A0A087YL08_POEFO Loading...

Pbx/knotted 1 homeobox 2

AlphaFold DB , UniProt , Accession A0A087YL08, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 493 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.2Very low39.6Very low243 Ų243153.8 Ų153.8100%1.19785%0.853SS**  094.70-79.1154.415000106.6
2M37.8Very low39.4Very low192 Ų192150.5 Ų150.595%0.94684%0.84SS**  trans-86.4125.6-166.6-78.1150.2157.600110.5
3Q39.9Very low39.1Very low186 Ų186152.5 Ų152.587%0.86984%0.842SS**  trans-87.1135.1163.2-79.514918.900108.1
4H43Very low38.9Very low196 Ų196154.1 Ų154.191%0.90784%0.844SS**  trans-145.4142.4165.7-115.7-88.6000110.7
5D33.4Very low38.8Very low138 Ų138150.3 Ų150.374%0.73884%0.841SS**  trans-92.9137.6-163.9-170.2-79.9000112.1
6S36.2Very low38.8Very low97 Ų97149.6 Ų149.668%0.67884%0.842SS**  trans49.9172.1153.1-51.70000119.5
7P45.4Very low38.5Very low121 Ų121152.1 Ų152.179%0.78685%0.845SS**  cis-137.3177.47.138.2-16.6000116.5
8L43.3Very low38.2Very low169 Ų169149.9 Ų149.989%0.88584%0.842SS**PPolyproline II helixtrans-55.8147.4168.7-63.3161000113
9P39.8Very low38.2Very low131 Ų131149.1 Ų149.185%0.85184%0.84SS**PPolyproline II helixtrans-96.9137.9162.333.9-27.2000112.5
10A34.5Very low38.8Very low90 Ų90146.8 Ų146.874%0.74483%0.832SS**PPolyproline II helixtrans-77.1157.8-171.400000114.8T12A10-T12 PolarHBondContact O-N 2.82Å
11V38.2Very low39.2Very low129 Ų129145.3 Ų145.378%0.78283%0.828SS**  trans-43.9127.3161.2179.40000111M13V11-M13 HydrophobicContact CG1-CG 4.42Å
12T37.8Very low38.9Very low114 Ų114139.2 Ų139.270%0.69981%0.807SS**  trans-127.9107.3160.6-61.70000108.5A10A10-T12 PolarHBondContact O-N 2.82Å
13M34.8Very low38.7Very low176 Ų176136.9 Ų136.987%0.86780%0.803SS**  trans-69.6128.4165-62.2-155.6-163.400108.9V11V11-M13 HydrophobicContact CG1-CG 4.42Å
14M36.3Very low38.2Very low175 Ų175139.1 Ų139.186%0.86281%0.806SS**  trans-105.9110.4164.9-73.6-84.9-165.100107.6
15A37.2Very low37.6Very low97 Ų97138.6 Ų138.680%0.80280%0.803SS**  trans-63.2137.6-179.700000111.9Q17A15-Q17 PolarHBondContact O-N 2.81Å
16T38.8Very low37.4Very low140 Ų140141 Ų14186%0.85981%0.81SS**  trans-63.7114.4168.351.40000109.7S18T16-S18 PolarHBondContact O-N 2.89Å
17Q33.3Very low37.2Very low192 Ų192141.8 Ų141.890%0.89782%0.815SS**  trans-77.7108.7174.9-151.5175.310900108.8A15 V19A15-Q17 PolarHBondContact O-N 2.81Å; Q17-V19 PolarHBondContact O-N 2.88Å
18S33.4Very low36.6Very low112 Ų112145.4 Ų145.478%0.78382%0.822SS**PPolyproline II helixtrans-71.1119177.6-166.80000110.2T16T16-S18 PolarHBondContact O-N 2.89Å
19V39.1Very low36.2Very low134 Ų134146.5 Ų146.581%0.81282%0.823SS**PPolyproline II helixtrans-84.2125.1169.31780000108.3Q17Q17-V19 PolarHBondContact O-N 2.88Å
20P49Very low35.7Very low104 Ų104149.4 Ų149.468%0.67583%0.827SS**PPolyproline II helixtrans-78.2149176.729.7-32.2000112
21P48.4Very low35.8Very low116 Ų116151.8 Ų151.875%0.75383%0.833SS**PPolyproline II helixtrans-72.1153.2-179.729.4-34.2000112.5
22P37.4Very low35.5Very low115 Ų115149.3 Ų149.375%0.74783%0.833SS**PPolyproline II helixtrans-69.4132.5-179.327.3-32.7000112.2Y24P22-Y24 PolarHBondContact O-N 2.85Å
23T32.6Very low35.2Very low142 Ų142150.3 Ų150.387%0.87184%0.839SS**PPolyproline II helixtrans-65.6117.4171.619.90000110.7Q25T23-Q25 PolarHBondContact O-N 3.29Å
24Y29.9Very low35.1Very low234 Ų234148.3 Ų148.392%0.91884%0.837SS**PPolyproline II helixtrans-71.4126168.7-93.7-95000110.4P22P22-Y24 PolarHBondContact O-N 2.85Å
25Q30.7Very low34.8Very low184 Ų184148 Ų14886%0.8683%0.834SS**  trans-87.8107.9180-154.3170.49.300108.6T23 S27T23-Q25 PolarHBondContact O-N 3.29Å; Q25-S27 PolarHBondContact O-N 2.82Å
26E29.8Very low34.6Very low190 Ų190151.9 Ų151.989%0.88884%0.835SS**PPolyproline II helixtrans-65.1122.1177-171.1169.485.100110.2Q28E26-Q28 PolarHBondContact O-N 3.09Å
27S32.5Very low34.2Very low112 Ų112152 Ų15278%0.78383%0.83SS**PPolyproline II helixtrans-79.5116.7-179.7-63.30000110Q25 Q29Q25-S27 PolarHBondContact O-N 2.82Å; S27-Q29 PolarHBondContact O-N 2.96Å
28Q31.9Very low34.1Very low198 Ų198147.2 Ų147.293%0.92582%0.818SS**PPolyproline II helixtrans-55.4124.3174.4-69.1171.254.100111.5E26E26-Q28 PolarHBondContact O-N 3.09Å
29Q34.5Very low33.9Very low192 Ų192151.3 Ų151.390%0.89782%0.822SS**PPolyproline II helixtrans-103.4129.9158.4-103.6172.529.800110S27S27-Q29 PolarHBondContact O-N 2.96Å
30M30.2Very low33.5Very low191 Ų191150.9 Ų150.994%0.94182%0.82SS**PPolyproline II helixtrans-56.3126.8177.1-74.6176.3177.900112
31T35.4Very low33.1Very low141 Ų141151.3 Ų151.387%0.86582%0.822SS**  trans-136.2138.5148.454.90000110
32G32.6Very low32.1Very low76 Ų76154 Ų15478%0.78483%0.825SS**  trans-64.5156.2-163.200000116.5
33T30.3Very low32Very low136 Ų136154.7 Ų154.783%0.83483%0.826SS**  trans-48.9131.4168.847.70000113.9
34T33.3Very low31.8Very low133 Ų133156.1 Ų156.182%0.81682%0.823SS**  trans-162.5100130.9-700000109.9
35Q31Very low32.1Very low170 Ų170152.3 Ų152.379%0.79482%0.817SS**  40138.9128-144.3174.975.300121.8
36Q32.9Very low32.6Very low178 Ų178148.9 Ų148.983%0.83281%0.811SS**  trans100.4141.8165.7-61.1-177.73200114.2
37N29.3Very low32.6Very low142 Ų142144.2 Ų144.276%0.75980%0.804SS**  cis-167.3154.9-16.4176.222.2000104.3
38S32.1Very low32.8Very low91 Ų91143.2 Ų143.264%0.63680%0.803SS**  trans-40.7161.1176.557.80000119.1
39K29.9Very low32.8Very low199 Ų199139.4 Ų139.487%0.86580%0.798SS**  trans97.3107.6151.2-96.8174.3171.6173.60120
40T30.2Very low32.7Very low125 Ų125134.7 Ų134.777%0.76779%0.792SS**  trans-57.8160.2135.344.60000110.1
41P40.8Very low33.3Very low112 Ų112130.9 Ų130.973%0.72779%0.791SS**  cis-149.2-177.635.339.2-16.3000117.7
42Q27.8Very low33.2Very low174 Ų174127.4 Ų127.481%0.81378%0.783SS**  trans76.8113.4145.6-99.8-175.67.800121.9
43V34Very low33.9Very low128 Ų128132 Ų13278%0.77679%0.79SS**  33.8111.8122.8-172.20000117.9
44H28.6Very low34.2Very low173 Ų173132.3 Ų132.380%0.80179%0.786SS**  trans-159.5125.5138.9-136.4-86.7000111.5
45I36.8Very low34.6Very low154 Ų154131.2 Ų131.279%0.7978%0.784SS**  trans-88.4137.7153.9-64.4174.9000105.9
46P41.3Very low35Very low112 Ų112128.4 Ų128.473%0.72778%0.778SS**  -143.8166.4112.228.5-7.3000114.9
47A30.1Very low35.7Very low92 Ų92124.4 Ų124.476%0.7677%0.77SS**  trans-73160.4-167.700000116.6
48A34.9Very low36.6Very low90 Ų90122.4 Ų122.474%0.74476%0.763SS**  trans60.4117.714300000119.4
49S32.2Very low37.7Very low118 Ų118124.5 Ų124.583%0.82577%0.772SS**  161.2153.4100.4-67.20000112.4
50A32.9Very low39.1Very low94 Ų94119.7 Ų119.778%0.77776%0.755SS**  trans88.598157.200000118.4
51A41.8Very low40.9Very low111 Ų111118.8 Ų118.892%0.91775%0.745SS**  39.597.6124.300000117.1
52G34.6Very low42.5Very low68 Ų68118.6 Ų118.670%0.70174%0.744SS**  trans-153.695.6155.300000107.5N54G52-N54 PolarHBondContact O-N 2.99Å
53N46.7Very low44.8Very low172 Ų172115.6 Ų115.692%0.9273%0.73SS**  trans-55.794.6160.2-93.80.8000107.4
54N36.3Very low47Very low142 Ų142112.1 Ų112.176%0.75972%0.715SS**  trans-12799.2156.1-95.2-16.3000105.4G52 V56G52-N54 PolarHBondContact O-N 2.99Å; N54-V56 HydrophobicContact CB-CG2 4.47Å; N54-V56 PolarHBondContact O-N 3.11Å
55S43.1Very low49.3Very low110 Ų110107.5 Ų107.577%0.76969%0.694SS**  trans-55.692151.9175.90000105.8S57S55-S57 PolarHBondContact O-N 3.35Å
56V39.3Very low51.4Low111 Ų111105.2 Ų105.267%0.67368%0.682SS**  trans-68.693.5166.9-177.80000103.8N54 V58N54-V56 HydrophobicContact CB-CG2 4.47Å; N54-V56 PolarHBondContact O-N 3.11Å; V56-V58 HydrophobicContact CG1-CG2 4.14Å; V56-V58 PolarHBondContact O-N 3.29Å
57S46.1Very low53.3Low95 Ų95104.2 Ų104.266%0.66467%0.668SS**  trans-6291.6161.4-56.60000105S55 T59S55-S57 PolarHBondContact O-N 3.35Å; S57-T59 VanDerWaalsContact C-N 3.29Å; S57-T59 PolarHBondContact O-N 3.21Å
58V48.3Very low55.5Low99 Ų99102.9 Ų102.960%0.665%0.653SS**  trans-61.2102170.4-179.40000104.6V56 L60V56-V58 HydrophobicContact CG1-CG2 4.14Å; V56-V58 PolarHBondContact O-N 3.29Å; V58-L60 HydrophobicContact CB-CD1 3.97Å; V58-L60 HydrophobicContact CG1-CD1 3.54Å; V58-L60 HydrophobicContact CG1-CG 3.86Å; V58-L60 PolarHBondContact O-N 2.97Å
59T56.1Low57.6Low135 Ų135102.2 Ų102.283%0.82864%0.637SS**  trans-68.281.5165.351.70000105.9S57 D61S57-T59 VanDerWaalsContact C-N 3.29Å; S57-T59 PolarHBondContact O-N 3.21Å; T59-D61 PolarHBondContact O-N 3Å
60L58.9Low59.9Low99 Ų99102.4 Ų102.452%0.51862%0.623SS.*  trans-60.8125166.7-83.1106.3000106.5V58 P62V58-L60 HydrophobicContact CB-CD1 3.97Å; V58-L60 HydrophobicContact CG1-CD1 3.54Å; V58-L60 HydrophobicContact CG1-CG 3.86Å; V58-L60 PolarHBondContact O-N 2.97Å; L60-P62 VanDerWaalsContact O-CD 3.27Å; L60-P62 WeakPolarHBondContact O-CD 3.42Å
61D68.1Low62.1Low105 Ų105106.3 Ų106.356%0.56162%0.618SS**  trans-48.5114.9171.4-172.6-15.8000108.1T59 Q63 A64 Q65T59-D61 PolarHBondContact O-N 3Å; D61-Q63 PolarHBondContact O-N 3.37Å; D61-Q63 PolarHBondContact OD1-N 2.82Å; D61-A64 HydrophobicContact CB-CB 4.08Å; D61-A64 PolarHBondContact O-N 3.18Å; D61-Q65 PolarHBondContact O-N 3.41Å; D61-Q65 VanDerWaalsContact O-N 3.11Å
62P74.4Confident63.7Low108 Ų108103.8 Ų103.870%0.70160%0.597SS**Hα-helixtrans-54.9-27.1-173.7-27.635000113L60 L66L60-P62 VanDerWaalsContact O-CD 3.27Å; L60-P62 WeakPolarHBondContact O-CD 3.42Å; P62-L66 WeakPolarHBondContact O-CB 3.27Å; P62-L66 PolarHBondContact O-N 2.86Å; P62-L66 VanDerWaalsContact O-N 3.09Å
63Q75.8Confident65.7Low112 Ų112105.2 Ų105.252%0.52359%0.592SS.*Hα-helixtrans-74.3-40.9177.9-171.167.8-0.400112.5D61 Q65 L66 E67D61-Q63 PolarHBondContact O-N 3.37Å; D61-Q63 PolarHBondContact OD1-N 2.82Å; Q63-Q65 VanDerWaalsContact C-N 3.33Å; Q63-L66 PolarHBondContact O-N 3.47Å; Q63-E67 PolarHBondContact O-N 3Å
64A80.2Confident67.2Low55 Ų55103.1 Ų103.146%0.45557%0.572SS.*Hα-helixtrans-68.3-35.6177.300000111.4D61 S68D61-A64 HydrophobicContact CB-CB 4.08Å; D61-A64 PolarHBondContact O-N 3.18Å; A64-S68 WeakPolarHBondContact O-CB 3.43Å; A64-S68 PolarHBondContact O-N 3.1Å
65Q77.7Confident69.3Low76 Ų7699.3 Ų99.336%0.35556%0.556SS.*Hα-helixtrans-65.2-45.8173.3-173.662.825.800111.2D61 Q63 E67 S68 D69D61-Q65 PolarHBondContact O-N 3.41Å; D61-Q65 VanDerWaalsContact O-N 3.11Å; Q63-Q65 VanDerWaalsContact C-N 3.33Å; Q65-E67 VanDerWaalsContact C-N 3.34Å; Q65-E67 PolarHBondContact O-N 3.16Å; Q65-S68 WeakPolarHBondContact O-CB 3.15Å; Q65-S68 PolarHBondContact O-N 3.15Å; Q65-D69 PolarHBondContact NE2-OD1 3.3Å; Q65-D69 WeakPolarHBondContact O-CB 3.48Å; Q65-D69 VanDerWaalsContact O-CG 3.22Å; Q65-D69 PolarHBondContact O-N 3.25Å
66L80.8Confident70.9Confident105 Ų10598.1 Ų98.155%0.5554%0.538SS..Hα-helixtrans-61.8-40.3177.6-176.866.3000112.5P62 Q63 K70P62-L66 WeakPolarHBondContact O-CB 3.27Å; P62-L66 PolarHBondContact O-N 2.86Å; P62-L66 VanDerWaalsContact O-N 3.09Å; Q63-L66 PolarHBondContact O-N 3.47Å; L66-K70 WeakPolarHBondContact O-CB 3.35Å; L66-K70 PolarHBondContact O-N 3.19Å
67E81.1Confident72.7Confident92 Ų9295 Ų9543%0.4352%0.516SS..Hα-helixtrans-67.8-36.8175.5-77.3-172.1-177.400112.6Q63 Q65 R71Q63-E67 PolarHBondContact O-N 3Å; Q65-E67 VanDerWaalsContact C-N 3.34Å; Q65-E67 PolarHBondContact O-N 3.16Å; E67-R71 WeakPolarHBondContact O-CB 3.46Å; E67-R71 VanDerWaalsContact O-CG 3.3Å; E67-R71 WeakPolarHBondContact O-CG 3.47Å; E67-R71 PolarHBondContact O-N 3.4Å
68S77.1Confident74.2Confident64 Ų6496.3 Ų96.345%0.44851%0.511SS..Hα-helixtrans-65.7-46.7174-174.10000111.4A64 Q65 K70 R71 A72A64-S68 WeakPolarHBondContact O-CB 3.43Å; A64-S68 PolarHBondContact O-N 3.1Å; Q65-S68 WeakPolarHBondContact O-CB 3.15Å; Q65-S68 PolarHBondContact O-N 3.15Å; S68-K70 VanDerWaalsContact C-N 3.34Å; S68-K70 PolarHBondContact O-N 2.74Å; S68-R71 PolarHBondContact O-N 3.02Å; S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 3.48Å
69D77.4Confident75.7Confident76 Ų76101.6 Ų101.641%0.40652%0.521SS..Hα-helixtrans-62.5-43.3177.3-69.2-10.5000110.5Q65 R71 A72 V73Q65-D69 PolarHBondContact NE2-OD1 3.3Å; Q65-D69 WeakPolarHBondContact O-CB 3.48Å; Q65-D69 VanDerWaalsContact O-CG 3.22Å; Q65-D69 PolarHBondContact O-N 3.25Å; D69-R71 PolarHBondContact O-N 3.08Å; D69-A72 PolarHBondContact O-N 2.91Å; D69-V73 VanDerWaalsContact O-CG2 3.3Å; D69-V73 WeakPolarHBondContact O-CG2 3.5Å; D69-V73 PolarHBondContact O-N 3.22Å
70K80.6Confident76.9Confident122 Ų12295.4 Ų95.453%0.5348%0.482SS..Hα-helixtrans-56.9-48.3173-178176.5177.4-177.70111.1L66 S68 A72 V73 Y74L66-K70 WeakPolarHBondContact O-CB 3.35Å; L66-K70 PolarHBondContact O-N 3.19Å; S68-K70 VanDerWaalsContact C-N 3.34Å; S68-K70 PolarHBondContact O-N 2.74Å; K70-A72 VanDerWaalsContact C-N 3.35Å; K70-A72 PolarHBondContact O-N 3.07Å; K70-V73 PolarHBondContact O-N 3.3Å; K70-Y74 HydrophobicContact CD-CE2 4.05Å; K70-Y74 VanDerWaalsContact CE-CE2 3.44Å; K70-Y74 HydrophobicContact CG-CD2 3.72Å; K70-Y74 HydrophobicContact CG-CE2 3.4Å; K70-Y74 VanDerWaalsContact CG-CE2 3.4Å; K70-Y74 WeakPolarHBondContact O-CD2 3.37Å; K70-Y74 PolarHBondContact O-N 3.31Å
71R79.8Confident77.9Confident175 Ų17592 Ų9266%0.6647%0.466SS*.Hα-helixtrans-63.5-38.1177.6-76176.7-176.1149.37.4112.6E67 S68 D69 Y74 S75E67-R71 WeakPolarHBondContact O-CB 3.46Å; E67-R71 VanDerWaalsContact O-CG 3.3Å; E67-R71 WeakPolarHBondContact O-CG 3.47Å; E67-R71 PolarHBondContact O-N 3.4Å; S68-R71 PolarHBondContact O-N 3.02Å; D69-R71 PolarHBondContact O-N 3.08Å; R71-Y74 PolarHBondContact O-N 2.95Å; R71-S75 WeakPolarHBondContact O-CB 3.45Å; R71-S75 PolarHBondContact O-N 3.35Å
72A76Confident78.7Confident58 Ų5887 Ų8748%0.47944%0.439SS..Hα-helixtrans-63.6-4617600000111.1S68 D69 K70 Y74 S75 H76S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 3.48Å; D69-A72 PolarHBondContact O-N 2.91Å; K70-A72 VanDerWaalsContact C-N 3.35Å; K70-A72 PolarHBondContact O-N 3.07Å; A72-Y74 PolarHBondContact O-N 3.25Å; A72-S75 PolarHBondContact O-N 3.49Å; A72-H76 WeakPolarHBondContact O-CB 3.49Å; A72-H76 PolarHBondContact O-N 2.9Å
73V76.6Confident79.3Confident98 Ų9885.1 Ų85.159%0.59442%0.42SS*.Hα-helixtrans-61.8-44.5175.9173.50000111.3D69 K70 S75 H76 F77D69-V73 VanDerWaalsContact O-CG2 3.3Å; D69-V73 WeakPolarHBondContact O-CG2 3.5Å; D69-V73 PolarHBondContact O-N 3.22Å; K70-V73 PolarHBondContact O-N 3.3Å; V73-S75 PolarHBondContact O-N 2.86Å; V73-H76 PolarHBondContact O-N 3.45Å; V73-F77 WeakPolarHBondContact O-CB 3.39Å; V73-F77 PolarHBondContact O-N 3.27Å
74Y77.5Confident79.9Confident129 Ų12982.9 Ų82.951%0.50642%0.415SS..Hα-helixtrans-63.7-39.2175.8-81.5-67.2000112.9K70 R71 A72 H76 F77 Q78K70-Y74 HydrophobicContact CD-CE2 4.05Å; K70-Y74 VanDerWaalsContact CE-CE2 3.44Å; K70-Y74 HydrophobicContact CG-CD2 3.72Å; K70-Y74 HydrophobicContact CG-CE2 3.4Å; K70-Y74 VanDerWaalsContact CG-CE2 3.4Å; K70-Y74 WeakPolarHBondContact O-CD2 3.37Å; K70-Y74 PolarHBondContact O-N 3.31Å; R71-Y74 PolarHBondContact O-N 2.95Å; A72-Y74 PolarHBondContact O-N 3.25Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; Y74-F77 PolarHBondContact O-N 2.82Å; Y74-Q78 WeakPolarHBondContact O-CB 3.3Å; Y74-Q78 WeakPolarHBondContact O-CG 3.05Å; Y74-Q78 PolarHBondContact O-N 2.82Å
75S79.5Confident80.3Confident61 Ų6180.4 Ų80.443%0.42739%0.394SS..Hα-helixtrans-64.2-41.5176-170.90000111R71 A72 V73 Q78 R79R71-S75 WeakPolarHBondContact O-CB 3.45Å; R71-S75 PolarHBondContact O-N 3.35Å; A72-S75 PolarHBondContact O-N 3.49Å; V73-S75 PolarHBondContact O-N 2.86Å; S75-Q78 PolarHBondContact O-N 3.02Å; S75-R79 VanDerWaalsContact O-CG 3.31Å; S75-R79 WeakPolarHBondContact O-CG 3.3Å; S75-R79 PolarHBondContact O-N 3.45Å; S75-R79 VanDerWaalsContact O-N 3.13Å
76H77.1Confident80.8Confident86 Ų8677.5 Ų77.540%0.39838%0.382SS..Hα-helixtrans-63.5-43.9176.6-156-118.4000111.5A72 V73 Y74 R79 H80 D130 L133A72-H76 WeakPolarHBondContact O-CB 3.49Å; A72-H76 PolarHBondContact O-N 2.9Å; V73-H76 PolarHBondContact O-N 3.45Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; H76-R79 PolarHBondContact O-N 3.43Å; H76-H80 PolarHBondContact O-N 2.95Å; H76-D130 IonicContact CE1-OD2 3.95Å; H76-L133 HydrophobicContact CB-CD2 4.39Å; H76-L133 WeakPolarHBondContact ND1-CD2 3.47Å
77F77.6Confident81.2Confident45 Ų4574.5 Ų74.520%0.19737%0.372CS..Hα-helixtrans-62.7-43176.7-161.1-84.8000112.8V73 Y74 R79 H80 F83 L86 L133 L136 M137V73-F77 WeakPolarHBondContact O-CB 3.39Å; V73-F77 PolarHBondContact O-N 3.27Å; Y74-F77 PolarHBondContact O-N 2.82Å; F77-R79 VanDerWaalsContact C-N 3.3Å; F77-R79 PolarHBondContact O-N 3.4Å; F77-H80 WeakPolarHBondContact O-CB 3.47Å; F77-H80 PolarHBondContact O-N 3.37Å; F77-F83 AromaticContact CD1-CD2 3.71Å; F77-F83 HydrophobicContact CD1-CD2 3.71Å; F77-F83 HydrophobicContact CD1-CE2 4.04Å; F77-F83 AromaticContact CE1-CD2 3.88Å; F77-F83 HydrophobicContact CE1-CD2 3.88Å; F77-F83 HydrophobicContact CE1-CE2 4.19Å; F77-L86 HydrophobicContact CE1-CD2 3.47Å; F77-L86 VanDerWaalsContact CE1-CD2 3.47Å; F77-L86 HydrophobicContact CZ-CD2 3.47Å; F77-L86 VanDerWaalsContact CZ-CD2 3.47Å; F77-L133 HydrophobicContact CD2-CD1 3.54Å; F77-L133 HydrophobicContact CE2-CD1 4.13Å; F77-L133 HydrophobicContact CG-CD1 4.43Å; F77-L136 HydrophobicContact CE2-CD2 4.42Å; F77-M137 HydrophobicContact CD1-SD 4.03Å; F77-M137 HydrophobicContact CD2-SD 3.64Å; F77-M137 HydrophobicContact CE1-CE 4.06Å; F77-M137 HydrophobicContact CE1-SD 3.58Å; F77-M137 VanDerWaalsContact CE1-SD 3.58Å; F77-M137 HydrophobicContact CE2-CG 4.36Å; F77-M137 HydrophobicContact CE2-SD 3.12Å; F77-M137 WeakPolarHBondContact CE2-SD 3.42Å; F77-M137 HydrophobicContact CG-SD 4.06Å; F77-M137 HydrophobicContact CZ-CE 4.08Å; F77-M137 HydrophobicContact CZ-SD 3.09Å; F77-M137 WeakPolarHBondContact CZ-SD 3.46Å
78Q78.1Confident81.6Confident122 Ų12273.5 Ų73.557%0.5737%0.369SS*.Hα-helixtrans-69.9-25.8179.1-75.2176.628.800113.4Y74 S75 H80 F83Y74-Q78 WeakPolarHBondContact O-CB 3.3Å; Y74-Q78 WeakPolarHBondContact O-CG 3.05Å; Y74-Q78 PolarHBondContact O-N 2.82Å; S75-Q78 PolarHBondContact O-N 3.02Å; Q78-H80 VanDerWaalsContact C-N 3.29Å; Q78-F83 HydrophobicContact CG-CE2 4.23Å; Q78-F83 HydrophobicContact CG-CZ 4.14Å
79R78.6Confident82.1Confident210 Ų21070.4 Ų70.479%0.79235%0.348SS*.THydrogen-bonded Turntrans-85.3-5.4174.8-65.4-170.393.495.46.2112.9S75 H76 F77S75-R79 VanDerWaalsContact O-CG 3.31Å; S75-R79 WeakPolarHBondContact O-CG 3.3Å; S75-R79 PolarHBondContact O-N 3.45Å; S75-R79 VanDerWaalsContact O-N 3.13Å; H76-R79 PolarHBondContact O-N 3.43Å; F77-R79 VanDerWaalsContact C-N 3.3Å; F77-R79 PolarHBondContact O-N 3.4Å
80H81.3Confident82.7Confident5 Ų572.9 Ų72.92%0.02336%0.355CS..SBendtrans-67.3135.2-176.8-168.4-80.9000111.2H76 F77 Q78 L82 F83 S128 L133 D134 M137H76-H80 PolarHBondContact O-N 2.95Å; F77-H80 WeakPolarHBondContact O-CB 3.47Å; F77-H80 PolarHBondContact O-N 3.37Å; Q78-H80 VanDerWaalsContact C-N 3.29Å; H80-L82 WeakPolarHBondContact ND1-CB 3.05Å; H80-L82 PolarHBondContact ND1-N 3.01Å; H80-L82 PolarHBondContact O-N 3.08Å; H80-L82 VanDerWaalsContact O-N 3.14Å; H80-F83 WeakPolarHBondContact O-CB 3.2Å; H80-F83 PolarHBondContact O-N 3.34Å; H80-S128 PolarHBondContact CD2-OG 3.04Å; H80-L133 HydrophobicContact CB-CD2 4.45Å; H80-D134 IonicContact CD2-OD1 2.7Å; H80-D134 IonicContact CE1-OD1 3.85Å; H80-D134 IonicContact NE2-OD1 3.48Å; H80-D134 PolarHBondContact NE2-OD1 3.47Å; H80-M137 HydrophobicContact CB-CE 4.19Å; H80-M137 HydrophobicContact CB-CG 4.48Å
81P81.5Confident83.2Confident27 Ų2771.8 Ų71.818%0.17535%0.351CS..THydrogen-bonded Turntrans-55-36.6-177.5-25.432.1000113.9F83 P84 F115 Q119 P125P81-F83 VanDerWaalsContact C-N 3.33Å; P81-F83 PolarHBondContact O-N 3.44Å; P81-P84 VanDerWaalsContact O-CD 3.27Å; P81-P84 WeakPolarHBondContact O-CD 3.25Å; P81-F115 WeakPolarHBondContact O-CZ 3.3Å; P81-Q119 PolarHBondContact O-NE2 3.38Å; P81-P125 VanDerWaalsContact CB-O 3.23Å; P81-P125 WeakPolarHBondContact CB-O 3.46Å; P81-P125 WeakPolarHBondContact CG-O 3.23Å
82L84.6Confident83.5Confident1 Ų165 Ų651%0.00533%0.327CS..THydrogen-bonded Turntrans-77.5-6.3177.4-58.9177.3000115.5H80 L85 L86 F115 M137 V138 I141 W380H80-L82 WeakPolarHBondContact ND1-CB 3.05Å; H80-L82 PolarHBondContact ND1-N 3.01Å; H80-L82 PolarHBondContact O-N 3.08Å; H80-L82 VanDerWaalsContact O-N 3.14Å; L82-L85 PolarHBondContact O-N 3.29Å; L82-L86 PolarHBondContact O-N 2.82Å; L82-L86 VanDerWaalsContact O-N 3.11Å; L82-F115 HydrophobicContact CD2-CE1 3.98Å; L82-F115 HydrophobicContact CD2-CZ 4.28Å; L82-M137 HydrophobicContact CB-CB 4.38Å; L82-M137 HydrophobicContact CB-CE 4.04Å; L82-M137 HydrophobicContact CD1-CB 4.06Å; L82-V138 HydrophobicContact CD1-CG2 3.95Å; L82-I141 HydrophobicContact CB-CD1 4.01Å; L82-I141 HydrophobicContact CD1-CD1 4.37Å; L82-W380 HydrophobicContact CD1-CH2 4.19Å; L82-W380 HydrophobicContact CD2-CH2 4.33Å; L82-W380 HydrophobicContact CD2-CZ3 4.09Å
83F86.7Confident84.1Confident68 Ų6862.7 Ų62.730%0.29831%0.307SS..Hα-helixtrans-59.5-43.8-177.1178.4-98000114F77 Q78 H80 P81 L85 L86 A87 M137F77-F83 AromaticContact CD1-CD2 3.71Å; F77-F83 HydrophobicContact CD1-CD2 3.71Å; F77-F83 HydrophobicContact CD1-CE2 4.04Å; F77-F83 AromaticContact CE1-CD2 3.88Å; F77-F83 HydrophobicContact CE1-CD2 3.88Å; F77-F83 HydrophobicContact CE1-CE2 4.19Å; Q78-F83 HydrophobicContact CG-CE2 4.23Å; Q78-F83 HydrophobicContact CG-CZ 4.14Å; H80-F83 WeakPolarHBondContact O-CB 3.2Å; H80-F83 PolarHBondContact O-N 3.34Å; P81-F83 VanDerWaalsContact C-N 3.33Å; P81-F83 PolarHBondContact O-N 3.44Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 2.73Å; F83-L86 PolarHBondContact O-N 2.85Å; F83-A87 WeakPolarHBondContact O-CB 3.31Å; F83-A87 PolarHBondContact O-N 2.93Å; F83-M137 HydrophobicContact CB-CE 4.1Å
84P87.8Confident84.7Confident65 Ų6562.5 Ų62.542%0.42230%0.3SS..Hα-helixtrans-58.6-39.7177.4-24.235.5000112.7P81 A87 L88 F115P81-P84 VanDerWaalsContact O-CD 3.27Å; P81-P84 WeakPolarHBondContact O-CD 3.25Å; P84-A87 PolarHBondContact O-N 3.42Å; P84-L88 VanDerWaalsContact O-CG 3.31Å; P84-L88 WeakPolarHBondContact O-CG 2.99Å; P84-L88 PolarHBondContact O-N 2.95Å; P84-F115 HydrophobicContact CB-CE2 4.22Å; P84-F115 HydrophobicContact CG-CE2 4.42Å
85L88.1Confident85.1Confident3 Ų359.9 Ų59.92%0.01629%0.292CS..Hα-helixtrans-67.4-41.1178.2-173.665.2000111.8L82 F83 L89 F108 I112 F115 I141L82-L85 PolarHBondContact O-N 3.29Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 2.73Å; L85-L89 WeakPolarHBondContact O-CB 3.38Å; L85-L89 PolarHBondContact O-N 2.78Å; L85-F108 HydrophobicContact CD1-CE2 3.88Å; L85-F108 HydrophobicContact CD1-CZ 3.93Å; L85-F108 HydrophobicContact CG-CE2 4.49Å; L85-F108 HydrophobicContact CG-CZ 4.18Å; L85-I112 HydrophobicContact CD1-CG1 4Å; L85-I112 HydrophobicContact CD2-CG1 4.35Å; L85-F115 HydrophobicContact CB-CD1 4.3Å; L85-F115 HydrophobicContact CB-CD2 4.21Å; L85-F115 HydrophobicContact CB-CE1 4.3Å; L85-F115 HydrophobicContact CB-CE2 4.21Å; L85-F115 HydrophobicContact CB-CG 4.24Å; L85-F115 HydrophobicContact CB-CZ 4.24Å; L85-F115 HydrophobicContact CD1-CB 4.2Å; L85-F115 HydrophobicContact CD1-CG 4.29Å; L85-F115 HydrophobicContact CD2-CD1 4.04Å; L85-F115 HydrophobicContact CD2-CE1 4.27Å; L85-I141 HydrophobicContact CD2-CD1 4.3Å
86L88.9Confident85.4Confident16 Ų1658.4 Ų58.48%0.08428%0.284CS..Hα-helixtrans-63.3-42.5175-178.872.4000111.7F77 L82 F83 L89 F90 M137 A140 I141 L144F77-L86 HydrophobicContact CE1-CD2 3.47Å; F77-L86 VanDerWaalsContact CE1-CD2 3.47Å; F77-L86 HydrophobicContact CZ-CD2 3.47Å; F77-L86 VanDerWaalsContact CZ-CD2 3.47Å; L82-L86 PolarHBondContact O-N 2.82Å; L82-L86 VanDerWaalsContact O-N 3.11Å; F83-L86 PolarHBondContact O-N 2.85Å; L86-L89 PolarHBondContact O-N 2.84Å; L86-F90 PolarHBondContact O-N 3.44Å; L86-M137 HydrophobicContact CB-CE 4.28Å; L86-M137 HydrophobicContact CD2-CE 3.89Å; L86-M137 HydrophobicContact CD2-SD 4.23Å; L86-A140 HydrophobicContact CD1-CB 3.91Å; L86-I141 HydrophobicContact CB-CD1 4.4Å; L86-I141 HydrophobicContact CB-CG1 4.01Å; L86-I141 HydrophobicContact CD1-CG1 3.67Å; L86-I141 HydrophobicContact CG-CG1 4.43Å; L86-L144 HydrophobicContact CD1-CD1 3.55Å
87A89.8Confident85.7Confident42 Ų4258.4 Ų58.435%0.34729%0.289SS..Hα-helixtrans-64-45.6178.200000111.7F83 P84 L89 F90 E91F83-A87 WeakPolarHBondContact O-CB 3.31Å; F83-A87 PolarHBondContact O-N 2.93Å; P84-A87 PolarHBondContact O-N 3.42Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 PolarHBondContact O-N 2.91Å; A87-F90 WeakPolarHBondContact O-CB 3.34Å; A87-F90 PolarHBondContact O-N 3.41Å; A87-F90 VanDerWaalsContact O-N 3.17Å; A87-E91 PolarHBondContact O-N 3.25Å
88L88.4Confident85.9Confident70 Ų7062.3 Ų62.337%0.36631%0.308SS..Hα-helixtrans-59.2-41.3175-74.7170.9000112.1P84 F90 E91 K92P84-L88 VanDerWaalsContact O-CG 3.31Å; P84-L88 WeakPolarHBondContact O-CG 2.99Å; P84-L88 PolarHBondContact O-N 2.95Å; L88-F90 VanDerWaalsContact C-N 3.34Å; L88-E91 PolarHBondContact O-N 3.31Å; L88-K92 WeakPolarHBondContact O-CG 3.38Å; L88-K92 PolarHBondContact O-N 2.92Å
89L89.4Confident85.6Confident0 Ų060 Ų600%032%0.317CS..Hα-helixtrans-65.9-39.2177-175.854.8000112L85 L86 A87 K92 C93 F108 I141 L144 R145 L148L85-L89 WeakPolarHBondContact O-CB 3.38Å; L85-L89 PolarHBondContact O-N 2.78Å; L86-L89 PolarHBondContact O-N 2.84Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 PolarHBondContact O-N 2.91Å; L89-K92 PolarHBondContact O-N 3.46Å; L89-C93 PolarHBondContact O-N 3.31Å; L89-C93 PolarHBondContact O-SG 2.95Å; L89-F108 HydrophobicContact CB-CD2 4.4Å; L89-F108 HydrophobicContact CB-CE2 3.61Å; L89-F108 HydrophobicContact CB-CZ 3.69Å; L89-F108 HydrophobicContact CD1-CD1 3.86Å; L89-F108 HydrophobicContact CD1-CD2 3.89Å; L89-F108 HydrophobicContact CD1-CE1 3.73Å; L89-F108 HydrophobicContact CD1-CE2 3.79Å; L89-F108 HydrophobicContact CD1-CG 3.93Å; L89-F108 HydrophobicContact CD1-CZ 3.72Å; L89-F108 HydrophobicContact CD2-CE1 3.89Å; L89-F108 HydrophobicContact CD2-CE2 4.43Å; L89-F108 HydrophobicContact CD2-CZ 3.71Å; L89-F108 HydrophobicContact CG-CE1 4.26Å; L89-F108 HydrophobicContact CG-CE2 4.13Å; L89-F108 HydrophobicContact CG-CZ 3.9Å; L89-I141 HydrophobicContact CD2-CG2 4.09Å; L89-I141 WeakPolarHBondContact CD2-O 3.47Å; L89-L144 HydrophobicContact CD2-CB 3.51Å; L89-L144 HydrophobicContact CG-CB 3.82Å; L89-R145 HydrophobicContact CD2-CB 4.26Å; L89-L148 HydrophobicContact CD1-CB 4.43Å; L89-L148 HydrophobicContact CD1-CD2 3.8Å
90F89.7Confident84.6Confident127 Ų12753.2 Ų53.256%0.55730%0.302SS*.Hα-helixtrans-64.2-44.6176.5-158.3-86.4000111.3L86 A87 L88 K92 C93 E94 L144L86-F90 PolarHBondContact O-N 3.44Å; A87-F90 WeakPolarHBondContact O-CB 3.34Å; A87-F90 PolarHBondContact O-N 3.41Å; A87-F90 VanDerWaalsContact O-N 3.17Å; L88-F90 VanDerWaalsContact C-N 3.34Å; F90-K92 PolarHBondContact O-N 3.41Å; F90-C93 WeakPolarHBondContact O-CB 3.31Å; F90-C93 PolarHBondContact O-N 3.11Å; F90-E94 WeakPolarHBondContact O-CB 3.27Å; F90-E94 PolarHBondContact O-N 3.38Å; F90-L144 HydrophobicContact CD2-CD1 3.96Å; F90-L144 HydrophobicContact CD2-CD2 4.18Å; F90-L144 HydrophobicContact CE2-CD2 4.48Å
91E89.6Confident83.5Confident99 Ų9960.7 Ų60.746%0.46334%0.337SS..Hα-helixtrans-59.1-44.8175.3-174.5-179.6177.100111.4A87 L88 C93 E94 Q95A87-E91 PolarHBondContact O-N 3.25Å; L88-E91 PolarHBondContact O-N 3.31Å; E91-C93 PolarHBondContact O-N 3.23Å; E91-E94 WeakPolarHBondContact O-CB 3.42Å; E91-E94 PolarHBondContact O-N 2.94Å; E91-Q95 HydrophobicContact CG-CG 4.5Å; E91-Q95 VanDerWaalsContact O-CG 3.3Å; E91-Q95 WeakPolarHBondContact O-CG 3.07Å; E91-Q95 PolarHBondContact O-N 3.27Å; E91-Q95 PolarHBondContact OE1-NE2 3.47Å
92K87.5Confident82.6Confident34 Ų3463.2 Ų63.215%0.14835%0.354CS..Hα-helixtrans-63.5-39.9175.3-75.7-174.3-169.8-93.60113.2L88 L89 F90 E94 A96 I103 S107 F108 D111 L148L88-K92 WeakPolarHBondContact O-CG 3.38Å; L88-K92 PolarHBondContact O-N 2.92Å; L89-K92 PolarHBondContact O-N 3.46Å; F90-K92 PolarHBondContact O-N 3.41Å; K92-E94 VanDerWaalsContact C-N 3.31Å; K92-A96 VanDerWaalsContact O-CB 3.3Å; K92-A96 WeakPolarHBondContact O-CB 3.45Å; K92-A96 PolarHBondContact O-N 3.27Å; K92-I103 HydrophobicContact CB-CG2 4.25Å; K92-S107 PolarHBondContact NZ-OG 2.97Å; K92-S107 VanDerWaalsContact NZ-OG 3.14Å; K92-F108 HydrophobicContact CD-CB 4.16Å; K92-F108 HydrophobicContact CD-CD2 4.1Å; K92-D111 WeakPolarHBondContact CE-OD2 3.39Å; K92-D111 IonicContact NZ-OD2 2.68Å; K92-D111 PolarHBondContact NZ-OD2 3.44Å; K92-L148 HydrophobicContact CB-CD1 4.43Å; K92-L148 HydrophobicContact CB-CD2 4.4Å
93C88.3Confident81.9Confident8 Ų864 Ų645%0.05436%0.358CS..Hα-helixtrans-61.6-44174.4-67.60000110.7L89 F90 E91 A96 T97L89-C93 PolarHBondContact O-N 3.31Å; L89-C93 PolarHBondContact O-SG 2.95Å; F90-C93 WeakPolarHBondContact O-CB 3.31Å; F90-C93 PolarHBondContact O-N 3.11Å; E91-C93 PolarHBondContact O-N 3.23Å; C93-A96 PolarHBondContact O-N 3.48Å; C93-T97 WeakPolarHBondContact O-CG2 3.32Å; C93-T97 PolarHBondContact O-N 3.32Å; C93-T97 PolarHBondContact O-OG1 2.85Å
94E88.6Confident81.4Confident95 Ų9563 Ų6344%0.44436%0.358SS..Hα-helixtrans-61.2-51.1177.4179.7175.3-170.200111.3F90 E91 K92 A96 T97 Q98F90-E94 WeakPolarHBondContact O-CB 3.27Å; F90-E94 PolarHBondContact O-N 3.38Å; E91-E94 WeakPolarHBondContact O-CB 3.42Å; E91-E94 PolarHBondContact O-N 2.94Å; K92-E94 VanDerWaalsContact C-N 3.31Å; E94-A96 VanDerWaalsContact C-N 3.26Å; E94-A96 PolarHBondContact O-N 3.35Å; E94-T97 PolarHBondContact O-N 3.45Å; E94-T97 PolarHBondContact O-OG1 3.32Å; E94-Q98 WeakPolarHBondContact O-CG 3.26Å; E94-Q98 PolarHBondContact O-N 3.27Å; E94-Q98 PolarHBondContact OE1-NE2 2.97Å
95Q86.7Confident80.8Confident74 Ų7461.1 Ų61.135%0.34635%0.346SS..Hα-helixtrans-59.1-38.7177.7-65.4171.83.300111.5E91 T97 Q98 G99 I103E91-Q95 HydrophobicContact CG-CG 4.5Å; E91-Q95 VanDerWaalsContact O-CG 3.3Å; E91-Q95 WeakPolarHBondContact O-CG 3.07Å; E91-Q95 PolarHBondContact O-N 3.27Å; E91-Q95 PolarHBondContact OE1-NE2 3.47Å; Q95-T97 VanDerWaalsContact C-N 3.28Å; Q95-T97 PolarHBondContact O-N 3.44Å; Q95-Q98 PolarHBondContact O-N 2.98Å; Q95-Q98 VanDerWaalsContact O-N 3.11Å; Q95-G99 PolarHBondContact O-N 3.28Å; Q95-I103 HydrophobicContact CB-CD1 3.24Å; Q95-I103 HydrophobicContact CB-CG1 4.49Å
96A85.3Confident80.5Confident30 Ų3063.7 Ų63.725%0.24837%0.368CS..Hα-helixtrans-63.7-34176.600000112.1K92 C93 E94 I103 L148 L151K92-A96 VanDerWaalsContact O-CB 3.3Å; K92-A96 WeakPolarHBondContact O-CB 3.45Å; K92-A96 PolarHBondContact O-N 3.27Å; C93-A96 PolarHBondContact O-N 3.48Å; E94-A96 VanDerWaalsContact C-N 3.26Å; E94-A96 PolarHBondContact O-N 3.35Å; A96-I103 HydrophobicContact CB-CB 4.36Å; A96-I103 HydrophobicContact CB-CD1 4.05Å; A96-I103 HydrophobicContact CB-CG2 4.48Å; A96-L148 HydrophobicContact CB-CD1 4.08Å; A96-L151 HydrophobicContact CB-CB 4.39Å; A96-L151 HydrophobicContact CB-CD1 4.1Å
97T84.5Confident80.2Confident85 Ų8564.7 Ų64.752%0.52138%0.376SS..Hα-helixtrans-76.6-24.1174.158.90000114.1C93 E94 Q95 G99 L151C93-T97 WeakPolarHBondContact O-CG2 3.32Å; C93-T97 PolarHBondContact O-N 3.32Å; C93-T97 PolarHBondContact O-OG1 2.85Å; E94-T97 PolarHBondContact O-N 3.45Å; E94-T97 PolarHBondContact O-OG1 3.32Å; Q95-T97 VanDerWaalsContact C-N 3.28Å; Q95-T97 PolarHBondContact O-N 3.44Å; T97-G99 VanDerWaalsContact C-N 3.26Å; T97-G99 PolarHBondContact O-N 2.93Å; T97-L151 HydrophobicContact CG2-CD1 3.71Å; T97-L151 HydrophobicContact CG2-CD2 3.96Å
98Q81.7Confident80Confident127 Ų12762.7 Ų62.759%0.59336%0.36SS*.Hα-helixtrans-78.2-8.6178.2-68.6-17723.800113.2E94 Q95 S100E94-Q98 WeakPolarHBondContact O-CG 3.26Å; E94-Q98 PolarHBondContact O-N 3.27Å; E94-Q98 PolarHBondContact OE1-NE2 2.97Å; Q95-Q98 PolarHBondContact O-N 2.98Å; Q95-Q98 VanDerWaalsContact O-N 3.11Å; Q98-S100 PolarHBondContact O-N 3.02Å
99G70.6Confident79.9Confident73 Ų7361.6 Ų61.675%0.75335%0.354SS*.THydrogen-bonded Turntrans72.112.6176.800000114.3Q95 T97Q95-G99 PolarHBondContact O-N 3.28Å; T97-G99 VanDerWaalsContact C-N 3.26Å; T97-G99 PolarHBondContact O-N 2.93Å
100S57.7Low79.8Confident68 Ų6865.2 Ų65.248%0.47638%0.376SS..  trans-103.4117.8178.6166.80000108.5Q98Q98-S100 PolarHBondContact O-N 3.02Å
101E58.6Low79.7Confident162 Ų16261.2 Ų61.276%0.75736%0.361SS*.SBendtrans73.7142.5175.5-53.8-73.2125.600116.7I103E101-I103 VanDerWaalsContact C-N 3.3Å; E101-I103 PolarHBondContact O-N 3.48Å
102C61.3Low79.5Confident80 Ų8057.9 Ų57.954%0.54135%0.346SS..  trans-71.579.3-179177.60000111T104C102-T104 PolarHBondContact O-N 3.05Å
103I70.2Confident79.4Confident18 Ų1861.9 Ų61.99%0.09237%0.365CS..  trans-77.4110.8173.7-64.6144.2000108.5K92 Q95 A96 E101 L148K92-I103 HydrophobicContact CB-CG2 4.25Å; Q95-I103 HydrophobicContact CB-CD1 3.24Å; Q95-I103 HydrophobicContact CB-CG1 4.49Å; A96-I103 HydrophobicContact CB-CB 4.36Å; A96-I103 HydrophobicContact CB-CD1 4.05Å; A96-I103 HydrophobicContact CB-CG2 4.48Å; E101-I103 VanDerWaalsContact C-N 3.3Å; E101-I103 PolarHBondContact O-N 3.48Å; I103-L148 HydrophobicContact CG2-CD1 3.97Å
104T76Confident79.4Confident47 Ų4766 Ų6629%0.28839%0.386SS..  trans-98.3144.2173.850.50000109.8C102 A106 S107 E152C102-T104 PolarHBondContact O-N 3.05Å; T104-A106 PolarHBondContact O-N 3.14Å; T104-S107 WeakPolarHBondContact O-CB 3.5Å; T104-S107 PolarHBondContact O-N 3.43Å; T104-S107 PolarHBondContact O-OG 3.49Å; T104-E152 VanDerWaalsContact CA-OE1 3.25Å; T104-E152 WeakPolarHBondContact CA-OE1 3.47Å; T104-E152 WeakPolarHBondContact CB-OE1 3.47Å
105S76.6Confident79.3Confident26 Ų2662.8 Ų62.818%0.18237%0.371CS..Hα-helixtrans-58.7-30.9173.953.90000112.4S107 F108 D109 L149 E152S105-S107 PolarHBondContact O-N 3.13Å; S105-F108 WeakPolarHBondContact O-CB 3.12Å; S105-F108 PolarHBondContact O-N 3.38Å; S105-D109 PolarHBondContact O-N 3.04Å; S105-L149 VanDerWaalsContact OG-CD2 3.29Å; S105-L149 WeakPolarHBondContact OG-CD2 3.22Å; S105-E152 WeakPolarHBondContact CB-OE2 3.49Å; S105-E152 PolarHBondContact N-OE1 3.38Å; S105-E152 PolarHBondContact N-OE2 3.49Å; S105-E152 PolarHBondContact OG-OE2 3.08Å
106A80.9Confident79.2Confident57 Ų5760.3 Ų60.347%0.47136%0.361SS..Hα-helixtrans-60.2-31.4174.800000113.1T104 F108 D109 V110T104-A106 PolarHBondContact O-N 3.14Å; A106-F108 VanDerWaalsContact C-N 3.25Å; A106-F108 PolarHBondContact O-N 3.49Å; A106-D109 PolarHBondContact O-N 3.37Å; A106-V110 PolarHBondContact O-N 3.18Å
107S83.4Confident79.1Confident36 Ų3664.1 Ų64.125%0.25237%0.373SS..Hα-helixtrans-63.7-34175.174.20000112K92 T104 S105 D109 V110 D111K92-S107 PolarHBondContact NZ-OG 2.97Å; K92-S107 VanDerWaalsContact NZ-OG 3.14Å; T104-S107 WeakPolarHBondContact O-CB 3.5Å; T104-S107 PolarHBondContact O-N 3.43Å; T104-S107 PolarHBondContact O-OG 3.49Å; S105-S107 PolarHBondContact O-N 3.13Å; S107-D109 VanDerWaalsContact C-N 3.35Å; S107-V110 PolarHBondContact O-N 3.16Å; S107-D111 PolarHBondContact O-N 3.34Å; S107-D111 VanDerWaalsContact O-OD2 3.07Å
108F84.6Confident79Confident1 Ų163.8 Ų63.80%0.00437%0.366CS..Hα-helixtrans-73-29.3178.6-177.1-114.4000112.1L85 L89 K92 S105 A106 V110 D111 I112 R145 L148L85-F108 HydrophobicContact CD1-CE2 3.88Å; L85-F108 HydrophobicContact CD1-CZ 3.93Å; L85-F108 HydrophobicContact CG-CE2 4.49Å; L85-F108 HydrophobicContact CG-CZ 4.18Å; L89-F108 HydrophobicContact CB-CD2 4.4Å; L89-F108 HydrophobicContact CB-CE2 3.61Å; L89-F108 HydrophobicContact CB-CZ 3.69Å; L89-F108 HydrophobicContact CD1-CD1 3.86Å; L89-F108 HydrophobicContact CD1-CD2 3.89Å; L89-F108 HydrophobicContact CD1-CE1 3.73Å; L89-F108 HydrophobicContact CD1-CE2 3.79Å; L89-F108 HydrophobicContact CD1-CG 3.93Å; L89-F108 HydrophobicContact CD1-CZ 3.72Å; L89-F108 HydrophobicContact CD2-CE1 3.89Å; L89-F108 HydrophobicContact CD2-CE2 4.43Å; L89-F108 HydrophobicContact CD2-CZ 3.71Å; L89-F108 HydrophobicContact CG-CE1 4.26Å; L89-F108 HydrophobicContact CG-CE2 4.13Å; L89-F108 HydrophobicContact CG-CZ 3.9Å; K92-F108 HydrophobicContact CD-CB 4.16Å; K92-F108 HydrophobicContact CD-CD2 4.1Å; S105-F108 WeakPolarHBondContact O-CB 3.12Å; S105-F108 PolarHBondContact O-N 3.38Å; A106-F108 VanDerWaalsContact C-N 3.25Å; A106-F108 PolarHBondContact O-N 3.49Å; F108-V110 VanDerWaalsContact C-N 3.32Å; F108-V110 PolarHBondContact O-N 3.32Å; F108-D111 HydrophobicContact CD2-CB 4.41Å; F108-D111 PolarHBondContact O-N 3.06Å; F108-I112 HydrophobicContact CD1-CD1 3.8Å; F108-I112 HydrophobicContact CD1-CG1 4.19Å; F108-I112 HydrophobicContact CE1-CD1 3.55Å; F108-I112 HydrophobicContact CE1-CG1 3.82Å; F108-I112 HydrophobicContact CE2-CG1 4.45Å; F108-I112 HydrophobicContact CZ-CD1 4.18Å; F108-I112 HydrophobicContact CZ-CG1 3.94Å; F108-I112 WeakPolarHBondContact O-CG1 3.35Å; F108-I112 PolarHBondContact O-N 3.21Å; F108-R145 HydrophobicContact CD1-CG 4.42Å; F108-R145 HydrophobicContact CE1-CG 4.47Å; F108-L148 HydrophobicContact CB-CD2 4.23Å
109D86Confident79Confident47 Ų4758.2 Ų58.225%0.25134%0.34SS..Hα-helixtrans-62.4-41.3175.2-66.3-32.8000111.3S105 A106 S107 D111 I112 E113 R145S105-D109 PolarHBondContact O-N 3.04Å; A106-D109 PolarHBondContact O-N 3.37Å; S107-D109 VanDerWaalsContact C-N 3.35Å; D109-D111 VanDerWaalsContact C-N 3.31Å; D109-D111 PolarHBondContact O-N 3.4Å; D109-I112 WeakPolarHBondContact O-CB 3.23Å; D109-I112 PolarHBondContact O-N 2.9Å; D109-E113 PolarHBondContact O-N 3.39Å; D109-E113 VanDerWaalsContact O-N 3.08Å; D109-R145 IonicContact OD1-CZ 3.74Å; D109-R145 IonicContact OD1-NE 2.78Å; D109-R145 IonicContact OD1-NH2 2.78Å; D109-R145 PolarHBondContact OD1-NH2 3.17Å; D109-R145 IonicContact OD2-NH2 3.69Å
110V87.9Confident79.5Confident75 Ų7559.6 Ų59.646%0.45533%0.327SS..Hα-helixtrans-62.9-38.4173.9179.60000111.4A106 S107 F108 I112 E113 N114A106-V110 PolarHBondContact O-N 3.18Å; S107-V110 PolarHBondContact O-N 3.16Å; F108-V110 VanDerWaalsContact C-N 3.32Å; F108-V110 PolarHBondContact O-N 3.32Å; V110-I112 VanDerWaalsContact C-N 3.35Å; V110-E113 PolarHBondContact O-N 2.72Å; V110-N114 WeakPolarHBondContact O-CB 3.49Å; V110-N114 VanDerWaalsContact O-CG 3.28Å; V110-N114 PolarHBondContact O-N 3.2Å; V110-N114 PolarHBondContact O-ND2 3.36Å
111D87.1Confident80.6Confident44 Ų4465.5 Ų65.524%0.23534%0.338CS..Hα-helixtrans-68.6-33.5177.3-65.9-43.5000112.5K92 S107 F108 D109 F115K92-D111 WeakPolarHBondContact CE-OD2 3.39Å; K92-D111 IonicContact NZ-OD2 2.68Å; K92-D111 PolarHBondContact NZ-OD2 3.44Å; S107-D111 PolarHBondContact O-N 3.34Å; S107-D111 VanDerWaalsContact O-OD2 3.07Å; F108-D111 HydrophobicContact CD2-CB 4.41Å; F108-D111 PolarHBondContact O-N 3.06Å; D109-D111 VanDerWaalsContact C-N 3.31Å; D109-D111 PolarHBondContact O-N 3.4Å; D111-F115 VanDerWaalsContact O-CB 3.27Å; D111-F115 WeakPolarHBondContact O-CB 3.09Å; D111-F115 PolarHBondContact O-N 3.04Å
112I87.2Confident81.5Confident29 Ų2962 Ų6215%0.14932%0.322CS..Hα-helixtrans-63-47.9171.1-65.4166000109.9L85 F108 D109 V110 N114 F115 V116L85-I112 HydrophobicContact CD1-CG1 4Å; L85-I112 HydrophobicContact CD2-CG1 4.35Å; F108-I112 HydrophobicContact CD1-CD1 3.8Å; F108-I112 HydrophobicContact CD1-CG1 4.19Å; F108-I112 HydrophobicContact CE1-CD1 3.55Å; F108-I112 HydrophobicContact CE1-CG1 3.82Å; F108-I112 HydrophobicContact CE2-CG1 4.45Å; F108-I112 HydrophobicContact CZ-CD1 4.18Å; F108-I112 HydrophobicContact CZ-CG1 3.94Å; F108-I112 WeakPolarHBondContact O-CG1 3.35Å; F108-I112 PolarHBondContact O-N 3.21Å; D109-I112 WeakPolarHBondContact O-CB 3.23Å; D109-I112 PolarHBondContact O-N 2.9Å; V110-I112 VanDerWaalsContact C-N 3.35Å; I112-N114 PolarHBondContact O-N 2.96Å; I112-F115 WeakPolarHBondContact O-CB 3.12Å; I112-F115 PolarHBondContact O-N 2.94Å; I112-V116 HydrophobicContact CG2-CG2 4.36Å; I112-V116 WeakPolarHBondContact O-CG2 3.2Å; I112-V116 PolarHBondContact O-N 3.45Å
113E85.2Confident82.1Confident118 Ų11866.7 Ų66.755%0.55134%0.336SS*.Hα-helixtrans-60.5-45.8179.4-71179168.800111.5D109 V110 F115 V116 H117D109-E113 PolarHBondContact O-N 3.39Å; D109-E113 VanDerWaalsContact O-N 3.08Å; V110-E113 PolarHBondContact O-N 2.72Å; E113-F115 VanDerWaalsContact C-N 3.3Å; E113-F115 PolarHBondContact O-N 2.79Å; E113-V116 PolarHBondContact O-N 3.43Å; E113-H117 PolarHBondContact O-CD2 2.96Å; E113-H117 VanDerWaalsContact O-CD2 3.29Å; E113-H117 PolarHBondContact O-N 3.32Å
114N86.8Confident82.2Confident94 Ų9471.4 Ų71.450%0.50336%0.356SS..Hα-helixtrans-59.6-41175.4-73.4-28.9000112.1V110 I112 Q118V110-N114 WeakPolarHBondContact O-CB 3.49Å; V110-N114 VanDerWaalsContact O-CG 3.28Å; V110-N114 PolarHBondContact O-N 3.2Å; V110-N114 PolarHBondContact O-ND2 3.36Å; I112-N114 PolarHBondContact O-N 2.96Å; N114-Q118 WeakPolarHBondContact O-CB 3.46Å; N114-Q118 PolarHBondContact O-N 3.25Å
115F86.5Confident82.1Confident27 Ų2773.5 Ų73.512%0.11837%0.37CS..Hα-helixtrans-65.8-42.2177173.7-94.4000112.1P81 L82 P84 L85 D111 I112 E113 Q118 Q119 F126P81-F115 WeakPolarHBondContact O-CZ 3.3Å; L82-F115 HydrophobicContact CD2-CE1 3.98Å; L82-F115 HydrophobicContact CD2-CZ 4.28Å; P84-F115 HydrophobicContact CB-CE2 4.22Å; P84-F115 HydrophobicContact CG-CE2 4.42Å; L85-F115 HydrophobicContact CB-CD1 4.3Å; L85-F115 HydrophobicContact CB-CD2 4.21Å; L85-F115 HydrophobicContact CB-CE1 4.3Å; L85-F115 HydrophobicContact CB-CE2 4.21Å; L85-F115 HydrophobicContact CB-CG 4.24Å; L85-F115 HydrophobicContact CB-CZ 4.24Å; L85-F115 HydrophobicContact CD1-CB 4.2Å; L85-F115 HydrophobicContact CD1-CG 4.29Å; L85-F115 HydrophobicContact CD2-CD1 4.04Å; L85-F115 HydrophobicContact CD2-CE1 4.27Å; D111-F115 VanDerWaalsContact O-CB 3.27Å; D111-F115 WeakPolarHBondContact O-CB 3.09Å; D111-F115 PolarHBondContact O-N 3.04Å; I112-F115 WeakPolarHBondContact O-CB 3.12Å; I112-F115 PolarHBondContact O-N 2.94Å; E113-F115 VanDerWaalsContact C-N 3.3Å; E113-F115 PolarHBondContact O-N 2.79Å; F115-Q118 PolarHBondContact O-N 3.3Å; F115-Q119 HydrophobicContact CD1-CG 4.3Å; F115-Q119 HydrophobicContact CE1-CG 3.87Å; F115-Q119 HydrophobicContact CE2-CG 4.24Å; F115-Q119 HydrophobicContact CZ-CG 3.85Å; F115-Q119 VanDerWaalsContact CZ-NE2 3.27Å; F115-Q119 WeakPolarHBondContact O-CB 3.4Å; F115-Q119 WeakPolarHBondContact O-CG 3.49Å; F115-Q119 PolarHBondContact O-N 2.94Å; F115-F126 HydrophobicContact CE1-CE1 4.49Å
116V84.5Confident81.6Confident23 Ų2373.8 Ų73.814%0.13937%0.368CS..Hα-helixtrans-63-47.1176.5171.40000110.6I112 E113 Q118 Q119 E120 F126 P381I112-V116 HydrophobicContact CG2-CG2 4.36Å; I112-V116 WeakPolarHBondContact O-CG2 3.2Å; I112-V116 PolarHBondContact O-N 3.45Å; E113-V116 PolarHBondContact O-N 3.43Å; V116-Q118 VanDerWaalsContact C-N 3.31Å; V116-Q118 PolarHBondContact O-N 3.34Å; V116-Q119 WeakPolarHBondContact O-CB 3.44Å; V116-Q119 PolarHBondContact O-N 3.08Å; V116-E120 WeakPolarHBondContact O-CG 3Å; V116-E120 PolarHBondContact O-N 3.09Å; V116-F126 HydrophobicContact CG1-CZ 4.16Å; V116-F126 HydrophobicContact CG2-CE1 4.32Å; V116-P381 HydrophobicContact CG1-CG 4.48Å
117H83.6Confident81.4Confident110 Ų11072.5 Ų72.551%0.50935%0.352SS..Hα-helixtrans-62.7-36.4176.9-77.1-48.4000113.1E113 E120 R121E113-H117 PolarHBondContact O-CD2 2.96Å; E113-H117 VanDerWaalsContact O-CD2 3.29Å; E113-H117 PolarHBondContact O-N 3.32Å; H117-E120 IonicContact ND1-OE2 2.82Å; H117-E120 PolarHBondContact ND1-OE2 3.25Å; H117-R121 VanDerWaalsContact O-CG 3.29Å; H117-R121 WeakPolarHBondContact O-CG 3.15Å; H117-R121 PolarHBondContact O-N 3.39Å; H117-R121 VanDerWaalsContact O-N 3.08Å
118Q83.6Confident81.2Confident77 Ų7772.2 Ų72.236%0.3635%0.35SS..Hα-helixtrans-68.9-39.8175.8-173.462.139.300111.7N114 F115 V116 R121 E122N114-Q118 WeakPolarHBondContact O-CB 3.46Å; N114-Q118 PolarHBondContact O-N 3.25Å; F115-Q118 PolarHBondContact O-N 3.3Å; V116-Q118 VanDerWaalsContact C-N 3.31Å; V116-Q118 PolarHBondContact O-N 3.34Å; Q118-R121 PolarHBondContact O-N 3.18Å; Q118-E122 PolarHBondContact NE2-OE1 3.45Å; Q118-E122 WeakPolarHBondContact O-CG 3.18Å; Q118-E122 PolarHBondContact O-N 3.22Å
119Q81.8Confident80.8Confident11 Ų1181.7 Ų81.75%0.05139%0.394CS..Hα-helixtrans-62.2-43.7174.5-80.4-93.318.700112.2P81 F115 V116 R121 E122 H123 K124 F126P81-Q119 PolarHBondContact O-NE2 3.38Å; F115-Q119 HydrophobicContact CD1-CG 4.3Å; F115-Q119 HydrophobicContact CE1-CG 3.87Å; F115-Q119 HydrophobicContact CE2-CG 4.24Å; F115-Q119 HydrophobicContact CZ-CG 3.85Å; F115-Q119 VanDerWaalsContact CZ-NE2 3.27Å; F115-Q119 WeakPolarHBondContact O-CB 3.4Å; F115-Q119 WeakPolarHBondContact O-CG 3.49Å; F115-Q119 PolarHBondContact O-N 2.94Å; V116-Q119 WeakPolarHBondContact O-CB 3.44Å; V116-Q119 PolarHBondContact O-N 3.08Å; Q119-R121 PolarHBondContact O-N 2.98Å; Q119-E122 PolarHBondContact O-N 3.49Å; Q119-H123 PolarHBondContact O-N 3.24Å; Q119-H123 VanDerWaalsContact O-N 3.11Å; Q119-K124 PolarHBondContact O-N 2.96Å; Q119-K124 PolarHBondContact OE1-O 2.88Å; Q119-F126 HydrophobicContact CB-CD1 4.26Å; Q119-F126 HydrophobicContact CB-CE1 3.46Å; Q119-F126 VanDerWaalsContact CB-CE1 3.46Å; Q119-F126 HydrophobicContact CB-CE2 4.39Å; Q119-F126 HydrophobicContact CB-CZ 3.54Å; Q119-F126 HydrophobicContact CG-CD1 4.13Å; Q119-F126 HydrophobicContact CG-CE1 3.67Å; Q119-F126 HydrophobicContact CG-CZ 4.27Å
120E80.6Confident80.5Confident102 Ų10282 Ų8248%0.47740%0.396SS..Hα-helixtrans-61.8-42.3176.3-73.317616500111.8V116 H117 E122 H123V116-E120 WeakPolarHBondContact O-CG 3Å; V116-E120 PolarHBondContact O-N 3.09Å; H117-E120 IonicContact ND1-OE2 2.82Å; H117-E120 PolarHBondContact ND1-OE2 3.25Å; E120-E122 VanDerWaalsContact C-N 3.32Å; E120-E122 PolarHBondContact O-N 3.39Å; E120-H123 PolarHBondContact O-N 3.11Å
121R80.3Confident80.3Confident191 Ų19181.2 Ų81.272%0.72139%0.392SS*.Hα-helixtrans-65.8-32.5176.2-75.4177.162.6-161.9-2.2113.5H117 Q118 Q119H117-R121 VanDerWaalsContact O-CG 3.29Å; H117-R121 WeakPolarHBondContact O-CG 3.15Å; H117-R121 PolarHBondContact O-N 3.39Å; H117-R121 VanDerWaalsContact O-N 3.08Å; Q118-R121 PolarHBondContact O-N 3.18Å; Q119-R121 PolarHBondContact O-N 2.98Å
122E77.4Confident80.2Confident90 Ų9086.9 Ų86.942%0.42142%0.417SS..Hα-helixtrans-87.7-3.4179.8-71.4-172.7-169.100113.7Q118 Q119 E120 K124Q118-E122 PolarHBondContact NE2-OE1 3.45Å; Q118-E122 WeakPolarHBondContact O-CG 3.18Å; Q118-E122 PolarHBondContact O-N 3.22Å; Q119-E122 PolarHBondContact O-N 3.49Å; E120-E122 VanDerWaalsContact C-N 3.32Å; E120-E122 PolarHBondContact O-N 3.39Å; E122-K124 HydrophobicContact CB-CD 4.25Å; E122-K124 HydrophobicContact CB-CG 4.24Å; E122-K124 PolarHBondContact O-N 3.39Å; E122-K124 VanDerWaalsContact O-N 3.09Å; E122-K124 WeakPolarHBondContact OE2-CD 3.48Å; E122-K124 VanDerWaalsContact OE2-CE 3.31Å; E122-K124 WeakPolarHBondContact OE2-CE 3.42Å; E122-K124 IonicContact OE2-NZ 3.97Å; E122-K124 PolarHBondContact OE2-NZ 3.19Å
123H73.9Confident80Confident178 Ų17886.1 Ų86.182%0.82441%0.414SS*.THydrogen-bonded Turntrans48.132.9-173.5-76.2-78.2000113.2Q119 E120Q119-H123 PolarHBondContact O-N 3.24Å; Q119-H123 VanDerWaalsContact O-N 3.11Å; E120-H123 PolarHBondContact O-N 3.11Å
124K72.8Confident80Confident116 Ų11681 Ų8150%0.50439%0.39SS..  trans-85.8139.9177.4-82.8175.1-177.3161.90110Q119 E122Q119-K124 PolarHBondContact O-N 2.96Å; Q119-K124 PolarHBondContact OE1-O 2.88Å; E122-K124 HydrophobicContact CB-CD 4.25Å; E122-K124 HydrophobicContact CB-CG 4.24Å; E122-K124 PolarHBondContact O-N 3.39Å; E122-K124 VanDerWaalsContact O-N 3.09Å; E122-K124 WeakPolarHBondContact OE2-CD 3.48Å; E122-K124 VanDerWaalsContact OE2-CE 3.31Å; E122-K124 WeakPolarHBondContact OE2-CE 3.42Å; E122-K124 IonicContact OE2-NZ 3.97Å; E122-K124 PolarHBondContact OE2-NZ 3.19Å
125P72.9Confident80Confident92 Ų9279.8 Ų79.860%0.59738%0.383SS*.  trans-65.4138.5172.327.2-32.1000109.6P81 F127P81-P125 VanDerWaalsContact CB-O 3.23Å; P81-P125 WeakPolarHBondContact CB-O 3.46Å; P81-P125 WeakPolarHBondContact CG-O 3.23Å; P125-F127 PolarHBondContact O-N 3.11Å
126F67.6Low80.1Confident31 Ų3183.2 Ų83.214%0.13640%0.403CS..SBendtrans-68.8-18175.8-75.4-79.6000113.3F115 V116 Q119 I384F115-F126 HydrophobicContact CE1-CE1 4.49Å; V116-F126 HydrophobicContact CG1-CZ 4.16Å; V116-F126 HydrophobicContact CG2-CE1 4.32Å; Q119-F126 HydrophobicContact CB-CD1 4.26Å; Q119-F126 HydrophobicContact CB-CE1 3.46Å; Q119-F126 VanDerWaalsContact CB-CE1 3.46Å; Q119-F126 HydrophobicContact CB-CE2 4.39Å; Q119-F126 HydrophobicContact CB-CZ 3.54Å; Q119-F126 HydrophobicContact CG-CD1 4.13Å; Q119-F126 HydrophobicContact CG-CE1 3.67Å; Q119-F126 HydrophobicContact CG-CZ 4.27Å; F126-I384 HydrophobicContact CB-CD1 4Å; F126-I384 HydrophobicContact CB-CG1 3.83Å; F126-I384 HydrophobicContact CD1-CD1 3.5Å; F126-I384 VanDerWaalsContact CD1-CD1 3.5Å; F126-I384 HydrophobicContact CD1-CG1 4.12Å; F126-I384 HydrophobicContact CD2-CD1 4.16Å; F126-I384 HydrophobicContact CD2-CG1 3.91Å; F126-I384 HydrophobicContact CE1-CD1 3.93Å; F126-I384 HydrophobicContact CG-CD1 3.61Å; F126-I384 HydrophobicContact CG-CG1 3.68Å; F126-I384 HydrophobicContact CZ-CD1 4.44Å
127F76.8Confident80.2Confident31 Ų3182.1 Ų82.114%0.13640%0.396CS..SBendtrans-122150.7-175.1-66.1-59.2000111P125 D134 V138 I384 V388P125-F127 PolarHBondContact O-N 3.11Å; F127-D134 WeakPolarHBondContact CB-OD2 3.34Å; F127-D134 HydrophobicContact CD1-CB 3.71Å; F127-D134 HydrophobicContact CE1-CB 4.22Å; F127-V138 HydrophobicContact CE1-CG2 4.47Å; F127-I384 HydrophobicContact CE1-CG2 3.98Å; F127-I384 HydrophobicContact CE2-CB 4.09Å; F127-I384 HydrophobicContact CE2-CG2 3.76Å; F127-I384 WeakPolarHBondContact CE2-O 3.44Å; F127-I384 HydrophobicContact CZ-CB 4.03Å; F127-I384 HydrophobicContact CZ-CG2 3.18Å; F127-I384 WeakPolarHBondContact CZ-O 3.44Å; F127-V388 HydrophobicContact CE1-CG2 4.1Å; F127-V388 HydrophobicContact CE2-CG2 4.21Å; F127-V388 HydrophobicContact CZ-CG2 3.65Å
128S78.4Confident80.4Confident29 Ų2977.9 Ų77.920%0.20338%0.378CS..  trans-82.1177.9171.766.70000110.9H80 D130 D134H80-S128 PolarHBondContact CD2-OG 3.04Å; S128-D130 PolarHBondContact O-N 3.27Å; S128-D130 PolarHBondContact OG-N 3.32Å; S128-D130 PolarHBondContact OG-O 2.68Å; S128-D134 PolarHBondContact N-OD1 3.41Å; S128-D134 PolarHBondContact OG-OD1 3.45Å
129E75.3Confident80.6Confident200 Ų20080.3 Ų80.394%0.93539%0.387SS*.SBendtrans-73.6-4.2173.1-65.5177162.100112.3P131E129-P131 WeakPolarHBondContact O-CD 3.34Å
130D81.3Confident80.9Confident53 Ų5381.2 Ų81.228%0.28340%0.396SS..  trans-112.7101.7-178-179.45.6000111.7H76 S128 E132 L133 D134H76-D130 IonicContact CE1-OD2 3.95Å; S128-D130 PolarHBondContact O-N 3.27Å; S128-D130 PolarHBondContact OG-N 3.32Å; S128-D130 PolarHBondContact OG-O 2.68Å; D130-E132 VanDerWaalsContact C-N 3.25Å; D130-E132 PolarHBondContact O-N 2.9Å; D130-E132 PolarHBondContact OD1-N 3.36Å; D130-L133 HydrophobicContact CB-CB 4.12Å; D130-L133 PolarHBondContact O-N 3.5Å; D130-L133 WeakPolarHBondContact OD2-CB 3.49Å; D130-D134 VanDerWaalsContact O-CG 3.23Å; D130-D134 PolarHBondContact O-N 3.43Å; D130-D134 VanDerWaalsContact O-N 3.07Å
131P82.6Confident81.3Confident59 Ų5976.8 Ų76.838%0.38338%0.376SS..Hα-helixtrans-62.2-28.4179.5-21.832.5000113.8E129 N135 T391E129-P131 WeakPolarHBondContact O-CD 3.34Å; P131-N135 WeakPolarHBondContact O-CB 3.34Å; P131-N135 PolarHBondContact O-N 3.39Å; P131-N135 VanDerWaalsContact O-N 3.08Å; P131-N135 PolarHBondContact O-ND2 3.1Å; P131-T391 HydrophobicContact CG-CG2 4.35Å
132E85.4Confident81.7Confident163 Ų16371.6 Ų71.676%0.76236%0.36SS*.Hα-helixtrans-70.6-42.5-179.3-67.9-172.3176.800110.7D130 N135 L136D130-E132 VanDerWaalsContact C-N 3.25Å; D130-E132 PolarHBondContact O-N 2.9Å; D130-E132 PolarHBondContact OD1-N 3.36Å; E132-N135 PolarHBondContact O-N 3.34Å; E132-L136 PolarHBondContact O-N 3.04Å
133L83Confident82.4Confident14 Ų1472 Ų727%0.07337%0.368CS..Hα-helixtrans-64.8-43.6173.7179.260.4000111.5H76 F77 H80 D130 N135 L136 M137H76-L133 HydrophobicContact CB-CD2 4.39Å; H76-L133 WeakPolarHBondContact ND1-CD2 3.47Å; F77-L133 HydrophobicContact CD2-CD1 3.54Å; F77-L133 HydrophobicContact CE2-CD1 4.13Å; F77-L133 HydrophobicContact CG-CD1 4.43Å; H80-L133 HydrophobicContact CB-CD2 4.45Å; D130-L133 HydrophobicContact CB-CB 4.12Å; D130-L133 PolarHBondContact O-N 3.5Å; D130-L133 WeakPolarHBondContact OD2-CB 3.49Å; L133-N135 VanDerWaalsContact C-N 3.29Å; L133-N135 PolarHBondContact O-N 3.26Å; L133-L136 HydrophobicContact CD1-CD2 4.44Å; L133-L136 WeakPolarHBondContact O-CB 3.2Å; L133-L136 PolarHBondContact O-N 2.98Å; L133-L136 VanDerWaalsContact O-N 3.08Å; L133-M137 HydrophobicContact CD1-CG 4.1Å; L133-M137 HydrophobicContact CD1-SD 4.45Å; L133-M137 HydrophobicContact CG-CG 4.24Å; L133-M137 VanDerWaalsContact O-CG 3.27Å; L133-M137 WeakPolarHBondContact O-CG 3.47Å; L133-M137 PolarHBondContact O-N 3.39Å
134D84.8Confident83.2Confident11 Ų1165 Ų656%0.05934%0.337CS..Hα-helixtrans-55.5-46.8176.8-63.8-24.8000111.2H80 F127 S128 D130 L136 M137 V138H80-D134 IonicContact CD2-OD1 2.7Å; H80-D134 IonicContact CE1-OD1 3.85Å; H80-D134 IonicContact NE2-OD1 3.48Å; H80-D134 PolarHBondContact NE2-OD1 3.47Å; F127-D134 WeakPolarHBondContact CB-OD2 3.34Å; F127-D134 HydrophobicContact CD1-CB 3.71Å; F127-D134 HydrophobicContact CE1-CB 4.22Å; S128-D134 PolarHBondContact N-OD1 3.41Å; S128-D134 PolarHBondContact OG-OD1 3.45Å; D130-D134 VanDerWaalsContact O-CG 3.23Å; D130-D134 PolarHBondContact O-N 3.43Å; D130-D134 VanDerWaalsContact O-N 3.07Å; D134-L136 VanDerWaalsContact C-N 3.33Å; D134-L136 PolarHBondContact O-N 3.36Å; D134-M137 PolarHBondContact O-N 2.98Å; D134-V138 VanDerWaalsContact O-CG2 3.31Å; D134-V138 WeakPolarHBondContact O-CG2 3.38Å; D134-V138 PolarHBondContact O-N 2.99Å
135N87.1Confident83.9Confident67 Ų6762.4 Ų62.436%0.35832%0.324SS..Hα-helixtrans-62.8-39.6177.2-84.1-73.1000112P131 E132 L133 K139P131-N135 WeakPolarHBondContact O-CB 3.34Å; P131-N135 PolarHBondContact O-N 3.39Å; P131-N135 VanDerWaalsContact O-N 3.08Å; P131-N135 PolarHBondContact O-ND2 3.1Å; E132-N135 PolarHBondContact O-N 3.34Å; L133-N135 VanDerWaalsContact C-N 3.29Å; L133-N135 PolarHBondContact O-N 3.26Å; N135-K139 WeakPolarHBondContact O-CB 3.27Å; N135-K139 VanDerWaalsContact O-CG 3.25Å; N135-K139 WeakPolarHBondContact O-CG 3.31Å; N135-K139 PolarHBondContact O-N 3.18Å
136L88.3Confident84.7Confident100 Ų10062.6 Ų62.652%0.52432%0.319SS..Hα-helixtrans-64.7-44.1175.8-179.562.8000111.4F77 E132 L133 D134 K139 A140F77-L136 HydrophobicContact CE2-CD2 4.42Å; E132-L136 PolarHBondContact O-N 3.04Å; L133-L136 HydrophobicContact CD1-CD2 4.44Å; L133-L136 WeakPolarHBondContact O-CB 3.2Å; L133-L136 PolarHBondContact O-N 2.98Å; L133-L136 VanDerWaalsContact O-N 3.08Å; D134-L136 VanDerWaalsContact C-N 3.33Å; D134-L136 PolarHBondContact O-N 3.36Å; L136-K139 PolarHBondContact O-N 3.31Å; L136-A140 WeakPolarHBondContact O-CB 3.34Å; L136-A140 PolarHBondContact O-N 3.3Å
137M87.4Confident85.7Confident0 Ų064.9 Ų64.90%033%0.33CS..Hα-helixtrans-61.2-48177.8-69.3-63.6-7000111.4F77 H80 L82 F83 L86 L133 D134 K139 A140 I141F77-M137 HydrophobicContact CD1-SD 4.03Å; F77-M137 HydrophobicContact CD2-SD 3.64Å; F77-M137 HydrophobicContact CE1-CE 4.06Å; F77-M137 HydrophobicContact CE1-SD 3.58Å; F77-M137 VanDerWaalsContact CE1-SD 3.58Å; F77-M137 HydrophobicContact CE2-CG 4.36Å; F77-M137 HydrophobicContact CE2-SD 3.12Å; F77-M137 WeakPolarHBondContact CE2-SD 3.42Å; F77-M137 HydrophobicContact CG-SD 4.06Å; F77-M137 HydrophobicContact CZ-CE 4.08Å; F77-M137 HydrophobicContact CZ-SD 3.09Å; F77-M137 WeakPolarHBondContact CZ-SD 3.46Å; H80-M137 HydrophobicContact CB-CE 4.19Å; H80-M137 HydrophobicContact CB-CG 4.48Å; L82-M137 HydrophobicContact CB-CB 4.38Å; L82-M137 HydrophobicContact CB-CE 4.04Å; L82-M137 HydrophobicContact CD1-CB 4.06Å; F83-M137 HydrophobicContact CB-CE 4.1Å; L86-M137 HydrophobicContact CB-CE 4.28Å; L86-M137 HydrophobicContact CD2-CE 3.89Å; L86-M137 HydrophobicContact CD2-SD 4.23Å; L133-M137 HydrophobicContact CD1-CG 4.1Å; L133-M137 HydrophobicContact CD1-SD 4.45Å; L133-M137 HydrophobicContact CG-CG 4.24Å; L133-M137 VanDerWaalsContact O-CG 3.27Å; L133-M137 WeakPolarHBondContact O-CG 3.47Å; L133-M137 PolarHBondContact O-N 3.39Å; D134-M137 PolarHBondContact O-N 2.98Å; M137-K139 PolarHBondContact O-N 2.95Å; M137-A140 PolarHBondContact O-N 3.38Å; M137-I141 VanDerWaalsContact O-CG1 3.3Å; M137-I141 WeakPolarHBondContact O-CG1 3.45Å; M137-I141 PolarHBondContact O-N 2.94Å
138V87.2Confident86.3Confident21 Ų2163.6 Ų63.613%0.12732%0.324CS..Hα-helixtrans-59.9-45.6177.1167.30000111L82 F127 D134 I141 Q142 W380L82-V138 HydrophobicContact CD1-CG2 3.95Å; F127-V138 HydrophobicContact CE1-CG2 4.47Å; D134-V138 VanDerWaalsContact O-CG2 3.31Å; D134-V138 WeakPolarHBondContact O-CG2 3.38Å; D134-V138 PolarHBondContact O-N 2.99Å; V138-I141 PolarHBondContact O-N 3.09Å; V138-Q142 VanDerWaalsContact O-CG 3.26Å; V138-Q142 WeakPolarHBondContact O-CG 3.31Å; V138-Q142 PolarHBondContact O-N 2.96Å; V138-W380 HydrophobicContact CB-CZ2 4.1Å; V138-W380 HydrophobicContact CG1-CZ2 3.73Å; V138-W380 HydrophobicContact CG2-CH2 4.07Å; V138-W380 HydrophobicContact CG2-CZ2 3.74Å
139K87.1Confident86.8Confident127 Ų12765.2 Ų65.255%0.55233%0.33SS*.Hα-helixtrans-64.8-41177.7-75.4175.3-178.61740112.2N135 L136 M137 Q142 V143N135-K139 WeakPolarHBondContact O-CB 3.27Å; N135-K139 VanDerWaalsContact O-CG 3.25Å; N135-K139 WeakPolarHBondContact O-CG 3.31Å; N135-K139 PolarHBondContact O-N 3.18Å; L136-K139 PolarHBondContact O-N 3.31Å; M137-K139 PolarHBondContact O-N 2.95Å; K139-Q142 WeakPolarHBondContact O-CB 3.49Å; K139-Q142 PolarHBondContact O-N 3.42Å; K139-V143 WeakPolarHBondContact O-CG2 3.28Å; K139-V143 PolarHBondContact O-N 2.89Å
140A89.4Confident87.6Confident30 Ų3060.9 Ų60.925%0.24831%0.31CS..Hα-helixtrans-62-45.4177.700000111.3L86 L136 M137 Q142 V143 L144L86-A140 HydrophobicContact CD1-CB 3.91Å; L136-A140 WeakPolarHBondContact O-CB 3.34Å; L136-A140 PolarHBondContact O-N 3.3Å; M137-A140 PolarHBondContact O-N 3.38Å; A140-Q142 VanDerWaalsContact C-N 3.34Å; A140-Q142 PolarHBondContact O-N 3.04Å; A140-V143 PolarHBondContact O-N 3.03Å; A140-L144 WeakPolarHBondContact O-CG 3.47Å; A140-L144 PolarHBondContact O-N 3.41Å
141I88.6Confident87.9Confident9 Ų960.1 Ų60.15%0.04631%0.306CS..Hα-helixtrans-61.1-43.6175.2-66.8168.7000110.6L82 L85 L86 L89 M137 V138 L144 R145 W380L82-I141 HydrophobicContact CB-CD1 4.01Å; L82-I141 HydrophobicContact CD1-CD1 4.37Å; L85-I141 HydrophobicContact CD2-CD1 4.3Å; L86-I141 HydrophobicContact CB-CD1 4.4Å; L86-I141 HydrophobicContact CB-CG1 4.01Å; L86-I141 HydrophobicContact CD1-CG1 3.67Å; L86-I141 HydrophobicContact CG-CG1 4.43Å; L89-I141 HydrophobicContact CD2-CG2 4.09Å; L89-I141 WeakPolarHBondContact CD2-O 3.47Å; M137-I141 VanDerWaalsContact O-CG1 3.3Å; M137-I141 WeakPolarHBondContact O-CG1 3.45Å; M137-I141 PolarHBondContact O-N 2.94Å; V138-I141 PolarHBondContact O-N 3.09Å; I141-L144 PolarHBondContact O-N 3.19Å; I141-R145 WeakPolarHBondContact O-CB 3.38Å; I141-R145 PolarHBondContact O-N 3.06Å; I141-W380 HydrophobicContact CD1-CH2 4.35Å
142Q89Confident88.1Confident83 Ų8359.2 Ų59.239%0.38830%0.296SS..Hα-helixtrans-60.5-47.4177.8-76172.3-6.400112.6V138 K139 A140 R145 I146V138-Q142 VanDerWaalsContact O-CG 3.26Å; V138-Q142 WeakPolarHBondContact O-CG 3.31Å; V138-Q142 PolarHBondContact O-N 2.96Å; K139-Q142 WeakPolarHBondContact O-CB 3.49Å; K139-Q142 PolarHBondContact O-N 3.42Å; A140-Q142 VanDerWaalsContact C-N 3.34Å; A140-Q142 PolarHBondContact O-N 3.04Å; Q142-R145 PolarHBondContact O-N 3.27Å; Q142-I146 WeakPolarHBondContact O-CG1 3.43Å; Q142-I146 PolarHBondContact O-N 3.41Å; Q142-I146 VanDerWaalsContact O-N 3.08Å
143V92.1Very high88.3Confident97 Ų9758.1 Ų58.159%0.58829%0.289SS*.Hα-helixtrans-63.9-45.9-179.5170.90000110.8K139 A140 R145 I146 H147K139-V143 WeakPolarHBondContact O-CG2 3.28Å; K139-V143 PolarHBondContact O-N 2.89Å; A140-V143 PolarHBondContact O-N 3.03Å; V143-R145 VanDerWaalsContact C-N 3.28Å; V143-R145 PolarHBondContact O-N 3.2Å; V143-I146 PolarHBondContact O-N 2.82Å; V143-H147 PolarHBondContact O-N 3.41Å
144L89.8Confident88.6Confident32 Ų3261.5 Ų61.517%0.16831%0.31CS..Hα-helixtrans-65.2-32.7177.8-73.1173.3000112.3L86 L89 F90 A140 I141 H147 L148L86-L144 HydrophobicContact CD1-CD1 3.55Å; L89-L144 HydrophobicContact CD2-CB 3.51Å; L89-L144 HydrophobicContact CG-CB 3.82Å; F90-L144 HydrophobicContact CD2-CD1 3.96Å; F90-L144 HydrophobicContact CD2-CD2 4.18Å; F90-L144 HydrophobicContact CE2-CD2 4.48Å; A140-L144 WeakPolarHBondContact O-CG 3.47Å; A140-L144 PolarHBondContact O-N 3.41Å; I141-L144 PolarHBondContact O-N 3.19Å; L144-H147 WeakPolarHBondContact O-CB 3.42Å; L144-H147 PolarHBondContact O-N 2.85Å; L144-L148 PolarHBondContact O-N 3.09Å
145R87.3Confident88.7Confident61 Ų6163.9 Ų63.923%0.2332%0.323CS..Hα-helixtrans-66.8-40.6175.7-172.5178.4-176.7-163.52.9111.4L89 F108 D109 I141 Q142 V143 H147 L148 L149L89-R145 HydrophobicContact CD2-CB 4.26Å; F108-R145 HydrophobicContact CD1-CG 4.42Å; F108-R145 HydrophobicContact CE1-CG 4.47Å; D109-R145 IonicContact OD1-CZ 3.74Å; D109-R145 IonicContact OD1-NE 2.78Å; D109-R145 IonicContact OD1-NH2 2.78Å; D109-R145 PolarHBondContact OD1-NH2 3.17Å; D109-R145 IonicContact OD2-NH2 3.69Å; I141-R145 WeakPolarHBondContact O-CB 3.38Å; I141-R145 PolarHBondContact O-N 3.06Å; Q142-R145 PolarHBondContact O-N 3.27Å; V143-R145 VanDerWaalsContact C-N 3.28Å; V143-R145 PolarHBondContact O-N 3.2Å; R145-H147 VanDerWaalsContact C-N 3.3Å; R145-L148 PolarHBondContact O-N 3.03Å; R145-L149 WeakPolarHBondContact O-CG 3.47Å; R145-L149 PolarHBondContact O-N 3.13Å; R145-L149 VanDerWaalsContact O-N 3.08Å
146I89.7Confident88.8Confident97 Ų9765.2 Ų65.250%0.49733%0.327SS..Hα-helixtrans-61.8-43.9172.9-65.6165000109.8Q142 V143 L148 L149 E150Q142-I146 WeakPolarHBondContact O-CG1 3.43Å; Q142-I146 PolarHBondContact O-N 3.41Å; Q142-I146 VanDerWaalsContact O-N 3.08Å; V143-I146 PolarHBondContact O-N 2.82Å; I146-L148 PolarHBondContact O-N 3.48Å; I146-L149 WeakPolarHBondContact O-CB 3.48Å; I146-L149 PolarHBondContact O-N 3.31Å; I146-E150 WeakPolarHBondContact O-CG 3.4Å; I146-E150 PolarHBondContact O-N 3.08Å
147H89.9Confident88.9Confident79 Ų7966.2 Ų66.237%0.36633%0.332SS..Hα-helixtrans-60.1-44.9177.9-172.552.3000112.3V143 L144 R145 L149 E150 L151V143-H147 PolarHBondContact O-N 3.41Å; L144-H147 WeakPolarHBondContact O-CB 3.42Å; L144-H147 PolarHBondContact O-N 2.85Å; R145-H147 VanDerWaalsContact C-N 3.3Å; H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 2.65Å; H147-E150 PolarHBondContact O-N 2.64Å; H147-E150 VanDerWaalsContact O-N 3.16Å; H147-L151 WeakPolarHBondContact O-CG 3.29Å; H147-L151 PolarHBondContact O-N 3.48Å
148L89Confident88.9Confident3 Ų369.5 Ų69.52%0.01635%0.354CS..Hα-helixtrans-59.6-42175.8-172.863.8000112.2L89 K92 A96 I103 F108 L144 R145 I146 E150 L151 E152L89-L148 HydrophobicContact CD1-CB 4.43Å; L89-L148 HydrophobicContact CD1-CD2 3.8Å; K92-L148 HydrophobicContact CB-CD1 4.43Å; K92-L148 HydrophobicContact CB-CD2 4.4Å; A96-L148 HydrophobicContact CB-CD1 4.08Å; I103-L148 HydrophobicContact CG2-CD1 3.97Å; F108-L148 HydrophobicContact CB-CD2 4.23Å; L144-L148 PolarHBondContact O-N 3.09Å; R145-L148 PolarHBondContact O-N 3.03Å; I146-L148 PolarHBondContact O-N 3.48Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.23Å; L148-L151 PolarHBondContact O-N 3.21Å; L148-E152 PolarHBondContact O-N 3.36Å
149L89.1Confident89Confident64 Ų6471.7 Ų71.734%0.33536%0.362SS..Hα-helixtrans-63.7-37.2175.8-76.3166.2000112.6S105 R145 I146 H147 K153S105-L149 VanDerWaalsContact OG-CD2 3.29Å; S105-L149 WeakPolarHBondContact OG-CD2 3.22Å; R145-L149 WeakPolarHBondContact O-CG 3.47Å; R145-L149 PolarHBondContact O-N 3.13Å; R145-L149 VanDerWaalsContact O-N 3.08Å; I146-L149 WeakPolarHBondContact O-CB 3.48Å; I146-L149 PolarHBondContact O-N 3.31Å; H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 2.65Å; L149-K153 WeakPolarHBondContact O-CG 3.44Å; L149-K153 PolarHBondContact O-N 2.79Å; L149-K153 VanDerWaalsContact O-N 3.14Å
150E90.6Very high89.3Confident108 Ų10869.6 Ų69.651%0.50536%0.357SS..Hα-helixtrans-67.8-42.3175.3-71.8-179.2167.400111.5I146 H147 L148 E152 K153 V154I146-E150 WeakPolarHBondContact O-CG 3.4Å; I146-E150 PolarHBondContact O-N 3.08Å; H147-E150 PolarHBondContact O-N 2.64Å; H147-E150 VanDerWaalsContact O-N 3.16Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.23Å; E150-E152 VanDerWaalsContact C-N 3.35Å; E150-E152 PolarHBondContact O-N 3.38Å; E150-K153 PolarHBondContact O-N 3.29Å; E150-V154 WeakPolarHBondContact O-CG2 3.22Å; E150-V154 PolarHBondContact O-N 2.93Å
151L88.1Confident89.5Confident38 Ų3874.9 Ų74.920%0.19938%0.375CS..Hα-helixtrans-61-42.9174.7-69.9174.2000111.8A96 T97 H147 L148 K153 V154 N155A96-L151 HydrophobicContact CB-CB 4.39Å; A96-L151 HydrophobicContact CB-CD1 4.1Å; T97-L151 HydrophobicContact CG2-CD1 3.71Å; T97-L151 HydrophobicContact CG2-CD2 3.96Å; H147-L151 WeakPolarHBondContact O-CG 3.29Å; H147-L151 PolarHBondContact O-N 3.48Å; L148-L151 PolarHBondContact O-N 3.21Å; L151-K153 VanDerWaalsContact C-N 3.35Å; L151-K153 PolarHBondContact O-N 3.27Å; L151-V154 PolarHBondContact O-N 3.41Å; L151-N155 PolarHBondContact O-N 2.9Å
152E88.1Confident89.6Confident39 Ų3977.5 Ų77.518%0.18239%0.393CS..Hα-helixtrans-59.4-44.4175.5-176.6175-154.900111.6T104 S105 L148 E150 V154 N155 E156T104-E152 VanDerWaalsContact CA-OE1 3.25Å; T104-E152 WeakPolarHBondContact CA-OE1 3.47Å; T104-E152 WeakPolarHBondContact CB-OE1 3.47Å; S105-E152 WeakPolarHBondContact CB-OE2 3.49Å; S105-E152 PolarHBondContact N-OE1 3.38Å; S105-E152 PolarHBondContact N-OE2 3.49Å; S105-E152 PolarHBondContact OG-OE2 3.08Å; L148-E152 PolarHBondContact O-N 3.36Å; E150-E152 VanDerWaalsContact C-N 3.35Å; E150-E152 PolarHBondContact O-N 3.38Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 2.95Å; E152-N155 WeakPolarHBondContact O-CB 3.23Å; E152-N155 PolarHBondContact O-N 3.2Å; E152-E156 WeakPolarHBondContact O-CG 3.48Å; E152-E156 PolarHBondContact O-N 3.37Å
153K89.1Confident89.9Confident140 Ų14078.2 Ų78.261%0.60940%0.4SS*.Hα-helixtrans-61.1-41.8175.9-72.7171.5-175.1171.90112.5L149 E150 L151 N155 E156 L157L149-K153 WeakPolarHBondContact O-CG 3.44Å; L149-K153 PolarHBondContact O-N 2.79Å; L149-K153 VanDerWaalsContact O-N 3.14Å; E150-K153 PolarHBondContact O-N 3.29Å; L151-K153 VanDerWaalsContact C-N 3.35Å; L151-K153 PolarHBondContact O-N 3.27Å; K153-N155 VanDerWaalsContact C-N 3.32Å; K153-E156 PolarHBondContact O-N 3.14Å; K153-L157 WeakPolarHBondContact O-CG 3.29Å; K153-L157 PolarHBondContact O-N 3.08Å; K153-L157 VanDerWaalsContact O-N 3.08Å
154V89.9Confident89.9Confident86 Ų8681.9 Ų81.952%0.52140%0.403SS..Hα-helixtrans-63.5-42.4176.8173.80000110.2E150 L151 E152 L157 C158E150-V154 WeakPolarHBondContact O-CG2 3.22Å; E150-V154 PolarHBondContact O-N 2.93Å; L151-V154 PolarHBondContact O-N 3.41Å; E152-V154 VanDerWaalsContact C-N 3.34Å; E152-V154 PolarHBondContact O-N 2.95Å; V154-L157 PolarHBondContact O-N 3.24Å; V154-C158 PolarHBondContact O-N 3.18Å; V154-C158 PolarHBondContact O-SG 3.47Å
155N86.6Confident90.2Very high61 Ų6187 Ų8733%0.32642%0.421SS..Hα-helixtrans-61.3-44.6176.5-170.434.4000112.1L151 E152 K153 L157 C158 K159L151-N155 PolarHBondContact O-N 2.9Å; E152-N155 WeakPolarHBondContact O-CB 3.23Å; E152-N155 PolarHBondContact O-N 3.2Å; K153-N155 VanDerWaalsContact C-N 3.32Å; N155-L157 VanDerWaalsContact C-N 3.32Å; N155-L157 PolarHBondContact O-N 3.3Å; N155-C158 WeakPolarHBondContact O-CB 3.26Å; N155-C158 PolarHBondContact O-N 2.94Å; N155-K159 WeakPolarHBondContact ND2-CE 3.43Å; N155-K159 WeakPolarHBondContact O-CG 3.46Å; N155-K159 PolarHBondContact O-N 3.36Å
156E89Confident90.5Very high94 Ų9487.7 Ų87.744%0.43943%0.428SS..Hα-helixtrans-61.3-39176.2-72.6-58.6116.400112.4E152 K153 K159 D160E152-E156 WeakPolarHBondContact O-CG 3.48Å; E152-E156 PolarHBondContact O-N 3.37Å; K153-E156 PolarHBondContact O-N 3.14Å; E156-K159 PolarHBondContact O-N 2.97Å; E156-K159 IonicContact OE1-NZ 3.52Å; E156-K159 PolarHBondContact OE1-NZ 3.05Å; E156-D160 PolarHBondContact O-N 2.96Å
157L89.1Confident90.7Very high121 Ų12187 Ų8763%0.63443%0.429SS*.Hα-helixtrans-64.9-39.6174.4-70.1173.2000112.4K153 V154 N155 D160 F161K153-L157 WeakPolarHBondContact O-CG 3.29Å; K153-L157 PolarHBondContact O-N 3.08Å; K153-L157 VanDerWaalsContact O-N 3.08Å; V154-L157 PolarHBondContact O-N 3.24Å; N155-L157 VanDerWaalsContact C-N 3.32Å; N155-L157 PolarHBondContact O-N 3.3Å; L157-D160 PolarHBondContact O-N 3.08Å; L157-F161 WeakPolarHBondContact O-CB 3.42Å; L157-F161 PolarHBondContact O-N 3.49Å
158C88.9Confident90.8Very high69 Ų6986.7 Ų86.747%0.46644%0.435SS..Hα-helixtrans-63.2-43.9174.3-73.10000111.3V154 N155 F161 C162V154-C158 PolarHBondContact O-N 3.18Å; V154-C158 PolarHBondContact O-SG 3.47Å; N155-C158 WeakPolarHBondContact O-CB 3.26Å; N155-C158 PolarHBondContact O-N 2.94Å; C158-F161 PolarHBondContact O-N 3.31Å; C158-C162 WeakPolarHBondContact O-CB 3.38Å; C158-C162 PolarHBondContact O-N 2.93Å; C158-C162 PolarHBondContact O-SG 3.4Å
159K88.3Confident91Very high67 Ų6790 Ų9029%0.29145%0.452SS..Hα-helixtrans-62.2-46176-69.4176.8-166.8164.70111.8N155 E156 F161 C162 N163N155-K159 WeakPolarHBondContact ND2-CE 3.43Å; N155-K159 WeakPolarHBondContact O-CG 3.46Å; N155-K159 PolarHBondContact O-N 3.36Å; E156-K159 PolarHBondContact O-N 2.97Å; E156-K159 IonicContact OE1-NZ 3.52Å; E156-K159 PolarHBondContact OE1-NZ 3.05Å; K159-F161 VanDerWaalsContact C-N 3.34Å; K159-F161 PolarHBondContact O-N 2.96Å; K159-C162 PolarHBondContact O-N 3.05Å; K159-N163 WeakPolarHBondContact O-CB 3.19Å; K159-N163 VanDerWaalsContact O-CG 3.26Å; K159-N163 PolarHBondContact O-N 2.78Å; K159-N163 PolarHBondContact O-ND2 3.04Å
160D92.8Very high90.9Very high83 Ų8393.1 Ų93.144%0.44446%0.463SS..Hα-helixtrans-59.2-46.2176.9-177.867.5000111.3E156 L157 C162 N163 R164E156-D160 PolarHBondContact O-N 2.96Å; L157-D160 PolarHBondContact O-N 3.08Å; D160-C162 PolarHBondContact O-N 3.27Å; D160-N163 PolarHBondContact O-N 3.23Å; D160-R164 WeakPolarHBondContact O-CB 3.45Å; D160-R164 WeakPolarHBondContact O-CG 3.36Å; D160-R164 PolarHBondContact O-N 3.49Å; D160-R164 WeakPolarHBondContact OD2-CD 3.45Å
161F94.2Very high90.9Very high141 Ų14192.4 Ų92.462%0.61847%0.466SS*.Hα-helixtrans-58.3-48.7176176.5-97.9000111.8L157 C158 K159 N163 R164 Y165L157-F161 WeakPolarHBondContact O-CB 3.42Å; L157-F161 PolarHBondContact O-N 3.49Å; C158-F161 PolarHBondContact O-N 3.31Å; K159-F161 VanDerWaalsContact C-N 3.34Å; K159-F161 PolarHBondContact O-N 2.96Å; F161-N163 PolarHBondContact O-N 2.89Å; F161-R164 PolarHBondContact O-N 3.47Å; F161-Y165 VanDerWaalsContact O-CB 3.26Å; F161-Y165 WeakPolarHBondContact O-CB 3.34Å; F161-Y165 PolarHBondContact O-N 3.16Å
162C91.8Very high90.8Very high64 Ų6497.2 Ų97.243%0.43249%0.486SS..Hα-helixtrans-60.2-45.6177.2-73.30000111.8C158 K159 D160 Y165 I166C158-C162 WeakPolarHBondContact O-CB 3.38Å; C158-C162 PolarHBondContact O-N 2.93Å; C158-C162 PolarHBondContact O-SG 3.4Å; K159-C162 PolarHBondContact O-N 3.05Å; D160-C162 PolarHBondContact O-N 3.27Å; C162-Y165 PolarHBondContact O-N 3.47Å; C162-I166 WeakPolarHBondContact O-CB 3.42Å; C162-I166 WeakPolarHBondContact O-CD1 3.46Å; C162-I166 WeakPolarHBondContact O-CG1 3.36Å; C162-I166 PolarHBondContact O-N 2.96Å
163N93.6Very high90.4Very high98 Ų98101 Ų10152%0.52451%0.505SS..Hα-helixtrans-60.8-48178.3-75.5-27.9000111.4K159 D160 F161 Y165 I166 T167K159-N163 WeakPolarHBondContact O-CB 3.19Å; K159-N163 VanDerWaalsContact O-CG 3.26Å; K159-N163 PolarHBondContact O-N 2.78Å; K159-N163 PolarHBondContact O-ND2 3.04Å; D160-N163 PolarHBondContact O-N 3.23Å; F161-N163 PolarHBondContact O-N 2.89Å; N163-Y165 VanDerWaalsContact C-N 3.33Å; N163-Y165 PolarHBondContact O-N 3.47Å; N163-I166 PolarHBondContact O-N 3.16Å; N163-T167 WeakPolarHBondContact O-CB 3.48Å; N163-T167 PolarHBondContact O-N 3.46Å; N163-T167 PolarHBondContact O-OG1 2.86Å
164R93.2Very high89.6Confident175 Ų175100.8 Ų100.866%0.6651%0.506SS*.Hα-helixtrans-63.2-39.6177.4-70.6-178.666.5169.13.2112.3D160 F161 T167 C168D160-R164 WeakPolarHBondContact O-CB 3.45Å; D160-R164 WeakPolarHBondContact O-CG 3.36Å; D160-R164 PolarHBondContact O-N 3.49Å; D160-R164 WeakPolarHBondContact OD2-CD 3.45Å; F161-R164 PolarHBondContact O-N 3.47Å; R164-T167 PolarHBondContact O-N 3.31Å; R164-C168 WeakPolarHBondContact O-CB 3.27Å; R164-C168 PolarHBondContact O-N 3.43Å
165Y95.7Very high88.2Confident138 Ų13899.2 Ų99.254%0.54150%0.498SS..Hα-helixtrans-64.6-46176.8-176.8-110.9000111.5F161 C162 N163 C168 L169F161-Y165 VanDerWaalsContact O-CB 3.26Å; F161-Y165 WeakPolarHBondContact O-CB 3.34Å; F161-Y165 PolarHBondContact O-N 3.16Å; C162-Y165 PolarHBondContact O-N 3.47Å; N163-Y165 VanDerWaalsContact C-N 3.33Å; N163-Y165 PolarHBondContact O-N 3.47Å; Y165-C168 PolarHBondContact O-N 2.93Å; Y165-L169 HydrophobicContact CD1-CD1 3.61Å; Y165-L169 HydrophobicContact CE1-CD1 3.19Å; Y165-L169 HydrophobicContact CE1-CG 4.25Å; Y165-L169 HydrophobicContact CE2-CD1 4.22Å; Y165-L169 HydrophobicContact CE2-CG 4.48Å; Y165-L169 HydrophobicContact CG-CD1 4.28Å; Y165-L169 WeakPolarHBondContact O-CB 3.29Å; Y165-L169 PolarHBondContact O-N 3.21Å
166I93.4Very high86.7Confident76 Ų76100.8 Ų100.839%0.3951%0.507SS..Hα-helixtrans-62.1-45.1175.7-68.8165000110.6C162 N163 C168 L169 K170C162-I166 WeakPolarHBondContact O-CB 3.42Å; C162-I166 WeakPolarHBondContact O-CD1 3.46Å; C162-I166 WeakPolarHBondContact O-CG1 3.36Å; C162-I166 PolarHBondContact O-N 2.96Å; N163-I166 PolarHBondContact O-N 3.16Å; I166-C168 PolarHBondContact O-N 3.17Å; I166-L169 PolarHBondContact O-N 3.4Å; I166-K170 HydrophobicContact CG2-CD 4.04Å; I166-K170 HydrophobicContact CG2-CG 4.3Å; I166-K170 WeakPolarHBondContact O-CB 3.45Å; I166-K170 WeakPolarHBondContact O-CG 3.42Å; I166-K170 PolarHBondContact O-N 3.18Å
167T93.9Very high85.2Confident84 Ų84100.5 Ų100.552%0.51551%0.508SS..Hα-helixtrans-60.2-46.9177.1-62.50000111.1N163 R164 L169 K170 T171N163-T167 WeakPolarHBondContact O-CB 3.48Å; N163-T167 PolarHBondContact O-N 3.46Å; N163-T167 PolarHBondContact O-OG1 2.86Å; R164-T167 PolarHBondContact O-N 3.31Å; T167-L169 PolarHBondContact O-N 3.41Å; T167-K170 PolarHBondContact O-N 3Å; T167-T171 PolarHBondContact O-N 3.49Å; T167-T171 PolarHBondContact O-OG1 3.29Å
168C93.3Very high83.7Confident71 Ų71101.1 Ų101.148%0.4851%0.511SS..Hα-helixtrans-61.8-43.2177.3-175.50000112.4R164 Y165 I166 T171 K172R164-C168 WeakPolarHBondContact O-CB 3.27Å; R164-C168 PolarHBondContact O-N 3.43Å; Y165-C168 PolarHBondContact O-N 2.93Å; I166-C168 PolarHBondContact O-N 3.17Å; C168-T171 PolarHBondContact O-N 3.24Å; C168-K172 PolarHBondContact O-N 3.39Å
169L93.2Very high82.1Confident73 Ų73104 Ų10438%0.38252%0.521SS..Hα-helixtrans-60.7-47.2174.4-88.1165.6000111.7Y165 I166 T167 T171 K172 M173Y165-L169 HydrophobicContact CD1-CD1 3.61Å; Y165-L169 HydrophobicContact CE1-CD1 3.19Å; Y165-L169 HydrophobicContact CE1-CG 4.25Å; Y165-L169 HydrophobicContact CE2-CD1 4.22Å; Y165-L169 HydrophobicContact CE2-CG 4.48Å; Y165-L169 HydrophobicContact CG-CD1 4.28Å; Y165-L169 WeakPolarHBondContact O-CB 3.29Å; Y165-L169 PolarHBondContact O-N 3.21Å; I166-L169 PolarHBondContact O-N 3.4Å; T167-L169 PolarHBondContact O-N 3.41Å; L169-T171 PolarHBondContact O-N 3.43Å; L169-K172 PolarHBondContact O-N 3.38Å; L169-M173 WeakPolarHBondContact O-CB 3.35Å; L169-M173 WeakPolarHBondContact O-CG 3.29Å; L169-M173 PolarHBondContact O-N 2.66Å
170K86.6Confident80.6Confident130 Ų130109.7 Ų109.757%0.56554%0.541SS*.Hα-helixtrans-58.6-48.3177.4-78.5179.9175.4-1780110.5I166 T167 K172 M173 H174I166-K170 HydrophobicContact CG2-CD 4.04Å; I166-K170 HydrophobicContact CG2-CG 4.3Å; I166-K170 WeakPolarHBondContact O-CB 3.45Å; I166-K170 WeakPolarHBondContact O-CG 3.42Å; I166-K170 PolarHBondContact O-N 3.18Å; T167-K170 PolarHBondContact O-N 3Å; K170-K172 PolarHBondContact O-N 3.36Å; K170-M173 PolarHBondContact O-N 3.44Å; K170-H174 WeakPolarHBondContact O-CB 3.41Å; K170-H174 PolarHBondContact O-N 2.86Å; K170-H174 PolarHBondContact O-ND1 3.48Å
171T89.4Confident78.7Confident93 Ų93112.6 Ų112.657%0.57156%0.556SS**Hα-helixtrans-59.1-47177.6-56.40000111.6T167 C168 L169 H174 S175T167-T171 PolarHBondContact O-N 3.49Å; T167-T171 PolarHBondContact O-OG1 3.29Å; C168-T171 PolarHBondContact O-N 3.24Å; L169-T171 PolarHBondContact O-N 3.43Å; T171-H174 PolarHBondContact O-N 3.06Å; T171-S175 WeakPolarHBondContact O-CB 3.43Å; T171-S175 PolarHBondContact O-N 3.42Å; T171-S175 PolarHBondContact O-OG 3.32Å
172K86.3Confident76.5Confident139 Ų139112.5 Ų112.560%0.60456%0.562SS**Hα-helixtrans-64.7-41.2178-87.2-169.3166-174.80113.5C168 L169 K170 S175 D176C168-K172 PolarHBondContact O-N 3.39Å; L169-K172 PolarHBondContact O-N 3.38Å; K170-K172 PolarHBondContact O-N 3.36Å; K172-S175 WeakPolarHBondContact CA-OG 3.46Å; K172-S175 PolarHBondContact O-OG 2.93Å; K172-D176 PolarHBondContact O-N 3.33Å
173M80.1Confident74.5Confident119 Ų119117 Ų11759%0.58658%0.582SS**Hα-helixtrans-70-34.3179.1-72.9-148.774.600112.7L169 K170 N177L169-M173 WeakPolarHBondContact O-CB 3.35Å; L169-M173 WeakPolarHBondContact O-CG 3.29Å; L169-M173 PolarHBondContact O-N 2.66Å; K170-M173 PolarHBondContact O-N 3.44Å; M173-N177 PolarHBondContact O-N 3.12Å; M173-N177 PolarHBondContact O-ND2 2.8Å
174H71.9Confident72Confident135 Ų135116.3 Ų116.363%0.62560%0.597SS**Hα-helixtrans-77-33.7176.6-70.675.1000111.8K170 T171 N177 L178K170-H174 WeakPolarHBondContact O-CB 3.41Å; K170-H174 PolarHBondContact O-N 2.86Å; K170-H174 PolarHBondContact O-ND1 3.48Å; T171-H174 PolarHBondContact O-N 3.06Å; H174-N177 PolarHBondContact O-N 3.31Å; H174-L178 PolarHBondContact O-N 2.91Å
175S60.4Low69.1Low52 Ų52111.3 Ų111.336%0.36460%0.6SS.*Hα-helixtrans-65.8-37.6174.961.60000112.9T171 K172 N177 L178 L179T171-S175 WeakPolarHBondContact O-CB 3.43Å; T171-S175 PolarHBondContact O-N 3.42Å; T171-S175 PolarHBondContact O-OG 3.32Å; K172-S175 WeakPolarHBondContact CA-OG 3.46Å; K172-S175 PolarHBondContact O-OG 2.93Å; S175-N177 VanDerWaalsContact C-N 3.33Å; S175-N177 PolarHBondContact O-N 3.44Å; S175-L178 PolarHBondContact O-N 3.04Å; S175-L179 WeakPolarHBondContact O-CG 3.48Å; S175-L179 PolarHBondContact O-N 3.42Å
176D56Low66.9Low95 Ų95109.8 Ų109.851%0.50861%0.607SS.*Hα-helixtrans-71.6-26.5178.5-72.6-24.5000113.1K172 R180K172-D176 PolarHBondContact O-N 3.33Å; D176-R180 PolarHBondContact O-N 2.99Å
177N57.7Low64.5Low87 Ų87117.1 Ų117.147%0.46563%0.631SS.*Hα-helixtrans-75.6-32.1172.3-80.6-79.3000111.8M173 H174 S175M173-N177 PolarHBondContact O-N 3.12Å; M173-N177 PolarHBondContact O-ND2 2.8Å; H174-N177 PolarHBondContact O-N 3.31Å; S175-N177 VanDerWaalsContact C-N 3.33Å; S175-N177 PolarHBondContact O-N 3.44Å
178L56.6Low61.6Low135 Ų135118.7 Ų118.771%0.70765%0.646SS**Hα-helixtrans-68.6-43.8174.2-133.972.2000111.4H174 S175 R180 N181H174-L178 PolarHBondContact O-N 2.91Å; S175-L178 PolarHBondContact O-N 3.04Å; L178-R180 VanDerWaalsContact C-N 3.3Å; L178-R180 PolarHBondContact O-N 3.22Å; L178-N181 PolarHBondContact O-N 2.86Å
179L55.6Low59.5Low128 Ų128120.4 Ų120.467%0.6766%0.656SS**Hα-helixtrans-72-18.3-179.7-68.3172.8000114.4S175S175-L179 WeakPolarHBondContact O-CG 3.48Å; S175-L179 PolarHBondContact O-N 3.42Å
180R56.9Low56.8Low187 Ų187121.8 Ų121.871%0.70667%0.672SS**THydrogen-bonded Turntrans-85-11.4174.7-164.5158.368.6-129.2-0.8113.2D176 L178D176-R180 PolarHBondContact O-N 2.99Å; L178-R180 VanDerWaalsContact C-N 3.3Å; L178-R180 PolarHBondContact O-N 3.22Å
181N52.7Low54.4Low144 Ų144124.4 Ų124.477%0.7769%0.686SS**SBendtrans-92-6.6-178-130.980.8000113.7L178L178-N181 PolarHBondContact O-N 2.86Å
182D47.9Very low51.9Low139 Ų139125.9 Ų125.974%0.74369%0.694SS**SBendtrans-104.92.6-174.2-112.8-84.4000115.3
183L49.7Very low49.5Very low160 Ų160123.7 Ų123.784%0.83870%0.697SS**SBendtrans-11178.5173.9-87.684.7000112.8
184G41.3Very low47.4Very low83 Ų83126 Ų12686%0.85671%0.71SS**  89.6110.4126.700000119.5
185G33.3Very low45.6Very low69 Ų69123.5 Ų123.571%0.71171%0.708SS**  trans170.791.5151.700000114
186P48.7Very low44.5Very low106 Ų106127.9 Ų127.969%0.68873%0.725SS**  trans-72.3154.5166.932.9-30.5000108.6
187Y42.4Very low43.6Very low231 Ų231130.7 Ų130.791%0.90674%0.735SS**  trans83.487.6-174-44.8-71.5000115.6
188S34.1Very low42.5Very low116 Ų116133.7 Ų133.781%0.81175%0.746SS**  -171.6137.4113.5-161.60000110.7
189P49.3Very low41.4Very low108 Ų108134.1 Ų134.170%0.70175%0.745SS**  trans-84.8141177.333.7-30.1000111.9
190S36.5Very low40.4Very low101 Ų101134 Ų13471%0.70674%0.744SS**  trans54.7119143.7-44.50000119.2
191H35.8Very low39.2Very low186 Ų186131.1 Ų131.186%0.86174%0.741SS**  -161.8100.7124.8-86.3-61.5000111.5
192T36.6Very low38.1Very low123 Ų123131.8 Ų131.876%0.75574%0.739SS**  66.3101.2129.1-33.90000121.5
193S35.5Very low37.2Very low93 Ų93130.9 Ų130.965%0.6574%0.739SS**  62.6119.1125.1-171.90000121.7
194L36.1Very low36.3Very low167 Ų167128.6 Ų128.687%0.87474%0.737SS**  -174.587.5117.9-92.1166000105.5
195S35.4Very low35.6Very low83 Ų83130 Ų13058%0.5873%0.733SS**  60.9118.674.3-152.90000115.2
196M37.6Very low36.8Very low145 Ų145132 Ų13271%0.71473%0.734SS**  trans83.9133.2160.6-49.8-73.478.500117.8
197Q36.9Very low35.8Very low154 Ų154131.5 Ų131.572%0.7273%0.733SS**  cis-175.7117.8-9.8-172.8148.77.100108.3
198Q34.4Very low35.1Very low150 Ų150127.7 Ų127.770%0.70173%0.725SS**  trans10.1126.9132.7-150.374.738.700119.1
199E33.7Very low34.9Very low144 Ų144128.6 Ų128.667%0.67373%0.726SS**  trans54.4150136.9-81.4-174.3102.200121.4
200L34.4Very low33.8Very low125 Ų125128 Ų12865%0.65472%0.724SS**  cis-168.4171.61.3-16983000105.1
201I30.7Very low33.4Very low127 Ų127129.2 Ų129.265%0.65173%0.727SS**  trans75.2117.9154.418.2-173.7000123.1
202Q30.1Very low32.9Very low157 Ų157125.7 Ų125.773%0.73472%0.724SS**  80.9121.9123.4-125.9123.945.700122.7
203T28.8Very low32.6Very low120 Ų120125.1 Ų125.174%0.73673%0.725SS**  trans79.2135.6137.3480000122.3
204S30.3Very low32.1Very low113 Ų113126.5 Ų126.579%0.7973%0.734SS**  trans75.3103151.641.20000119.8
205S28Very low31.8Very low112 Ų112124.1 Ų124.178%0.78373%0.727SS**  trans-47.7-179.5140.7-52.50000112.7
206P57.9Low31.6Very low110 Ų110127.3 Ų127.371%0.71474%0.737SS**  cis-128.7168.5-30.723.5-3000111.1
207S26.5Very low31Very low96 Ų96124.9 Ų124.967%0.67173%0.734SS**  trans176.6121.2133-91.10000115.3
208M29.2Very low30.6Very low152 Ų152123.4 Ų123.475%0.74974%0.741SS**  trans57.9141.5131.6-35.2-65.5170.500121.8
209T29.2Very low30.2Very low134 Ų134120 Ų12082%0.82275%0.746SS**  trans75.4137.2152.963.70000116.8
210S26.5Very low30Very low96 Ų96120.8 Ų120.867%0.67175%0.753SS**  cis-175.7145.4-0.344.30000107.9
211V27.1Very low29.9Very low126 Ų126121.3 Ų121.376%0.76476%0.761SS**  trans17129146-49.50000118.8
212S26Very low30Very low113 Ų113121.7 Ų121.779%0.7977%0.769SS**  178.7131.6102.6-75.70000112.8
213S29.5Very low30.5Very low111 Ų111120.5 Ų120.578%0.77678%0.775SS**  trans-56.8148.7166.244.60000114.7
214S26.7Very low30.7Very low122 Ų122119.7 Ų119.785%0.85378%0.78SS**  trans-144.1140146.3-172.60000110.5
215V29Very low30.5Very low117 Ų117118 Ų11871%0.70978%0.781SS**  trans-113152.6-167.4-760000110.9
216N30.1Very low30.6Very low150 Ų150116.3 Ų116.380%0.80278%0.782SS**  trans68.1151.6150.4-81.95.7000118.2
217S25.4Very low29.3Very low93 Ų93119.8 Ų119.865%0.6579%0.793SS**  cis-171.9158.610.8-116.10000109.6
218S29Very low29.7Very low124 Ų124124.2 Ų124.287%0.86780%0.803SS**  trans123.7124.5138.9-51.60000117.6
219G26.8Very low29.9Very low78 Ų78126.1 Ų126.180%0.80481%0.81SS**  trans122.47913300000121.1
220I29.4Very low30Very low160 Ų160125.4 Ų125.482%0.82181%0.811SS**  trans8125.9140.1-101.8165.3000120.8
221V31.1Very low30.3Very low137 Ų137128.7 Ų128.783%0.8382%0.821SS**  177.1143.2105.5-81.10000111.6
222V33.6Very low30.6Very low134 Ų134129.6 Ų129.681%0.81283%0.826SS**  trans-105.2151176.4176.50000109.4
223P40.2Very low30.8Very low132 Ų132128.3 Ų128.386%0.85782%0.823SS**  -139.9164.7108.227.3-6.7000114.8
224A32.8Very low30.9Very low103 Ų103132 Ų13285%0.85183%0.83SS**  trans-78.5156.4-159.900000117.8
225G26.7Very low31.4Very low77 Ų77131.9 Ų131.979%0.79482%0.824SS**  trans-169.2113.7156.400000110.6
226G29.4Very low31.7Very low78 Ų78132.8 Ų132.880%0.80483%0.83SS**  trans-70.1170.5175.700000112.7
227L30Very low32.1Very low183 Ų183133 Ų13396%0.95883%0.829SS**  cis-153.4156.235.8-96.6161.7000111.3
228Q35Very low32.5Very low189 Ų189136 Ų13688%0.88384%0.839SS**  trans-86.5152.6-164.6-68.9168.29.900114.7
229Q34.8Very low32.8Very low192 Ų192135.4 Ų135.490%0.89783%0.834SS**  trans-64.1148.9168.9-77.9164-15.200112.8N231Q229-N231 PolarHBondContact O-N 3.35Å
230S30.3Very low33.1Very low119 Ų119140.5 Ų140.583%0.83284%0.837SS**  trans-68.5113.2-176.3-470000113.1
231N32.4Very low33.3Very low164 Ų164139.7 Ų139.788%0.87784%0.839SS**  trans-109.7114.3155.7-84.6-3.6000108Q229Q229-N231 PolarHBondContact O-N 3.35Å
232V35.1Very low33.4Very low146 Ų146139.6 Ų139.689%0.88584%0.838SS**  trans-86.3108.5167.8-1080000108
233A30Very low33.4Very low86 Ų86139.5 Ų139.571%0.71184%0.844SS**  trans-89.4122.2170.300000109.3
234M30.2Very low33.2Very low188 Ų188136 Ų13693%0.92683%0.832SS**  trans-87.7107.3167.8-73.9-73.2-172.600108
235T37.3Very low33.7Very low120 Ų120135.4 Ų135.474%0.73684%0.836SS**  trans-105.7111.4175.4-23.20000109.1I237T235-I237 PolarHBondContact O-N 2.9Å
236T36.6Very low34.3Very low136 Ų136138 Ų13883%0.83484%0.837SS**  trans-70.9122.4171.7-59.90000109.1
237I37.2Very low34.5Very low153 Ų153142.3 Ų142.379%0.78584%0.84SS**  trans-100.4133.9177.1-29.4174.6000108.7T235T235-I237 PolarHBondContact O-N 2.9Å
238N35Very low34.9Very low158 Ų158143.3 Ų143.385%0.84583%0.833SS**  trans-15.5123.4-179.5-110.2-22.4000118.4
239S34.8Very low34.8Very low111 Ų111142 Ų14278%0.77683%0.826SS**PPolyproline II helixtrans-82.9117.2167.9-70.50000110.8
240Q32.6Very low35.1Very low185 Ų185138.1 Ų138.186%0.86482%0.818SS**PPolyproline II helixtrans-96.4122.3167.846.1-174.5-26.400108.9
241V33.2Very low35.5Very low142 Ų142138.4 Ų138.486%0.86181%0.814SS**PPolyproline II helixtrans-86.8129179.7-71.30000110.3
242V33.2Very low36.1Very low135 Ų135134 Ų13482%0.81880%0.8SS**  trans-120.6133.7165.2176.10000107.5G244V242-G244 PolarHBondContact O-N 3.43Å; V242-G244 VanDerWaalsContact O-N 3.16Å
243S34.3Very low36.5Very low132 Ų132134.3 Ų134.392%0.92379%0.794SS**SBendtrans-50.6114.4-179.1-67.80000112.4
244G35.5Very low37Very low60 Ų60135.1 Ų135.162%0.61979%0.79SS**SBendtrans144.657.2174.700000115.9V242 T246V242-G244 PolarHBondContact O-N 3.43Å; V242-G244 VanDerWaalsContact O-N 3.16Å; G244-T246 VanDerWaalsContact C-N 3.35Å; G244-T246 PolarHBondContact O-N 3Å; G244-T246 PolarHBondContact O-OG1 3.21Å
245G43.4Very low38.1Very low89 Ų89129.8 Ų129.892%0.91877%0.768SS**SBendtrans48.118.4142.400000123.2
246T39.4Very low38.5Very low133 Ų133130.4 Ų130.482%0.81678%0.777SS**  trans-142.1119.9176.8-60000112.1G244G244-T246 VanDerWaalsContact C-N 3.35Å; G244-T246 PolarHBondContact O-N 3Å; G244-T246 PolarHBondContact O-OG1 3.21Å
247L33.5Very low38.9Very low168 Ų168132.2 Ų132.288%0.8878%0.776SS**  trans-81.4118177.6-14999.2000109.1
248Y38.1Very low39.5Very low204 Ų204127.7 Ų127.780%0.877%0.768SS**  trans-110123.7171.5-144.6-92.3000108.8P250Y248-P250 WeakPolarHBondContact O-CD 3.3Å
249Q34.6Very low39.6Very low161 Ų161126.7 Ų126.775%0.75276%0.758SS**  trans-108.7104.2175.7-147.7177.336.800108.1V251Q249-V251 PolarHBondContact O-N 3.46Å
250P40Very low40.1Very low110 Ų110126.2 Ų126.271%0.71475%0.75SS**  trans-80.5117.8170.330-29.4000109.2Y248 A252Y248-P250 WeakPolarHBondContact O-CD 3.3Å; P250-A252 PolarHBondContact O-N 3.01Å
251V38.8Very low40.3Very low125 Ų125124 Ų12476%0.75874%0.744SS**  trans-81.8113168.7-178.50000107.9Q249Q249-V251 PolarHBondContact O-N 3.46Å
252A44.5Very low40.7Very low71 Ų71123.5 Ų123.559%0.58774%0.741SS**  trans-90.9127.3171.100000109.4P250P250-A252 PolarHBondContact O-N 3.01Å
253M43.8Very low40.8Very low153 Ų153125.2 Ų125.275%0.75474%0.74SS**  trans-105.5122175-30.2-162.7-69.200107.9
254V41Very low40.8Very low103 Ų103123.7 Ų123.762%0.62474%0.735SS**BIsolated β-bridgetrans-95.5124.1172.6169.70000108.2
255T53.5Low40.8Very low76 Ų76127.2 Ų127.247%0.46674%0.74SS.*  trans-78.9158.8172.771.70000109.8Q257 G258T255-Q257 PolarHBondContact O-N 3.2Å; T255-G258 PolarHBondContact O-N 3.19Å
256S44.4Very low40.4Very low133 Ų133128.4 Ų128.493%0.9373%0.731SS**THydrogen-bonded Turntrans-61.62.7-176.253.60000115.9
257Q46.9Very low40.2Very low174 Ų174128.7 Ų128.781%0.81374%0.735SS**THydrogen-bonded Turntrans-113.110.6173.1-67.1-167.96.400114.3T255 Q259T255-Q257 PolarHBondContact O-N 3.2Å; Q257-Q259 PolarHBondContact O-N 3.28Å
258G48.2Very low40.2Very low59 Ų59124 Ų12461%0.60873%0.728SS**  trans7721.1167.200000116.3T255T255-G258 PolarHBondContact O-N 3.19Å
259Q37.5Very low40Very low137 Ų137120.5 Ų120.564%0.6473%0.727SS**  trans-99.1132.9171.1-76-177.7-24.800111.6Q257Q257-Q259 PolarHBondContact O-N 3.28Å
260V45.5Very low39.9Very low101 Ų101120 Ų12061%0.61273%0.729SS**BIsolated β-bridgetrans-97.2116.8178.4-166.30000108.7
261L38Very low39.4Very low138 Ų138122.9 Ų122.972%0.72373%0.733SS**  trans-110.5115.6175.7-91.6146.5000109.4
262T40.7Very low39Very low131 Ų131124.3 Ų124.380%0.80473%0.734SS**  trans-98.2111.3172.447.40000109.2
263Q34.8Very low38.1Very low171 Ų171129.5 Ų129.580%0.79975%0.746SS**PPolyproline II helixtrans-103.6118.4173.2-165.9-171.110000109.5
264A34.4Very low37.6Very low100 Ų100129.3 Ų129.383%0.82675%0.748SS**PPolyproline II helixtrans-97.9125.1172.700000110.1
265L35.4Very low37.2Very low135 Ų135129 Ų12971%0.70775%0.751SS**PPolyproline II helixtrans-100.8137.6169.9-77.7151.3000109.3
266P35.3Very low36.1Very low114 Ų114133.6 Ų133.674%0.7477%0.767SS**PPolyproline II helixtrans-82.5156.1-177.131.4-32.7000113.5
267P36.1Very low35.6Very low138 Ų138134 Ų13490%0.89676%0.764SS**PPolyproline II helixtrans-82.9132-169.932.1-32.8000113.2
268G32.2Very low34.7Very low71 Ų71133.1 Ų133.173%0.73276%0.764SS**  trans-123.8119.5170.900000111.1
269T33.7Very low34.4Very low129 Ų129136.6 Ų136.679%0.79177%0.773SS**  trans-41.2124.5-179-47.80000116.4Q271T269-Q271 HydrophobicContact CG2-CG 4.17Å
270I32.3Very low34Very low151 Ų151136.9 Ų136.977%0.77478%0.78SS**  trans-127101.8155.8-66.6174.1000108.3I272I270-I272 HydrophobicContact CG2-CG1 4.05Å
271Q29.4Very low33.7Very low171 Ų171140.4 Ų140.480%0.79979%0.794SS**  trans-85.1126.2165.2-78.1-85.130.400108.2T269T269-Q271 HydrophobicContact CG2-CG 4.17Å
272I31.7Very low33.6Very low154 Ų154138.9 Ų138.979%0.7980%0.795SS**  trans-104.3102.6171.2-58.4178.2000107.7I270I270-I272 HydrophobicContact CG2-CG1 4.05Å
273Q25.5Very low33.2Very low181 Ų181138.5 Ų138.585%0.84680%0.798SS**  trans-97.6120171.1-163.2105.279.700109.1
274N34Very low33.8Very low149 Ų149138.1 Ų138.180%0.79780%0.8SS**  trans-82.1122.9173.7-174.8-11000109.4
275S30.8Very low33.9Very low97 Ų97141.1 Ų141.168%0.67880%0.802SS**  trans-162.4116.6163.6-77.90000112.9
276Q31.2Very low33.7Very low172 Ų172142 Ų14280%0.80481%0.807SS**  trans44.8120.2136-79.1168.9-24.100122.1
277V34.3Very low33.5Very low142 Ų142141.7 Ų141.786%0.86181%0.808SS**  trans1.8116.5140.3-71.90000118.4
278N28.6Very low33.7Very low154 Ų154143.8 Ų143.882%0.82481%0.805SS**  trans-152.4136.2140.4-160.70.8000110.4
279V41.3Very low34.4Very low132 Ų132147.2 Ų147.280%0.881%0.807SS**  trans-87.7126.8175.6-77.10000108.3
280D28.6Very low34.4Very low144 Ų144150.3 Ų150.377%0.7781%0.81SS**  trans-140126161.8-159.6-82.6000110.7S282D280-S282 WeakPolarHBondContact OD1-CB 3.47Å; D280-S282 PolarHBondContact OD1-N 2.95Å
281L40.3Very low35.3Very low174 Ų174153.4 Ų153.491%0.91182%0.817SS**  trans-100.321.1-167.4175.852.6000111.8
282S34.9Very low35.8Very low107 Ų107150.8 Ų150.875%0.74882%0.818SS**  trans-120.135.6-165.3-138.20000117D280D280-S282 WeakPolarHBondContact OD1-CB 3.47Å; D280-S282 PolarHBondContact OD1-N 2.95Å
283S33.6Very low36.5Very low123 Ų123152.8 Ų152.886%0.8682%0.821SS**  trans-137.646174.1-173.90000114.2
284L45.4Very low37.4Very low163 Ų163152 Ų15285%0.85382%0.823SS**  trans-87.1118.3151.1-101.6162.6000106.7
285L38.4Very low38Very low163 Ų163154.6 Ų154.685%0.85383%0.827SS**  trans162.1127133.8-79.3-178.4000107.8
286D30.8Very low38.8Very low152 Ų152161.8 Ų161.881%0.81384%0.839SS**  trans89.798.1170.5-148.5-84.3000117.9
287S30.2Very low40.2Very low109 Ų109157.5 Ų157.576%0.76284%0.84SS**  159.2106.5125.6-85.10000109.8
288E40.8Very low42.2Very low181 Ų181157.2 Ų157.285%0.84684%0.839SS**  trans-60.7152.5165.3-72.2-17887.800111.2
289D45.7Very low45Very low143 Ų143152 Ų15277%0.76581%0.811SS**  trans63.782.7166.7-75.9-67.3000119.4
290K35Very low47.3Very low195 Ų195149.1 Ų149.185%0.84880%0.795SS**  trans-147.796.1142.4-70.2-160.7175.668.30113.6S292K290-S292 PolarHBondContact O-N 3.12Å
291K50.4Low50Low216 Ų216151 Ų15194%0.93980%0.796SS**  trans-12.587.3148.8-148.8168-167168.70115
292S40.3Very low52.5Low115 Ų115148.7 Ų148.780%0.80478%0.78SS**  trans-100.1109.4174.267.20000111.7K290 N294K290-S292 PolarHBondContact O-N 3.12Å; S292-N294 PolarHBondContact O-N 3.14Å
293K45.5Very low55.2Low197 Ų197143.6 Ų143.686%0.85775%0.745SS**  trans-55127.1176.2-68.4166.2175.7171.60112.6K295K293-K295 PolarHBondContact O-N 3.03Å
294N45.8Very low57.9Low165 Ų165138.7 Ų138.788%0.88271%0.71SS**  trans21.387.8148-634.8000118S292S292-N294 PolarHBondContact O-N 3.14Å
295K46.8Very low60.2Low203 Ų203135.2 Ų135.288%0.88369%0.692SS**  trans-84.9130.3138.9-70.4179.2178.9177.20107.4K293 G297K293-K295 PolarHBondContact O-N 3.03Å; K295-G297 PolarHBondContact O-N 2.92Å
296R46.5Very low62.8Low248 Ų248129 Ų12994%0.93666%0.66SS**SBendtrans-48.2116.1-177.2-122.1175.4-82.8-162.5-4.5112.1V298R296-V298 PolarHBondContact O-N 3.4Å
297G61.9Low65.8Low81 Ų81121.8 Ų121.884%0.83562%0.621SS**SBendtrans75.922.3130.500000120.7K295K295-G297 PolarHBondContact O-N 2.92Å
298V76.2Confident68.7Low137 Ų137122.1 Ų122.183%0.8361%0.605SS**  trans-111.2120.5171.9-174.80000110R296R296-V298 PolarHBondContact O-N 3.4Å
299L85.9Confident71.2Confident45 Ų45116.6 Ų116.624%0.23659%0.587CS.*  trans-68.7150.1176.8-63.8173000110.6M307 L334 W342L299-M307 HydrophobicContact CD1-CE 3.83Å; L299-L334 HydrophobicContact CD1-CD1 4.08Å; L299-L334 HydrophobicContact CD2-CD1 4.05Å; L299-L334 HydrophobicContact CD2-CD2 3.84Å; L299-W342 HydrophobicContact CD1-CB 4.34Å; L299-W342 VanDerWaalsContact CD1-CD1 3.42Å; L299-W342 HydrophobicContact CD1-CG 4.12Å
300P89.9Confident73.5Confident71 Ų71111.1 Ų111.146%0.46156%0.555SS.*  trans-51.2142.6176.4-26.834.7000112.5H302 A303 T304P300-H302 VanDerWaalsContact C-N 3.3Å; P300-H302 PolarHBondContact O-N 3.16Å; P300-A303 HydrophobicContact CB-CB 4.14Å; P300-A303 WeakPolarHBondContact O-CB 3.5Å; P300-A303 PolarHBondContact O-N 2.93Å; P300-T304 PolarHBondContact O-N 2.56Å; P300-T304 PolarHBondContact O-OG1 3.26Å; P300-T304 VanDerWaalsContact O-OG1 3.04Å
301K86.3Confident76.2Confident182 Ų182101.9 Ų101.979%0.79152%0.515SS*.Hα-helixtrans-59.2-41.6-179.3-68.8-177.4179.41790111.9T304 N305K301-T304 PolarHBondContact O-N 3.03Å; K301-N305 WeakPolarHBondContact O-CB 3.35Å; K301-N305 PolarHBondContact O-N 3.41Å; K301-N305 PolarHBondContact O-OD1 3.03Å
302H91.2Very high78Confident126 Ų12696.5 Ų96.558%0.58349%0.492SS*.Hα-helixtrans-58.5-49176.1178.465.6000111.8P300 T304 N305 I306P300-H302 VanDerWaalsContact C-N 3.3Å; P300-H302 PolarHBondContact O-N 3.16Å; H302-T304 PolarHBondContact O-N 3.25Å; H302-N305 PolarHBondContact O-N 3.39Å; H302-I306 WeakPolarHBondContact NE2-CD1 3.32Å; H302-I306 PolarHBondContact O-N 3.5Å; H302-I306 VanDerWaalsContact O-N 3.16Å
303A91.4Very high80.3Confident1 Ų198 Ų981%0.00849%0.486CS..Hα-helixtrans-58.8-46.3176.500000112.3P300 N305 I306 M307 T332 L334P300-A303 HydrophobicContact CB-CB 4.14Å; P300-A303 WeakPolarHBondContact O-CB 3.5Å; P300-A303 PolarHBondContact O-N 2.93Å; A303-N305 VanDerWaalsContact C-N 3.3Å; A303-N305 PolarHBondContact O-N 3.05Å; A303-I306 PolarHBondContact O-N 3.24Å; A303-M307 WeakPolarHBondContact O-CE 3.46Å; A303-M307 WeakPolarHBondContact O-CG 3.5Å; A303-M307 PolarHBondContact O-N 3.33Å; A303-T332 HydrophobicContact CB-CG2 4.01Å; A303-L334 HydrophobicContact CB-CD1 3.86Å; A303-L334 HydrophobicContact CB-CG 4.17Å
304T91.7Very high82.4Confident20 Ų2091.6 Ų91.612%0.12346%0.459CS..Hα-helixtrans-64.5-35.1179.1-53.10000112P300 K301 H302 R308 W342P300-T304 PolarHBondContact O-N 2.56Å; P300-T304 PolarHBondContact O-OG1 3.26Å; P300-T304 VanDerWaalsContact O-OG1 3.04Å; K301-T304 PolarHBondContact O-N 3.03Å; H302-T304 PolarHBondContact O-N 3.25Å; T304-R308 HydrophobicContact CG2-CG 4.37Å; T304-R308 WeakPolarHBondContact O-CB 3.16Å; T304-R308 VanDerWaalsContact O-CG 3.23Å; T304-R308 WeakPolarHBondContact O-CG 3.33Å; T304-R308 PolarHBondContact O-N 3.26Å; T304-W342 HydrophobicContact CG2-CZ2 4.04Å
305N93.7Very high84.3Confident89 Ų8986 Ų8648%0.47643%0.429SS..Hα-helixtrans-66.4-44.3177.6-71.6-8.4000111.7K301 H302 A303 R308 S309K301-N305 WeakPolarHBondContact O-CB 3.35Å; K301-N305 PolarHBondContact O-N 3.41Å; K301-N305 PolarHBondContact O-OD1 3.03Å; H302-N305 PolarHBondContact O-N 3.39Å; A303-N305 VanDerWaalsContact C-N 3.3Å; A303-N305 PolarHBondContact O-N 3.05Å; N305-R308 PolarHBondContact O-N 3.3Å; N305-S309 WeakPolarHBondContact O-CB 3.48Å; N305-S309 PolarHBondContact O-N 3.48Å; N305-S309 PolarHBondContact O-OG 2.94Å; N305-S309 VanDerWaalsContact O-OG 3.04Å
306I92.1Very high85.9Confident34 Ų3484.3 Ų84.317%0.17443%0.426CS..Hα-helixtrans-60.1-48.5176.8-67.6166.7000110.6H302 A303 R308 S309 W310 Q331 T332H302-I306 WeakPolarHBondContact NE2-CD1 3.32Å; H302-I306 PolarHBondContact O-N 3.5Å; H302-I306 VanDerWaalsContact O-N 3.16Å; A303-I306 PolarHBondContact O-N 3.24Å; I306-R308 VanDerWaalsContact C-N 3.33Å; I306-R308 PolarHBondContact O-N 3.44Å; I306-S309 PolarHBondContact O-N 3.25Å; I306-W310 PolarHBondContact O-N 3.4Å; I306-Q331 HydrophobicContact CD1-CB 4.18Å; I306-T332 HydrophobicContact CB-CG2 3.83Å; I306-T332 HydrophobicContact CD1-CG2 3.93Å; I306-T332 HydrophobicContact CG1-CG2 4.47Å; I306-T332 HydrophobicContact CG2-CG2 3.91Å
307M93.8Very high87.6Confident0 Ų078.3 Ų78.30%041%0.409CS..Hα-helixtrans-66.3-34.5-179.5-61.2-176.8-72.700112.7L299 A303 L311 I328 T332 L334 V339 W342 F343L299-M307 HydrophobicContact CD1-CE 3.83Å; A303-M307 WeakPolarHBondContact O-CE 3.46Å; A303-M307 WeakPolarHBondContact O-CG 3.5Å; A303-M307 PolarHBondContact O-N 3.33Å; M307-L311 WeakPolarHBondContact O-CB 3.43Å; M307-L311 PolarHBondContact O-N 3.29Å; M307-I328 HydrophobicContact CG-CG2 3.65Å; M307-I328 HydrophobicContact SD-CG2 4.49Å; M307-T332 HydrophobicContact CG-CG2 4.37Å; M307-L334 HydrophobicContact CE-CD1 3.81Å; M307-L334 HydrophobicContact SD-CD1 4.17Å; M307-V339 HydrophobicContact SD-CG2 4.44Å; M307-W342 VanDerWaalsContact C-CH2 3.45Å; M307-W342 HydrophobicContact CB-CD2 3.87Å; M307-W342 HydrophobicContact CB-CE3 3.45Å; M307-W342 VanDerWaalsContact CB-CE3 3.45Å; M307-W342 HydrophobicContact CB-CH2 3.56Å; M307-W342 HydrophobicContact CB-CZ2 3.94Å; M307-W342 HydrophobicContact CB-CZ3 3.31Å; M307-W342 HydrophobicContact CE-CB 4.19Å; M307-W342 HydrophobicContact CE-CD2 3.63Å; M307-W342 HydrophobicContact CE-CE3 4.34Å; M307-W342 HydrophobicContact CE-CG 3.53Å; M307-W342 HydrophobicContact CG-CD2 4.37Å; M307-W342 HydrophobicContact CG-CE3 4.15Å; M307-W342 HydrophobicContact CG-CZ3 4.45Å; M307-W342 WeakPolarHBondContact O-CZ3 3.43Å; M307-W342 HydrophobicContact SD-CB 3.85Å; M307-W342 HydrophobicContact SD-CD2 3.6Å; M307-W342 HydrophobicContact SD-CE3 3.8Å; M307-W342 HydrophobicContact SD-CG 3.64Å; M307-F343 HydrophobicContact CB-CE2 4.37Å; M307-F343 HydrophobicContact CB-CZ 4.05Å; M307-F343 HydrophobicContact CG-CE2 4.29Å; M307-F343 HydrophobicContact CG-CZ 4.4Å
308R91.1Very high88.9Confident116 Ų11675 Ų7544%0.43837%0.372SS..Hα-helixtrans-66-46172.4-78.4177.4177.5178.2-1.6111.9T304 N305 I306 W310 L311 F312 W342T304-R308 HydrophobicContact CG2-CG 4.37Å; T304-R308 WeakPolarHBondContact O-CB 3.16Å; T304-R308 VanDerWaalsContact O-CG 3.23Å; T304-R308 WeakPolarHBondContact O-CG 3.33Å; T304-R308 PolarHBondContact O-N 3.26Å; N305-R308 PolarHBondContact O-N 3.3Å; I306-R308 VanDerWaalsContact C-N 3.33Å; I306-R308 PolarHBondContact O-N 3.44Å; R308-W310 VanDerWaalsContact C-N 3.31Å; R308-W310 PolarHBondContact O-N 3.19Å; R308-L311 PolarHBondContact O-N 3.47Å; R308-F312 HydrophobicContact CB-CD2 4.26Å; R308-F312 HydrophobicContact CB-CE2 4.03Å; R308-F312 HydrophobicContact CG-CE2 4.49Å; R308-F312 WeakPolarHBondContact O-CD2 3.38Å; R308-F312 PolarHBondContact O-N 3.42Å; R308-W342 HydrophobicContact CB-CH2 4.41Å; R308-W342 HydrophobicContact CG-CH2 3.73Å; R308-W342 HydrophobicContact CG-CZ2 3.76Å
309S93.3Very high89.6Confident65 Ų6574.7 Ų74.746%0.45536%0.357SS..Hα-helixtrans-57.9-45.4177.9-64.80000111.4N305 I306 F312 Q313N305-S309 WeakPolarHBondContact O-CB 3.48Å; N305-S309 PolarHBondContact O-N 3.48Å; N305-S309 PolarHBondContact O-OG 2.94Å; N305-S309 VanDerWaalsContact O-OG 3.04Å; I306-S309 PolarHBondContact O-N 3.25Å; S309-F312 PolarHBondContact O-N 3.22Å; S309-Q313 VanDerWaalsContact O-CG 3.28Å; S309-Q313 WeakPolarHBondContact O-CG 3.43Å; S309-Q313 PolarHBondContact O-N 3.42Å; S309-Q313 VanDerWaalsContact O-N 3.1Å
310W94.1Very high89.9Confident27 Ų2773 Ų7310%0.10235%0.349CS..Hα-helixtrans-62-45.4175.9-171.596.2000111.6I306 R308 F312 Q313 H314 P320 E324 I328 F343I306-W310 PolarHBondContact O-N 3.4Å; R308-W310 VanDerWaalsContact C-N 3.31Å; R308-W310 PolarHBondContact O-N 3.19Å; W310-F312 VanDerWaalsContact C-N 3.34Å; W310-F312 PolarHBondContact O-N 3.08Å; W310-Q313 PolarHBondContact O-N 3.45Å; W310-H314 AromaticContact CD1-CE1 3.87Å; W310-H314 AromaticContact CD1-ND1 3.92Å; W310-H314 AromaticContact CD2-ND1 3.58Å; W310-H314 AromaticContact CE2-CE1 3.62Å; W310-H314 AromaticContact CE2-CG 3.82Å; W310-H314 AromaticContact CE2-ND1 3.36Å; W310-H314 HydrophobicContact CE3-CB 4.23Å; W310-H314 AromaticContact CG-ND1 3.92Å; W310-H314 HydrophobicContact CH2-CB 3.67Å; W310-H314 AromaticContact CH2-CG 3.74Å; W310-H314 HydrophobicContact CZ2-CB 4.07Å; W310-H314 AromaticContact CZ2-CD2 3.89Å; W310-H314 AromaticContact CZ2-CE1 3.96Å; W310-H314 AromaticContact CZ2-CG 3.59Å; W310-H314 AromaticContact CZ2-ND1 3.64Å; W310-H314 HydrophobicContact CZ3-CB 3.78Å; W310-H314 AromaticContact NE1-CE1 3.44Å; W310-H314 PolarHBondContact NE1-CE1 3.14Å; W310-H314 AromaticContact NE1-ND1 3.61Å; W310-H314 PolarHBondContact O-N 2.91Å; W310-H314 PolarHBondContact O-ND1 2.92Å; W310-P320 HydrophobicContact CD2-CB 4.47Å; W310-P320 HydrophobicContact CE3-CB 4.4Å; W310-P320 HydrophobicContact CH2-CB 3.49Å; W310-P320 VanDerWaalsContact CH2-CB 3.49Å; W310-P320 HydrophobicContact CH2-CG 4.05Å; W310-P320 VanDerWaalsContact CZ2-CA 3.44Å; W310-P320 HydrophobicContact CZ2-CB 3.51Å; W310-P320 HydrophobicContact CZ3-CB 3.94Å; W310-P320 HydrophobicContact CZ3-CG 4.08Å; W310-E324 WeakPolarHBondContact CZ2-OE1 3.21Å; W310-E324 PolarHBondContact NE1-OE1 3.03Å; W310-E324 VanDerWaalsContact NE1-OE1 3.12Å; W310-I328 HydrophobicContact CB-CD1 4.22Å; W310-I328 HydrophobicContact CD2-CD1 4.23Å; W310-I328 HydrophobicContact CG-CD1 3.83Å; W310-F343 HydrophobicContact CB-CZ 4.4Å; W310-F343 HydrophobicContact CD2-CE1 4.31Å; W310-F343 HydrophobicContact CD2-CZ 4.2Å; W310-F343 HydrophobicContact CE3-CD1 4.28Å; W310-F343 AromaticContact CE3-CE1 3.4Å; W310-F343 HydrophobicContact CE3-CE1 3.4Å; W310-F343 VanDerWaalsContact CE3-CE1 3.4Å; W310-F343 AromaticContact CE3-CZ 3.73Å; W310-F343 HydrophobicContact CE3-CZ 3.73Å; W310-F343 HydrophobicContact CG-CZ 4.5Å; W310-F343 HydrophobicContact CZ3-CD1 4.4Å; W310-F343 AromaticContact CZ3-CE1 3.94Å; W310-F343 HydrophobicContact CZ3-CE1 3.94Å; W310-F343 HydrophobicContact CZ3-CZ 4.49Å
311L91.9Very high90.1Very high1 Ų173.3 Ų73.31%0.00535%0.35CS..Hα-helixtrans-59.6-42.1179-178.165.1000112.4M307 R308 Q313 H314 L315 P318 W342 F343 A346 R347 I350M307-L311 WeakPolarHBondContact O-CB 3.43Å; M307-L311 PolarHBondContact O-N 3.29Å; R308-L311 PolarHBondContact O-N 3.47Å; L311-Q313 VanDerWaalsContact C-N 3.33Å; L311-H314 CarbonylContact O-C 3.2Å; L311-H314 PolarHBondContact O-N 2.68Å; L311-L315 WeakPolarHBondContact O-CD2 3.44Å; L311-L315 PolarHBondContact O-N 2.7Å; L311-P318 HydrophobicContact CD1-CB 3.72Å; L311-W342 HydrophobicContact CD2-CH2 4.47Å; L311-F343 HydrophobicContact CB-CE1 4.23Å; L311-A346 HydrophobicContact CD2-CB 3.84Å; L311-R347 HydrophobicContact CD1-CG 4.21Å; L311-I350 HydrophobicContact CD2-CB 4.44Å; L311-I350 HydrophobicContact CD2-CD1 4.37Å
312F88.1Confident90.4Very high103 Ų10368.6 Ų68.645%0.45233%0.33SS..Hα-helixtrans-73.1-23.9179-69.6-57.9000113.5R308 S309 W310 L315 I350R308-F312 HydrophobicContact CB-CD2 4.26Å; R308-F312 HydrophobicContact CB-CE2 4.03Å; R308-F312 HydrophobicContact CG-CE2 4.49Å; R308-F312 WeakPolarHBondContact O-CD2 3.38Å; R308-F312 PolarHBondContact O-N 3.42Å; S309-F312 PolarHBondContact O-N 3.22Å; W310-F312 VanDerWaalsContact C-N 3.34Å; W310-F312 PolarHBondContact O-N 3.08Å; F312-L315 HydrophobicContact CD1-CD2 4.06Å; F312-L315 WeakPolarHBondContact O-CG 3.28Å; F312-I350 HydrophobicContact CE1-CG2 4.12Å; F312-I350 HydrophobicContact CZ-CG2 4.14Å
313Q90Very high90.5Very high147 Ų14768.4 Ų68.469%0.68733%0.334SS*.Hα-helixtrans-74.9-31.6170.9-71.1168.28.700111.5S309 W310 L311S309-Q313 VanDerWaalsContact O-CG 3.28Å; S309-Q313 WeakPolarHBondContact O-CG 3.43Å; S309-Q313 PolarHBondContact O-N 3.42Å; S309-Q313 VanDerWaalsContact O-N 3.1Å; W310-Q313 PolarHBondContact O-N 3.45Å; L311-Q313 VanDerWaalsContact C-N 3.33Å
314H88.1Confident90.6Very high62 Ų6270.5 Ų70.529%0.28734%0.343SS..  trans-111.845.4-174.9-59.884000112.4W310 L311 M316 H317 P318W310-H314 AromaticContact CD1-CE1 3.87Å; W310-H314 AromaticContact CD1-ND1 3.92Å; W310-H314 AromaticContact CD2-ND1 3.58Å; W310-H314 AromaticContact CE2-CE1 3.62Å; W310-H314 AromaticContact CE2-CG 3.82Å; W310-H314 AromaticContact CE2-ND1 3.36Å; W310-H314 HydrophobicContact CE3-CB 4.23Å; W310-H314 AromaticContact CG-ND1 3.92Å; W310-H314 HydrophobicContact CH2-CB 3.67Å; W310-H314 AromaticContact CH2-CG 3.74Å; W310-H314 HydrophobicContact CZ2-CB 4.07Å; W310-H314 AromaticContact CZ2-CD2 3.89Å; W310-H314 AromaticContact CZ2-CE1 3.96Å; W310-H314 AromaticContact CZ2-CG 3.59Å; W310-H314 AromaticContact CZ2-ND1 3.64Å; W310-H314 HydrophobicContact CZ3-CB 3.78Å; W310-H314 AromaticContact NE1-CE1 3.44Å; W310-H314 PolarHBondContact NE1-CE1 3.14Å; W310-H314 AromaticContact NE1-ND1 3.61Å; W310-H314 PolarHBondContact O-N 2.91Å; W310-H314 PolarHBondContact O-ND1 2.92Å; L311-H314 CarbonylContact O-C 3.2Å; L311-H314 PolarHBondContact O-N 2.68Å; H314-M316 VanDerWaalsContact C-N 3.29Å; H314-M316 PolarHBondContact O-N 3.36Å; H314-H317 CarbonylContact O-C 3.35Å; H314-H317 PolarHBondContact O-N 3.02Å; H314-P318 WeakPolarHBondContact O-CA 3.25Å; H314-P318 VanDerWaalsContact O-N 3.07Å
315L85.7Confident90.8Very high47 Ų4771.2 Ų71.225%0.24635%0.345CS..SBendtrans-65-32.6-178.3-68.3173.9000113.3L311 F312 L351 M354L311-L315 WeakPolarHBondContact O-CD2 3.44Å; L311-L315 PolarHBondContact O-N 2.7Å; F312-L315 HydrophobicContact CD1-CD2 4.06Å; F312-L315 WeakPolarHBondContact O-CG 3.28Å; L315-L351 HydrophobicContact CB-CD1 4.24Å; L315-L351 HydrophobicContact CD2-CD1 3.49Å; L315-L351 VanDerWaalsContact CD2-CD1 3.49Å; L315-L351 HydrophobicContact CG-CD1 4.47Å; L315-M354 HydrophobicContact CD1-CE 3.75Å; L315-M354 HydrophobicContact CD2-CE 3.46Å; L315-M354 VanDerWaalsContact CD2-CE 3.46Å; L315-M354 HydrophobicContact CG-CE 4.19Å
316M80.3Confident90.8Very high168 Ų16873.7 Ų73.783%0.82835%0.347SS*.SBendtrans-73.8-36.7179.2-61-64.889.600112.2H314H314-M316 VanDerWaalsContact C-N 3.29Å; H314-M316 PolarHBondContact O-N 3.36Å
317H83.8Confident91Very high123 Ų12377.7 Ų77.757%0.56937%0.365SS*.SBendtrans-135.177.8178.3-167.1-93.2000110.7H314 Y319H314-H317 CarbonylContact O-C 3.35Å; H314-H317 PolarHBondContact O-N 3.02Å; H317-Y319 PolarHBondContact O-N 3.29Å
318P87.9Confident91Very high10 Ų1078 Ų787%0.06537%0.367CS..  trans-78.230.5-171.538.7-46.2000112.9L311 H314 P320 R347 L351L311-P318 HydrophobicContact CD1-CB 3.72Å; H314-P318 WeakPolarHBondContact O-CA 3.25Å; H314-P318 VanDerWaalsContact O-N 3.07Å; P318-P320 WeakPolarHBondContact O-CD 3.34Å; P318-R347 HydrophobicContact CB-CG 3.81Å; P318-R347 HydrophobicContact CG-CG 3.98Å; P318-R347 VanDerWaalsContact O-CD 3.32Å; P318-R347 WeakPolarHBondContact O-CD 3.34Å; P318-R347 PolarHBondContact O-NH1 2.95Å; P318-L351 HydrophobicContact CB-CD2 3.71Å; P318-L351 HydrophobicContact CG-CD2 3.39Å
319Y92.1Very high91.2Very high132 Ų13273 Ų7352%0.51835%0.351SS..  trans-109.994.5-179.6-65-103.8000107.9H317 T321 R347H317-Y319 PolarHBondContact O-N 3.29Å; Y319-T321 PolarHBondContact O-N 3.44Å; Y319-R347 VanDerWaalsContact CE1-CZ 3.42Å; Y319-R347 VanDerWaalsContact CE1-NH1 3.26Å; Y319-R347 VanDerWaalsContact CE1-NH2 3.32Å
320P91.5Very high91.3Very high10 Ų1073.9 Ų73.97%0.06536%0.362CS..  trans-63.2138.6176.624.7-31000109W310 P318 E324 K325 F343W310-P320 HydrophobicContact CD2-CB 4.47Å; W310-P320 HydrophobicContact CE3-CB 4.4Å; W310-P320 HydrophobicContact CH2-CB 3.49Å; W310-P320 VanDerWaalsContact CH2-CB 3.49Å; W310-P320 HydrophobicContact CH2-CG 4.05Å; W310-P320 VanDerWaalsContact CZ2-CA 3.44Å; W310-P320 HydrophobicContact CZ2-CB 3.51Å; W310-P320 HydrophobicContact CZ3-CB 3.94Å; W310-P320 HydrophobicContact CZ3-CG 4.08Å; P318-P320 WeakPolarHBondContact O-CD 3.34Å; P320-E324 WeakPolarHBondContact CA-OE2 3.25Å; P320-E324 HydrophobicContact CB-CB 4.08Å; P320-K325 HydrophobicContact CB-CG 3.91Å; P320-K325 HydrophobicContact CG-CD 4.47Å; P320-K325 HydrophobicContact CG-CG 3.77Å; P320-K325 WeakPolarHBondContact O-CE 3.35Å; P320-F343 HydrophobicContact CG-CD1 4.33Å; P320-F343 HydrophobicContact CG-CD2 3.92Å; P320-F343 HydrophobicContact CG-CE2 4.17Å; P320-F343 HydrophobicContact CG-CG 4.01Å; P320-F343 HydrophobicContact CG-CZ 4.5Å
321T93.8Very high91.2Very high77 Ų7777.3 Ų77.347%0.47238%0.379SS..  trans-63.3166.1169.660.50000110.5Y319 D323 E324 K325Y319-T321 PolarHBondContact O-N 3.44Å; T321-D323 VanDerWaalsContact C-N 3.28Å; T321-D323 PolarHBondContact O-N 3.46Å; T321-E324 WeakPolarHBondContact CB-OE2 3.47Å; T321-E324 WeakPolarHBondContact CG2-OE2 3.29Å; T321-E324 PolarHBondContact N-OE2 2.97Å; T321-E324 PolarHBondContact O-N 3.48Å; T321-E324 VanDerWaalsContact OG1-CD 3.29Å; T321-E324 WeakPolarHBondContact OG1-CG 3.39Å; T321-E324 PolarHBondContact OG1-N 3.11Å; T321-E324 PolarHBondContact OG1-OE2 2.75Å; T321-K325 WeakPolarHBondContact O-CG 3.39Å; T321-K325 PolarHBondContact O-N 2.76Å
322E92.8Very high91.2Very high82 Ų8277.3 Ų77.338%0.38338%0.379SS..Hα-helixtrans-64-36.1-177.8-162.761-166.300112.3K325 R326 L336E322-K325 PolarHBondContact O-N 3.46Å; E322-K325 IonicContact OE2-NZ 2.64Å; E322-K325 PolarHBondContact OE2-NZ 2.85Å; E322-R326 VanDerWaalsContact O-CG 3.31Å; E322-R326 WeakPolarHBondContact O-CG 3.48Å; E322-R326 PolarHBondContact O-N 3.02Å; E322-L336 WeakPolarHBondContact OE1-CD2 3.34Å
323D93.3Very high91.4Very high122 Ų12277.7 Ų77.765%0.65240%0.395SS*.Hα-helixtrans-69.4-40.5176.2-65.4-49.2000112.4T321 K325 R326 Q327T321-D323 VanDerWaalsContact C-N 3.28Å; T321-D323 PolarHBondContact O-N 3.46Å; D323-K325 VanDerWaalsContact C-N 3.34Å; D323-K325 PolarHBondContact O-N 3.25Å; D323-R326 WeakPolarHBondContact O-CB 3.03Å; D323-R326 PolarHBondContact O-N 3.28Å; D323-Q327 PolarHBondContact O-N 2.87Å
324E93.9Very high91.6Very high46 Ų4671.6 Ų71.622%0.21537%0.367CS..Hα-helixtrans-63.5-41.3174.5-71.7171.5119.400111.6W310 P320 T321 R326 Q327 I328W310-E324 WeakPolarHBondContact CZ2-OE1 3.21Å; W310-E324 PolarHBondContact NE1-OE1 3.03Å; W310-E324 VanDerWaalsContact NE1-OE1 3.12Å; P320-E324 WeakPolarHBondContact CA-OE2 3.25Å; P320-E324 HydrophobicContact CB-CB 4.08Å; T321-E324 WeakPolarHBondContact CB-OE2 3.47Å; T321-E324 WeakPolarHBondContact CG2-OE2 3.29Å; T321-E324 PolarHBondContact N-OE2 2.97Å; T321-E324 PolarHBondContact O-N 3.48Å; T321-E324 VanDerWaalsContact OG1-CD 3.29Å; T321-E324 WeakPolarHBondContact OG1-CG 3.39Å; T321-E324 PolarHBondContact OG1-N 3.11Å; T321-E324 PolarHBondContact OG1-OE2 2.75Å; E324-R326 VanDerWaalsContact C-N 3.3Å; E324-R326 PolarHBondContact O-N 2.82Å; E324-Q327 PolarHBondContact O-N 3.25Å; E324-I328 WeakPolarHBondContact O-CB 3.42Å; E324-I328 WeakPolarHBondContact O-CD1 2.74Å; E324-I328 WeakPolarHBondContact O-CG1 3.38Å; E324-I328 PolarHBondContact O-N 3.17Å
325K94.9Very high91.9Very high34 Ų3472.3 Ų72.315%0.14838%0.376CS..Hα-helixtrans-61.7-39.6174.3-67.6176.3-143.2153.20111.4P320 T321 E322 D323 I328 A329 L336 V339P320-K325 HydrophobicContact CB-CG 3.91Å; P320-K325 HydrophobicContact CG-CD 4.47Å; P320-K325 HydrophobicContact CG-CG 3.77Å; P320-K325 WeakPolarHBondContact O-CE 3.35Å; T321-K325 WeakPolarHBondContact O-CG 3.39Å; T321-K325 PolarHBondContact O-N 2.76Å; E322-K325 PolarHBondContact O-N 3.46Å; E322-K325 IonicContact OE2-NZ 2.64Å; E322-K325 PolarHBondContact OE2-NZ 2.85Å; D323-K325 VanDerWaalsContact C-N 3.34Å; D323-K325 PolarHBondContact O-N 3.25Å; K325-I328 PolarHBondContact O-N 3.47Å; K325-A329 VanDerWaalsContact O-CB 3.25Å; K325-A329 WeakPolarHBondContact O-CB 3.3Å; K325-A329 PolarHBondContact O-N 3Å; K325-L336 HydrophobicContact CB-CD1 3.48Å; K325-L336 VanDerWaalsContact CB-CD1 3.48Å; K325-V339 HydrophobicContact CB-CG1 4.48Å
326R95Very high92.2Very high141 Ų14172.6 Ų72.653%0.53238%0.377SS..Hα-helixtrans-64.2-42.8175.2-72.7172-171.1-75-5111.5E322 D323 E324 A329 A330 L336E322-R326 VanDerWaalsContact O-CG 3.31Å; E322-R326 WeakPolarHBondContact O-CG 3.48Å; E322-R326 PolarHBondContact O-N 3.02Å; D323-R326 WeakPolarHBondContact O-CB 3.03Å; D323-R326 PolarHBondContact O-N 3.28Å; E324-R326 VanDerWaalsContact C-N 3.3Å; E324-R326 PolarHBondContact O-N 2.82Å; R326-A329 PolarHBondContact O-N 3.45Å; R326-A330 WeakPolarHBondContact O-CB 3.49Å; R326-A330 PolarHBondContact O-N 3.39Å; R326-L336 HydrophobicContact CG-CD1 4.31Å
327Q94.9Very high92.8Very high119 Ų11969.9 Ų69.956%0.55637%0.365SS*.Hα-helixtrans-63.4-44.5177.1-167.8-177.12600111.4D323 E324 A330 Q331D323-Q327 PolarHBondContact O-N 2.87Å; E324-Q327 PolarHBondContact O-N 3.25Å; Q327-A330 PolarHBondContact O-N 2.98Å; Q327-Q331 WeakPolarHBondContact O-CG 3.49Å; Q327-Q331 PolarHBondContact O-N 3.32Å
328I94.8Very high93.2Very high5 Ų567.8 Ų67.83%0.02636%0.356CS..Hα-helixtrans-64.8-42.8176.3-67.4165.4000110.4M307 W310 E324 K325 A330 Q331 T332 V339 F343M307-I328 HydrophobicContact CG-CG2 3.65Å; M307-I328 HydrophobicContact SD-CG2 4.49Å; W310-I328 HydrophobicContact CB-CD1 4.22Å; W310-I328 HydrophobicContact CD2-CD1 4.23Å; W310-I328 HydrophobicContact CG-CD1 3.83Å; E324-I328 WeakPolarHBondContact O-CB 3.42Å; E324-I328 WeakPolarHBondContact O-CD1 2.74Å; E324-I328 WeakPolarHBondContact O-CG1 3.38Å; E324-I328 PolarHBondContact O-N 3.17Å; K325-I328 PolarHBondContact O-N 3.47Å; I328-A330 VanDerWaalsContact C-N 3.32Å; I328-A330 PolarHBondContact O-N 3.49Å; I328-Q331 PolarHBondContact O-N 2.93Å; I328-T332 HydrophobicContact CG2-CG2 3.99Å; I328-T332 VanDerWaalsContact O-CB 3.26Å; I328-T332 WeakPolarHBondContact O-CB 3.18Å; I328-T332 WeakPolarHBondContact O-CG2 3.43Å; I328-T332 PolarHBondContact O-N 3.17Å; I328-T332 PolarHBondContact O-OG1 2.88Å; I328-V339 HydrophobicContact CB-CG1 4.25Å; I328-V339 HydrophobicContact CG2-CG1 3.8Å; I328-V339 HydrophobicContact CG2-CG2 4.2Å; I328-F343 HydrophobicContact CD1-CE2 3.79Å; I328-F343 HydrophobicContact CD1-CZ 3.79Å; I328-F343 HydrophobicContact CG2-CE2 4.4Å
329A95.4Very high93.5Very high12 Ų1267.3 Ų67.310%0.09935%0.353CS..Hα-helixtrans-58.4-44.3175.100000111.6K325 R326 S333 L334 V339K325-A329 VanDerWaalsContact O-CB 3.25Å; K325-A329 WeakPolarHBondContact O-CB 3.3Å; K325-A329 PolarHBondContact O-N 3Å; R326-A329 PolarHBondContact O-N 3.45Å; A329-S333 WeakPolarHBondContact O-CA 3.42Å; A329-S333 PolarHBondContact O-N 3.41Å; A329-L334 WeakPolarHBondContact CB-O 3.42Å; A329-L334 PolarHBondContact O-N 3.33Å; A329-V339 HydrophobicContact CB-CG2 4.02Å
330A94.3Very high93.6Very high84 Ų8464 Ų6469%0.69434%0.344SS*.Hα-helixtrans-63.3-45.5176.800000112.4R326 Q327 I328R326-A330 WeakPolarHBondContact O-CB 3.49Å; R326-A330 PolarHBondContact O-N 3.39Å; Q327-A330 PolarHBondContact O-N 2.98Å; I328-A330 VanDerWaalsContact C-N 3.32Å; I328-A330 PolarHBondContact O-N 3.49Å
331Q92.7Very high93.7Very high98 Ų9867.9 Ų67.946%0.45836%0.364SS..Hα-helixtrans-70.2-34.9179.6-69.7178.418.100113.1I306 Q327 I328I306-Q331 HydrophobicContact CD1-CB 4.18Å; Q327-Q331 WeakPolarHBondContact O-CG 3.49Å; Q327-Q331 PolarHBondContact O-N 3.32Å; I328-Q331 PolarHBondContact O-N 2.93Å
332T92.1Very high93.7Very high2 Ų265.9 Ų65.91%0.01235%0.348CS..Hα-helixtrans-92-6.1-175.362.10000113.5A303 I306 M307 I328 L334A303-T332 HydrophobicContact CB-CG2 4.01Å; I306-T332 HydrophobicContact CB-CG2 3.83Å; I306-T332 HydrophobicContact CD1-CG2 3.93Å; I306-T332 HydrophobicContact CG1-CG2 4.47Å; I306-T332 HydrophobicContact CG2-CG2 3.91Å; M307-T332 HydrophobicContact CG-CG2 4.37Å; I328-T332 HydrophobicContact CG2-CG2 3.99Å; I328-T332 VanDerWaalsContact O-CB 3.26Å; I328-T332 WeakPolarHBondContact O-CB 3.18Å; I328-T332 WeakPolarHBondContact O-CG2 3.43Å; I328-T332 PolarHBondContact O-N 3.17Å; I328-T332 PolarHBondContact O-OG1 2.88Å; T332-L334 PolarHBondContact O-N 3.41Å; T332-L334 WeakPolarHBondContact OG1-CB 3.34Å; T332-L334 WeakPolarHBondContact OG1-CG 2.97Å
333S92.9Very high93.8Very high111 Ų11162.1 Ų62.178%0.77633%0.33SS*.THydrogen-bonded Turntrans52.733.3-171.259.90000113.1A329A329-S333 WeakPolarHBondContact O-CA 3.42Å; A329-S333 PolarHBondContact O-N 3.41Å
334L92.6Very high93.7Very high19 Ų1958.6 Ų58.610%0.09931%0.311CS..  trans-104.7155.2176.2-64.1-176.9000110.2L299 A303 M307 A329 T332 Q338 V339L299-L334 HydrophobicContact CD1-CD1 4.08Å; L299-L334 HydrophobicContact CD2-CD1 4.05Å; L299-L334 HydrophobicContact CD2-CD2 3.84Å; A303-L334 HydrophobicContact CB-CD1 3.86Å; A303-L334 HydrophobicContact CB-CG 4.17Å; M307-L334 HydrophobicContact CE-CD1 3.81Å; M307-L334 HydrophobicContact SD-CD1 4.17Å; A329-L334 WeakPolarHBondContact CB-O 3.42Å; A329-L334 PolarHBondContact O-N 3.33Å; T332-L334 PolarHBondContact O-N 3.41Å; T332-L334 WeakPolarHBondContact OG1-CB 3.34Å; T332-L334 WeakPolarHBondContact OG1-CG 2.97Å; L334-Q338 HydrophobicContact CB-CB 4.2Å; L334-V339 HydrophobicContact CB-CG2 3.92Å; L334-V339 HydrophobicContact CD1-CG2 4.48Å
335T94.4Very high93.6Very high77 Ų7759.7 Ų59.747%0.47232%0.318SS..  trans-70.3150.817171.10000110.2L337 Q338 V339T335-L337 PolarHBondContact O-N 2.78Å; T335-L337 VanDerWaalsContact O-N 3.14Å; T335-Q338 WeakPolarHBondContact O-CA 3.39Å; T335-Q338 WeakPolarHBondContact O-CB 3.26Å; T335-Q338 PolarHBondContact O-N 3.25Å; T335-Q338 VanDerWaalsContact OG1-CG 3.29Å; T335-Q338 WeakPolarHBondContact OG1-CG 3.46Å; T335-Q338 PolarHBondContact OG1-N 3.39Å; T335-Q338 PolarHBondContact OG1-OE1 3.05Å; T335-V339 PolarHBondContact O-N 2.86Å
336L92.6Very high93.5Very high53 Ų5358.4 Ų58.428%0.27731%0.314SS..Hα-helixtrans-53.3-36.9176.6-173.261.9000112.3E322 K325 R326 V339 N340E322-L336 WeakPolarHBondContact OE1-CD2 3.34Å; K325-L336 HydrophobicContact CB-CD1 3.48Å; K325-L336 VanDerWaalsContact CB-CD1 3.48Å; R326-L336 HydrophobicContact CG-CD1 4.31Å; L336-V339 PolarHBondContact O-N 2.82Å; L336-N340 WeakPolarHBondContact O-CB 3.43Å; L336-N340 PolarHBondContact O-N 2.84Å
337L93.1Very high93.4Very high111 Ų11153.9 Ų53.958%0.58130%0.297SS*.Hα-helixtrans-65.8-40.3175.1-178.661.7000112.7T335 V339 N340 N341T335-L337 PolarHBondContact O-N 2.78Å; T335-L337 VanDerWaalsContact O-N 3.14Å; L337-V339 VanDerWaalsContact C-N 3.34Å; L337-N340 PolarHBondContact O-N 3.4Å; L337-N341 WeakPolarHBondContact O-CB 3.41Å; L337-N341 VanDerWaalsContact O-CG 3.3Å; L337-N341 PolarHBondContact O-N 3.3Å; L337-N341 PolarHBondContact O-ND2 3.28Å; L337-N341 VanDerWaalsContact O-ND2 3.16Å
338Q92.5Very high93.1Very high79 Ų7955.6 Ų55.637%0.36930%0.298SS..Hα-helixtrans-64.2-41.5175.7-74.2169.1-32.700111.2L334 T335 W342L334-Q338 HydrophobicContact CB-CB 4.2Å; T335-Q338 WeakPolarHBondContact O-CA 3.39Å; T335-Q338 WeakPolarHBondContact O-CB 3.26Å; T335-Q338 PolarHBondContact O-N 3.25Å; T335-Q338 VanDerWaalsContact OG1-CG 3.29Å; T335-Q338 WeakPolarHBondContact OG1-CG 3.46Å; T335-Q338 PolarHBondContact OG1-N 3.39Å; T335-Q338 PolarHBondContact OG1-OE1 3.05Å; Q338-W342 VanDerWaalsContact O-CB 3.29Å; Q338-W342 WeakPolarHBondContact O-CB 3.39Å; Q338-W342 PolarHBondContact O-N 3.4Å
339V94.4Very high92.8Very high0 Ų064.1 Ų64.10%033%0.33CS..Hα-helixtrans-62.9-47.4175.2176.60000110.7M307 K325 I328 A329 L334 T335 L336 L337 W342 F343M307-V339 HydrophobicContact SD-CG2 4.44Å; K325-V339 HydrophobicContact CB-CG1 4.48Å; I328-V339 HydrophobicContact CB-CG1 4.25Å; I328-V339 HydrophobicContact CG2-CG1 3.8Å; I328-V339 HydrophobicContact CG2-CG2 4.2Å; A329-V339 HydrophobicContact CB-CG2 4.02Å; L334-V339 HydrophobicContact CB-CG2 3.92Å; L334-V339 HydrophobicContact CD1-CG2 4.48Å; T335-V339 PolarHBondContact O-N 2.86Å; L336-V339 PolarHBondContact O-N 2.82Å; L337-V339 VanDerWaalsContact C-N 3.34Å; V339-W342 WeakPolarHBondContact O-CB 3.31Å; V339-W342 PolarHBondContact O-N 3.49Å; V339-F343 HydrophobicContact CG1-CD2 3.74Å; V339-F343 HydrophobicContact CG1-CE2 3.66Å; V339-F343 VanDerWaalsContact O-CD2 3.28Å; V339-F343 WeakPolarHBondContact O-CD2 3.32Å; V339-F343 PolarHBondContact O-N 3.28Å
340N92.9Very high92.2Very high62 Ų6266.1 Ų66.133%0.33234%0.338SS..Hα-helixtrans-59.7-50.7178.1-170.9-6.3000111.8L336 L337 W342 F343 I344L336-N340 WeakPolarHBondContact O-CB 3.43Å; L336-N340 PolarHBondContact O-N 2.84Å; L337-N340 PolarHBondContact O-N 3.4Å; N340-W342 PolarHBondContact O-N 3.46Å; N340-F343 PolarHBondContact O-N 3.45Å; N340-I344 WeakPolarHBondContact O-CG1 3.44Å; N340-I344 PolarHBondContact O-N 2.96Å; N340-I344 VanDerWaalsContact OD1-CD1 3.26Å; N340-I344 WeakPolarHBondContact OD1-CD1 3.44Å
341N93.4Very high91.4Very high91 Ų9162.8 Ų62.849%0.48731%0.309SS..Hα-helixtrans-60-36.7177.5-76.1-33.1000112.4L337 N345L337-N341 WeakPolarHBondContact O-CB 3.41Å; L337-N341 VanDerWaalsContact O-CG 3.3Å; L337-N341 PolarHBondContact O-N 3.3Å; L337-N341 PolarHBondContact O-ND2 3.28Å; L337-N341 VanDerWaalsContact O-ND2 3.16Å; N341-N345 WeakPolarHBondContact O-CB 3.26Å; N341-N345 PolarHBondContact O-N 2.88Å; N341-N345 VanDerWaalsContact O-N 3.12Å
342W94.8Very high90.5Very high35 Ų3563.6 Ų63.613%0.13331%0.313CS..Hα-helixtrans-64.9-47.9176.5-171.190.7000111.6L299 T304 M307 R308 L311 Q338 V339 N340 I344 N345 A346L299-W342 HydrophobicContact CD1-CB 4.34Å; L299-W342 VanDerWaalsContact CD1-CD1 3.42Å; L299-W342 HydrophobicContact CD1-CG 4.12Å; T304-W342 HydrophobicContact CG2-CZ2 4.04Å; M307-W342 VanDerWaalsContact C-CH2 3.45Å; M307-W342 HydrophobicContact CB-CD2 3.87Å; M307-W342 HydrophobicContact CB-CE3 3.45Å; M307-W342 VanDerWaalsContact CB-CE3 3.45Å; M307-W342 HydrophobicContact CB-CH2 3.56Å; M307-W342 HydrophobicContact CB-CZ2 3.94Å; M307-W342 HydrophobicContact CB-CZ3 3.31Å; M307-W342 HydrophobicContact CE-CB 4.19Å; M307-W342 HydrophobicContact CE-CD2 3.63Å; M307-W342 HydrophobicContact CE-CE3 4.34Å; M307-W342 HydrophobicContact CE-CG 3.53Å; M307-W342 HydrophobicContact CG-CD2 4.37Å; M307-W342 HydrophobicContact CG-CE3 4.15Å; M307-W342 HydrophobicContact CG-CZ3 4.45Å; M307-W342 WeakPolarHBondContact O-CZ3 3.43Å; M307-W342 HydrophobicContact SD-CB 3.85Å; M307-W342 HydrophobicContact SD-CD2 3.6Å; M307-W342 HydrophobicContact SD-CE3 3.8Å; M307-W342 HydrophobicContact SD-CG 3.64Å; R308-W342 HydrophobicContact CB-CH2 4.41Å; R308-W342 HydrophobicContact CG-CH2 3.73Å; R308-W342 HydrophobicContact CG-CZ2 3.76Å; L311-W342 HydrophobicContact CD2-CH2 4.47Å; Q338-W342 VanDerWaalsContact O-CB 3.29Å; Q338-W342 WeakPolarHBondContact O-CB 3.39Å; Q338-W342 PolarHBondContact O-N 3.4Å; V339-W342 WeakPolarHBondContact O-CB 3.31Å; V339-W342 PolarHBondContact O-N 3.49Å; N340-W342 PolarHBondContact O-N 3.46Å; W342-I344 PolarHBondContact O-N 3.47Å; W342-N345 PolarHBondContact O-N 2.88Å; W342-A346 HydrophobicContact CD2-CB 4.21Å; W342-A346 HydrophobicContact CE3-CB 3.82Å; W342-A346 HydrophobicContact CH2-CB 3.77Å; W342-A346 HydrophobicContact CZ2-CB 4.17Å; W342-A346 HydrophobicContact CZ3-CB 3.57Å; W342-A346 WeakPolarHBondContact O-CB 3.38Å; W342-A346 PolarHBondContact O-N 3.47Å
343F94.9Very high89.6Confident3 Ų367.1 Ų67.11%0.01334%0.336CS..Hα-helixtrans-64.3-39.2179.2-84-69.9000112.9M307 W310 L311 P320 I328 V339 N340 N345 A346 R347M307-F343 HydrophobicContact CB-CE2 4.37Å; M307-F343 HydrophobicContact CB-CZ 4.05Å; M307-F343 HydrophobicContact CG-CE2 4.29Å; M307-F343 HydrophobicContact CG-CZ 4.4Å; W310-F343 HydrophobicContact CB-CZ 4.4Å; W310-F343 HydrophobicContact CD2-CE1 4.31Å; W310-F343 HydrophobicContact CD2-CZ 4.2Å; W310-F343 HydrophobicContact CE3-CD1 4.28Å; W310-F343 AromaticContact CE3-CE1 3.4Å; W310-F343 HydrophobicContact CE3-CE1 3.4Å; W310-F343 VanDerWaalsContact CE3-CE1 3.4Å; W310-F343 AromaticContact CE3-CZ 3.73Å; W310-F343 HydrophobicContact CE3-CZ 3.73Å; W310-F343 HydrophobicContact CG-CZ 4.5Å; W310-F343 HydrophobicContact CZ3-CD1 4.4Å; W310-F343 AromaticContact CZ3-CE1 3.94Å; W310-F343 HydrophobicContact CZ3-CE1 3.94Å; W310-F343 HydrophobicContact CZ3-CZ 4.49Å; L311-F343 HydrophobicContact CB-CE1 4.23Å; P320-F343 HydrophobicContact CG-CD1 4.33Å; P320-F343 HydrophobicContact CG-CD2 3.92Å; P320-F343 HydrophobicContact CG-CE2 4.17Å; P320-F343 HydrophobicContact CG-CG 4.01Å; P320-F343 HydrophobicContact CG-CZ 4.5Å; I328-F343 HydrophobicContact CD1-CE2 3.79Å; I328-F343 HydrophobicContact CD1-CZ 3.79Å; I328-F343 HydrophobicContact CG2-CE2 4.4Å; V339-F343 HydrophobicContact CG1-CD2 3.74Å; V339-F343 HydrophobicContact CG1-CE2 3.66Å; V339-F343 VanDerWaalsContact O-CD2 3.28Å; V339-F343 WeakPolarHBondContact O-CD2 3.32Å; V339-F343 PolarHBondContact O-N 3.28Å; N340-F343 PolarHBondContact O-N 3.45Å; F343-N345 VanDerWaalsContact C-N 3.31Å; F343-N345 PolarHBondContact O-N 3.27Å; F343-A346 PolarHBondContact O-N 3.28Å; F343-R347 WeakPolarHBondContact O-CG 3.38Å; F343-R347 PolarHBondContact O-N 3.31Å
344I90.9Very high88.6Confident48 Ų4865.5 Ų65.525%0.24632%0.317CS..Hα-helixtrans-58.3-45.4173.5-68.9168.9000110.8N340 W342N340-I344 WeakPolarHBondContact O-CG1 3.44Å; N340-I344 PolarHBondContact O-N 2.96Å; N340-I344 VanDerWaalsContact OD1-CD1 3.26Å; N340-I344 WeakPolarHBondContact OD1-CD1 3.44Å; W342-I344 PolarHBondContact O-N 3.47Å
345N92.6Very high87.5Confident70 Ų7068.7 Ų68.737%0.37433%0.333SS..Hα-helixtrans-72.2-42.5-179-165.9-77.3000112.1N341 W342 F343 R348 R349N341-N345 WeakPolarHBondContact O-CB 3.26Å; N341-N345 PolarHBondContact O-N 2.88Å; N341-N345 VanDerWaalsContact O-N 3.12Å; W342-N345 PolarHBondContact O-N 2.88Å; F343-N345 VanDerWaalsContact C-N 3.31Å; F343-N345 PolarHBondContact O-N 3.27Å; N345-R348 PolarHBondContact O-N 2.93Å; N345-R349 PolarHBondContact O-N 3.5Å; N345-R349 VanDerWaalsContact O-N 3.08Å; N345-R349 WeakPolarHBondContact OD1-CD 3.47Å; N345-R349 PolarHBondContact OD1-NE 3.43Å
346A91.6Very high86.2Confident6 Ų671.4 Ų71.45%0.0535%0.345CS..Hα-helixtrans-64.6-41.8-177.100000112L311 W342 F343 R348 R349 I350L311-A346 HydrophobicContact CD2-CB 3.84Å; W342-A346 HydrophobicContact CD2-CB 4.21Å; W342-A346 HydrophobicContact CE3-CB 3.82Å; W342-A346 HydrophobicContact CH2-CB 3.77Å; W342-A346 HydrophobicContact CZ2-CB 4.17Å; W342-A346 HydrophobicContact CZ3-CB 3.57Å; W342-A346 WeakPolarHBondContact O-CB 3.38Å; W342-A346 PolarHBondContact O-N 3.47Å; F343-A346 PolarHBondContact O-N 3.28Å; A346-R348 PolarHBondContact O-N 3.48Å; A346-R349 PolarHBondContact O-N 3.36Å; A346-I350 HydrophobicContact CB-CD1 4.2Å; A346-I350 WeakPolarHBondContact O-CA 3.35Å; A346-I350 VanDerWaalsContact O-CB 3.23Å; A346-I350 WeakPolarHBondContact O-CB 3.45Å; A346-I350 WeakPolarHBondContact O-CG1 3.39Å; A346-I350 PolarHBondContact O-N 3.47Å
347R92.6Very high85Confident46 Ų4672.6 Ų72.617%0.17436%0.363CS..Iπ-helixtrans-57.4-46.4174.4-74.7-169.7-65-140.316.6112.9L311 P318 Y319 F343 R349 L351 Q352L311-R347 HydrophobicContact CD1-CG 4.21Å; P318-R347 HydrophobicContact CB-CG 3.81Å; P318-R347 HydrophobicContact CG-CG 3.98Å; P318-R347 VanDerWaalsContact O-CD 3.32Å; P318-R347 WeakPolarHBondContact O-CD 3.34Å; P318-R347 PolarHBondContact O-NH1 2.95Å; Y319-R347 VanDerWaalsContact CE1-CZ 3.42Å; Y319-R347 VanDerWaalsContact CE1-NH1 3.26Å; Y319-R347 VanDerWaalsContact CE1-NH2 3.32Å; F343-R347 WeakPolarHBondContact O-CG 3.38Å; F343-R347 PolarHBondContact O-N 3.31Å; R347-R349 PolarHBondContact O-N 3.3Å; R347-L351 WeakPolarHBondContact O-CA 3.49Å; R347-L351 VanDerWaalsContact O-CB 3.29Å; R347-L351 WeakPolarHBondContact O-CB 3.2Å; R347-L351 PolarHBondContact O-N 3.02Å; R347-L351 VanDerWaalsContact O-N 3.09Å; R347-Q352 PolarHBondContact O-N 3.34Å
348R88.6Confident83.4Confident156 Ų15671.2 Ų71.259%0.58936%0.362SS*.Iπ-helixtrans-68.1-34.5-179.4-65-176.3-168.5127.11.4113N345 A346N345-R348 PolarHBondContact O-N 2.93Å; A346-R348 PolarHBondContact O-N 3.48Å
349R88.8Confident81.4Confident183 Ų18373.5 Ų73.569%0.69138%0.377SS*.Iπ-helixtrans-94.2-26.5-174-67.8-169.1177.3179.9-6.7114.8N345 A346 R347N345-R349 PolarHBondContact O-N 3.5Å; N345-R349 VanDerWaalsContact O-N 3.08Å; N345-R349 WeakPolarHBondContact OD1-CD 3.47Å; N345-R349 PolarHBondContact OD1-NE 3.43Å; A346-R349 PolarHBondContact O-N 3.36Å; R347-R349 PolarHBondContact O-N 3.3Å
350I83.6Confident79.2Confident54 Ų5478.7 Ų78.728%0.27741%0.41SS..Iπ-helixtrans-111.4-47.2-173.1-53.9177.6000110.1L311 F312 A346L311-I350 HydrophobicContact CD2-CB 4.44Å; L311-I350 HydrophobicContact CD2-CD1 4.37Å; F312-I350 HydrophobicContact CE1-CG2 4.12Å; F312-I350 HydrophobicContact CZ-CG2 4.14Å; A346-I350 HydrophobicContact CB-CD1 4.2Å; A346-I350 WeakPolarHBondContact O-CA 3.35Å; A346-I350 VanDerWaalsContact O-CB 3.23Å; A346-I350 WeakPolarHBondContact O-CB 3.45Å; A346-I350 WeakPolarHBondContact O-CG1 3.39Å; A346-I350 PolarHBondContact O-N 3.47Å
351L77.8Confident77Confident14 Ų1482.2 Ų82.27%0.07343%0.429CS..Iπ-helixtrans-82-47.3-172.7-172.968.6000113L315 P318 R347 M354 L355L315-L351 HydrophobicContact CB-CD1 4.24Å; L315-L351 HydrophobicContact CD2-CD1 3.49Å; L315-L351 VanDerWaalsContact CD2-CD1 3.49Å; L315-L351 HydrophobicContact CG-CD1 4.47Å; P318-L351 HydrophobicContact CB-CD2 3.71Å; P318-L351 HydrophobicContact CG-CD2 3.39Å; R347-L351 WeakPolarHBondContact O-CA 3.49Å; R347-L351 VanDerWaalsContact O-CB 3.29Å; R347-L351 WeakPolarHBondContact O-CB 3.2Å; R347-L351 PolarHBondContact O-N 3.02Å; R347-L351 VanDerWaalsContact O-N 3.09Å; L351-M354 HydrophobicContact CD1-CE 3.9Å; L351-M354 WeakPolarHBondContact O-CB 3.42Å; L351-M354 PolarHBondContact O-N 2.86Å; L351-L355 HydrophobicContact CD1-CD1 4.17Å; L351-L355 HydrophobicContact CG-CD1 4.47Å; L351-L355 PolarHBondContact O-N 2.85Å
352Q73.7Confident74.7Confident116 Ų11683.1 Ų83.154%0.54244%0.44SS..Hα-helixtrans-53.4-50.4-179.8-89.7-176.4-23.600113R347 M354 L355 D356R347-Q352 PolarHBondContact O-N 3.34Å; Q352-M354 PolarHBondContact O-N 2.89Å; Q352-L355 PolarHBondContact O-N 3.03Å; Q352-D356 PolarHBondContact O-N 2.91Å; Q352-D356 VanDerWaalsContact O-N 3.09Å
353P73.8Confident72.1Confident76 Ų7685.8 Ų85.849%0.49447%0.47SS..Hα-helixtrans-63.3-26177.9-23.334.7000114.2A357P353-A357 WeakPolarHBondContact O-CB 3.39Å; P353-A357 PolarHBondContact O-N 3.48Å
354M71.3Confident69.9Low76 Ų7691.6 Ų91.637%0.37451%0.508SS..Hα-helixtrans-80.2-40.2179.7-169.5170.463.900111.5L315 L351 Q352 A357 S358L315-M354 HydrophobicContact CD1-CE 3.75Å; L315-M354 HydrophobicContact CD2-CE 3.46Å; L315-M354 VanDerWaalsContact CD2-CE 3.46Å; L315-M354 HydrophobicContact CG-CE 4.19Å; L351-M354 HydrophobicContact CD1-CE 3.9Å; L351-M354 WeakPolarHBondContact O-CB 3.42Å; L351-M354 PolarHBondContact O-N 2.86Å; Q352-M354 PolarHBondContact O-N 2.89Å; M354-A357 PolarHBondContact O-N 3.43Å; M354-S358 PolarHBondContact O-N 3.45Å; M354-S358 PolarHBondContact O-OG 3.47Å
355L69Low67.5Low86 Ų8699.1 Ų99.145%0.4554%0.538SS..Hα-helixtrans-63.9-43.1175.5-122.969.1000111.5L351 Q352 A357 S358L351-L355 HydrophobicContact CD1-CD1 4.17Å; L351-L355 HydrophobicContact CG-CD1 4.47Å; L351-L355 PolarHBondContact O-N 2.85Å; Q352-L355 PolarHBondContact O-N 3.03Å; L355-A357 VanDerWaalsContact C-N 3.26Å; L355-A357 PolarHBondContact O-N 3.27Å; L355-S358 WeakPolarHBondContact CA-OG 3.41Å; L355-S358 PolarHBondContact O-N 2.97Å; L355-S358 PolarHBondContact O-OG 3.31Å; L355-S358 VanDerWaalsContact O-OG 3.04Å
356D68Low65.7Low135 Ų135100.5 Ų100.572%0.72256%0.56SS**Hα-helixtrans-64.5-28.8176.8-72.2-14000112.6Q352Q352-D356 PolarHBondContact O-N 2.91Å; Q352-D356 VanDerWaalsContact O-N 3.09Å
357A66.6Low63.4Low78 Ų78110 Ų11065%0.64560%0.6SS**Hα-helixtrans-84.9-26.5178.100000113.6P353 M354 L355P353-A357 WeakPolarHBondContact O-CB 3.39Å; P353-A357 PolarHBondContact O-N 3.48Å; M354-A357 PolarHBondContact O-N 3.43Å; L355-A357 VanDerWaalsContact C-N 3.26Å; L355-A357 PolarHBondContact O-N 3.27Å
358S60.7Low61.3Low82 Ų82117.9 Ų117.957%0.57364%0.636SS**Hα-helixtrans-84.9-4.1-177.850.90000115M354 L355 P360M354-S358 PolarHBondContact O-N 3.45Å; M354-S358 PolarHBondContact O-OG 3.47Å; L355-S358 WeakPolarHBondContact CA-OG 3.41Å; L355-S358 PolarHBondContact O-N 2.97Å; L355-S358 PolarHBondContact O-OG 3.31Å; L355-S358 VanDerWaalsContact O-OG 3.04Å; S358-P360 WeakPolarHBondContact O-CD 3.36Å
359N49.9Very low58.7Low126 Ų126118.5 Ų118.567%0.67465%0.647SS**  trans-111.475.7173.4-167.447.4000111.7D361N359-D361 PolarHBondContact O-N 2.82Å
360P47.8Very low56.5Low109 Ų109120 Ų12071%0.70866%0.659SS**  trans-80.594.9168.332.4-31000109.3S358S358-P360 WeakPolarHBondContact O-CD 3.36Å
361D46.3Very low54Low136 Ų136121.6 Ų121.673%0.72768%0.675SS**  trans-63.8129.5173.6-166.613.5000110.9N359 A363N359-D361 PolarHBondContact O-N 2.82Å; D361-A363 PolarHBondContact O-N 2.85Å
362P44.4Very low52.6Low111 Ų111130 Ų13072%0.72171%0.714SS**  trans-82.1104.1177.831.5-33.7000112.8
363A40.4Very low50.9Low90 Ų90133 Ų13374%0.74473%0.727SS**SBendtrans66.5153.4151.900000119.4D361D361-A363 PolarHBondContact O-N 2.85Å
364P49.8Very low48.9Very low125 Ų125136.7 Ų136.781%0.81273%0.731SS**  trans-100.9129.8-140.836.1-30.7000113.9
365K41Very low47.1Very low206 Ų206137.9 Ų137.990%0.89675%0.745SS**  trans-128.8131.8146.6-72-170.8179.6-179.40108.7K367K365-K367 PolarHBondContact O-N 3.34Å
366A53.1Low45.5Very low100 Ų100140 Ų14083%0.82676%0.762SS**  trans-48.6117.7-168.400000113.4
367K44.6Very low44.1Very low205 Ų205138.4 Ų138.489%0.89175%0.75SS**  trans-164.9127.8147.3-100.2155.7-168.8-172.40109.8K365 M369K365-K367 PolarHBondContact O-N 3.34Å; K367-M369 PolarHBondContact O-N 3.19Å
368K49Very low43.3Very low212 Ų212143.7 Ų143.792%0.92275%0.753SS**  trans-12.2105.5179.1-82.3169.8168.2167.90117.7
369M33.8Very low42.7Very low168 Ų168143.9 Ų143.983%0.82874%0.743SS**  trans-76.7117.7153.5-80.1-113.3102.900109.9K367K367-M369 PolarHBondContact O-N 3.19Å
370K42.3Very low42.4Very low215 Ų215140.2 Ų140.294%0.93572%0.72SS**  trans-106.579.4160.6-163.7143.4-179.6172.70107.3
371S30.8Very low42.6Very low87 Ų87137.4 Ų137.461%0.60870%0.702SS**  trans-109.5127.3171.362.20000110.7H373S371-H373 PolarHBondContact O-N 2.91Å; S371-H373 VanDerWaalsContact O-N 3.13Å
372Q47.2Very low42.7Very low191 Ų191137.6 Ų137.689%0.89370%0.703SS**SBendtrans-77.880.3177.5179.9173.6-2700108.9
373H39.8Very low43Very low178 Ų178136.5 Ų136.582%0.82470%0.698SS**  trans-168.588.9146.3-111.8-77.8000106.3S371 P375S371-H373 PolarHBondContact O-N 2.91Å; S371-H373 VanDerWaalsContact O-N 3.13Å; H373-P375 WeakPolarHBondContact O-CD 3.34Å
374R31.1Very low43.8Very low154 Ų154132.5 Ų132.558%0.58166%0.664SS**  trans-72123178.7-152.4-176.3-158.1-1712.7107.9T376 Q377R374-T376 PolarHBondContact O-N 2.95Å; R374-Q377 HydrophobicContact CG-CG 3.98Å; R374-Q377 VanDerWaalsContact NE-CG 3.34Å
375P33.5Very low44.1Very low102 Ų102127.7 Ų127.766%0.66263%0.632SS**  trans-60.7132.9156.527.7-28.9000105.8H373 Q377H373-P375 WeakPolarHBondContact O-CD 3.34Å; P375-Q377 PolarHBondContact O-N 3.19Å
376T35.9Very low44.7Very low131 Ų131120.3 Ų120.380%0.80461%0.61SS**  trans-37.498.7176.9-430000109.3R374 R378R374-T376 PolarHBondContact O-N 2.95Å; T376-R378 PolarHBondContact O-N 3.44Å; T376-R378 VanDerWaalsContact O-N 3.11Å
377Q37.5Very low44.6Very low100 Ų100117 Ų11747%0.46759%0.586SS.*  trans-65.1126.9-176.6-84.4-142.6-25.800106.9R374 P375 F379R374-Q377 HydrophobicContact CG-CG 3.98Å; R374-Q377 VanDerWaalsContact NE-CG 3.34Å; P375-Q377 PolarHBondContact O-N 3.19Å; Q377-F379 HydrophobicContact CB-CD2 3.66Å; Q377-F379 HydrophobicContact CB-CE2 4.12Å; Q377-F379 PolarHBondContact O-N 2.82Å
378R50.6Low45Very low190 Ų190110.3 Ų110.372%0.71756%0.562SS**  trans-58.294.8162.5-93.1-179171.6-152.9-9105.8T376 W380T376-R378 PolarHBondContact O-N 3.44Å; T376-R378 VanDerWaalsContact O-N 3.11Å; R378-W380 VanDerWaalsContact C-N 3.32Å
379F46.9Very low45Very low85 Ų85106.4 Ų106.437%0.37355%0.55SS.*  trans-98.410.9-174.9-125-102.7000111.7Q377Q377-F379 HydrophobicContact CB-CD2 3.66Å; Q377-F379 HydrophobicContact CB-CE2 4.12Å; Q377-F379 PolarHBondContact O-N 2.82Å
380W45.3Very low45.6Very low50 Ų50105.4 Ų105.419%0.18954%0.544CS..SBendtrans-92.3134.4174.5-63.5104.6000107.6L82 V138 I141 R378 I384 V385L82-W380 HydrophobicContact CD1-CH2 4.19Å; L82-W380 HydrophobicContact CD2-CH2 4.33Å; L82-W380 HydrophobicContact CD2-CZ3 4.09Å; V138-W380 HydrophobicContact CB-CZ2 4.1Å; V138-W380 HydrophobicContact CG1-CZ2 3.73Å; V138-W380 HydrophobicContact CG2-CH2 4.07Å; V138-W380 HydrophobicContact CG2-CZ2 3.74Å; I141-W380 HydrophobicContact CD1-CH2 4.35Å; R378-W380 VanDerWaalsContact C-N 3.32Å; W380-I384 HydrophobicContact CB-CB 4.07Å; W380-I384 HydrophobicContact CB-CG2 3.9Å; W380-I384 HydrophobicContact CD2-CG2 3.83Å; W380-I384 HydrophobicContact CE3-CB 4.41Å; W380-I384 HydrophobicContact CE3-CD1 3.63Å; W380-I384 HydrophobicContact CE3-CG2 3.6Å; W380-I384 HydrophobicContact CG-CG2 3.99Å; W380-I384 HydrophobicContact CZ3-CD1 4.11Å; W380-I384 HydrophobicContact CZ3-CG2 4.31Å; W380-V385 HydrophobicContact CB-CG2 3.8Å
381P51.5Low45.6Very low50 Ų5099.9 Ų99.933%0.32553%0.528SS..  trans-52144.9168.719-30000110V116 S383 I384 V385V116-P381 HydrophobicContact CG1-CG 4.48Å; P381-S383 PolarHBondContact O-N 3.49Å; P381-I384 HydrophobicContact CG-CD1 3.81Å; P381-I384 HydrophobicContact CG-CG1 4.1Å; P381-I384 PolarHBondContact O-N 3.36Å; P381-V385 PolarHBondContact O-N 2.95Å
382D48.2Very low46.1Very low140 Ų140104 Ų10475%0.74954%0.537SS*.Hα-helixtrans-52.9-28.8-173.7-77.8-54.7000113I384 V385 A386D382-I384 VanDerWaalsContact C-N 3.29Å; D382-I384 PolarHBondContact O-N 2.75Å; D382-V385 PolarHBondContact O-N 3.33Å; D382-A386 WeakPolarHBondContact O-CB 3.46Å; D382-A386 PolarHBondContact O-N 3.35Å
383S51Low45.5Very low88 Ų88105.8 Ų105.862%0.61554%0.536SS*.Hα-helixtrans-57.3-35.7174.1-50.80000114P381 G387P381-S383 PolarHBondContact O-N 3.49Å; S383-G387 PolarHBondContact O-N 3.28Å
384I55.9Low45Very low5 Ų5102.4 Ų102.43%0.02653%0.533CS..Hα-helixtrans-80.6-37.3179.2-67.6-178.5000110.1F126 F127 W380 P381 D382F126-I384 HydrophobicContact CB-CD1 4Å; F126-I384 HydrophobicContact CB-CG1 3.83Å; F126-I384 HydrophobicContact CD1-CD1 3.5Å; F126-I384 VanDerWaalsContact CD1-CD1 3.5Å; F126-I384 HydrophobicContact CD1-CG1 4.12Å; F126-I384 HydrophobicContact CD2-CD1 4.16Å; F126-I384 HydrophobicContact CD2-CG1 3.91Å; F126-I384 HydrophobicContact CE1-CD1 3.93Å; F126-I384 HydrophobicContact CG-CD1 3.61Å; F126-I384 HydrophobicContact CG-CG1 3.68Å; F126-I384 HydrophobicContact CZ-CD1 4.44Å; F127-I384 HydrophobicContact CE1-CG2 3.98Å; F127-I384 HydrophobicContact CE2-CB 4.09Å; F127-I384 HydrophobicContact CE2-CG2 3.76Å; F127-I384 WeakPolarHBondContact CE2-O 3.44Å; F127-I384 HydrophobicContact CZ-CB 4.03Å; F127-I384 HydrophobicContact CZ-CG2 3.18Å; F127-I384 WeakPolarHBondContact CZ-O 3.44Å; W380-I384 HydrophobicContact CB-CB 4.07Å; W380-I384 HydrophobicContact CB-CG2 3.9Å; W380-I384 HydrophobicContact CD2-CG2 3.83Å; W380-I384 HydrophobicContact CE3-CB 4.41Å; W380-I384 HydrophobicContact CE3-CD1 3.63Å; W380-I384 HydrophobicContact CE3-CG2 3.6Å; W380-I384 HydrophobicContact CG-CG2 3.99Å; W380-I384 HydrophobicContact CZ3-CD1 4.11Å; W380-I384 HydrophobicContact CZ3-CG2 4.31Å; P381-I384 HydrophobicContact CG-CD1 3.81Å; P381-I384 HydrophobicContact CG-CG1 4.1Å; P381-I384 PolarHBondContact O-N 3.36Å; D382-I384 VanDerWaalsContact C-N 3.29Å; D382-I384 PolarHBondContact O-N 2.75Å
385V56.7Low45Very low24 Ų24104 Ų10415%0.14555%0.547CS..Hα-helixtrans-70.7-38.4177.7175.50000111.8W380 P381 D382W380-V385 HydrophobicContact CB-CG2 3.8Å; P381-V385 PolarHBondContact O-N 2.95Å; D382-V385 PolarHBondContact O-N 3.33Å
386A54Low44.9Very low51 Ų51106 Ų10642%0.42156%0.557SS.*Hα-helixtrans-67.2-37.9179.500000112.4D382 V388 L389 Q390D382-A386 WeakPolarHBondContact O-CB 3.46Å; D382-A386 PolarHBondContact O-N 3.35Å; A386-V388 VanDerWaalsContact C-N 3.32Å; A386-V388 PolarHBondContact O-N 3.04Å; A386-L389 PolarHBondContact O-N 3.48Å; A386-L389 VanDerWaalsContact O-N 3.15Å; A386-Q390 WeakPolarHBondContact O-CB 3.45Å; A386-Q390 PolarHBondContact O-N 3.19Å; A386-Q390 VanDerWaalsContact O-N 3.1Å
387G50.9Low44.7Very low32 Ų32105.9 Ų105.933%0.3356%0.556SS.*Hα-helixtrans-59.7-38.6177.500000113.6S383S383-G387 PolarHBondContact O-N 3.28Å
388V53.6Low44.4Very low63 Ų63107.9 Ų107.938%0.38257%0.57SS.*Hα-helixtrans-71-30177.5173.10000112.4F127 A386F127-V388 HydrophobicContact CE1-CG2 4.1Å; F127-V388 HydrophobicContact CE2-CG2 4.21Å; F127-V388 HydrophobicContact CZ-CG2 3.65Å; A386-V388 VanDerWaalsContact C-N 3.32Å; A386-V388 PolarHBondContact O-N 3.04Å
389L47.5Very low43.4Very low130 Ų130106.6 Ų106.668%0.68158%0.577SS**Hα-helixtrans-86.3-22.6-177.4-143.875.6000113.2A386A386-L389 PolarHBondContact O-N 3.48Å; A386-L389 VanDerWaalsContact O-N 3.15Å
390Q47.1Very low42.7Very low148 Ų148107.3 Ų107.369%0.69259%0.593SS**Hα-helixtrans-82.5-18.4-172.4-151.4161.227.300114.3A386 H392A386-Q390 WeakPolarHBondContact O-CB 3.45Å; A386-Q390 PolarHBondContact O-N 3.19Å; A386-Q390 VanDerWaalsContact O-N 3.1Å; Q390-H392 PolarHBondContact O-N 3.39Å
391T42.8Very low42Very low99 Ų99114.3 Ų114.361%0.60763%0.627SS**THydrogen-bonded Turntrans-71.9-11.1178.1-78.30000114.1P131P131-T391 HydrophobicContact CG-CG2 4.35Å
392H40.3Very low41Very low173 Ų173119.3 Ų119.380%0.80165%0.652SS**THydrogen-bonded Turntrans-90.410.6180-90.3-76.1000115.8Q390Q390-H392 PolarHBondContact O-N 3.39Å
393R34.5Very low41Very low228 Ų228117.3 Ų117.386%0.8665%0.646SS**SBendtrans-131.832.9-174.6-151.7-174.5167.1160-2.9116.8
394S30.3Very low40Very low108 Ų108120.3 Ų120.376%0.75565%0.654SS**  trans-147.382.5177.2-60.70000113.9
395Q30.4Very low38.8Very low188 Ų188125.7 Ų125.788%0.87969%0.692SS**  trans-165.2106.7147.2-112.2172.448.100110
396T31Very low37.7Very low142 Ų142132.6 Ų132.687%0.87173%0.725SS**  trans175.6106.9134.443.50000108.9
397V32Very low36.5Very low129 Ų129137.8 Ų137.878%0.78275%0.746SS**  trans-143.2124.3163.9-176.90000110.3
398N32.7Very low35.4Very low143 Ų143139 Ų13977%0.76576%0.759SS**  trans71.3121153.2-64.2-7.5000122.4
399N28.5Very low34.4Very low163 Ų163143.7 Ų143.787%0.87278%0.781SS**  -161.5150.491.4-133.51.4000114
400S31.5Very low33.7Very low100 Ų100146.7 Ų146.770%0.69979%0.791SS**  trans-74.2149-169.1-560000116.3
401E31.1Very low32.8Very low196 Ų196144.9 Ų144.992%0.91680%0.795SS**  177.6122.8120.7-91.8179.1161.600110.7
402N31.6Very low32.2Very low156 Ų156148 Ų14883%0.83481%0.807SS**  trans-112.6172.1176.2-132.944.7000107.7
403P47.8Very low31.4Very low97 Ų97145.9 Ų145.963%0.6381%0.812SS**  cis-140.1176.820.233-6.6000113.4
404L30.4Very low31.7Very low151 Ų151140.1 Ų140.179%0.79181%0.806SS**  -169.8137.352.2-74.8163.1000110.7
405S30.2Very low31.8Very low118 Ų118141.8 Ų141.883%0.82581%0.807SS**  trans44.3140.7141.4-66.10000122.7
406M34.3Very low31.7Very low170 Ų170137.5 Ų137.584%0.83780%0.797SS**  cis-1541571691-93.5-174.900114.6
407D28.6Very low31.8Very low159 Ų159135.4 Ų135.485%0.8579%0.794SS**  trans55.8132.8145.3-114.4-98.3000122.1
408G27.9Very low32Very low59 Ų59135.8 Ų135.861%0.60880%0.797SS**  cis1781767.100000114.4
409L32.4Very low32.3Very low161 Ų161137.4 Ų137.484%0.84381%0.805SS**  trans89.779175.2-50.1-177.7000116.9
410Q31.3Very low32.7Very low193 Ų193134.8 Ų134.890%0.90281%0.806SS**  68.8110.983.3-74.1-174.1-19.300116.5
411S28.5Very low33.1Very low109 Ų109139.1 Ų139.176%0.76282%0.818SS**  trans-141.6146.6159.8-142.60000109.5
412L30.4Very low33.3Very low166 Ų166138.6 Ų138.687%0.86982%0.815SS**  trans89.8125.2161.1-45.3-176.5000119.5
413S25Very low33.6Very low128 Ų128140.8 Ų140.890%0.89582%0.82SS**  trans-140123.5140.2-176.70000108.8
414S39.1Very low32.8Very low107 Ų107140.6 Ų140.675%0.74883%0.827SS**  trans-139.71211621790000105.2
415D32.6Very low32.9Very low142 Ų142142.1 Ų142.176%0.75983%0.832SS**  trans-179.4111.5149.9-96.6-37.2000106.8
416S29.6Very low33.6Very low98 Ų98145.2 Ų145.269%0.68584%0.839SS**  93.3143.669.472.80000112.2
417A32.5Very low33.5Very low98 Ų98140.7 Ų140.781%0.8184%0.835SS**  trans-41.1129.7-166.300000117.3
418T35.3Very low33.9Very low137 Ų137137.3 Ų137.384%0.8483%0.83SS**  trans-176.591.1152.312.20000110.9
419L40.2Very low34.1Very low178 Ų178141.4 Ų141.493%0.93284%0.838SS**  trans178.485.8146.6-128.467.6000112
420A35.9Very low34.3Very low108 Ų108140.5 Ų140.589%0.89383%0.833SS**  trans-159.455156.100000110.1
421M40.3Very low34.7Very low191 Ų191135.3 Ų135.394%0.94182%0.818SS**SBendtrans-140.939.6169.8-149.5-173.9-79.200111
422Q35.5Very low35.2Very low184 Ų184138.5 Ų138.586%0.8682%0.823SS**  trans-152.979.3170.4-163162.262.200111.8
423Q36.9Very low35.4Very low203 Ų203137.2 Ų137.295%0.94982%0.818SS**  trans-153.893.7149.6-144.5121.836.500109.5
424A32.1Very low36.1Very low93 Ų93134 Ų13477%0.76980%0.804SS**  trans-112.6131.8163.100000107.4
425M33Very low36.2Very low182 Ų182135.3 Ų135.390%0.89781%0.808SS**  trans145.9136.9153.1-77.2-89.7-157.600110.9
426L43.8Very low36.7Very low184 Ų184136.9 Ų136.996%0.96381%0.811SS**  trans84.4111.8-171.3-47.9175.8000112.7
427G32.3Very low37.1Very low74 Ų74139.4 Ų139.476%0.76382%0.817SS**  cis151.7132.84.600000109.2
428A37Very low37.7Very low89 Ų89141.3 Ų141.374%0.73681%0.813SS**  trans63.7119.4159.800000118.7
429D32.6Very low38Very low145 Ų145143.9 Ų143.978%0.77582%0.816SS**  104.9140.710774.6-95.6000108.4
430D35.4Very low38.2Very low141 Ų141142.9 Ų142.975%0.75481%0.811SS**  cis-159.4128.125.7-152.1-118.8000104.9
431S39.6Very low38.7Very low84 Ų84146.3 Ų146.359%0.58781%0.809SS**  88.9122.1100.1-168.30000116.1
432M39.3Very low38.9Very low176 Ų176145.5 Ų145.587%0.86780%0.803SS**  trans64.8147.4150-81179153.200117.6
433D34.6Very low39.3Very low140 Ų140144.5 Ų144.575%0.74980%0.798SS**  cis174.2123.55.8178.841.8000100.7
434G40.2Very low39.7Very low59 Ų59142.1 Ų142.161%0.60879%0.787SS**  8271.368.200000112
435T40.9Very low40.1Very low136 Ų136146.5 Ų146.583%0.83479%0.791SS**  trans-163.7125.7147.6-13.70000112.2
436E44.1Very low40.5Very low175 Ų175146 Ų14682%0.81879%0.787SS**  trans-63.9144153.9-58.2166.8177.300107.5
437D37.8Very low40.5Very low151 Ų151145.8 Ų145.881%0.80778%0.781SS**  trans-176.9148.6140.5-89.4-30.6000110.4
438D45.1Very low41Very low138 Ų138151.8 Ų151.874%0.73879%0.789SS**  trans-48155.5178.8-59.1-72.1000114.4
439E42.2Very low41.4Very low191 Ų191156.2 Ų156.289%0.89380%0.795SS**  -173.1125.1123.7-98.8164.8-157.500110.5
440D44Very low41.9Very low157 Ų157157.9 Ų157.984%0.8480%0.798SS**  trans-58.2131.3165-59.8-68.6000110
441E45.2Very low42.1Very low180 Ų180154.6 Ų154.684%0.84180%0.798SS**  trans-119.290.6158.6-81.4-176168.400108.2E443E441-E443 PolarHBondContact O-N 3.23Å
442E46.3Very low42.1Very low174 Ų174158.1 Ų158.181%0.81381%0.807SS**  trans-63.6112.3149-66.7-175.6160.200107.5
443E42.9Very low42.3Very low163 Ų163157.1 Ų157.176%0.76281%0.805SS**  trans-100.594.8157.3-77.9-168.4164.800108E441E441-E443 PolarHBondContact O-N 3.23Å
444E44.6Very low42.8Very low153 Ų153158.4 Ų158.472%0.71581%0.806SS**  trans-62121148.6-64.2-172.8152.800108
445E42.3Very low42.9Very low184 Ų184163.7 Ų163.786%0.8682%0.815SS**  trans-115.7104.9152.1-77-162.2163.900107.6
446E39.8Very low43Very low173 Ų173166.4 Ų166.481%0.80882%0.818SS**  trans-64.9164.8168.5-69.6-171.3147.600112
447E44.4Very low42.9Very low178 Ų178165.6 Ų165.683%0.83281%0.814SS**  trans-52.9141.7-175.4-51.9177.2159.900115.5
448E42.2Very low43.4Very low200 Ų200167.4 Ų167.494%0.93582%0.818SS**  trans-134107.4136.2-74.9-164.7165.600109.2
449E46.7Very low43.2Very low182 Ų182168.7 Ų168.785%0.8582%0.82SS**  trans-54.2133.5154.5-80.4-168.1141.300109.7
450E42.1Very low43.3Very low180 Ų180168.7 Ų168.784%0.84182%0.82SS**  trans-144107.2134.4-75.9-156.3162.400108.8
451G39.5Very low43.3Very low73 Ų73169.5 Ų169.575%0.75382%0.818SS**  trans-75.8133.616200000109.9
452M39.6Very low43.3Very low157 Ų157168.2 Ų168.277%0.77381%0.812SS**  trans-125.190.7158.9-86-176.6167.900107.5
453D43.3Very low42.9Very low155 Ų155168.4 Ų168.483%0.82981%0.814SS**  trans-72.4116.4151.2-71.1-46.8000106.7
454E46.2Very low42.5Very low167 Ų167164.2 Ų164.278%0.7881%0.814SS**  trans-110.398161.4-76-170.8170.400107.8
455E41.3Very low42.3Very low171 Ų171166.4 Ų166.480%0.79982%0.824SS**  trans-69.6117.5160.7-63.6176.215600108.2
456E43.8Very low42.3Very low193 Ų193166.1 Ų166.190%0.90282%0.823SS**  trans-100.189.5159.5-80.5-172.9169.100108
457E41.6Very low42.3Very low157 Ų157165.9 Ų165.973%0.73482%0.821SS**  trans-87.6117.2154.6-70.4-17115700107.9
458E47.6Very low42Very low189 Ų189165.7 Ų165.788%0.88382%0.82SS**  trans-107.4101.3157.5-78.8-166.6164.200108.2
459E40.9Very low41.6Very low165 Ų165162 Ų16277%0.77181%0.807SS**  trans-74.6126.9158.8-66.1-176.1150.300109
460E44.8Very low41.3Very low192 Ų192165 Ų16590%0.89781%0.81SS**  trans-116.399.8155.8-77.8-163.8164.100108.3
461E43.9Very low40.9Very low173 Ų173159.5 Ų159.581%0.80880%0.803SS**  trans-99.9121.3162.6-87.6-165.9171.600110.7
462E45.3Very low40.7Very low153 Ų153166 Ų16672%0.71580%0.804SS**  66135.5127.7-92.1-168.7172.300125
463E39.1Very low40.6Very low179 Ų179164.4 Ų164.484%0.83680%0.795SS**  trans87.6130.4137.9-74.6-173167.700122
464G34.5Very low40.3Very low74 Ų74164.1 Ų164.176%0.76379%0.793SS**  trans175.753.3176.700000115.7
465E40.2Very low39.9Very low199 Ų199162 Ų16293%0.9380%0.797SS**  trans52.3152.5139.9-62.6-172.6161.800125.3
466E41.3Very low39.5Very low179 Ų179157.2 Ų157.284%0.83679%0.793SS**  trans-78151.7-165.2-72.5174.8148.800118
467E40.8Very low39.1Very low167 Ų167160.3 Ų160.378%0.7880%0.796SS**  54.2117.1127.1-151.3-176.9-141.800122.1
468H36.4Very low38.8Very low174 Ų174156.7 Ų156.781%0.80680%0.802SS**  trans-162.2120130.8-118.969.5000115.3
469D35.6Very low38.1Very low123 Ų123151.9 Ų151.966%0.65880%0.802SS**  55.9119.3129.1-161.727.4000121.6
470R39.3Very low37.9Very low244 Ų244147.9 Ų147.992%0.92181%0.806SS**  -172.5108.8121.5-100.4169.7-167.9-174.66.7111.8
471G33.8Very low37.7Very low66 Ų66147.4 Ų147.468%0.6880%0.804SS**  trans-78.6160.8170.500000115
472R35.1Very low37.6Very low209 Ų209150.7 Ų150.779%0.78981%0.808SS**  174.1123.2127.9-108.7-167-176.8-133.58.2113.6
473Q37.7Very low37.2Very low124 Ų124150.8 Ų150.858%0.57981%0.809SS**  64.2114.3125.7-73.4172.818.700122.9
474L37.4Very low37.2Very low148 Ų148149 Ų14978%0.77580%0.804SS**  77.7139.3115.8-65.2170.8000122
475S36.6Very low37.3Very low124 Ų124149.7 Ų149.787%0.86780%0.798SS**  trans84.1130.8154.7-55.10000116.4
476G34.7Very low37.2Very low70 Ų70148.5 Ų148.572%0.72279%0.794SS**  cis166170.21.500000110.7
477R35Very low37.2Very low257 Ų257147 Ų14797%0.9779%0.792SS**  trans71.2122.3152.1-90.2174.6130.3-162.5-2.8121.7
478G34.3Very low37.3Very low82 Ų82143.2 Ų143.285%0.84579%0.789SS**  trans86.8124.8132.300000114.8
479G33.1Very low37.4Very low87 Ų87138.4 Ų138.490%0.89779%0.786SS**  cis121.4123.727.700000107.8
480G36Very low37.9Very low82 Ų82139.1 Ų139.185%0.84579%0.79SS**  trans150.589.716800000116.1
481Q41.1Very low38.5Very low182 Ų182134.3 Ų134.385%0.8578%0.778SS**  trans-65.3154159.1-74.1171.7-42.600112.4
482R41.6Very low39.4Very low241 Ų241137.6 Ų137.691%0.90978%0.779SS**  trans-178.5102.2135.7-97.9178-118.4-175.4-2107.4
483E37.4Very low40.1Very low155 Ų155139.4 Ų139.472%0.72480%0.797SS**  62.4109.584.1-77.2-96.5110.700115.3
484L40Very low40.2Very low141 Ų141140.2 Ų140.274%0.73881%0.808SS**  trans53.7126.2133.7-56.6172.5000120.9
485S35.5Very low40.3Very low90 Ų90139.7 Ų139.763%0.62981%0.809SS**  153.8144.787.4-139.70000114.6
486M38.4Very low40.6Very low174 Ų174140.6 Ų140.686%0.85781%0.806SS**  trans66.8141.8152.9-69.8143.814400118
487D40.2Very low40.9Very low148 Ų148144.8 Ų144.879%0.79181%0.811SS**  cis-169.2126.135.2-156.5-128.2000106.9
488A43.9Very low41.3Very low86 Ų86137.8 Ų137.871%0.71180%0.801SS**  85.9135.294.800000117.3
489G39.1Very low41.7Very low73 Ų73141.5 Ų141.575%0.75380%0.798SS**  trans82.3141.515600000116.1
490D46Very low42.3Very low139 Ų139145.4 Ų145.474%0.74379%0.791SS**  cis-171.9144.49.6-159.2-129000108.8
491E50.6Low42.8Very low142 Ų142150.2 Ų150.266%0.66479%0.787SS**  trans26.6123.3144.9-68.3-172.545.800122.2
492L54.4Low43Very low135 Ų135147.6 Ų147.671%0.70778%0.782SS**  91.314893.2-67.5-179.6000111.8
493E48.4Very low43.1Very low247 Ų247139.1 Ų139.1100%1.15477%0.77SS**  cis-150.5010.5-147.6172.3138.400109.1

Retrieved 493 of 493 residues in 654.3 ms (Link to these results)