Confident87.7Confident59 Ų5960.4 Ų60.429%0.29133%0.326SS..EExtended strand (participates in β ladder)trans-140.3116.7-178.5-65.5-157.3-60.300111.4K113 N114 V154K113-M117 HydrophobicContact CD-CE 4.37Å; K113-M117 PolarHBondContact N-O 3.4Å; N114-M117 PolarHBondContact N-O 3.17Å; N114-M117 CarbonylContact O-C 3.52Å; N114-M117 PolarHBondContact O-N 2.92Å; N114-M117 VanDerWaalsContact O-O 3.05Å; M117-V154 WeakPolarHBondContact CA-O 3.43Å
118A89.1Confident87.6Confident0 Ų059.5 Ų59.50%032%0.322CS..EExtended strand (participates in β ladder)trans-86.3147168.500000110.4F88 L112 Y153 V154 L156F88-A118 HydrophobicContact CE2-CB 4.29Å; L112-A118 HydrophobicContact CD2-CB 4.1Å; A118-Y153 WeakPolarHBondContact O-CA 3.47Å; A118-V154 HydrophobicContact CB-CB 4.49Å; A118-V154 PolarHBondContact N-O 2.83Å; A118-V154 PolarHBondContact O-N 3.45Å; A118-L156 HydrophobicContact CB-CD1 4.33Å; A118-L156 HydrophobicContact CB-CD2 4.15Å; A118-L156 HydrophobicContact CB-CG 4.4Å
119V91.2Very high87.6Confident17 Ų1760.4 Ų60.410%0.10333%0.327CS..EExtended strand (participates in β ladder)trans-123.3116.1179.5-178.80000107.3T111 K113 V151 L152 Y153T111-V119 PolarHBondContact N-O 3.36Å; T111-V119 PolarHBondContact O-N 3.04Å; T111-V119 PolarHBondContact OG1-O 3.37Å; K113-V119 HydrophobicContact CB-CG2 3.54Å; K113-V119 HydrophobicContact CD-CG2 4.42Å; V119-V151 HydrophobicContact CG1-CG1 3.28Å; V119-L152 WeakPolarHBondContact CA-O 3.35Å; V119-Y153 HydrophobicContact CG1-CE1 4.34Å; V119-Y153 HydrophobicContact CG2-CD1 3.75Å; V119-Y153 HydrophobicContact CG2-CE1 3.72Å
120I91.7Very high87.5Confident0 Ų062.3 Ų62.30%033%0.334CS..EExtended strand (participates in β ladder)trans-105.7112.3176.9-56.3165.2000107F88 L104 A108 I110 I136 V151 L152 V154F88-I120 HydrophobicContact CD1-CD1 4.14Å; F88-I120 HydrophobicContact CE1-CD1 4.44Å; L104-I120 HydrophobicContact CD1-CG2 4.5Å; L104-I120 HydrophobicContact CD2-CD1 4.24Å; A108-I120 HydrophobicContact CB-CG2 3.63Å; I110-I120 HydrophobicContact CG1-CG1 4.43Å; I110-I120 HydrophobicContact CG2-CG1 4.25Å; I120-I136 HydrophobicContact CD1-CD1 3.94Å; I120-V151 WeakPolarHBondContact O-CA 3.49Å; I120-L152 HydrophobicContact CB-CB 4.2Å; I120-L152 HydrophobicContact CD1-CD2 4.34Å; I120-L152 PolarHBondContact N-O 3.22Å; I120-L152 PolarHBondContact O-N 3.31Å; I120-V154 HydrophobicContact CD1-CG2 3.97Å
121N92.3Very high87.5Confident57 Ų5762 Ų6231%0.30533%0.334SS..EExtended strand (participates in β ladder)trans-98.8118.4177.7-176.9-2.7000109.7A108 Q109 A123 N150A108-N121 CarbonylContact C-O 3.59Å; A108-N121 VanDerWaalsContact CA-O 3.29Å; A108-N121 WeakPolarHBondContact CA-O 3.36Å; A108-N121 WeakPolarHBondContact CB-O 3.42Å; Q109-N121 HydrophobicContact CB-CB 4.48Å; Q109-N121 PolarHBondContact N-O 2.88Å; Q109-N121 PolarHBondContact O-N 3.08Å; N121-A123 VanDerWaalsContact OD1-CB 3.31Å; N121-A123 WeakPolarHBondContact OD1-CB 3.34Å; N121-A123 PolarHBondContact OD1-N 2.96Å; N121-N150 PolarHBondContact OD1-O 2.88Å
122F90.3Very high87.6Confident3 Ų359.3 Ų59.31%0.01332%0.317CS..  trans-117.829.3-178.251.9-95.4000111.8A108 S124 S125 V129 I132 Q147 N150 L152A108-F122 HydrophobicContact CB-CB 4.05Å; F122-S124 PolarHBondContact O-N 3.39Å; F122-S124 VanDerWaalsContact O-N 3.08Å; F122-S125 CarbonylContact O-C 3.57Å; F122-S125 VanDerWaalsContact O-C 3.28Å; F122-S125 PolarHBondContact O-N 3.44Å; F122-V129 HydrophobicContact CD2-CG2 3.56Å; F122-V129 HydrophobicContact CE1-CG2 4.47Å; F122-V129 HydrophobicContact CE2-CB 4.46Å; F122-V129 HydrophobicContact CE2-CG2 3.09Å; F122-V129 HydrophobicContact CG-CG2 4.43Å; F122-V129 HydrophobicContact CZ-CG2 3.62Å; F122-I132 HydrophobicContact CB-CD1 3.85Å; F122-I132 HydrophobicContact CD1-CD1 4.4Å; F122-I132 HydrophobicContact CG-CD1 4.23Å; F122-Q147 HydrophobicContact CZ-CG 4.5Å; F122-N150 WeakPolarHBondContact CD1-O 3.46Å; F122-N150 HydrophobicContact CD2-CB 4.37Å; F122-N150 VanDerWaalsContact CE1-C 3.48Å; F122-N150 WeakPolarHBondContact CE1-O 3.36Å; F122-N150 VanDerWaalsContact CE2-C 3.44Å; F122-N150 HydrophobicContact CE2-CB 4.08Å; F122-N150 WeakPolarHBondContact CZ-O 3.37Å; F122-N150 PolarHBondContact N-O 3.25Å; F122-N150 VanDerWaalsContact N-O 3.09Å; F122-L152 HydrophobicContact CE1-CB 4.02Å
123A87.7Confident87.6Confident55 Ų5557.7 Ų57.746%0.45531%0.309SS..THydrogen-bonded Turntrans-55.9-25.8179.800000114.6N121 S125 N150N121-A123 VanDerWaalsContact OD1-CB 3.31Å; N121-A123 WeakPolarHBondContact OD1-CB 3.34Å; N121-A123 PolarHBondContact OD1-N 2.96Å; A123-S125 VanDerWaalsContact C-N 3.31Å; A123-N150 HydrophobicContact CB-CB 4.27Å
124S85.7Confident87.7Confident97 Ų9756.4 Ų56.468%0.67831%0.305SS*.THydrogen-bonded Turntrans-68.1-26.4173.850.20000113.7I107 F122I107-S124 PolarHBondContact O-OG 3.16Å; F122-S124 PolarHBondContact O-N 3.39Å; F122-S124 VanDerWaalsContact O-N 3.08Å
125S84.8Confident87.9Confident29 Ų2952.8 Ų52.820%0.20329%0.287CS..  trans-147.168.7-169.452.50000111.4I107 F122 A123 E127 A128I107-S125 WeakPolarHBondContact CG2-OG 3.35Å; I107-S125 PolarHBondContact O-OG 3.25Å; F122-S125 CarbonylContact O-C 3.57Å; F122-S125 VanDerWaalsContact O-C 3.28Å; F122-S125 PolarHBondContact O-N 3.44Å; A123-S125 VanDerWaalsContact C-N 3.31Å; S125-E127 PolarHBondContact O-N 2.96Å; S125-E127 VanDerWaalsContact O-N 3.11Å; S125-A128 WeakPolarHBondContact O-CB 3.48Å; S125-A128 PolarHBondContact O-N 3.04Å
126P85.1Confident88.3Confident74 Ų7448.2 Ų48.248%0.48126%0.257SS..G310 helixtrans-62.2-21.3-179.726.8-35.3000113.2A128 V129P126-A128 VanDerWaalsContact C-N 3.29Å; P126-A128 PolarHBondContact O-N 2.65Å; P126-V129 WeakPolarHBondContact O-CG2 3.39Å
127E86Confident88.5Confident163 Ų16346.2 Ų46.276%0.76226%0.256SS*.G310 helixtrans-71.3-23.7176.5-59.7-178.5-179.100112.9P96 S125 V129P96-E127 HydrophobicContact CG-CB 4.49Å; S125-E127 PolarHBondContact O-N 2.96Å; S125-E127 VanDerWaalsContact O-N 3.11Å; E127-V129 VanDerWaalsContact C-N 3.31Å; E127-V129 PolarHBondContact O-N 3.17Å
128A86.6Confident88.5Confident3 Ų351.9 Ų51.93%0.02527%0.274CS..G310 helixtrans-82.2-3.1-175.500000113.9P95 I107 S125 P126 K130 A131 I132P95-A128 HydrophobicContact CB-CB 4.18Å; I107-A128 HydrophobicContact CG2-CB 4.05Å; S125-A128 WeakPolarHBondContact O-CB 3.48Å; S125-A128 PolarHBondContact O-N 3.04Å; P126-A128 VanDerWaalsContact C-N 3.29Å; P126-A128 PolarHBondContact O-N 2.65Å; A128-K130 VanDerWaalsContact C-N 3.33Å; A128-K130 PolarHBondContact O-N 2.99Å; A128-A131 WeakPolarHBondContact O-CA 3.33Å; A128-A131 WeakPolarHBondContact O-CB 3.45Å; A128-A131 PolarHBondContact O-N 3.01Å; A128-I132 HydrophobicContact CB-CD1 4.32Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 3.43Å
129V89.1Confident88.2Confident22 Ų2253.8 Ų53.813%0.13329%0.287CS..Hα-helixtrans-48.6-51.6-176.6172.50000112.6F122 P126 E127 A131 I132 T133F122-V129 HydrophobicContact CD2-CG2 3.56Å; F122-V129 HydrophobicContact CE1-CG2 4.47Å; F122-V129 HydrophobicContact CE2-CB 4.46Å; F122-V129 HydrophobicContact CE2-CG2 3.09Å; F122-V129 HydrophobicContact CG-CG2 4.43Å; F122-V129 HydrophobicContact CZ-CG2 3.62Å; P126-V129 WeakPolarHBondContact O-CG2 3.39Å; E127-V129 VanDerWaalsContact C-N 3.31Å; E127-V129 PolarHBondContact O-N 3.17Å; V129-A131 VanDerWaalsContact C-N 3.27Å; V129-A131 PolarHBondContact O-N 3.36Å; V129-I132 PolarHBondContact O-N 3.5Å; V129-T133 PolarHBondContact O-N 2.91Å; V129-T133 PolarHBondContact O-OG1 3.12Å
130K88.5Confident87.7Confident164 Ų16456.1 Ų56.171%0.71332%0.315SS*.Hα-helixtrans-64.6-33.7-177.5-66-177.2179.9178.80112.1A128 T133 Q134A128-K130 VanDerWaalsContact C-N 3.33Å; A128-K130 PolarHBondContact O-N 2.99Å; K130-T133 PolarHBondContact O-OG1 3.5Å; K130-T133 VanDerWaalsContact O-OG1 3.05Å; K130-Q134 WeakPolarHBondContact O-CB 3.27Å; K130-Q134 WeakPolarHBondContact O-CG 3.43Å; K130-Q134 PolarHBondContact O-N 2.87Å
131A89.5Confident86.9Confident12 Ų1258.6 Ų58.610%0.09933%0.328CS..Hα-helixtrans-71.5-38.917700000111.1V93 K94 A128 V129 A135V93-A131 HydrophobicContact CG1-CB 3.59Å; K94-A131 VanDerWaalsContact O-CB 3.28Å; K94-A131 WeakPolarHBondContact O-CB 3.47Å; A128-A131 WeakPolarHBondContact O-CA 3.33Å; A128-A131 WeakPolarHBondContact O-CB 3.45Å; A128-A131 PolarHBondContact O-N 3.01Å; V129-A131 VanDerWaalsContact C-N 3.27Å; V129-A131 PolarHBondContact O-N 3.36Å; A131-A135 WeakPolarHBondContact O-CB 3.33Å; A131-A135 PolarHBondContact O-N 2.79Å
132I89.6Confident86.2Confident2 Ų263.7 Ų63.71%0.0136%0.355CS..Hα-helixtrans-65.4-47.5177.5-64.3168.9000110.7V93 L104 I107 A108 F122 A128 V129 Q134 A135 I136 L152V93-I132 HydrophobicContact CG1-CG1 4.08Å; V93-I132 HydrophobicContact CG2-CG1 4.43Å; L104-I132 HydrophobicContact CD1-CB 4.31Å; L104-I132 HydrophobicContact CD1-CD1 4.09Å; L104-I132 HydrophobicContact CD1-CG1 3.74Å; L104-I132 HydrophobicContact CD1-CG2 3.76Å; I107-I132 HydrophobicContact CG2-CD1 4.47Å; A108-I132 HydrophobicContact CB-CD1 4.39Å; F122-I132 HydrophobicContact CB-CD1 3.85Å; F122-I132 HydrophobicContact CD1-CD1 4.4Å; F122-I132 HydrophobicContact CG-CD1 4.23Å; A128-I132 HydrophobicContact CB-CD1 4.32Å; A128-I132 WeakPolarHBondContact O-CG1 3.47Å; A128-I132 PolarHBondContact O-N 3.43Å; V129-I132 PolarHBondContact O-N 3.5Å; I132-Q134 VanDerWaalsContact C-N 3.34Å; I132-Q134 PolarHBondContact O-N 3.27Å; I132-A135 WeakPolarHBondContact O-CB 3.31Å; I132-A135 PolarHBondContact O-N 2.85Å; I132-A135 VanDerWaalsContact O-N 3.15Å; I132-I136 HydrophobicContact CG2-CD1 4.06Å; I132-I136 WeakPolarHBondContact O-CG1 3.48Å; I132-I136 PolarHBondContact O-N 3.03Å; I132-L152 HydrophobicContact CG2-CD2 4.4Å
133T88.2Confident85.8Confident18 Ų1864.4 Ų64.411%0.1136%0.359CS..Hα-helixtrans-61-44.3178.155.60000111.2V129 K130 A135 I136 D137 Y145 L152V129-T133 PolarHBondContact O-N 2.91Å; V129-T133 PolarHBondContact O-OG1 3.12Å; K130-T133 PolarHBondContact O-OG1 3.5Å; K130-T133 VanDerWaalsContact O-OG1 3.05Å; T133-A135 VanDerWaalsContact C-N 3.31Å; T133-A135 PolarHBondContact O-N 3.26Å; T133-I136 PolarHBondContact O-N 3.39Å; T133-D137 PolarHBondContact O-N 2.94Å; T133-Y145 HydrophobicContact CG2-CD2 4.19Å; T133-Y145 HydrophobicContact CG2-CE1 4.46Å; T133-Y145 HydrophobicContact CG2-CE2 3.66Å; T133-L152 HydrophobicContact CG2-CD2 4.47Å
134Q88.4Confident85.6Confident95 Ų9564.5 Ų64.544%0.44437%0.366SS..Hα-helixtrans-62.6-35.4175.2-74.2177.310.100113.1K130 I132 D137 R138K130-Q134 WeakPolarHBondContact O-CB 3.27Å; K130-Q134 WeakPolarHBondContact O-CG 3.43Å; K130-Q134 PolarHBondContact O-N 2.87Å; I132-Q134 VanDerWaalsContact C-N 3.34Å; I132-Q134 PolarHBondContact O-N 3.27Å; Q134-D137 PolarHBondContact O-N 3.19Å; Q134-R138 WeakPolarHBondContact O-CB 3.25Å; Q134-R138 VanDerWaalsContact O-CG 3.22Å; Q134-R138 WeakPolarHBondContact O-CG 3.38Å; Q134-R138 PolarHBondContact O-N 3.11Å
135A89.4Confident85.8Confident7 Ų763.9 Ų63.96%0.05835%0.349CS..Hα-helixtrans-67.8-38.1176.300000111.6V93 A131 I132 T133 R138 S139V93-A135 HydrophobicContact CG2-CB 3.79Å; A131-A135 WeakPolarHBondContact O-CB 3.33Å; A131-A135 PolarHBondContact O-N 2.79Å; I132-A135 WeakPolarHBondContact O-CB 3.31Å; I132-A135 PolarHBondContact O-N 2.85Å; I132-A135 VanDerWaalsContact O-N 3.15Å; T133-A135 VanDerWaalsContact C-N 3.31Å; T133-A135 PolarHBondContact O-N 3.26Å; A135-R138 PolarHBondContact O-N 3.36Å; A135-S139 WeakPolarHBondContact O-CB 3.33Å; A135-S139 PolarHBondContact O-N 2.95Å
136I88.6Confident86Confident2 Ų268.7 Ų68.71%0.0137%0.368CS..Hα-helixtrans-64.9-43.5174.3-65.8165.8000110.3L91 I120 I132 T133 R138 S139 M141 V143 L152 V154L91-I136 HydrophobicContact CD1-CG1 4.27Å; I120-I136 HydrophobicContact CD1-CD1 3.94Å; I132-I136 HydrophobicContact CG2-CD1 4.06Å; I132-I136 WeakPolarHBondContact O-CG1 3.48Å; I132-I136 PolarHBondContact O-N 3.03Å; T133-I136 PolarHBondContact O-N 3.39Å; I136-R138 PolarHBondContact O-N 3.03Å; I136-S139 WeakPolarHBondContact O-CB 3.48Å; I136-S139 PolarHBondContact O-N 3.44Å; I136-S139 PolarHBondContact O-OG 3.38Å; I136-M141 HydrophobicContact CG2-CE 4.45Å; I136-V143 HydrophobicContact CG2-CG2 3.98Å; I136-L152 HydrophobicContact CD1-CD2 3.38Å; I136-V154 HydrophobicContact CD1-CG2 4.27Å
137D88.1Confident86.3Confident91 Ų9170 Ų7049%0.48737%0.368SS..Hα-helixtrans-63.5-42.9177.2-63.2-27.8000111.6T133 Q134 S139 G140T133-D137 PolarHBondContact O-N 2.94Å; Q134-D137 PolarHBondContact O-N 3.19Å; D137-S139 VanDerWaalsContact C-N 3.26Å; D137-S139 PolarHBondContact O-N 2.9Å; D137-G140 PolarHBondContact O-N 3.2Å
138R87.5Confident86.4Confident179 Ų17967.3 Ų67.368%0.67536%0.356SS*.Hα-helixtrans-67.2-24.4176.8-73.3175.6-170.8161.68.6113.7Q134 A135 I136 G140Q134-R138 WeakPolarHBondContact O-CB 3.25Å; Q134-R138 VanDerWaalsContact O-CG 3.22Å; Q134-R138 WeakPolarHBondContact O-CG 3.38Å; Q134-R138 PolarHBondContact O-N 3.11Å; A135-R138 PolarHBondContact O-N 3.36Å; I136-R138 PolarHBondContact O-N 3.03Å; R138-G140 PolarHBondContact O-N 3.27Å; R138-G140 VanDerWaalsContact O-N 3.13Å
139S83.6Confident86.5Confident39 Ų3974 Ų7427%0.27339%0.391SS..THydrogen-bonded Turntrans-64.4-13.6179.275.80000113.5A135 I136 D137 M141A135-S139 WeakPolarHBondContact O-CB 3.33Å; A135-S139 PolarHBondContact O-N 2.95Å; I136-S139 WeakPolarHBondContact O-CB 3.48Å; I136-S139 PolarHBondContact O-N 3.44Å; I136-S139 PolarHBondContact O-OG 3.38Å; D137-S139 VanDerWaalsContact C-N 3.26Å; D137-S139 PolarHBondContact O-N 2.9Å; S139-M141 VanDerWaalsContact C-N 3.27Å; S139-M141 PolarHBondContact O-N 3.48Å; S139-M141 WeakPolarHBondContact OG-CG 3.42Å
140G80.3Confident86.5Confident67 Ų6776.3 Ų76.369%0.69140%0.403SS*.THydrogen-bonded Turntrans73.716179.900000113.8D137 R138D137-G140 PolarHBondContact O-N 3.2Å; R138-G140 PolarHBondContact O-N 3.27Å; R138-G140 VanDerWaalsContact O-N 3.13Å
141M75.6Confident86.7Confident52 Ų5270 Ų7026%0.25638%0.378SS..  trans-80.4-15178.7-67.3-168.5-49.700114A87 F88 I136 S139 V143A87-M141 HydrophobicContact CB-SD 4.5Å; F88-M141 HydrophobicContact CD1-CE 3.89Å; F88-M141 HydrophobicContact CE1-CE 3.22Å; F88-M141 HydrophobicContact CE1-SD 4.47Å; F88-M141 HydrophobicContact CE2-CE 4.31Å; F88-M141 HydrophobicContact CZ-CE 3.46Å; F88-M141 VanDerWaalsContact CZ-CE 3.46Å; F88-M141 HydrophobicContact CZ-SD 4.27Å; I136-M141 HydrophobicContact CG2-CE 4.45Å; S139-M141 VanDerWaalsContact C-N 3.27Å; S139-M141 PolarHBondContact O-N 3.48Å; S139-M141 WeakPolarHBondContact OG-CG 3.42Å; M141-V143 HydrophobicContact CB-CG1 4.34Å; M141-V143 HydrophobicContact CB-CG2 3.99Å; M141-V143 HydrophobicContact CE-CG2 4.16Å; M141-V143 WeakPolarHBondContact O-CG1 3.34Å; M141-V143 PolarHBondContact O-N 2.89Å; M141-V143 VanDerWaalsContact O-N 3.12Å
142D77.6Confident86.8Confident163 Ų16369.5 Ų69.587%0.87237%0.374SS*.  trans43.346.1179.6-163.931.3000113.3
143V81.2Confident86.9Confident18 Ų1871.6 Ų71.611%0.10938%0.382CS..  trans-103.9121.8-179.9-73.70000109.4I136 M141 Y145 V154 P155I136-V143 HydrophobicContact CG2-CG2 3.98Å; M141-V143 HydrophobicContact CB-CG1 4.34Å; M141-V143 HydrophobicContact CB-CG2 3.99Å; M141-V143 HydrophobicContact CE-CG2 4.16Å; M141-V143 WeakPolarHBondContact O-CG1 3.34Å; M141-V143 PolarHBondContact O-N 2.89Å; M141-V143 VanDerWaalsContact O-N 3.12Å; V143-Y145 PolarHBondContact O-N 3.02Å; V143-V154 HydrophobicContact CB-CG1 3.98Å; V143-V154 HydrophobicContact CG2-CG1 3.45Å; V143-V154 VanDerWaalsContact CG2-CG1 3.45Å; V143-P155 WeakPolarHBondContact CG1-O 3.4Å
144G84.3Confident87Confident58 Ų5870.7 Ų70.760%0.59838%0.376SS*.  trans-66.4130.1173.600000110.6P155G144-P155 WeakPolarHBondContact O-CD 3.46Å; G144-P155 WeakPolarHBondContact O-CG 2.98Å
145Y88.8Confident87Confident84 Ų8468.9 Ų68.933%0.32937%0.373SS..  trans-109.2148.8-179.752.6-100.1000112T133 V143 L152 Y153T133-Y145 HydrophobicContact CG2-CD2 4.19Å; T133-Y145 HydrophobicContact CG2-CE1 4.46Å; T133-Y145 HydrophobicContact CG2-CE2 3.66Å; V143-Y145 PolarHBondContact O-N 3.02Å; Y145-L152 HydrophobicContact CD2-CD1 3.67Å; Y145-L152 HydrophobicContact CG-CD1 4Å; Y145-L152 HydrophobicContact CG-CD2 4.41Å; Y145-Y153 WeakPolarHBondContact CA-O 3.5Å
146Q90.4Very high86.6Confident129 Ų12969.4 Ų69.460%0.60337%0.374SS*.EExtended strand (participates in β ladder)trans-116.3115.5175.1-66.8-177.7-21.700109.7Y153Q146-Y153 PolarHBondContact N-O 3.26Å; Q146-Y153 PolarHBondContact O-N 2.96Å
147Q90.1Very high86.2Confident102 Ų10273.6 Ų73.648%0.47740%0.402SS..EExtended strand (participates in β ladder)trans-88.7130.7176.8-174.4-177.2-13.500110.5F122 N149 L152F122-Q147 HydrophobicContact CZ-CG 4.5Å; Q147-N149 PolarHBondContact NE2-O 3.15Å; Q147-L152 HydrophobicContact CB-CD1 3.98Å
148Q89.6Confident85.9Confident106 Ų10677.1 Ų77.150%0.49541%0.408SS..EExtended strand (participates in β ladder)trans-132.7112.4169-61.7179.64.500108.8N150 V151 Y153Q148-N150 PolarHBondContact O-N 3.38Å; Q148-N150 VanDerWaalsContact O-N 3.11Å; Q148-V151 PolarHBondContact N-O 3Å; Q148-V151 PolarHBondContact O-N 3.15Å; Q148-Y153 HydrophobicContact CB-CE2 4.04Å; Q148-Y153 HydrophobicContact CG-CD2 4.23Å; Q148-Y153 HydrophobicContact CG-CE2 3.98Å
149N87.5Confident85.6Confident145 Ų14570.7 Ų70.778%0.77539%0.39SS*.THydrogen-bonded Turntrans51.3-116.2-176-56.7-16000111.3Q147Q147-N149 PolarHBondContact NE2-O 3.15Å
150N89.8Confident85.7Confident69 Ų6971.8 Ų71.837%0.36940%0.397SS..THydrogen-bonded Turntrans-97.417.8-178.5-63.1-9.3000113.8N121 F122 A123 Q148N121-N150 PolarHBondContact OD1-O 2.88Å; F122-N150 WeakPolarHBondContact CD1-O 3.46Å; F122-N150 HydrophobicContact CD2-CB 4.37Å; F122-N150 VanDerWaalsContact CE1-C 3.48Å; F122-N150 WeakPolarHBondContact CE1-O 3.36Å; F122-N150 VanDerWaalsContact CE2-C 3.44Å; F122-N150 HydrophobicContact CE2-CB 4.08Å; F122-N150 WeakPolarHBondContact CZ-O 3.37Å; F122-N150 PolarHBondContact N-O 3.25Å; F122-N150 VanDerWaalsContact N-O 3.09Å; A123-N150 HydrophobicContact CB-CB 4.27Å; Q148-N150 PolarHBondContact O-N 3.38Å; Q148-N150 VanDerWaalsContact O-N 3.11Å
151V92.6Very high86.1Confident32 Ų3277 Ų7719%0.19440%0.396CS..EExtended strand (participates in β ladder)trans-129.2132.4-174.5-176.70000110.4V119 I120 Q148 Y153V119-V151 HydrophobicContact CG1-CG1 3.28Å; I120-V151 WeakPolarHBondContact O-CA 3.49Å; Q148-V151 PolarHBondContact N-O 3Å; Q148-V151 PolarHBondContact O-N 3.15Å; V151-Y153 HydrophobicContact CB-CE2 4.48Å; V151-Y153 HydrophobicContact CG1-CD2 4.47Å; V151-Y153 HydrophobicContact CG1-CE1 4.4Å; V151-Y153 HydrophobicContact CG1-CE2 3.98Å
152L92.2Very high86.8Confident2 Ų281.2 Ų81.21%0.0142%0.415CS..EExtended strand (participates in β ladder)trans-107.7123.8174-166.566.2000110V119 I120 F122 I132 T133 I136 Y145 Q147 V154V119-L152 WeakPolarHBondContact CA-O 3.35Å; I120-L152 HydrophobicContact CB-CB 4.2Å; I120-L152 HydrophobicContact CD1-CD2 4.34Å; I120-L152 PolarHBondContact N-O 3.22Å; I120-L152 PolarHBondContact O-N 3.31Å; F122-L152 HydrophobicContact CE1-CB 4.02Å; I132-L152 HydrophobicContact CG2-CD2 4.4Å; T133-L152 HydrophobicContact CG2-CD2 4.47Å; I136-L152 HydrophobicContact CD1-CD2 3.38Å; Y145-L152 HydrophobicContact CD2-CD1 3.67Å; Y145-L152 HydrophobicContact CG-CD1 4Å; Y145-L152 HydrophobicContact CG-CD2 4.41Å; Q147-L152 HydrophobicContact CB-CD1 3.98Å; L152-V154 HydrophobicContact CD2-CG2 4.09Å; L152-V154 HydrophobicContact CG-CG2 4.07Å
153Y91.9Very high87.3Confident45 Ų4579.6 Ų79.618%0.17640%0.4CS..EExtended strand (participates in β ladder)trans-96.5121.2172.7-63.7-83.6000109.6K113 A118 V119 Y145 Q146 Q148 V151K113-Y153 HydrophobicContact CD-CE1 4.14Å; A118-Y153 WeakPolarHBondContact O-CA 3.47Å; V119-Y153 HydrophobicContact CG1-CE1 4.34Å; V119-Y153 HydrophobicContact CG2-CD1 3.75Å; V119-Y153 HydrophobicContact CG2-CE1 3.72Å; Y145-Y153 WeakPolarHBondContact CA-O 3.5Å; Q146-Y153 PolarHBondContact N-O 3.26Å; Q146-Y153 PolarHBondContact O-N 2.96Å; Q148-Y153 HydrophobicContact CB-CE2 4.04Å; Q148-Y153 HydrophobicContact CG-CD2 4.23Å; Q148-Y153 HydrophobicContact CG-CE2 3.98Å; V151-Y153 HydrophobicContact CB-CE2 4.48Å; V151-Y153 HydrophobicContact CG1-CD2 4.47Å; V151-Y153 HydrophobicContact CG1-CE1 4.4Å; V151-Y153 HydrophobicContact CG1-CE2 3.98Å
154V89.8Confident87.7Confident0 Ų080.4 Ų80.40%040%0.401CS..EExtended strand (participates in β ladder)trans-118.2114.6179.5-173.40000109F88 M117 A118 I120 I136 V143 L152F88-V154 HydrophobicContact CE1-CB 4.43Å; F88-V154 HydrophobicContact CE1-CG1 4Å; F88-V154 HydrophobicContact CE1-CG2 4.5Å; F88-V154 HydrophobicContact CZ-CB 4.32Å; F88-V154 HydrophobicContact CZ-CG1 3.8Å; M117-V154 WeakPolarHBondContact CA-O 3.43Å; A118-V154 HydrophobicContact CB-CB 4.49Å; A118-V154 PolarHBondContact N-O 2.83Å; A118-V154 PolarHBondContact O-N 3.45Å; I120-V154 HydrophobicContact CD1-CG2 3.97Å; I136-V154 HydrophobicContact CD1-CG2 4.27Å; V143-V154 HydrophobicContact CB-CG1 3.98Å; V143-V154 HydrophobicContact CG2-CG1 3.45Å; V143-V154 VanDerWaalsContact CG2-CG1 3.45Å; L152-V154 HydrophobicContact CD2-CG2 4.09Å; L152-V154 HydrophobicContact CG-CG2 4.07Å
155P87.7Confident88Confident57 Ų5781 Ų8137%0.3739%0.389SS..EExtended strand (participates in β ladder)trans-70.8134.8173.131.5-31.2000109.5R116 V143 G144R116-P155 CarbonylContact O-C 3.59Å; R116-P155 WeakPolarHBondContact O-CA 3.47Å; V143-P155 WeakPolarHBondContact CG1-O 3.4Å; G144-P155 WeakPolarHBondContact O-CD 3.46Å; G144-P155 WeakPolarHBondContact O-CG 2.98Å
156L82.1Confident88.2Confident17 Ų1780.8 Ų80.89%0.08939%0.393CS..PPolyproline II helixtrans-98.8131.4-179.3-56.1-179.7000109.9V84 F88 L112 R116 A118V84-L156 HydrophobicContact CB-CD1 3.89Å; V84-L156 HydrophobicContact CB-CD2 4.41Å; V84-L156 HydrophobicContact CG1-CD1 4.33Å; V84-L156 HydrophobicContact CG1-CD2 3.94Å; V84-L156 HydrophobicContact CG2-CD1 4.04Å; F88-L156 HydrophobicContact CE2-CD2 3.43Å; F88-L156 VanDerWaalsContact CE2-CD2 3.43Å; F88-L156 HydrophobicContact CZ-CD2 3.61Å; L112-L156 HydrophobicContact CD2-CD1 3.91Å; R116-L156 PolarHBondContact O-N 2.61Å; A118-L156 HydrophobicContact CB-CD1 4.33Å; A118-L156 HydrophobicContact CB-CD2 4.15Å; A118-L156 HydrophobicContact CB-CG 4.4Å
157P80Confident88.2Confident91 Ų9175.8 Ų75.859%0.59137%0.37SS*.PPolyproline II helixtrans-64.3146.1175.427.4-33.5000109.8
158R80.6Confident88.4Confident164 Ų16471.5 Ų71.562%0.61935%0.352SS*.PPolyproline II helixtrans-68.4135.1171.9-63.8-168-170.4-152.920.5108.8S160R158-S160 PolarHBondContact O-N 3.02Å
159P81.3Confident88.6Confident45 Ų4574.1 Ų74.129%0.29236%0.358SS..PPolyproline II helixtrans-62.7132.7177.922-28.1000109.9M81 K163M81-P159 HydrophobicContact CE-CB 3.87Å; M81-P159 HydrophobicContact CE-CG 3.18Å; P159-K163 HydrophobicContact CB-CB 4.45Å; P159-K163 HydrophobicContact CB-CG 4.45Å
160S86.1Confident88.9Confident61 Ų6169.7 Ų69.743%0.42733%0.334SS..PPolyproline II helixtrans-62.7159.317667.70000111.1R158 E162 K163 R164R158-S160 PolarHBondContact O-N 3.02Å; S160-E162 VanDerWaalsContact C-N 3.25Å; S160-E162 PolarHBondContact O-N 3.27Å; S160-K163 PolarHBondContact O-N 2.9Å; S160-K163 VanDerWaalsContact O-N 3.13Å; S160-K163 PolarHBondContact OG-N 3.43Å; S160-R164 PolarHBondContact O-N 3.36Å
161R89Confident89.1Confident176 Ų17666.4 Ų66.466%0.66432%0.316SS*.Hα-helixtrans-55.1-43.6173.9179.6177.8169.3175.3-1.3111.5K163 R164 E165R161-K163 VanDerWaalsContact C-N 3.3Å; R161-K163 PolarHBondContact O-N 3.35Å; R161-R164 WeakPolarHBondContact O-CB 3.45Å; R161-R164 PolarHBondContact O-N 3.47Å; R161-R164 VanDerWaalsContact O-N 3.09Å; R161-E165 HydrophobicContact CG-CG 4.43Å; R161-E165 IonicContact CZ-OE1 2.83Å; R161-E165 IonicContact NE-OE1 3.9Å; R161-E165 PolarHBondContact NE-OE1 3.35Å; R161-E165 IonicContact NH2-OE1 3.98Å; R161-E165 PolarHBondContact NH2-OE1 2.93Å; R161-E165 WeakPolarHBondContact O-CG 3.47Å; R161-E165 PolarHBondContact O-N 3.35Å
162E90.4Very high89.3Confident141 Ų14169.7 Ų69.766%0.65933%0.328SS*.Hα-helixtrans-57.2-42177-61.9178.2176.800112.2S160 R164 E165 N166S160-E162 VanDerWaalsContact C-N 3.25Å; S160-E162 PolarHBondContact O-N 3.27Å; E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 PolarHBondContact O-N 3.35Å; E162-E165 PolarHBondContact O-N 3.29Å; E162-N166 WeakPolarHBondContact O-CB 3.11Å; E162-N166 PolarHBondContact O-N 2.88Å; E162-N166 PolarHBondContact O-ND2 3.1Å; E162-N166 PolarHBondContact O-OD1 3.18Å
163K88Confident89.5Confident129 Ų12974.3 Ų74.356%0.56135%0.352SS*.Hα-helixtrans-64.3-39.2177-174137.4-178.4173.30111.7P159 S160 R161 N166 M167P159-K163 HydrophobicContact CB-CB 4.45Å; P159-K163 HydrophobicContact CB-CG 4.45Å; S160-K163 PolarHBondContact O-N 2.9Å; S160-K163 VanDerWaalsContact O-N 3.13Å; S160-K163 PolarHBondContact OG-N 3.43Å; R161-K163 VanDerWaalsContact C-N 3.3Å; R161-K163 PolarHBondContact O-N 3.35Å; K163-N166 WeakPolarHBondContact O-CB 3.5Å; K163-N166 PolarHBondContact O-N 3.18Å; K163-M167 HydrophobicContact CG-CE 4.13Å; K163-M167 WeakPolarHBondContact O-CE 3.48Å; K163-M167 PolarHBondContact O-N 3.42Å
164R88.7Confident89.7Confident35 Ų3572.4 Ų72.413%0.13235%0.345CS..Hα-helixtrans-65.9-43.3175.7-62.1-172.8-171.2131.6-18112.1M81 S160 R161 E162 N166 M167 A168 L234 Q237M81-R164 HydrophobicContact CE-CG 3.96Å; S160-R164 PolarHBondContact O-N 3.36Å; R161-R164 WeakPolarHBondContact O-CB 3.45Å; R161-R164 PolarHBondContact O-N 3.47Å; R161-R164 VanDerWaalsContact O-N 3.09Å; E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 PolarHBondContact O-N 3.35Å; R164-N166 VanDerWaalsContact C-N 3.29Å; R164-N166 PolarHBondContact O-N 2.9Å; R164-M167 HydrophobicContact CG-CE 4.26Å; R164-M167 PolarHBondContact O-N 3.32Å; R164-M167 VanDerWaalsContact O-N 3.16Å; R164-A168 PolarHBondContact O-N 3.45Å; R164-L234 VanDerWaalsContact CD-O 3.31Å; R164-L234 WeakPolarHBondContact CD-O 3.04Å; R164-Q237 PolarHBondContact NH2-O 3.46Å
165E91.7Very high90Very high71 Ų7172.4 Ų72.433%0.33235%0.345SS..Hα-helixtrans-62.3-37.4175-70.3176.2-179.800111.4R161 E162 A168 R169 L235R161-E165 HydrophobicContact CG-CG 4.43Å; R161-E165 IonicContact CZ-OE1 2.83Å; R161-E165 IonicContact NE-OE1 3.9Å; R161-E165 PolarHBondContact NE-OE1 3.35Å; R161-E165 IonicContact NH2-OE1 3.98Å; R161-E165 PolarHBondContact NH2-OE1 2.93Å; R161-E165 WeakPolarHBondContact O-CG 3.47Å; R161-E165 PolarHBondContact O-N 3.35Å; E162-E165 PolarHBondContact O-N 3.29Å; E165-A168 PolarHBondContact O-N 3.44Å; E165-R169 WeakPolarHBondContact O-CG 3.15Å; E165-R169 PolarHBondContact O-N 2.95Å; E165-L235 HydrophobicContact CG-CD2 4.34Å
166N92.3Very high90.4Very high80 Ų8073 Ų7343%0.42835%0.345SS..Hα-helixtrans-62.2-42.7172.5-67.9-11.2000112.5E162 K163 R164 R169 N170E162-N166 WeakPolarHBondContact O-CB 3.11Å; E162-N166 PolarHBondContact O-N 2.88Å; E162-N166 PolarHBondContact O-ND2 3.1Å; E162-N166 PolarHBondContact O-OD1 3.18Å; K163-N166 WeakPolarHBondContact O-CB 3.5Å; K163-N166 PolarHBondContact O-N 3.18Å; R164-N166 VanDerWaalsContact C-N 3.29Å; R164-N166 PolarHBondContact O-N 2.9Å; N166-R169 PolarHBondContact O-N 3.1Å; N166-R169 PolarHBondContact OD1-NH2 2.96Å; N166-N170 PolarHBondContact O-N 3.35Å
167M91.6Very high91.1Very high24 Ų2476.4 Ų76.412%0.11836%0.361CS..Hα-helixtrans-65.2-41175.4-73.1-178.2-73.600111.9L79 M81 K163 R164 R169 N170 A171 L234L79-M167 HydrophobicContact CD2-CB 4.19Å; L79-M167 WeakPolarHBondContact CD2-O 3.36Å; M81-M167 HydrophobicContact CE-CE 3.54Å; M81-M167 HydrophobicContact SD-CE 3.2Å; M81-M167 WeakPolarHBondContact SD-CE 3.28Å; M81-M167 HydrophobicContact SD-SD 3.85Å; K163-M167 HydrophobicContact CG-CE 4.13Å; K163-M167 WeakPolarHBondContact O-CE 3.48Å; K163-M167 PolarHBondContact O-N 3.42Å; R164-M167 HydrophobicContact CG-CE 4.26Å; R164-M167 PolarHBondContact O-N 3.32Å; R164-M167 VanDerWaalsContact O-N 3.16Å; M167-R169 VanDerWaalsContact C-N 3.32Å; M167-R169 PolarHBondContact O-N 2.98Å; M167-N170 PolarHBondContact O-N 3.21Å; M167-A171 PolarHBondContact O-N 3.36Å; M167-L234 HydrophobicContact CB-CD1 3.88Å; M167-L234 HydrophobicContact CB-CD2 4.39Å; M167-L234 HydrophobicContact SD-CD2 4.48Å
168A93.2Very high91.8Very high11 Ų1172.1 Ų72.19%0.09133%0.333CS..Hα-helixtrans-63-38.3175.300000112.3R164 E165 A171 K172 Q231R164-A168 PolarHBondContact O-N 3.45Å; E165-A168 PolarHBondContact O-N 3.44Å; A168-A171 WeakPolarHBondContact O-CB 3.4Å; A168-A171 PolarHBondContact O-N 3.28Å; A168-K172 PolarHBondContact O-N 2.71Å; A168-Q231 HydrophobicContact CB-CG 4.26Å; A168-Q231 PolarHBondContact O-NE2 3.44Å; A168-Q231 VanDerWaalsContact O-NE2 3.1Å
169R93.6Very high92.6Very high162 Ų16265.2 Ų65.261%0.61131%0.307SS*.Hα-helixtrans-63.6-43.9171.3-74-169.5-76.6178.4-12.7111.8E165 N166 M167 A171 K172 L173E165-R169 WeakPolarHBondContact O-CG 3.15Å; E165-R169 PolarHBondContact O-N 2.95Å; N166-R169 PolarHBondContact O-N 3.1Å; N166-R169 PolarHBondContact OD1-NH2 2.96Å; M167-R169 VanDerWaalsContact C-N 3.32Å; M167-R169 PolarHBondContact O-N 2.98Å; R169-A171 VanDerWaalsContact C-N 3.32Å; R169-A171 PolarHBondContact O-N 3.5Å; R169-K172 WeakPolarHBondContact O-CB 3.31Å; R169-K172 PolarHBondContact O-N 3.21Å; R169-L173 PolarHBondContact O-N 2.93Å
170N94.2Very high93.3Very high52 Ų5267.4 Ų67.428%0.27832%0.317SS..Hα-helixtrans-63.6-37.5177.2-169.436000112.1Q78 L79 N166 M167 K172 L173 L174Q78-N170 PolarHBondContact OE1-ND2 3.21Å; L79-N170 HydrophobicContact CD2-CB 4.03Å; N166-N170 PolarHBondContact O-N 3.35Å; M167-N170 PolarHBondContact O-N 3.21Å; N170-K172 VanDerWaalsContact C-N 3.27Å; N170-K172 PolarHBondContact O-N 3.28Å; N170-L173 WeakPolarHBondContact O-CB 3.48Å; N170-L173 PolarHBondContact O-N 3.09Å; N170-L173 VanDerWaalsContact O-N 3.1Å; N170-L174 WeakPolarHBondContact O-CG 3.44Å; N170-L174 PolarHBondContact O-N 3.44Å
171A95Very high93.8Very high0 Ų068.7 Ų68.70%031%0.312CS..Hα-helixtrans-55.5-43.5173.600000112.1Y75 L79 M167 A168 R169 L174 C175 Q231Y75-A171 HydrophobicContact CE1-CB 4.35Å; Y75-A171 PolarHBondContact OH-O 3.12Å; L79-A171 HydrophobicContact CD1-CB 3.48Å; L79-A171 VanDerWaalsContact CD1-CB 3.48Å; M167-A171 PolarHBondContact O-N 3.36Å; A168-A171 WeakPolarHBondContact O-CB 3.4Å; A168-A171 PolarHBondContact O-N 3.28Å; R169-A171 VanDerWaalsContact C-N 3.32Å; R169-A171 PolarHBondContact O-N 3.5Å; A171-L174 PolarHBondContact O-N 3.28Å; A171-C175 WeakPolarHBondContact O-CB 3.28Å; A171-C175 PolarHBondContact O-N 3.03Å; A171-Q231 HydrophobicContact CB-CG 4.3Å
172K95.5Very high94.2Very high100 Ų10060.3 Ų60.344%0.43528%0.281SS..Hα-helixtrans-63.5-42.1176.2-170.1176.8-177.4175.70111.9A168 R169 N170 C175 N176 M227A168-K172 PolarHBondContact O-N 2.71Å; R169-K172 WeakPolarHBondContact O-CB 3.31Å; R169-K172 PolarHBondContact O-N 3.21Å; N170-K172 VanDerWaalsContact C-N 3.27Å; N170-K172 PolarHBondContact O-N 3.28Å; K172-C175 PolarHBondContact O-N 3.01Å; K172-N176 VanDerWaalsContact O-CG 3.26Å; K172-N176 PolarHBondContact O-N 2.89Å; K172-N176 PolarHBondContact O-ND2 3.01Å; K172-N176 PolarHBondContact O-OD1 3.31Å; K172-M227 HydrophobicContact CB-SD 4.36Å; K172-M227 HydrophobicContact CG-SD 4.38Å
173L96.2Very high94.4Very high100 Ų10058.3 Ų58.352%0.52427%0.267SS..Hα-helixtrans-62.4-46177.4-67.9174.7000111.9R169 N170 C175 N176 Q177R169-L173 PolarHBondContact O-N 2.93Å; N170-L173 WeakPolarHBondContact O-CB 3.48Å; N170-L173 PolarHBondContact O-N 3.09Å; N170-L173 VanDerWaalsContact O-N 3.1Å; L173-C175 VanDerWaalsContact C-N 3.33Å; L173-C175 PolarHBondContact O-N 2.93Å; L173-N176 PolarHBondContact O-N 3.16Å; L173-Q177 WeakPolarHBondContact O-CG 3.31Å; L173-Q177 PolarHBondContact O-N 2.95Å
174L95.9Very high94.8Very high4 Ų455 Ų552%0.02126%0.264CS..Hα-helixtrans-63.1-38.4176.4-71.1175.1000112.3L71 Q74 Y75 L79 N170 A171 Q177 C178L71-L174 HydrophobicContact CD1-CB 4.07Å; Q74-L174 HydrophobicContact CB-CD1 4.26Å; Q74-L174 HydrophobicContact CB-CD2 4.37Å; Y75-L174 HydrophobicContact CD1-CB 4.4Å; Y75-L174 HydrophobicContact CD1-CD1 3.72Å; Y75-L174 HydrophobicContact CE1-CB 3.78Å; Y75-L174 HydrophobicContact CE1-CD1 3.86Å; L79-L174 HydrophobicContact CD1-CD1 4.35Å; L79-L174 HydrophobicContact CG-CD1 4.43Å; N170-L174 WeakPolarHBondContact O-CG 3.44Å; N170-L174 PolarHBondContact O-N 3.44Å; A171-L174 PolarHBondContact O-N 3.28Å; L174-Q177 PolarHBondContact O-N 3.44Å; L174-C178 PolarHBondContact O-N 3.34Å
175C96.2Very high95.1Very high0 Ų054.1 Ų54.10%026%0.262CS..Hα-helixtrans-63.2-43.9174.7-169.20000111.7A171 K172 L173 Q177 C178 H179 M227A171-C175 WeakPolarHBondContact O-CB 3.28Å; A171-C175 PolarHBondContact O-N 3.03Å; K172-C175 PolarHBondContact O-N 3.01Å; L173-C175 VanDerWaalsContact C-N 3.33Å; L173-C175 PolarHBondContact O-N 2.93Å; C175-Q177 VanDerWaalsContact C-N 3.34Å; C175-Q177 PolarHBondContact O-N 3.3Å; C175-C178 WeakPolarHBondContact O-CB 3.31Å; C175-C178 PolarHBondContact O-N 3.34Å; C175-C178 VanDerWaalsContact O-N 3.12Å; C175-H179 PolarHBondContact O-CD2 3.08Å; C175-H179 PolarHBondContact O-N 3.09Å; C175-M227 HydrophobicContact CB-CB 4.21Å; C175-M227 HydrophobicContact CB-CE 3.65Å; C175-M227 HydrophobicContact CB-CG 4Å; C175-M227 HydrophobicContact CB-SD 4.49Å; C175-M227 WeakPolarHBondContact SG-CE 3.4Å
176N96.2Very high95.2Very high71 Ų7152.1 Ų52.138%0.3825%0.253SS..Hα-helixtrans-60.2-43.4175.4-67.3-17.5000111.7K172 L173 C178 H179 D180K172-N176 VanDerWaalsContact O-CG 3.26Å; K172-N176 PolarHBondContact O-N 2.89Å; K172-N176 PolarHBondContact O-ND2 3.01Å; K172-N176 PolarHBondContact O-OD1 3.31Å; L173-N176 PolarHBondContact O-N 3.16Å; N176-C178 VanDerWaalsContact C-N 3.3Å; N176-C178 PolarHBondContact O-N 3.47Å; N176-H179 WeakPolarHBondContact O-CB 3.29Å; N176-H179 PolarHBondContact O-N 3.36Å; N176-H179 VanDerWaalsContact O-N 3.16Å; N176-D180 PolarHBondContact O-N 3.43Å
177Q96.4Very high95.3Very high88 Ų8856.6 Ų56.641%0.41126%0.264SS..Hα-helixtrans-60.5-39.8174.6-70175.7100111.9L173 L174 C175 D180 R181L173-Q177 WeakPolarHBondContact O-CG 3.31Å; L173-Q177 PolarHBondContact O-N 2.95Å; L174-Q177 PolarHBondContact O-N 3.44Å; C175-Q177 VanDerWaalsContact C-N 3.34Å; C175-Q177 PolarHBondContact O-N 3.3Å; Q177-D180 PolarHBondContact O-N 3.24Å; Q177-R181 WeakPolarHBondContact O-CG 3.44Å; Q177-R181 PolarHBondContact O-N 3.33Å
178C96.6Very high95.4Very high1 Ų157.5 Ų57.51%0.00727%0.273CS..Hα-helixtrans-62.8-43.9174.1-179.40000111.3L71 L174 C175 N176 D180 R181 L182L71-C178 HydrophobicContact CB-CB 4.35Å; L71-C178 HydrophobicContact CD1-CB 4.07Å; L71-C178 HydrophobicContact CD2-CB 4.05Å; L71-C178 HydrophobicContact CG-CB 4.38Å; L174-C178 PolarHBondContact O-N 3.34Å; C175-C178 WeakPolarHBondContact O-CB 3.31Å; C175-C178 PolarHBondContact O-N 3.34Å; C175-C178 VanDerWaalsContact O-N 3.12Å; N176-C178 VanDerWaalsContact C-N 3.3Å; N176-C178 PolarHBondContact O-N 3.47Å; C178-D180 VanDerWaalsContact C-N 3.31Å; C178-D180 PolarHBondContact O-N 3.04Å; C178-R181 PolarHBondContact O-N 3.39Å; C178-L182 WeakPolarHBondContact O-CG 3.32Å; C178-L182 PolarHBondContact O-N 3.05Å
179H95.9Very high95.4Very high18 Ų1857.1 Ų57.18%0.08327%0.269CS..Hα-helixtrans-59.5-40.9175.1-74.7-166.2000112.3C175 N176 R181 L182 R183 A220 E224C175-H179 PolarHBondContact O-CD2 3.08Å; C175-H179 PolarHBondContact O-N 3.09Å; N176-H179 WeakPolarHBondContact O-CB 3.29Å; N176-H179 PolarHBondContact O-N 3.36Å; N176-H179 VanDerWaalsContact O-N 3.16Å; H179-R181 VanDerWaalsContact C-N 3.35Å; H179-L182 PolarHBondContact O-N 3.49Å; H179-R183 WeakPolarHBondContact O-CG 3.18Å; H179-R183 PolarHBondContact O-N 3.43Å; H179-A220 PolarHBondContact NE2-O 2.83Å; H179-E224 IonicContact CE1-OE1 2.73Å; H179-E224 PolarHBondContact CE1-OE1 2.99Å
180D96.5Very high95.3Very high92 Ų9251.1 Ų51.149%0.49225%0.248SC..Hα-helixtrans-65-38.3176.2-68.2-27.3000112.2N176 Q177 C178 R183 A184N176-D180 PolarHBondContact O-N 3.43Å; Q177-D180 PolarHBondContact O-N 3.24Å; C178-D180 VanDerWaalsContact C-N 3.31Å; C178-D180 PolarHBondContact O-N 3.04Å; D180-R183 WeakPolarHBondContact O-CB 3.28Å; D180-R183 PolarHBondContact O-N 3.03Å; D180-R183 IonicContact OD1-CZ 3.75Å; D180-R183 IonicContact OD1-NH1 3.94Å; D180-R183 PolarHBondContact OD1-NH1 2.83Å; D180-A184 PolarHBondContact O-N 3.13Å
181R96.6Very high95.3Very high88 Ų8853.5 Ų53.533%0.33226%0.26SS..Hα-helixtrans-66.8-42.9173.6-66.9177.7-165.6163.41.4112.1E67 Q177 C178 H179 R183 A184 V185E67-R181 HydrophobicContact CG-CB 4.21Å; E67-R181 WeakPolarHBondContact OE2-CB 3.46Å; E67-R181 WeakPolarHBondContact OE2-CD 3.4Å; E67-R181 IonicContact OE2-NH1 2.72Å; Q177-R181 WeakPolarHBondContact O-CG 3.44Å; Q177-R181 PolarHBondContact O-N 3.33Å; C178-R181 PolarHBondContact O-N 3.39Å; H179-R181 VanDerWaalsContact C-N 3.35Å; R181-R183 VanDerWaalsContact C-N 3.29Å; R181-R183 PolarHBondContact O-N 3.15Å; R181-A184 WeakPolarHBondContact O-CB 3.2Å; R181-A184 PolarHBondContact O-N 3.46Å; R181-A184 VanDerWaalsContact O-N 3.08Å; R181-V185 WeakPolarHBondContact O-CG2 3.48Å; R181-V185 PolarHBondContact O-N 3.05Å
182L96.7Very high95Very high0 Ų058.2 Ų58.20%028%0.28CS..Hα-helixtrans-59.7-40.4173.8-67.5172.1000111.3M64 E67 C178 H179 A184 V185 M186M64-L182 HydrophobicContact CB-CD2 4.24Å; M64-L182 HydrophobicContact CG-CD2 4.43Å; M64-L182 HydrophobicContact SD-CB 4.26Å; M64-L182 HydrophobicContact SD-CD2 3.37Å; M64-L182 WeakPolarHBondContact SD-CD2 3.49Å; M64-L182 HydrophobicContact SD-CG 4.41Å; E67-L182 HydrophobicContact CB-CD2 4.01Å; C178-L182 WeakPolarHBondContact O-CG 3.32Å; C178-L182 PolarHBondContact O-N 3.05Å; H179-L182 PolarHBondContact O-N 3.49Å; L182-A184 VanDerWaalsContact C-N 3.35Å; L182-V185 PolarHBondContact O-N 3.34Å; L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 PolarHBondContact O-N 3.13Å
183R94.9Very high94.8Very high98 Ų9853.6 Ų53.637%0.3726%0.26SS..Hα-helixtrans-63.1-39172.9-72.7175-168.9115.97.8112.1H179 D180 R181 M186 R187 M216H179-R183 WeakPolarHBondContact O-CG 3.18Å; H179-R183 PolarHBondContact O-N 3.43Å; D180-R183 WeakPolarHBondContact O-CB 3.28Å; D180-R183 PolarHBondContact O-N 3.03Å; D180-R183 IonicContact OD1-CZ 3.75Å; D180-R183 IonicContact OD1-NH1 3.94Å; D180-R183 PolarHBondContact OD1-NH1 2.83Å; R181-R183 VanDerWaalsContact C-N 3.29Å; R181-R183 PolarHBondContact O-N 3.15Å; R183-M186 PolarHBondContact O-N 3.16Å; R183-R187 VanDerWaalsContact O-CB 3.3Å; R183-R187 WeakPolarHBondContact O-CB 3.4Å; R183-R187 PolarHBondContact O-N 3.18Å; R183-M216 HydrophobicContact CG-CE 3.57Å
184A95.9Very high94.4Very high61 Ų6155.6 Ų55.650%0.50426%0.261SS..Hα-helixtrans-64.2-43.1176.700000111.8D180 R181 L182 R187 S188D180-A184 PolarHBondContact O-N 3.13Å; R181-A184 WeakPolarHBondContact O-CB 3.2Å; R181-A184 PolarHBondContact O-N 3.46Å; R181-A184 VanDerWaalsContact O-N 3.08Å; L182-A184 VanDerWaalsContact C-N 3.35Å; A184-R187 PolarHBondContact O-N 3.36Å; A184-S188 PolarHBondContact O-N 3.27Å
185V95.3Very high94.1Very high15 Ų1559.9 Ų59.99%0.09129%0.291CS..Hα-helixtrans-58.6-54.6172.8177.10000109.7E63 M64 E67 R181 L182 R187 S188 Y189E63-V185 HydrophobicContact CB-CG1 3.98Å; M64-V185 HydrophobicContact CE-CB 3.83Å; M64-V185 HydrophobicContact CE-CG1 3.54Å; M64-V185 HydrophobicContact CG-CG1 4.27Å; M64-V185 HydrophobicContact SD-CB 3.9Å; M64-V185 HydrophobicContact SD-CG1 3.76Å; E67-V185 HydrophobicContact CG-CG2 4.38Å; R181-V185 WeakPolarHBondContact O-CG2 3.48Å; R181-V185 PolarHBondContact O-N 3.05Å; L182-V185 PolarHBondContact O-N 3.34Å; V185-R187 VanDerWaalsContact C-N 3.29Å; V185-R187 PolarHBondContact O-N 3.5Å; V185-S188 WeakPolarHBondContact O-CB 3.5Å; V185-S188 PolarHBondContact O-N 2.92Å; V185-S188 PolarHBondContact O-OG 3.38Å; V185-Y189 HydrophobicContact CG1-CD2 3.96Å; V185-Y189 HydrophobicContact CG1-CE2 3.73Å; V185-Y189 VanDerWaalsContact O-CD2 3.27Å; V185-Y189 WeakPolarHBondContact O-CD2 3.31Å; V185-Y189 PolarHBondContact O-N 2.94Å
186M93.8Very high93.6Very high30 Ų3063.3 Ų63.315%0.14831%0.306CS..Hα-helixtrans-53.5-45.4178.1-176-17376.300112.1M64 L182 R183 S188 Y189 E190 L212 M216M64-M186 HydrophobicContact CE-CB 4.21Å; L182-M186 WeakPolarHBondContact O-CB 3.38Å; L182-M186 PolarHBondContact O-N 3.13Å; R183-M186 PolarHBondContact O-N 3.16Å; M186-S188 VanDerWaalsContact C-N 3.29Å; M186-S188 PolarHBondContact O-N 3.17Å; M186-Y189 PolarHBondContact O-N 2.68Å; M186-Y189 VanDerWaalsContact O-N 3.14Å; M186-E190 WeakPolarHBondContact CE-OE1 3.37Å; M186-E190 PolarHBondContact O-N 3.06Å; M186-L212 HydrophobicContact CG-CB 4.49Å; M186-M216 HydrophobicContact SD-CB 3.87Å; M186-M216 HydrophobicContact SD-CG 3.87Å
187R94.2Very high93Very high174 Ų17465 Ų6566%0.65731%0.31SS*.Hα-helixtrans-61.3-35.9178.1-165.3179.9-171.6108-3.6112.4R183 A184 V185 E190 I191R183-R187 VanDerWaalsContact O-CB 3.3Å; R183-R187 WeakPolarHBondContact O-CB 3.4Å; R183-R187 PolarHBondContact O-N 3.18Å; A184-R187 PolarHBondContact O-N 3.36Å; V185-R187 VanDerWaalsContact C-N 3.29Å; V185-R187 PolarHBondContact O-N 3.5Å; R187-E190 PolarHBondContact O-N 3.2Å; R187-I191 HydrophobicContact CG-CD1 4.41Å; R187-I191 WeakPolarHBondContact O-CD1 3.43Å; R187-I191 VanDerWaalsContact O-CG1 3.27Å; R187-I191 WeakPolarHBondContact O-CG1 3.3Å; R187-I191 PolarHBondContact O-N 3.39Å
188S94.4Very high92.5Very high42 Ų4270.9 Ų70.929%0.29433%0.334SS..Hα-helixtrans-63.5-40.9175.581.90000111.9A184 V185 M186 I191 K192A184-S188 PolarHBondContact O-N 3.27Å; V185-S188 WeakPolarHBondContact O-CB 3.5Å; V185-S188 PolarHBondContact O-N 2.92Å; V185-S188 PolarHBondContact O-OG 3.38Å; M186-S188 VanDerWaalsContact C-N 3.29Å; M186-S188 PolarHBondContact O-N 3.17Å; S188-I191 PolarHBondContact O-N 3.19Å; S188-K192 WeakPolarHBondContact O-CG 3.43Å; S188-K192 PolarHBondContact O-N 3.41Å
189Y93.3Very high91.9Very high3 Ų377.9 Ų77.91%0.01237%0.367CS..Hα-helixtrans-72.2-37.2176.8-74.3-82.9000112L55 S59 M60 E63 V185 M186 I191 K192 M193L55-Y189 HydrophobicContact CD2-CD1 4.41Å; S59-Y189 PolarHBondContact OG-OH 3.33Å; M60-Y189 VanDerWaalsContact CA-CZ 3.49Å; M60-Y189 WeakPolarHBondContact CA-OH 3.38Å; M60-Y189 HydrophobicContact CB-CD1 4.27Å; M60-Y189 HydrophobicContact CB-CD2 4.3Å; M60-Y189 HydrophobicContact CB-CE1 3.79Å; M60-Y189 HydrophobicContact CB-CE2 3.89Å; M60-Y189 HydrophobicContact CG-CD2 3.95Å; M60-Y189 HydrophobicContact CG-CE1 4.44Å; M60-Y189 HydrophobicContact CG-CE2 3.91Å; M60-Y189 HydrophobicContact CG-CG 4.32Å; M60-Y189 PolarHBondContact N-OH 3.21Å; E63-Y189 VanDerWaalsContact CD-OH 3.28Å; E63-Y189 PolarHBondContact OE1-OH 2.94Å; V185-Y189 HydrophobicContact CG1-CD2 3.96Å; V185-Y189 HydrophobicContact CG1-CE2 3.73Å; V185-Y189 VanDerWaalsContact O-CD2 3.27Å; V185-Y189 WeakPolarHBondContact O-CD2 3.31Å; V185-Y189 PolarHBondContact O-N 2.94Å; M186-Y189 PolarHBondContact O-N 2.68Å; M186-Y189 VanDerWaalsContact O-N 3.14Å; Y189-I191 VanDerWaalsContact C-N 3.31Å; Y189-I191 PolarHBondContact O-N 3.07Å; Y189-K192 HydrophobicContact CD1-CD 4.31Å; Y189-K192 PolarHBondContact O-N 3.46Å; Y189-M193 WeakPolarHBondContact O-CG 3.35Å; Y189-M193 PolarHBondContact O-N 3.3Å
190E92.1Very high91.3Very high36 Ų3678 Ų7817%0.16837%0.368CS..Hα-helixtrans-59-40.9171.5-75.8-177-160.300112.5M186 R187 M193 R194 L212M186-E190 WeakPolarHBondContact CE-OE1 3.37Å; M186-E190 PolarHBondContact O-N 3.06Å; R187-E190 PolarHBondContact O-N 3.2Å; E190-M193 PolarHBondContact O-N 2.92Å; E190-R194 VanDerWaalsContact O-CG 3.28Å; E190-R194 WeakPolarHBondContact O-CG 3.31Å; E190-R194 PolarHBondContact O-N 3.3Å; E190-R194 IonicContact OE2-NH2 3.29Å; E190-R194 PolarHBondContact OE2-NH2 3.45Å; E190-L212 HydrophobicContact CG-CD1 4.04Å
191I92.7Very high90.8Very high102 Ų10277 Ų7752%0.52337%0.368SS..Hα-helixtrans-64-43.8177.1-68.2163.9000110.2R187 S188 Y189 M193 R194 S195R187-I191 HydrophobicContact CG-CD1 4.41Å; R187-I191 WeakPolarHBondContact O-CD1 3.43Å; R187-I191 VanDerWaalsContact O-CG1 3.27Å; R187-I191 WeakPolarHBondContact O-CG1 3.3Å; R187-I191 PolarHBondContact O-N 3.39Å; S188-I191 PolarHBondContact O-N 3.19Å; Y189-I191 VanDerWaalsContact C-N 3.31Å; Y189-I191 PolarHBondContact O-N 3.07Å; I191-M193 VanDerWaalsContact C-N 3.29Å; I191-M193 PolarHBondContact O-N 3.44Å; I191-R194 PolarHBondContact O-N 3.37Å; I191-S195 PolarHBondContact O-N 3.04Å
192K90.5Very high90.4Very high100 Ų10078.6 Ų78.644%0.43538%0.379SS..Hα-helixtrans-61.8-33.6174.2-67.2173.2-174.6174.20112.6S188 Y189 S195S188-K192 WeakPolarHBondContact O-CG 3.43Å; S188-K192 PolarHBondContact O-N 3.41Å; Y189-K192 HydrophobicContact CD1-CD 4.31Å; Y189-K192 PolarHBondContact O-N 3.46Å; K192-S195 PolarHBondContact O-OG 2.72Å
193M90.2Very high90Very high3 Ų383.6 Ų83.62%0.01541%0.406CS..Hα-helixtrans-72.4-37.7173.6-74-179.851.100112.9L55 Y189 E190 I191 S195 K196 K197 Y205 L208 Q209 L212L55-M193 HydrophobicContact CD1-CG 4.3Å; L55-M193 HydrophobicContact CD1-SD 3.76Å; L55-M193 HydrophobicContact CD2-CG 3.45Å; L55-M193 VanDerWaalsContact CD2-CG 3.45Å; L55-M193 HydrophobicContact CD2-SD 3.95Å; L55-M193 HydrophobicContact CG-CG 4.06Å; L55-M193 HydrophobicContact CG-SD 4.18Å; Y189-M193 WeakPolarHBondContact O-CG 3.35Å; Y189-M193 PolarHBondContact O-N 3.3Å; E190-M193 PolarHBondContact O-N 2.92Å; I191-M193 VanDerWaalsContact C-N 3.29Å; I191-M193 PolarHBondContact O-N 3.44Å; M193-S195 VanDerWaalsContact C-N 3.28Å; M193-S195 PolarHBondContact O-N 2.93Å; M193-K196 PolarHBondContact O-N 2.87Å; M193-K197 PolarHBondContact O-N 3.11Å; M193-Y205 HydrophobicContact CB-CE2 4.14Å; M193-Y205 HydrophobicContact CE-CD2 3.98Å; M193-Y205 HydrophobicContact CE-CE2 3.87Å; M193-L208 HydrophobicContact CE-CB 3.31Å; M193-L208 HydrophobicContact CE-CD1 4.14Å; M193-L208 HydrophobicContact CE-CG 4.38Å; M193-L208 HydrophobicContact SD-CB 4.11Å; M193-Q209 HydrophobicContact CE-CG 3.85Å; M193-L212 HydrophobicContact SD-CD1 3.35Å; M193-L212 WeakPolarHBondContact SD-CD1 3.36Å; M193-L212 HydrophobicContact SD-CG 4.08Å
194R89.1Confident89.7Confident142 Ų14280.3 Ų80.354%0.53640%0.397SS..Hα-helixtrans-63.4-33.4-179.4-75.2173.3-163.7-161.87.8112.1E190 I191 K196 K197 Y205E190-R194 VanDerWaalsContact O-CG 3.28Å; E190-R194 WeakPolarHBondContact O-CG 3.31Å; E190-R194 PolarHBondContact O-N 3.3Å; E190-R194 IonicContact OE2-NH2 3.29Å; E190-R194 PolarHBondContact OE2-NH2 3.45Å; I191-R194 PolarHBondContact O-N 3.37Å; R194-K196 VanDerWaalsContact C-N 3.32Å; R194-K197 VanDerWaalsContact O-CB 3.25Å; R194-K197 WeakPolarHBondContact O-CB 3.39Å; R194-K197 PolarHBondContact O-N 2.86Å; R194-Y205 WeakPolarHBondContact CG-OH 3.4Å
195S88.4Confident89.4Confident94 Ų9478.2 Ų78.266%0.65738%0.376SS*.Hα-helixtrans-66.6-32.9175.356.90000112.8I191 K192 M193 K197I191-S195 PolarHBondContact O-N 3.04Å; K192-S195 PolarHBondContact O-OG 2.72Å; M193-S195 VanDerWaalsContact C-N 3.28Å; M193-S195 PolarHBondContact O-N 2.93Å; S195-K197 VanDerWaalsContact C-N 3.32Å; S195-K197 PolarHBondContact O-N 3.02Å
196K86.1Confident89.2Confident71 Ų7179.1 Ų79.131%0.30939%0.385SS..THydrogen-bonded Turntrans-85.23.6176.9-59.3-176.3-176.8-179.20114.3Y54 M193 R194 K198 E199 L200Y54-K196 PolarHBondContact O-NZ 2.94Å; M193-K196 PolarHBondContact O-N 2.87Å; R194-K196 VanDerWaalsContact C-N 3.32Å; K196-K198 PolarHBondContact O-N 3.01Å; K196-E199 PolarHBondContact O-N 2.74Å; K196-L200 HydrophobicContact CB-CD1 4.44Å
197K84.4Confident89Confident108 Ų10878.1 Ų78.147%0.4738%0.381SS..THydrogen-bonded Turntrans-56.9-28.1-173.6-171.7179.8179.4-1740113.8M193 R194 S195 E199 L200 Y205M193-K197 PolarHBondContact O-N 3.11Å; R194-K197 VanDerWaalsContact O-CB 3.25Å; R194-K197 WeakPolarHBondContact O-CB 3.39Å; R194-K197 PolarHBondContact O-N 2.86Å; S195-K197 VanDerWaalsContact C-N 3.32Å; S195-K197 PolarHBondContact O-N 3.02Å; K197-E199 VanDerWaalsContact C-N 3.29Å; K197-E199 PolarHBondContact O-N 3.13Å; K197-L200 PolarHBondContact O-N 3.43Å; K197-Y205 HydrophobicContact CG-CD2 4.49Å
198K84.5Confident88.8Confident210 Ų21069.9 Ų69.991%0.91335%0.35SS*.THydrogen-bonded Turntrans-70.5-23.6179.5-64.6-177.5-179.11790113.6K196K196-K198 PolarHBondContact O-N 3.01Å
199E84.7Confident88.6Confident149 Ų14971 Ų7170%0.69635%0.35SS*.THydrogen-bonded Turntrans-91.3-12.4-178.3-63.3169.2-172.200112.1K196 K197K196-E199 PolarHBondContact O-N 2.74Å; K197-E199 VanDerWaalsContact C-N 3.29Å; K197-E199 PolarHBondContact O-N 3.13Å
200L82.5Confident88.5Confident20 Ų2073.9 Ų73.911%0.10536%0.364CS..SBendtrans-106.3134.9-170.5-71.7170.8000111.6Y54 K196 K197 V204 Y205 L208Y54-L200 HydrophobicContact CD1-CD2 3.43Å; Y54-L200 VanDerWaalsContact CD1-CD2 3.43Å; Y54-L200 HydrophobicContact CD1-CG 4.2Å; Y54-L200 HydrophobicContact CD2-CD2 3.89Å; Y54-L200 HydrophobicContact CE1-CD2 3.29Å; Y54-L200 HydrophobicContact CE1-CG 4.24Å; Y54-L200 HydrophobicContact CE2-CD2 3.79Å; Y54-L200 HydrophobicContact CG-CD2 3.72Å; Y54-L200 VanDerWaalsContact CZ-CD2 3.49Å; K196-L200 HydrophobicContact CB-CD1 4.44Å; K197-L200 PolarHBondContact O-N 3.43Å; L200-V204 HydrophobicContact CD2-CB 4.46Å; L200-V204 HydrophobicContact CD2-CG1 3.83Å; L200-Y205 HydrophobicContact CD1-CD2 4.15Å; L200-L208 HydrophobicContact CD1-CD1 3.99Å; L200-L208 HydrophobicContact CD2-CD1 4.27Å
201S87.2Confident88.5Confident71 Ų7174.3 Ų74.350%0.49737%0.366SS..  trans-61.8145.8163.6178.80000110.1D203 V204 Y205S201-D203 PolarHBondContact O-N 3.26Å; S201-V204 PolarHBondContact O-N 2.81Å; S201-V204 VanDerWaalsContact O-N 3.12Å; S201-Y205 PolarHBondContact O-N 3.25Å
202Q88.1Confident88.5Confident122 Ų12269.6 Ų69.657%0.5734%0.342SS*.Hα-helixtrans-56.1-34.9-179-17764.124.900112.4A206Q202-A206 PolarHBondContact O-N 2.87Å; Q202-A206 VanDerWaalsContact O-N 3.11Å
203D88.4Confident88.6Confident104 Ų10468.8 Ų68.856%0.55634%0.34SS*.Hα-helixtrans-71.5-42179-66-27.5000111.8V44 S201 Y205 A206 S207V44-D203 HydrophobicContact CG2-CB 4.1Å; S201-D203 PolarHBondContact O-N 3.26Å; D203-Y205 VanDerWaalsContact C-N 3.35Å; D203-A206 PolarHBondContact O-N 3.13Å; D203-S207 PolarHBondContact O-N 3.35Å; D203-S207 PolarHBondContact O-OG 3.23Å
204V88.1Confident88.7Confident30 Ų3073.5 Ų73.518%0.18236%0.362CS..Hα-helixtrans-63.7-44176.3179.90000109.9L46 Y54 L200 S201 A206 S207 L208L46-V204 HydrophobicContact CD1-CG1 4.02Å; L46-V204 HydrophobicContact CD2-CG1 4.29Å; L46-V204 HydrophobicContact CD2-CG2 4.43Å; Y54-V204 HydrophobicContact CE2-CG1 4.27Å; L200-V204 HydrophobicContact CD2-CB 4.46Å; L200-V204 HydrophobicContact CD2-CG1 3.83Å; S201-V204 PolarHBondContact O-N 2.81Å; S201-V204 VanDerWaalsContact O-N 3.12Å; V204-A206 VanDerWaalsContact C-N 3.33Å; V204-A206 PolarHBondContact O-N 3.43Å; V204-S207 PolarHBondContact O-N 3.21Å; V204-L208 HydrophobicContact CG1-CD1 4.19Å; V204-L208 HydrophobicContact CG1-CG 4.38Å; V204-L208 VanDerWaalsContact O-CG 3.32Å; V204-L208 WeakPolarHBondContact O-CG 3.49Å; V204-L208 PolarHBondContact O-N 2.79Å
205Y90.2Very high88.9Confident16 Ų1667.6 Ų67.66%0.06334%0.341CS..Hα-helixtrans-58.6-43.8176.4-176.2-96.6000112.1M193 R194 K197 L200 S201 D203 L208 Q209M193-Y205 HydrophobicContact CB-CE2 4.14Å; M193-Y205 HydrophobicContact CE-CD2 3.98Å; M193-Y205 HydrophobicContact CE-CE2 3.87Å; R194-Y205 WeakPolarHBondContact CG-OH 3.4Å; K197-Y205 HydrophobicContact CG-CD2 4.49Å; L200-Y205 HydrophobicContact CD1-CD2 4.15Å; S201-Y205 PolarHBondContact O-N 3.25Å; D203-Y205 VanDerWaalsContact C-N 3.35Å; Y205-L208 PolarHBondContact O-N 3.33Å; Y205-Q209 HydrophobicContact CD1-CG 4.3Å; Y205-Q209 HydrophobicContact CE1-CG 3.93Å; Y205-Q209 VanDerWaalsContact CE1-OE1 3.32Å; Y205-Q209 WeakPolarHBondContact O-CG 3.46Å; Y205-Q209 PolarHBondContact O-N 2.87Å; Y205-Q209 PolarHBondContact OH-NE2 2.96Å
206A89.5Confident89.2Confident34 Ų3464.1 Ų64.128%0.28132%0.315SS..Hα-helixtrans-63.9-42.7177.300000112.3Q202 D203 V204 Q209 Q210Q202-A206 PolarHBondContact O-N 2.87Å; Q202-A206 VanDerWaalsContact O-N 3.11Å; D203-A206 PolarHBondContact O-N 3.13Å; V204-A206 VanDerWaalsContact C-N 3.33Å; V204-A206 PolarHBondContact O-N 3.43Å; A206-Q209 PolarHBondContact O-N 3.38Å; A206-Q210 PolarHBondContact O-N 2.56Å
207S89.9Confident89.6Confident10 Ų1066.2 Ų66.27%0.0732%0.321CS..Hα-helixtrans-63.6-39.7175.5-71.50000112.6V44 L46 D203 V204 Q210 H211V44-S207 PolarHBondContact N-OG 3.44Å; V44-S207 PolarHBondContact O-OG 2.96Å; L46-S207 VanDerWaalsContact CD1-CB 3.47Å; D203-S207 PolarHBondContact O-N 3.35Å; D203-S207 PolarHBondContact O-OG 3.23Å; V204-S207 PolarHBondContact O-N 3.21Å; S207-Q210 PolarHBondContact O-N 3.22Å; S207-H211 PolarHBondContact O-N 3.39Å
208L90.2Very high90.2Very high0 Ų063.8 Ų63.80%032%0.318CS..Hα-helixtrans-64.4-41.4175.7-69.8173.5000112.2L46 I51 Y54 L55 M193 L200 V204 Y205 Q210 H211 L212L46-L208 HydrophobicContact CD1-CD2 3.99Å; L46-L208 HydrophobicContact CD1-CG 4.05Å; I51-L208 HydrophobicContact CB-CD2 4.13Å; I51-L208 HydrophobicContact CG1-CD2 4.03Å; I51-L208 HydrophobicContact CG2-CD2 3.8Å; Y54-L208 HydrophobicContact CD2-CD1 4.23Å; Y54-L208 HydrophobicContact CG-CD1 4.27Å; L55-L208 HydrophobicContact CD1-CB 4.45Å; L55-L208 HydrophobicContact CD1-CD2 4.09Å; M193-L208 HydrophobicContact CE-CB 3.31Å; M193-L208 HydrophobicContact CE-CD1 4.14Å; M193-L208 HydrophobicContact CE-CG 4.38Å; M193-L208 HydrophobicContact SD-CB 4.11Å; L200-L208 HydrophobicContact CD1-CD1 3.99Å; L200-L208 HydrophobicContact CD2-CD1 4.27Å; V204-L208 HydrophobicContact CG1-CD1 4.19Å; V204-L208 HydrophobicContact CG1-CG 4.38Å; V204-L208 VanDerWaalsContact O-CG 3.32Å; V204-L208 WeakPolarHBondContact O-CG 3.49Å; V204-L208 PolarHBondContact O-N 2.79Å; Y205-L208 PolarHBondContact O-N 3.33Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; L208-H211 PolarHBondContact O-N 3.23Å; L208-L212 PolarHBondContact O-N 3.12Å
209Q91.1Very high90.7Very high65 Ų6554.4 Ų54.430%0.30428%0.277SS..Hα-helixtrans-61.8-43.6175.1-73-173.4-5300111.4M193 Y205 A206 H211 L212 E213M193-Q209 HydrophobicContact CE-CG 3.85Å; Y205-Q209 HydrophobicContact CD1-CG 4.3Å; Y205-Q209 HydrophobicContact CE1-CG 3.93Å; Y205-Q209 VanDerWaalsContact CE1-OE1 3.32Å; Y205-Q209 WeakPolarHBondContact O-CG 3.46Å; Y205-Q209 PolarHBondContact O-N 2.87Å; Y205-Q209 PolarHBondContact OH-NE2 2.96Å; A206-Q209 PolarHBondContact O-N 3.38Å; Q209-H211 VanDerWaalsContact C-N 3.31Å; Q209-H211 PolarHBondContact O-N 3.01Å; Q209-L212 PolarHBondContact O-N 3.19Å; Q209-E213 PolarHBondContact O-N 3.47Å
210Q91.7Very high91.3Very high64 Ų6447.8 Ų47.830%0.29925%0.248SC..Hα-helixtrans-60.9-41.8175.8-175.8-179.3-15.400111.5M43 A206 S207 L208 L212 E213 E214M43-Q210 VanDerWaalsContact CE-OE1 3.27Å; M43-Q210 VanDerWaalsContact CG-OE1 3.26Å; M43-Q210 PolarHBondContact SD-OE1 3.4Å; M43-Q210 VanDerWaalsContact SD-OE1 3.34Å; A206-Q210 PolarHBondContact O-N 2.56Å; S207-Q210 PolarHBondContact O-N 3.22Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 2.82Å; Q210-E213 PolarHBondContact O-N 3.44Å; Q210-E214 HydrophobicContact CG-CG 4.32Å; Q210-E214 WeakPolarHBondContact CG-OE1 3.37Å; Q210-E214 PolarHBondContact NE2-OE1 2.86Å; Q210-E214 WeakPolarHBondContact O-CB 3.38Å; Q210-E214 WeakPolarHBondContact O-CG 3.43Å; Q210-E214 PolarHBondContact O-N 2.99Å
211H91.3Very high91.9Very high46 Ų4655 Ų5521%0.21327%0.273CS..Hα-helixtrans-61.3-41.7176.5-177.9-84.9000112.3I51 S207 L208 Q209 E214 T215I51-H211 HydrophobicContact CD1-CB 4.39Å; S207-H211 PolarHBondContact O-N 3.39Å; L208-H211 PolarHBondContact O-N 3.23Å; Q209-H211 VanDerWaalsContact C-N 3.31Å; Q209-H211 PolarHBondContact O-N 3.01Å; H211-E214 PolarHBondContact O-N 3.18Å; H211-T215 PolarHBondContact CE1-OG1 3.14Å; H211-T215 WeakPolarHBondContact O-CB 3.22Å; H211-T215 PolarHBondContact O-N 3Å; H211-T215 PolarHBondContact O-OG1 2.86Å
212L92.4Very high92.4Very high2 Ų256.2 Ų56.21%0.0127%0.27CS..Hα-helixtrans-60.6-46174.4-71.7-175.1000111.7L55 M60 M186 E190 M193 L208 Q209 Q210 T215 M216L55-L212 HydrophobicContact CD1-CD2 3.94Å; L55-L212 HydrophobicContact CD1-CG 4.19Å; M60-L212 HydrophobicContact CE-CD2 4.29Å; M60-L212 HydrophobicContact SD-CD2 3.26Å; M60-L212 WeakPolarHBondContact SD-CD2 3.37Å; M186-L212 HydrophobicContact CG-CB 4.49Å; E190-L212 HydrophobicContact CG-CD1 4.04Å; M193-L212 HydrophobicContact SD-CD1 3.35Å; M193-L212 WeakPolarHBondContact SD-CD1 3.36Å; M193-L212 HydrophobicContact SD-CG 4.08Å; L208-L212 PolarHBondContact O-N 3.12Å; Q209-L212 PolarHBondContact O-N 3.19Å; Q210-L212 PolarHBondContact O-N 2.82Å; L212-T215 PolarHBondContact O-N 3.05Å; L212-M216 WeakPolarHBondContact O-CB 3.4Å; L212-M216 PolarHBondContact O-N 2.93Å
213E92.7Very high92.7Very high83 Ų8350.4 Ų50.439%0.38824%0.243SC..Hα-helixtrans-64-43.1178.1-73.2-172.3-159.900112.4Q209 Q210 M216 R217Q209-E213 PolarHBondContact O-N 3.47Å; Q210-E213 PolarHBondContact O-N 3.44Å; E213-M216 PolarHBondContact O-N 2.97Å; E213-R217 WeakPolarHBondContact O-CB 3.41Å; E213-R217 WeakPolarHBondContact O-CG 3.39Å; E213-R217 PolarHBondContact O-N 3.47Å; E213-R217 IonicContact OE2-CZ 2.79Å; E213-R217 IonicContact OE2-NH2 2.78Å; E213-R217 PolarHBondContact OE2-NH2 2.88Å
214E93.2Very high93.1Very high102 Ų10249.2 Ų49.248%0.47723%0.234SC..Hα-helixtrans-63.2-43.8177.6-75.3176.3-176.400111.4Q210 H211 R217 S218Q210-E214 HydrophobicContact CG-CG 4.32Å; Q210-E214 WeakPolarHBondContact CG-OE1 3.37Å; Q210-E214 PolarHBondContact NE2-OE1 2.86Å; Q210-E214 WeakPolarHBondContact O-CB 3.38Å; Q210-E214 WeakPolarHBondContact O-CG 3.43Å; Q210-E214 PolarHBondContact O-N 2.99Å; H211-E214 PolarHBondContact O-N 3.18Å; E214-R217 PolarHBondContact O-N 2.87Å; E214-S218 PolarHBondContact O-N 2.76Å
215T92.7Very high93.5Very high18 Ų1852.1 Ų52.111%0.1125%0.252CS..Hα-helixtrans-58.6-51.7174.6-55.40000110.5M60 H211 L212 R217 S218 Y219M60-T215 HydrophobicContact CE-CG2 3.87Å; H211-T215 PolarHBondContact CE1-OG1 3.14Å; H211-T215 WeakPolarHBondContact O-CB 3.22Å; H211-T215 PolarHBondContact O-N 3Å; H211-T215 PolarHBondContact O-OG1 2.86Å; L212-T215 PolarHBondContact O-N 3.05Å; T215-R217 PolarHBondContact O-N 2.85Å; T215-S218 WeakPolarHBondContact O-CB 3.38Å; T215-S218 PolarHBondContact O-N 3.45Å; T215-S218 VanDerWaalsContact O-N 3.14Å; T215-Y219 HydrophobicContact CG2-CD2 3.87Å; T215-Y219 HydrophobicContact CG2-CE2 3.69Å; T215-Y219 VanDerWaalsContact O-CD2 3.24Å; T215-Y219 WeakPolarHBondContact O-CD2 3.37Å; T215-Y219 PolarHBondContact O-N 3.36Å; T215-Y219 VanDerWaalsContact O-N 3.1Å
216M94.4Very high93.7Very high22 Ų2253.7 Ų53.711%0.10826%0.261CS..Hα-helixtrans-58.5-45.4177.8178.4-82.6-169.200112R183 M186 L212 E213 S218 Y219 A220R183-M216 HydrophobicContact CG-CE 3.57Å; M186-M216 HydrophobicContact SD-CB 3.87Å; M186-M216 HydrophobicContact SD-CG 3.87Å; L212-M216 WeakPolarHBondContact O-CB 3.4Å; L212-M216 PolarHBondContact O-N 2.93Å; E213-M216 PolarHBondContact O-N 2.97Å; M216-S218 VanDerWaalsContact C-N 3.28Å; M216-S218 PolarHBondContact O-N 2.85Å; M216-Y219 PolarHBondContact O-N 3.42Å; M216-A220 WeakPolarHBondContact O-CB 3.49Å; M216-A220 PolarHBondContact O-N 2.89Å; M216-A220 HydrophobicContact SD-CB 4.43Å
217R95.2Very high94Very high115 Ų11553.2 Ų53.243%0.43425%0.253SS..Hα-helixtrans-60.6-37.8177.2-72.8170.8-163.7-164.99.2111.6E213 E214 T215 R221E213-R217 WeakPolarHBondContact O-CB 3.41Å; E213-R217 WeakPolarHBondContact O-CG 3.39Å; E213-R217 PolarHBondContact O-N 3.47Å; E213-R217 IonicContact OE2-CZ 2.79Å; E213-R217 IonicContact OE2-NH2 2.78Å; E213-R217 PolarHBondContact OE2-NH2 2.88Å; E214-R217 PolarHBondContact O-N 2.87Å; T215-R217 PolarHBondContact O-N 2.85Å; R217-R221 WeakPolarHBondContact O-CB 3.49Å; R217-R221 VanDerWaalsContact O-CG 3.23Å; R217-R221 WeakPolarHBondContact O-CG 3.46Å; R217-R221 PolarHBondContact O-N 2.95Å
218S95.9Very high94.2Very high57 Ų5757.7 Ų57.740%0.39927%0.273SS..Hα-helixtrans-62.3-48.3175-175.90000111.7E214 T215 M216 R221 K222E214-S218 PolarHBondContact O-N 2.76Å; T215-S218 WeakPolarHBondContact O-CB 3.38Å; T215-S218 PolarHBondContact O-N 3.45Å; T215-S218 VanDerWaalsContact O-N 3.14Å; M216-S218 VanDerWaalsContact C-N 3.28Å; M216-S218 PolarHBondContact O-N 2.85Å; S218-R221 PolarHBondContact O-N 3.19Å; S218-K222 WeakPolarHBondContact O-CG 2.79Å; S218-K222 PolarHBondContact O-N 2.85Å; S218-K222 VanDerWaalsContact O-N 3.08Å
219Y96Very high94.3Very high13 Ų1360.2 Ų60.25%0.05129%0.29CS..Hα-helixtrans-67.6-37.6177.3-75.8-78.9000113M64 E65 L68 T215 M216 R221 K222 G223M64-Y219 HydrophobicContact CB-CD1 3.95Å; M64-Y219 HydrophobicContact CB-CD2 3.77Å; M64-Y219 HydrophobicContact CB-CE1 3.99Å; M64-Y219 HydrophobicContact CB-CE2 3.81Å; M64-Y219 HydrophobicContact CB-CG 3.87Å; M64-Y219 HydrophobicContact CG-CD2 4.11Å; M64-Y219 HydrophobicContact CG-CE2 4.28Å; E65-Y219 HydrophobicContact CG-CE1 3.65Å; E65-Y219 PolarHBondContact OE1-OH 3.15Å; L68-Y219 HydrophobicContact CD1-CD1 3.6Å; L68-Y219 HydrophobicContact CD1-CE1 4.28Å; L68-Y219 HydrophobicContact CG-CD1 4.23Å; T215-Y219 HydrophobicContact CG2-CD2 3.87Å; T215-Y219 HydrophobicContact CG2-CE2 3.69Å; T215-Y219 VanDerWaalsContact O-CD2 3.24Å; T215-Y219 WeakPolarHBondContact O-CD2 3.37Å; T215-Y219 PolarHBondContact O-N 3.36Å; T215-Y219 VanDerWaalsContact O-N 3.1Å; M216-Y219 PolarHBondContact O-N 3.42Å; Y219-R221 PolarHBondContact O-N 3.44Å; Y219-K222 HydrophobicContact CD1-CD 4.25Å; Y219-K222 WeakPolarHBondContact O-CB 3.13Å; Y219-K222 PolarHBondContact O-N 3.36Å; Y219-G223 PolarHBondContact O-N 2.79Å
220A95.9Very high94.4Very high10 Ų1060.1 Ų60.18%0.08329%0.289CS..Hα-helixtrans-61-44.3174.700000111.7H179 M216 G223 E224H179-A220 PolarHBondContact NE2-O 2.83Å; M216-A220 WeakPolarHBondContact O-CB 3.49Å; M216-A220 PolarHBondContact O-N 2.89Å; M216-A220 HydrophobicContact SD-CB 4.43Å; A220-G223 WeakPolarHBondContact O-CA 3.2Å; A220-G223 PolarHBondContact O-N 3.02Å; A220-G223 VanDerWaalsContact O-N 3.11Å; A220-E224 WeakPolarHBondContact O-CG 3.42Å; A220-E224 PolarHBondContact O-N 2.95Å
221R96.7Very high94.4Very high171 Ų17159.4 Ų59.465%0.64529%0.285SS*.Hα-helixtrans-61.3-42.4174.2-74173.2-176-161.61.6112.4R217 S218 Y219 G223 E224 V225R217-R221 WeakPolarHBondContact O-CB 3.49Å; R217-R221 VanDerWaalsContact O-CG 3.23Å; R217-R221 WeakPolarHBondContact O-CG 3.46Å; R217-R221 PolarHBondContact O-N 2.95Å; S218-R221 PolarHBondContact O-N 3.19Å; Y219-R221 PolarHBondContact O-N 3.44Å; R221-G223 PolarHBondContact O-N 3.15Å; R221-E224 PolarHBondContact O-N 3.19Å; R221-V225 WeakPolarHBondContact O-CG2 3.49Å; R221-V225 PolarHBondContact O-N 2.83Å
222K96.1Very high94.4Very high96 Ų9659.8 Ų59.842%0.41729%0.293SS..Hα-helixtrans-58-40.2173.6-69.8173.7-174.8175.90111L68 S218 Y219 L226L68-K222 HydrophobicContact CD1-CB 3.87Å; L68-K222 HydrophobicContact CD1-CD 4.04Å; S218-K222 WeakPolarHBondContact O-CG 2.79Å; S218-K222 PolarHBondContact O-N 2.85Å; S218-K222 VanDerWaalsContact O-N 3.08Å; Y219-K222 HydrophobicContact CD1-CD 4.25Å; Y219-K222 WeakPolarHBondContact O-CB 3.13Å; Y219-K222 PolarHBondContact O-N 3.36Å; K222-L226 WeakPolarHBondContact O-CG 3.43Å; K222-L226 PolarHBondContact O-N 3.1Å
223G95.5Very high94.3Very high1 Ų163.6 Ų63.61%0.0131%0.311CS..Hα-helixtrans-65.4-40.3174.800000113.8Y219 A220 R221 L226 M227Y219-G223 PolarHBondContact O-N 2.79Å; A220-G223 WeakPolarHBondContact O-CA 3.2Å; A220-G223 PolarHBondContact O-N 3.02Å; A220-G223 VanDerWaalsContact O-N 3.11Å; R221-G223 PolarHBondContact O-N 3.15Å; G223-L226 PolarHBondContact O-N 3.36Å; G223-M227 PolarHBondContact O-N 2.98Å
224E96Very high94.1Very high78 Ų7859.9 Ų59.936%0.36429%0.294SS..Hα-helixtrans-64.5-46176.2-71.8169.4174.900111.7H179 A220 R221 L226 M227 E228H179-E224 IonicContact CE1-OE1 2.73Å; H179-E224 PolarHBondContact CE1-OE1 2.99Å; A220-E224 WeakPolarHBondContact O-CG 3.42Å; A220-E224 PolarHBondContact O-N 2.95Å; R221-E224 PolarHBondContact O-N 3.19Å; E224-L226 VanDerWaalsContact C-N 3.27Å; E224-L226 PolarHBondContact O-N 3.27Å; E224-M227 WeakPolarHBondContact O-CA 3.12Å; E224-M227 WeakPolarHBondContact O-CB 3.49Å; E224-M227 PolarHBondContact O-N 2.84Å; E224-E228 WeakPolarHBondContact O-CG 3.38Å; E224-E228 PolarHBondContact O-N 2.86Å
225V96.4Very high93.8Very high92 Ų9258.9 Ų58.956%0.55829%0.291SS*.Hα-helixtrans-58.3-40.8175.9172.60000111.3R221 M227 S229R221-V225 WeakPolarHBondContact O-CG2 3.49Å; R221-V225 PolarHBondContact O-N 2.83Å; V225-M227 VanDerWaalsContact C-N 3.34Å; V225-S229 VanDerWaalsContact O-CB 3.25Å; V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.3Å
226L95.2Very high93.4Very high48 Ų4862 Ų6225%0.25131%0.307SS..Hα-helixtrans-65.2-37.3175-70.8171.1000112.3K72 Y75 K222 G223 E224 K230K72-L226 HydrophobicContact CG-CD1 4.12Å; Y75-L226 HydrophobicContact CE2-CB 4.28Å; K222-L226 WeakPolarHBondContact O-CG 3.43Å; K222-L226 PolarHBondContact O-N 3.1Å; G223-L226 PolarHBondContact O-N 3.36Å; E224-L226 VanDerWaalsContact C-N 3.27Å; E224-L226 PolarHBondContact O-N 3.27Å; L226-K230 WeakPolarHBondContact O-CB 3.46Å; L226-K230 VanDerWaalsContact O-CG 3.29Å; L226-K230 WeakPolarHBondContact O-CG 3.14Å; L226-K230 PolarHBondContact O-N 2.97Å; L226-K230 VanDerWaalsContact O-N 3.15Å
227M94.8Very high92.1Very high25 Ų2566.2 Ų66.212%0.12333%0.327CS..Hα-helixtrans-66.4-48.6176.7-171.6-134.5-54.700111.2K172 C175 G223 E224 V225 K230 Q231K172-M227 HydrophobicContact CB-SD 4.36Å; K172-M227 HydrophobicContact CG-SD 4.38Å; C175-M227 HydrophobicContact CB-CB 4.21Å; C175-M227 HydrophobicContact CB-CE 3.65Å; C175-M227 HydrophobicContact CB-CG 4Å; C175-M227 HydrophobicContact CB-SD 4.49Å; C175-M227 WeakPolarHBondContact SG-CE 3.4Å; G223-M227 PolarHBondContact O-N 2.98Å; E224-M227 WeakPolarHBondContact O-CA 3.12Å; E224-M227 WeakPolarHBondContact O-CB 3.49Å; E224-M227 PolarHBondContact O-N 2.84Å; V225-M227 VanDerWaalsContact C-N 3.34Å; M227-K230 PolarHBondContact O-N 2.83Å; M227-Q231 WeakPolarHBondContact O-CB 3.27Å; M227-Q231 WeakPolarHBondContact O-CG 3.28Å; M227-Q231 PolarHBondContact O-N 2.88Å
228E94.6Very high90.3Very high104 Ų10463.1 Ų63.149%0.48633%0.326SS..Hα-helixtrans-61.2-47.7180-71.5177.5175.900111.3E224 K230 Q231 S232E224-E228 WeakPolarHBondContact O-CG 3.38Å; E224-E228 PolarHBondContact O-N 2.86Å; E228-K230 VanDerWaalsContact C-N 3.32Å; E228-K230 PolarHBondContact O-N 3.39Å; E228-Q231 PolarHBondContact O-N 2.78Å; E228-Q231 VanDerWaalsContact O-N 3.15Å; E228-S232 PolarHBondContact O-N 3.05Å; E228-S232 PolarHBondContact O-OG 3.16Å
229S93.4Very high88.1Confident52 Ų5271 Ų7136%0.36435%0.353SS..Hα-helixtrans-54.6-46.9174.8173.60000111.7V225 S232 E233V225-S229 VanDerWaalsContact O-CB 3.25Å; V225-S229 WeakPolarHBondContact O-CB 3.39Å; V225-S229 PolarHBondContact O-N 3.3Å; S229-S232 PolarHBondContact O-N 3.22Å; S229-S232 PolarHBondContact O-OG 3.35Å; S229-E233 VanDerWaalsContact O-CG 3.31Å; S229-E233 WeakPolarHBondContact O-CG 3.29Å; S229-E233 PolarHBondContact O-N 3.41Å
230K91.6Very high87.7Confident64 Ų6473.9 Ų73.928%0.27837%0.368SS..Hα-helixtrans-67.4-38.2176.9-73.7-73.2161.6-152.50113Y75 L226 M227 E228 E233 L234Y75-K230 HydrophobicContact CD2-CG 3.79Å; Y75-K230 HydrophobicContact CE2-CG 4.15Å; Y75-K230 HydrophobicContact CG-CG 4.44Å; L226-K230 WeakPolarHBondContact O-CB 3.46Å; L226-K230 VanDerWaalsContact O-CG 3.29Å; L226-K230 WeakPolarHBondContact O-CG 3.14Å; L226-K230 PolarHBondContact O-N 2.97Å; L226-K230 VanDerWaalsContact O-N 3.15Å; M227-K230 PolarHBondContact O-N 2.83Å; E228-K230 VanDerWaalsContact C-N 3.32Å; E228-K230 PolarHBondContact O-N 3.39Å; K230-E233 IonicContact NZ-OE1 3.27Å; K230-E233 IonicContact NZ-OE2 3.79Å; K230-E233 PolarHBondContact NZ-OE2 3.03Å; K230-E233 PolarHBondContact O-N 3.38Å; K230-L234 WeakPolarHBondContact O-CB 3.49Å; K230-L234 WeakPolarHBondContact O-CG 3.18Å; K230-L234 PolarHBondContact O-N 3.11Å
231Q92.5Very high87.3Confident48 Ų4877.3 Ų77.322%0.22438%0.383CS..Hα-helixtrans-66.2-42177.2-75.9178.8-20.400111.9A168 A171 M227 E228 L234 L235A168-Q231 HydrophobicContact CB-CG 4.26Å; A168-Q231 PolarHBondContact O-NE2 3.44Å; A168-Q231 VanDerWaalsContact O-NE2 3.1Å; A171-Q231 HydrophobicContact CB-CG 4.3Å; M227-Q231 WeakPolarHBondContact O-CB 3.27Å; M227-Q231 WeakPolarHBondContact O-CG 3.28Å; M227-Q231 PolarHBondContact O-N 2.88Å; E228-Q231 PolarHBondContact O-N 2.78Å; E228-Q231 VanDerWaalsContact O-N 3.15Å; Q231-L234 PolarHBondContact O-N 2.78Å; Q231-L235 WeakPolarHBondContact O-CB 3.39Å; Q231-L235 VanDerWaalsContact O-CG 3.31Å; Q231-L235 WeakPolarHBondContact O-CG 3.44Å; Q231-L235 PolarHBondContact O-N 3.08Å
232S91.2Very high86.8Confident54 Ų5472.1 Ų72.138%0.37837%0.369SS..Hα-helixtrans-63.4-43.7174.251.40000111.8E228 S229 L234 L235 D236E228-S232 PolarHBondContact O-N 3.05Å; E228-S232 PolarHBondContact O-OG 3.16Å; S229-S232 PolarHBondContact O-N 3.22Å; S229-S232 PolarHBondContact O-OG 3.35Å; S232-L234 VanDerWaalsContact C-N 3.3Å; S232-L234 PolarHBondContact O-N 3.42Å; S232-L235 PolarHBondContact O-N 3.06Å; S232-D236 VanDerWaalsContact O-CB 3.31Å; S232-D236 WeakPolarHBondContact O-CB 3.41Å; S232-D236 PolarHBondContact O-N 3.09Å
233E90Very high86.2Confident83 Ų8370.6 Ų70.639%0.38837%0.366SS..Hα-helixtrans-57.3-43.7176.5-76.4173.8-169.100112S229 K230 Q237S229-E233 VanDerWaalsContact O-CG 3.31Å; S229-E233 WeakPolarHBondContact O-CG 3.29Å; S229-E233 PolarHBondContact O-N 3.41Å; K230-E233 IonicContact NZ-OE1 3.27Å; K230-E233 IonicContact NZ-OE2 3.79Å; K230-E233 PolarHBondContact NZ-OE2 3.03Å; K230-E233 PolarHBondContact O-N 3.38Å; E233-Q237 VanDerWaalsContact O-CG 3.28Å; E233-Q237 WeakPolarHBondContact O-CG 3.49Å
234L88Confident85.6Confident5 Ų575 Ų753%0.02639%0.388CS..Hα-helixtrans-70.5-34.5-179-68.8171.7000112.7M81 R164 M167 K230 Q231 S232M81-L234 HydrophobicContact CG-CD2 3.91Å; M81-L234 HydrophobicContact SD-CD2 3.28Å; M81-L234 WeakPolarHBondContact SD-CD2 3.46Å; R164-L234 VanDerWaalsContact CD-O 3.31Å; R164-L234 WeakPolarHBondContact CD-O 3.04Å; M167-L234 HydrophobicContact CB-CD1 3.88Å; M167-L234 HydrophobicContact CB-CD2 4.39Å; M167-L234 HydrophobicContact SD-CD2 4.48Å; K230-L234 WeakPolarHBondContact O-CB 3.49Å; K230-L234 WeakPolarHBondContact O-CG 3.18Å; K230-L234 PolarHBondContact O-N 3.11Å; Q231-L234 PolarHBondContact O-N 2.78Å; S232-L234 VanDerWaalsContact C-N 3.3Å; S232-L234 PolarHBondContact O-N 3.42Å
235L87.9Confident84.9Confident80 Ų8074.8 Ų74.842%0.41939%0.389SS..Hα-helixtrans-89.2-36.5-176.3-66.6174.9000113.1E165 Q231 S232 Q237 A238E165-L235 HydrophobicContact CG-CD2 4.34Å; Q231-L235 WeakPolarHBondContact O-CB 3.39Å; Q231-L235 VanDerWaalsContact O-CG 3.31Å; Q231-L235 WeakPolarHBondContact O-CG 3.44Å; Q231-L235 PolarHBondContact O-N 3.08Å; S232-L235 PolarHBondContact O-N 3.06Å; L235-Q237 VanDerWaalsContact C-N 3.32Å; L235-Q237 PolarHBondContact O-N 2.91Å; L235-A238 WeakPolarHBondContact O-CB 3.31Å; L235-A238 PolarHBondContact O-N 2.96Å; L235-A238 VanDerWaalsContact O-N 3.08Å
236D83.4Confident84.1Confident84 Ų8473.6 Ų73.645%0.44938%0.377SS..Hα-helixtrans-69.9-29.6-177.4-78.8-39.8000112.7S232 A238 K239S232-D236 VanDerWaalsContact O-CB 3.31Å; S232-D236 WeakPolarHBondContact O-CB 3.41Å; S232-D236 PolarHBondContact O-N 3.09Å; D236-A238 PolarHBondContact O-N 3.11Å; D236-K239 PolarHBondContact O-N 3.47Å; D236-K239 VanDerWaalsContact O-N 3.13Å; D236-K239 IonicContact OD1-NZ 3.49Å; D236-K239 PolarHBondContact OD1-NZ 3.46Å
237Q68.2Low83.3Confident111 Ų11175.5 Ų75.552%0.51939%0.387SS..THydrogen-bonded Turntrans-64.9-2171.7-68.7179.97.900113.8R164 E233 L235R164-Q237 PolarHBondContact NH2-O 3.46Å; E233-Q237 VanDerWaalsContact O-CG 3.28Å; E233-Q237 WeakPolarHBondContact O-CG 3.49Å; L235-Q237 VanDerWaalsContact C-N 3.32Å; L235-Q237 PolarHBondContact O-N 2.91Å
238A57.5Low82.3Confident50 Ų5079.8 Ų79.841%0.41341%0.409SS..THydrogen-bonded Turntrans-89.2-13.2174.400000114.8L235 D236L235-A238 WeakPolarHBondContact O-CB 3.31Å; L235-A238 PolarHBondContact O-N 2.96Å; L235-A238 VanDerWaalsContact O-N 3.08Å; D236-A238 PolarHBondContact O-N 3.11Å
239K49.4Very low81.2Confident222 Ų22277.5 Ų77.597%0.96540%0.402SS*.  trans-80.20172.2-63.3171.5-175.21510110D236D236-K239 PolarHBondContact O-N 3.47Å; D236-K239 VanDerWaalsContact O-N 3.13Å; D236-K239 IonicContact OD1-NZ 3.49Å; D236-K239 PolarHBondContact OD1-NZ 3.46Å

Retrieved 239 of 239 residues in 100.2 ms (Link to these results)