A0A087YIW9_POEFO Loading...

DCN1-like protein

AlphaFold DB , UniProt , Accession A0A087YIW9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 280 aa.

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(Predicted Aligned Error values between residue pairs)
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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M40.5Very low41.6Very low237 Ų237132.2 Ų132.2100%1.16772%0.716SS**  069.30-63.7-178.881.800109
2H39.8Very low41.6Very low190 Ų190126 Ų12688%0.8869%0.691SS**  trans-133.988.7-179.7-81.8-44.9000108.8
3S41.4Very low41.9Very low98 Ų98126.9 Ų126.969%0.68569%0.687SS**  trans-147.7-4.8171.5-53.40000114.7
4D44Very low41.8Very low134 Ų134125.7 Ų125.772%0.71768%0.679SS**SBendtrans-99-10.6-171.2-67.1-33.5000115.9
5A43.7Very low41.9Very low86 Ų86123.1 Ų123.171%0.71167%0.669SS**Hα-helixtrans-78.2-26.7-178.300000113.9
6A44.9Very low42.3Very low71 Ų71120.8 Ų120.859%0.58766%0.66SS**Hα-helixtrans-80.2-24.2-178.800000113.2
7N40.7Very low42.3Very low104 Ų104120 Ų12056%0.55665%0.654SS**Hα-helixtrans-80.5-23.7-179-94.5-14.8000113.6N11N7-N11 PolarHBondContact O-N 3.5Å
8F37.6Very low42.3Very low177 Ų177115.7 Ų115.778%0.77664%0.637SS**Hα-helixtrans-74.7-32.9177.5-113.2-89.6000112.7S12F8-S12 PolarHBondContact O-N 3.35Å
9Q44Very low42.3Very low140 Ų140112.8 Ų112.865%0.65463%0.626SS**Hα-helixtrans-76.4-31178.6-114.4169.4-25.600113.1S12Q9-S12 PolarHBondContact O-OG 3.42Å; Q9-S12 VanDerWaalsContact O-OG 3.04Å
10L41.3Very low42.7Very low111 Ų111112.4 Ų112.458%0.58162%0.622SS**Hα-helixtrans-71.9-37.7174-122.583.9000111.7S12 H13 L14L10-S12 PolarHBondContact O-N 3.29Å; L10-H13 PolarHBondContact O-N 3.27Å; L10-L14 WeakPolarHBondContact O-CD1 3.44Å; L10-L14 PolarHBondContact O-N 2.66Å; L10-L14 VanDerWaalsContact O-N 3.15Å
11N40Very low42.9Very low106 Ų106113.5 Ų113.557%0.56762%0.622SS**Hα-helixtrans-72.4-25.5-179.4-79.2-10.1000113.6N7 T15N7-N11 PolarHBondContact O-N 3.5Å; N11-T15 WeakPolarHBondContact O-CG2 3.43Å; N11-T15 PolarHBondContact O-N 3.2Å; N11-T15 PolarHBondContact O-OG1 3.04Å
12S41.9Very low43.1Very low58 Ų58109.2 Ų109.241%0.40660%0.597SS.*Hα-helixtrans-74.9-33172.762.40000112.8F8 Q9 L10 T15 T16F8-S12 PolarHBondContact O-N 3.35Å; Q9-S12 PolarHBondContact O-OG 3.42Å; Q9-S12 VanDerWaalsContact O-OG 3.04Å; L10-S12 PolarHBondContact O-N 3.29Å; S12-T15 WeakPolarHBondContact CA-OG1 3.36Å; S12-T15 PolarHBondContact O-OG1 3.32Å; S12-T16 PolarHBondContact O-N 3.3Å; S12-T16 PolarHBondContact O-OG1 3.48Å; S12-T16 VanDerWaalsContact O-OG1 3.14Å
13H45Very low43.7Very low138 Ų138105.5 Ų105.564%0.63958%0.582SS**Hα-helixtrans-74.5-35.9175.7-89.8-88.1000113L10 T15 T16 L17L10-H13 PolarHBondContact O-N 3.27Å; H13-T15 VanDerWaalsContact C-N 3.29Å; H13-T15 PolarHBondContact O-N 2.6Å; H13-T16 PolarHBondContact O-N 3.28Å; H13-L17 PolarHBondContact O-N 2.87Å
14L40.7Very low44Very low110 Ų110107.3 Ų107.358%0.57658%0.58SS**Hα-helixtrans-67.7-26.6175.3-93.7134.7000113.2L10 A18L10-L14 WeakPolarHBondContact O-CD1 3.44Å; L10-L14 PolarHBondContact O-N 2.66Å; L10-L14 VanDerWaalsContact O-N 3.15Å; L14-A18 WeakPolarHBondContact O-CB 3.2Å; L14-A18 PolarHBondContact O-N 3.42Å
15T43.8Very low44Very low86 Ų86106.5 Ų106.553%0.52857%0.571SS.*Hα-helixtrans-80.9-29.8179.140.20000112.9N11 S12 H13 S19N11-T15 WeakPolarHBondContact O-CG2 3.43Å; N11-T15 PolarHBondContact O-N 3.2Å; N11-T15 PolarHBondContact O-OG1 3.04Å; S12-T15 WeakPolarHBondContact CA-OG1 3.36Å; S12-T15 PolarHBondContact O-OG1 3.32Å; H13-T15 VanDerWaalsContact C-N 3.29Å; H13-T15 PolarHBondContact O-N 2.6Å; T15-S19 WeakPolarHBondContact O-CB 3.03Å; T15-S19 PolarHBondContact O-N 3.06Å; T15-S19 VanDerWaalsContact O-N 3.17Å; T15-S19 PolarHBondContact O-OG 3.31Å
16T47.7Very low44Very low86 Ų86105.2 Ų105.253%0.52856%0.555SS.*Hα-helixtrans-77.8-41.9176.1-45.10000112.4S12 H13 A18 S19 I20S12-T16 PolarHBondContact O-N 3.3Å; S12-T16 PolarHBondContact O-OG1 3.48Å; S12-T16 VanDerWaalsContact O-OG1 3.14Å; H13-T16 PolarHBondContact O-N 3.28Å; T16-A18 VanDerWaalsContact C-N 3.33Å; T16-A18 PolarHBondContact O-N 2.92Å; T16-S19 WeakPolarHBondContact O-CB 3.3Å; T16-S19 PolarHBondContact O-N 3.27Å; T16-I20 PolarHBondContact O-N 3.46Å; T16-I20 VanDerWaalsContact O-N 3.07Å
17L42.9Very low44Very low108 Ų108107.4 Ų107.457%0.56556%0.556SS**Hα-helixtrans-62.4-39.3171.5-94.4157.2000112.2H13 S19 I20 H21H13-L17 PolarHBondContact O-N 2.87Å; L17-S19 PolarHBondContact O-N 3.31Å; L17-I20 PolarHBondContact O-N 3.44Å; L17-H21 PolarHBondContact O-N 3.39Å
18A42Very low44.1Very low42 Ų42108.8 Ų108.835%0.34756%0.559SS.*Hα-helixtrans-65.9-24.1173.400000113.1L14 T16 K22L14-A18 WeakPolarHBondContact O-CB 3.2Å; L14-A18 PolarHBondContact O-N 3.42Å; T16-A18 VanDerWaalsContact C-N 3.33Å; T16-A18 PolarHBondContact O-N 2.92Å; A18-K22 VanDerWaalsContact O-CB 3.3Å; A18-K22 WeakPolarHBondContact O-CB 3.47Å; A18-K22 WeakPolarHBondContact O-CD 2.96Å; A18-K22 WeakPolarHBondContact O-CG 3.46Å; A18-K22 PolarHBondContact O-N 2.98Å; A18-K22 VanDerWaalsContact O-N 3.12Å
19S41.1Very low44.2Very low62 Ų62108.1 Ų108.143%0.43455%0.551SS.*Hα-helixtrans-79.8-37.7177.7-60.60000111.3T15 T16 L17 K22 I23T15-S19 WeakPolarHBondContact O-CB 3.03Å; T15-S19 PolarHBondContact O-N 3.06Å; T15-S19 VanDerWaalsContact O-N 3.17Å; T15-S19 PolarHBondContact O-OG 3.31Å; T16-S19 WeakPolarHBondContact O-CB 3.3Å; T16-S19 PolarHBondContact O-N 3.27Å; L17-S19 PolarHBondContact O-N 3.31Å; S19-K22 PolarHBondContact O-N 3.13Å; S19-I23 WeakPolarHBondContact O-CD1 3.47Å; S19-I23 VanDerWaalsContact O-CG1 3.27Å; S19-I23 WeakPolarHBondContact O-CG1 3.44Å; S19-I23 PolarHBondContact O-N 2.82Å; S19-I23 VanDerWaalsContact O-N 3.15Å
20I50.7Low44Very low103 Ų103108.1 Ų108.153%0.52856%0.555SS.*Hα-helixtrans-67.7-43.9173.2-64.5170.1000110.8T16 L17 K22 I23 H24T16-I20 PolarHBondContact O-N 3.46Å; T16-I20 VanDerWaalsContact O-N 3.07Å; L17-I20 PolarHBondContact O-N 3.44Å; I20-K22 PolarHBondContact O-N 2.77Å; I20-I23 PolarHBondContact O-N 3.41Å; I20-H24 PolarHBondContact O-N 2.74Å; I20-H24 VanDerWaalsContact O-N 3.08Å
21H48Very low44.4Very low136 Ų136109.8 Ų109.863%0.6357%0.565SS**Hα-helixtrans-66.1-32.7175.2-86.4-143.7000113.5L17 H25L17-H21 PolarHBondContact O-N 3.39Å; H21-H25 VanDerWaalsContact O-CB 3.32Å; H21-H25 WeakPolarHBondContact O-CB 3.05Å; H21-H25 PolarHBondContact O-N 3.48Å
22K45Very low44.5Very low148 Ų148110.9 Ų110.964%0.64357%0.57SS**Hα-helixtrans-71.5-33.3175.9-82.4173.6-176.9175.40112.9A18 S19 I20 T26A18-K22 VanDerWaalsContact O-CB 3.3Å; A18-K22 WeakPolarHBondContact O-CB 3.47Å; A18-K22 WeakPolarHBondContact O-CD 2.96Å; A18-K22 WeakPolarHBondContact O-CG 3.46Å; A18-K22 PolarHBondContact O-N 2.98Å; A18-K22 VanDerWaalsContact O-N 3.12Å; S19-K22 PolarHBondContact O-N 3.13Å; I20-K22 PolarHBondContact O-N 2.77Å; K22-T26 VanDerWaalsContact O-CB 3.27Å; K22-T26 WeakPolarHBondContact O-CB 3.48Å; K22-T26 PolarHBondContact O-N 2.88Å; K22-T26 VanDerWaalsContact O-N 3.09Å; K22-T26 PolarHBondContact O-OG1 2.72Å
23I51.7Low44Very low111 Ų111114.7 Ų114.757%0.56959%0.59SS**Hα-helixtrans-68.5-47.3174.2-68.6164000109.5S19 I20 H25 T26 L27S19-I23 WeakPolarHBondContact O-CD1 3.47Å; S19-I23 VanDerWaalsContact O-CG1 3.27Å; S19-I23 WeakPolarHBondContact O-CG1 3.44Å; S19-I23 PolarHBondContact O-N 2.82Å; S19-I23 VanDerWaalsContact O-N 3.15Å; I20-I23 PolarHBondContact O-N 3.41Å; I23-H25 PolarHBondContact O-N 3.43Å; I23-T26 PolarHBondContact O-N 2.74Å; I23-L27 HydrophobicContact CG2-CD1 4.05Å; I23-L27 WeakPolarHBondContact O-CG 3.42Å; I23-L27 PolarHBondContact O-N 3.41Å; I23-L27 VanDerWaalsContact O-N 3.15Å
24H46.9Very low43.4Very low136 Ų136116.9 Ų116.963%0.6360%0.601SS**Hα-helixtrans-61.1-45.1177.4-169.1-102.6000112.9I20 T26 H28I20-H24 PolarHBondContact O-N 2.74Å; I20-H24 VanDerWaalsContact O-N 3.08Å; H24-T26 PolarHBondContact O-N 3.09Å; H24-H28 PolarHBondContact O-N 3.21Å
25H44Very low42.9Very low117 Ų117119 Ų11954%0.54261%0.613SS.*Hα-helixtrans-72.6-27.9179.9-171.1-71.1000113.7H21 I23 R29H21-H25 VanDerWaalsContact O-CB 3.32Å; H21-H25 WeakPolarHBondContact O-CB 3.05Å; H21-H25 PolarHBondContact O-N 3.48Å; I23-H25 PolarHBondContact O-N 3.43Å; H25-R29 PolarHBondContact O-N 3.27Å
26T44.1Very low42.2Very low60 Ų60121.1 Ų121.137%0.36863%0.626SS.*Hα-helixtrans-77.1-33.4177.9-56.40000111.5K22 I23 H24 R29 L30K22-T26 VanDerWaalsContact O-CB 3.27Å; K22-T26 WeakPolarHBondContact O-CB 3.48Å; K22-T26 PolarHBondContact O-N 2.88Å; K22-T26 VanDerWaalsContact O-N 3.09Å; K22-T26 PolarHBondContact O-OG1 2.72Å; I23-T26 PolarHBondContact O-N 2.74Å; H24-T26 PolarHBondContact O-N 3.09Å; T26-R29 PolarHBondContact O-N 2.71Å; T26-L30 PolarHBondContact O-N 2.86Å
27L44.7Very low41.3Very low117 Ų117120.4 Ų120.461%0.61364%0.635SS**Hα-helixtrans-67.4-37.3173.2-69.4170.5000112.3I23 R29 L30I23-L27 HydrophobicContact CG2-CD1 4.05Å; I23-L27 WeakPolarHBondContact O-CG 3.42Å; I23-L27 PolarHBondContact O-N 3.41Å; I23-L27 VanDerWaalsContact O-N 3.15Å; L27-R29 VanDerWaalsContact C-N 3.3Å; L27-R29 PolarHBondContact O-N 3.15Å; L27-L30 PolarHBondContact O-N 2.94Å
28H42Very low40.7Very low132 Ų132123.7 Ų123.761%0.61165%0.648SS**Hα-helixtrans-68.9-24.5175.2-166.5-81.3000113.5H24H24-H28 PolarHBondContact O-N 3.21Å
29R39.9Very low40Very low163 Ų163128.7 Ų128.762%0.61567%0.669SS**Hα-helixtrans-83.3-18.9-179.5-127.7-164.9-30.3-137-1.4114.2H25 T26 L27H25-R29 PolarHBondContact O-N 3.27Å; T26-R29 PolarHBondContact O-N 2.71Å; L27-R29 VanDerWaalsContact C-N 3.3Å; L27-R29 PolarHBondContact O-N 3.15Å
30L41.2Very low39.5Very low141 Ų141130.8 Ų130.874%0.73868%0.683SS**THydrogen-bonded Turntrans-92.21.2-178.5-70.4172.1000112.9T26 L27T26-L30 PolarHBondContact O-N 2.86Å; L27-L30 PolarHBondContact O-N 2.94Å
31N48.4Very low38.7Very low146 Ų146135 Ų13578%0.78170%0.7SS**SBendtrans-123.924.1-173.3-125.115.6000115.3
32L42.7Very low38.4Very low129 Ų129134.2 Ų134.268%0.67571%0.707SS**  trans-138.996.5174.7-82.6166.8000112.6
33T32Very low37.8Very low137 Ų137133.3 Ų133.384%0.8472%0.719SS**  trans177.7119.4155.641.80000104.6
34E31.7Very low36.7Very low184 Ų184132.5 Ų132.586%0.8673%0.729SS**  cis-155.5133.823.7-71163.8136.700106.3
35D30.2Very low35.7Very low154 Ų154131.2 Ų131.282%0.82473%0.734SS**  84138.980-148.8-8.9000116.5
36V30.2Very low35Very low132 Ų132131.9 Ų131.980%0.875%0.75SS**  trans104.4112.7152.3-168.70000118.8
37G27.6Very low34.5Very low70 Ų70134 Ų13472%0.72277%0.767SS**  trans168.169.9154.200000119.7
38Q30.6Very low33.9Very low178 Ų178140.6 Ų140.683%0.83278%0.784SS**  trans59.3115138.8-78173.4-26.100124
39D27.7Very low33.4Very low147 Ų147139 Ų13979%0.78679%0.794SS**  55.8126.2118.2-72.4-30.8000124.3
40S30Very low33.1Very low105 Ų105139.8 Ų139.873%0.73481%0.806SS**  113.798.112669.80000120.4
41H33.9Very low33.2Very low193 Ų193138.6 Ų138.689%0.89481%0.807SS**  trans55.4154.1131.9-76-62.5000124.5
42P42.1Very low33.4Very low118 Ų118136.6 Ų136.677%0.76680%0.803SS**  trans-108.3166-149.441-31.9000113.9
43S31.5Very low32.9Very low130 Ų130141.2 Ų141.291%0.90981%0.811SS**  trans-138.3141.7163.960.80000112.5
44A29.5Very low32.9Very low93 Ų93144.9 Ų144.977%0.76982%0.815SS**  trans-97.1152.4-160.700000113.5
45C26.7Very low33Very low109 Ų109145.2 Ų145.274%0.73681%0.814SS**  trans42.5127.4131.5-151.90000120.1
46C28.4Very low32.9Very low131 Ų131150 Ų15089%0.88582%0.82SS**  -166.7115124.5-1000000112.9
47S33.3Very low33Very low104 Ų104154.9 Ų154.973%0.72782%0.824SS**  trans-68.4151.9157.8-40.80000110.9
48R32.2Very low34Very low257 Ų257157 Ų15797%0.9783%0.825SS**  trans-159.7137.4148.5-115.8168.8177.9-171.1-0.9113.7
49A31.4Very low34Very low97 Ų97153.7 Ų153.780%0.80282%0.822SS**  trans-94.3164.4-17500000113.7
50M33.5Very low34.3Very low180 Ų180152 Ų15289%0.88783%0.828SS**  trans-49.9168160.8-70.9-113.1173.700113.1
51P43.7Very low34.4Very low116 Ų116150.3 Ų150.375%0.75383%0.828SS**  -161.5-142.851.740.5-12.6000115
52P53.6Low34.4Very low105 Ų105148.8 Ų148.868%0.68283%0.826SS**  -132.5176.4-59.830.9-10.2000117.6
53R32Very low34.1Very low226 Ų226149.7 Ų149.785%0.85382%0.824SS**  trans71.4133.9139.6-92.6-179.1176.8-167.82.3122.7
54K32.2Very low34.4Very low214 Ų214150.2 Ų150.293%0.9382%0.816SS**  -165.8138.7116.2-104.8167.6-172.8176.90114.1
55K32.2Very low34.9Very low191 Ų191151.2 Ų151.283%0.8382%0.817SS**  trans-90.9152.9172.2-86.8177.4171.2177.30110.8
56R29.9Very low35.3Very low254 Ų254150.9 Ų150.996%0.95882%0.823SS**  trans-167.3139.5133.7-114.4174.1159.3-178.2-7.1113.4
57R32.2Very low36.3Very low235 Ų235154.7 Ų154.789%0.88782%0.824SS**  trans-98180166.2-114.8-176-172.6-173.61.5108.5
58P46.7Very low36.5Very low114 Ų114159.6 Ų159.674%0.7483%0.833SS**  cis-142.3175.733.934.7-9.8000115.3
59S31.2Very low36.8Very low109 Ų109152.9 Ų152.976%0.76283%0.825SS**  175.9132.975.851.40000107.9
60A33.7Very low37.5Very low110 Ų110159.3 Ų159.391%0.90983%0.829SS**  73.3119.488.900000115.9
61G32.5Very low38.2Very low71 Ų71158.8 Ų158.873%0.73282%0.824SS**  trans158.485.6171.300000113.7
62D34.1Very low38.2Very low160 Ų160160.1 Ų160.186%0.85683%0.825SS**  16.6142.2128.4-64.4-6.8000117.7
63D35.2Very low37.8Very low137 Ų137159.7 Ų159.773%0.73382%0.824SS**  cis-173.5170.77.5-156.4-12.5000108.5
64L38Very low38.5Very low142 Ų142155.9 Ų155.974%0.74382%0.819SS**  trans82.797157.4-53.2176.6000122.6
65S39.8Very low39.1Very low113 Ų113154.2 Ų154.279%0.7981%0.812SS**  trans29.4118.4130.769.60000122.1
66A36.7Very low39.6Very low103 Ų103154.7 Ų154.785%0.85181%0.809SS**  trans-155.1119.1131.300000110.7
67K48Very low40.2Very low211 Ų211150.3 Ų150.392%0.91780%0.797SS**  trans-73.3123.9171.6-71.9175.2173175.50109.9
68K37.1Very low40.7Very low207 Ų207145.4 Ų145.490%0.978%0.784SS**  trans-170.2115.6135.1-122.9169.5175.4173.60113.2
69S38.3Very low40.6Very low116 Ų116145.4 Ų145.481%0.81177%0.774SS**  trans36.9100.3146.9-167.20000118.5
70R46.4Very low41.5Very low232 Ų232144.4 Ų144.488%0.87576%0.763SS**  trans-94.5163.8148.7-81.1-176172-176.6-2.2109.1
71Q48.1Very low42.3Very low169 Ų169141.6 Ų141.679%0.7974%0.737SS**  trans89.6105.8172.3-104106.61.900116.5
72D43.5Very low43.3Very low143 Ų143143.5 Ų143.577%0.76573%0.727SS**SBend173.920.2119.8-90-8.5000115.9
73S45.4Very low44.3Very low97 Ų97140.1 Ų140.168%0.67871%0.708SS**SBendtrans-106.72.3-178.566.30000116.4
74I48.3Very low45.3Very low145 Ų145142.9 Ų142.974%0.74471%0.708SS**SBendtrans-100.1-30.6-177.4-61.3175.9000112.2
75F43.1Very low46.3Very low179 Ų179142.5 Ų142.579%0.78570%0.703SS**Hα-helixtrans-70.7-42.4178.8-112.7-94.4000112.8K77 H78 E79F75-K77 VanDerWaalsContact C-N 3.32Å; F75-K77 PolarHBondContact O-N 3.45Å; F75-H78 PolarHBondContact O-N 2.9Å; F75-E79 PolarHBondContact O-N 3.12Å
76R43.9Very low47.4Very low201 Ų201143.3 Ų143.376%0.75869%0.694SS**Hα-helixtrans-65.1-27.5-178.4-91.1-177.9177.91730.6115T80R76-T80 PolarHBondContact O-N 3.01Å; R76-T80 PolarHBondContact O-OG1 2.98Å
77K41.5Very low49.2Very low163 Ų163145.3 Ų145.371%0.70969%0.685SS**Hα-helixtrans-77.6-35.7-179.2-91.1-173.8174.7-177.30112.7F75 S81F75-K77 VanDerWaalsContact C-N 3.32Å; F75-K77 PolarHBondContact O-N 3.45Å; K77-S81 PolarHBondContact O-N 3.49Å; K77-S81 PolarHBondContact O-OG 3.27Å
78H43.4Very low51.3Low132 Ų132139.3 Ų139.361%0.61167%0.667SS**Hα-helixtrans-72.5-40.3176.6-114.724.3000111.5F75 T80 S81 Q82F75-H78 PolarHBondContact O-N 2.9Å; H78-T80 PolarHBondContact O-N 2.94Å; H78-S81 WeakPolarHBondContact CA-OG 3.42Å; H78-S81 PolarHBondContact O-N 3.18Å; H78-S81 PolarHBondContact O-OG 2.88Å; H78-Q82 WeakPolarHBondContact O-CB 3.17Å; H78-Q82 WeakPolarHBondContact O-CG 3.3Å; H78-Q82 PolarHBondContact O-N 3.29Å
79E44.3Very low54Low113 Ų113131.6 Ų131.653%0.52863%0.633SS.*Hα-helixtrans-59.6-48.8175.6-125.4173.116700111.7F75 S81 Q82 I83F75-E79 PolarHBondContact O-N 3.12Å; E79-S81 VanDerWaalsContact C-N 3.32Å; E79-S81 PolarHBondContact O-N 3.22Å; E79-Q82 PolarHBondContact O-N 3Å; E79-I83 HydrophobicContact CG-CD1 4.47Å; E79-I83 VanDerWaalsContact O-CB 3.3Å; E79-I83 WeakPolarHBondContact O-CB 3.47Å; E79-I83 WeakPolarHBondContact O-CD1 3.21Å; E79-I83 WeakPolarHBondContact O-CG1 3.41Å; E79-I83 PolarHBondContact O-N 3.45Å
80T50.8Low56.9Low88 Ų88128 Ų12854%0.5461%0.608SS.*Hα-helixtrans-71.1-20.9179.331.60000114.9R76 H78R76-T80 PolarHBondContact O-N 3.01Å; R76-T80 PolarHBondContact O-OG1 2.98Å; H78-T80 PolarHBondContact O-N 2.94Å
81S50.5Low59.3Low52 Ų52120.9 Ų120.936%0.36459%0.594SS.*Hα-helixtrans-85.9-38.3174.236.80000112.1K77 H78 E79 R84 E85K77-S81 PolarHBondContact O-N 3.49Å; K77-S81 PolarHBondContact O-OG 3.27Å; H78-S81 WeakPolarHBondContact CA-OG 3.42Å; H78-S81 PolarHBondContact O-N 3.18Å; H78-S81 PolarHBondContact O-OG 2.88Å; E79-S81 VanDerWaalsContact C-N 3.32Å; E79-S81 PolarHBondContact O-N 3.22Å; S81-R84 PolarHBondContact O-N 2.8Å; S81-E85 PolarHBondContact O-N 3.27Å
82Q52.3Low61.6Low110 Ų110119.5 Ų119.551%0.51459%0.586SS.*Hα-helixtrans-64.4-42.5171.2-77.4179.1-29.200112.2H78 E79 R84 E85 E86H78-Q82 WeakPolarHBondContact O-CB 3.17Å; H78-Q82 WeakPolarHBondContact O-CG 3.3Å; H78-Q82 PolarHBondContact O-N 3.29Å; E79-Q82 PolarHBondContact O-N 3Å; Q82-R84 VanDerWaalsContact C-N 3.25Å; Q82-R84 PolarHBondContact O-N 3.08Å; Q82-E85 PolarHBondContact O-N 3.26Å; Q82-E86 PolarHBondContact O-N 3.01Å
83I56.1Low64.2Low90 Ų90116.2 Ų116.246%0.46256%0.562SS.*Hα-helixtrans-60.6-35.2175.5-68.2162.5000111.4E79E79-I83 HydrophobicContact CG-CD1 4.47Å; E79-I83 VanDerWaalsContact O-CB 3.3Å; E79-I83 WeakPolarHBondContact O-CB 3.47Å; E79-I83 WeakPolarHBondContact O-CD1 3.21Å; E79-I83 WeakPolarHBondContact O-CG1 3.41Å; E79-I83 PolarHBondContact O-N 3.45Å
84R56.3Low66.7Low194 Ų194111.6 Ų111.673%0.73253%0.53SS*.Hα-helixtrans-75.7-36.4177.6-86.9-178.8163.6-166.2-4.6113.6S81 Q82 E86 E87 T88S81-R84 PolarHBondContact O-N 2.8Å; Q82-R84 VanDerWaalsContact C-N 3.25Å; Q82-R84 PolarHBondContact O-N 3.08Å; R84-E86 VanDerWaalsContact C-N 3.32Å; R84-E87 PolarHBondContact O-N 2.78Å; R84-T88 PolarHBondContact O-N 3.14Å
85E58.8Low69.1Low135 Ų135107.7 Ų107.763%0.63151%0.51SS*.Hα-helixtrans-67.7-34.5175.9-79.3178.6170.600111.7S81 Q82 E87 T88S81-E85 PolarHBondContact O-N 3.27Å; Q82-E85 PolarHBondContact O-N 3.26Å; E85-E87 VanDerWaalsContact C-N 3.3Å; E85-E87 PolarHBondContact O-N 2.65Å; E85-T88 PolarHBondContact O-N 3.42Å; E85-T88 PolarHBondContact O-OG1 3.4Å; E85-T88 VanDerWaalsContact O-OG1 3.13Å
86E63.1Low71.7Confident130 Ų130104 Ų10461%0.60750%0.496SS*.Hα-helixtrans-64.1-33.4175.2-80.6-179.3168.600112.8Q82 R84 R93 R163Q82-E86 PolarHBondContact O-N 3.01Å; R84-E86 VanDerWaalsContact C-N 3.32Å; E86-R93 PolarHBondContact O-NH1 2.98Å; E86-R93 PolarHBondContact O-NH2 3.31Å; E86-R93 VanDerWaalsContact O-NH2 3.09Å; E86-R163 PolarHBondContact O-NH2 3.3Å
87E73.9Confident74.3Confident144 Ų14494.8 Ų94.867%0.67346%0.461SS*.Hα-helixtrans-78-20.2-180-79.5-160.5176.100114.9R84 E85 R163R84-E87 PolarHBondContact O-N 2.78Å; E85-E87 VanDerWaalsContact C-N 3.3Å; E85-E87 PolarHBondContact O-N 2.65Å; E87-R163 VanDerWaalsContact CA-NH2 3.27Å; E87-R163 VanDerWaalsContact O-CZ 3.31Å; E87-R163 PolarHBondContact O-NH1 3.42Å; E87-R163 PolarHBondContact O-NH2 2.89Å
88T91.1Very high77.1Confident86 Ų8687 Ų8753%0.52843%0.427SS..SBendtrans-89.7149.1176.752.70000112.7R84 E85 R93R84-T88 PolarHBondContact O-N 3.14Å; E85-T88 PolarHBondContact O-N 3.42Å; E85-T88 PolarHBondContact O-OG1 3.4Å; E85-T88 VanDerWaalsContact O-OG1 3.13Å; T88-R93 PolarHBondContact O-NH2 3.27Å
89F95.8Very high79.7Confident44 Ų4484.6 Ų84.619%0.19341%0.413CS..  trans-60.9138.6173.3172.3-90.7000111.6C94 Q157 C158 D159F89-C94 HydrophobicContact CE2-CB 3.93Å; F89-C94 HydrophobicContact CZ-CB 3.89Å; F89-Q157 VanDerWaalsContact CB-OE1 3.32Å; F89-C158 WeakPolarHBondContact CE2-O 3.48Å; F89-D159 HydrophobicContact CD2-CB 3.69Å; F89-D159 HydrophobicContact CE2-CB 3.75Å
90S97.4Very high82.2Confident40 Ų4084.3 Ų84.328%0.2841%0.412SS..  trans-127.2117.1176.9174.60000110.8K92 R93 C94 D159S90-K92 PolarHBondContact O-N 3.31Å; S90-K92 PolarHBondContact OG-N 2.85Å; S90-R93 PolarHBondContact O-N 3.09Å; S90-R93 PolarHBondContact OG-N 3.28Å; S90-C94 PolarHBondContact O-N 2.93Å; S90-D159 WeakPolarHBondContact CB-OD2 3.5Å; S90-D159 PolarHBondContact N-OD2 3.45Å
91S96.9Very high84.5Confident84 Ų8480.9 Ų80.959%0.58739%0.389SS*.Hα-helixtrans-58.6-32.1175-57.40000112.6L95S91-L95 WeakPolarHBondContact O-CB 3.45Å; S91-L95 PolarHBondContact O-N 2.97Å
92K97.4Very high86.7Confident140 Ų14078.8 Ų78.861%0.60938%0.375SS*.Hα-helixtrans-67.4-46.6177.7-176.9-178.6169.8-173.70111.1S90 C94 L95 E96S90-K92 PolarHBondContact O-N 3.31Å; S90-K92 PolarHBondContact OG-N 2.85Å; K92-C94 VanDerWaalsContact C-N 3.32Å; K92-C94 PolarHBondContact O-N 2.81Å; K92-L95 PolarHBondContact O-N 3.34Å; K92-E96 WeakPolarHBondContact CE-OE1 3.41Å; K92-E96 IonicContact NZ-OE1 3.84Å; K92-E96 WeakPolarHBondContact O-CG 3.44Å; K92-E96 PolarHBondContact O-N 3.33Å
93R97.9Very high88.7Confident74 Ų7476 Ų7628%0.27938%0.376SS..Hα-helixtrans-62.5-42.3175.6-68.6-166.2-59.2-161.1-1.4111.2E86 T88 S90 L95 E96 W97 D159E86-R93 PolarHBondContact O-NH1 2.98Å; E86-R93 PolarHBondContact O-NH2 3.31Å; E86-R93 VanDerWaalsContact O-NH2 3.09Å; T88-R93 PolarHBondContact O-NH2 3.27Å; S90-R93 PolarHBondContact O-N 3.09Å; S90-R93 PolarHBondContact OG-N 3.28Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.47Å; R93-E96 PolarHBondContact O-N 3.02Å; R93-W97 VanDerWaalsContact O-CB 3.24Å; R93-W97 WeakPolarHBondContact O-CB 3.35Å; R93-W97 PolarHBondContact O-N 3.22Å; R93-D159 HydrophobicContact CB-CB 4.14Å; R93-D159 IonicContact CZ-OD1 3.95Å; R93-D159 IonicContact CZ-OD2 3.07Å; R93-D159 IonicContact NE-OD1 2.78Å; R93-D159 IonicContact NE-OD2 2.75Å; R93-D159 PolarHBondContact NE-OD2 3.36Å; R93-D159 IonicContact NH2-OD1 2.78Å; R93-D159 PolarHBondContact NH2-OD1 2.85Å; R93-D159 IonicContact NH2-OD2 2.69Å; R93-D159 PolarHBondContact NH2-OD2 2.9Å
94C98.4Very high90.4Very high0 Ų077.5 Ų77.50%039%0.393CS..Hα-helixtrans-60.8-36.4177.7-171.10000112.7F89 S90 K92 F98 W149 L150 M153 D159F89-C94 HydrophobicContact CE2-CB 3.93Å; F89-C94 HydrophobicContact CZ-CB 3.89Å; S90-C94 PolarHBondContact O-N 2.93Å; K92-C94 VanDerWaalsContact C-N 3.32Å; K92-C94 PolarHBondContact O-N 2.81Å; C94-F98 PolarHBondContact O-N 3.2Å; C94-F98 VanDerWaalsContact O-N 3.13Å; C94-W149 PolarHBondContact O-NE1 2.75Å; C94-L150 HydrophobicContact CB-CD2 4.35Å; C94-M153 VanDerWaalsContact SG-CB 3.59Å; C94-D159 HydrophobicContact CB-CB 3.84Å
95L98.3Very high92.2Very high62 Ų6273 Ų7333%0.32538%0.384SS..Hα-helixtrans-71.4-45.7175.8-179.465.9000111.9S91 K92 R93 W97 F98 Y99 L146 L150S91-L95 WeakPolarHBondContact O-CB 3.45Å; S91-L95 PolarHBondContact O-N 2.97Å; K92-L95 PolarHBondContact O-N 3.34Å; R93-L95 VanDerWaalsContact C-N 3.27Å; R93-L95 PolarHBondContact O-N 3.47Å; L95-W97 VanDerWaalsContact C-N 3.3Å; L95-W97 PolarHBondContact O-N 3.46Å; L95-F98 WeakPolarHBondContact O-CB 3.24Å; L95-F98 PolarHBondContact O-N 3.48Å; L95-Y99 HydrophobicContact CD1-CD2 4.1Å; L95-Y99 HydrophobicContact CD1-CE2 3.53Å; L95-Y99 HydrophobicContact CG-CD2 4.16Å; L95-Y99 HydrophobicContact CG-CE2 3.9Å; L95-Y99 VanDerWaalsContact O-CD2 3.32Å; L95-Y99 WeakPolarHBondContact O-CD2 3.36Å; L95-Y99 PolarHBondContact O-N 3.26Å; L95-L146 HydrophobicContact CD1-CD1 3.44Å; L95-L146 VanDerWaalsContact CD1-CD1 3.44Å; L95-L146 HydrophobicContact CD1-CD2 4.39Å; L95-L146 HydrophobicContact CD1-CG 4.49Å; L95-L150 HydrophobicContact CB-CD2 4.23Å; L95-L150 HydrophobicContact CD1-CD1 4.31Å; L95-L150 HydrophobicContact CD1-CD2 4.36Å
96E98.1Very high94Very high103 Ų10371.2 Ų71.248%0.48138%0.378SS..Hα-helixtrans-59.9-44.4176.3-72.2169.5171.300110.4K92 R93 F98 Y99 E100K92-E96 WeakPolarHBondContact CE-OE1 3.41Å; K92-E96 IonicContact NZ-OE1 3.84Å; K92-E96 WeakPolarHBondContact O-CG 3.44Å; K92-E96 PolarHBondContact O-N 3.33Å; R93-E96 PolarHBondContact O-N 3.02Å; E96-F98 VanDerWaalsContact C-N 3.35Å; E96-F98 PolarHBondContact O-N 3.07Å; E96-Y99 PolarHBondContact O-N 3.13Å; E96-E100 PolarHBondContact O-N 3.42Å
97W98.6Very high95.7Very high7 Ų767.7 Ų67.73%0.02737%0.365CS..Hα-helixtrans-61.1-38.4176.4-175.740.6000113R93 L95 Y99 E100 Y101 F116 W149 M153 T161 L164R93-W97 VanDerWaalsContact O-CB 3.24Å; R93-W97 WeakPolarHBondContact O-CB 3.35Å; R93-W97 PolarHBondContact O-N 3.22Å; L95-W97 VanDerWaalsContact C-N 3.3Å; L95-W97 PolarHBondContact O-N 3.46Å; W97-Y99 PolarHBondContact O-N 3.26Å; W97-E100 WeakPolarHBondContact O-CB 3.12Å; W97-E100 PolarHBondContact O-N 3.32Å; W97-Y101 AromaticContact CD1-CE2 3.72Å; W97-Y101 AromaticContact CE2-CE2 3.99Å; W97-Y101 HydrophobicContact CG-CE2 4.49Å; W97-Y101 AromaticContact NE1-CE2 3.38Å; W97-Y101 AromaticContact NE1-CZ 3.8Å; W97-Y101 PolarHBondContact NE1-OH 2.99Å; W97-Y101 WeakPolarHBondContact O-CD2 3.31Å; W97-F116 HydrophobicContact CH2-CE2 4.04Å; W97-F116 HydrophobicContact CZ2-CD2 4.38Å; W97-F116 AromaticContact CZ2-CE2 3.73Å; W97-F116 HydrophobicContact CZ2-CE2 3.73Å; W97-W149 AromaticContact CD2-CZ2 3.68Å; W97-W149 HydrophobicContact CD2-CZ2 3.68Å; W97-W149 AromaticContact CE2-CZ2 3.95Å; W97-W149 AromaticContact CE3-CZ2 3.51Å; W97-W149 HydrophobicContact CE3-CZ2 3.51Å; W97-W149 AromaticContact CE3-NE1 3.99Å; W97-W149 HydrophobicContact CG-CZ2 4.36Å; W97-W149 HydrophobicContact CH2-CH2 4.3Å; W97-W149 AromaticContact CH2-CZ2 3.91Å; W97-W149 HydrophobicContact CH2-CZ2 3.91Å; W97-W149 HydrophobicContact CZ2-CH2 4.31Å; W97-W149 HydrophobicContact CZ2-CZ2 4.07Å; W97-W149 HydrophobicContact CZ3-CH2 4.45Å; W97-W149 AromaticContact CZ3-CZ2 3.63Å; W97-W149 HydrophobicContact CZ3-CZ2 3.63Å; W97-M153 HydrophobicContact CH2-CE 4.09Å; W97-M153 HydrophobicContact CH2-SD 4.19Å; W97-M153 HydrophobicContact CZ3-CE 4.11Å; W97-M153 HydrophobicContact CZ3-CG 4.28Å; W97-M153 HydrophobicContact CZ3-SD 3.85Å; W97-T161 PolarHBondContact NE1-OG1 3.33Å; W97-L164 HydrophobicContact CH2-CB 3.87Å; W97-L164 HydrophobicContact CH2-CD2 3.79Å; W97-L164 HydrophobicContact CH2-CG 4.48Å; W97-L164 HydrophobicContact CZ2-CD2 4.4Å
98F98.8Very high96.9Very high0 Ų060.9 Ų60.90%033%0.333CS..Hα-helixtrans-58.8-47.2173.8172.1-94.8000112.1C94 L95 E96 E100 Y101 A102 V108 L146 W149C94-F98 PolarHBondContact O-N 3.2Å; C94-F98 VanDerWaalsContact O-N 3.13Å; L95-F98 WeakPolarHBondContact O-CB 3.24Å; L95-F98 PolarHBondContact O-N 3.48Å; E96-F98 VanDerWaalsContact C-N 3.35Å; E96-F98 PolarHBondContact O-N 3.07Å; F98-E100 PolarHBondContact O-N 3.39Å; F98-Y101 PolarHBondContact O-N 2.88Å; F98-A102 HydrophobicContact CD1-CB 3.86Å; F98-A102 HydrophobicContact CE1-CB 3.33Å; F98-A102 HydrophobicContact CE2-CB 4.35Å; F98-A102 HydrophobicContact CZ-CB 3.62Å; F98-A102 PolarHBondContact O-N 3.28Å; F98-V108 HydrophobicContact CD2-CG2 3.84Å; F98-V108 HydrophobicContact CE2-CG2 3.51Å; F98-V108 HydrophobicContact CZ-CG2 4.06Å; F98-L146 HydrophobicContact CB-CD1 4.49Å; F98-L146 HydrophobicContact CD1-CD1 3.5Å; F98-L146 HydrophobicContact CD2-CD1 4.37Å; F98-L146 HydrophobicContact CE1-CB 3.88Å; F98-L146 HydrophobicContact CE1-CD1 3.7Å; F98-L146 HydrophobicContact CE1-CG 4.34Å; F98-L146 HydrophobicContact CE2-CB 4.33Å; F98-L146 HydrophobicContact CG-CD1 3.87Å; F98-L146 VanDerWaalsContact CZ-CA 3.48Å; F98-L146 HydrophobicContact CZ-CB 3.76Å; F98-L146 HydrophobicContact CZ-CD1 4.2Å; F98-W149 HydrophobicContact CB-CD2 4.43Å; F98-W149 HydrophobicContact CB-CG 4.22Å; F98-W149 HydrophobicContact CD2-CB 3.61Å; F98-W149 AromaticContact CD2-CD1 3.9Å; F98-W149 AromaticContact CD2-CD2 3.73Å; F98-W149 HydrophobicContact CD2-CD2 3.73Å; F98-W149 HydrophobicContact CD2-CE3 4.18Å; F98-W149 AromaticContact CD2-CG 3.49Å; F98-W149 HydrophobicContact CD2-CG 3.49Å; F98-W149 VanDerWaalsContact CD2-CG 3.49Å; F98-W149 HydrophobicContact CE2-CB 3.97Å; F98-W149 HydrophobicContact CE2-CG 4.31Å; F98-W149 HydrophobicContact CG-CG 4.28Å
99Y98.5Very high97.2Very high80 Ų8057.7 Ų57.731%0.31432%0.318SS..Hα-helixtrans-70.8-12.7-177.5-73.7-61.8000113.5L95 E96 W97 Y101 A102 G103 D105 D106L95-Y99 HydrophobicContact CD1-CD2 4.1Å; L95-Y99 HydrophobicContact CD1-CE2 3.53Å; L95-Y99 HydrophobicContact CG-CD2 4.16Å; L95-Y99 HydrophobicContact CG-CE2 3.9Å; L95-Y99 VanDerWaalsContact O-CD2 3.32Å; L95-Y99 WeakPolarHBondContact O-CD2 3.36Å; L95-Y99 PolarHBondContact O-N 3.26Å; E96-Y99 PolarHBondContact O-N 3.13Å; W97-Y99 PolarHBondContact O-N 3.26Å; Y99-Y101 PolarHBondContact O-N 2.93Å; Y99-A102 HydrophobicContact CD1-CB 4.27Å; Y99-G103 WeakPolarHBondContact CD1-O 3.49Å; Y99-G103 PolarHBondContact O-N 2.92Å; Y99-G103 VanDerWaalsContact O-N 3.11Å; Y99-D105 WeakPolarHBondContact CE1-O 3.2Å; Y99-D106 PolarHBondContact OH-OD1 2.63Å
100E98.2Very high97.2Very high108 Ų10858.6 Ų58.651%0.50533%0.328SS..Hα-helixtrans-63.7-23.6168.1-63.7-179.7-163.200113E96 W97 F98 K115E96-E100 PolarHBondContact O-N 3.42Å; W97-E100 WeakPolarHBondContact O-CB 3.12Å; W97-E100 PolarHBondContact O-N 3.32Å; F98-E100 PolarHBondContact O-N 3.39Å; E100-K115 PolarHBondContact O-NZ 3.33Å
101Y98.3Very high97.2Very high15 Ų1564.1 Ų64.16%0.05935%0.349CS..Hα-helixtrans-110.5-31.3179.5-52.9-69000113.1W97 F98 Y99 K115 F116 D119 W149W97-Y101 AromaticContact CD1-CE2 3.72Å; W97-Y101 AromaticContact CE2-CE2 3.99Å; W97-Y101 HydrophobicContact CG-CE2 4.49Å; W97-Y101 AromaticContact NE1-CE2 3.38Å; W97-Y101 AromaticContact NE1-CZ 3.8Å; W97-Y101 PolarHBondContact NE1-OH 2.99Å; W97-Y101 WeakPolarHBondContact O-CD2 3.31Å; F98-Y101 PolarHBondContact O-N 2.88Å; Y99-Y101 PolarHBondContact O-N 2.93Å; Y101-K115 HydrophobicContact CD1-CB 4.27Å; Y101-K115 HydrophobicContact CD1-CD 3.98Å; Y101-K115 HydrophobicContact CD1-CG 4.1Å; Y101-K115 HydrophobicContact CE1-CD 4.17Å; Y101-K115 HydrophobicContact CE1-CG 4.04Å; Y101-F116 HydrophobicContact CD1-CB 3.78Å; Y101-F116 HydrophobicContact CD2-CB 4.4Å; Y101-F116 HydrophobicContact CD2-CD2 4.25Å; Y101-F116 VanDerWaalsContact CE1-CA 3.47Å; Y101-F116 HydrophobicContact CE1-CB 3.83Å; Y101-F116 HydrophobicContact CE1-CD2 4.38Å; Y101-F116 HydrophobicContact CE2-CB 4.4Å; Y101-F116 AromaticContact CE2-CD2 3.74Å; Y101-F116 HydrophobicContact CE2-CD2 3.74Å; Y101-F116 HydrophobicContact CG-CB 4.1Å; Y101-F116 AromaticContact CZ-CD2 3.84Å; Y101-D119 HydrophobicContact CE1-CB 4.46Å; Y101-D119 WeakPolarHBondContact CE1-OD2 3.46Å; Y101-D119 WeakPolarHBondContact OH-CB 3.47Å; Y101-D119 PolarHBondContact OH-OD2 3.25Å; Y101-W149 AromaticContact CD2-CH2 3.89Å; Y101-W149 HydrophobicContact CD2-CH2 3.89Å; Y101-W149 HydrophobicContact CD2-CZ2 4.36Å; Y101-W149 HydrophobicContact CE2-CH2 4.03Å; Y101-W149 HydrophobicContact CE2-CZ2 4.41Å
102A97.1Very high97.2Very high9 Ų960.5 Ų60.57%0.07433%0.325CS..Hα-helixtrans-85.1-15.6-179.200000113.7F98 Y99 C104 D105 V108F98-A102 HydrophobicContact CD1-CB 3.86Å; F98-A102 HydrophobicContact CE1-CB 3.33Å; F98-A102 HydrophobicContact CE2-CB 4.35Å; F98-A102 HydrophobicContact CZ-CB 3.62Å; F98-A102 PolarHBondContact O-N 3.28Å; Y99-A102 HydrophobicContact CD1-CB 4.27Å; A102-C104 PolarHBondContact O-N 3.24Å; A102-D105 VanDerWaalsContact CB-O 3.3Å; A102-D105 WeakPolarHBondContact CB-O 3.42Å; A102-D105 PolarHBondContact O-N 2.78Å; A102-V108 HydrophobicContact CB-CG2 3.85Å
103G93.9Very high97.3Very high51 Ų5154.5 Ų54.553%0.52630%0.3SS..THydrogen-bonded Turntrans66.5-120.1-175.200000111.3Y99Y99-G103 WeakPolarHBondContact CD1-O 3.49Å; Y99-G103 PolarHBondContact O-N 2.92Å; Y99-G103 VanDerWaalsContact O-N 3.11Å
104C91Very high97.3Very high121 Ų12157 Ų5782%0.81832%0.315SS*.THydrogen-bonded Turntrans-99.11.5177.659.70000114.1A102A102-C104 PolarHBondContact O-N 3.24Å
105D94.1Very high97.3Very high101 Ų10161.2 Ų61.254%0.5433%0.333SS..SBendtrans-98.3160-177.8-63.2-30.9000111.3Y99 A102 V107Y99-D105 WeakPolarHBondContact CE1-O 3.2Å; A102-D105 VanDerWaalsContact CB-O 3.3Å; A102-D105 WeakPolarHBondContact CB-O 3.42Å; A102-D105 PolarHBondContact O-N 2.78Å; D105-V107 PolarHBondContact O-N 3.4Å
106D97.5Very high97.3Very high96 Ų9658.3 Ų58.351%0.51332%0.318SS..SBendtrans-88.623.1174.6-72.3-25.1000112.6Y99 L146Y99-D106 PolarHBondContact OH-OD1 2.63Å; D106-L146 HydrophobicContact CB-CB 4.23Å; D106-L146 PolarHBondContact O-N 2.65Å
107V98.3Very high97.3Very high57 Ų5753.4 Ų53.435%0.34530%0.295SS..EExtended strand (participates in β ladder)trans-143.7129179.8-175.30000110.1D105 G109 Y143 F144 T145D105-V107 PolarHBondContact O-N 3.4Å; V107-G109 PolarHBondContact O-N 3.05Å; V107-Y143 HydrophobicContact CG1-CD1 3.9Å; V107-F144 CarbonylContact C-O 3.48Å; V107-F144 WeakPolarHBondContact CA-O 3.42Å; V107-T145 HydrophobicContact CG2-CG2 4.29Å
108V98.6Very high97.3Very high0 Ų060.2 Ų60.20%033%0.327CS..EExtended strand (participates in β ladder)trans-80.3110.9163.5-176.30000107.5F98 A102 G112 I113 Y143 F144F98-V108 HydrophobicContact CD2-CG2 3.84Å; F98-V108 HydrophobicContact CE2-CG2 3.51Å; F98-V108 HydrophobicContact CZ-CG2 4.06Å; A102-V108 HydrophobicContact CB-CG2 3.85Å; V108-G112 VanDerWaalsContact CG1-C 3.47Å; V108-I113 HydrophobicContact CB-CD1 4.35Å; V108-I113 HydrophobicContact CG1-CD1 3.75Å; V108-I113 HydrophobicContact CG1-CG1 4Å; V108-Y143 VanDerWaalsContact O-CA 3.25Å; V108-Y143 WeakPolarHBondContact O-CA 3.36Å; V108-F144 HydrophobicContact CB-CB 4.39Å; V108-F144 PolarHBondContact N-O 3.23Å; V108-F144 PolarHBondContact O-N 3.3Å
109G97.9Very high97.3Very high20 Ų2062.6 Ų62.621%0.20634%0.34CS..  trans-87.3-174.2174.400000113.4V107 E111 G112 I113 G142V107-G109 PolarHBondContact O-N 3.05Å; G109-E111 PolarHBondContact O-N 2.96Å; G109-G112 WeakPolarHBondContact O-CA 3.32Å; G109-G112 PolarHBondContact O-N 3.16Å; G109-I113 WeakPolarHBondContact O-CG1 3.17Å; G109-I113 PolarHBondContact O-N 3.32Å; G109-G142 CarbonylContact C-O 3.59Å
110P96.3Very high97.3Very high62 Ų6259 Ų5940%0.40333%0.326SS..Hα-helixtrans-53.2-45.3-174-30.336.2000114.6G112 I113 E114 Y143P110-G112 VanDerWaalsContact C-N 3.32Å; P110-G112 PolarHBondContact O-N 3.39Å; P110-I113 PolarHBondContact O-N 3.23Å; P110-E114 WeakPolarHBondContact O-CG 3.45Å; P110-E114 PolarHBondContact O-N 3.21Å; P110-Y143 HydrophobicContact CG-CE1 4.33Å; P110-Y143 HydrophobicContact CG-CE2 4.42Å
111E96.8Very high97.2Very high156 Ų15656.7 Ų56.773%0.72933%0.332SS*.Hα-helixtrans-61.9-40.1177.7-62179.7179.500112.1G109 E114 K115G109-E111 PolarHBondContact O-N 2.96Å; E111-E114 PolarHBondContact O-N 2.99Å; E111-K115 PolarHBondContact O-N 3.41Å; E111-K115 VanDerWaalsContact O-N 3.15Å
112G98.2Very high97.2Very high8 Ų856.7 Ų56.78%0.08233%0.333CS..Hα-helixtrans-69.1-36.4175.700000112.4V108 G109 P110 F116V108-G112 VanDerWaalsContact CG1-C 3.47Å; G109-G112 WeakPolarHBondContact O-CA 3.32Å; G109-G112 PolarHBondContact O-N 3.16Å; P110-G112 VanDerWaalsContact C-N 3.32Å; P110-G112 PolarHBondContact O-N 3.39Å; G112-F116 VanDerWaalsContact O-CB 3.24Å; G112-F116 WeakPolarHBondContact O-CB 3.4Å; G112-F116 PolarHBondContact O-N 3.44Å
113I98.2Very high97.1Very high15 Ų1563 Ų638%0.07736%0.361CS..Hα-helixtrans-65.1-41.9173.5-65.9-61.8000111V108 G109 P110 F116 C117 G142 F144V108-I113 HydrophobicContact CB-CD1 4.35Å; V108-I113 HydrophobicContact CG1-CD1 3.75Å; V108-I113 HydrophobicContact CG1-CG1 4Å; G109-I113 WeakPolarHBondContact O-CG1 3.17Å; G109-I113 PolarHBondContact O-N 3.32Å; P110-I113 PolarHBondContact O-N 3.23Å; I113-F116 PolarHBondContact O-N 2.91Å; I113-C117 WeakPolarHBondContact O-CB 3.4Å; I113-C117 PolarHBondContact O-N 3.25Å; I113-C117 PolarHBondContact O-SG 3.14Å; I113-G142 WeakPolarHBondContact CG1-O 3.28Å; I113-F144 HydrophobicContact CD1-CD2 3.33Å; I113-F144 HydrophobicContact CD1-CE2 3.58Å; I113-F144 HydrophobicContact CD1-CG 4.01Å; I113-F144 HydrophobicContact CD1-CZ 4.41Å
114E97.6Very high97.1Very high126 Ų12664 Ų6459%0.58936%0.358SS*.Hα-helixtrans-59.4-50.2176.2-75.2178.5-175.700111.2P110 E111 F116 C117 E118 P124P110-E114 WeakPolarHBondContact O-CG 3.45Å; P110-E114 PolarHBondContact O-N 3.21Å; E111-E114 PolarHBondContact O-N 2.99Å; E114-F116 VanDerWaalsContact C-N 3.34Å; E114-F116 PolarHBondContact O-N 2.82Å; E114-C117 WeakPolarHBondContact O-CB 3.28Å; E114-C117 PolarHBondContact O-N 3.33Å; E114-E118 PolarHBondContact O-N 2.96Å; E114-P124 HydrophobicContact CG-CG 4.5Å
115K98.4Very high97.2Very high89 Ų8964.4 Ų64.439%0.38735%0.348SS..Hα-helixtrans-59.3-44.2175.2-176.8-171.8166.9-165.40111.8E100 Y101 E111 C117 E118 D119E100-K115 PolarHBondContact O-NZ 3.33Å; Y101-K115 HydrophobicContact CD1-CB 4.27Å; Y101-K115 HydrophobicContact CD1-CD 3.98Å; Y101-K115 HydrophobicContact CD1-CG 4.1Å; Y101-K115 HydrophobicContact CE1-CD 4.17Å; Y101-K115 HydrophobicContact CE1-CG 4.04Å; E111-K115 PolarHBondContact O-N 3.41Å; E111-K115 VanDerWaalsContact O-N 3.15Å; K115-C117 VanDerWaalsContact C-N 3.33Å; K115-C117 PolarHBondContact O-N 3.3Å; K115-E118 PolarHBondContact O-N 3.35Å; K115-D119 WeakPolarHBondContact O-CB 3.42Å; K115-D119 PolarHBondContact O-N 3.19Å
116F98.6Very high97.2Very high0 Ų061.9 Ų61.90%034%0.335CS..Hα-helixtrans-60.8-42177.2169.8-114.7000112.3W97 Y101 G112 I113 E114 D119 I120 M129 L132 F144 W149 M153 L164W97-F116 HydrophobicContact CH2-CE2 4.04Å; W97-F116 HydrophobicContact CZ2-CD2 4.38Å; W97-F116 AromaticContact CZ2-CE2 3.73Å; W97-F116 HydrophobicContact CZ2-CE2 3.73Å; Y101-F116 HydrophobicContact CD1-CB 3.78Å; Y101-F116 HydrophobicContact CD2-CB 4.4Å; Y101-F116 HydrophobicContact CD2-CD2 4.25Å; Y101-F116 VanDerWaalsContact CE1-CA 3.47Å; Y101-F116 HydrophobicContact CE1-CB 3.83Å; Y101-F116 HydrophobicContact CE1-CD2 4.38Å; Y101-F116 HydrophobicContact CE2-CB 4.4Å; Y101-F116 AromaticContact CE2-CD2 3.74Å; Y101-F116 HydrophobicContact CE2-CD2 3.74Å; Y101-F116 HydrophobicContact CG-CB 4.1Å; Y101-F116 AromaticContact CZ-CD2 3.84Å; G112-F116 VanDerWaalsContact O-CB 3.24Å; G112-F116 WeakPolarHBondContact O-CB 3.4Å; G112-F116 PolarHBondContact O-N 3.44Å; I113-F116 PolarHBondContact O-N 2.91Å; E114-F116 VanDerWaalsContact C-N 3.34Å; E114-F116 PolarHBondContact O-N 2.82Å; F116-D119 PolarHBondContact O-N 3.32Å; F116-I120 HydrophobicContact CD1-CD1 4.36Å; F116-I120 HydrophobicContact CD2-CG2 4.18Å; F116-I120 HydrophobicContact CE1-CD1 3.88Å; F116-I120 HydrophobicContact CE2-CD1 4.37Å; F116-I120 HydrophobicContact CE2-CG2 3.81Å; F116-I120 HydrophobicContact CZ-CD1 3.91Å; F116-I120 HydrophobicContact CZ-CG2 4.31Å; F116-I120 WeakPolarHBondContact O-CG1 3.46Å; F116-I120 PolarHBondContact O-N 3.24Å; F116-M129 HydrophobicContact CD1-CE 4.01Å; F116-M129 HydrophobicContact CE1-CE 3.82Å; F116-M129 HydrophobicContact CE1-SD 4.36Å; F116-L132 HydrophobicContact CE1-CD2 3.63Å; F116-L132 HydrophobicContact CZ-CD2 3.7Å; F116-F144 HydrophobicContact CE1-CE2 4.23Å; F116-W149 AromaticContact CD2-CH2 3.7Å; F116-W149 HydrophobicContact CD2-CH2 3.7Å; F116-W149 HydrophobicContact CD2-CZ3 4.24Å; F116-W149 HydrophobicContact CE1-CZ3 4.34Å; F116-W149 AromaticContact CE2-CH2 3.44Å; F116-W149 HydrophobicContact CE2-CH2 3.44Å; F116-W149 VanDerWaalsContact CE2-CH2 3.44Å; F116-W149 HydrophobicContact CE2-CZ2 4.41Å; F116-W149 AromaticContact CE2-CZ3 4Å; F116-W149 HydrophobicContact CE2-CZ3 4Å; F116-W149 HydrophobicContact CG-CH2 4.36Å; F116-W149 HydrophobicContact CG-CZ3 4.49Å; F116-W149 AromaticContact CZ-CH2 3.91Å; F116-W149 HydrophobicContact CZ-CH2 3.91Å; F116-W149 HydrophobicContact CZ-CZ3 4.02Å; F116-M153 HydrophobicContact CE2-CE 4.47Å; F116-M153 HydrophobicContact CZ-CE 3.98Å; F116-L164 HydrophobicContact CE1-CD2 4.48Å; F116-L164 HydrophobicContact CE2-CD2 3.69Å; F116-L164 HydrophobicContact CZ-CD2 3.34Å
117C98.5Very high97.2Very high0 Ų058.9 Ų58.90%032%0.32CS..Hα-helixtrans-63-45.5176.3-69.80000111.5I113 E114 K115 D119 I120 G121 V122 P124 M129I113-C117 WeakPolarHBondContact O-CB 3.4Å; I113-C117 PolarHBondContact O-N 3.25Å; I113-C117 PolarHBondContact O-SG 3.14Å; E114-C117 WeakPolarHBondContact O-CB 3.28Å; E114-C117 PolarHBondContact O-N 3.33Å; K115-C117 VanDerWaalsContact C-N 3.33Å; K115-C117 PolarHBondContact O-N 3.3Å; C117-D119 PolarHBondContact O-N 3.21Å; C117-I120 WeakPolarHBondContact O-CG1 3.41Å; C117-I120 PolarHBondContact O-N 3.25Å; C117-G121 PolarHBondContact O-N 3.37Å; C117-V122 CarbonylContact C-O 3.52Å; C117-V122 VanDerWaalsContact C-O 3.27Å; C117-V122 HydrophobicContact CB-CG2 4.27Å; C117-V122 VanDerWaalsContact CB-O 3.31Å; C117-V122 WeakPolarHBondContact CB-O 3.32Å; C117-V122 PolarHBondContact O-N 3.25Å; C117-P124 HydrophobicContact CB-CG 4.08Å; C117-M129 WeakPolarHBondContact SG-CE 3.4Å
118E98.4Very high97.1Very high150 Ų15056.1 Ų56.170%0.70130%0.303SS*.Hα-helixtrans-56.8-49.3173.6-176.7179.9-174.400111E114 K115 I120 G121E114-E118 PolarHBondContact O-N 2.96Å; K115-E118 PolarHBondContact O-N 3.35Å; E118-I120 VanDerWaalsContact C-N 3.31Å; E118-I120 PolarHBondContact O-N 3.25Å; E118-G121 PolarHBondContact O-N 2.91Å
119D98.5Very high97.1Very high50 Ų5056.8 Ų56.827%0.26731%0.306SS..Hα-helixtrans-62.7-32.9180-80.7-12.5000112.7Y101 K115 F116 C117 T161 R165Y101-D119 HydrophobicContact CE1-CB 4.46Å; Y101-D119 WeakPolarHBondContact CE1-OD2 3.46Å; Y101-D119 WeakPolarHBondContact OH-CB 3.47Å; Y101-D119 PolarHBondContact OH-OD2 3.25Å; K115-D119 WeakPolarHBondContact O-CB 3.42Å; K115-D119 PolarHBondContact O-N 3.19Å; F116-D119 PolarHBondContact O-N 3.32Å; C117-D119 PolarHBondContact O-N 3.21Å; D119-T161 HydrophobicContact CB-CG2 4.18Å; D119-T161 WeakPolarHBondContact O-CG2 3.43Å; D119-R165 PolarHBondContact O-NE 2.96Å; D119-R165 PolarHBondContact O-NH2 3.4Å
120I98.3Very high97.1Very high4 Ų456.2 Ų56.22%0.02130%0.298CS..Hα-helixtrans-91.2-1175.670-176000113.1F116 C117 E118 V122 M129 T161 L164 R165F116-I120 HydrophobicContact CD1-CD1 4.36Å; F116-I120 HydrophobicContact CD2-CG2 4.18Å; F116-I120 HydrophobicContact CE1-CD1 3.88Å; F116-I120 HydrophobicContact CE2-CD1 4.37Å; F116-I120 HydrophobicContact CE2-CG2 3.81Å; F116-I120 HydrophobicContact CZ-CD1 3.91Å; F116-I120 HydrophobicContact CZ-CG2 4.31Å; F116-I120 WeakPolarHBondContact O-CG1 3.46Å; F116-I120 PolarHBondContact O-N 3.24Å; C117-I120 WeakPolarHBondContact O-CG1 3.41Å; C117-I120 PolarHBondContact O-N 3.25Å; E118-I120 VanDerWaalsContact C-N 3.31Å; E118-I120 PolarHBondContact O-N 3.25Å; I120-V122 HydrophobicContact CD1-CG2 3.65Å; I120-V122 HydrophobicContact CG1-CB 4.42Å; I120-V122 HydrophobicContact CG1-CG1 4.27Å; I120-V122 HydrophobicContact CG1-CG2 3.58Å; I120-M129 HydrophobicContact CD1-SD 3.73Å; I120-T161 HydrophobicContact CG2-CG2 4.05Å; I120-L164 HydrophobicContact CD1-CD2 4.3Å; I120-L164 HydrophobicContact CG2-CD2 3.99Å; I120-L164 HydrophobicContact CG2-CG 4.49Å; I120-R165 HydrophobicContact CB-CG 4.19Å; I120-R165 WeakPolarHBondContact O-CG 3.47Å
121G97.8Very high97.3Very high61 Ų6153.2 Ų53.263%0.62928%0.279SS*.THydrogen-bonded Turntrans7336.2176.300000113.7C117 E118C117-G121 PolarHBondContact O-N 3.37Å; E118-G121 PolarHBondContact O-N 2.91Å
122V97Very high97.3Very high14 Ų1445.9 Ų45.99%0.08525%0.245CC..  trans-129.6153176-530000110.4C117 I120 N126 V128 M129 L168C117-V122 CarbonylContact C-O 3.52Å; C117-V122 VanDerWaalsContact C-O 3.27Å; C117-V122 HydrophobicContact CB-CG2 4.27Å; C117-V122 VanDerWaalsContact CB-O 3.31Å; C117-V122 WeakPolarHBondContact CB-O 3.32Å; C117-V122 PolarHBondContact O-N 3.25Å; I120-V122 HydrophobicContact CD1-CG2 3.65Å; I120-V122 HydrophobicContact CG1-CB 4.42Å; I120-V122 HydrophobicContact CG1-CG1 4.27Å; I120-V122 HydrophobicContact CG1-CG2 3.58Å; V122-N126 HydrophobicContact CB-CB 4.34Å; V122-V128 HydrophobicContact CB-CG1 4.34Å; V122-V128 HydrophobicContact CG1-CG1 3.96Å; V122-M129 HydrophobicContact CG2-CG 3.74Å; V122-M129 HydrophobicContact CG2-SD 3.67Å; V122-L168 HydrophobicContact CG1-CD1 3.79Å
123E95.7Very high97.4Very high142 Ų14245.5 Ų45.566%0.66424%0.241SC*.  trans-75.8148.5169.9-67.2174.2176.600110.3E125 N126E123-E125 PolarHBondContact O-N 2.97Å; E123-N126 WeakPolarHBondContact O-CB 3.33Å; E123-N126 PolarHBondContact O-N 3.13Å
124P92.9Very high97.4Very high72 Ų7247.8 Ų47.847%0.46825%0.249SC..THydrogen-bonded Turntrans-56-35.3174.7-26.735000113.1E114 C117 N126E114-P124 HydrophobicContact CG-CG 4.5Å; C117-P124 HydrophobicContact CB-CG 4.08Å; P124-N126 PolarHBondContact O-N 2.91Å
125E93.4Very high97.4Very high130 Ų13044.7 Ų44.761%0.60723%0.233SC*.THydrogen-bonded Turntrans-84.824.6176.1-60.2-174.9-175.400112.8E123 L211E123-E125 PolarHBondContact O-N 2.97Å; E125-L211 WeakPolarHBondContact O-CD1 3.4Å; E125-L211 WeakPolarHBondContact O-CD2 3.43Å
126N94.9Very high97.4Very high48 Ų4840.5 Ų40.526%0.25722%0.215SC..  trans-87.1136.4173.9-162.7-69000111.2V122 E123 P124 V128 M129V122-N126 HydrophobicContact CB-CB 4.34Å; E123-N126 WeakPolarHBondContact O-CB 3.33Å; E123-N126 PolarHBondContact O-N 3.13Å; P124-N126 PolarHBondContact O-N 2.91Å; N126-V128 HydrophobicContact CB-CG1 4.2Å; N126-V128 PolarHBondContact O-N 3.04Å; N126-V128 VanDerWaalsContact OD1-CG1 3.28Å; N126-V128 WeakPolarHBondContact OD1-CG1 3.48Å; N126-V128 PolarHBondContact OD1-N 3.17Å; N126-M129 WeakPolarHBondContact O-CB 3.34Å; N126-M129 PolarHBondContact O-N 3.41Å
127V96.5Very high97.4Very high32 Ų3244.1 Ų44.119%0.19423%0.234CC..Hα-helixtrans-55.7-27.9178.174.30000113.4M129 L130 V131 L175 L211V127-M129 VanDerWaalsContact C-N 3.25Å; V127-M129 PolarHBondContact O-N 3.01Å; V127-L130 WeakPolarHBondContact O-CB 3.46Å; V127-L130 PolarHBondContact O-N 3.46Å; V127-V131 PolarHBondContact O-N 2.85Å; V127-L175 HydrophobicContact CB-CD1 4.45Å; V127-L175 HydrophobicContact CG1-CD1 4.03Å; V127-L175 HydrophobicContact CG2-CD1 3.6Å; V127-L211 HydrophobicContact CB-CB 4.27Å; V127-L211 HydrophobicContact CG2-CB 4.3Å; V127-L211 WeakPolarHBondContact CG2-O 3.36Å
128V97.8Very high97.4Very high0 Ų044.1 Ų44.10%023%0.234CC..Hα-helixtrans-64.6-30.2176.277.20000112.5V122 N126 L130 V131 L132 L168 L171 R172V122-V128 HydrophobicContact CB-CG1 4.34Å; V122-V128 HydrophobicContact CG1-CG1 3.96Å; N126-V128 HydrophobicContact CB-CG1 4.2Å; N126-V128 PolarHBondContact O-N 3.04Å; N126-V128 VanDerWaalsContact OD1-CG1 3.28Å; N126-V128 WeakPolarHBondContact OD1-CG1 3.48Å; N126-V128 PolarHBondContact OD1-N 3.17Å; V128-L130 VanDerWaalsContact C-N 3.34Å; V128-V131 PolarHBondContact O-N 3.17Å; V128-L132 PolarHBondContact O-N 2.92Å; V128-L168 HydrophobicContact CG1-CD2 4.33Å; V128-L168 HydrophobicContact CG2-CD2 3.96Å; V128-L171 HydrophobicContact CG2-CB 3.73Å; V128-L171 HydrophobicContact CG2-CD1 4.36Å; V128-R172 HydrophobicContact CB-CG 4.14Å; V128-R172 HydrophobicContact CG2-CG 3.88Å
129M98.3Very high97.4Very high14 Ų1442.7 Ų42.77%0.06923%0.228CC..Hα-helixtrans-67.6-36.1175.5-72.2-58.6-61.600111.8F116 C117 I120 V122 N126 V127 L132 A133 F144F116-M129 HydrophobicContact CD1-CE 4.01Å; F116-M129 HydrophobicContact CE1-CE 3.82Å; F116-M129 HydrophobicContact CE1-SD 4.36Å; C117-M129 WeakPolarHBondContact SG-CE 3.4Å; I120-M129 HydrophobicContact CD1-SD 3.73Å; V122-M129 HydrophobicContact CG2-CG 3.74Å; V122-M129 HydrophobicContact CG2-SD 3.67Å; N126-M129 WeakPolarHBondContact O-CB 3.34Å; N126-M129 PolarHBondContact O-N 3.41Å; V127-M129 VanDerWaalsContact C-N 3.25Å; V127-M129 PolarHBondContact O-N 3.01Å; M129-L132 HydrophobicContact CE-CD2 4.33Å; M129-L132 PolarHBondContact O-N 3.34Å; M129-L132 HydrophobicContact SD-CD2 4.21Å; M129-A133 WeakPolarHBondContact O-CB 3.34Å; M129-A133 PolarHBondContact O-N 3.06Å; M129-F144 HydrophobicContact CE-CE2 4.47Å
130L98.3Very high97.2Very high7 Ų743.4 Ų43.44%0.03724%0.237CC..Hα-helixtrans-65-40.4172.6177.662.8000111.6V127 V128 L132 A133 W134 I184 Y187 A188 F191 L212V127-L130 WeakPolarHBondContact O-CB 3.46Å; V127-L130 PolarHBondContact O-N 3.46Å; V128-L130 VanDerWaalsContact C-N 3.34Å; L130-L132 VanDerWaalsContact C-N 3.35Å; L130-A133 PolarHBondContact O-N 3.33Å; L130-W134 WeakPolarHBondContact O-CB 3.06Å; L130-W134 PolarHBondContact O-N 3.27Å; L130-I184 HydrophobicContact CD2-CG2 4.28Å; L130-I184 HydrophobicContact CG-CG2 4.19Å; L130-Y187 HydrophobicContact CD1-CD1 4.23Å; L130-Y187 HydrophobicContact CD1-CE1 4.08Å; L130-A188 HydrophobicContact CD1-CB 3.87Å; L130-A188 HydrophobicContact CD2-CB 3.83Å; L130-A188 HydrophobicContact CG-CB 4.43Å; L130-F191 HydrophobicContact CD1-CD1 3.85Å; L130-F191 HydrophobicContact CD1-CE1 4.18Å; L130-L212 HydrophobicContact CD2-CD1 4.04Å; L130-L212 HydrophobicContact CD2-CD2 3.73Å; L130-L212 HydrophobicContact CD2-CG 3.92Å
131V98.5Very high97.1Very high0 Ų046.9 Ų46.90%025%0.254CS..Hα-helixtrans-66-40.1174.9-174.40000111.2V127 V128 W134 K135 L171 V174 L175 I184V127-V131 PolarHBondContact O-N 2.85Å; V128-V131 PolarHBondContact O-N 3.17Å; V131-W134 WeakPolarHBondContact O-CB 3.5Å; V131-W134 PolarHBondContact O-N 2.89Å; V131-K135 WeakPolarHBondContact O-CG 3.48Å; V131-K135 PolarHBondContact O-N 3.33Å; V131-L171 HydrophobicContact CG1-CB 4.26Å; V131-L171 HydrophobicContact CG1-CD2 4.28Å; V131-L171 WeakPolarHBondContact CG1-O 3.25Å; V131-V174 HydrophobicContact CG1-CB 4.13Å; V131-V174 HydrophobicContact CG1-CG1 4.35Å; V131-V174 HydrophobicContact CG1-CG2 4.43Å; V131-L175 HydrophobicContact CG2-CD1 3.7Å; V131-L175 HydrophobicContact CG2-CD2 3.84Å; V131-L175 HydrophobicContact CG2-CG 3.65Å; V131-I184 HydrophobicContact CG1-CD1 4.24Å; V131-I184 HydrophobicContact CG2-CD1 4.34Å
132L98.7Very high97Very high1 Ų145.1 Ų45.11%0.00524%0.236CC..Hα-helixtrans-61.8-49.1175.7-179.962.3000110.9F116 V128 M129 L130 W134 K135 L136 M153 L156 L164 L171F116-L132 HydrophobicContact CE1-CD2 3.63Å; F116-L132 HydrophobicContact CZ-CD2 3.7Å; V128-L132 PolarHBondContact O-N 2.92Å; M129-L132 HydrophobicContact CE-CD2 4.33Å; M129-L132 PolarHBondContact O-N 3.34Å; M129-L132 HydrophobicContact SD-CD2 4.21Å; L130-L132 VanDerWaalsContact C-N 3.35Å; L132-W134 VanDerWaalsContact C-N 3.26Å; L132-W134 PolarHBondContact O-N 3.49Å; L132-K135 WeakPolarHBondContact O-CA 3.44Å; L132-K135 WeakPolarHBondContact O-CB 3.44Å; L132-K135 PolarHBondContact O-N 3.01Å; L132-L136 HydrophobicContact CD1-CD1 3.57Å; L132-L136 HydrophobicContact CG-CD1 4.08Å; L132-L136 VanDerWaalsContact O-CD1 3.31Å; L132-L136 WeakPolarHBondContact O-CD1 3.3Å; L132-L136 PolarHBondContact O-N 2.99Å; L132-M153 HydrophobicContact CD1-CE 4.29Å; L132-M153 HydrophobicContact CD2-CE 4.48Å; L132-L156 HydrophobicContact CD1-CD1 3.78Å; L132-L164 HydrophobicContact CD1-CD1 4.04Å; L132-L164 HydrophobicContact CD2-CD2 4.01Å; L132-L171 HydrophobicContact CB-CD1 4.29Å; L132-L171 HydrophobicContact CD1-CD1 4.09Å
133A98.7Very high97Very high1 Ų149.8 Ų49.81%0.00825%0.252CS..Hα-helixtrans-55.2-43.3175.400000111.8M129 L130 K135 L136 D137 A138 F144 Y187 F191M129-A133 WeakPolarHBondContact O-CB 3.34Å; M129-A133 PolarHBondContact O-N 3.06Å; L130-A133 PolarHBondContact O-N 3.33Å; A133-K135 PolarHBondContact O-N 3.31Å; A133-L136 CarbonylContact O-C 3.27Å; A133-L136 PolarHBondContact O-N 3.21Å; A133-D137 PolarHBondContact O-N 2.99Å; A133-A138 HydrophobicContact CB-CB 4.21Å; A133-A138 PolarHBondContact O-N 2.74Å; A133-F144 HydrophobicContact CB-CE1 3.84Å; A133-F144 HydrophobicContact CB-CZ 4.09Å; A133-Y187 VanDerWaalsContact C-OH 3.29Å; A133-Y187 HydrophobicContact CB-CE1 4.37Å; A133-Y187 PolarHBondContact O-OH 3.16Å; A133-F191 HydrophobicContact CB-CE1 4.02Å; A133-F191 HydrophobicContact CB-CE2 3.81Å; A133-F191 HydrophobicContact CB-CZ 3.47Å; A133-F191 VanDerWaalsContact CB-CZ 3.47Å
134W98.6Very high97.2Very high62 Ų6243.3 Ų43.324%0.23522%0.222CC..Hα-helixtrans-62.2-40.2174.2178.472.3000113.1L130 V131 L132 L136 D137 V174 L183 I184 Y187L130-W134 WeakPolarHBondContact O-CB 3.06Å; L130-W134 PolarHBondContact O-N 3.27Å; V131-W134 WeakPolarHBondContact O-CB 3.5Å; V131-W134 PolarHBondContact O-N 2.89Å; L132-W134 VanDerWaalsContact C-N 3.26Å; L132-W134 PolarHBondContact O-N 3.49Å; W134-L136 VanDerWaalsContact C-N 3.31Å; W134-L136 PolarHBondContact O-N 2.89Å; W134-D137 PolarHBondContact O-N 3.47Å; W134-D137 VanDerWaalsContact O-N 3.09Å; W134-V174 HydrophobicContact CZ3-CG1 3.97Å; W134-L183 HydrophobicContact CZ2-CB 4.4Å; W134-I184 HydrophobicContact CB-CG1 4.27Å; W134-I184 HydrophobicContact CD2-CD1 4.17Å; W134-I184 HydrophobicContact CD2-CG1 3.51Å; W134-I184 HydrophobicContact CE3-CD1 3.87Å; W134-I184 HydrophobicContact CE3-CG1 3.75Å; W134-I184 HydrophobicContact CG-CG1 3.72Å; W134-I184 HydrophobicContact CZ2-CG1 4.46Å; W134-I184 HydrophobicContact CZ3-CD1 4.17Å; W134-I184 HydrophobicContact CZ3-CG1 4.31Å; W134-Y187 HydrophobicContact CB-CD1 3.74Å; W134-Y187 HydrophobicContact CB-CE1 3.69Å; W134-Y187 HydrophobicContact CB-CG 4.39Å; W134-Y187 AromaticContact CD1-CD1 3.77Å; W134-Y187 AromaticContact CD1-CD2 3.99Å; W134-Y187 AromaticContact CD1-CG 3.55Å; W134-Y187 HydrophobicContact CG-CD1 4.14Å; W134-Y187 HydrophobicContact CG-CE1 4.48Å; W134-Y187 HydrophobicContact CG-CG 4.36Å
135K98.4Very high97.4Very high62 Ų6242.1 Ų42.127%0.2721%0.214SC..Hα-helixtrans-66.9-30.9175.2-73.9-64.8-170.1-1760113.1V131 L132 A133 L156 L171V131-K135 WeakPolarHBondContact O-CG 3.48Å; V131-K135 PolarHBondContact O-N 3.33Å; L132-K135 WeakPolarHBondContact O-CA 3.44Å; L132-K135 WeakPolarHBondContact O-CB 3.44Å; L132-K135 PolarHBondContact O-N 3.01Å; A133-K135 PolarHBondContact O-N 3.31Å; K135-L156 HydrophobicContact CB-CD1 4.18Å; K135-L156 HydrophobicContact CD-CD2 4.41Å; K135-L156 HydrophobicContact CG-CD2 4.29Å; K135-L171 HydrophobicContact CG-CD2 3.84Å
136L98.6Very high97.7Very high0 Ų037 Ų370%019%0.19CC..Hα-helixtrans-77.8-13.7173.2-87.961.9000112.2L132 A133 W134 A138 F144 E148 W149 R151 M153 L156L132-L136 HydrophobicContact CD1-CD1 3.57Å; L132-L136 HydrophobicContact CG-CD1 4.08Å; L132-L136 VanDerWaalsContact O-CD1 3.31Å; L132-L136 WeakPolarHBondContact O-CD1 3.3Å; L132-L136 PolarHBondContact O-N 2.99Å; A133-L136 CarbonylContact O-C 3.27Å; A133-L136 PolarHBondContact O-N 3.21Å; W134-L136 VanDerWaalsContact C-N 3.31Å; W134-L136 PolarHBondContact O-N 2.89Å; L136-A138 HydrophobicContact CB-CB 4.49Å; L136-F144 HydrophobicContact CD2-CD1 3.95Å; L136-F144 HydrophobicContact CD2-CD2 4.01Å; L136-F144 HydrophobicContact CD2-CE1 4.13Å; L136-F144 HydrophobicContact CD2-CE2 4.16Å; L136-F144 HydrophobicContact CD2-CG 3.92Å; L136-F144 HydrophobicContact CD2-CZ 4.23Å; L136-E148 HydrophobicContact CB-CB 4.43Å; L136-W149 HydrophobicContact CD2-CE3 4.34Å; L136-R151 PolarHBondContact O-NH2 3.27Å; L136-M153 HydrophobicContact CD1-CE 4.33Å; L136-M153 HydrophobicContact CD1-SD 4.46Å; L136-M153 HydrophobicContact CD2-CE 4.3Å; L136-L156 HydrophobicContact CD1-CD1 4.44Å
137D98.4Very high97.9Very high76 Ų7641.1 Ų41.141%0.40621%0.208SC..THydrogen-bonded Turntrans53.247.5-168.9174.454.9000110.1A133 W134 Q139 R151A133-D137 PolarHBondContact O-N 2.99Å; W134-D137 PolarHBondContact O-N 3.47Å; W134-D137 VanDerWaalsContact O-N 3.09Å; D137-Q139 PolarHBondContact O-NE2 3.46Å; D137-Q139 PolarHBondContact OD1-NE2 2.87Å; D137-R151 PolarHBondContact O-NH2 3.48Å; D137-R151 IonicContact OD2-CZ 3.19Å; D137-R151 IonicContact OD2-NH1 2.71Å; D137-R151 IonicContact OD2-NH2 2.86Å; D137-R151 PolarHBondContact OD2-NH2 2.78Å; D137-R151 VanDerWaalsContact OD2-NH2 3.07Å
138A98.4Very high98Very high0 Ų040.3 Ų40.30%020%0.202CC..  trans-70.8134.3-17900000110.9A133 L136 F144 E148 Y187 F191A133-A138 HydrophobicContact CB-CB 4.21Å; A133-A138 PolarHBondContact O-N 2.74Å; L136-A138 HydrophobicContact CB-CB 4.49Å; A138-F144 HydrophobicContact CB-CD1 3.61Å; A138-F144 HydrophobicContact CB-CE1 3.57Å; A138-E148 WeakPolarHBondContact CA-OE1 3.48Å; A138-Y187 WeakPolarHBondContact O-CE2 3.26Å; A138-Y187 PolarHBondContact O-OH 3.17Å; A138-F191 HydrophobicContact CB-CD2 4.47Å; A138-F191 HydrophobicContact CB-CE2 3.93Å
139Q97.4Very high98Very high120 Ų12040.3 Ų40.356%0.56120%0.202SC*.SBendtrans-86.2-26.1-173.5-61-55.1-6400114.2D137 E148D137-Q139 PolarHBondContact O-NE2 3.46Å; D137-Q139 PolarHBondContact OD1-NE2 2.87Å; Q139-E148 WeakPolarHBondContact CG-OE1 3.34Å; Q139-E148 PolarHBondContact N-OE1 2.78Å
140S95.2Very high98Very high66 Ų6642 Ų4246%0.46221%0.211SC..SBendtrans-137.8131-172-61.30000112.1G142 Y143 F191S140-G142 PolarHBondContact O-N 3.05Å; S140-Y143 PolarHBondContact O-N 3.31Å; S140-F191 VanDerWaalsContact C-CE2 3.41Å; S140-F191 WeakPolarHBondContact O-CE2 3.36Å
141M95.6Very high98Very high76 Ų7647.3 Ų47.337%0.37423%0.231SC..THydrogen-bonded Turntrans-59.3133.2176.1-176.2173.366.700112.6Y143 F191 A192 T204M141-Y143 VanDerWaalsContact C-N 3.34Å; M141-Y143 VanDerWaalsContact O-CD2 3.28Å; M141-Y143 WeakPolarHBondContact O-CD2 3.47Å; M141-F191 VanDerWaalsContact CA-CZ 3.43Å; M141-F191 HydrophobicContact CB-CD1 4.03Å; M141-F191 HydrophobicContact CB-CD2 4.49Å; M141-F191 HydrophobicContact CB-CE1 3.79Å; M141-F191 HydrophobicContact CB-CE2 4.28Å; M141-F191 HydrophobicContact CB-CG 4.4Å; M141-F191 HydrophobicContact CB-CZ 3.95Å; M141-F191 WeakPolarHBondContact CB-O 3.49Å; M141-F191 HydrophobicContact CG-CD1 4.39Å; M141-F191 HydrophobicContact CG-CE1 3.85Å; M141-F191 HydrophobicContact CG-CZ 4.23Å; M141-F191 PolarHBondContact N-O 3.49Å; M141-A192 HydrophobicContact CE-CB 4.07Å; M141-A192 HydrophobicContact SD-CB 3.9Å; M141-T204 HydrophobicContact CE-CG2 3.95Å
142G95.6Very high98Very high24 Ų2447.3 Ų47.325%0.24723%0.231CC..THydrogen-bonded Turntrans83.74.1-178.400000114.8G109 I113 S140G109-G142 CarbonylContact C-O 3.59Å; I113-G142 WeakPolarHBondContact CG1-O 3.28Å; S140-G142 PolarHBondContact O-N 3.05Å
143Y97.8Very high98Very high112 Ų11247.3 Ų47.344%0.43923%0.231SC..  trans-135.5139.1-179.7-59.4-92.3000112.1V107 V108 P110 S140 M141V107-Y143 HydrophobicContact CG1-CD1 3.9Å; V108-Y143 VanDerWaalsContact O-CA 3.25Å; V108-Y143 WeakPolarHBondContact O-CA 3.36Å; P110-Y143 HydrophobicContact CG-CE1 4.33Å; P110-Y143 HydrophobicContact CG-CE2 4.42Å; S140-Y143 PolarHBondContact O-N 3.31Å; M141-Y143 VanDerWaalsContact C-N 3.34Å; M141-Y143 VanDerWaalsContact O-CD2 3.28Å; M141-Y143 WeakPolarHBondContact O-CD2 3.47Å
144F98.6Very high98Very high6 Ų648 Ų483%0.02624%0.238CC..EExtended strand (participates in β ladder)trans-126.7121.6164.2-64.9-37.5000110.2V107 V108 I113 F116 M129 A133 L136 A138 W149V107-F144 CarbonylContact C-O 3.48Å; V107-F144 WeakPolarHBondContact CA-O 3.42Å; V108-F144 HydrophobicContact CB-CB 4.39Å; V108-F144 PolarHBondContact N-O 3.23Å; V108-F144 PolarHBondContact O-N 3.3Å; I113-F144 HydrophobicContact CD1-CD2 3.33Å; I113-F144 HydrophobicContact CD1-CE2 3.58Å; I113-F144 HydrophobicContact CD1-CG 4.01Å; I113-F144 HydrophobicContact CD1-CZ 4.41Å; F116-F144 HydrophobicContact CE1-CE2 4.23Å; M129-F144 HydrophobicContact CE-CE2 4.47Å; A133-F144 HydrophobicContact CB-CE1 3.84Å; A133-F144 HydrophobicContact CB-CZ 4.09Å; L136-F144 HydrophobicContact CD2-CD1 3.95Å; L136-F144 HydrophobicContact CD2-CD2 4.01Å; L136-F144 HydrophobicContact CD2-CE1 4.13Å; L136-F144 HydrophobicContact CD2-CE2 4.16Å; L136-F144 HydrophobicContact CD2-CG 3.92Å; L136-F144 HydrophobicContact CD2-CZ 4.23Å; A138-F144 HydrophobicContact CB-CD1 3.61Å; A138-F144 HydrophobicContact CB-CE1 3.57Å; F144-W149 HydrophobicContact CB-CE3 4.37Å; F144-W149 HydrophobicContact CD2-CE3 4.06Å; F144-W149 HydrophobicContact CD2-CZ3 4.11Å
145T98.7Very high97.9Very high48 Ų4849.6 Ų49.629%0.29426%0.259SS..EExtended strand (participates in β ladder)trans-75.4158.917266.40000111V107 Q147 E148 W149V107-T145 HydrophobicContact CG2-CG2 4.29Å; T145-Q147 PolarHBondContact O-N 2.75Å; T145-E148 WeakPolarHBondContact CB-OE2 3.11Å; T145-E148 WeakPolarHBondContact CG2-OE2 3.35Å; T145-E148 PolarHBondContact N-OE2 3.01Å; T145-E148 PolarHBondContact O-N 2.81Å; T145-E148 WeakPolarHBondContact OG1-CB 3.35Å; T145-E148 WeakPolarHBondContact OG1-CG 3.38Å; T145-E148 PolarHBondContact OG1-N 3Å; T145-E148 PolarHBondContact OG1-OE2 3.11Å; T145-W149 WeakPolarHBondContact O-CB 3.39Å; T145-W149 PolarHBondContact O-N 2.69Å
146L98.6Very high97.9Very high22 Ų2247.8 Ų47.812%0.11525%0.252CS..Hα-helixtrans-53.5-41.5174.9177.562.1000112.5L95 F98 D106 L150L95-L146 HydrophobicContact CD1-CD1 3.44Å; L95-L146 VanDerWaalsContact CD1-CD1 3.44Å; L95-L146 HydrophobicContact CD1-CD2 4.39Å; L95-L146 HydrophobicContact CD1-CG 4.49Å; F98-L146 HydrophobicContact CB-CD1 4.49Å; F98-L146 HydrophobicContact CD1-CD1 3.5Å; F98-L146 HydrophobicContact CD2-CD1 4.37Å; F98-L146 HydrophobicContact CE1-CB 3.88Å; F98-L146 HydrophobicContact CE1-CD1 3.7Å; F98-L146 HydrophobicContact CE1-CG 4.34Å; F98-L146 HydrophobicContact CE2-CB 4.33Å; F98-L146 HydrophobicContact CG-CD1 3.87Å; F98-L146 VanDerWaalsContact CZ-CA 3.48Å; F98-L146 HydrophobicContact CZ-CB 3.76Å; F98-L146 HydrophobicContact CZ-CD1 4.2Å; D106-L146 HydrophobicContact CB-CB 4.23Å; D106-L146 PolarHBondContact O-N 2.65Å; L146-L150 HydrophobicContact CD1-CD1 3.81Å; L146-L150 HydrophobicContact CD1-CD2 4.47Å; L146-L150 HydrophobicContact CD1-CG 3.89Å; L146-L150 HydrophobicContact CG-CD1 4.02Å; L146-L150 HydrophobicContact CG-CG 4.42Å; L146-L150 WeakPolarHBondContact O-CB 3.45Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.3Å; L146-L150 PolarHBondContact O-N 2.86Å
147Q98.5Very high97.9Very high135 Ų13553 Ų5363%0.63128%0.277SS*.Hα-helixtrans-70-43.6-177.9-64.9-58.6-43.300112.4T145 W149 R151T145-Q147 PolarHBondContact O-N 2.75Å; Q147-W149 VanDerWaalsContact C-N 3.33Å; Q147-R151 WeakPolarHBondContact O-CB 3.4Å; Q147-R151 PolarHBondContact O-N 3.32Å; Q147-R151 VanDerWaalsContact O-N 3.08Å
148E98.8Very high97.9Very high14 Ų1449.4 Ų49.47%0.06526%0.257CS..Hα-helixtrans-60.2-46.2175.4-70.7159.715900110.5L136 A138 Q139 T145 G152L136-E148 HydrophobicContact CB-CB 4.43Å; A138-E148 WeakPolarHBondContact CA-OE1 3.48Å; Q139-E148 WeakPolarHBondContact CG-OE1 3.34Å; Q139-E148 PolarHBondContact N-OE1 2.78Å; T145-E148 WeakPolarHBondContact CB-OE2 3.11Å; T145-E148 WeakPolarHBondContact CG2-OE2 3.35Å; T145-E148 PolarHBondContact N-OE2 3.01Å; T145-E148 PolarHBondContact O-N 2.81Å; T145-E148 WeakPolarHBondContact OG1-CB 3.35Å; T145-E148 WeakPolarHBondContact OG1-CG 3.38Å; T145-E148 PolarHBondContact OG1-N 3Å; T145-E148 PolarHBondContact OG1-OE2 3.11Å; E148-G152 PolarHBondContact O-N 2.83Å
149W98.8Very high97.9Very high0 Ų049.6 Ų49.60%026%0.258CS..Hα-helixtrans-60-58.6178.2-174.9-83.1000112C94 W97 F98 Y101 F116 L136 F144 T145 Q147 R151 G152 M153C94-W149 PolarHBondContact O-NE1 2.75Å; W97-W149 AromaticContact CD2-CZ2 3.68Å; W97-W149 HydrophobicContact CD2-CZ2 3.68Å; W97-W149 AromaticContact CE2-CZ2 3.95Å; W97-W149 AromaticContact CE3-CZ2 3.51Å; W97-W149 HydrophobicContact CE3-CZ2 3.51Å; W97-W149 AromaticContact CE3-NE1 3.99Å; W97-W149 HydrophobicContact CG-CZ2 4.36Å; W97-W149 HydrophobicContact CH2-CH2 4.3Å; W97-W149 AromaticContact CH2-CZ2 3.91Å; W97-W149 HydrophobicContact CH2-CZ2 3.91Å; W97-W149 HydrophobicContact CZ2-CH2 4.31Å; W97-W149 HydrophobicContact CZ2-CZ2 4.07Å; W97-W149 HydrophobicContact CZ3-CH2 4.45Å; W97-W149 AromaticContact CZ3-CZ2 3.63Å; W97-W149 HydrophobicContact CZ3-CZ2 3.63Å; F98-W149 HydrophobicContact CB-CD2 4.43Å; F98-W149 HydrophobicContact CB-CG 4.22Å; F98-W149 HydrophobicContact CD2-CB 3.61Å; F98-W149 AromaticContact CD2-CD1 3.9Å; F98-W149 AromaticContact CD2-CD2 3.73Å; F98-W149 HydrophobicContact CD2-CD2 3.73Å; F98-W149 HydrophobicContact CD2-CE3 4.18Å; F98-W149 AromaticContact CD2-CG 3.49Å; F98-W149 HydrophobicContact CD2-CG 3.49Å; F98-W149 VanDerWaalsContact CD2-CG 3.49Å; F98-W149 HydrophobicContact CE2-CB 3.97Å; F98-W149 HydrophobicContact CE2-CG 4.31Å; F98-W149 HydrophobicContact CG-CG 4.28Å; Y101-W149 AromaticContact CD2-CH2 3.89Å; Y101-W149 HydrophobicContact CD2-CH2 3.89Å; Y101-W149 HydrophobicContact CD2-CZ2 4.36Å; Y101-W149 HydrophobicContact CE2-CH2 4.03Å; Y101-W149 HydrophobicContact CE2-CZ2 4.41Å; F116-W149 AromaticContact CD2-CH2 3.7Å; F116-W149 HydrophobicContact CD2-CH2 3.7Å; F116-W149 HydrophobicContact CD2-CZ3 4.24Å; F116-W149 HydrophobicContact CE1-CZ3 4.34Å; F116-W149 AromaticContact CE2-CH2 3.44Å; F116-W149 HydrophobicContact CE2-CH2 3.44Å; F116-W149 VanDerWaalsContact CE2-CH2 3.44Å; F116-W149 HydrophobicContact CE2-CZ2 4.41Å; F116-W149 AromaticContact CE2-CZ3 4Å; F116-W149 HydrophobicContact CE2-CZ3 4Å; F116-W149 HydrophobicContact CG-CH2 4.36Å; F116-W149 HydrophobicContact CG-CZ3 4.49Å; F116-W149 AromaticContact CZ-CH2 3.91Å; F116-W149 HydrophobicContact CZ-CH2 3.91Å; F116-W149 HydrophobicContact CZ-CZ3 4.02Å; L136-W149 HydrophobicContact CD2-CE3 4.34Å; F144-W149 HydrophobicContact CB-CE3 4.37Å; F144-W149 HydrophobicContact CD2-CE3 4.06Å; F144-W149 HydrophobicContact CD2-CZ3 4.11Å; T145-W149 WeakPolarHBondContact O-CB 3.39Å; T145-W149 PolarHBondContact O-N 2.69Å; Q147-W149 VanDerWaalsContact C-N 3.33Å; W149-R151 VanDerWaalsContact C-N 3.29Å; W149-R151 PolarHBondContact O-N 3.22Å; W149-G152 PolarHBondContact O-N 2.99Å; W149-M153 HydrophobicContact CD2-CE 3.89Å; W149-M153 HydrophobicContact CD2-CG 3.96Å; W149-M153 HydrophobicContact CE3-CE 3.8Å; W149-M153 HydrophobicContact CG-CG 3.98Å; W149-M153 HydrophobicContact CH2-CE 3.79Å; W149-M153 HydrophobicContact CZ2-CE 3.87Å; W149-M153 HydrophobicContact CZ3-CE 3.74Å; W149-M153 WeakPolarHBondContact O-CB 3.28Å; W149-M153 WeakPolarHBondContact O-CG 3.4Å; W149-M153 PolarHBondContact O-N 3.02Å
150L98.4Very high97.9Very high50 Ų5045.6 Ų45.626%0.26224%0.244SC..Hα-helixtrans-59.7-40.3-176.3-69.2179.2000112.2C94 L95 L146 G154C94-L150 HydrophobicContact CB-CD2 4.35Å; L95-L150 HydrophobicContact CB-CD2 4.23Å; L95-L150 HydrophobicContact CD1-CD1 4.31Å; L95-L150 HydrophobicContact CD1-CD2 4.36Å; L146-L150 HydrophobicContact CD1-CD1 3.81Å; L146-L150 HydrophobicContact CD1-CD2 4.47Å; L146-L150 HydrophobicContact CD1-CG 3.89Å; L146-L150 HydrophobicContact CG-CD1 4.02Å; L146-L150 HydrophobicContact CG-CG 4.42Å; L146-L150 WeakPolarHBondContact O-CB 3.45Å; L146-L150 VanDerWaalsContact O-CG 3.3Å; L146-L150 WeakPolarHBondContact O-CG 3.3Å; L146-L150 PolarHBondContact O-N 2.86Å; L150-G154 WeakPolarHBondContact O-CA 3.49Å; L150-G154 PolarHBondContact O-N 2.99Å
151R98.4Very high98.1Very high118 Ų11844 Ų4445%0.44523%0.231SC..Hα-helixtrans-66.7-50.3177.4178.5-177.962-162.21.5111.8L136 D137 Q147 W149 S155L136-R151 PolarHBondContact O-NH2 3.27Å; D137-R151 PolarHBondContact O-NH2 3.48Å; D137-R151 IonicContact OD2-CZ 3.19Å; D137-R151 IonicContact OD2-NH1 2.71Å; D137-R151 IonicContact OD2-NH2 2.86Å; D137-R151 PolarHBondContact OD2-NH2 2.78Å; D137-R151 VanDerWaalsContact OD2-NH2 3.07Å; Q147-R151 WeakPolarHBondContact O-CB 3.4Å; Q147-R151 PolarHBondContact O-N 3.32Å; Q147-R151 VanDerWaalsContact O-N 3.08Å; W149-R151 VanDerWaalsContact C-N 3.29Å; W149-R151 PolarHBondContact O-N 3.22Å; R151-S155 WeakPolarHBondContact O-CB 3.47Å; R151-S155 PolarHBondContact O-N 2.6Å; R151-S155 PolarHBondContact O-OG 3.35Å
152G98.4Very high98.2Very high1 Ų146.9 Ų46.91%0.0124%0.244CC..Hα-helixtrans-68.1-51-176.600000112.2E148 W149 G154 S155 L156E148-G152 PolarHBondContact O-N 2.83Å; W149-G152 PolarHBondContact O-N 2.99Å; G152-G154 VanDerWaalsContact C-N 3.33Å; G152-G154 PolarHBondContact O-N 3.32Å; G152-S155 WeakPolarHBondContact O-CB 3.2Å; G152-S155 PolarHBondContact O-N 2.8Å; G152-S155 VanDerWaalsContact O-N 3.12Å; G152-L156 WeakPolarHBondContact O-CG 3.41Å; G152-L156 PolarHBondContact O-N 3.4Å
153M98.5Very high98.3Very high0 Ų048.6 Ų48.60%024%0.242CC..Hα-helixtrans-64.3-37.9178.8-64.8-61.3-175.300111.9C94 W97 F116 L132 L136 W149 L156 Q157 C158 L164C94-M153 VanDerWaalsContact SG-CB 3.59Å; W97-M153 HydrophobicContact CH2-CE 4.09Å; W97-M153 HydrophobicContact CH2-SD 4.19Å; W97-M153 HydrophobicContact CZ3-CE 4.11Å; W97-M153 HydrophobicContact CZ3-CG 4.28Å; W97-M153 HydrophobicContact CZ3-SD 3.85Å; F116-M153 HydrophobicContact CE2-CE 4.47Å; F116-M153 HydrophobicContact CZ-CE 3.98Å; L132-M153 HydrophobicContact CD1-CE 4.29Å; L132-M153 HydrophobicContact CD2-CE 4.48Å; L136-M153 HydrophobicContact CD1-CE 4.33Å; L136-M153 HydrophobicContact CD1-SD 4.46Å; L136-M153 HydrophobicContact CD2-CE 4.3Å; W149-M153 HydrophobicContact CD2-CE 3.89Å; W149-M153 HydrophobicContact CD2-CG 3.96Å; W149-M153 HydrophobicContact CE3-CE 3.8Å; W149-M153 HydrophobicContact CG-CG 3.98Å; W149-M153 HydrophobicContact CH2-CE 3.79Å; W149-M153 HydrophobicContact CZ2-CE 3.87Å; W149-M153 HydrophobicContact CZ3-CE 3.74Å; W149-M153 WeakPolarHBondContact O-CB 3.28Å; W149-M153 WeakPolarHBondContact O-CG 3.4Å; W149-M153 PolarHBondContact O-N 3.02Å; M153-L156 CarbonylContact O-C 3.39Å; M153-L156 PolarHBondContact O-N 3.26Å; M153-Q157 PolarHBondContact O-N 2.89Å; M153-C158 WeakPolarHBondContact CB-O 3.36Å; M153-C158 PolarHBondContact O-N 3.28Å; M153-C158 HydrophobicContact SD-CB 4.3Å; M153-L164 HydrophobicContact CE-CD2 4.03Å; M153-L164 HydrophobicContact SD-CD2 4.44Å
154G98.1Very high98.3Very high15 Ų1543.2 Ų43.216%0.15522%0.222CC..Hα-helixtrans-61.1-42.9170.400000112.9L150 G152 L156 Q157L150-G154 WeakPolarHBondContact O-CA 3.49Å; L150-G154 PolarHBondContact O-N 2.99Å; G152-G154 VanDerWaalsContact C-N 3.33Å; G152-G154 PolarHBondContact O-N 3.32Å; G154-L156 VanDerWaalsContact C-N 3.31Å; G154-L156 PolarHBondContact O-N 3.21Å; G154-Q157 PolarHBondContact O-N 3.03Å; G154-Q157 VanDerWaalsContact O-N 3.15Å; G154-Q157 PolarHBondContact O-NE2 3.22Å
155S97.8Very high98.3Very high96 Ų9649 Ų4967%0.67124%0.243SC*.Hα-helixtrans-66.6-33.7176.1-58.20000112.5R151 G152 Q157R151-S155 WeakPolarHBondContact O-CB 3.47Å; R151-S155 PolarHBondContact O-N 2.6Å; R151-S155 PolarHBondContact O-OG 3.35Å; G152-S155 WeakPolarHBondContact O-CB 3.2Å; G152-S155 PolarHBondContact O-N 2.8Å; G152-S155 VanDerWaalsContact O-N 3.12Å; S155-Q157 VanDerWaalsContact C-N 3.28Å
156L97.8Very high98.2Very high25 Ų2552.5 Ų52.513%0.13126%0.26CS..THydrogen-bonded Turntrans-80.4-6.1174.8-67.5173.1000113.5L132 K135 L136 G152 M153 G154 C158 Y170 L171L132-L156 HydrophobicContact CD1-CD1 3.78Å; K135-L156 HydrophobicContact CB-CD1 4.18Å; K135-L156 HydrophobicContact CD-CD2 4.41Å; K135-L156 HydrophobicContact CG-CD2 4.29Å; L136-L156 HydrophobicContact CD1-CD1 4.44Å; G152-L156 WeakPolarHBondContact O-CG 3.41Å; G152-L156 PolarHBondContact O-N 3.4Å; M153-L156 CarbonylContact O-C 3.39Å; M153-L156 PolarHBondContact O-N 3.26Å; G154-L156 VanDerWaalsContact C-N 3.31Å; G154-L156 PolarHBondContact O-N 3.21Å; L156-C158 HydrophobicContact CB-CB 4.35Å; L156-C158 PolarHBondContact O-N 3.2Å; L156-C158 PolarHBondContact O-SG 3.36Å; L156-Y170 HydrophobicContact CD2-CE1 4.14Å; L156-L171 HydrophobicContact CD1-CD2 4.42Å; L156-L171 HydrophobicContact CD2-CD2 4.01Å
157Q97.8Very high98.2Very high110 Ų11052.8 Ų52.851%0.51426%0.264SS..THydrogen-bonded Turntrans54.534.9-173.3-60.2-70.2-63.900112.9F89 M153 G154 S155F89-Q157 VanDerWaalsContact CB-OE1 3.32Å; M153-Q157 PolarHBondContact O-N 2.89Å; G154-Q157 PolarHBondContact O-N 3.03Å; G154-Q157 VanDerWaalsContact O-N 3.15Å; G154-Q157 PolarHBondContact O-NE2 3.22Å; S155-Q157 VanDerWaalsContact C-N 3.28Å
158C98.4Very high98.2Very high0 Ų047 Ų470%024%0.237CC..  trans-109.5117.4178.7-680000109.6F89 M153 L156 R163 L164 S167F89-C158 WeakPolarHBondContact CE2-O 3.48Å; M153-C158 WeakPolarHBondContact CB-O 3.36Å; M153-C158 PolarHBondContact O-N 3.28Å; M153-C158 HydrophobicContact SD-CB 4.3Å; L156-C158 HydrophobicContact CB-CB 4.35Å; L156-C158 PolarHBondContact O-N 3.2Å; L156-C158 PolarHBondContact O-SG 3.36Å; C158-R163 HydrophobicContact CB-CB 4.26Å; C158-L164 HydrophobicContact CB-CB 4.32Å; C158-S167 PolarHBondContact SG-OG 2.88Å; C158-S167 VanDerWaalsContact SG-OG 3.42Å
159D98.3Very high98.1Very high3 Ų351.8 Ų51.82%0.01626%0.263CS..  trans-123.715.9175.663.1-5.4000112.8F89 S90 R93 C94 R163F89-D159 HydrophobicContact CD2-CB 3.69Å; F89-D159 HydrophobicContact CE2-CB 3.75Å; S90-D159 WeakPolarHBondContact CB-OD2 3.5Å; S90-D159 PolarHBondContact N-OD2 3.45Å; R93-D159 HydrophobicContact CB-CB 4.14Å; R93-D159 IonicContact CZ-OD1 3.95Å; R93-D159 IonicContact CZ-OD2 3.07Å; R93-D159 IonicContact NE-OD1 2.78Å; R93-D159 IonicContact NE-OD2 2.75Å; R93-D159 PolarHBondContact NE-OD2 3.36Å; R93-D159 IonicContact NH2-OD1 2.78Å; R93-D159 PolarHBondContact NH2-OD1 2.85Å; R93-D159 IonicContact NH2-OD2 2.69Å; R93-D159 PolarHBondContact NH2-OD2 2.9Å; C94-D159 HydrophobicContact CB-CB 3.84Å; D159-R163 WeakPolarHBondContact OD1-CD 3.33Å; D159-R163 IonicContact OD1-CZ 3.84Å; D159-R163 IonicContact OD1-NE 2.88Å; D159-R163 PolarHBondContact OD1-NE 3.1Å
160S98.2Very high98.1Very high37 Ų3757.5 Ų57.526%0.25929%0.286SS..SBendtrans-158.7161.1177.772.70000111.8E162 R163 L164S160-E162 VanDerWaalsContact C-N 3.27Å; S160-E162 PolarHBondContact O-N 3.48Å; S160-R163 PolarHBondContact O-N 2.87Å; S160-R163 PolarHBondContact OG-N 3.25Å; S160-L164 PolarHBondContact O-N 2.88Å; S160-L164 VanDerWaalsContact O-N 3.14Å
161T98.4Very high98.1Very high31 Ų3155.1 Ų55.119%0.1927%0.273CS..Hα-helixtrans-52.8-43173.8-56.60000112.6W97 D119 I120 L164 R165W97-T161 PolarHBondContact NE1-OG1 3.33Å; D119-T161 HydrophobicContact CB-CG2 4.18Å; D119-T161 WeakPolarHBondContact O-CG2 3.43Å; I120-T161 HydrophobicContact CG2-CG2 4.05Å; T161-L164 PolarHBondContact O-N 3.43Å; T161-R165 HydrophobicContact CG2-CG 4.47Å; T161-R165 WeakPolarHBondContact O-CB 3.47Å; T161-R165 WeakPolarHBondContact O-CG 3.19Å; T161-R165 PolarHBondContact O-N 2.85Å
162E97.8Very high98Very high138 Ų13853.9 Ų53.965%0.64527%0.269SS*.Hα-helixtrans-63.2-46.4-179.2-174.9-178.3176.900112.1S160 L164 R165 N166S160-E162 VanDerWaalsContact C-N 3.27Å; S160-E162 PolarHBondContact O-N 3.48Å; E162-L164 VanDerWaalsContact C-N 3.32Å; E162-L164 PolarHBondContact O-N 3.39Å; E162-R165 PolarHBondContact O-N 2.85Å; E162-N166 VanDerWaalsContact O-CG 3.27Å; E162-N166 PolarHBondContact O-N 3.09Å; E162-N166 PolarHBondContact O-ND2 2.88Å
163R97.7Very high98Very high59 Ų5956.8 Ų56.822%0.22329%0.289CS..Hα-helixtrans-63.9-40.2178.9-71.9-177.6-175.2-96.7-11.1112.2E86 E87 C158 D159 S160 N166 S167E86-R163 PolarHBondContact O-NH2 3.3Å; E87-R163 VanDerWaalsContact CA-NH2 3.27Å; E87-R163 VanDerWaalsContact O-CZ 3.31Å; E87-R163 PolarHBondContact O-NH1 3.42Å; E87-R163 PolarHBondContact O-NH2 2.89Å; C158-R163 HydrophobicContact CB-CB 4.26Å; D159-R163 WeakPolarHBondContact OD1-CD 3.33Å; D159-R163 IonicContact OD1-CZ 3.84Å; D159-R163 IonicContact OD1-NE 2.88Å; D159-R163 PolarHBondContact OD1-NE 3.1Å; S160-R163 PolarHBondContact O-N 2.87Å; S160-R163 PolarHBondContact OG-N 3.25Å; R163-N166 PolarHBondContact O-N 3.48Å; R163-S167 PolarHBondContact O-N 2.94Å; R163-S167 VanDerWaalsContact O-N 3.14Å; R163-S167 PolarHBondContact O-OG 3.18Å
164L98.4Very high97.9Very high0 Ų057.4 Ų57.40%029%0.292CS..Hα-helixtrans-68-43.1177.5-178.560.8000111.4W97 F116 I120 L132 M153 C158 S160 T161 E162 N166 S167 L168 L171W97-L164 HydrophobicContact CH2-CB 3.87Å; W97-L164 HydrophobicContact CH2-CD2 3.79Å; W97-L164 HydrophobicContact CH2-CG 4.48Å; W97-L164 HydrophobicContact CZ2-CD2 4.4Å; F116-L164 HydrophobicContact CE1-CD2 4.48Å; F116-L164 HydrophobicContact CE2-CD2 3.69Å; F116-L164 HydrophobicContact CZ-CD2 3.34Å; I120-L164 HydrophobicContact CD1-CD2 4.3Å; I120-L164 HydrophobicContact CG2-CD2 3.99Å; I120-L164 HydrophobicContact CG2-CG 4.49Å; L132-L164 HydrophobicContact CD1-CD1 4.04Å; L132-L164 HydrophobicContact CD2-CD2 4.01Å; M153-L164 HydrophobicContact CE-CD2 4.03Å; M153-L164 HydrophobicContact SD-CD2 4.44Å; C158-L164 HydrophobicContact CB-CB 4.32Å; S160-L164 PolarHBondContact O-N 2.88Å; S160-L164 VanDerWaalsContact O-N 3.14Å; T161-L164 PolarHBondContact O-N 3.43Å; E162-L164 VanDerWaalsContact C-N 3.32Å; E162-L164 PolarHBondContact O-N 3.39Å; L164-N166 VanDerWaalsContact C-N 3.28Å; L164-N166 PolarHBondContact O-N 2.99Å; L164-S167 CarbonylContact O-C 3.53Å; L164-S167 WeakPolarHBondContact O-CA 3.48Å; L164-S167 WeakPolarHBondContact O-CB 3.49Å; L164-S167 PolarHBondContact O-N 3.23Å; L164-L168 WeakPolarHBondContact O-CG 3.39Å; L164-L168 PolarHBondContact O-N 3.25Å; L164-L168 VanDerWaalsContact O-N 3.13Å; L164-L171 HydrophobicContact CD1-CD1 4.11Å
165R98.5Very high97.8Very high126 Ų12658.2 Ų58.248%0.47529%0.293SS..Hα-helixtrans-53.1-46.6172.9-80.7177.6173.5-176.2-5111.4D119 I120 T161 E162 S167 L168D119-R165 PolarHBondContact O-NE 2.96Å; D119-R165 PolarHBondContact O-NH2 3.4Å; I120-R165 HydrophobicContact CB-CG 4.19Å; I120-R165 WeakPolarHBondContact O-CG 3.47Å; T161-R165 HydrophobicContact CG2-CG 4.47Å; T161-R165 WeakPolarHBondContact O-CB 3.47Å; T161-R165 WeakPolarHBondContact O-CG 3.19Å; T161-R165 PolarHBondContact O-N 2.85Å; E162-R165 PolarHBondContact O-N 2.85Å; R165-S167 PolarHBondContact O-N 3.46Å; R165-L168 WeakPolarHBondContact O-CB 3.18Å; R165-L168 WeakPolarHBondContact O-CG 3.44Å; R165-L168 PolarHBondContact O-N 3.19Å
166N97.6Very high97.7Very high123 Ų12358.8 Ų58.866%0.65830%0.297SS*.Hα-helixtrans-65.8-19.2177.1-67.8-22.6000113.5E162 R163 L164E162-N166 VanDerWaalsContact O-CG 3.27Å; E162-N166 PolarHBondContact O-N 3.09Å; E162-N166 PolarHBondContact O-ND2 2.88Å; R163-N166 PolarHBondContact O-N 3.48Å; L164-N166 VanDerWaalsContact C-N 3.28Å; L164-N166 PolarHBondContact O-N 2.99Å
167S97.9Very high97.6Very high27 Ų2761.1 Ų61.119%0.18931%0.31CS..Hα-helixtrans-95.1-7.1178.7-58.30000113.6C158 R163 L164 R165 D169 Y170 L171C158-S167 PolarHBondContact SG-OG 2.88Å; C158-S167 VanDerWaalsContact SG-OG 3.42Å; R163-S167 PolarHBondContact O-N 2.94Å; R163-S167 VanDerWaalsContact O-N 3.14Å; R163-S167 PolarHBondContact O-OG 3.18Å; L164-S167 CarbonylContact O-C 3.53Å; L164-S167 WeakPolarHBondContact O-CA 3.48Å; L164-S167 WeakPolarHBondContact O-CB 3.49Å; L164-S167 PolarHBondContact O-N 3.23Å; R165-S167 PolarHBondContact O-N 3.46Å; S167-D169 VanDerWaalsContact C-N 3.31Å; S167-D169 PolarHBondContact O-N 3Å; S167-Y170 WeakPolarHBondContact O-CB 3.38Å; S167-Y170 PolarHBondContact O-N 3.41Å; S167-Y170 VanDerWaalsContact O-N 3.16Å; S167-L171 WeakPolarHBondContact O-CG 3.38Å; S167-L171 PolarHBondContact O-N 3.44Å
168L98Very high97.5Very high13 Ų1359.3 Ų59.37%0.06831%0.309CS..Hα-helixtrans-61.2-37.4-176.3-68.6177.9000112.7V122 V128 L164 R165 L171 R172V122-L168 HydrophobicContact CG1-CD1 3.79Å; V128-L168 HydrophobicContact CG1-CD2 4.33Å; V128-L168 HydrophobicContact CG2-CD2 3.96Å; L164-L168 WeakPolarHBondContact O-CG 3.39Å; L164-L168 PolarHBondContact O-N 3.25Å; L164-L168 VanDerWaalsContact O-N 3.13Å; R165-L168 WeakPolarHBondContact O-CB 3.18Å; R165-L168 WeakPolarHBondContact O-CG 3.44Å; R165-L168 PolarHBondContact O-N 3.19Å; L168-L171 HydrophobicContact CD2-CD1 4.31Å; L168-L171 PolarHBondContact O-N 2.64Å; L168-R172 WeakPolarHBondContact O-CG 3.24Å; L168-R172 PolarHBondContact O-N 3.29Å
169D97.8Very high97.4Very high115 Ų11563.8 Ų63.862%0.61534%0.337SS*.Hα-helixtrans-68.4-37.2178-71.3-21.6000112S167 R172 S173S167-D169 VanDerWaalsContact C-N 3.31Å; S167-D169 PolarHBondContact O-N 3Å; D169-R172 PolarHBondContact O-N 3.46Å; D169-R172 IonicContact OD1-CZ 3.88Å; D169-R172 IonicContact OD1-NH1 3.61Å; D169-R172 PolarHBondContact OD1-NH1 3.43Å; D169-S173 PolarHBondContact O-N 3.04Å
170Y98.1Very high97.4Very high120 Ų12064.9 Ų64.947%0.47134%0.344SS..Hα-helixtrans-60.8-47.6169.9163-110.6000110.9L156 S167 R172 S173 V174L156-Y170 HydrophobicContact CD2-CE1 4.14Å; S167-Y170 WeakPolarHBondContact O-CB 3.38Å; S167-Y170 PolarHBondContact O-N 3.41Å; S167-Y170 VanDerWaalsContact O-N 3.16Å; Y170-R172 VanDerWaalsContact C-N 3.32Å; Y170-R172 PolarHBondContact O-N 3.2Å; Y170-S173 WeakPolarHBondContact O-CB 3.25Å; Y170-S173 PolarHBondContact O-N 2.98Å; Y170-S173 PolarHBondContact O-OG 2.73Å; Y170-V174 HydrophobicContact CE2-CG2 4.36Å; Y170-V174 PolarHBondContact O-N 3.3Å
171L98.2Very high97.4Very high0 Ų064 Ų640%034%0.336CS..Hα-helixtrans-58.4-43.3177.5-66.4175.5000111.7V128 V131 L132 K135 L156 L164 S167 L168 S173 V174V128-L171 HydrophobicContact CG2-CB 3.73Å; V128-L171 HydrophobicContact CG2-CD1 4.36Å; V131-L171 HydrophobicContact CG1-CB 4.26Å; V131-L171 HydrophobicContact CG1-CD2 4.28Å; V131-L171 WeakPolarHBondContact CG1-O 3.25Å; L132-L171 HydrophobicContact CB-CD1 4.29Å; L132-L171 HydrophobicContact CD1-CD1 4.09Å; K135-L171 HydrophobicContact CG-CD2 3.84Å; L156-L171 HydrophobicContact CD1-CD2 4.42Å; L156-L171 HydrophobicContact CD2-CD2 4.01Å; L164-L171 HydrophobicContact CD1-CD1 4.11Å; S167-L171 WeakPolarHBondContact O-CG 3.38Å; S167-L171 PolarHBondContact O-N 3.44Å; L168-L171 HydrophobicContact CD2-CD1 4.31Å; L168-L171 PolarHBondContact O-N 2.64Å; L171-S173 VanDerWaalsContact C-N 3.31Å; L171-S173 PolarHBondContact O-N 2.87Å; L171-V174 WeakPolarHBondContact O-CB 3.45Å; L171-V174 PolarHBondContact O-N 2.97Å
172R96.9Very high97.4Very high93 Ų9366.6 Ų66.635%0.35135%0.345SS..Hα-helixtrans-60.6-40.5174.4-69.8173.6-172.7118.74.6112V128 L168 D169 Y170 V174 L175V128-R172 HydrophobicContact CB-CG 4.14Å; V128-R172 HydrophobicContact CG2-CG 3.88Å; L168-R172 WeakPolarHBondContact O-CG 3.24Å; L168-R172 PolarHBondContact O-N 3.29Å; D169-R172 PolarHBondContact O-N 3.46Å; D169-R172 IonicContact OD1-CZ 3.88Å; D169-R172 IonicContact OD1-NH1 3.61Å; D169-R172 PolarHBondContact OD1-NH1 3.43Å; Y170-R172 VanDerWaalsContact C-N 3.32Å; Y170-R172 PolarHBondContact O-N 3.2Å; R172-V174 PolarHBondContact O-N 3.07Å; R172-L175 PolarHBondContact O-N 3.08Å
173S97.4Very high97.4Very high62 Ų6264.5 Ų64.543%0.43434%0.337SS..Hα-helixtrans-63-25.9-179.8800000113.4D169 Y170 L171 L175 S176D169-S173 PolarHBondContact O-N 3.04Å; Y170-S173 WeakPolarHBondContact O-CB 3.25Å; Y170-S173 PolarHBondContact O-N 2.98Å; Y170-S173 PolarHBondContact O-OG 2.73Å; L171-S173 VanDerWaalsContact C-N 3.31Å; L171-S173 PolarHBondContact O-N 2.87Å; S173-L175 PolarHBondContact O-N 3.02Å; S173-S176 VanDerWaalsContact O-CB 3.28Å; S173-S176 WeakPolarHBondContact O-CB 3.47Å; S173-S176 PolarHBondContact O-N 3.42Å; S173-S176 PolarHBondContact O-OG 2.68Å
174V97.4Very high97.5Very high12 Ų1261.7 Ų61.77%0.07333%0.326CS..Hα-helixtrans-57.3-33.6176.7178.60000111.8V131 W134 Y170 L171 R172 S176 D177 S180 I184V131-V174 HydrophobicContact CG1-CB 4.13Å; V131-V174 HydrophobicContact CG1-CG1 4.35Å; V131-V174 HydrophobicContact CG1-CG2 4.43Å; W134-V174 HydrophobicContact CZ3-CG1 3.97Å; Y170-V174 HydrophobicContact CE2-CG2 4.36Å; Y170-V174 PolarHBondContact O-N 3.3Å; L171-V174 WeakPolarHBondContact O-CB 3.45Å; L171-V174 PolarHBondContact O-N 2.97Å; R172-V174 PolarHBondContact O-N 3.07Å; V174-S176 PolarHBondContact O-N 3.28Å; V174-D177 PolarHBondContact O-N 3.3Å; V174-S180 WeakPolarHBondContact O-CB 3.45Å; V174-I184 HydrophobicContact CG1-CD1 3.73Å
175L95.4Very high97.5Very high32 Ų3261.7 Ų61.717%0.16833%0.326CS..THydrogen-bonded Turntrans-71.8-13.4179-66.4170.3000113.6V127 V131 R172 S173 D177 F181 I184V127-L175 HydrophobicContact CB-CD1 4.45Å; V127-L175 HydrophobicContact CG1-CD1 4.03Å; V127-L175 HydrophobicContact CG2-CD1 3.6Å; V131-L175 HydrophobicContact CG2-CD1 3.7Å; V131-L175 HydrophobicContact CG2-CD2 3.84Å; V131-L175 HydrophobicContact CG2-CG 3.65Å; R172-L175 PolarHBondContact O-N 3.08Å; S173-L175 PolarHBondContact O-N 3.02Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-F181 HydrophobicContact CB-CD2 4.23Å; L175-F181 HydrophobicContact CD2-CD2 3.9Å; L175-F181 HydrophobicContact CD2-CE2 4.38Å; L175-I184 HydrophobicContact CD2-CB 4.4Å; L175-I184 HydrophobicContact CD2-CD1 3.81Å; L175-I184 HydrophobicContact CD2-CG2 4.07Å
176S95.1Very high97.5Very high108 Ų10861.1 Ų61.176%0.75532%0.324SS*.THydrogen-bonded Turntrans-77.7-21.2176.5-57.50000112.4S173 V174S173-S176 VanDerWaalsContact O-CB 3.28Å; S173-S176 WeakPolarHBondContact O-CB 3.47Å; S173-S176 PolarHBondContact O-N 3.42Å; S173-S176 PolarHBondContact O-OG 2.68Å; V174-S176 PolarHBondContact O-N 3.28Å
177D96.5Very high97.5Very high75 Ų7556.6 Ų56.640%0.40130%0.298SS..SBendtrans-80.3122.4172.217152.7000110.5V174 L175 T179 S180 F181V174-D177 PolarHBondContact O-N 3.3Å; L175-D177 VanDerWaalsContact C-N 3.33Å; D177-T179 VanDerWaalsContact C-N 3.26Å; D177-T179 PolarHBondContact O-N 2.97Å; D177-T179 WeakPolarHBondContact OD2-CB 3.28Å; D177-S180 PolarHBondContact O-N 2.77Å; D177-S180 WeakPolarHBondContact OD2-CB 3.23Å; D177-S180 PolarHBondContact OD2-N 3.49Å; D177-S180 PolarHBondContact OD2-OG 3.09Å; D177-F181 VanDerWaalsContact O-CB 3.32Å; D177-F181 WeakPolarHBondContact O-CB 3.19Å; D177-F181 PolarHBondContact O-N 3.32Å
178S95.4Very high97.5Very high71 Ų7155.3 Ų55.350%0.49729%0.289SS..Hα-helixtrans-61.1-34.2-175.1-177.70000113.2K182S178-K182 WeakPolarHBondContact O-CB 3.48Å; S178-K182 PolarHBondContact O-N 3.34Å
179T97.1Very high97.6Very high95 Ų9554.9 Ų54.958%0.58329%0.287SS*.Hα-helixtrans-70.6-51.7179.5-54.80000110.2D177 F181 K182 L183D177-T179 VanDerWaalsContact C-N 3.26Å; D177-T179 PolarHBondContact O-N 2.97Å; D177-T179 WeakPolarHBondContact OD2-CB 3.28Å; T179-F181 VanDerWaalsContact C-N 3.34Å; T179-F181 PolarHBondContact O-N 3.26Å; T179-K182 PolarHBondContact O-N 3.29Å; T179-K182 VanDerWaalsContact O-N 3.17Å; T179-L183 HydrophobicContact CG2-CD1 4.5Å; T179-L183 WeakPolarHBondContact O-CG 3.49Å; T179-L183 PolarHBondContact O-N 2.96Å
180S97.6Very high97.5Very high25 Ų2552.3 Ų52.318%0.17527%0.273CS..Hα-helixtrans-60-44176.8-59.90000111.2V174 D177 K182 L183 I184V174-S180 WeakPolarHBondContact O-CB 3.45Å; D177-S180 PolarHBondContact O-N 2.77Å; D177-S180 WeakPolarHBondContact OD2-CB 3.23Å; D177-S180 PolarHBondContact OD2-N 3.49Å; D177-S180 PolarHBondContact OD2-OG 3.09Å; S180-K182 VanDerWaalsContact C-N 3.35Å; S180-K182 PolarHBondContact O-N 2.97Å; S180-L183 PolarHBondContact O-N 3.23Å; S180-I184 WeakPolarHBondContact O-CB 3.13Å; S180-I184 VanDerWaalsContact O-CG1 3.3Å; S180-I184 WeakPolarHBondContact O-CG1 3.47Å; S180-I184 PolarHBondContact O-N 2.98Å
181F98.2Very high97.5Very high19 Ų1947.3 Ų47.38%0.08325%0.254CS..Hα-helixtrans-56.9-46.8174.2-174.6-82.5000111.7L175 D177 T179 L183 I184 Y185 L212 L213 L244L175-F181 HydrophobicContact CB-CD2 4.23Å; L175-F181 HydrophobicContact CD2-CD2 3.9Å; L175-F181 HydrophobicContact CD2-CE2 4.38Å; D177-F181 VanDerWaalsContact O-CB 3.32Å; D177-F181 WeakPolarHBondContact O-CB 3.19Å; D177-F181 PolarHBondContact O-N 3.32Å; T179-F181 VanDerWaalsContact C-N 3.34Å; T179-F181 PolarHBondContact O-N 3.26Å; F181-L183 VanDerWaalsContact C-N 3.3Å; F181-L183 PolarHBondContact O-N 2.8Å; F181-I184 PolarHBondContact O-N 3.18Å; F181-Y185 HydrophobicContact CE1-CD2 4.14Å; F181-Y185 HydrophobicContact CZ-CD2 4.48Å; F181-Y185 WeakPolarHBondContact O-CB 3.47Å; F181-Y185 PolarHBondContact O-N 3.33Å; F181-L212 HydrophobicContact CE2-CD2 4.38Å; F181-L212 WeakPolarHBondContact CE2-O 3.4Å; F181-L212 HydrophobicContact CZ-CB 4.31Å; F181-L212 HydrophobicContact CZ-CD2 4.42Å; F181-L212 WeakPolarHBondContact CZ-O 3.46Å; F181-L213 HydrophobicContact CE1-CD2 4.2Å; F181-L213 HydrophobicContact CZ-CD2 3.9Å; F181-L244 HydrophobicContact CD1-CD1 4.32Å; F181-L244 HydrophobicContact CE1-CD1 3.7Å
182K98.1Very high97.5Very high86 Ų8647.8 Ų47.837%0.37426%0.258SS..Hα-helixtrans-62.6-37.9178.6-175.6170.5-178.4166.30111.7S178 T179 S180 R186 L244S178-K182 WeakPolarHBondContact O-CB 3.48Å; S178-K182 PolarHBondContact O-N 3.34Å; T179-K182 PolarHBondContact O-N 3.29Å; T179-K182 VanDerWaalsContact O-N 3.17Å; S180-K182 VanDerWaalsContact C-N 3.35Å; S180-K182 PolarHBondContact O-N 2.97Å; K182-R186 VanDerWaalsContact O-CG 3.28Å; K182-R186 WeakPolarHBondContact O-CG 3.41Å; K182-R186 PolarHBondContact O-N 3.43Å; K182-R186 VanDerWaalsContact O-N 3.16Å; K182-L244 HydrophobicContact CB-CD2 4.45Å; K182-L244 HydrophobicContact CG-CD2 4.15Å
183L98.5Very high97.4Very high93 Ų9346.5 Ų46.549%0.48725%0.253SS..Hα-helixtrans-67.3-47.7175.9-68.1173.8000111.7W134 T179 S180 F181 Y185 R186 Y187W134-L183 HydrophobicContact CZ2-CB 4.4Å; T179-L183 HydrophobicContact CG2-CD1 4.5Å; T179-L183 WeakPolarHBondContact O-CG 3.49Å; T179-L183 PolarHBondContact O-N 2.96Å; S180-L183 PolarHBondContact O-N 3.23Å; F181-L183 VanDerWaalsContact C-N 3.3Å; F181-L183 PolarHBondContact O-N 2.8Å; L183-Y185 PolarHBondContact O-N 2.68Å; L183-R186 PolarHBondContact O-N 3.44Å; L183-Y187 WeakPolarHBondContact O-CB 3.37Å; L183-Y187 PolarHBondContact O-N 2.9Å
184I98.7Very high97.2Very high0 Ų050.3 Ų50.30%026%0.264CS..Hα-helixtrans-62.8-43.2178.2-68.2162000110.7L130 V131 W134 V174 L175 S180 F181 R186 Y187 A188 L212L130-I184 HydrophobicContact CD2-CG2 4.28Å; L130-I184 HydrophobicContact CG-CG2 4.19Å; V131-I184 HydrophobicContact CG1-CD1 4.24Å; V131-I184 HydrophobicContact CG2-CD1 4.34Å; W134-I184 HydrophobicContact CB-CG1 4.27Å; W134-I184 HydrophobicContact CD2-CD1 4.17Å; W134-I184 HydrophobicContact CD2-CG1 3.51Å; W134-I184 HydrophobicContact CE3-CD1 3.87Å; W134-I184 HydrophobicContact CE3-CG1 3.75Å; W134-I184 HydrophobicContact CG-CG1 3.72Å; W134-I184 HydrophobicContact CZ2-CG1 4.46Å; W134-I184 HydrophobicContact CZ3-CD1 4.17Å; W134-I184 HydrophobicContact CZ3-CG1 4.31Å; V174-I184 HydrophobicContact CG1-CD1 3.73Å; L175-I184 HydrophobicContact CD2-CB 4.4Å; L175-I184 HydrophobicContact CD2-CD1 3.81Å; L175-I184 HydrophobicContact CD2-CG2 4.07Å; S180-I184 WeakPolarHBondContact O-CB 3.13Å; S180-I184 VanDerWaalsContact O-CG1 3.3Å; S180-I184 WeakPolarHBondContact O-CG1 3.47Å; S180-I184 PolarHBondContact O-N 2.98Å; F181-I184 PolarHBondContact O-N 3.18Å; I184-R186 VanDerWaalsContact C-N 3.32Å; I184-R186 PolarHBondContact O-N 3.47Å; I184-Y187 WeakPolarHBondContact O-CB 3.31Å; I184-Y187 PolarHBondContact O-N 3.44Å; I184-A188 WeakPolarHBondContact O-CB 3.48Å; I184-A188 PolarHBondContact O-N 3.15Å; I184-L212 HydrophobicContact CG2-CD2 4.33Å
185Y98.7Very high96.8Very high0 Ų058.1 Ų58.10%030%0.297CS..Hα-helixtrans-58.9-43.1176.8-178.4-83000111.8F181 L183 L209 L212 L213 W240 L244F181-Y185 HydrophobicContact CE1-CD2 4.14Å; F181-Y185 HydrophobicContact CZ-CD2 4.48Å; F181-Y185 WeakPolarHBondContact O-CB 3.47Å; F181-Y185 PolarHBondContact O-N 3.33Å; L183-Y185 PolarHBondContact O-N 2.68Å; Y185-L209 HydrophobicContact CE2-CD2 3.98Å; Y185-L209 VanDerWaalsContact OH-CD2 3.26Å; Y185-L209 WeakPolarHBondContact OH-CD2 3.24Å; Y185-L212 HydrophobicContact CD2-CB 4.16Å; Y185-L212 HydrophobicContact CD2-CD1 3.76Å; Y185-L212 HydrophobicContact CD2-CG 4.42Å; Y185-L212 HydrophobicContact CE2-CD1 4.26Å; Y185-L212 HydrophobicContact CG-CD1 4.42Å; Y185-L213 HydrophobicContact CE2-CD1 3.96Å; Y185-L213 HydrophobicContact CE2-CD2 4.31Å; Y185-L213 HydrophobicContact CE2-CG 4.12Å; Y185-W240 AromaticContact CD1-CD1 3.98Å; Y185-W240 AromaticContact CD1-NE1 3.42Å; Y185-W240 AromaticContact CE1-CD1 3.37Å; Y185-W240 HydrophobicContact CE1-CD2 4.35Å; Y185-W240 AromaticContact CE1-CE2 3.73Å; Y185-W240 HydrophobicContact CE1-CG 4.13Å; Y185-W240 HydrophobicContact CE1-CZ2 4.39Å; Y185-W240 AromaticContact CE1-NE1 3.09Å; Y185-W240 WeakPolarHBondContact CE1-O 3.39Å; Y185-W240 HydrophobicContact CE2-CZ2 4.16Å; Y185-W240 AromaticContact CZ-CE2 3.73Å; Y185-W240 AromaticContact CZ-NE1 3.61Å; Y185-W240 PolarHBondContact O-NE1 3.13Å; Y185-W240 PolarHBondContact OH-O 2.91Å; Y185-L244 HydrophobicContact CD1-CB 3.89Å; Y185-L244 HydrophobicContact CD1-CD2 3.64Å; Y185-L244 HydrophobicContact CD1-CG 4.3Å; Y185-L244 HydrophobicContact CD2-CB 4.44Å; Y185-L244 HydrophobicContact CD2-CD1 4.29Å; Y185-L244 HydrophobicContact CD2-CD2 4.36Å; Y185-L244 HydrophobicContact CE1-CB 3.5Å; Y185-L244 HydrophobicContact CE1-CD2 4.17Å; Y185-L244 HydrophobicContact CE1-CG 4.39Å; Y185-L244 HydrophobicContact CE2-CB 4.11Å; Y185-L244 HydrophobicContact CE2-CD1 4.45Å; Y185-L244 HydrophobicContact CG-CB 4.35Å; Y185-L244 HydrophobicContact CG-CD1 4.49Å; Y185-L244 HydrophobicContact CG-CD2 3.76Å; Y185-L244 HydrophobicContact CG-CG 4.43Å
186R98.3Very high96.6Very high114 Ų11463.2 Ų63.243%0.4332%0.324SS..Hα-helixtrans-70-40.9177-70.4175.880.399.4-1.5111.7K182 L183 I184 A188 F189K182-R186 VanDerWaalsContact O-CG 3.28Å; K182-R186 WeakPolarHBondContact O-CG 3.41Å; K182-R186 PolarHBondContact O-N 3.43Å; K182-R186 VanDerWaalsContact O-N 3.16Å; L183-R186 PolarHBondContact O-N 3.44Å; I184-R186 VanDerWaalsContact C-N 3.32Å; I184-R186 PolarHBondContact O-N 3.47Å; R186-A188 VanDerWaalsContact C-N 3.32Å; R186-A188 PolarHBondContact O-N 3.24Å; R186-F189 PolarHBondContact O-N 2.94Å
187Y98.6Very high96.6Very high29 Ų2962.8 Ų62.811%0.11431%0.31CS..Hα-helixtrans-58.7-43.1176163.4-98.4000112L130 A133 W134 A138 L183 I184 F189 D190 F191L130-Y187 HydrophobicContact CD1-CD1 4.23Å; L130-Y187 HydrophobicContact CD1-CE1 4.08Å; A133-Y187 VanDerWaalsContact C-OH 3.29Å; A133-Y187 HydrophobicContact CB-CE1 4.37Å; A133-Y187 PolarHBondContact O-OH 3.16Å; W134-Y187 HydrophobicContact CB-CD1 3.74Å; W134-Y187 HydrophobicContact CB-CE1 3.69Å; W134-Y187 HydrophobicContact CB-CG 4.39Å; W134-Y187 AromaticContact CD1-CD1 3.77Å; W134-Y187 AromaticContact CD1-CD2 3.99Å; W134-Y187 AromaticContact CD1-CG 3.55Å; W134-Y187 HydrophobicContact CG-CD1 4.14Å; W134-Y187 HydrophobicContact CG-CE1 4.48Å; W134-Y187 HydrophobicContact CG-CG 4.36Å; A138-Y187 WeakPolarHBondContact O-CE2 3.26Å; A138-Y187 PolarHBondContact O-OH 3.17Å; L183-Y187 WeakPolarHBondContact O-CB 3.37Å; L183-Y187 PolarHBondContact O-N 2.9Å; I184-Y187 WeakPolarHBondContact O-CB 3.31Å; I184-Y187 PolarHBondContact O-N 3.44Å; Y187-F189 PolarHBondContact O-N 3.39Å; Y187-F189 VanDerWaalsContact O-N 3.09Å; Y187-D190 PolarHBondContact O-N 3.4Å; Y187-F191 HydrophobicContact CD1-CB 4.26Å; Y187-F191 HydrophobicContact CE1-CB 3.8Å; Y187-F191 HydrophobicContact CE1-CD1 4.27Å; Y187-F191 HydrophobicContact CE1-CD2 4.26Å; Y187-F191 AromaticContact CE1-CG 3.87Å; Y187-F191 HydrophobicContact CE1-CG 3.87Å; Y187-F191 HydrophobicContact CE2-CB 4.1Å; Y187-F191 AromaticContact CZ-CD2 3.76Å; Y187-F191 AromaticContact CZ-CG 3.78Å; Y187-F191 WeakPolarHBondContact O-CB 3.4Å; Y187-F191 PolarHBondContact O-N 3.07Å; Y187-F191 WeakPolarHBondContact OH-CD2 3.22Å
188A98.6Very high96.5Very high0 Ų069.7 Ų69.70%033%0.331CS..Hα-helixtrans-54-34.8-178.100000113.2L130 I184 R186 A192 L212 W240L130-A188 HydrophobicContact CD1-CB 3.87Å; L130-A188 HydrophobicContact CD2-CB 3.83Å; L130-A188 HydrophobicContact CG-CB 4.43Å; I184-A188 WeakPolarHBondContact O-CB 3.48Å; I184-A188 PolarHBondContact O-N 3.15Å; R186-A188 VanDerWaalsContact C-N 3.32Å; R186-A188 PolarHBondContact O-N 3.24Å; A188-A192 VanDerWaalsContact O-CB 3.25Å; A188-A192 WeakPolarHBondContact O-CB 3.47Å; A188-A192 PolarHBondContact O-N 2.97Å; A188-L212 HydrophobicContact CB-CD1 3.86Å; A188-W240 HydrophobicContact CB-CZ2 4.16Å
189F98.4Very high96.7Very high3 Ų367.6 Ų67.61%0.01332%0.316CS..Hα-helixtrans-64.2-50174.9179.6-87.8000112.2R186 Y187 F191 R193 L200 K237 W240R186-F189 PolarHBondContact O-N 2.94Å; Y187-F189 PolarHBondContact O-N 3.39Å; Y187-F189 VanDerWaalsContact O-N 3.09Å; F189-F191 VanDerWaalsContact C-N 3.32Å; F189-R193 WeakPolarHBondContact O-CB 3.49Å; F189-R193 PolarHBondContact O-N 3.21Å; F189-L200 HydrophobicContact CD2-CD1 3.73Å; F189-L200 HydrophobicContact CD2-CG 3.83Å; F189-L200 HydrophobicContact CE2-CD1 4.19Å; F189-L200 HydrophobicContact CE2-CG 3.83Å; F189-L200 HydrophobicContact CG-CD1 4.5Å; F189-K237 HydrophobicContact CD1-CB 4.14Å; F189-K237 HydrophobicContact CD1-CD 4.05Å; F189-K237 HydrophobicContact CD1-CG 3.88Å; F189-K237 HydrophobicContact CE1-CB 3.58Å; F189-K237 HydrophobicContact CE1-CD 3.98Å; F189-K237 HydrophobicContact CE1-CG 3.82Å; F189-K237 HydrophobicContact CE2-CB 4.29Å; F189-K237 HydrophobicContact CG-CG 4.46Å; F189-K237 VanDerWaalsContact CZ-CA 3.5Å; F189-K237 HydrophobicContact CZ-CB 3.66Å; F189-K237 HydrophobicContact CZ-CG 4.33Å; F189-K237 VanDerWaalsContact CZ-N 3.31Å; F189-W240 HydrophobicContact CB-CD2 4.18Å; F189-W240 HydrophobicContact CB-CG 4.01Å; F189-W240 HydrophobicContact CD2-CB 3.71Å; F189-W240 AromaticContact CD2-CD2 3.96Å; F189-W240 HydrophobicContact CD2-CD2 3.96Å; F189-W240 HydrophobicContact CD2-CE3 4.31Å; F189-W240 AromaticContact CD2-CG 3.67Å; F189-W240 HydrophobicContact CD2-CG 3.67Å; F189-W240 HydrophobicContact CE2-CB 4.2Å; F189-W240 HydrophobicContact CG-CB 4.49Å; F189-W240 HydrophobicContact CG-CG 4.19Å
190D97.4Very high96.7Very high61 Ų6163.2 Ų63.233%0.32629%0.289SS..Hα-helixtrans-69.8-34.5-178-67.8-44.4000111.1Y187 K237Y187-D190 PolarHBondContact O-N 3.4Å; D190-K237 IonicContact OD1-NZ 3.41Å; D190-K237 PolarHBondContact OD1-NZ 3.3Å; D190-K237 IonicContact OD2-NZ 3.89Å; D190-K237 PolarHBondContact OD2-NZ 3.12Å
191F97.8Very high96.7Very high15 Ų1565.2 Ų65.27%0.06630%0.298CS..Hα-helixtrans-66.9-44.5177.3175.3-116000113.5L130 A133 A138 S140 M141 Y187 F189L130-F191 HydrophobicContact CD1-CD1 3.85Å; L130-F191 HydrophobicContact CD1-CE1 4.18Å; A133-F191 HydrophobicContact CB-CE1 4.02Å; A133-F191 HydrophobicContact CB-CE2 3.81Å; A133-F191 HydrophobicContact CB-CZ 3.47Å; A133-F191 VanDerWaalsContact CB-CZ 3.47Å; A138-F191 HydrophobicContact CB-CD2 4.47Å; A138-F191 HydrophobicContact CB-CE2 3.93Å; S140-F191 VanDerWaalsContact C-CE2 3.41Å; S140-F191 WeakPolarHBondContact O-CE2 3.36Å; M141-F191 VanDerWaalsContact CA-CZ 3.43Å; M141-F191 HydrophobicContact CB-CD1 4.03Å; M141-F191 HydrophobicContact CB-CD2 4.49Å; M141-F191 HydrophobicContact CB-CE1 3.79Å; M141-F191 HydrophobicContact CB-CE2 4.28Å; M141-F191 HydrophobicContact CB-CG 4.4Å; M141-F191 HydrophobicContact CB-CZ 3.95Å; M141-F191 WeakPolarHBondContact CB-O 3.49Å; M141-F191 HydrophobicContact CG-CD1 4.39Å; M141-F191 HydrophobicContact CG-CE1 3.85Å; M141-F191 HydrophobicContact CG-CZ 4.23Å; M141-F191 PolarHBondContact N-O 3.49Å; Y187-F191 HydrophobicContact CD1-CB 4.26Å; Y187-F191 HydrophobicContact CE1-CB 3.8Å; Y187-F191 HydrophobicContact CE1-CD1 4.27Å; Y187-F191 HydrophobicContact CE1-CD2 4.26Å; Y187-F191 AromaticContact CE1-CG 3.87Å; Y187-F191 HydrophobicContact CE1-CG 3.87Å; Y187-F191 HydrophobicContact CE2-CB 4.1Å; Y187-F191 AromaticContact CZ-CD2 3.76Å; Y187-F191 AromaticContact CZ-CG 3.78Å; Y187-F191 WeakPolarHBondContact O-CB 3.4Å; Y187-F191 PolarHBondContact O-N 3.07Å; Y187-F191 WeakPolarHBondContact OH-CD2 3.22Å; F189-F191 VanDerWaalsContact C-N 3.32Å
192A97.4Very high96.7Very high10 Ų1065.2 Ų65.28%0.08330%0.299CS..Hα-helixtrans-82.5-13.9-177.700000113.5M141 A188 L200 T204 M208M141-A192 HydrophobicContact CE-CB 4.07Å; M141-A192 HydrophobicContact SD-CB 3.9Å; A188-A192 VanDerWaalsContact O-CB 3.25Å; A188-A192 WeakPolarHBondContact O-CB 3.47Å; A188-A192 PolarHBondContact O-N 2.97Å; A192-L200 VanDerWaalsContact C-CD2 3.45Å; A192-L200 HydrophobicContact CB-CD2 3.83Å; A192-T204 HydrophobicContact CB-CG2 3.96Å; A192-M208 HydrophobicContact CB-CG 4.2Å
193R95.6Very high96.6Very high66 Ų6666.1 Ų66.125%0.24931%0.308CS..SBendtrans-81.4131.3-177-176.6-174.962.862.414.8110.8F189 Q197 L200F189-R193 WeakPolarHBondContact O-CB 3.49Å; F189-R193 PolarHBondContact O-N 3.21Å; R193-Q197 VanDerWaalsContact CD-O 3.23Å; R193-Q197 WeakPolarHBondContact CD-O 3.39Å; R193-Q197 HydrophobicContact CG-CB 4.05Å; R193-Q197 VanDerWaalsContact CZ-O 3.3Å; R193-Q197 PolarHBondContact NE-O 3.35Å; R193-Q197 PolarHBondContact NH1-O 2.87Å; R193-L200 VanDerWaalsContact CA-CD2 3.45Å; R193-L200 HydrophobicContact CB-CD2 3.67Å; R193-L200 HydrophobicContact CG-CD2 4.45Å
194E92.3Very high96.5Very high142 Ų14263.2 Ų63.266%0.66429%0.294SS*.PPolyproline II helixtrans-58.7151.7172-66.6-178.8178.300112.2D196 Q197E194-D196 PolarHBondContact O-N 2.88Å; E194-Q197 HydrophobicContact CB-CB 4.47Å; E194-Q197 HydrophobicContact CB-CG 3.9Å; E194-Q197 PolarHBondContact O-N 3.46Å
195K89.2Confident96.5Very high176 Ų17663.2 Ų63.277%0.76529%0.294SS*.THydrogen-bonded Turntrans-55.5140.7175.1-162178.7176.3-179.20109.8Q197K195-Q197 PolarHBondContact O-N 3.06Å
196D91Very high96.5Very high139 Ų13964.6 Ų64.674%0.74330%0.3SS*.THydrogen-bonded Turntrans67.6-7.6178.2-48.3-45.8000117E194E194-D196 PolarHBondContact O-N 2.88Å
197Q94.4Very high96.4Very high99 Ų9962 Ų6246%0.46330%0.299SS..  trans-77.4162.1172.3-63.6-55.8-3600112.2R193 E194 K195R193-Q197 VanDerWaalsContact CD-O 3.23Å; R193-Q197 WeakPolarHBondContact CD-O 3.39Å; R193-Q197 HydrophobicContact CG-CB 4.05Å; R193-Q197 VanDerWaalsContact CZ-O 3.3Å; R193-Q197 PolarHBondContact NE-O 3.35Å; R193-Q197 PolarHBondContact NH1-O 2.87Å; E194-Q197 HydrophobicContact CB-CB 4.47Å; E194-Q197 HydrophobicContact CB-CG 3.9Å; E194-Q197 PolarHBondContact O-N 3.46Å; K195-Q197 PolarHBondContact O-N 3.06Å
198R96.1Very high96.4Very high220 Ų22061.4 Ų61.483%0.8330%0.297SS*.SBendtrans-115.55.7174.3-65.6-175.3180-177.50.3113.5
199S97.9Very high96.4Very high28 Ų2861.5 Ų61.520%0.19630%0.298CS..EExtended strand (participates in β ladder)trans-151.4156.3-173.153.20000110.6I235S199-I235 CarbonylContact C-O 3.58Å; S199-I235 VanDerWaalsContact CA-O 3.24Å; S199-I235 WeakPolarHBondContact CA-O 3.36Å; S199-I235 VanDerWaalsContact CB-O 3.28Å; S199-I235 WeakPolarHBondContact CB-O 3.49Å
200L97.8Very high96.3Very high3 Ų362.6 Ų62.62%0.01631%0.309CS..EExtended strand (participates in β ladder)trans-86.6145.7167.1-62.5177.7000109.4F189 A192 R193 A205 V234 I235 W240F189-L200 HydrophobicContact CD2-CD1 3.73Å; F189-L200 HydrophobicContact CD2-CG 3.83Å; F189-L200 HydrophobicContact CE2-CD1 4.19Å; F189-L200 HydrophobicContact CE2-CG 3.83Å; F189-L200 HydrophobicContact CG-CD1 4.5Å; A192-L200 VanDerWaalsContact C-CD2 3.45Å; A192-L200 HydrophobicContact CB-CD2 3.83Å; R193-L200 VanDerWaalsContact CA-CD2 3.45Å; R193-L200 HydrophobicContact CB-CD2 3.67Å; R193-L200 HydrophobicContact CG-CD2 4.45Å; L200-A205 HydrophobicContact CB-CB 4Å; L200-A205 HydrophobicContact CD1-CB 4.22Å; L200-V234 CarbonylContact O-C 3.4Å; L200-V234 WeakPolarHBondContact O-CA 3.43Å; L200-V234 WeakPolarHBondContact O-CB 3.28Å; L200-I235 PolarHBondContact N-O 3.32Å; L200-I235 PolarHBondContact O-N 2.9Å; L200-W240 HydrophobicContact CD1-CE3 3.92Å; L200-W240 HydrophobicContact CD1-CZ3 3.87Å
201D97.6Very high96.3Very high67 Ų6762 Ų6236%0.35831%0.306SS..EExtended strand (participates in β ladder)trans-64.1154.3163.473.591.9000110.4N203 T204 A205D201-N203 VanDerWaalsContact C-N 3.29Å; D201-N203 PolarHBondContact O-N 3Å; D201-N203 WeakPolarHBondContact OD1-CB 3.37Å; D201-N203 PolarHBondContact OD1-N 3.08Å; D201-T204 VanDerWaalsContact CG-OG1 3.3Å; D201-T204 PolarHBondContact O-N 3.29Å; D201-T204 PolarHBondContact OD1-N 2.62Å; D201-T204 PolarHBondContact OD1-OG1 2.91Å; D201-T204 WeakPolarHBondContact OD2-CB 3.46Å; D201-T204 PolarHBondContact OD2-OG1 3.2Å; D201-A205 WeakPolarHBondContact O-CB 3.21Å; D201-A205 PolarHBondContact O-N 2.78Å
202L97.6Very high96.3Very high19 Ų1961.6 Ų61.610%0.09930%0.304CS..Hα-helixtrans-61.7-36.3-173.1-173.767.7000112.7A205 K206 L227 Y232 K233 I235L202-A205 PolarHBondContact O-N 3.15Å; L202-K206 HydrophobicContact CD1-CG 4.43Å; L202-K206 HydrophobicContact CG-CD 4.39Å; L202-K206 HydrophobicContact CG-CG 4.34Å; L202-K206 WeakPolarHBondContact O-CB 3.29Å; L202-K206 VanDerWaalsContact O-CG 3.27Å; L202-K206 WeakPolarHBondContact O-CG 3.37Å; L202-K206 PolarHBondContact O-N 3.08Å; L202-L227 HydrophobicContact CD1-CB 4.24Å; L202-L227 HydrophobicContact CD1-CD2 4.24Å; L202-L227 WeakPolarHBondContact CD2-O 3.24Å; L202-Y232 WeakPolarHBondContact CD2-O 3.18Å; L202-K233 WeakPolarHBondContact CB-O 3.42Å; L202-K233 PolarHBondContact N-O 3.13Å; L202-I235 HydrophobicContact CD1-CD1 4.06Å; L202-I235 HydrophobicContact CD1-CG1 4.1Å
203N96.8Very high96.3Very high104 Ų10461.2 Ų61.256%0.55630%0.301SS*.Hα-helixtrans-68.8-47.9-177.5-71.3-29000110.5D201 A205 K206 C207D201-N203 VanDerWaalsContact C-N 3.29Å; D201-N203 PolarHBondContact O-N 3Å; D201-N203 WeakPolarHBondContact OD1-CB 3.37Å; D201-N203 PolarHBondContact OD1-N 3.08Å; N203-A205 VanDerWaalsContact C-N 3.32Å; N203-A205 PolarHBondContact O-N 2.91Å; N203-K206 PolarHBondContact O-N 3.2Å; N203-C207 PolarHBondContact O-N 3.28Å; N203-C207 PolarHBondContact O-SG 3Å
204T96.8Very high96.4Very high33 Ų3359.6 Ų59.620%0.20231%0.305CS..Hα-helixtrans-59.6-43.5174.6-58.70000111.6M141 A192 D201 C207 M208M141-T204 HydrophobicContact CE-CG2 3.95Å; A192-T204 HydrophobicContact CB-CG2 3.96Å; D201-T204 VanDerWaalsContact CG-OG1 3.3Å; D201-T204 PolarHBondContact O-N 3.29Å; D201-T204 PolarHBondContact OD1-N 2.62Å; D201-T204 PolarHBondContact OD1-OG1 2.91Å; D201-T204 WeakPolarHBondContact OD2-CB 3.46Å; D201-T204 PolarHBondContact OD2-OG1 3.2Å; T204-C207 PolarHBondContact O-N 3Å; T204-M208 PolarHBondContact O-N 3.28Å
205A98.3Very high96.4Very high0 Ų062.7 Ų62.70%032%0.316CS..Hα-helixtrans-61.1-47.3177.800000112L200 D201 L202 N203 C207 M208 L209 I235 W240L200-A205 HydrophobicContact CB-CB 4Å; L200-A205 HydrophobicContact CD1-CB 4.22Å; D201-A205 WeakPolarHBondContact O-CB 3.21Å; D201-A205 PolarHBondContact O-N 2.78Å; L202-A205 PolarHBondContact O-N 3.15Å; N203-A205 VanDerWaalsContact C-N 3.32Å; N203-A205 PolarHBondContact O-N 2.91Å; A205-C207 PolarHBondContact O-N 2.88Å; A205-M208 PolarHBondContact O-N 3.07Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 VanDerWaalsContact O-CG 3.25Å; A205-L209 WeakPolarHBondContact O-CG 2.95Å; A205-L209 PolarHBondContact O-N 3.09Å; A205-I235 HydrophobicContact CB-CB 3.93Å; A205-I235 HydrophobicContact CB-CG1 3.62Å; A205-W240 HydrophobicContact CB-CZ3 4.36Å
206K97.9Very high96.7Very high28 Ų2858.9 Ų58.912%0.12231%0.308CS..Hα-helixtrans-59.2-46.2176.5-75.9-172.6-44.8163.20111.8L202 N203 L209 G210 N224 L227 E228L202-K206 HydrophobicContact CD1-CG 4.43Å; L202-K206 HydrophobicContact CG-CD 4.39Å; L202-K206 HydrophobicContact CG-CG 4.34Å; L202-K206 WeakPolarHBondContact O-CB 3.29Å; L202-K206 VanDerWaalsContact O-CG 3.27Å; L202-K206 WeakPolarHBondContact O-CG 3.37Å; L202-K206 PolarHBondContact O-N 3.08Å; N203-K206 PolarHBondContact O-N 3.2Å; K206-L209 PolarHBondContact O-N 3.44Å; K206-G210 PolarHBondContact O-N 2.86Å; K206-N224 WeakPolarHBondContact CD-OD1 3.37Å; K206-N224 WeakPolarHBondContact CG-OD1 3.39Å; K206-L227 HydrophobicContact CD-CB 4.15Å; K206-L227 HydrophobicContact CG-CB 4.2Å; K206-L227 HydrophobicContact CG-CD1 3.97Å; K206-E228 HydrophobicContact CD-CG 3.91Å; K206-E228 IonicContact NZ-OE1 3.03Å; K206-E228 PolarHBondContact NZ-OE1 2.8Å
207C96.9Very high97Very high60 Ų6052.7 Ų52.741%0.40527%0.274SS..Hα-helixtrans-58.4-51.3177.8-680000110.7N203 T204 A205 L209 G210 L211N203-C207 PolarHBondContact O-N 3.28Å; N203-C207 PolarHBondContact O-SG 3Å; T204-C207 PolarHBondContact O-N 3Å; A205-C207 PolarHBondContact O-N 2.88Å; C207-L209 PolarHBondContact O-N 3.11Å; C207-G210 WeakPolarHBondContact O-CA 3.46Å; C207-G210 PolarHBondContact O-N 2.88Å; C207-G210 VanDerWaalsContact O-N 3.11Å; C207-L211 WeakPolarHBondContact O-CG 3.25Å; C207-L211 PolarHBondContact O-N 3.46Å
208M98.2Very high97.1Very high17 Ų1752.2 Ų52.28%0.08428%0.279CS..Hα-helixtrans-64.1-40.7179.7-74.1-56100.800113.5A192 T204 A205 G210 L211 L212 W240A192-M208 HydrophobicContact CB-CG 4.2Å; T204-M208 PolarHBondContact O-N 3.28Å; A205-M208 PolarHBondContact O-N 3.07Å; M208-G210 VanDerWaalsContact C-N 3.27Å; M208-G210 PolarHBondContact O-N 3.08Å; M208-L211 HydrophobicContact CE-CD1 3.4Å; M208-L211 VanDerWaalsContact CE-CD1 3.4Å; M208-L211 HydrophobicContact CE-CG 4.13Å; M208-L211 PolarHBondContact O-N 3.42Å; M208-L211 HydrophobicContact SD-CD1 4.18Å; M208-L212 WeakPolarHBondContact O-CG 3.37Å; M208-L212 PolarHBondContact O-N 3.37Å; M208-L212 VanDerWaalsContact O-N 3.09Å; M208-W240 HydrophobicContact CB-CH2 3.56Å; M208-W240 HydrophobicContact CB-CZ3 4.22Å
209L98.4Very high97.2Very high2 Ų242.2 Ų42.21%0.0124%0.242CC..Hα-helixtrans-62.8-37.4173.6-68.8171.7000111.2Y185 A205 K206 C207 L212 L213 F220 F223 L227 W240 V243Y185-L209 HydrophobicContact CE2-CD2 3.98Å; Y185-L209 VanDerWaalsContact OH-CD2 3.26Å; Y185-L209 WeakPolarHBondContact OH-CD2 3.24Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 VanDerWaalsContact O-CG 3.25Å; A205-L209 WeakPolarHBondContact O-CG 2.95Å; A205-L209 PolarHBondContact O-N 3.09Å; K206-L209 PolarHBondContact O-N 3.44Å; C207-L209 PolarHBondContact O-N 3.11Å; L209-L212 PolarHBondContact O-N 3.48Å; L209-L213 HydrophobicContact CD2-CD1 4.11Å; L209-L213 WeakPolarHBondContact O-CA 3.2Å; L209-L213 WeakPolarHBondContact O-CB 3.42Å; L209-L213 PolarHBondContact O-N 3.31Å; L209-F220 HydrophobicContact CB-CE2 3.6Å; L209-F220 HydrophobicContact CB-CZ 4.28Å; L209-F223 HydrophobicContact CD1-CE1 4.1Å; L209-L227 HydrophobicContact CD1-CD1 4.26Å; L209-W240 HydrophobicContact CD1-CZ3 4.28Å; L209-W240 HydrophobicContact CD2-CD2 4.4Å; L209-W240 HydrophobicContact CD2-CE3 3.96Å; L209-W240 HydrophobicContact CD2-CH2 3.65Å; L209-W240 HydrophobicContact CD2-CZ2 4.15Å; L209-W240 HydrophobicContact CD2-CZ3 3.58Å; L209-W240 HydrophobicContact CG-CE3 4.17Å; L209-W240 HydrophobicContact CG-CH2 3.81Å; L209-W240 HydrophobicContact CG-CZ3 3.5Å; L209-W240 VanDerWaalsContact CG-CZ3 3.5Å; L209-V243 HydrophobicContact CD2-CG1 4.01Å
210G97.9Very high97.2Very high25 Ų2541.8 Ų41.826%0.25824%0.237SC..Hα-helixtrans-61.9-41.8174.800000113K206 C207 M208 L212 G214 F220K206-G210 PolarHBondContact O-N 2.86Å; C207-G210 WeakPolarHBondContact O-CA 3.46Å; C207-G210 PolarHBondContact O-N 2.88Å; C207-G210 VanDerWaalsContact O-N 3.11Å; M208-G210 VanDerWaalsContact C-N 3.27Å; M208-G210 PolarHBondContact O-N 3.08Å; G210-L212 VanDerWaalsContact C-N 3.35Å; G210-L212 PolarHBondContact O-N 2.98Å; G210-G214 VanDerWaalsContact O-CA 3.29Å; G210-G214 WeakPolarHBondContact O-CA 3.31Å; G210-G214 PolarHBondContact O-N 2.99Å; G210-F220 VanDerWaalsContact CA-CE1 3.49Å; G210-F220 VanDerWaalsContact N-CZ 3.28Å
211L96.5Very high97.2Very high49 Ų4945.5 Ų45.526%0.25726%0.261SS..Hα-helixtrans-63.8-41.3175.8-60.4-166.6000112.4E125 V127 C207 M208E125-L211 WeakPolarHBondContact O-CD1 3.4Å; E125-L211 WeakPolarHBondContact O-CD2 3.43Å; V127-L211 HydrophobicContact CB-CB 4.27Å; V127-L211 HydrophobicContact CG2-CB 4.3Å; V127-L211 WeakPolarHBondContact CG2-O 3.36Å; C207-L211 WeakPolarHBondContact O-CG 3.25Å; C207-L211 PolarHBondContact O-N 3.46Å; M208-L211 HydrophobicContact CE-CD1 3.4Å; M208-L211 VanDerWaalsContact CE-CD1 3.4Å; M208-L211 HydrophobicContact CE-CG 4.13Å; M208-L211 PolarHBondContact O-N 3.42Å; M208-L211 HydrophobicContact SD-CD1 4.18Å
212L98Very high97.2Very high6 Ų644.2 Ų44.23%0.03126%0.256CS..Hα-helixtrans-84.7-41.1-172.7-73.5163000113.4L130 F181 I184 Y185 A188 M208 L209 G210 W240L130-L212 HydrophobicContact CD2-CD1 4.04Å; L130-L212 HydrophobicContact CD2-CD2 3.73Å; L130-L212 HydrophobicContact CD2-CG 3.92Å; F181-L212 HydrophobicContact CE2-CD2 4.38Å; F181-L212 WeakPolarHBondContact CE2-O 3.4Å; F181-L212 HydrophobicContact CZ-CB 4.31Å; F181-L212 HydrophobicContact CZ-CD2 4.42Å; F181-L212 WeakPolarHBondContact CZ-O 3.46Å; I184-L212 HydrophobicContact CG2-CD2 4.33Å; Y185-L212 HydrophobicContact CD2-CB 4.16Å; Y185-L212 HydrophobicContact CD2-CD1 3.76Å; Y185-L212 HydrophobicContact CD2-CG 4.42Å; Y185-L212 HydrophobicContact CE2-CD1 4.26Å; Y185-L212 HydrophobicContact CG-CD1 4.42Å; A188-L212 HydrophobicContact CB-CD1 3.86Å; M208-L212 WeakPolarHBondContact O-CG 3.37Å; M208-L212 PolarHBondContact O-N 3.37Å; M208-L212 VanDerWaalsContact O-N 3.09Å; L209-L212 PolarHBondContact O-N 3.48Å; G210-L212 VanDerWaalsContact C-N 3.35Å; G210-L212 PolarHBondContact O-N 2.98Å; L212-W240 HydrophobicContact CD1-CH2 4.31Å; L212-W240 HydrophobicContact CD1-CZ2 3.84Å
213L97.8Very high97.2Very high3 Ų343.4 Ų43.42%0.01625%0.251CS..Hα-helixtrans-115.3-15.4-169.4-58.8-179.8000113.4F181 Y185 L209 K215 T216 W217 F220 V243 L244F181-L213 HydrophobicContact CE1-CD2 4.2Å; F181-L213 HydrophobicContact CZ-CD2 3.9Å; Y185-L213 HydrophobicContact CE2-CD1 3.96Å; Y185-L213 HydrophobicContact CE2-CD2 4.31Å; Y185-L213 HydrophobicContact CE2-CG 4.12Å; L209-L213 HydrophobicContact CD2-CD1 4.11Å; L209-L213 WeakPolarHBondContact O-CA 3.2Å; L209-L213 WeakPolarHBondContact O-CB 3.42Å; L209-L213 PolarHBondContact O-N 3.31Å; L213-K215 PolarHBondContact O-N 3.36Å; L213-K215 VanDerWaalsContact O-N 3.08Å; L213-T216 PolarHBondContact O-N 2.54Å; L213-T216 VanDerWaalsContact O-N 3.07Å; L213-W217 HydrophobicContact CB-CB 4.11Å; L213-W217 HydrophobicContact CB-CE3 4.3Å; L213-W217 HydrophobicContact CD1-CE3 3.95Å; L213-W217 HydrophobicContact CD1-CZ3 4.44Å; L213-W217 PolarHBondContact O-N 3.45Å; L213-F220 HydrophobicContact CB-CD2 4.1Å; L213-F220 HydrophobicContact CB-CG 4.46Å; L213-V243 HydrophobicContact CD1-CG1 3.9Å; L213-L244 HydrophobicContact CD2-CD1 4.17Å
214G96.4Very high97.3Very high31 Ų3140 Ų4032%0.3223%0.234SC..THydrogen-bonded Turntrans-61.6-25.4-170.500000115.3G210G210-G214 VanDerWaalsContact O-CA 3.29Å; G210-G214 WeakPolarHBondContact O-CA 3.31Å; G210-G214 PolarHBondContact O-N 2.99Å
215K93.8Very high97.3Very high207 Ų20742 Ų4290%0.924%0.24SC*.THydrogen-bonded Turntrans-96.4-24175.7-64.6-176.4-178.9177.90113.8L213L213-K215 PolarHBondContact O-N 3.36Å; L213-K215 VanDerWaalsContact O-N 3.08Å
216T93.9Very high97.3Very high97 Ų9742.4 Ų42.460%0.59524%0.242SC*.THydrogen-bonded Turntrans-106.4-23.8-167.854.80000113.5L213 P218L213-T216 PolarHBondContact O-N 2.54Å; L213-T216 VanDerWaalsContact O-N 3.07Å; T216-P218 WeakPolarHBondContact O-CD 3.36Å
217W97.4Very high97.3Very high9 Ų941 Ų413%0.03424%0.236CC..  trans-108.3108-179.2-178.137.6000110.3L213 L219 F220 F223 V243 F246L213-W217 HydrophobicContact CB-CB 4.11Å; L213-W217 HydrophobicContact CB-CE3 4.3Å; L213-W217 HydrophobicContact CD1-CE3 3.95Å; L213-W217 HydrophobicContact CD1-CZ3 4.44Å; L213-W217 PolarHBondContact O-N 3.45Å; W217-L219 HydrophobicContact CD2-CB 4.4Å; W217-L219 HydrophobicContact CZ2-CB 3.81Å; W217-L219 PolarHBondContact O-N 2.85Å; W217-L219 VanDerWaalsContact O-N 3.15Å; W217-F220 HydrophobicContact CB-CB 4.21Å; W217-F220 HydrophobicContact CD2-CB 4.2Å; W217-F220 HydrophobicContact CE3-CB 3.68Å; W217-F220 AromaticContact CE3-CD2 3.98Å; W217-F220 HydrophobicContact CE3-CD2 3.98Å; W217-F220 HydrophobicContact CE3-CG 4.35Å; W217-F220 HydrophobicContact CG-CB 4.46Å; W217-F220 HydrophobicContact CZ3-CB 4.42Å; W217-F220 HydrophobicContact CZ3-CD2 4.21Å; W217-F220 WeakPolarHBondContact O-CB 3.1Å; W217-F220 PolarHBondContact O-N 2.77Å; W217-F223 HydrophobicContact CH2-CB 3.61Å; W217-F223 AromaticContact CH2-CD1 3.81Å; W217-F223 HydrophobicContact CH2-CD1 3.81Å; W217-F223 AromaticContact CH2-CD2 3.93Å; W217-F223 HydrophobicContact CH2-CD2 3.93Å; W217-F223 HydrophobicContact CH2-CE1 4.43Å; W217-F223 AromaticContact CH2-CG 3.5Å; W217-F223 HydrophobicContact CH2-CG 3.5Å; W217-F223 VanDerWaalsContact CH2-CG 3.5Å; W217-F223 HydrophobicContact CZ3-CB 3.75Å; W217-F223 AromaticContact CZ3-CD1 3.51Å; W217-F223 HydrophobicContact CZ3-CD1 3.51Å; W217-F223 HydrophobicContact CZ3-CD2 4.48Å; W217-F223 HydrophobicContact CZ3-CE1 4.2Å; W217-F223 AromaticContact CZ3-CG 3.66Å; W217-F223 HydrophobicContact CZ3-CG 3.66Å; W217-V243 HydrophobicContact CZ3-CG1 4.15Å; W217-F246 HydrophobicContact CH2-CD1 4.47Å; W217-F246 AromaticContact CZ2-CD1 3.84Å; W217-F246 HydrophobicContact CZ2-CD1 3.84Å; W217-F246 HydrophobicContact CZ2-CE1 4.06Å
218P97.6Very high97.3Very high89 Ų8943.4 Ų43.458%0.57824%0.241SC*.THydrogen-bonded Turntrans-60.9-25.8-175.6-26.635.3000114.9T216 F220 P221 L252T216-P218 WeakPolarHBondContact O-CD 3.36Å; P218-F220 VanDerWaalsContact C-N 3.34Å; P218-P221 WeakPolarHBondContact O-CD 3.22Å; P218-L252 HydrophobicContact CB-CD1 4.21Å; P218-L252 HydrophobicContact CB-CD2 4.02Å; P218-L252 HydrophobicContact CG-CD1 4.06Å; P218-L252 HydrophobicContact CG-CD2 3.98Å
219L97.4Very high97.2Very high10 Ų1047.5 Ų47.55%0.05226%0.26CS..THydrogen-bonded Turntrans-84.8-4.2175.4-66175000113.2W217 V222 F223 L252 L254 Y274W217-L219 HydrophobicContact CD2-CB 4.4Å; W217-L219 HydrophobicContact CZ2-CB 3.81Å; W217-L219 PolarHBondContact O-N 2.85Å; W217-L219 VanDerWaalsContact O-N 3.15Å; L219-V222 HydrophobicContact CB-CG2 4.08Å; L219-V222 HydrophobicContact CD2-CG2 3.87Å; L219-V222 WeakPolarHBondContact O-CG2 3.39Å; L219-V222 PolarHBondContact O-N 3.31Å; L219-F223 WeakPolarHBondContact O-CB 3.03Å; L219-F223 PolarHBondContact O-N 2.94Å; L219-L252 HydrophobicContact CD1-CD2 4.46Å; L219-L252 HydrophobicContact CG-CD2 4.19Å; L219-L254 HydrophobicContact CD1-CD2 3.75Å; L219-Y274 HydrophobicContact CD2-CE2 4.29Å
220F98.3Very high97Very high18 Ų1848.4 Ų48.48%0.07927%0.267CS..Hα-helixtrans-56-44.1179.8178.9-97.6000113.6L209 G210 L213 W217 P218 V222 F223 N224L209-F220 HydrophobicContact CB-CE2 3.6Å; L209-F220 HydrophobicContact CB-CZ 4.28Å; G210-F220 VanDerWaalsContact CA-CE1 3.49Å; G210-F220 VanDerWaalsContact N-CZ 3.28Å; L213-F220 HydrophobicContact CB-CD2 4.1Å; L213-F220 HydrophobicContact CB-CG 4.46Å; W217-F220 HydrophobicContact CB-CB 4.21Å; W217-F220 HydrophobicContact CD2-CB 4.2Å; W217-F220 HydrophobicContact CE3-CB 3.68Å; W217-F220 AromaticContact CE3-CD2 3.98Å; W217-F220 HydrophobicContact CE3-CD2 3.98Å; W217-F220 HydrophobicContact CE3-CG 4.35Å; W217-F220 HydrophobicContact CG-CB 4.46Å; W217-F220 HydrophobicContact CZ3-CB 4.42Å; W217-F220 HydrophobicContact CZ3-CD2 4.21Å; W217-F220 WeakPolarHBondContact O-CB 3.1Å; W217-F220 PolarHBondContact O-N 2.77Å; P218-F220 VanDerWaalsContact C-N 3.34Å; F220-V222 VanDerWaalsContact C-N 3.33Å; F220-V222 PolarHBondContact O-N 3.43Å; F220-F223 PolarHBondContact O-N 3.46Å; F220-N224 HydrophobicContact CE1-CB 4.09Å; F220-N224 HydrophobicContact CE2-CB 4.37Å; F220-N224 HydrophobicContact CZ-CB 3.93Å; F220-N224 WeakPolarHBondContact O-CB 3.2Å; F220-N224 PolarHBondContact O-N 3.4Å
221P97.9Very high97Very high81 Ų8154.2 Ų54.253%0.52629%0.285SS..Hα-helixtrans-59.3-42-179.7-25.536000113.2P218 Q225P218-P221 WeakPolarHBondContact O-CD 3.22Å; P221-Q225 PolarHBondContact O-N 2.91Å; P221-Q225 VanDerWaalsContact O-N 3.09Å
222V97.6Very high97Very high41 Ų4153.4 Ų53.425%0.24828%0.279CS..Hα-helixtrans-74.8-34.2178.4-66.20000111.8L219 F220 Q225 F226 F270 Y274L219-V222 HydrophobicContact CB-CG2 4.08Å; L219-V222 HydrophobicContact CD2-CG2 3.87Å; L219-V222 WeakPolarHBondContact O-CG2 3.39Å; L219-V222 PolarHBondContact O-N 3.31Å; F220-V222 VanDerWaalsContact C-N 3.33Å; F220-V222 PolarHBondContact O-N 3.43Å; V222-Q225 PolarHBondContact O-N 3.04Å; V222-F226 PolarHBondContact O-N 2.9Å; V222-F270 HydrophobicContact CG2-CE2 4.36Å; V222-F270 HydrophobicContact CG2-CZ 4.23Å; V222-Y274 HydrophobicContact CB-CD2 4.27Å; V222-Y274 HydrophobicContact CB-CE2 4.18Å; V222-Y274 HydrophobicContact CG1-CE2 4.23Å; V222-Y274 HydrophobicContact CG2-CD2 4.04Å; V222-Y274 HydrophobicContact CG2-CE2 3.81Å
223F98.4Very high97Very high1 Ų160.5 Ų60.50%0.00431%0.309CS..Hα-helixtrans-64.7-42.9172.5-177.3-109.3000111.9L209 W217 L219 F220 Q225 F226 L227 V243 L266 L267 F270L209-F223 HydrophobicContact CD1-CE1 4.1Å; W217-F223 HydrophobicContact CH2-CB 3.61Å; W217-F223 AromaticContact CH2-CD1 3.81Å; W217-F223 HydrophobicContact CH2-CD1 3.81Å; W217-F223 AromaticContact CH2-CD2 3.93Å; W217-F223 HydrophobicContact CH2-CD2 3.93Å; W217-F223 HydrophobicContact CH2-CE1 4.43Å; W217-F223 AromaticContact CH2-CG 3.5Å; W217-F223 HydrophobicContact CH2-CG 3.5Å; W217-F223 VanDerWaalsContact CH2-CG 3.5Å; W217-F223 HydrophobicContact CZ3-CB 3.75Å; W217-F223 AromaticContact CZ3-CD1 3.51Å; W217-F223 HydrophobicContact CZ3-CD1 3.51Å; W217-F223 HydrophobicContact CZ3-CD2 4.48Å; W217-F223 HydrophobicContact CZ3-CE1 4.2Å; W217-F223 AromaticContact CZ3-CG 3.66Å; W217-F223 HydrophobicContact CZ3-CG 3.66Å; L219-F223 WeakPolarHBondContact O-CB 3.03Å; L219-F223 PolarHBondContact O-N 2.94Å; F220-F223 PolarHBondContact O-N 3.46Å; F223-Q225 VanDerWaalsContact C-N 3.32Å; F223-Q225 PolarHBondContact O-N 2.61Å; F223-F226 HydrophobicContact CD2-CD1 4.22Å; F223-F226 HydrophobicContact CE2-CD1 4.18Å; F223-F226 HydrophobicContact CE2-CE1 4.45Å; F223-F226 WeakPolarHBondContact O-CB 3.38Å; F223-F226 PolarHBondContact O-N 3.31Å; F223-L227 HydrophobicContact CD1-CD1 4.02Å; F223-L227 HydrophobicContact CD1-CG 4.38Å; F223-L227 HydrophobicContact CE1-CD1 3.6Å; F223-L227 HydrophobicContact CE1-CD2 4.44Å; F223-L227 HydrophobicContact CE1-CG 4.08Å; F223-L227 HydrophobicContact CZ-CD1 4.11Å; F223-L227 HydrophobicContact CZ-CD2 4.11Å; F223-L227 HydrophobicContact CZ-CG 4.19Å; F223-L227 WeakPolarHBondContact O-CG 3.04Å; F223-L227 PolarHBondContact O-N 2.95Å; F223-V243 HydrophobicContact CE1-CG1 3.99Å; F223-V243 HydrophobicContact CE1-CG2 4.02Å; F223-V243 HydrophobicContact CZ-CG1 4.36Å; F223-V243 HydrophobicContact CZ-CG2 3.66Å; F223-L266 HydrophobicContact CE2-CD2 3.81Å; F223-L266 HydrophobicContact CZ-CD2 3.71Å; F223-L267 HydrophobicContact CE2-CD2 3.96Å; F223-L267 HydrophobicContact CZ-CD2 4.32Å; F223-F270 HydrophobicContact CB-CE2 3.97Å; F223-F270 HydrophobicContact CB-CZ 4.02Å; F223-F270 HydrophobicContact CD2-CB 4.26Å; F223-F270 AromaticContact CD2-CD1 3.84Å; F223-F270 HydrophobicContact CD2-CD1 3.84Å; F223-F270 AromaticContact CD2-CD2 3.71Å; F223-F270 HydrophobicContact CD2-CD2 3.71Å; F223-F270 HydrophobicContact CD2-CE1 4.08Å; F223-F270 AromaticContact CD2-CE2 3.96Å; F223-F270 HydrophobicContact CD2-CE2 3.96Å; F223-F270 AromaticContact CD2-CG 3.64Å; F223-F270 HydrophobicContact CD2-CG 3.64Å; F223-F270 HydrophobicContact CD2-CZ 4.14Å; F223-F270 HydrophobicContact CE2-CB 4.26Å; F223-F270 HydrophobicContact CE2-CD1 4.35Å; F223-F270 HydrophobicContact CE2-CG 4.11Å; F223-F270 HydrophobicContact CG-CE2 4.49Å
224N97.9Very high97Very high34 Ų3463.5 Ų63.518%0.18233%0.328CS..Hα-helixtrans-62.5-40.4175.3-175.672.4000111.6K206 F220 L227 E228K206-N224 WeakPolarHBondContact CD-OD1 3.37Å; K206-N224 WeakPolarHBondContact CG-OD1 3.39Å; F220-N224 HydrophobicContact CE1-CB 4.09Å; F220-N224 HydrophobicContact CE2-CB 4.37Å; F220-N224 HydrophobicContact CZ-CB 3.93Å; F220-N224 WeakPolarHBondContact O-CB 3.2Å; F220-N224 PolarHBondContact O-N 3.4Å; N224-L227 PolarHBondContact O-N 3.27Å; N224-E228 PolarHBondContact ND2-OE1 2.82Å; N224-E228 VanDerWaalsContact ND2-OE1 3.13Å; N224-E228 WeakPolarHBondContact O-CG 3.38Å; N224-E228 PolarHBondContact O-N 3.42Å
225Q97.8Very high97.1Very high73 Ų7362.2 Ų62.234%0.34131%0.313SS..Hα-helixtrans-63.7-41.1174.2-172.6-174.321.900112.1P221 V222 F223 E228 Q229 W273 R277P221-Q225 PolarHBondContact O-N 2.91Å; P221-Q225 VanDerWaalsContact O-N 3.09Å; V222-Q225 PolarHBondContact O-N 3.04Å; F223-Q225 VanDerWaalsContact C-N 3.32Å; F223-Q225 PolarHBondContact O-N 2.61Å; Q225-E228 WeakPolarHBondContact O-CB 3.37Å; Q225-E228 PolarHBondContact O-N 3.13Å; Q225-Q229 WeakPolarHBondContact O-CG 3.41Å; Q225-Q229 PolarHBondContact O-N 3.23Å; Q225-W273 HydrophobicContact CB-CH2 4.16Å; Q225-W273 HydrophobicContact CG-CH2 4.11Å; Q225-W273 HydrophobicContact CG-CZ2 4.29Å; Q225-R277 VanDerWaalsContact CD-NH1 3.28Å
226F98.2Very high97.4Very high9 Ų955.2 Ų55.24%0.03929%0.286CS..Hα-helixtrans-57.8-51172.7159.9-102.2000110.7V222 F223 E228 Q229 S230 Y232 L266 E269 F270 W273V222-F226 PolarHBondContact O-N 2.9Å; F223-F226 HydrophobicContact CD2-CD1 4.22Å; F223-F226 HydrophobicContact CE2-CD1 4.18Å; F223-F226 HydrophobicContact CE2-CE1 4.45Å; F223-F226 WeakPolarHBondContact O-CB 3.38Å; F223-F226 PolarHBondContact O-N 3.31Å; F226-E228 VanDerWaalsContact C-N 3.26Å; F226-E228 PolarHBondContact O-N 3.34Å; F226-Q229 CarbonylContact O-C 3.58Å; F226-Q229 PolarHBondContact O-N 2.78Å; F226-S230 VanDerWaalsContact O-CB 3.29Å; F226-S230 WeakPolarHBondContact O-CB 3.41Å; F226-S230 PolarHBondContact O-N 3.16Å; F226-Y232 HydrophobicContact CZ-CE2 4.18Å; F226-L266 HydrophobicContact CE1-CD2 4.35Å; F226-L266 HydrophobicContact CE1-CG 4.3Å; F226-L266 WeakPolarHBondContact CZ-O 3.23Å; F226-E269 HydrophobicContact CE2-CB 4.17Å; F226-E269 HydrophobicContact CZ-CB 3.93Å; F226-F270 HydrophobicContact CB-CD2 3.76Å; F226-F270 HydrophobicContact CB-CE2 4.33Å; F226-F270 HydrophobicContact CD1-CB 3.81Å; F226-F270 AromaticContact CD1-CD2 3.94Å; F226-F270 HydrophobicContact CD1-CD2 3.94Å; F226-F270 HydrophobicContact CD1-CG 4.26Å; F226-F270 HydrophobicContact CD2-CB 4.44Å; F226-F270 HydrophobicContact CD2-CD2 4.46Å; F226-F270 HydrophobicContact CE1-CB 3.73Å; F226-F270 HydrophobicContact CE2-CB 4.36Å; F226-F270 HydrophobicContact CG-CB 4.17Å; F226-F270 AromaticContact CG-CD2 3.8Å; F226-F270 HydrophobicContact CG-CD2 3.8Å; F226-F270 HydrophobicContact CG-CG 4.46Å; F226-F270 HydrophobicContact CZ-CB 4.01Å; F226-W273 HydrophobicContact CB-CD2 4.08Å; F226-W273 HydrophobicContact CB-CE3 3.83Å; F226-W273 HydrophobicContact CB-CH2 3.98Å; F226-W273 HydrophobicContact CB-CZ2 4.17Å; F226-W273 HydrophobicContact CB-CZ3 3.82Å; F226-W273 HydrophobicContact CD2-CB 3.94Å; F226-W273 AromaticContact CD2-CD2 3.92Å; F226-W273 HydrophobicContact CD2-CD2 3.92Å; F226-W273 HydrophobicContact CD2-CE3 4.3Å; F226-W273 AromaticContact CD2-CG 3.78Å; F226-W273 HydrophobicContact CD2-CG 3.78Å; F226-W273 HydrophobicContact CE2-CB 4.24Å; F226-W273 HydrophobicContact CE2-CG 4.46Å; F226-W273 HydrophobicContact CG-CD2 4.47Å; F226-W273 HydrophobicContact CG-CE3 4.48Å
227L97.9Very high97.6Very high0 Ų054.6 Ų54.60%028%0.275CS..Hα-helixtrans-55.7-42.2178.8-70.8-179000111.8L202 K206 L209 F223 N224 Q229 S230 I235 L266L202-L227 HydrophobicContact CD1-CB 4.24Å; L202-L227 HydrophobicContact CD1-CD2 4.24Å; L202-L227 WeakPolarHBondContact CD2-O 3.24Å; K206-L227 HydrophobicContact CD-CB 4.15Å; K206-L227 HydrophobicContact CG-CB 4.2Å; K206-L227 HydrophobicContact CG-CD1 3.97Å; L209-L227 HydrophobicContact CD1-CD1 4.26Å; F223-L227 HydrophobicContact CD1-CD1 4.02Å; F223-L227 HydrophobicContact CD1-CG 4.38Å; F223-L227 HydrophobicContact CE1-CD1 3.6Å; F223-L227 HydrophobicContact CE1-CD2 4.44Å; F223-L227 HydrophobicContact CE1-CG 4.08Å; F223-L227 HydrophobicContact CZ-CD1 4.11Å; F223-L227 HydrophobicContact CZ-CD2 4.11Å; F223-L227 HydrophobicContact CZ-CG 4.19Å; F223-L227 WeakPolarHBondContact O-CG 3.04Å; F223-L227 PolarHBondContact O-N 2.95Å; N224-L227 PolarHBondContact O-N 3.27Å; L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 2.98Å; L227-S230 PolarHBondContact O-N 3.22Å; L227-S230 PolarHBondContact O-OG 2.92Å; L227-I235 HydrophobicContact CD2-CD1 4.35Å; L227-L266 HydrophobicContact CD2-CD1 4.19Å; L227-L266 HydrophobicContact CD2-CD2 4.41Å
228E95.9Very high97.6Very high110 Ų11058.8 Ų58.851%0.51430%0.298SS..Hα-helixtrans-61.3-34.8177.2-80.9172.6-176.400114.6K206 N224 Q225 F226K206-E228 HydrophobicContact CD-CG 3.91Å; K206-E228 IonicContact NZ-OE1 3.03Å; K206-E228 PolarHBondContact NZ-OE1 2.8Å; N224-E228 PolarHBondContact ND2-OE1 2.82Å; N224-E228 VanDerWaalsContact ND2-OE1 3.13Å; N224-E228 WeakPolarHBondContact O-CG 3.38Å; N224-E228 PolarHBondContact O-N 3.42Å; Q225-E228 WeakPolarHBondContact O-CB 3.37Å; Q225-E228 PolarHBondContact O-N 3.13Å; F226-E228 VanDerWaalsContact C-N 3.26Å; F226-E228 PolarHBondContact O-N 3.34Å
229Q95.6Very high97.7Very high103 Ų10355.8 Ų55.848%0.48128%0.276SS..Hα-helixtrans-95.1-9.4-177.5-62.9176.211.600112.5Q225 F226 L227Q225-Q229 WeakPolarHBondContact O-CG 3.41Å; Q225-Q229 PolarHBondContact O-N 3.23Å; F226-Q229 CarbonylContact O-C 3.58Å; F226-Q229 PolarHBondContact O-N 2.78Å; L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 2.98Å
230S95.6Very high97.7Very high21 Ų2155.4 Ų55.415%0.14727%0.274CS..SBendtrans-74.8167.4-177.278.40000113.1F226 L227 Y232F226-S230 VanDerWaalsContact O-CB 3.29Å; F226-S230 WeakPolarHBondContact O-CB 3.41Å; F226-S230 PolarHBondContact O-N 3.16Å; L227-S230 PolarHBondContact O-N 3.22Å; L227-S230 PolarHBondContact O-OG 2.92Å; S230-Y232 VanDerWaalsContact C-N 3.29Å; S230-Y232 WeakPolarHBondContact OG-CD2 3.42Å; S230-Y232 PolarHBondContact OG-N 3.21Å
231K96.4Very high97.7Very high146 Ų14655.8 Ų55.864%0.63528%0.279SS*.SBendtrans-75.9-13.9171.565.5-169.1173-164.70113.6E269K231-E269 VanDerWaalsContact CE-OE1 3.23Å; K231-E269 WeakPolarHBondContact CE-OE1 3.45Å; K231-E269 IonicContact NZ-OE1 2.65Å; K231-E269 PolarHBondContact NZ-OE1 3.36Å; K231-E269 IonicContact NZ-OE2 3.81Å
232Y97.8Very high97.8Very high33 Ų3353.4 Ų53.413%0.12926%0.262CS..  trans-63.6143.5-174.5-64.4-77.2000111.1L202 F226 S230 L266 E269L202-Y232 WeakPolarHBondContact CD2-O 3.18Å; F226-Y232 HydrophobicContact CZ-CE2 4.18Å; S230-Y232 VanDerWaalsContact C-N 3.29Å; S230-Y232 WeakPolarHBondContact OG-CD2 3.42Å; S230-Y232 PolarHBondContact OG-N 3.21Å; Y232-L266 HydrophobicContact CD1-CD1 4.09Å; Y232-L266 HydrophobicContact CD2-CD1 3.99Å; Y232-L266 HydrophobicContact CD2-CG 4.24Å; Y232-L266 HydrophobicContact CE1-CB 4.21Å; Y232-L266 HydrophobicContact CE1-CD1 4.15Å; Y232-L266 HydrophobicContact CE1-CG 4.48Å; Y232-L266 HydrophobicContact CE2-CB 4.15Å; Y232-L266 HydrophobicContact CE2-CD1 4.09Å; Y232-L266 HydrophobicContact CE2-CG 3.91Å; Y232-L266 HydrophobicContact CG-CD1 4.03Å; Y232-L266 WeakPolarHBondContact OH-CA 3.49Å; Y232-L266 PolarHBondContact OH-N 3.32Å; Y232-E269 WeakPolarHBondContact CE2-OE2 3.47Å; Y232-E269 VanDerWaalsContact OH-CD 3.26Å; Y232-E269 PolarHBondContact OH-OE2 3.44Å
233K97.8Very high97.8Very high154 Ų15451.6 Ų51.667%0.6725%0.251SS*.  trans-120.9-17.2174.8-59.4-60.6169.2-155.20112.8L202L202-K233 WeakPolarHBondContact CB-O 3.42Å; L202-K233 PolarHBondContact N-O 3.13Å
234V98.2Very high97.8Very high67 Ų6751.9 Ų51.941%0.40625%0.252SS..EExtended strand (participates in β ladder)trans-143.6157.1-179.8-60.80000109.7L200L200-V234 CarbonylContact O-C 3.4Å; L200-V234 WeakPolarHBondContact O-CA 3.43Å; L200-V234 WeakPolarHBondContact O-CB 3.28Å
235I98.6Very high97.8Very high4 Ų453.9 Ų53.92%0.02126%0.26CS..EExtended strand (participates in β ladder)trans-118.9122.9171.2-59.2-60.3000108.2S199 L200 L202 A205 L227 Q239 W240 L266S199-I235 CarbonylContact C-O 3.58Å; S199-I235 VanDerWaalsContact CA-O 3.24Å; S199-I235 WeakPolarHBondContact CA-O 3.36Å; S199-I235 VanDerWaalsContact CB-O 3.28Å; S199-I235 WeakPolarHBondContact CB-O 3.49Å; L200-I235 PolarHBondContact N-O 3.32Å; L200-I235 PolarHBondContact O-N 2.9Å; L202-I235 HydrophobicContact CD1-CD1 4.06Å; L202-I235 HydrophobicContact CD1-CG1 4.1Å; A205-I235 HydrophobicContact CB-CB 3.93Å; A205-I235 HydrophobicContact CB-CG1 3.62Å; L227-I235 HydrophobicContact CD2-CD1 4.35Å; I235-Q239 HydrophobicContact CG2-CB 3.96Å; I235-W240 HydrophobicContact CG2-CB 4.14Å; I235-W240 HydrophobicContact CG2-CE3 4.4Å; I235-L266 HydrophobicContact CD1-CD1 3.44Å; I235-L266 VanDerWaalsContact CD1-CD1 3.44Å
236N98.4Very high97.8Very high60 Ų6050.5 Ų50.532%0.32124%0.244SC..EExtended strand (participates in β ladder)trans-85.6172.2176.574.335.8000111.8D238 Q239 W240N236-D238 VanDerWaalsContact C-N 3.31Å; N236-D238 PolarHBondContact O-N 3.05Å; N236-D238 PolarHBondContact OD1-N 3.3Å; N236-Q239 PolarHBondContact O-N 2.9Å; N236-Q239 WeakPolarHBondContact OD1-CG 3.35Å; N236-Q239 PolarHBondContact OD1-N 3.08Å; N236-W240 WeakPolarHBondContact O-CB 3.27Å; N236-W240 PolarHBondContact O-N 3.43Å
237K98.2Very high97.8Very high84 Ų8451.2 Ų51.237%0.36525%0.251SS..Hα-helixtrans-63.2-35.1-175.1-166.2164.2-168.7156.60113.7F189 D190 C241F189-K237 HydrophobicContact CD1-CB 4.14Å; F189-K237 HydrophobicContact CD1-CD 4.05Å; F189-K237 HydrophobicContact CD1-CG 3.88Å; F189-K237 HydrophobicContact CE1-CB 3.58Å; F189-K237 HydrophobicContact CE1-CD 3.98Å; F189-K237 HydrophobicContact CE1-CG 3.82Å; F189-K237 HydrophobicContact CE2-CB 4.29Å; F189-K237 HydrophobicContact CG-CG 4.46Å; F189-K237 VanDerWaalsContact CZ-CA 3.5Å; F189-K237 HydrophobicContact CZ-CB 3.66Å; F189-K237 HydrophobicContact CZ-CG 4.33Å; F189-K237 VanDerWaalsContact CZ-N 3.31Å; D190-K237 IonicContact OD1-NZ 3.41Å; D190-K237 PolarHBondContact OD1-NZ 3.3Å; D190-K237 IonicContact OD2-NZ 3.89Å; D190-K237 PolarHBondContact OD2-NZ 3.12Å; K237-C241 PolarHBondContact O-N 3.15Å; K237-C241 VanDerWaalsContact O-N 3.07Å; K237-C241 PolarHBondContact O-SG 3.47Å
238D98.3Very high97.8Very high96 Ų9656 Ų5651%0.51327%0.269SS..Hα-helixtrans-70.3-49.6-179.8177.970.6000111.1N236 W240 C241 N242N236-D238 VanDerWaalsContact C-N 3.31Å; N236-D238 PolarHBondContact O-N 3.05Å; N236-D238 PolarHBondContact OD1-N 3.3Å; D238-W240 VanDerWaalsContact C-N 3.33Å; D238-W240 PolarHBondContact O-N 3.49Å; D238-C241 PolarHBondContact O-N 2.59Å; D238-N242 WeakPolarHBondContact O-CB 3.43Å; D238-N242 PolarHBondContact O-N 3.49Å; D238-N242 PolarHBondContact O-ND2 3.36Å; D238-N242 PolarHBondContact OD1-ND2 3.49Å; D238-N242 VanDerWaalsContact OD1-ND2 3.17Å; D238-N242 PolarHBondContact OD2-ND2 3.39Å
239Q98.6Very high97.8Very high27 Ų2753.5 Ų53.513%0.12626%0.261CS..Hα-helixtrans-55.2-48.7172.9-69.9166.7-26.400111.1I235 N236 C241 N242 V243 P264I235-Q239 HydrophobicContact CG2-CB 3.96Å; N236-Q239 PolarHBondContact O-N 2.9Å; N236-Q239 WeakPolarHBondContact OD1-CG 3.35Å; N236-Q239 PolarHBondContact OD1-N 3.08Å; Q239-C241 PolarHBondContact O-N 3.34Å; Q239-N242 PolarHBondContact O-N 3.26Å; Q239-V243 WeakPolarHBondContact O-CG2 3.47Å; Q239-V243 PolarHBondContact O-N 3.47Å; Q239-P264 HydrophobicContact CG-CB 4.05Å
240W98.8Very high97.9Very high1 Ų149.4 Ų49.40%0.00424%0.242CC..Hα-helixtrans-54.6-49.5177.3179.8-90.3000112.1Y185 A188 F189 L200 A205 M208 L209 L212 I235 N236 D238 V243Y185-W240 AromaticContact CD1-CD1 3.98Å; Y185-W240 AromaticContact CD1-NE1 3.42Å; Y185-W240 AromaticContact CE1-CD1 3.37Å; Y185-W240 HydrophobicContact CE1-CD2 4.35Å; Y185-W240 AromaticContact CE1-CE2 3.73Å; Y185-W240 HydrophobicContact CE1-CG 4.13Å; Y185-W240 HydrophobicContact CE1-CZ2 4.39Å; Y185-W240 AromaticContact CE1-NE1 3.09Å; Y185-W240 WeakPolarHBondContact CE1-O 3.39Å; Y185-W240 HydrophobicContact CE2-CZ2 4.16Å; Y185-W240 AromaticContact CZ-CE2 3.73Å; Y185-W240 AromaticContact CZ-NE1 3.61Å; Y185-W240 PolarHBondContact O-NE1 3.13Å; Y185-W240 PolarHBondContact OH-O 2.91Å; A188-W240 HydrophobicContact CB-CZ2 4.16Å; F189-W240 HydrophobicContact CB-CD2 4.18Å; F189-W240 HydrophobicContact CB-CG 4.01Å; F189-W240 HydrophobicContact CD2-CB 3.71Å; F189-W240 AromaticContact CD2-CD2 3.96Å; F189-W240 HydrophobicContact CD2-CD2 3.96Å; F189-W240 HydrophobicContact CD2-CE3 4.31Å; F189-W240 AromaticContact CD2-CG 3.67Å; F189-W240 HydrophobicContact CD2-CG 3.67Å; F189-W240 HydrophobicContact CE2-CB 4.2Å; F189-W240 HydrophobicContact CG-CB 4.49Å; F189-W240 HydrophobicContact CG-CG 4.19Å; L200-W240 HydrophobicContact CD1-CE3 3.92Å; L200-W240 HydrophobicContact CD1-CZ3 3.87Å; A205-W240 HydrophobicContact CB-CZ3 4.36Å; M208-W240 HydrophobicContact CB-CH2 3.56Å; M208-W240 HydrophobicContact CB-CZ3 4.22Å; L209-W240 HydrophobicContact CD1-CZ3 4.28Å; L209-W240 HydrophobicContact CD2-CD2 4.4Å; L209-W240 HydrophobicContact CD2-CE3 3.96Å; L209-W240 HydrophobicContact CD2-CH2 3.65Å; L209-W240 HydrophobicContact CD2-CZ2 4.15Å; L209-W240 HydrophobicContact CD2-CZ3 3.58Å; L209-W240 HydrophobicContact CG-CE3 4.17Å; L209-W240 HydrophobicContact CG-CH2 3.81Å; L209-W240 HydrophobicContact CG-CZ3 3.5Å; L209-W240 VanDerWaalsContact CG-CZ3 3.5Å; L212-W240 HydrophobicContact CD1-CH2 4.31Å; L212-W240 HydrophobicContact CD1-CZ2 3.84Å; I235-W240 HydrophobicContact CG2-CB 4.14Å; I235-W240 HydrophobicContact CG2-CE3 4.4Å; N236-W240 WeakPolarHBondContact O-CB 3.27Å; N236-W240 PolarHBondContact O-N 3.43Å; D238-W240 VanDerWaalsContact C-N 3.33Å; D238-W240 PolarHBondContact O-N 3.49Å; W240-V243 PolarHBondContact O-N 3.34Å
241C98.4Very high98Very high26 Ų2652.1 Ų52.118%0.17626%0.255CS..Hα-helixtrans-65.2-40.5-179.9-69.40000112.3K237 D238 Q239 L244 E245K237-C241 PolarHBondContact O-N 3.15Å; K237-C241 VanDerWaalsContact O-N 3.07Å; K237-C241 PolarHBondContact O-SG 3.47Å; D238-C241 PolarHBondContact O-N 2.59Å; Q239-C241 PolarHBondContact O-N 3.34Å; C241-L244 PolarHBondContact O-N 3.09Å; C241-E245 PolarHBondContact O-N 2.98Å
242N98.5Very high97.9Very high32 Ų3249.6 Ų49.617%0.17125%0.248CC..Hα-helixtrans-69.7-29.5-179.8-81-72.3000112.8D238 Q239 L244 E245 F246 W263 P264 L267D238-N242 WeakPolarHBondContact O-CB 3.43Å; D238-N242 PolarHBondContact O-N 3.49Å; D238-N242 PolarHBondContact O-ND2 3.36Å; D238-N242 PolarHBondContact OD1-ND2 3.49Å; D238-N242 VanDerWaalsContact OD1-ND2 3.17Å; D238-N242 PolarHBondContact OD2-ND2 3.39Å; Q239-N242 PolarHBondContact O-N 3.26Å; N242-L244 VanDerWaalsContact C-N 3.26Å; N242-L244 PolarHBondContact O-N 3.16Å; N242-E245 PolarHBondContact O-N 3.31Å; N242-F246 VanDerWaalsContact O-CB 3.24Å; N242-F246 WeakPolarHBondContact O-CB 3.34Å; N242-F246 PolarHBondContact O-N 3.23Å; N242-W263 HydrophobicContact CB-CE3 4.23Å; N242-W263 HydrophobicContact CB-CZ3 4.22Å; N242-P264 HydrophobicContact CB-CG 3.64Å; N242-L267 HydrophobicContact CB-CD1 3.98Å
243V98.7Very high97.7Very high3 Ų353.3 Ų53.32%0.01827%0.27CS..Hα-helixtrans-57.4-41171.9168.90000111.3L209 L213 W217 F223 Q239 W240 S247 L267L209-V243 HydrophobicContact CD2-CG1 4.01Å; L213-V243 HydrophobicContact CD1-CG1 3.9Å; W217-V243 HydrophobicContact CZ3-CG1 4.15Å; F223-V243 HydrophobicContact CE1-CG1 3.99Å; F223-V243 HydrophobicContact CE1-CG2 4.02Å; F223-V243 HydrophobicContact CZ-CG1 4.36Å; F223-V243 HydrophobicContact CZ-CG2 3.66Å; Q239-V243 WeakPolarHBondContact O-CG2 3.47Å; Q239-V243 PolarHBondContact O-N 3.47Å; W240-V243 PolarHBondContact O-N 3.34Å; V243-S247 WeakPolarHBondContact O-CB 3.47Å; V243-S247 PolarHBondContact O-N 2.92Å; V243-L267 HydrophobicContact CG2-CD2 4.11Å
244L98.4Very high97.6Very high6 Ų646.2 Ų46.23%0.03124%0.24CC..Hα-helixtrans-66.6-44.5176178.561.9000111.7F181 K182 Y185 L213 C241 N242 S247 R248F181-L244 HydrophobicContact CD1-CD1 4.32Å; F181-L244 HydrophobicContact CE1-CD1 3.7Å; K182-L244 HydrophobicContact CB-CD2 4.45Å; K182-L244 HydrophobicContact CG-CD2 4.15Å; Y185-L244 HydrophobicContact CD1-CB 3.89Å; Y185-L244 HydrophobicContact CD1-CD2 3.64Å; Y185-L244 HydrophobicContact CD1-CG 4.3Å; Y185-L244 HydrophobicContact CD2-CB 4.44Å; Y185-L244 HydrophobicContact CD2-CD1 4.29Å; Y185-L244 HydrophobicContact CD2-CD2 4.36Å; Y185-L244 HydrophobicContact CE1-CB 3.5Å; Y185-L244 HydrophobicContact CE1-CD2 4.17Å; Y185-L244 HydrophobicContact CE1-CG 4.39Å; Y185-L244 HydrophobicContact CE2-CB 4.11Å; Y185-L244 HydrophobicContact CE2-CD1 4.45Å; Y185-L244 HydrophobicContact CG-CB 4.35Å; Y185-L244 HydrophobicContact CG-CD1 4.49Å; Y185-L244 HydrophobicContact CG-CD2 3.76Å; Y185-L244 HydrophobicContact CG-CG 4.43Å; L213-L244 HydrophobicContact CD2-CD1 4.17Å; C241-L244 PolarHBondContact O-N 3.09Å; N242-L244 VanDerWaalsContact C-N 3.26Å; N242-L244 PolarHBondContact O-N 3.16Å; L244-S247 PolarHBondContact O-N 3.02Å; L244-S247 PolarHBondContact O-OG 3.48Å; L244-R248 HydrophobicContact CD1-CG 4.47Å; L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.02Å
245E97.9Very high97.5Very high77 Ų7746.8 Ų46.836%0.3625%0.246SC..Hα-helixtrans-63.4-44.5179.9-16862.8-154.100111C241 N242 S247 R248 T249 W263C241-E245 PolarHBondContact O-N 2.98Å; N242-E245 PolarHBondContact O-N 3.31Å; E245-S247 VanDerWaalsContact C-N 3.33Å; E245-S247 PolarHBondContact O-N 3.36Å; E245-R248 PolarHBondContact O-N 3.09Å; E245-R248 VanDerWaalsContact O-N 3.08Å; E245-T249 HydrophobicContact CG-CG2 4.3Å; E245-T249 WeakPolarHBondContact O-CB 3.27Å; E245-T249 WeakPolarHBondContact O-CG2 3.32Å; E245-T249 PolarHBondContact O-N 3Å; E245-T249 PolarHBondContact O-OG1 2.91Å; E245-T249 WeakPolarHBondContact OE1-CG2 3.36Å; E245-W263 HydrophobicContact CB-CH2 4.06Å; E245-W263 HydrophobicContact CB-CZ3 4.06Å; E245-W263 HydrophobicContact CG-CH2 3.84Å; E245-W263 HydrophobicContact CG-CZ3 4.23Å
246F98.4Very high97.4Very high1 Ų150 Ų500%0.00426%0.263CS..Hα-helixtrans-56.7-47.1174.2-173.2-80.1000111.1W217 N242 R248 T249 I250 L254 Y257 W263 L267 F270 V271W217-F246 HydrophobicContact CH2-CD1 4.47Å; W217-F246 AromaticContact CZ2-CD1 3.84Å; W217-F246 HydrophobicContact CZ2-CD1 3.84Å; W217-F246 HydrophobicContact CZ2-CE1 4.06Å; N242-F246 VanDerWaalsContact O-CB 3.24Å; N242-F246 WeakPolarHBondContact O-CB 3.34Å; N242-F246 PolarHBondContact O-N 3.23Å; F246-R248 PolarHBondContact O-N 3.33Å; F246-R248 VanDerWaalsContact O-N 3.07Å; F246-T249 PolarHBondContact O-N 3.32Å; F246-I250 HydrophobicContact CD1-CB 4.22Å; F246-I250 HydrophobicContact CD1-CG1 4.29Å; F246-I250 HydrophobicContact CD2-CB 4.3Å; F246-I250 HydrophobicContact CD2-CG1 3.56Å; F246-I250 HydrophobicContact CE1-CB 4.06Å; F246-I250 HydrophobicContact CE1-CG1 4.36Å; F246-I250 HydrophobicContact CE1-CG2 4.14Å; F246-I250 HydrophobicContact CE2-CB 4.2Å; F246-I250 HydrophobicContact CE2-CG1 3.7Å; F246-I250 HydrophobicContact CE2-CG2 4.18Å; F246-I250 HydrophobicContact CG-CB 4.33Å; F246-I250 HydrophobicContact CG-CG1 3.89Å; F246-I250 HydrophobicContact CZ-CB 4.06Å; F246-I250 HydrophobicContact CZ-CG1 4.1Å; F246-I250 HydrophobicContact CZ-CG2 3.82Å; F246-I250 WeakPolarHBondContact O-CB 3.11Å; F246-I250 PolarHBondContact O-N 3.2Å; F246-L254 HydrophobicContact CE1-CD2 4.22Å; F246-L254 HydrophobicContact CZ-CD2 3.93Å; F246-Y257 HydrophobicContact CD2-CD2 4.47Å; F246-Y257 AromaticContact CE2-CD2 3.67Å; F246-Y257 HydrophobicContact CE2-CD2 3.67Å; F246-Y257 AromaticContact CE2-CE2 3.86Å; F246-Y257 HydrophobicContact CE2-CE2 3.86Å; F246-Y257 HydrophobicContact CZ-CD2 4.49Å; F246-W263 HydrophobicContact CB-CH2 4.18Å; F246-W263 HydrophobicContact CB-CZ3 4.04Å; F246-L267 HydrophobicContact CB-CD1 3.82Å; F246-L267 HydrophobicContact CB-CD2 4.39Å; F246-L267 HydrophobicContact CD2-CB 4.18Å; F246-L267 HydrophobicContact CD2-CD1 3.78Å; F246-L267 HydrophobicContact CD2-CD2 4.18Å; F246-L267 HydrophobicContact CD2-CG 4.28Å; F246-L267 HydrophobicContact CE2-CB 4.31Å; F246-L267 HydrophobicContact CG-CD1 4.05Å; F246-L267 HydrophobicContact CG-CD2 4.15Å; F246-F270 HydrophobicContact CE1-CD1 4.21Å; F246-F270 AromaticContact CE1-CE1 3.91Å; F246-F270 HydrophobicContact CE1-CE1 3.91Å; F246-F270 HydrophobicContact CZ-CD1 4.08Å; F246-F270 HydrophobicContact CZ-CE1 4.1Å; F246-V271 HydrophobicContact CE2-CG2 3.93Å; F246-V271 HydrophobicContact CZ-CG2 3.79Å
247S97.9Very high97.3Very high25 Ų2548 Ų4818%0.17525%0.252CS..Hα-helixtrans-61.2-20.6179.276.90000114.2V243 L244 E245V243-S247 WeakPolarHBondContact O-CB 3.47Å; V243-S247 PolarHBondContact O-N 2.92Å; L244-S247 PolarHBondContact O-N 3.02Å; L244-S247 PolarHBondContact O-OG 3.48Å; E245-S247 VanDerWaalsContact C-N 3.33Å; E245-S247 PolarHBondContact O-N 3.36Å
248R96.6Very high97.2Very high101 Ų10148.4 Ų48.438%0.38126%0.258SS..Hα-helixtrans-102-23.7-177.2-71.3176.1171.8-164-5.4113.8L244 E245 F246L244-R248 HydrophobicContact CD1-CG 4.47Å; L244-R248 WeakPolarHBondContact O-CG 3.41Å; L244-R248 PolarHBondContact O-N 3.02Å; E245-R248 PolarHBondContact O-N 3.09Å; E245-R248 VanDerWaalsContact O-N 3.08Å; F246-R248 PolarHBondContact O-N 3.33Å; F246-R248 VanDerWaalsContact O-N 3.07Å
249T97.3Very high96.8Very high57 Ų5750.2 Ų50.235%0.3526%0.263SS..Hα-helixtrans-115.3-24.9-169.556.60000113.9E245 F246 N256E245-T249 HydrophobicContact CG-CG2 4.3Å; E245-T249 WeakPolarHBondContact O-CB 3.27Å; E245-T249 WeakPolarHBondContact O-CG2 3.32Å; E245-T249 PolarHBondContact O-N 3Å; E245-T249 PolarHBondContact O-OG1 2.91Å; E245-T249 WeakPolarHBondContact OE1-CG2 3.36Å; F246-T249 PolarHBondContact O-N 3.32Å; T249-N256 PolarHBondContact O-ND2 3.49Å
250I97.8Very high96.6Very high17 Ų1756.5 Ų56.59%0.08730%0.298CS..SBendtrans-92.7132.6179.6-55.7-55.4000110F246 L254 Y257 W263F246-I250 HydrophobicContact CD1-CB 4.22Å; F246-I250 HydrophobicContact CD1-CG1 4.29Å; F246-I250 HydrophobicContact CD2-CB 4.3Å; F246-I250 HydrophobicContact CD2-CG1 3.56Å; F246-I250 HydrophobicContact CE1-CB 4.06Å; F246-I250 HydrophobicContact CE1-CG1 4.36Å; F246-I250 HydrophobicContact CE1-CG2 4.14Å; F246-I250 HydrophobicContact CE2-CB 4.2Å; F246-I250 HydrophobicContact CE2-CG1 3.7Å; F246-I250 HydrophobicContact CE2-CG2 4.18Å; F246-I250 HydrophobicContact CG-CB 4.33Å; F246-I250 HydrophobicContact CG-CG1 3.89Å; F246-I250 HydrophobicContact CZ-CB 4.06Å; F246-I250 HydrophobicContact CZ-CG1 4.1Å; F246-I250 HydrophobicContact CZ-CG2 3.82Å; F246-I250 WeakPolarHBondContact O-CB 3.11Å; F246-I250 PolarHBondContact O-N 3.2Å; I250-L254 HydrophobicContact CG2-CD2 3.74Å; I250-Y257 HydrophobicContact CD1-CD2 4.19Å; I250-Y257 HydrophobicContact CG1-CD2 4.43Å; I250-W263 HydrophobicContact CD1-CZ2 4.02Å; I250-W263 HydrophobicContact CG1-CZ2 4.21Å
251N96.6Very high96.3Very high78 Ų7857.7 Ų57.742%0.41731%0.31SS..  trans-62.3153.2176.7-68.6-20.9000110.5D253 L254 S255 N256N251-D253 WeakPolarHBondContact CB-OD1 3.32Å; N251-D253 PolarHBondContact O-N 3.37Å; N251-L254 WeakPolarHBondContact O-CA 3.15Å; N251-L254 PolarHBondContact O-N 3.03Å; N251-S255 PolarHBondContact ND2-OG 3.01Å; N251-S255 VanDerWaalsContact ND2-OG 3.08Å; N251-N256 WeakPolarHBondContact CB-OD1 3.47Å; N251-N256 PolarHBondContact N-OD1 3.35Å
252L94.8Very high96.2Very high93 Ų9361.6 Ų61.649%0.48734%0.344SS..THydrogen-bonded Turntrans-64.6-24.5-178.5-58.5-179.5000113.4P218 L219 L254P218-L252 HydrophobicContact CB-CD1 4.21Å; P218-L252 HydrophobicContact CB-CD2 4.02Å; P218-L252 HydrophobicContact CG-CD1 4.06Å; P218-L252 HydrophobicContact CG-CD2 3.98Å; L219-L252 HydrophobicContact CD1-CD2 4.46Å; L219-L252 HydrophobicContact CG-CD2 4.19Å; L252-L254 VanDerWaalsContact C-N 3.33Å
253D93.4Very high96.1Very high111 Ų11162.3 Ų62.359%0.59434%0.344SS*.THydrogen-bonded Turntrans-90.12.5174.666.9-6.5000113.2N251 S255N251-D253 WeakPolarHBondContact CB-OD1 3.32Å; N251-D253 PolarHBondContact O-N 3.37Å; D253-S255 VanDerWaalsContact CG-OG 3.28Å; D253-S255 PolarHBondContact O-N 3.02Å; D253-S255 VanDerWaalsContact O-N 3.13Å; D253-S255 VanDerWaalsContact OD1-CB 3.22Å; D253-S255 WeakPolarHBondContact OD1-CB 3.5Å; D253-S255 PolarHBondContact OD1-N 3.14Å; D253-S255 PolarHBondContact OD1-OG 3.5Å; D253-S255 PolarHBondContact OD2-OG 3.42Å
254L95.8Very high96.1Very high5 Ų562.9 Ų62.93%0.02635%0.348CS..  trans60.116.2-178.4-46.6178.2000114.1L219 F246 I250 N251 L252 N256 Y257 V271 Y274L219-L254 HydrophobicContact CD1-CD2 3.75Å; F246-L254 HydrophobicContact CE1-CD2 4.22Å; F246-L254 HydrophobicContact CZ-CD2 3.93Å; I250-L254 HydrophobicContact CG2-CD2 3.74Å; N251-L254 WeakPolarHBondContact O-CA 3.15Å; N251-L254 PolarHBondContact O-N 3.03Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L254-N256 VanDerWaalsContact C-N 3.28Å; L254-N256 PolarHBondContact O-N 3.26Å; L254-Y257 WeakPolarHBondContact O-CB 3.41Å; L254-Y257 PolarHBondContact O-N 3.27Å; L254-V271 HydrophobicContact CD1-CB 4.36Å; L254-V271 HydrophobicContact CD1-CG1 4.05Å; L254-V271 HydrophobicContact CD1-CG2 4.19Å; L254-Y274 HydrophobicContact CD1-CD1 3.42Å; L254-Y274 VanDerWaalsContact CD1-CD1 3.42Å; L254-Y274 HydrophobicContact CD1-CE1 4.12Å; L254-Y274 HydrophobicContact CD1-CG 3.97Å; L254-Y274 HydrophobicContact CG-CD1 4.31Å
255S95.3Very high96.1Very high78 Ų7866.8 Ų66.855%0.54537%0.372SS..THydrogen-bonded Turntrans-64.4-28-17453.70000114.6N251 D253N251-S255 PolarHBondContact ND2-OG 3.01Å; N251-S255 VanDerWaalsContact ND2-OG 3.08Å; D253-S255 VanDerWaalsContact CG-OG 3.28Å; D253-S255 PolarHBondContact O-N 3.02Å; D253-S255 VanDerWaalsContact O-N 3.13Å; D253-S255 VanDerWaalsContact OD1-CB 3.22Å; D253-S255 WeakPolarHBondContact OD1-CB 3.5Å; D253-S255 PolarHBondContact OD1-N 3.14Å; D253-S255 PolarHBondContact OD1-OG 3.5Å; D253-S255 PolarHBondContact OD2-OG 3.42Å
256N96.5Very high96.1Very high71 Ų7163.2 Ų63.238%0.3836%0.355SS..THydrogen-bonded Turntrans-100.310-179.773.2-38.6000113.3T249 N251 L254T249-N256 PolarHBondContact O-ND2 3.49Å; N251-N256 WeakPolarHBondContact CB-OD1 3.47Å; N251-N256 PolarHBondContact N-OD1 3.35Å; L254-N256 VanDerWaalsContact C-N 3.28Å; L254-N256 PolarHBondContact O-N 3.26Å
257Y97.4Very high96.1Very high20 Ų2063.2 Ų63.28%0.07836%0.356CS..  trans-75.1130.3176177.4-94.6000110.6F246 I250 L254 E259 W263 D268 V271F246-Y257 HydrophobicContact CD2-CD2 4.47Å; F246-Y257 AromaticContact CE2-CD2 3.67Å; F246-Y257 HydrophobicContact CE2-CD2 3.67Å; F246-Y257 AromaticContact CE2-CE2 3.86Å; F246-Y257 HydrophobicContact CE2-CE2 3.86Å; F246-Y257 HydrophobicContact CZ-CD2 4.49Å; I250-Y257 HydrophobicContact CD1-CD2 4.19Å; I250-Y257 HydrophobicContact CG1-CD2 4.43Å; L254-Y257 WeakPolarHBondContact O-CB 3.41Å; L254-Y257 PolarHBondContact O-N 3.27Å; Y257-E259 HydrophobicContact CD1-CG 4.07Å; Y257-E259 HydrophobicContact CE1-CB 4.44Å; Y257-E259 HydrophobicContact CE1-CG 3.74Å; Y257-W263 HydrophobicContact CE2-CB 4.37Å; Y257-W263 AromaticContact CE2-CD1 3.42Å; Y257-W263 VanDerWaalsContact CE2-CD1 3.42Å; Y257-W263 AromaticContact CE2-CG 3.94Å; Y257-W263 HydrophobicContact CE2-CG 3.94Å; Y257-W263 AromaticContact CE2-NE1 3.92Å; Y257-D268 WeakPolarHBondContact OH-CA 3.46Å; Y257-D268 WeakPolarHBondContact OH-CB 3.41Å; Y257-D268 PolarHBondContact OH-OD1 2.74Å; Y257-V271 HydrophobicContact CD1-CB 4.16Å; Y257-V271 HydrophobicContact CD1-CG1 3.66Å; Y257-V271 HydrophobicContact CD1-CG2 3.95Å; Y257-V271 HydrophobicContact CD2-CG2 3.87Å; Y257-V271 HydrophobicContact CE1-CB 4.02Å; Y257-V271 HydrophobicContact CE1-CG1 3.92Å; Y257-V271 HydrophobicContact CE1-CG2 3.96Å; Y257-V271 HydrophobicContact CE2-CG2 3.91Å; Y257-V271 HydrophobicContact CG-CG1 4.22Å; Y257-V271 HydrophobicContact CG-CG2 3.88Å
258D94.9Very high96.1Very high92 Ų9264.1 Ų64.149%0.49236%0.358SS..  trans-102.6112.7179.6-1789.5000109.7D260 G261D258-D260 VanDerWaalsContact C-N 3.25Å; D258-D260 PolarHBondContact O-N 2.88Å; D258-D260 PolarHBondContact OD1-N 3.05Å; D258-D260 VanDerWaalsContact OD1-N 3.08Å; D258-G261 PolarHBondContact O-N 3.33Å; D258-G261 VanDerWaalsContact O-N 3.09Å
259E91.3Very high96.1Very high133 Ų13361.3 Ų61.362%0.62135%0.35SS*.THydrogen-bonded Turntrans-69.7-22.4-179.6-71.2172.3-166.100112.4Y257 G261 K275Y257-E259 HydrophobicContact CD1-CG 4.07Å; Y257-E259 HydrophobicContact CE1-CB 4.44Å; Y257-E259 HydrophobicContact CE1-CG 3.74Å; E259-G261 VanDerWaalsContact C-N 3.28Å; E259-K275 IonicContact OE1-NZ 3.73Å; E259-K275 PolarHBondContact OE1-NZ 3.04Å
260D92.8Very high96.2Very high160 Ų16058.6 Ų58.686%0.85633%0.333SS*.THydrogen-bonded Turntrans-90.64.7173.4-66.1-48.6000112.1D258D258-D260 VanDerWaalsContact C-N 3.25Å; D258-D260 PolarHBondContact O-N 2.88Å; D258-D260 PolarHBondContact OD1-N 3.05Å; D258-D260 VanDerWaalsContact OD1-N 3.08Å
261G93.3Very high96.2Very high26 Ų2657.9 Ų57.927%0.26833%0.329SS..SBendtrans-70.2166.4179.600000113.7D258 E259 W263D258-G261 PolarHBondContact O-N 3.33Å; D258-G261 VanDerWaalsContact O-N 3.09Å; E259-G261 VanDerWaalsContact C-N 3.28Å; G261-W263 PolarHBondContact O-N 3.39Å; G261-W263 VanDerWaalsContact O-N 3.13Å
262A95.9Very high96.1Very high107 Ų10759.8 Ų59.888%0.88434%0.336SS*.SBendtrans-85.432.5178.600000113.3
263W98Very high96.2Very high47 Ų4757.2 Ų57.218%0.17832%0.32CS..  trans-73.2150.2177.4-69.5112.3000110.5N242 E245 F246 I250 Y257 G261 L267 D268N242-W263 HydrophobicContact CB-CE3 4.23Å; N242-W263 HydrophobicContact CB-CZ3 4.22Å; E245-W263 HydrophobicContact CB-CH2 4.06Å; E245-W263 HydrophobicContact CB-CZ3 4.06Å; E245-W263 HydrophobicContact CG-CH2 3.84Å; E245-W263 HydrophobicContact CG-CZ3 4.23Å; F246-W263 HydrophobicContact CB-CH2 4.18Å; F246-W263 HydrophobicContact CB-CZ3 4.04Å; I250-W263 HydrophobicContact CD1-CZ2 4.02Å; I250-W263 HydrophobicContact CG1-CZ2 4.21Å; Y257-W263 HydrophobicContact CE2-CB 4.37Å; Y257-W263 AromaticContact CE2-CD1 3.42Å; Y257-W263 VanDerWaalsContact CE2-CD1 3.42Å; Y257-W263 AromaticContact CE2-CG 3.94Å; Y257-W263 HydrophobicContact CE2-CG 3.94Å; Y257-W263 AromaticContact CE2-NE1 3.92Å; G261-W263 PolarHBondContact O-N 3.39Å; G261-W263 VanDerWaalsContact O-N 3.13Å; W263-L267 HydrophobicContact CB-CB 4.49Å; W263-L267 HydrophobicContact CD2-CD1 4.39Å; W263-L267 HydrophobicContact CE3-CD1 3.66Å; W263-L267 HydrophobicContact CZ3-CD1 4.18Å; W263-D268 VanDerWaalsContact CB-OD1 3.31Å; W263-D268 WeakPolarHBondContact CB-OD1 3.3Å
264P97.6Very high96.3Very high15 Ų1553.9 Ų53.910%0.09730%0.299CS..  trans-62.4139.4170.3-23.634000110.6Q239 N242 L266 L267 D268Q239-P264 HydrophobicContact CG-CB 4.05Å; N242-P264 HydrophobicContact CB-CG 3.64Å; P264-L266 PolarHBondContact O-N 3.26Å; P264-L267 PolarHBondContact O-N 3.04Å; P264-D268 PolarHBondContact O-N 3.17Å
265V97.7Very high96.2Very high88 Ų8856.8 Ų56.853%0.53331%0.312SS..Hα-helixtrans-45.7-31177.4179.40000113.9L267 D268 E269V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 3.07Å; V265-D268 WeakPolarHBondContact CA-OD2 3.32Å; V265-D268 PolarHBondContact O-N 2.71Å; V265-E269 HydrophobicContact CG1-CG 4.15Å; V265-E269 WeakPolarHBondContact O-CB 3.29Å; V265-E269 WeakPolarHBondContact O-CG 3.4Å; V265-E269 PolarHBondContact O-N 2.98Å
266L98.3Very high96.1Very high2 Ų258.9 Ų58.91%0.0131%0.313CS..Hα-helixtrans-58-40.9174.8-179.2150.9000113.2F223 F226 L227 Y232 I235 P264 F270F223-L266 HydrophobicContact CE2-CD2 3.81Å; F223-L266 HydrophobicContact CZ-CD2 3.71Å; F226-L266 HydrophobicContact CE1-CD2 4.35Å; F226-L266 HydrophobicContact CE1-CG 4.3Å; F226-L266 WeakPolarHBondContact CZ-O 3.23Å; L227-L266 HydrophobicContact CD2-CD1 4.19Å; L227-L266 HydrophobicContact CD2-CD2 4.41Å; Y232-L266 HydrophobicContact CD1-CD1 4.09Å; Y232-L266 HydrophobicContact CD2-CD1 3.99Å; Y232-L266 HydrophobicContact CD2-CG 4.24Å; Y232-L266 HydrophobicContact CE1-CB 4.21Å; Y232-L266 HydrophobicContact CE1-CD1 4.15Å; Y232-L266 HydrophobicContact CE1-CG 4.48Å; Y232-L266 HydrophobicContact CE2-CB 4.15Å; Y232-L266 HydrophobicContact CE2-CD1 4.09Å; Y232-L266 HydrophobicContact CE2-CG 3.91Å; Y232-L266 HydrophobicContact CG-CD1 4.03Å; Y232-L266 WeakPolarHBondContact OH-CA 3.49Å; Y232-L266 PolarHBondContact OH-N 3.32Å; I235-L266 HydrophobicContact CD1-CD1 3.44Å; I235-L266 VanDerWaalsContact CD1-CD1 3.44Å; P264-L266 PolarHBondContact O-N 3.26Å; L266-F270 PolarHBondContact O-N 2.65Å; L266-F270 VanDerWaalsContact O-N 3.12Å
267L98.4Very high95.8Very high1 Ų160.3 Ų60.31%0.00531%0.313CS..Hα-helixtrans-76.6-34.7178.8-65.7178000111.1F223 N242 V243 F246 W263 P264 V265 F270 V271F223-L267 HydrophobicContact CE2-CD2 3.96Å; F223-L267 HydrophobicContact CZ-CD2 4.32Å; N242-L267 HydrophobicContact CB-CD1 3.98Å; V243-L267 HydrophobicContact CG2-CD2 4.11Å; F246-L267 HydrophobicContact CB-CD1 3.82Å; F246-L267 HydrophobicContact CB-CD2 4.39Å; F246-L267 HydrophobicContact CD2-CB 4.18Å; F246-L267 HydrophobicContact CD2-CD1 3.78Å; F246-L267 HydrophobicContact CD2-CD2 4.18Å; F246-L267 HydrophobicContact CD2-CG 4.28Å; F246-L267 HydrophobicContact CE2-CB 4.31Å; F246-L267 HydrophobicContact CG-CD1 4.05Å; F246-L267 HydrophobicContact CG-CD2 4.15Å; W263-L267 HydrophobicContact CB-CB 4.49Å; W263-L267 HydrophobicContact CD2-CD1 4.39Å; W263-L267 HydrophobicContact CE3-CD1 3.66Å; W263-L267 HydrophobicContact CZ3-CD1 4.18Å; P264-L267 PolarHBondContact O-N 3.04Å; V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 3.07Å; L267-F270 WeakPolarHBondContact O-CB 3.17Å; L267-F270 PolarHBondContact O-N 3.45Å; L267-V271 WeakPolarHBondContact O-CG2 3.27Å; L267-V271 PolarHBondContact O-N 3.15Å
268D97.8Very high95Very high44 Ų4465.3 Ų65.324%0.23534%0.337CS..Hα-helixtrans-61.9-49.5174.6-44.7-12.7000110.2Y257 W263 P264 V265 F270 V271 E272Y257-D268 WeakPolarHBondContact OH-CA 3.46Å; Y257-D268 WeakPolarHBondContact OH-CB 3.41Å; Y257-D268 PolarHBondContact OH-OD1 2.74Å; W263-D268 VanDerWaalsContact CB-OD1 3.31Å; W263-D268 WeakPolarHBondContact CB-OD1 3.3Å; P264-D268 PolarHBondContact O-N 3.17Å; V265-D268 WeakPolarHBondContact CA-OD2 3.32Å; V265-D268 PolarHBondContact O-N 2.71Å; D268-F270 VanDerWaalsContact C-N 3.26Å; D268-F270 PolarHBondContact O-N 3.21Å; D268-V271 PolarHBondContact O-N 3.45Å; D268-V271 VanDerWaalsContact O-N 3.16Å; D268-E272 PolarHBondContact O-N 3.12Å
269E97.9Very high94Very high42 Ų4268.7 Ų68.720%0.19635%0.352CS..Hα-helixtrans-62-32.5175.1-72.8-179.7171.200112.2F226 K231 Y232 V265 W273F226-E269 HydrophobicContact CE2-CB 4.17Å; F226-E269 HydrophobicContact CZ-CB 3.93Å; K231-E269 VanDerWaalsContact CE-OE1 3.23Å; K231-E269 WeakPolarHBondContact CE-OE1 3.45Å; K231-E269 IonicContact NZ-OE1 2.65Å; K231-E269 PolarHBondContact NZ-OE1 3.36Å; K231-E269 IonicContact NZ-OE2 3.81Å; Y232-E269 WeakPolarHBondContact CE2-OE2 3.47Å; Y232-E269 VanDerWaalsContact OH-CD 3.26Å; Y232-E269 PolarHBondContact OH-OE2 3.44Å; V265-E269 HydrophobicContact CG1-CG 4.15Å; V265-E269 WeakPolarHBondContact O-CB 3.29Å; V265-E269 WeakPolarHBondContact O-CG 3.4Å; V265-E269 PolarHBondContact O-N 2.98Å; E269-W273 WeakPolarHBondContact O-CB 3.45Å; E269-W273 PolarHBondContact O-N 2.7Å
270F98.1Very high92.2Very high0 Ų069.8 Ų69.80%037%0.374CS..Hα-helixtrans-66.3-45.3174.1166.1-116.8000111.9V222 F223 F226 F246 L266 L267 D268 W273 Y274V222-F270 HydrophobicContact CG2-CE2 4.36Å; V222-F270 HydrophobicContact CG2-CZ 4.23Å; F223-F270 HydrophobicContact CB-CE2 3.97Å; F223-F270 HydrophobicContact CB-CZ 4.02Å; F223-F270 HydrophobicContact CD2-CB 4.26Å; F223-F270 AromaticContact CD2-CD1 3.84Å; F223-F270 HydrophobicContact CD2-CD1 3.84Å; F223-F270 AromaticContact CD2-CD2 3.71Å; F223-F270 HydrophobicContact CD2-CD2 3.71Å; F223-F270 HydrophobicContact CD2-CE1 4.08Å; F223-F270 AromaticContact CD2-CE2 3.96Å; F223-F270 HydrophobicContact CD2-CE2 3.96Å; F223-F270 AromaticContact CD2-CG 3.64Å; F223-F270 HydrophobicContact CD2-CG 3.64Å; F223-F270 HydrophobicContact CD2-CZ 4.14Å; F223-F270 HydrophobicContact CE2-CB 4.26Å; F223-F270 HydrophobicContact CE2-CD1 4.35Å; F223-F270 HydrophobicContact CE2-CG 4.11Å; F223-F270 HydrophobicContact CG-CE2 4.49Å; F226-F270 HydrophobicContact CB-CD2 3.76Å; F226-F270 HydrophobicContact CB-CE2 4.33Å; F226-F270 HydrophobicContact CD1-CB 3.81Å; F226-F270 AromaticContact CD1-CD2 3.94Å; F226-F270 HydrophobicContact CD1-CD2 3.94Å; F226-F270 HydrophobicContact CD1-CG 4.26Å; F226-F270 HydrophobicContact CD2-CB 4.44Å; F226-F270 HydrophobicContact CD2-CD2 4.46Å; F226-F270 HydrophobicContact CE1-CB 3.73Å; F226-F270 HydrophobicContact CE2-CB 4.36Å; F226-F270 HydrophobicContact CG-CB 4.17Å; F226-F270 AromaticContact CG-CD2 3.8Å; F226-F270 HydrophobicContact CG-CD2 3.8Å; F226-F270 HydrophobicContact CG-CG 4.46Å; F226-F270 HydrophobicContact CZ-CB 4.01Å; F246-F270 HydrophobicContact CE1-CD1 4.21Å; F246-F270 AromaticContact CE1-CE1 3.91Å; F246-F270 HydrophobicContact CE1-CE1 3.91Å; F246-F270 HydrophobicContact CZ-CD1 4.08Å; F246-F270 HydrophobicContact CZ-CE1 4.1Å; L266-F270 PolarHBondContact O-N 2.65Å; L266-F270 VanDerWaalsContact O-N 3.12Å; L267-F270 WeakPolarHBondContact O-CB 3.17Å; L267-F270 PolarHBondContact O-N 3.45Å; D268-F270 VanDerWaalsContact C-N 3.26Å; D268-F270 PolarHBondContact O-N 3.21Å; F270-W273 HydrophobicContact CD2-CE3 4.4Å; F270-W273 HydrophobicContact CE2-CZ3 4.49Å; F270-W273 PolarHBondContact O-N 3.09Å; F270-Y274 VanDerWaalsContact O-CB 3.32Å; F270-Y274 WeakPolarHBondContact O-CB 3.47Å; F270-Y274 PolarHBondContact O-N 3.39Å
271V97.7Very high92.2Very high2 Ų265.3 Ų65.31%0.01235%0.35CS..Hα-helixtrans-64.2-45.6179.9171.80000110.6F246 L254 Y257 L267 D268 Y274 K275F246-V271 HydrophobicContact CE2-CG2 3.93Å; F246-V271 HydrophobicContact CZ-CG2 3.79Å; L254-V271 HydrophobicContact CD1-CB 4.36Å; L254-V271 HydrophobicContact CD1-CG1 4.05Å; L254-V271 HydrophobicContact CD1-CG2 4.19Å; Y257-V271 HydrophobicContact CD1-CB 4.16Å; Y257-V271 HydrophobicContact CD1-CG1 3.66Å; Y257-V271 HydrophobicContact CD1-CG2 3.95Å; Y257-V271 HydrophobicContact CD2-CG2 3.87Å; Y257-V271 HydrophobicContact CE1-CB 4.02Å; Y257-V271 HydrophobicContact CE1-CG1 3.92Å; Y257-V271 HydrophobicContact CE1-CG2 3.96Å; Y257-V271 HydrophobicContact CE2-CG2 3.91Å; Y257-V271 HydrophobicContact CG-CG1 4.22Å; Y257-V271 HydrophobicContact CG-CG2 3.88Å; L267-V271 WeakPolarHBondContact O-CG2 3.27Å; L267-V271 PolarHBondContact O-N 3.15Å; D268-V271 PolarHBondContact O-N 3.45Å; D268-V271 VanDerWaalsContact O-N 3.16Å; V271-Y274 PolarHBondContact O-N 3.34Å; V271-K275 HydrophobicContact CG1-CD 4.05Å; V271-K275 HydrophobicContact CG1-CG 4.44Å; V271-K275 WeakPolarHBondContact O-CG 3.45Å; V271-K275 PolarHBondContact O-N 3.47Å
272E96.2Very high92.1Very high119 Ų11967.3 Ų67.356%0.55635%0.354SS*.Hα-helixtrans-57-54.6175.4-176.2177.7-156.100110.8D268 Y274 K275 E276D268-E272 PolarHBondContact O-N 3.12Å; E272-Y274 VanDerWaalsContact C-N 3.26Å; E272-Y274 PolarHBondContact O-N 3.32Å; E272-K275 PolarHBondContact O-N 3.34Å; E272-K275 VanDerWaalsContact O-N 3.16Å; E272-E276 WeakPolarHBondContact O-CG 3.47Å; E272-E276 PolarHBondContact O-N 2.98Å
273W96.6Very high91.9Very high38 Ų3865.1 Ų65.114%0.14433%0.325CS..Hα-helixtrans-57.6-37.3179175.794.8000113.1Q225 F226 E269 F270 R277Q225-W273 HydrophobicContact CB-CH2 4.16Å; Q225-W273 HydrophobicContact CG-CH2 4.11Å; Q225-W273 HydrophobicContact CG-CZ2 4.29Å; F226-W273 HydrophobicContact CB-CD2 4.08Å; F226-W273 HydrophobicContact CB-CE3 3.83Å; F226-W273 HydrophobicContact CB-CH2 3.98Å; F226-W273 HydrophobicContact CB-CZ2 4.17Å; F226-W273 HydrophobicContact CB-CZ3 3.82Å; F226-W273 HydrophobicContact CD2-CB 3.94Å; F226-W273 AromaticContact CD2-CD2 3.92Å; F226-W273 HydrophobicContact CD2-CD2 3.92Å; F226-W273 HydrophobicContact CD2-CE3 4.3Å; F226-W273 AromaticContact CD2-CG 3.78Å; F226-W273 HydrophobicContact CD2-CG 3.78Å; F226-W273 HydrophobicContact CE2-CB 4.24Å; F226-W273 HydrophobicContact CE2-CG 4.46Å; F226-W273 HydrophobicContact CG-CD2 4.47Å; F226-W273 HydrophobicContact CG-CE3 4.48Å; E269-W273 WeakPolarHBondContact O-CB 3.45Å; E269-W273 PolarHBondContact O-N 2.7Å; F270-W273 HydrophobicContact CD2-CE3 4.4Å; F270-W273 HydrophobicContact CE2-CZ3 4.49Å; F270-W273 PolarHBondContact O-N 3.09Å; W273-R277 WeakPolarHBondContact O-CG 3.44Å; W273-R277 PolarHBondContact O-N 3.39Å
274Y95.6Very high91.6Very high42 Ų4266.2 Ų66.217%0.16533%0.333CS..Hα-helixtrans-70.7-43.9178.5-175.6-94000111.6L219 V222 L254 F270 V271 E272 R277 Q278L219-Y274 HydrophobicContact CD2-CE2 4.29Å; V222-Y274 HydrophobicContact CB-CD2 4.27Å; V222-Y274 HydrophobicContact CB-CE2 4.18Å; V222-Y274 HydrophobicContact CG1-CE2 4.23Å; V222-Y274 HydrophobicContact CG2-CD2 4.04Å; V222-Y274 HydrophobicContact CG2-CE2 3.81Å; L254-Y274 HydrophobicContact CD1-CD1 3.42Å; L254-Y274 VanDerWaalsContact CD1-CD1 3.42Å; L254-Y274 HydrophobicContact CD1-CE1 4.12Å; L254-Y274 HydrophobicContact CD1-CG 3.97Å; L254-Y274 HydrophobicContact CG-CD1 4.31Å; F270-Y274 VanDerWaalsContact O-CB 3.32Å; F270-Y274 WeakPolarHBondContact O-CB 3.47Å; F270-Y274 PolarHBondContact O-N 3.39Å; V271-Y274 PolarHBondContact O-N 3.34Å; E272-Y274 VanDerWaalsContact C-N 3.26Å; E272-Y274 PolarHBondContact O-N 3.32Å; Y274-R277 PolarHBondContact O-N 3.19Å; Y274-Q278 HydrophobicContact CD1-CG 4.28Å; Y274-Q278 HydrophobicContact CE1-CG 3.93Å; Y274-Q278 WeakPolarHBondContact O-CG 3.46Å; Y274-Q278 PolarHBondContact O-N 3.3Å; Y274-Q278 PolarHBondContact OH-NE2 3.48Å; Y274-Q278 VanDerWaalsContact OH-NE2 3.09Å
275K93.5Very high91.2Very high66 Ų6669.4 Ų69.429%0.28735%0.348SS..Hα-helixtrans-62.3-44.3178.4-74.6176-179.6176.90111.6E259 V271 E272 R277 Q278 M279E259-K275 IonicContact OE1-NZ 3.73Å; E259-K275 PolarHBondContact OE1-NZ 3.04Å; V271-K275 HydrophobicContact CG1-CD 4.05Å; V271-K275 HydrophobicContact CG1-CG 4.44Å; V271-K275 WeakPolarHBondContact O-CG 3.45Å; V271-K275 PolarHBondContact O-N 3.47Å; E272-K275 PolarHBondContact O-N 3.34Å; E272-K275 VanDerWaalsContact O-N 3.16Å; K275-R277 VanDerWaalsContact C-N 3.26Å; K275-R277 PolarHBondContact O-N 3.15Å; K275-Q278 PolarHBondContact O-N 3.38Å; K275-M279 WeakPolarHBondContact O-CG 3.19Å; K275-M279 PolarHBondContact O-N 2.88Å
276E92.8Very high90.8Very high121 Ų12168.1 Ų68.157%0.56534%0.335SS*.Hα-helixtrans-57.9-39178.5-72.7-176.2160.100112.5E272 M279 S280E272-E276 WeakPolarHBondContact O-CG 3.47Å; E272-E276 PolarHBondContact O-N 2.98Å; E276-M279 PolarHBondContact O-N 3.4Å; E276-S280 PolarHBondContact O-N 3.34Å
277R89.2Confident90.2Very high102 Ų10272.9 Ų72.939%0.38536%0.359SS..Hα-helixtrans-74-25.1-179.9-75.5-178.5159.7-157.1-2.9114.7Q225 W273 Y274 K275 M279Q225-R277 VanDerWaalsContact CD-NH1 3.28Å; W273-R277 WeakPolarHBondContact O-CG 3.44Å; W273-R277 PolarHBondContact O-N 3.39Å; Y274-R277 PolarHBondContact O-N 3.19Å; K275-R277 VanDerWaalsContact C-N 3.26Å; K275-R277 PolarHBondContact O-N 3.15Å; R277-M279 VanDerWaalsContact C-N 3.31Å
278Q81.6Confident89.6Confident125 Ų12578.4 Ų78.458%0.58439%0.386SS*.Hα-helixtrans-79.2-19.8174.7-66.2-67.4-4.600112.1Y274 K275Y274-Q278 HydrophobicContact CD1-CG 4.28Å; Y274-Q278 HydrophobicContact CE1-CG 3.93Å; Y274-Q278 WeakPolarHBondContact O-CG 3.46Å; Y274-Q278 PolarHBondContact O-N 3.3Å; Y274-Q278 PolarHBondContact OH-NE2 3.48Å; Y274-Q278 VanDerWaalsContact OH-NE2 3.09Å; K275-Q278 PolarHBondContact O-N 3.38Å
279M72.8Confident88.9Confident163 Ų16381.3 Ų81.380%0.80340%0.398SS*.Hα-helixtrans-91.3-13.8178.3-64.2-176.8-167.800113.5K275 E276 R277K275-M279 WeakPolarHBondContact O-CG 3.19Å; K275-M279 PolarHBondContact O-N 2.88Å; E276-M279 PolarHBondContact O-N 3.4Å; R277-M279 VanDerWaalsContact C-N 3.31Å
280S54.8Low88.1Confident155 Ų15584.8 Ų84.8100%1.08442%0.417SS*.  trans-92.40176.4-177.60000112.7E276E276-S280 PolarHBondContact O-N 3.34Å

Retrieved 280 of 280 residues in 476.8 ms (Link to these results)