A0A096N2B6_PAPAN Loading...

Small ribosomal subunit protein uS5

AlphaFold DB (E9PQD7), UniProt , Accession A0A096N2B6, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 235 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.9Very low39.7Very low234 Ų234120.3 Ų120.3100%1.15386%0.86SS**  0141.20-88.553.2179.100108.2
2A39.3Very low39.3Very low85 Ų85117.1 Ų117.170%0.70286%0.858SS**  trans-74.2169.516400000109.5
3D42.4Very low38.9Very low168 Ų168113.9 Ų113.990%0.89885%0.853SS**  -167.9166.2102.7-101-57000111.6
4D40.6Very low39.4Very low152 Ų152115.6 Ų115.681%0.81386%0.856SS**  trans-121.8161.9-153.5-160-67.1000112.7
5A43.4Very low38.9Very low99 Ų99113.3 Ų113.382%0.81885%0.854SS**  trans157.6139.6151.800000110.5
6G34.6Very low38.4Very low76 Ų76110.9 Ų110.978%0.78485%0.849SS**  cis-167.5174.6-1.200000111.4
7A40.5Very low38.9Very low109 Ų109112.5 Ų112.590%0.90185%0.852SS**  trans-119.6160.9-157.600000116.6
8A38Very low38.5Very low109 Ų109110.2 Ų110.290%0.90185%0.845SS**  trans-168.7148.6150.700000108.2
9G32.4Very low38.3Very low77 Ų77114.9 Ų114.979%0.79485%0.853SS**  cis168.3133.6-400000108.4
10G34.3Very low38Very low79 Ų79113.2 Ų113.281%0.81485%0.851SS**  trans-81-157.6-175.400000115
11P46.1Very low37.8Very low135 Ų135114.3 Ų114.388%0.87785%0.846SS**  cis-124.5-170.910.243.1-28.6000114
12G34.7Very low37.2Very low82 Ų82113.6 Ų113.685%0.84583%0.83SS**  cis145.180.4-16.700000117.9
13G34.6Very low36.9Very low76 Ų76113.4 Ų113.478%0.78484%0.836SS**  trans117.1173159.200000118
14P45.8Very low36.8Very low138 Ų138108.7 Ų108.790%0.89683%0.828SS**  cis-132.9171.89.242.2-26.7000117.2
15G32Very low36.6Very low81 Ų81111.5 Ų111.584%0.83583%0.833SS**  trans110.6107.8146.900000119.4
16G31.2Very low36.1Very low75 Ų75118.7 Ų118.777%0.77384%0.839SS**  trans-109.7-155.115800000110.9
17P46.6Very low36Very low138 Ų138119.1 Ų119.190%0.89684%0.843SS**  cis-134.6176.5-9.341.8-26.2000114.5
18G31.9Very low35.5Very low71 Ų71117.7 Ų117.773%0.73284%0.839SS**  trans130.3124.1139.900000120.7
19M33.8Very low35.1Very low200 Ų200123 Ų12399%0.98584%0.842SS**  trans71.7111.7147.7-127.673.782.100120.8
20G32.7Very low35.2Very low80 Ų80123.2 Ų123.283%0.82584%0.844SS**  trans170.7100.7165.900000113.7
21N33.1Very low35.4Very low137 Ų137125.9 Ų125.973%0.73385%0.851SS**  trans-96.2147.6-167.8-143.3-8.1000113.2
22R33.8Very low34.7Very low219 Ų219122.7 Ų122.783%0.82684%0.842SS**  trans61.7129.4156.4-62.3172.8-168.1166.22.7121.3
23G32.4Very low34.8Very low81 Ų81125.6 Ų125.684%0.83584%0.837SS**  100.5132.3109.600000117.6
24G40.6Very low34.9Very low69 Ų69133.5 Ų133.571%0.71184%0.843SS**  trans-84.3170.7176.300000115
25F36.1Very low34.3Very low211 Ų211130.7 Ų130.793%0.92584%0.839SS**  trans64.7103.3171.1-61.9-84.8000118.6
26R33.3Very low34.7Very low250 Ų250139.5 Ų139.594%0.94385%0.847SS**  169.1125.6113.7-96.8179.7171.7-167.6-0.7114.4
27G32.5Very low34.8Very low85 Ų85139.4 Ų139.488%0.87685%0.846SS**  trans70.8154.7140.400000118.9
28G30.2Very low34.8Very low79 Ų79145.5 Ų145.581%0.81485%0.851SS**  trans157.5105.1169.900000115.6
29F28.9Very low34.9Very low221 Ų221145.7 Ų145.797%0.96985%0.853SS**  trans-49.4142.8166.9-84.4-120.7000115.1
30G34.9Very low35.5Very low81 Ų81148.8 Ų148.884%0.83585%0.854SS**  97.4122.1123.800000119.2
31S38.2Very low35.7Very low135 Ų135148.2 Ų148.294%0.94485%0.848SS**  trans-136.6128.4150.4-175.30000107.5
32G31.5Very low36.1Very low67 Ų67153.7 Ų153.769%0.69186%0.858SS**  trans153.327.1-175.700000120.7
33I36.5Very low36.2Very low144 Ų144146.8 Ų146.874%0.73886%0.856SS**  trans67.4117.7145.7-60.9171.2000120
34R36.5Very low36.6Very low241 Ų241154.3 Ų154.391%0.90986%0.859SS**  trans42.7122.3148.2-61.6173.4-152.3153.97.8121.1
35G34.5Very low36.4Very low80 Ų80154.5 Ų154.583%0.82586%0.861SS**  trans173.966.5159.500000115.5G37G35-G37 PolarHBondContact O-N 3.2Å
36R40Very low36.7Very low266 Ų266156 Ų156100%1.00486%0.86SS**  trans-82.798.3-179.6-169.7-174.9-169.2-168.95.6110.7
37G32.9Very low36.8Very low72 Ų72147.3 Ų147.374%0.74285%0.849SS**  trans-146126.6178.100000113.1G35G35-G37 PolarHBondContact O-N 3.2Å
38R47.2Very low37.3Very low267 Ų267155.1 Ų155.1100%1.00885%0.852SS**  trans-71.1129.7-175.7-73.3170.3166.3170.1-5.6111.9
39G33.9Very low37.5Very low75 Ų75154.4 Ų154.477%0.77385%0.845SS**  trans-143.674.6171.600000112.7G41G39-G41 PolarHBondContact O-N 3.49Å
40R46.7Very low38.3Very low264 Ų264149 Ų149100%0.99684%0.84SS**  trans-76.262.9175-117.2-172-176.8-177.11.5111R42R40-R42 PolarHBondContact O-N 3.36Å
41G35.3Very low38.6Very low69 Ų69156.8 Ų156.871%0.71184%0.844SS**  trans-91.281.2174.600000111.8G39 G43G39-G41 PolarHBondContact O-N 3.49Å; G41-G43 PolarHBondContact O-N 3.39Å
42R42.4Very low38.9Very low251 Ų251153.8 Ų153.895%0.94784%0.835SS**  trans-71.572.6164.8-96.1-174172177.2-2.7109.1R40 R44R40-R42 PolarHBondContact O-N 3.36Å; R42-R44 VanDerWaalsContact C-N 3.29Å; R42-R44 PolarHBondContact O-N 3.38Å
43G35Very low39Very low75 Ų75153.4 Ų153.477%0.77383%0.831SS**  trans-62.293.8165.100000108.6G41 G45G41-G43 PolarHBondContact O-N 3.39Å; G43-G45 PolarHBondContact O-N 3.44Å
44R42.1Very low39.4Very low239 Ų239156.2 Ų156.290%0.90284%0.838SS**  trans-61.388.3162-84.7179.5165.4171.5-5.2106.4R42 R46R42-R44 VanDerWaalsContact C-N 3.29Å; R42-R44 PolarHBondContact O-N 3.38Å; R44-R46 VanDerWaalsContact C-N 3.34Å; R44-R46 PolarHBondContact O-N 3.22Å
45G36.7Very low39.9Very low73 Ų73149 Ų14975%0.75383%0.829SS**  trans-54.3104.7166.100000106.5G43 G47G43-G45 PolarHBondContact O-N 3.44Å; G45-G47 PolarHBondContact O-N 3.3Å
46R40.9Very low40.7Very low242 Ų242153.5 Ų153.591%0.91383%0.829SS**  trans-53.9109.3177.3-79.6175166168.1-6106R44 R48R44-R46 VanDerWaalsContact C-N 3.34Å; R44-R46 PolarHBondContact O-N 3.22Å; R46-R48 PolarHBondContact O-N 3.13Å
47G36.5Very low41.5Very low68 Ų68148.9 Ų148.970%0.70182%0.824SS**  trans-51.8115.3166.600000105.8G45 G49G45-G47 PolarHBondContact O-N 3.3Å; G47-G49 VanDerWaalsContact C-N 3.3Å; G47-G49 PolarHBondContact O-N 2.95Å
48R41.8Very low43.3Very low249 Ų249154.6 Ų154.694%0.9483%0.829SS**  trans-57.8106.9169.5-82.7-178169-179.8-3.8104.3R46 A50R46-R48 PolarHBondContact O-N 3.13Å; R48-A50 PolarHBondContact O-N 2.89Å
49G35.9Very low44.9Very low64 Ų64148.8 Ų148.866%0.6681%0.813SS**  trans-51.4131.6-174.400000107.9G47 R51G47-G49 VanDerWaalsContact C-N 3.3Å; G47-G49 PolarHBondContact O-N 2.95Å; G49-R51 PolarHBondContact O-N 2.84Å
50A44.9Very low47.5Very low106 Ų106147.2 Ų147.288%0.87678%0.784SS**  trans-6287.2164.900000106.2R48 G52R48-A50 PolarHBondContact O-N 2.89Å; A50-G52 PolarHBondContact O-N 2.89Å
51R42Very low49.4Very low245 Ų245141.8 Ų141.893%0.92577%0.772SS**  trans-76.952.8173.4-159.2178.9-171.2177.12.3108.1G49 G53G49-R51 PolarHBondContact O-N 2.84Å; R51-G53 PolarHBondContact O-N 3Å
52G42.8Very low51.9Low73 Ų73139.3 Ų139.375%0.75374%0.743SS**  trans-69.861.1155.500000108.1A50 K54A50-G52 PolarHBondContact O-N 2.89Å; G52-K54 PolarHBondContact O-N 3.45Å
53G35.1Very low54.1Low58 Ų58132.5 Ų132.560%0.59873%0.729SS**PPolyproline II helixtrans-59126.5148.600000104.9R51 A55R51-G53 PolarHBondContact O-N 3Å; G53-A55 PolarHBondContact O-N 3.4Å
54K44.4Very low56.7Low204 Ų204130.6 Ų130.689%0.88770%0.702SS**PPolyproline II helixtrans-50.5118.1160.8-73.7-178.4172.2-174.70105.3G52 E56G52-K54 PolarHBondContact O-N 3.45Å; K54-E56 PolarHBondContact O-N 3.24Å
55A47Very low59Low88 Ų88123.9 Ų123.973%0.72768%0.679SS**PPolyproline II helixtrans-60.2116.4164.900000104.7G53 D57G53-A55 PolarHBondContact O-N 3.4Å; A55-D57 PolarHBondContact O-N 3.22Å
56E51.1Low61.5Low175 Ų175120.4 Ų120.482%0.81864%0.644SS**PPolyproline II helixtrans-46.6133.2162.2-65.4159.5-160.400106.8K54 K58K54-E56 PolarHBondContact O-N 3.24Å; E56-K58 VanDerWaalsContact C-N 3.29Å; E56-K58 WeakPolarHBondContact O-CA 3.48Å; E56-K58 WeakPolarHBondContact O-CB 3.36Å; E56-K58 PolarHBondContact O-N 3.44Å
57D57.6Low63.8Low170 Ų170108.9 Ų108.991%0.90960%0.6SS**  trans-57.592.9-170.6-68.9-56.4000110.2A55 E59A55-D57 PolarHBondContact O-N 3.22Å; D57-E59 PolarHBondContact O-N 3.15Å; D57-E59 VanDerWaalsContact O-N 3.09Å
58K69.5Low66.4Low192 Ų192107.2 Ų107.284%0.83557%0.573SS**  trans-83.7103.2-161.7-160.5174.5-169.5176.70107E56 W60E56-K58 VanDerWaalsContact C-N 3.29Å; E56-K58 WeakPolarHBondContact O-CA 3.48Å; E56-K58 WeakPolarHBondContact O-CB 3.36Å; E56-K58 PolarHBondContact O-N 3.44Å; K58-W60 PolarHBondContact O-N 3.47Å
59E82.1Confident68.7Low144 Ų14495.4 Ų95.467%0.67353%0.528SS*.  trans-47.2113.9-174.6-162.4-153.6139.100110.5D57 M61 K71D57-E59 PolarHBondContact O-N 3.15Å; D57-E59 VanDerWaalsContact O-N 3.09Å; E59-M61 PolarHBondContact O-N 2.94Å; E59-M61 VanDerWaalsContact O-N 3.07Å; E59-K71 IonicContact OE1-NZ 2.67Å; E59-K71 PolarHBondContact OE1-NZ 3.17Å
60W87.9Confident71.3Confident42 Ų4292.3 Ų92.316%0.15950%0.497CS..  trans-63115.6-173.2166.345.9000109.6K58 P62 V70 K71 E90 E92 I93 F96K58-W60 PolarHBondContact O-N 3.47Å; W60-P62 HydrophobicContact CZ2-CB 3.9Å; W60-P62 VanDerWaalsContact O-CD 3.31Å; W60-P62 WeakPolarHBondContact O-CD 3.47Å; W60-V70 HydrophobicContact CH2-CB 4.27Å; W60-V70 HydrophobicContact CH2-CG1 4.03Å; W60-V70 HydrophobicContact CZ3-CG1 4.35Å; W60-K71 HydrophobicContact CZ3-CB 4.2Å; W60-K71 WeakPolarHBondContact O-CD 3.43Å; W60-K71 WeakPolarHBondContact O-CE 3.36Å; W60-K71 PolarHBondContact O-NZ 2.64Å; W60-E90 WeakPolarHBondContact CZ2-OE2 3.2Å; W60-E90 PolarHBondContact NE1-OE2 3.15Å; W60-E92 HydrophobicContact CB-CB 4.4Å; W60-E92 HydrophobicContact CB-CG 4.36Å; W60-E92 HydrophobicContact CD2-CB 3.43Å; W60-E92 VanDerWaalsContact CD2-CB 3.43Å; W60-E92 HydrophobicContact CD2-CG 4.22Å; W60-E92 VanDerWaalsContact CE2-CB 3.48Å; W60-E92 HydrophobicContact CE3-CB 3.92Å; W60-E92 HydrophobicContact CG-CB 3.63Å; W60-E92 HydrophobicContact CG-CG 3.86Å; W60-E92 HydrophobicContact CH2-CB 4.46Å; W60-E92 HydrophobicContact CZ2-CB 4.03Å; W60-E92 HydrophobicContact CZ3-CB 4.4Å; W60-I93 HydrophobicContact CH2-CB 4.42Å; W60-I93 HydrophobicContact CH2-CG1 3.64Å; W60-I93 HydrophobicContact CZ2-CG1 3.59Å; W60-F96 HydrophobicContact CZ3-CB 4.25Å
61M85.8Confident73.4Confident151 Ų15190.4 Ų90.474%0.74447%0.468SS*.  trans-101.999.8173.4-85.9-171.9-96.400109.2E59 V63E59-M61 PolarHBondContact O-N 2.94Å; E59-M61 VanDerWaalsContact O-N 3.07Å; M61-V63 PolarHBondContact O-N 3.48Å
62P89.1Confident75.7Confident16 Ų1681.6 Ų81.610%0.10444%0.44CS..  trans-68.2130.6-173.623.9-33.8000112.8W60 R68 K71 E90W60-P62 HydrophobicContact CZ2-CB 3.9Å; W60-P62 VanDerWaalsContact O-CD 3.31Å; W60-P62 WeakPolarHBondContact O-CD 3.47Å; P62-R68 HydrophobicContact CB-CG 4.23Å; P62-R68 HydrophobicContact CG-CB 4.39Å; P62-R68 HydrophobicContact CG-CG 3.8Å; P62-R68 VanDerWaalsContact O-CZ 3.29Å; P62-R68 PolarHBondContact O-NH1 3.03Å; P62-K71 HydrophobicContact CG-CB 4.07Å; P62-K71 HydrophobicContact CG-CD 4.03Å; P62-E90 VanDerWaalsContact CA-OE2 3.28Å; P62-E90 WeakPolarHBondContact CA-OE2 3.45Å; P62-E90 WeakPolarHBondContact CB-OE2 3.43Å
63V87.3Confident77.9Confident108 Ų10884.9 Ų84.966%0.65544%0.437SS*.  trans-92.1-30-177.4-65.60000112.2M61 R68 E90M61-V63 PolarHBondContact O-N 3.48Å; V63-R68 PolarHBondContact O-NH1 3.4Å; V63-E90 HydrophobicContact CG2-CG 4.32Å; V63-E90 WeakPolarHBondContact CG2-OE1 3.29Å; V63-E90 PolarHBondContact N-OE1 3.45Å
64T90.4Very high80.4Confident35 Ų3585.8 Ų85.822%0.21543%0.425CS..SBendtrans-82.8167.3177.161.80000113.3G67 R68 K89 E90T64-G67 PolarHBondContact OG1-N 2.98Å; T64-R68 PolarHBondContact O-N 3.28Å; T64-R68 PolarHBondContact O-NH1 2.81Å; T64-K89 HydrophobicContact CG2-CB 4.43Å; T64-E90 WeakPolarHBondContact CB-OE1 3.37Å; T64-E90 WeakPolarHBondContact CG2-OE1 3.41Å; T64-E90 PolarHBondContact N-OE1 3.13Å; T64-E90 PolarHBondContact OG1-OE1 3.24Å
65K89.8Confident82.6Confident98 Ų9876.1 Ų76.143%0.42638%0.383SS..Hα-helixtrans-65.3-42.1167.9-65178.4177.7-176.80110.9R68 L69 Y208 L215 H219K65-R68 PolarHBondContact O-N 2.86Å; K65-L69 WeakPolarHBondContact O-CG 3.37Å; K65-L69 PolarHBondContact O-N 3.44Å; K65-L69 VanDerWaalsContact O-N 3.13Å; K65-Y208 HydrophobicContact CB-CD1 4.3Å; K65-Y208 HydrophobicContact CB-CE1 3.75Å; K65-L215 HydrophobicContact CB-CD1 4.11Å; K65-L215 HydrophobicContact CB-CD2 3.88Å; K65-L215 HydrophobicContact CD-CD1 4.23Å; K65-L215 HydrophobicContact CG-CD1 4.32Å; K65-L215 HydrophobicContact CG-CD2 4.17Å; K65-H219 WeakPolarHBondContact CE-NE2 3.43Å
66L90Very high84.5Confident1 Ų180.3 Ų80.31%0.00539%0.385CS..Hα-helixtrans-60.2-52.2178.8-167.672000111.6R68 L69 V70 I75 I81 L86 I88 I93L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 3.18Å; L66-L69 PolarHBondContact O-N 3.31Å; L66-L69 VanDerWaalsContact O-N 3.11Å; L66-V70 WeakPolarHBondContact O-CG2 3.48Å; L66-V70 PolarHBondContact O-N 3.25Å; L66-I75 HydrophobicContact CD1-CD1 3.83Å; L66-I81 HydrophobicContact CD1-CD1 4.21Å; L66-I81 HydrophobicContact CD1-CG1 4.28Å; L66-I81 HydrophobicContact CD1-CG2 4.32Å; L66-I81 HydrophobicContact CD2-CD1 4.48Å; L66-I81 HydrophobicContact CD2-CG2 4.19Å; L66-I81 HydrophobicContact CG-CD1 4.47Å; L66-L86 HydrophobicContact CD1-CB 4.32Å; L66-L86 HydrophobicContact CD1-CD1 3.88Å; L66-I88 HydrophobicContact CD2-CG1 4.12Å; L66-I93 HydrophobicContact CB-CD1 4.3Å; L66-I93 HydrophobicContact CD2-CD1 3.84Å; L66-I93 HydrophobicContact CG-CD1 4.03Å
67G90.1Very high86.2Confident0 Ų073.4 Ų73.40%036%0.356CS..Hα-helixtrans-58.8-38-179.800000113.3T64 V70 K71T64-G67 PolarHBondContact OG1-N 2.98Å; G67-V70 PolarHBondContact O-N 2.95Å; G67-K71 WeakPolarHBondContact O-CB 3.06Å; G67-K71 PolarHBondContact O-N 3.02Å
68R89.6Confident87.7Confident33 Ų3366.3 Ų66.313%0.12532%0.318CS..Hα-helixtrans-63.2-49.7173.2-74.3178.7-175.978.3-3.9111.5P62 V63 T64 K65 L66 V70 K71 D72 T218 H219P62-R68 HydrophobicContact CB-CG 4.23Å; P62-R68 HydrophobicContact CG-CB 4.39Å; P62-R68 HydrophobicContact CG-CG 3.8Å; P62-R68 VanDerWaalsContact O-CZ 3.29Å; P62-R68 PolarHBondContact O-NH1 3.03Å; V63-R68 PolarHBondContact O-NH1 3.4Å; T64-R68 PolarHBondContact O-N 3.28Å; T64-R68 PolarHBondContact O-NH1 2.81Å; K65-R68 PolarHBondContact O-N 2.86Å; L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 3.18Å; R68-V70 PolarHBondContact O-N 3.4Å; R68-K71 PolarHBondContact O-N 3.37Å; R68-D72 WeakPolarHBondContact O-CB 3.41Å; R68-D72 PolarHBondContact O-N 3.19Å; R68-D72 VanDerWaalsContact O-OD2 3.08Å; R68-T218 PolarHBondContact NE-O 3.02Å; R68-H219 PolarHBondContact NH1-ND1 2.85Å
69L90.7Very high88.5Confident0 Ų064.5 Ų64.50%031%0.312CS..Hα-helixtrans-60.6-29.2178.2-67.3177.3000113.5K65 L66 K74 I75 P207 Y208 F211 L215K65-L69 WeakPolarHBondContact O-CG 3.37Å; K65-L69 PolarHBondContact O-N 3.44Å; K65-L69 VanDerWaalsContact O-N 3.13Å; L66-L69 PolarHBondContact O-N 3.31Å; L66-L69 VanDerWaalsContact O-N 3.11Å; L69-K74 HydrophobicContact CB-CB 4.32Å; L69-K74 HydrophobicContact CD2-CB 3.97Å; L69-K74 HydrophobicContact CD2-CG 4.05Å; L69-K74 WeakPolarHBondContact O-CA 3.43Å; L69-K74 WeakPolarHBondContact O-CB 3.47Å; L69-K74 PolarHBondContact O-N 3.37Å; L69-I75 HydrophobicContact CB-CD1 3.75Å; L69-I75 HydrophobicContact CB-CG1 4.05Å; L69-I75 HydrophobicContact CD1-CD1 4.2Å; L69-I75 PolarHBondContact O-N 3.35Å; L69-I75 VanDerWaalsContact O-N 3.15Å; L69-P207 HydrophobicContact CD1-CB 4.4Å; L69-Y208 HydrophobicContact CD1-CD1 3.97Å; L69-Y208 HydrophobicContact CD1-CE1 4.27Å; L69-F211 HydrophobicContact CD1-CB 4.34Å; L69-F211 HydrophobicContact CD1-CD2 4.26Å; L69-F211 HydrophobicContact CD2-CB 3.39Å; L69-F211 HydrophobicContact CD2-CD2 3.96Å; L69-F211 HydrophobicContact CD2-CG 3.88Å; L69-L215 HydrophobicContact CD1-CD1 4.19Å; L69-L215 HydrophobicContact CD2-CD2 4.18Å; L69-L215 HydrophobicContact CD2-CG 4.17Å; L69-L215 HydrophobicContact CG-CD2 4.08Å; L69-L215 HydrophobicContact CG-CG 4.4Å
70V90.9Very high88.7Confident0 Ų060.4 Ų60.40%029%0.293CS..Hα-helixtrans-76-52.5174.1173.10000111W60 L66 G67 R68 D72 M73 I75 I81 I93 F96 F97W60-V70 HydrophobicContact CH2-CB 4.27Å; W60-V70 HydrophobicContact CH2-CG1 4.03Å; W60-V70 HydrophobicContact CZ3-CG1 4.35Å; L66-V70 WeakPolarHBondContact O-CG2 3.48Å; L66-V70 PolarHBondContact O-N 3.25Å; G67-V70 PolarHBondContact O-N 2.95Å; R68-V70 PolarHBondContact O-N 3.4Å; V70-D72 VanDerWaalsContact C-N 3.28Å; V70-D72 PolarHBondContact O-N 2.65Å; V70-M73 PolarHBondContact O-N 2.85Å; V70-I75 HydrophobicContact CG2-CB 4.29Å; V70-I75 HydrophobicContact CG2-CD1 4.38Å; V70-I81 HydrophobicContact CG2-CD1 4.13Å; V70-I93 HydrophobicContact CG1-CG2 4.42Å; V70-I93 HydrophobicContact CG2-CG2 4.09Å; V70-F96 HydrophobicContact CG1-CB 4.23Å; V70-F96 HydrophobicContact CG1-CD1 3.5Å; V70-F96 HydrophobicContact CG1-CE1 4.08Å; V70-F96 HydrophobicContact CG1-CG 3.97Å; V70-F97 HydrophobicContact CB-CE2 4.37Å; V70-F97 HydrophobicContact CG1-CD2 4.38Å; V70-F97 HydrophobicContact CG1-CE2 3.62Å; V70-F97 HydrophobicContact CG1-CZ 3.84Å; V70-F97 HydrophobicContact CG2-CE2 3.79Å; V70-F97 HydrophobicContact CG2-CZ 4.07Å
71K88.9Confident88.8Confident65 Ų6558.4 Ų58.428%0.28329%0.285SS..Hα-helixtrans-59.4-38.2178.1-175.3174.2-179.21790112.5E59 W60 P62 G67 R68 M73E59-K71 IonicContact OE1-NZ 2.67Å; E59-K71 PolarHBondContact OE1-NZ 3.17Å; W60-K71 HydrophobicContact CZ3-CB 4.2Å; W60-K71 WeakPolarHBondContact O-CD 3.43Å; W60-K71 WeakPolarHBondContact O-CE 3.36Å; W60-K71 PolarHBondContact O-NZ 2.64Å; P62-K71 HydrophobicContact CG-CB 4.07Å; P62-K71 HydrophobicContact CG-CD 4.03Å; G67-K71 WeakPolarHBondContact O-CB 3.06Å; G67-K71 PolarHBondContact O-N 3.02Å; R68-K71 PolarHBondContact O-N 3.37Å; K71-M73 PolarHBondContact O-N 3.19Å
72D89.3Confident88.9Confident61 Ų6158.1 Ų58.133%0.32628%0.277SS..THydrogen-bonded Turntrans-82.712.5179.7-55.7-30.7000112.8R68 V70 K74 H214R68-D72 WeakPolarHBondContact O-CB 3.41Å; R68-D72 PolarHBondContact O-N 3.19Å; R68-D72 VanDerWaalsContact O-OD2 3.08Å; V70-D72 VanDerWaalsContact C-N 3.28Å; V70-D72 PolarHBondContact O-N 2.65Å; D72-K74 HydrophobicContact CB-CG 4.36Å; D72-K74 PolarHBondContact O-N 3.12Å; D72-K74 VanDerWaalsContact O-N 3.16Å; D72-H214 IonicContact OD2-CE1 3.24Å; D72-H214 PolarHBondContact OD2-CE1 2.99Å; D72-H214 VanDerWaalsContact OD2-CE1 3.24Å
73M88.8Confident88.9Confident141 Ų14163.1 Ų63.170%0.69530%0.303SS*.THydrogen-bonded Turntrans51.634.4177.8-63.5-173.4-76.100114.8V70 K71 F96V70-M73 PolarHBondContact O-N 2.85Å; K71-M73 PolarHBondContact O-N 3.19Å; M73-F96 HydrophobicContact CG-CZ 4.15Å
74K88.6Confident89Confident78 Ų7860.8 Ų60.834%0.33928%0.284SS..  trans-84.6-40.1175-59-54.3-178.1-170.10112.1L69 D72 F211 H214L69-K74 HydrophobicContact CB-CB 4.32Å; L69-K74 HydrophobicContact CD2-CB 3.97Å; L69-K74 HydrophobicContact CD2-CG 4.05Å; L69-K74 WeakPolarHBondContact O-CA 3.43Å; L69-K74 WeakPolarHBondContact O-CB 3.47Å; L69-K74 PolarHBondContact O-N 3.37Å; D72-K74 HydrophobicContact CB-CG 4.36Å; D72-K74 PolarHBondContact O-N 3.12Å; D72-K74 VanDerWaalsContact O-N 3.16Å; K74-F211 HydrophobicContact CB-CD1 4.2Å; K74-F211 HydrophobicContact CB-CD2 3.85Å; K74-F211 HydrophobicContact CB-CE1 4.13Å; K74-F211 HydrophobicContact CB-CE2 3.78Å; K74-F211 HydrophobicContact CB-CG 4.08Å; K74-F211 HydrophobicContact CB-CZ 3.93Å; K74-F211 HydrophobicContact CD-CD1 4.29Å; K74-F211 HydrophobicContact CD-CE1 4.22Å; K74-F211 HydrophobicContact CG-CD1 4.32Å; K74-F211 HydrophobicContact CG-CG 4.42Å; K74-H214 WeakPolarHBondContact CE-NE2 3.21Å
75I89.6Confident89Confident1 Ų164.2 Ų64.21%0.00531%0.309CS..  trans-91.8122.5170.2-65.8170.7000107.3L66 L69 V70 S77 E80 I81 F97 P207L66-I75 HydrophobicContact CD1-CD1 3.83Å; L69-I75 HydrophobicContact CB-CD1 3.75Å; L69-I75 HydrophobicContact CB-CG1 4.05Å; L69-I75 HydrophobicContact CD1-CD1 4.2Å; L69-I75 PolarHBondContact O-N 3.35Å; L69-I75 VanDerWaalsContact O-N 3.15Å; V70-I75 HydrophobicContact CG2-CB 4.29Å; V70-I75 HydrophobicContact CG2-CD1 4.38Å; I75-S77 VanDerWaalsContact CG2-O 3.29Å; I75-S77 WeakPolarHBondContact CG2-O 3.37Å; I75-E80 WeakPolarHBondContact CA-OE2 3.43Å; I75-E80 HydrophobicContact CG2-CB 4.16Å; I75-I81 HydrophobicContact CD1-CG1 4.47Å; I75-I81 HydrophobicContact CG2-CD1 4.15Å; I75-I81 HydrophobicContact CG2-CG1 3.84Å; I75-F97 HydrophobicContact CG2-CZ 4.06Å; I75-P207 HydrophobicContact CD1-CB 3.99Å; I75-P207 HydrophobicContact CD1-CG 4.42Å; I75-P207 HydrophobicContact CG1-CB 4.04Å; I75-P207 HydrophobicContact CG1-CG 4.41Å
76K86.9Confident89Confident175 Ų17560.8 Ų60.876%0.76130%0.295SS*.  trans-96.6-21.8-173.3-65.7178-176.4173.20113.2E80 F97K76-E80 PolarHBondContact N-OE1 2.86Å; K76-E80 PolarHBondContact N-OE2 3.18Å; K76-F97 WeakPolarHBondContact O-CE1 3.37Å
77S88.5Confident89Confident31 Ų3164.8 Ų64.822%0.21732%0.321CS..  trans-135.7152.1-17667.60000112.3I75 E79 E80I75-S77 VanDerWaalsContact CG2-O 3.29Å; I75-S77 WeakPolarHBondContact CG2-O 3.37Å; S77-E79 PolarHBondContact O-N 3.48Å; S77-E80 WeakPolarHBondContact CB-OE1 3.04Å; S77-E80 PolarHBondContact N-OE1 3.16Å; S77-E80 VanDerWaalsContact OG-CD 3.26Å; S77-E80 VanDerWaalsContact OG-CG 3.29Å; S77-E80 WeakPolarHBondContact OG-CG 3.47Å; S77-E80 PolarHBondContact OG-N 3.43Å; S77-E80 PolarHBondContact OG-OE1 3.26Å
78L87.7Confident89.1Confident20 Ų2067.2 Ų67.211%0.10533%0.333CS..Hα-helixtrans-67.9-23.5168.1-171.560.2000111.6I81 Y82 I88 F97 L98L78-I81 HydrophobicContact CD1-CB 4.49Å; L78-I81 HydrophobicContact CD1-CD1 4.16Å; L78-I81 WeakPolarHBondContact O-CB 3.43Å; L78-I81 PolarHBondContact O-N 3.04Å; L78-Y82 HydrophobicContact CD1-CE1 4.31Å; L78-Y82 HydrophobicContact CD2-CE2 3.93Å; L78-Y82 WeakPolarHBondContact CD2-OH 3.4Å; L78-Y82 HydrophobicContact CG-CD2 4.31Å; L78-Y82 HydrophobicContact CG-CE1 4.29Å; L78-Y82 HydrophobicContact CG-CE2 3.7Å; L78-Y82 PolarHBondContact O-N 3.26Å; L78-Y82 VanDerWaalsContact O-N 3.12Å; L78-I88 HydrophobicContact CD1-CD1 3.78Å; L78-F97 HydrophobicContact CB-CD2 4.36Å; L78-F97 HydrophobicContact CB-CG 4.46Å; L78-F97 HydrophobicContact CD1-CD2 4.37Å; L78-L98 HydrophobicContact CD2-CD1 3.73Å; L78-L98 HydrophobicContact CD2-CG 4.31Å
79E85.8Confident89.1Confident154 Ų15473.6 Ų73.672%0.7236%0.362SS*.Hα-helixtrans-64.4-40.5177.3-60.1-179.6175.700112.1S77 I81 Y82 L83S77-E79 PolarHBondContact O-N 3.48Å; E79-I81 VanDerWaalsContact C-N 3.27Å; E79-I81 PolarHBondContact O-N 3.42Å; E79-Y82 PolarHBondContact O-N 2.98Å; E79-L83 WeakPolarHBondContact O-CB 3.45Å; E79-L83 PolarHBondContact O-N 3.27Å
80E87.4Confident89Confident58 Ų5874.3 Ų74.327%0.27137%0.365SS..Hα-helixtrans-56.6-40.1171.3-74.7152.7-118.200111.9I75 K76 S77 F84I75-E80 WeakPolarHBondContact CA-OE2 3.43Å; I75-E80 HydrophobicContact CG2-CB 4.16Å; K76-E80 PolarHBondContact N-OE1 2.86Å; K76-E80 PolarHBondContact N-OE2 3.18Å; S77-E80 WeakPolarHBondContact CB-OE1 3.04Å; S77-E80 PolarHBondContact N-OE1 3.16Å; S77-E80 VanDerWaalsContact OG-CD 3.26Å; S77-E80 VanDerWaalsContact OG-CG 3.29Å; S77-E80 WeakPolarHBondContact OG-CG 3.47Å; S77-E80 PolarHBondContact OG-N 3.43Å; S77-E80 PolarHBondContact OG-OE1 3.26Å; E80-F84 WeakPolarHBondContact O-CD2 3.47Å; E80-F84 PolarHBondContact O-N 3.15Å
81I89.9Confident88.8Confident0 Ų078 Ų780%039%0.391CS..Hα-helixtrans-67.6-40.4179.3-55.8-176.2000110.4L66 V70 I75 L78 E79 S85 L86 I88 I93 F97L66-I81 HydrophobicContact CD1-CD1 4.21Å; L66-I81 HydrophobicContact CD1-CG1 4.28Å; L66-I81 HydrophobicContact CD1-CG2 4.32Å; L66-I81 HydrophobicContact CD2-CD1 4.48Å; L66-I81 HydrophobicContact CD2-CG2 4.19Å; L66-I81 HydrophobicContact CG-CD1 4.47Å; V70-I81 HydrophobicContact CG2-CD1 4.13Å; I75-I81 HydrophobicContact CD1-CG1 4.47Å; I75-I81 HydrophobicContact CG2-CD1 4.15Å; I75-I81 HydrophobicContact CG2-CG1 3.84Å; L78-I81 HydrophobicContact CD1-CB 4.49Å; L78-I81 HydrophobicContact CD1-CD1 4.16Å; L78-I81 WeakPolarHBondContact O-CB 3.43Å; L78-I81 PolarHBondContact O-N 3.04Å; E79-I81 VanDerWaalsContact C-N 3.27Å; E79-I81 PolarHBondContact O-N 3.42Å; I81-S85 PolarHBondContact O-N 3.21Å; I81-L86 HydrophobicContact CG2-CB 3.97Å; I81-L86 PolarHBondContact O-N 3.3Å; I81-I88 HydrophobicContact CG2-CD1 4.18Å; I81-I88 HydrophobicContact CG2-CG1 3.93Å; I81-I93 HydrophobicContact CD1-CG2 4.11Å; I81-F97 HydrophobicContact CD1-CE2 3.94Å
82Y88.1Confident88.9Confident145 Ų14578.4 Ų78.457%0.56939%0.394SS*.Hα-helixtrans-71.6-38.7177.9-65.4-27.2000113.2L78 E79 F84 S85 I88L78-Y82 HydrophobicContact CD1-CE1 4.31Å; L78-Y82 HydrophobicContact CD2-CE2 3.93Å; L78-Y82 WeakPolarHBondContact CD2-OH 3.4Å; L78-Y82 HydrophobicContact CG-CD2 4.31Å; L78-Y82 HydrophobicContact CG-CE1 4.29Å; L78-Y82 HydrophobicContact CG-CE2 3.7Å; L78-Y82 PolarHBondContact O-N 3.26Å; L78-Y82 VanDerWaalsContact O-N 3.12Å; E79-Y82 PolarHBondContact O-N 2.98Å; Y82-F84 VanDerWaalsContact C-N 3.27Å; Y82-F84 PolarHBondContact O-N 2.98Å; Y82-S85 PolarHBondContact O-N 3.03Å; Y82-I88 HydrophobicContact CE1-CD1 4.37Å
83L88.6Confident88.9Confident122 Ų12275.5 Ų75.564%0.63938%0.379SS*.Hα-helixtrans-55.7-43.1177.3-178.864.4000111.8E79E79-L83 WeakPolarHBondContact O-CB 3.45Å; E79-L83 PolarHBondContact O-N 3.27Å
84F89.3Confident88.8Confident59 Ų5971.6 Ų71.626%0.25936%0.36SS..THydrogen-bonded Turntrans-91.38.6177.7-66.2-74.9000114E80 Y82 L86 T204 K205 P207E80-F84 WeakPolarHBondContact O-CD2 3.47Å; E80-F84 PolarHBondContact O-N 3.15Å; Y82-F84 VanDerWaalsContact C-N 3.27Å; Y82-F84 PolarHBondContact O-N 2.98Å; F84-L86 HydrophobicContact CB-CD1 4.28Å; F84-L86 HydrophobicContact CB-CD2 4.14Å; F84-L86 HydrophobicContact CB-CG 3.84Å; F84-L86 PolarHBondContact O-N 3.38Å; F84-T204 WeakPolarHBondContact CZ-OG1 3.45Å; F84-K205 WeakPolarHBondContact CZ-O 3.3Å; F84-P207 HydrophobicContact CD2-CG 4.14Å; F84-P207 HydrophobicContact CE2-CG 4.39Å
85S89.9Confident88.7Confident106 Ų10672 Ų7274%0.74137%0.366SS*.THydrogen-bonded Turntrans50.937.8179.3-63.70000114I81 Y82I81-S85 PolarHBondContact O-N 3.21Å; Y82-S85 PolarHBondContact O-N 3.03Å
86L89.3Confident88.5Confident26 Ų2676.7 Ų76.714%0.13639%0.386CS..  trans-77.9131-173.9-60.1-177.2000111.4L66 I81 F84 I88 Y208L66-L86 HydrophobicContact CD1-CB 4.32Å; L66-L86 HydrophobicContact CD1-CD1 3.88Å; I81-L86 HydrophobicContact CG2-CB 3.97Å; I81-L86 PolarHBondContact O-N 3.3Å; F84-L86 HydrophobicContact CB-CD1 4.28Å; F84-L86 HydrophobicContact CB-CD2 4.14Å; F84-L86 HydrophobicContact CB-CG 3.84Å; F84-L86 PolarHBondContact O-N 3.38Å; L86-I88 PolarHBondContact O-N 3.11Å; L86-Y208 HydrophobicContact CD1-CE2 4.09Å; L86-Y208 HydrophobicContact CD2-CD2 4.16Å; L86-Y208 HydrophobicContact CD2-CE2 3.67Å; L86-Y208 HydrophobicContact CG-CE2 4.46Å
87P90.4Very high88.5Confident85 Ų8570.5 Ų70.555%0.55236%0.36SS*.  trans-75114.1-176.828.7-34.3000111.8
88I92.3Very high88.2Confident51 Ų5171.9 Ų71.926%0.26236%0.364SS..  trans-72.8126.4171.3-56.2174.4000108.9L66 L78 I81 Y82 L86 E90 I93 I94L66-I88 HydrophobicContact CD2-CG1 4.12Å; L78-I88 HydrophobicContact CD1-CD1 3.78Å; I81-I88 HydrophobicContact CG2-CD1 4.18Å; I81-I88 HydrophobicContact CG2-CG1 3.93Å; Y82-I88 HydrophobicContact CE1-CD1 4.37Å; L86-I88 PolarHBondContact O-N 3.11Å; I88-E90 WeakPolarHBondContact CG2-O 3.43Å; I88-I93 HydrophobicContact CG2-CB 4.19Å; I88-I93 HydrophobicContact CG2-CD1 4.33Å; I88-I93 HydrophobicContact CG2-CG2 4.28Å; I88-I94 HydrophobicContact CD1-CG1 4.37Å; I88-I94 HydrophobicContact CG2-CD1 4.33Å; I88-I94 HydrophobicContact CG2-CG1 4.18Å
89K90.6Very high87.5Confident167 Ų16772.9 Ų72.973%0.72638%0.379SS*.  trans-125.4-8.2-178.3-63.2-174.2-179.2-176.20114.4T64T64-K89 HydrophobicContact CG2-CB 4.43Å
90E88.8Confident87Confident15 Ų1571 Ų717%0.0739%0.39CS..  trans-117.5127.6177.9-68.5170.8-136.600106W60 P62 V63 T64 I88 E92 I93W60-E90 WeakPolarHBondContact CZ2-OE2 3.2Å; W60-E90 PolarHBondContact NE1-OE2 3.15Å; P62-E90 VanDerWaalsContact CA-OE2 3.28Å; P62-E90 WeakPolarHBondContact CA-OE2 3.45Å; P62-E90 WeakPolarHBondContact CB-OE2 3.43Å; V63-E90 HydrophobicContact CG2-CG 4.32Å; V63-E90 WeakPolarHBondContact CG2-OE1 3.29Å; V63-E90 PolarHBondContact N-OE1 3.45Å; T64-E90 WeakPolarHBondContact CB-OE1 3.37Å; T64-E90 WeakPolarHBondContact CG2-OE1 3.41Å; T64-E90 PolarHBondContact N-OE1 3.13Å; T64-E90 PolarHBondContact OG1-OE1 3.24Å; I88-E90 WeakPolarHBondContact CG2-O 3.43Å; E90-E92 VanDerWaalsContact C-N 3.26Å; E90-I93 HydrophobicContact CB-CD1 3.95Å; E90-I93 HydrophobicContact CB-CG1 4.07Å
91S86.9Confident86.5Confident77 Ų7771.9 Ų71.954%0.53840%0.403SS..THydrogen-bonded Turntrans-70.4-30.4-179.444.40000111.4I93 I94 D95S91-I93 PolarHBondContact O-N 3.24Å; S91-I93 VanDerWaalsContact O-N 3.09Å; S91-I94 WeakPolarHBondContact O-CA 3.29Å; S91-I94 WeakPolarHBondContact O-CB 3.41Å; S91-I94 PolarHBondContact O-N 3.01Å; S91-D95 PolarHBondContact O-N 3.21Å; S91-D95 VanDerWaalsContact O-N 3.11Å
92E89.7Confident85.9Confident75 Ų7576 Ų7635%0.3543%0.425SS..Hα-helixtrans-59.2-23.7179.8-56.294.3144.400112.5W60 E90 D95 F96W60-E92 HydrophobicContact CB-CB 4.4Å; W60-E92 HydrophobicContact CB-CG 4.36Å; W60-E92 HydrophobicContact CD2-CB 3.43Å; W60-E92 VanDerWaalsContact CD2-CB 3.43Å; W60-E92 HydrophobicContact CD2-CG 4.22Å; W60-E92 VanDerWaalsContact CE2-CB 3.48Å; W60-E92 HydrophobicContact CE3-CB 3.92Å; W60-E92 HydrophobicContact CG-CB 3.63Å; W60-E92 HydrophobicContact CG-CG 3.86Å; W60-E92 HydrophobicContact CH2-CB 4.46Å; W60-E92 HydrophobicContact CZ2-CB 4.03Å; W60-E92 HydrophobicContact CZ3-CB 4.4Å; E90-E92 VanDerWaalsContact C-N 3.26Å; E92-D95 PolarHBondContact O-N 2.8Å; E92-F96 WeakPolarHBondContact O-CB 3.47Å; E92-F96 PolarHBondContact O-N 3.17Å
93I89.1Confident85.2Confident0 Ų077.7 Ų77.70%044%0.435CS..Hα-helixtrans-63.4-41.5170.7-66.4173.3000111.2W60 L66 V70 I81 I88 E90 S91 F97W60-I93 HydrophobicContact CH2-CB 4.42Å; W60-I93 HydrophobicContact CH2-CG1 3.64Å; W60-I93 HydrophobicContact CZ2-CG1 3.59Å; L66-I93 HydrophobicContact CB-CD1 4.3Å; L66-I93 HydrophobicContact CD2-CD1 3.84Å; L66-I93 HydrophobicContact CG-CD1 4.03Å; V70-I93 HydrophobicContact CG1-CG2 4.42Å; V70-I93 HydrophobicContact CG2-CG2 4.09Å; I81-I93 HydrophobicContact CD1-CG2 4.11Å; I88-I93 HydrophobicContact CG2-CB 4.19Å; I88-I93 HydrophobicContact CG2-CD1 4.33Å; I88-I93 HydrophobicContact CG2-CG2 4.28Å; E90-I93 HydrophobicContact CB-CD1 3.95Å; E90-I93 HydrophobicContact CB-CG1 4.07Å; S91-I93 PolarHBondContact O-N 3.24Å; S91-I93 VanDerWaalsContact O-N 3.09Å; I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 HydrophobicContact CG2-CE2 4.29Å; I93-F97 WeakPolarHBondContact O-CD2 3.21Å; I93-F97 PolarHBondContact O-N 3.36Å
94I87.1Confident84.3Confident58 Ų5879.9 Ų79.930%0.29745%0.447SS..Hα-helixtrans-74-40.5178.6-58.1177.2000109.3I88 S91 F96 F97 L98 L102I88-I94 HydrophobicContact CD1-CG1 4.37Å; I88-I94 HydrophobicContact CG2-CD1 4.33Å; I88-I94 HydrophobicContact CG2-CG1 4.18Å; S91-I94 WeakPolarHBondContact O-CA 3.29Å; S91-I94 WeakPolarHBondContact O-CB 3.41Å; S91-I94 PolarHBondContact O-N 3.01Å; I94-F96 VanDerWaalsContact C-N 3.29Å; I94-F96 PolarHBondContact O-N 2.85Å; I94-F97 PolarHBondContact O-N 3.38Å; I94-L98 HydrophobicContact CG2-CD1 4.32Å; I94-L98 PolarHBondContact O-N 3.5Å; I94-L102 HydrophobicContact CG2-CD1 3.89Å
95D86.6Confident83.1Confident88 Ų8881.3 Ų81.347%0.47146%0.455SS..Hα-helixtrans-62.4-36.7177.3-56.8-36.5000111.8S91 E92 G99S91-D95 PolarHBondContact O-N 3.21Å; S91-D95 VanDerWaalsContact O-N 3.11Å; E92-D95 PolarHBondContact O-N 2.8Å; D95-G99 WeakPolarHBondContact O-CA 3.42Å; D95-G99 PolarHBondContact O-N 3.29Å
96F86.6Confident81.9Confident98 Ų9882.2 Ų82.243%0.4346%0.455SS..Hα-helixtrans-62.5-43.4175.2-178.1-95.7000113.1W60 V70 M73 E92 I94W60-F96 HydrophobicContact CZ3-CB 4.25Å; V70-F96 HydrophobicContact CG1-CB 4.23Å; V70-F96 HydrophobicContact CG1-CD1 3.5Å; V70-F96 HydrophobicContact CG1-CE1 4.08Å; V70-F96 HydrophobicContact CG1-CG 3.97Å; M73-F96 HydrophobicContact CG-CZ 4.15Å; E92-F96 WeakPolarHBondContact O-CB 3.47Å; E92-F96 PolarHBondContact O-N 3.17Å; I94-F96 VanDerWaalsContact C-N 3.29Å; I94-F96 PolarHBondContact O-N 2.85Å
97F85.4Confident80.6Confident45 Ų4583 Ų8320%0.19746%0.459CS..Hα-helixtrans-84.7-35-178.4-71.8-61.3000114V70 I75 K76 L78 I81 I93 I94V70-F97 HydrophobicContact CB-CE2 4.37Å; V70-F97 HydrophobicContact CG1-CD2 4.38Å; V70-F97 HydrophobicContact CG1-CE2 3.62Å; V70-F97 HydrophobicContact CG1-CZ 3.84Å; V70-F97 HydrophobicContact CG2-CE2 3.79Å; V70-F97 HydrophobicContact CG2-CZ 4.07Å; I75-F97 HydrophobicContact CG2-CZ 4.06Å; K76-F97 WeakPolarHBondContact O-CE1 3.37Å; L78-F97 HydrophobicContact CB-CD2 4.36Å; L78-F97 HydrophobicContact CB-CG 4.46Å; L78-F97 HydrophobicContact CD1-CD2 4.37Å; I81-F97 HydrophobicContact CD1-CE2 3.94Å; I93-F97 HydrophobicContact CG2-CD2 4.39Å; I93-F97 HydrophobicContact CG2-CE2 4.29Å; I93-F97 WeakPolarHBondContact O-CD2 3.21Å; I93-F97 PolarHBondContact O-N 3.36Å; I94-F97 PolarHBondContact O-N 3.38Å
98L83.3Confident78.6Confident60 Ų6087 Ų8731%0.31447%0.468SS..Hα-helixtrans-126.1-4.9-167.7-60.1179.1000114.2L78 I94 A100 S101 L102L78-L98 HydrophobicContact CD2-CD1 3.73Å; L78-L98 HydrophobicContact CD2-CG 4.31Å; I94-L98 HydrophobicContact CG2-CD1 4.32Å; I94-L98 PolarHBondContact O-N 3.5Å; L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 2.84Å; L98-A100 VanDerWaalsContact O-N 3.11Å; L98-S101 WeakPolarHBondContact O-CA 3.4Å; L98-S101 PolarHBondContact O-N 3.39Å; L98-S101 PolarHBondContact O-OG 3.49Å; L98-L102 HydrophobicContact CB-CD1 3.89Å; L98-L102 HydrophobicContact CB-CD2 4.25Å; L98-L102 HydrophobicContact CB-CG 3.78Å; L98-L102 HydrophobicContact CD1-CD2 4.32Å; L98-L102 PolarHBondContact O-N 3.14Å
99G73.3Confident75.9Confident41 Ų4191.6 Ų91.642%0.42349%0.491SS..THydrogen-bonded Turntrans-55.7-35.7-164.600000116.1D95 S101D95-G99 WeakPolarHBondContact O-CA 3.42Å; D95-G99 PolarHBondContact O-N 3.29Å; G99-S101 VanDerWaalsContact C-N 3.33Å
100A73.9Confident73Confident114 Ų11491.5 Ų91.594%0.94250%0.496SS*.THydrogen-bonded Turntrans-78.4-14.6175.800000114.3L98L98-A100 VanDerWaalsContact C-N 3.32Å; L98-A100 PolarHBondContact O-N 2.84Å; L98-A100 VanDerWaalsContact O-N 3.11Å
101S76.8Confident70.2Confident77 Ų7795.8 Ų95.854%0.53853%0.525SS..THydrogen-bonded Turntrans-105.9-19.7-174.571.40000114.1L98 G99L98-S101 WeakPolarHBondContact O-CA 3.4Å; L98-S101 PolarHBondContact O-N 3.39Å; L98-S101 PolarHBondContact O-OG 3.49Å; G99-S101 VanDerWaalsContact C-N 3.33Å
102L77.4Confident67.4Low88 Ų8898.5 Ų98.546%0.46154%0.538SS..  trans-70.1141.3179.5-72172.8000111.7I94 L98I94-L102 HydrophobicContact CG2-CD1 3.89Å; L98-L102 HydrophobicContact CB-CD1 3.89Å; L98-L102 HydrophobicContact CB-CD2 4.25Å; L98-L102 HydrophobicContact CB-CG 3.78Å; L98-L102 HydrophobicContact CD1-CD2 4.32Å; L98-L102 PolarHBondContact O-N 3.14Å
103K73.5Confident64.8Low180 Ų180103.7 Ų103.778%0.78356%0.562SS**  trans-123.7111.1176.2-66.7177.2-1771720108.6
104D70.6Confident62.2Low168 Ų168112.2 Ų112.290%0.89860%0.599SS**  trans-80.7125.5175.6-75-29.9000111.3
105E65.1Low60Low89 Ų89117.8 Ų117.842%0.41662%0.624SS.*  trans-126.8116.2172.6-162.6-176-17600112.1L107 K154 M158E105-L107 PolarHBondContact O-N 3.32Å; E105-K154 HydrophobicContact CG-CD 4.42Å; E105-K154 WeakPolarHBondContact OE1-CD 3.41Å; E105-K154 WeakPolarHBondContact OE1-CE 3.35Å; E105-K154 IonicContact OE1-NZ 2.64Å; E105-K154 PolarHBondContact OE1-NZ 3.35Å; E105-K154 VanDerWaalsContact OE2-CD 3.3Å; E105-K154 WeakPolarHBondContact OE2-CD 3.48Å; E105-K154 VanDerWaalsContact OE2-CG 3.27Å; E105-K154 WeakPolarHBondContact OE2-CG 3.35Å; E105-M158 HydrophobicContact CB-SD 4.25Å
106V64.6Low57.7Low124 Ų124116.9 Ų116.975%0.75262%0.622SS**  trans-71.4113.4175.5-178.40000109.6K108V106-K108 PolarHBondContact O-N 2.89Å
107L60.1Low55.5Low42 Ų42123.4 Ų123.422%0.2264%0.643CS.*  trans-63.2-10.5-172.4-66.6174.4000115.6E105 I109 K154 L155 M158 L175 A179E105-L107 PolarHBondContact O-N 3.32Å; L107-I109 PolarHBondContact O-N 2.83Å; L107-K154 HydrophobicContact CD2-CB 3.94Å; L107-K154 HydrophobicContact CD2-CD 3.97Å; L107-L155 HydrophobicContact CD1-CD2 4.4Å; L107-M158 HydrophobicContact CD2-CE 4.44Å; L107-L175 HydrophobicContact CB-CD2 4.42Å; L107-A179 HydrophobicContact CD1-CB 4.17Å
108K48.8Very low53.5Low171 Ų171124 Ų12474%0.74366%0.656SS**  trans-92.498.3-177.9-171.9-178.2-179-177.90112V106V106-K108 PolarHBondContact O-N 2.89Å
109I35.8Very low51.2Low146 Ų146121.1 Ų121.175%0.74964%0.641SS**  trans-169.9146.9140.5-93145.3000108.1L107L107-I109 PolarHBondContact O-N 2.83Å
110M29.3Very low49.7Very low165 Ų165122.1 Ų122.181%0.81364%0.635SS**  trans-118.7169.5-179.9-59.5172.46700109.5
111P30.2Very low48.1Very low105 Ų105124 Ų12468%0.68262%0.618SS**  cis-127.3150.5-2835.8-21.2000112.9
112V29.4Very low46.7Very low134 Ų134124.8 Ų124.881%0.81262%0.62SS**  trans-145.9145.1169178.80000112.3
113Q33.5Very low45.4Very low185 Ų185128.8 Ų128.886%0.86463%0.629SS**  trans-97146.5173.5-56.6170.7-4.200111.5
114K35.1Very low44.9Very low179 Ų179124.3 Ų124.378%0.77861%0.609SS**  trans-163.7141.8151.2-152.1174.7176.31760114.5
115Q41.3Very low45.1Very low174 Ų174122.4 Ų122.481%0.81359%0.593SS**  trans-79.1144.9168.8-171102.6-31.900112.2
116T38.9Very low46.1Very low69 Ų69118.8 Ų118.842%0.42358%0.577SS.*  trans-146.1165.6166.843.90000111.6T144T116-T144 CarbonylContact C-O 2.88Å; T116-T144 WeakPolarHBondContact CB-O 3.44Å; T116-T144 PolarHBondContact OG1-O 2.87Å
117R40.4Very low47.3Very low235 Ų235116.2 Ų116.289%0.88756%0.562SS**  trans-127.5113.8-159.1-138.1-174.2-167.4-163.24.1113.8G143 T144R117-G143 CarbonylContact C-O 3.31Å; R117-T144 PolarHBondContact N-O 3.11Å
118A42.9Very low48.8Very low57 Ų57114.3 Ų114.347%0.47155%0.552SS.*  trans71.693.7157.600000121.2R142 G143 T144A118-R142 CarbonylContact O-C 3.5Å; A118-G143 CarbonylContact C-O 3.5Å; A118-G143 CarbonylContact O-C 3.59Å; A118-G143 WeakPolarHBondContact O-CA 3.47Å; A118-G143 PolarHBondContact O-N 3.28Å; A118-G143 VanDerWaalsContact O-N 3.12Å; A118-T144 VanDerWaalsContact C-CA 3.44Å; A118-T144 PolarHBondContact O-N 2.96Å
119G35.3Very low50.9Low0 Ų0114.4 Ų114.40%055%0.547CS..  trans133.9177.4165.400000128.3A140 P141 T144 D163G119-A140 VanDerWaalsContact C-CB 3.43Å; G119-A140 WeakPolarHBondContact O-CB 3.15Å; G119-P141 VanDerWaalsContact CA-CA 3.45Å; G119-T144 WeakPolarHBondContact CA-OG1 3.41Å; G119-T144 PolarHBondContact N-OG1 3.46Å; G119-T144 WeakPolarHBondContact O-CA 3.21Å; G119-T144 WeakPolarHBondContact O-CB 3.25Å; G119-T144 PolarHBondContact O-N 2.71Å; G119-T144 PolarHBondContact O-OG1 2.87Å; G119-D163 VanDerWaalsContact O-CB 3.23Å; G119-D163 WeakPolarHBondContact O-CB 3.04Å
120Q41Very low53.6Low62 Ų62108.8 Ų108.829%0.2952%0.521SS..  cis-133.1152.61.5-159-126.6-5300110.8T122 A140 P141 R142 D163Q120-T122 PolarHBondContact O-N 2.76Å; Q120-A140 CarbonylContact C-O 2.77Å; Q120-A140 WeakPolarHBondContact CA-O 2.89Å; Q120-A140 PolarHBondContact O-N 2.6Å; Q120-P141 WeakPolarHBondContact CA-O 3.37Å; Q120-R142 HydrophobicContact CB-CB 4.23Å; Q120-R142 HydrophobicContact CB-CG 4.45Å; Q120-R142 HydrophobicContact CG-CB 3.57Å; Q120-R142 HydrophobicContact CG-CG 3.76Å; Q120-D163 WeakPolarHBondContact CA-OD2 3.49Å; Q120-D163 HydrophobicContact CB-CB 4.03Å; Q120-D163 WeakPolarHBondContact CB-OD2 3.48Å; Q120-D163 PolarHBondContact N-OD2 3.37Å
121R39.5Very low56.5Low155 Ų155103.5 Ų103.559%0.58551%0.509SS*.  trans-92.686.1-162.9-165176.9176.5-179.8-0.8113.9R123 A140 P141R121-R123 HydrophobicContact CG-CG 4.45Å; R121-A140 WeakPolarHBondContact CA-O 3.42Å; R121-A140 VanDerWaalsContact CB-O 3.22Å; R121-A140 WeakPolarHBondContact CB-O 3.28Å; R121-A140 PolarHBondContact N-O 3.49Å; R121-P141 PolarHBondContact N-O 3.4Å
122T47.4Very low59.4Low93 Ų93102.2 Ų102.257%0.57150%0.502SS*.  trans-65.3162.7140.255.60000108.8Q120 P139Q120-T122 PolarHBondContact O-N 2.76Å; T122-P139 WeakPolarHBondContact O-CB 3.22Å; T122-P139 WeakPolarHBondContact O-CG 3.01Å; T122-P139 WeakPolarHBondContact OG1-CB 3.37Å
123R51.4Low62.5Low172 Ų17295.9 Ų95.965%0.64946%0.463SS*.  trans-108.7-6.3-171.6-64.8-171.2-164.1-115.90.4115.4R121R121-R123 HydrophobicContact CG-CG 4.45Å
124F61.6Low65.3Low86 Ų8690 Ų9038%0.37744%0.438SS..  trans-111.2128.6-165.7-51.3-65.3000111.9Y192 T194F124-Y192 AromaticContact CD1-CD1 3.94Å; F124-Y192 HydrophobicContact CD1-CD1 3.94Å; F124-Y192 AromaticContact CD1-CE1 3.96Å; F124-Y192 HydrophobicContact CD1-CE1 3.96Å; F124-Y192 HydrophobicContact CG-CD1 4.38Å; F124-T194 HydrophobicContact CD1-CG2 4.02Å; F124-T194 HydrophobicContact CD2-CG2 4.14Å; F124-T194 HydrophobicContact CE1-CG2 3.46Å; F124-T194 VanDerWaalsContact CE1-CG2 3.46Å; F124-T194 HydrophobicContact CE2-CG2 3.6Å; F124-T194 HydrophobicContact CG-CG2 4.34Å; F124-T194 HydrophobicContact CZ-CG2 3.23Å
125K76Confident68Low127 Ų12781.6 Ų81.655%0.55240%0.401SS*.  trans-92.6110.7174.5-62.8177-172.8170.60107.5L137 I138K125-L137 WeakPolarHBondContact CA-O 3.22Å; K125-I138 HydrophobicContact CD-CG2 4.49Å; K125-I138 HydrophobicContact CG-CG1 4.5Å; K125-I138 HydrophobicContact CG-CG2 4.28Å
126V85.6Confident70.2Confident13 Ų1378 Ų788%0.07938%0.381CS..EExtended strand (participates in β ladder)trans-107149.5-179.5-64.50000111.1R136 L137 A185 T189V126-R136 WeakPolarHBondContact O-CA 3.4Å; V126-L137 HydrophobicContact CG2-CB 3.74Å; V126-L137 HydrophobicContact CG2-CD1 3.9Å; V126-L137 HydrophobicContact CG2-CG 4.1Å; V126-L137 PolarHBondContact N-O 2.84Å; V126-L137 PolarHBondContact O-N 3.25Å; V126-A185 HydrophobicContact CG2-CB 4.38Å; V126-A185 VanDerWaalsContact CG2-O 3.28Å; V126-A185 WeakPolarHBondContact CG2-O 3.45Å; V126-T189 HydrophobicContact CG1-CG2 4.28Å; V126-T189 HydrophobicContact CG2-CG2 4.21Å
127T89.4Confident72.5Confident71 Ų7175.2 Ų75.244%0.43636%0.363SS..EExtended strand (participates in β ladder)trans-130.8120.6179.849.60000110.7L134 V135 R136T127-L134 HydrophobicContact CG2-CD2 4.42Å; T127-V135 CarbonylContact C-O 3.6Å; T127-V135 WeakPolarHBondContact CA-O 3.31Å; T127-R136 HydrophobicContact CG2-CB 3.93Å; T127-R136 HydrophobicContact CG2-CG 3.73Å
128G92Very high74.6Confident1 Ų165.9 Ų65.91%0.0133%0.33CS..EExtended strand (participates in β ladder)trans-106154.6170.200000111.9L134 V135 A181 D184G128-L134 WeakPolarHBondContact O-CA 3.28Å; G128-V135 PolarHBondContact N-O 3.19Å; G128-V135 PolarHBondContact O-N 3.2Å; G128-A181 CarbonylContact C-O 3.53Å; G128-A181 WeakPolarHBondContact CA-O 3.44Å; G128-D184 WeakPolarHBondContact CA-OD2 3.13Å
129R93.3Very high76.3Confident174 Ų17464.2 Ų64.266%0.65731%0.314SS*.EExtended strand (participates in β ladder)trans-141.3135-176.1-174.6179.7177.5177.90111.3G131 V133 D184R129-G131 PolarHBondContact NE-O 3.24Å; R129-V133 CarbonylContact C-O 2.98Å; R129-V133 WeakPolarHBondContact CA-O 3.19Å; R129-D184 PolarHBondContact N-OD2 3.44Å
130C91.4Very high78.3Confident28 Ų2864.6 Ų64.619%0.18932%0.317CS..EExtended strand (participates in β ladder)trans-140.4113.2169.3-166.50000109.5S132 V133 N177 K180 A181C130-S132 PolarHBondContact O-N 3.1Å; C130-V133 PolarHBondContact N-O 2.86Å; C130-V133 PolarHBondContact O-N 3.2Å; C130-N177 HydrophobicContact CB-CB 4.34Å; C130-N177 WeakPolarHBondContact CB-O 3.43Å; C130-K180 HydrophobicContact CB-CB 3.98Å; C130-A181 HydrophobicContact CB-CB 3.84Å
131G91.6Very high80Confident54 Ų5465.6 Ų65.656%0.55733%0.33SS*.THydrogen-bonded Turntrans59.3-123.3-173.200000112.4R129R129-G131 PolarHBondContact NE-O 3.24Å
132S91.3Very high81.6Confident78 Ų7867.3 Ų67.355%0.54534%0.336SS..THydrogen-bonded Turntrans-82.4-10.9175.261.50000113.9C130 G170C130-S132 PolarHBondContact O-N 3.1Å; S132-G170 WeakPolarHBondContact O-CA 3.18Å
133V93.2Very high82.8Confident0 Ų064.9 Ų64.90%033%0.329CS..EExtended strand (participates in β ladder)trans-89.9127.7-177.2-171.80000110.5R129 C130 V135 R169 C171 T172 N177 F178 A181R129-V133 CarbonylContact C-O 2.98Å; R129-V133 WeakPolarHBondContact CA-O 3.19Å; C130-V133 PolarHBondContact N-O 2.86Å; C130-V133 PolarHBondContact O-N 3.2Å; V133-V135 HydrophobicContact CG1-CG2 4.26Å; V133-R169 WeakPolarHBondContact CA-O 3.32Å; V133-C171 WeakPolarHBondContact CG2-O 3.35Å; V133-T172 HydrophobicContact CG1-CG2 4.23Å; V133-N177 HydrophobicContact CG2-CB 4.02Å; V133-F178 HydrophobicContact CG1-CB 4.42Å; V133-F178 HydrophobicContact CG1-CD2 3.9Å; V133-A181 HydrophobicContact CB-CB 4.43Å; V133-A181 HydrophobicContact CG1-CB 4.22Å
134L91.8Very high83.8Confident63 Ų6356.8 Ų56.833%0.3330%0.299SS..EExtended strand (participates in β ladder)trans-118.3129.9171.3-177.2155.2000108.6T127 G128 R136 A168 R169T127-L134 HydrophobicContact CG2-CD2 4.42Å; G128-L134 WeakPolarHBondContact O-CA 3.28Å; L134-R136 HydrophobicContact CD2-CB 4.37Å; L134-A168 CarbonylContact O-C 3.57Å; L134-A168 VanDerWaalsContact O-CA 3.3Å; L134-A168 WeakPolarHBondContact O-CA 3.2Å; L134-R169 PolarHBondContact N-O 3.23Å; L134-R169 PolarHBondContact O-N 3.36Å
135V91.7Very high84.5Confident1 Ų153.8 Ų53.81%0.00629%0.293CS..EExtended strand (participates in β ladder)trans-117.9123.9175.2-179.20000108.7T127 G128 V133 L137 F178 A181T127-V135 CarbonylContact C-O 3.6Å; T127-V135 WeakPolarHBondContact CA-O 3.31Å; G128-V135 PolarHBondContact N-O 3.19Å; G128-V135 PolarHBondContact O-N 3.2Å; V133-V135 HydrophobicContact CG1-CG2 4.26Å; V135-L137 HydrophobicContact CG1-CD2 4.16Å; V135-F178 HydrophobicContact CG2-CD2 3.67Å; V135-F178 HydrophobicContact CG2-CE2 3.71Å; V135-A181 HydrophobicContact CB-CB 4.38Å; V135-A181 HydrophobicContact CG2-CB 3.77Å
136R89.3Confident84.8Confident100 Ų10048.2 Ų48.238%0.37727%0.269SS..EExtended strand (participates in β ladder)trans-108.6122.1175.4-173.8179.7-167.7-164.115.8109.2V126 T127 L134 I138 T166 S167V126-R136 WeakPolarHBondContact O-CA 3.4Å; T127-R136 HydrophobicContact CG2-CB 3.93Å; T127-R136 HydrophobicContact CG2-CG 3.73Å; L134-R136 HydrophobicContact CD2-CB 4.37Å; R136-I138 HydrophobicContact CG-CD1 4.28Å; R136-I138 HydrophobicContact CG-CG1 3.89Å; R136-T166 WeakPolarHBondContact O-CA 3.23Å; R136-S167 PolarHBondContact N-O 2.83Å; R136-S167 PolarHBondContact O-N 2.92Å
137L86.4Confident84.8Confident9 Ų950.6 Ų50.65%0.04728%0.283CS..EExtended strand (participates in β ladder)trans-93.5132.8169.7-52.6-179.1000108.3K125 V126 V135 L156 T166 A185 I186K125-L137 WeakPolarHBondContact CA-O 3.22Å; V126-L137 HydrophobicContact CG2-CB 3.74Å; V126-L137 HydrophobicContact CG2-CD1 3.9Å; V126-L137 HydrophobicContact CG2-CG 4.1Å; V126-L137 PolarHBondContact N-O 2.84Å; V126-L137 PolarHBondContact O-N 3.25Å; V135-L137 HydrophobicContact CG1-CD2 4.16Å; L137-L156 HydrophobicContact CD1-CD2 3.92Å; L137-L156 HydrophobicContact CD2-CD1 4.09Å; L137-L156 HydrophobicContact CD2-CD2 4.08Å; L137-T166 HydrophobicContact CD2-CG2 3.77Å; L137-A185 HydrophobicContact CD1-CB 3.85Å; L137-A185 HydrophobicContact CG-CB 3.95Å; L137-I186 HydrophobicContact CD1-CG1 4.04Å
138I84.3Confident84.6Confident39 Ų3948.5 Ų48.520%0.227%0.271CS..EExtended strand (participates in β ladder)trans-132.3129.8-179.1-54.9177.2000107.8K125 R136 Y165K125-I138 HydrophobicContact CD-CG2 4.49Å; K125-I138 HydrophobicContact CG-CG1 4.5Å; K125-I138 HydrophobicContact CG-CG2 4.28Å; R136-I138 HydrophobicContact CG-CD1 4.28Å; R136-I138 HydrophobicContact CG-CG1 3.89Å; I138-Y165 PolarHBondContact N-O 3.04Å; I138-Y165 PolarHBondContact O-N 3.27Å
139P78.7Confident84.3Confident22 Ų2250.6 Ų50.614%0.14329%0.289CS..  trans-69.9166.4177.928.6-37.1000114.5T122T122-P139 WeakPolarHBondContact O-CB 3.22Å; T122-P139 WeakPolarHBondContact O-CG 3.01Å; T122-P139 WeakPolarHBondContact OG1-CB 3.37Å
140A77.1Confident84Confident8 Ų845.2 Ų45.27%0.06628%0.276CS..  trans-132.3-175.6-176.800000113.6G119 Q120 R121 T144 Y165G119-A140 VanDerWaalsContact C-CB 3.43Å; G119-A140 WeakPolarHBondContact O-CB 3.15Å; Q120-A140 CarbonylContact C-O 2.77Å; Q120-A140 WeakPolarHBondContact CA-O 2.89Å; Q120-A140 PolarHBondContact O-N 2.6Å; R121-A140 WeakPolarHBondContact CA-O 3.42Å; R121-A140 VanDerWaalsContact CB-O 3.22Å; R121-A140 WeakPolarHBondContact CB-O 3.28Å; R121-A140 PolarHBondContact N-O 3.49Å; A140-T144 VanDerWaalsContact CB-OG1 3.26Å; A140-T144 WeakPolarHBondContact CB-OG1 3.44Å; A140-Y165 HydrophobicContact CB-CD2 3.78Å; A140-Y165 HydrophobicContact CB-CE2 3.46Å; A140-Y165 VanDerWaalsContact CB-CE2 3.46Å
141P77.4Confident83.8Confident84 Ų8444.8 Ų44.855%0.54527%0.273SS..SBendtrans-64.7-88.4-177.5-24.937.3000125.8G119 Q120 R121G119-P141 VanDerWaalsContact CA-CA 3.45Å; Q120-P141 WeakPolarHBondContact CA-O 3.37Å; R121-P141 PolarHBondContact N-O 3.4Å
142R72.3Confident83.7Confident190 Ų19042.3 Ų42.372%0.71725%0.247SC*.SBendtrans-149.6103.4150.7175.2138.3-121.8-177.55.7118.5A118 Q120A118-R142 CarbonylContact O-C 3.5Å; Q120-R142 HydrophobicContact CB-CB 4.23Å; Q120-R142 HydrophobicContact CB-CG 4.45Å; Q120-R142 HydrophobicContact CG-CB 3.57Å; Q120-R142 HydrophobicContact CG-CG 3.76Å
143G72.9Confident83.6Confident42 Ų4240.8 Ų40.843%0.43323%0.23SC..SBendtrans99.834-166.800000123.2R117 A118 D163R117-G143 CarbonylContact C-O 3.31Å; A118-G143 CarbonylContact C-O 3.5Å; A118-G143 CarbonylContact O-C 3.59Å; A118-G143 WeakPolarHBondContact O-CA 3.47Å; A118-G143 PolarHBondContact O-N 3.28Å; A118-G143 VanDerWaalsContact O-N 3.12Å; G143-D163 WeakPolarHBondContact CA-OD2 3.48Å; G143-D163 PolarHBondContact N-OD2 2.91Å
144T73.1Confident83.3Confident3 Ų342.8 Ų42.82%0.01824%0.239CC..  trans-73.5-33.9-174.8-58.40000111.3T116 R117 A118 G119 A140 V147 D163 Y165T116-T144 CarbonylContact C-O 2.88Å; T116-T144 WeakPolarHBondContact CB-O 3.44Å; T116-T144 PolarHBondContact OG1-O 2.87Å; R117-T144 PolarHBondContact N-O 3.11Å; A118-T144 VanDerWaalsContact C-CA 3.44Å; A118-T144 PolarHBondContact O-N 2.96Å; G119-T144 WeakPolarHBondContact CA-OG1 3.41Å; G119-T144 PolarHBondContact N-OG1 3.46Å; G119-T144 WeakPolarHBondContact O-CA 3.21Å; G119-T144 WeakPolarHBondContact O-CB 3.25Å; G119-T144 PolarHBondContact O-N 2.71Å; G119-T144 PolarHBondContact O-OG1 2.87Å; A140-T144 VanDerWaalsContact CB-OG1 3.26Å; A140-T144 WeakPolarHBondContact CB-OG1 3.44Å; T144-V147 HydrophobicContact CG2-CG2 3.72Å; T144-D163 WeakPolarHBondContact CA-OD1 3.03Å; T144-D163 PolarHBondContact N-OD1 3.36Å; T144-Y165 HydrophobicContact CG2-CE1 4.17Å
145G76.3Confident83.1Confident23 Ų2341 Ų4124%0.23723%0.23CC..  trans72.8168.5-151.300000112.4V147 D162 D163G145-V147 PolarHBondContact O-N 3.25Å; G145-D162 CarbonylContact C-O 3.34Å; G145-D162 VanDerWaalsContact C-O 3.31Å; G145-D162 WeakPolarHBondContact CA-O 3.36Å; G145-D163 PolarHBondContact N-OD1 3.05Å
146I82.6Confident82.8Confident9 Ų941 Ų415%0.04623%0.23CC..EExtended strand (participates in β ladder)trans-79113.9179.4-56.6151.7000110.9S148 K153 L156 M157 I161 D162I146-S148 PolarHBondContact O-N 3.05Å; I146-K153 HydrophobicContact CB-CG 4.09Å; I146-K153 HydrophobicContact CD1-CG 4.44Å; I146-K153 HydrophobicContact CG2-CB 4.37Å; I146-K153 HydrophobicContact CG2-CG 3.96Å; I146-K153 WeakPolarHBondContact O-CE 3.36Å; I146-K153 PolarHBondContact O-NZ 3.04Å; I146-L156 HydrophobicContact CD1-CB 3.8Å; I146-L156 HydrophobicContact CG1-CB 4.16Å; I146-L156 HydrophobicContact CG2-CB 4.14Å; I146-L156 HydrophobicContact CG2-CD1 3.55Å; I146-L156 HydrophobicContact CG2-CG 4.49Å; I146-M157 HydrophobicContact CD1-CB 4.33Å; I146-M157 HydrophobicContact CD1-CE 4.36Å; I146-M157 HydrophobicContact CD1-CG 3.43Å; I146-M157 VanDerWaalsContact CD1-CG 3.43Å; I146-I161 WeakPolarHBondContact CD1-O 3.26Å; I146-I161 VanDerWaalsContact CG1-O 3.31Å; I146-I161 WeakPolarHBondContact CG1-O 3.39Å; I146-D162 PolarHBondContact N-O 3.33Å
147V84.3Confident82.7Confident64 Ų6441.5 Ų41.539%0.38824%0.238SC..EExtended strand (participates in β ladder)trans-89.890.6172-176.90000108.8T144 G145 C164 Y165 T166T144-V147 HydrophobicContact CG2-CG2 3.72Å; G145-V147 PolarHBondContact O-N 3.25Å; V147-C164 PolarHBondContact N-O 3.36Å; V147-Y165 HydrophobicContact CB-CD1 3.88Å; V147-Y165 HydrophobicContact CB-CE1 4.42Å; V147-Y165 HydrophobicContact CG1-CD1 4.3Å; V147-Y165 HydrophobicContact CG2-CD1 3.9Å; V147-Y165 HydrophobicContact CG2-CE1 3.95Å; V147-T166 PolarHBondContact O-N 2.74Å; V147-T166 PolarHBondContact O-OG1 2.8Å
148S85.1Confident82.5Confident27 Ų2745.4 Ų45.419%0.18926%0.256CS..SBendtrans-152.6155.6-176.1179.10000113.2I146 P152 K153 T166I146-S148 PolarHBondContact O-N 3.05Å; S148-P152 VanDerWaalsContact OG-CB 3.25Å; S148-P152 WeakPolarHBondContact OG-CB 3.39Å; S148-P152 WeakPolarHBondContact OG-CG 3.31Å; S148-K153 PolarHBondContact OG-N 3.34Å; S148-T166 VanDerWaalsContact CA-OG1 3.24Å; S148-T166 WeakPolarHBondContact CA-OG1 2.85Å; S148-T166 WeakPolarHBondContact CB-OG1 3.33Å; S148-T166 PolarHBondContact OG-OG1 3.11Å
149A86.4Confident82.3Confident45 Ų4545.9 Ų45.937%0.37227%0.267SS..  trans-53.3152.4156.600000111V151 P152 K153 F178A149-V151 VanDerWaalsContact C-N 3.31Å; A149-V151 PolarHBondContact O-N 3.23Å; A149-P152 WeakPolarHBondContact O-CD 3.5Å; A149-K153 WeakPolarHBondContact O-CB 3.49Å; A149-K153 PolarHBondContact O-N 2.88Å; A149-F178 HydrophobicContact CB-CE1 3.77Å; A149-F178 HydrophobicContact CB-CZ 3.83Å
150P87.3Confident82.4Confident61 Ų6147.7 Ų47.740%0.39629%0.289SS..Hα-helixtrans-61.1-32.3-167.520.8-33.6000114.6K153 K154P150-K153 PolarHBondContact O-N 2.82Å; P150-K154 WeakPolarHBondContact O-CG 3.26Å; P150-K154 PolarHBondContact O-N 2.86Å; P150-K154 VanDerWaalsContact O-N 3.12Å
151V87.8Confident82.5Confident19 Ų1949.8 Ų49.812%0.11530%0.299CS..Hα-helixtrans-67.7-57.8-178.1173.10000112A149 K153 K154 L155 L175 F178 A179A149-V151 VanDerWaalsContact C-N 3.31Å; A149-V151 PolarHBondContact O-N 3.23Å; V151-K153 PolarHBondContact O-N 3.09Å; V151-K154 PolarHBondContact O-N 2.77Å; V151-L155 PolarHBondContact O-N 2.77Å; V151-L175 HydrophobicContact CG1-CG 4.39Å; V151-L175 HydrophobicContact CG2-CD1 4.14Å; V151-L175 HydrophobicContact CG2-CG 4.02Å; V151-F178 HydrophobicContact CB-CD1 4.18Å; V151-F178 HydrophobicContact CB-CE1 4.42Å; V151-F178 HydrophobicContact CG1-CD1 4.42Å; V151-A179 HydrophobicContact CG1-CB 3.92Å
152P89Confident82.4Confident1 Ų151.2 Ų51.21%0.00630%0.302CS..Hα-helixtrans-62.5-27.8171.1-7.410000113.2S148 A149 K154 L155 L156 F178 T182S148-P152 VanDerWaalsContact OG-CB 3.25Å; S148-P152 WeakPolarHBondContact OG-CB 3.39Å; S148-P152 WeakPolarHBondContact OG-CG 3.31Å; A149-P152 WeakPolarHBondContact O-CD 3.5Å; P152-K154 PolarHBondContact O-N 2.67Å; P152-L155 PolarHBondContact O-N 3.48Å; P152-L156 WeakPolarHBondContact O-CB 3.32Å; P152-L156 VanDerWaalsContact O-CG 3.24Å; P152-L156 WeakPolarHBondContact O-CG 3.05Å; P152-L156 PolarHBondContact O-N 2.87Å; P152-F178 VanDerWaalsContact CD-CE1 3.4Å; P152-F178 HydrophobicContact CG-CD1 4.4Å; P152-F178 HydrophobicContact CG-CD2 4.31Å; P152-F178 HydrophobicContact CG-CE1 3.73Å; P152-F178 HydrophobicContact CG-CE2 3.62Å; P152-F178 HydrophobicContact CG-CZ 3.3Å; P152-T182 HydrophobicContact CB-CG2 3.67Å; P152-T182 WeakPolarHBondContact CB-OG1 3.38Å
153K88.2Confident82.8Confident46 Ų4642.9 Ų42.920%0.227%0.272CS..Hα-helixtrans-60.5-46.4178.7-167.4168-172.4164.50111.8I146 S148 A149 P150 V151 L156 M157I146-K153 HydrophobicContact CB-CG 4.09Å; I146-K153 HydrophobicContact CD1-CG 4.44Å; I146-K153 HydrophobicContact CG2-CB 4.37Å; I146-K153 HydrophobicContact CG2-CG 3.96Å; I146-K153 WeakPolarHBondContact O-CE 3.36Å; I146-K153 PolarHBondContact O-NZ 3.04Å; S148-K153 PolarHBondContact OG-N 3.34Å; A149-K153 WeakPolarHBondContact O-CB 3.49Å; A149-K153 PolarHBondContact O-N 2.88Å; P150-K153 PolarHBondContact O-N 2.82Å; V151-K153 PolarHBondContact O-N 3.09Å; K153-L156 PolarHBondContact O-N 3.26Å; K153-M157 HydrophobicContact CD-CE 4.22Å; K153-M157 HydrophobicContact CG-CE 3.89Å; K153-M157 VanDerWaalsContact O-CG 3.31Å; K153-M157 WeakPolarHBondContact O-CG 3.3Å; K153-M157 PolarHBondContact O-N 3.37Å
154K88.5Confident83.2Confident43 Ų4341.1 Ų41.119%0.18725%0.253CS..Hα-helixtrans-61.3-45.4174.4-67.4178.2176.3-146.20112E105 L107 P150 V151 P152 L156 M157 M158E105-K154 HydrophobicContact CG-CD 4.42Å; E105-K154 WeakPolarHBondContact OE1-CD 3.41Å; E105-K154 WeakPolarHBondContact OE1-CE 3.35Å; E105-K154 IonicContact OE1-NZ 2.64Å; E105-K154 PolarHBondContact OE1-NZ 3.35Å; E105-K154 VanDerWaalsContact OE2-CD 3.3Å; E105-K154 WeakPolarHBondContact OE2-CD 3.48Å; E105-K154 VanDerWaalsContact OE2-CG 3.27Å; E105-K154 WeakPolarHBondContact OE2-CG 3.35Å; L107-K154 HydrophobicContact CD2-CB 3.94Å; L107-K154 HydrophobicContact CD2-CD 3.97Å; P150-K154 WeakPolarHBondContact O-CG 3.26Å; P150-K154 PolarHBondContact O-N 2.86Å; P150-K154 VanDerWaalsContact O-N 3.12Å; V151-K154 PolarHBondContact O-N 2.77Å; P152-K154 PolarHBondContact O-N 2.67Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 3.1Å; K154-M157 PolarHBondContact O-N 3.12Å; K154-M158 HydrophobicContact CB-CE 4.42Å; K154-M158 WeakPolarHBondContact O-CG 3.37Å; K154-M158 PolarHBondContact O-N 2.61Å
155L87Confident83.8Confident26 Ų2645.7 Ų45.714%0.13627%0.27CS..Hα-helixtrans-60.9-41.1178.3-66.5172.2000112.6L107 V151 P152 M158 A159 A179 T182L107-L155 HydrophobicContact CD1-CD2 4.4Å; V151-L155 PolarHBondContact O-N 2.77Å; P152-L155 PolarHBondContact O-N 3.48Å; L155-M158 HydrophobicContact CD2-CE 3.9Å; L155-M158 PolarHBondContact O-N 2.94Å; L155-A159 WeakPolarHBondContact O-CB 3.15Å; L155-A159 PolarHBondContact O-N 2.75Å; L155-A179 HydrophobicContact CD1-CB 4.05Å; L155-T182 HydrophobicContact CB-CG2 4.13Å; L155-T182 HydrophobicContact CD1-CG2 3.9Å
156L85.4Confident84.4Confident0 Ų046.2 Ų46.20%027%0.269CS..Hα-helixtrans-70.7-36.3177.5-67.7168.5000112.1L137 I146 P152 K153 K154 A159 G160 I161 C164 T166 I186L137-L156 HydrophobicContact CD1-CD2 3.92Å; L137-L156 HydrophobicContact CD2-CD1 4.09Å; L137-L156 HydrophobicContact CD2-CD2 4.08Å; I146-L156 HydrophobicContact CD1-CB 3.8Å; I146-L156 HydrophobicContact CG1-CB 4.16Å; I146-L156 HydrophobicContact CG2-CB 4.14Å; I146-L156 HydrophobicContact CG2-CD1 3.55Å; I146-L156 HydrophobicContact CG2-CG 4.49Å; P152-L156 WeakPolarHBondContact O-CB 3.32Å; P152-L156 VanDerWaalsContact O-CG 3.24Å; P152-L156 WeakPolarHBondContact O-CG 3.05Å; P152-L156 PolarHBondContact O-N 2.87Å; K153-L156 PolarHBondContact O-N 3.26Å; K154-L156 VanDerWaalsContact C-N 3.34Å; K154-L156 PolarHBondContact O-N 3.1Å; L156-A159 PolarHBondContact O-N 3.19Å; L156-G160 PolarHBondContact O-N 2.69Å; L156-I161 HydrophobicContact CB-CB 4.42Å; L156-I161 HydrophobicContact CD2-CB 4.39Å; L156-I161 HydrophobicContact CD2-CD1 3.62Å; L156-I161 HydrophobicContact CD2-CG2 4.46Å; L156-I161 PolarHBondContact O-N 3.15Å; L156-C164 HydrophobicContact CD1-CB 4.38Å; L156-T166 HydrophobicContact CD1-CG2 3.69Å; L156-I186 HydrophobicContact CD2-CD1 4.1Å; L156-I186 HydrophobicContact CD2-CG1 4.35Å
157M85.9Confident84.7Confident111 Ų11148.3 Ų48.355%0.54728%0.284SS..Hα-helixtrans-62.6-46.3171.4-72.2173.2174.400112I146 K153 K154 A159 G160I146-M157 HydrophobicContact CD1-CB 4.33Å; I146-M157 HydrophobicContact CD1-CE 4.36Å; I146-M157 HydrophobicContact CD1-CG 3.43Å; I146-M157 VanDerWaalsContact CD1-CG 3.43Å; K153-M157 HydrophobicContact CD-CE 4.22Å; K153-M157 HydrophobicContact CG-CE 3.89Å; K153-M157 VanDerWaalsContact O-CG 3.31Å; K153-M157 WeakPolarHBondContact O-CG 3.3Å; K153-M157 PolarHBondContact O-N 3.37Å; K154-M157 PolarHBondContact O-N 3.12Å; M157-A159 VanDerWaalsContact C-N 3.26Å; M157-A159 PolarHBondContact O-N 3.03Å; M157-G160 PolarHBondContact O-N 2.92Å
158M82.9Confident85Confident90 Ų9047.2 Ų47.244%0.44328%0.282SS..Hα-helixtrans-65.4-30177.3-70.9-175.7-69.700112.4E105 L107 K154 L155 G160E105-M158 HydrophobicContact CB-SD 4.25Å; L107-M158 HydrophobicContact CD2-CE 4.44Å; K154-M158 HydrophobicContact CB-CE 4.42Å; K154-M158 WeakPolarHBondContact O-CG 3.37Å; K154-M158 PolarHBondContact O-N 2.61Å; L155-M158 HydrophobicContact CD2-CE 3.9Å; L155-M158 PolarHBondContact O-N 2.94Å; M158-G160 PolarHBondContact O-N 2.51Å
159A79.9Confident85.2Confident50 Ų5055 Ų5541%0.41331%0.307SS..THydrogen-bonded Turntrans-77.11.2172.700000114.3L155 L156 M157 I161 I186L155-A159 WeakPolarHBondContact O-CB 3.15Å; L155-A159 PolarHBondContact O-N 2.75Å; L156-A159 PolarHBondContact O-N 3.19Å; M157-A159 VanDerWaalsContact C-N 3.26Å; M157-A159 PolarHBondContact O-N 3.03Å; A159-I161 HydrophobicContact CB-CD1 4.04Å; A159-I161 HydrophobicContact CB-CG1 4.22Å; A159-I161 PolarHBondContact O-N 3.35Å; A159-I186 HydrophobicContact CB-CD1 4.22Å
160G80.9Confident85.4Confident60 Ų6055.3 Ų55.362%0.61932%0.315SS*.THydrogen-bonded Turntrans6820.1-177.500000114.3L156 M157 M158 D162L156-G160 PolarHBondContact O-N 2.69Å; M157-G160 PolarHBondContact O-N 2.92Å; M158-G160 PolarHBondContact O-N 2.51Å; G160-D162 PolarHBondContact O-N 2.81Å
161I79.8Confident85.5Confident51 Ų5155.5 Ų55.526%0.26232%0.317SS..  trans-88.199.9178.1-62.9166.9000108I146 L156 A159 D163 C164I146-I161 WeakPolarHBondContact CD1-O 3.26Å; I146-I161 VanDerWaalsContact CG1-O 3.31Å; I146-I161 WeakPolarHBondContact CG1-O 3.39Å; L156-I161 HydrophobicContact CB-CB 4.42Å; L156-I161 HydrophobicContact CD2-CB 4.39Å; L156-I161 HydrophobicContact CD2-CD1 3.62Å; L156-I161 HydrophobicContact CD2-CG2 4.46Å; L156-I161 PolarHBondContact O-N 3.15Å; A159-I161 HydrophobicContact CB-CD1 4.04Å; A159-I161 HydrophobicContact CB-CG1 4.22Å; A159-I161 PolarHBondContact O-N 3.35Å; I161-D163 PolarHBondContact O-N 2.96Å; I161-D163 VanDerWaalsContact O-N 3.15Å; I161-C164 HydrophobicContact CG2-CB 3.97Å
162D75.6Confident85.5Confident114 Ų11457.3 Ų57.361%0.6133%0.328SS*.  trans-55.3-33.5177.2-61.9-45.5000112.4G145 I146 G160G145-D162 CarbonylContact C-O 3.34Å; G145-D162 VanDerWaalsContact C-O 3.31Å; G145-D162 WeakPolarHBondContact CA-O 3.36Å; I146-D162 PolarHBondContact N-O 3.33Å; G160-D162 PolarHBondContact O-N 2.81Å
163D79.8Confident85.3Confident16 Ų1661.6 Ų61.69%0.08636%0.364CS..  trans-152.997.5-139.8-92.6-16.6000112.7G119 Q120 G143 T144 G145 I161G119-D163 VanDerWaalsContact O-CB 3.23Å; G119-D163 WeakPolarHBondContact O-CB 3.04Å; Q120-D163 WeakPolarHBondContact CA-OD2 3.49Å; Q120-D163 HydrophobicContact CB-CB 4.03Å; Q120-D163 WeakPolarHBondContact CB-OD2 3.48Å; Q120-D163 PolarHBondContact N-OD2 3.37Å; G143-D163 WeakPolarHBondContact CA-OD2 3.48Å; G143-D163 PolarHBondContact N-OD2 2.91Å; T144-D163 WeakPolarHBondContact CA-OD1 3.03Å; T144-D163 PolarHBondContact N-OD1 3.36Å; G145-D163 PolarHBondContact N-OD1 3.05Å; I161-D163 PolarHBondContact O-N 2.96Å; I161-D163 VanDerWaalsContact O-N 3.15Å
164C82.1Confident85.3Confident5 Ų562 Ų623%0.03437%0.37CS..EExtended strand (participates in β ladder)trans-157.9135.8-174.1-173.90000112.5V147 L156 I161V147-C164 PolarHBondContact N-O 3.36Å; L156-C164 HydrophobicContact CD1-CB 4.38Å; I161-C164 HydrophobicContact CG2-CB 3.97Å
165Y85.4Confident85.2Confident98 Ų9863.3 Ų63.338%0.38438%0.378SS..EExtended strand (participates in β ladder)trans-87.1131.6160.6-64.9-62.9000109.7I138 A140 T144 V147I138-Y165 PolarHBondContact N-O 3.04Å; I138-Y165 PolarHBondContact O-N 3.27Å; A140-Y165 HydrophobicContact CB-CD2 3.78Å; A140-Y165 HydrophobicContact CB-CE2 3.46Å; A140-Y165 VanDerWaalsContact CB-CE2 3.46Å; T144-Y165 HydrophobicContact CG2-CE1 4.17Å; V147-Y165 HydrophobicContact CB-CD1 3.88Å; V147-Y165 HydrophobicContact CB-CE1 4.42Å; V147-Y165 HydrophobicContact CG1-CD1 4.3Å; V147-Y165 HydrophobicContact CG2-CD1 3.9Å; V147-Y165 HydrophobicContact CG2-CE1 3.95Å
166T89.3Confident85.3Confident34 Ų3464.1 Ų64.121%0.20939%0.393CS..EExtended strand (participates in β ladder)trans-110.1142.9174.267.10000111.3R136 L137 V147 S148 L156R136-T166 WeakPolarHBondContact O-CA 3.23Å; L137-T166 HydrophobicContact CD2-CG2 3.77Å; V147-T166 PolarHBondContact O-N 2.74Å; V147-T166 PolarHBondContact O-OG1 2.8Å; S148-T166 VanDerWaalsContact CA-OG1 3.24Å; S148-T166 WeakPolarHBondContact CA-OG1 2.85Å; S148-T166 WeakPolarHBondContact CB-OG1 3.33Å; S148-T166 PolarHBondContact OG-OG1 3.11Å; L156-T166 HydrophobicContact CD1-CG2 3.69Å
167S87.7Confident85.6Confident53 Ų5367 Ų6737%0.37141%0.408SS..EExtended strand (participates in β ladder)trans-130123.9169.1-177.30000108.6R136R136-S167 PolarHBondContact N-O 2.83Å; R136-S167 PolarHBondContact O-N 2.92Å
168A90.4Very high85.9Confident42 Ų4262.3 Ų62.335%0.34739%0.385SS..EExtended strand (participates in β ladder)trans-115.2140.6-179.900000110.6L134 T172 F178L134-A168 CarbonylContact O-C 3.57Å; L134-A168 VanDerWaalsContact O-CA 3.3Å; L134-A168 WeakPolarHBondContact O-CA 3.2Å; A168-T172 HydrophobicContact CB-CG2 3.62Å; A168-F178 HydrophobicContact CB-CE2 3.71Å; A168-F178 HydrophobicContact CB-CZ 4.23Å
169R89.9Confident86.3Confident191 Ų19158.7 Ų58.772%0.72137%0.369SS*.EExtended strand (participates in β ladder)trans-129.1150.6172.6-67.6-173.6177-172.4-2.2109.6V133 L134V133-R169 WeakPolarHBondContact CA-O 3.32Å; L134-R169 PolarHBondContact N-O 3.23Å; L134-R169 PolarHBondContact O-N 3.36Å
170G91.6Very high86.9Confident51 Ų5163 Ų6353%0.52638%0.378SS..SBendtrans91.4-166.4-176.300000113.9S132 T172S132-G170 WeakPolarHBondContact O-CA 3.18Å; G170-T172 VanDerWaalsContact C-N 3.34Å; G170-T172 PolarHBondContact O-N 2.89Å
171C89.1Confident87.5Confident64 Ų6460.1 Ų60.143%0.43235%0.349SS..  trans-80.373.6-171.6-169.20000113.1V133 A173 T174V133-C171 WeakPolarHBondContact CG2-O 3.35Å; C171-A173 PolarHBondContact O-N 2.87Å; C171-A173 VanDerWaalsContact O-N 3.15Å; C171-T174 PolarHBondContact O-N 3.11Å; C171-T174 VanDerWaalsContact O-N 3.12Å; C171-T174 PolarHBondContact O-OG1 2.8Å
172T87.6Confident88Confident57 Ų5757.7 Ų57.735%0.3534%0.337SS..THydrogen-bonded Turntrans-64.1-13.8-179.754.20000114.5V133 A168 G170 T174 F178V133-T172 HydrophobicContact CG1-CG2 4.23Å; A168-T172 HydrophobicContact CB-CG2 3.62Å; G170-T172 VanDerWaalsContact C-N 3.34Å; G170-T172 PolarHBondContact O-N 2.89Å; T172-T174 PolarHBondContact O-N 3.02Å; T172-F178 HydrophobicContact CG2-CD2 4.02Å; T172-F178 HydrophobicContact CG2-CE2 3.88Å; T172-F178 HydrophobicContact CG2-CG 4.45Å; T172-F178 HydrophobicContact CG2-CZ 4.17Å
173A84.9Confident88.7Confident92 Ų9258.9 Ų58.976%0.7634%0.337SS*.THydrogen-bonded Turntrans-60.3-24.9170.400000112.7C171 L175C171-A173 PolarHBondContact O-N 2.87Å; C171-A173 VanDerWaalsContact O-N 3.15Å; A173-L175 PolarHBondContact O-N 2.91Å
174T87.9Confident89.3Confident54 Ų5460 Ų6033%0.33134%0.343SS..  trans-79.687.3175.657.60000111.4C171 T172 G176 N177 F178C171-T174 PolarHBondContact O-N 3.11Å; C171-T174 VanDerWaalsContact O-N 3.12Å; C171-T174 PolarHBondContact O-OG1 2.8Å; T172-T174 PolarHBondContact O-N 3.02Å; T174-G176 VanDerWaalsContact C-N 3.28Å; T174-G176 PolarHBondContact O-N 3.11Å; T174-G176 VanDerWaalsContact O-N 3.14Å; T174-N177 PolarHBondContact O-N 3.47Å; T174-N177 PolarHBondContact OG1-ND2 3.29Å; T174-N177 VanDerWaalsContact OG1-ND2 3.12Å; T174-F178 PolarHBondContact O-N 3.42Å
175L86.4Confident89.6Confident70 Ų7059.8 Ų59.837%0.36634%0.341SS..Hα-helixtrans-46.2-47.6-175.6-172.6159.4000113.2L107 V151 A173 N177 F178 A179L107-L175 HydrophobicContact CB-CD2 4.42Å; V151-L175 HydrophobicContact CG1-CG 4.39Å; V151-L175 HydrophobicContact CG2-CD1 4.14Å; V151-L175 HydrophobicContact CG2-CG 4.02Å; A173-L175 PolarHBondContact O-N 2.91Å; L175-N177 PolarHBondContact O-N 3.44Å; L175-F178 PolarHBondContact O-N 3.14Å; L175-A179 WeakPolarHBondContact O-CB 3.31Å; L175-A179 PolarHBondContact O-N 2.97Å
176G88.7Confident89.7Confident43 Ų4356.8 Ų56.844%0.44333%0.331SS..Hα-helixtrans-61-44-178.600000113.7T174 K180T174-G176 VanDerWaalsContact C-N 3.28Å; T174-G176 PolarHBondContact O-N 3.11Å; T174-G176 VanDerWaalsContact O-N 3.14Å; G176-K180 WeakPolarHBondContact O-CB 3.41Å; G176-K180 VanDerWaalsContact O-CG 3.29Å; G176-K180 WeakPolarHBondContact O-CG 3.5Å; G176-K180 PolarHBondContact O-N 3.07Å
177N92.3Very high89.6Confident60 Ų6057.9 Ų57.932%0.32134%0.34SS..Hα-helixtrans-70.9-38.5176.8-61.9-29.8000111C130 V133 T174 L175 K180 A181C130-N177 HydrophobicContact CB-CB 4.34Å; C130-N177 WeakPolarHBondContact CB-O 3.43Å; V133-N177 HydrophobicContact CG2-CB 4.02Å; T174-N177 PolarHBondContact O-N 3.47Å; T174-N177 PolarHBondContact OG1-ND2 3.29Å; T174-N177 VanDerWaalsContact OG1-ND2 3.12Å; L175-N177 PolarHBondContact O-N 3.44Å; N177-K180 PolarHBondContact O-N 3.09Å; N177-A181 VanDerWaalsContact O-CB 3.23Å; N177-A181 WeakPolarHBondContact O-CB 3.24Å; N177-A181 PolarHBondContact O-N 2.9Å
178F91Very high89.5Confident14 Ų1459.1 Ų59.16%0.06134%0.339CS..Hα-helixtrans-67.7-40.6-179.6-171.7-149.6000112.4V133 V135 A149 V151 P152 A168 T172 T174 L175 T182V133-F178 HydrophobicContact CG1-CB 4.42Å; V133-F178 HydrophobicContact CG1-CD2 3.9Å; V135-F178 HydrophobicContact CG2-CD2 3.67Å; V135-F178 HydrophobicContact CG2-CE2 3.71Å; A149-F178 HydrophobicContact CB-CE1 3.77Å; A149-F178 HydrophobicContact CB-CZ 3.83Å; V151-F178 HydrophobicContact CB-CD1 4.18Å; V151-F178 HydrophobicContact CB-CE1 4.42Å; V151-F178 HydrophobicContact CG1-CD1 4.42Å; P152-F178 VanDerWaalsContact CD-CE1 3.4Å; P152-F178 HydrophobicContact CG-CD1 4.4Å; P152-F178 HydrophobicContact CG-CD2 4.31Å; P152-F178 HydrophobicContact CG-CE1 3.73Å; P152-F178 HydrophobicContact CG-CE2 3.62Å; P152-F178 HydrophobicContact CG-CZ 3.3Å; A168-F178 HydrophobicContact CB-CE2 3.71Å; A168-F178 HydrophobicContact CB-CZ 4.23Å; T172-F178 HydrophobicContact CG2-CD2 4.02Å; T172-F178 HydrophobicContact CG2-CE2 3.88Å; T172-F178 HydrophobicContact CG2-CG 4.45Å; T172-F178 HydrophobicContact CG2-CZ 4.17Å; T174-F178 PolarHBondContact O-N 3.42Å; L175-F178 PolarHBondContact O-N 3.14Å; F178-T182 PolarHBondContact O-N 2.89Å; F178-T182 VanDerWaalsContact O-N 3.11Å; F178-T182 PolarHBondContact O-OG1 3.41Å
179A91.8Very high89Confident13 Ų1360 Ų6011%0.10734%0.34CS..Hα-helixtrans-63.5-49.2171.300000111.4L107 V151 L155 L175 A181 T182 F183L107-A179 HydrophobicContact CD1-CB 4.17Å; V151-A179 HydrophobicContact CG1-CB 3.92Å; L155-A179 HydrophobicContact CD1-CB 4.05Å; L175-A179 WeakPolarHBondContact O-CB 3.31Å; L175-A179 PolarHBondContact O-N 2.97Å; A179-A181 PolarHBondContact O-N 2.88Å; A179-T182 WeakPolarHBondContact O-CB 3.42Å; A179-T182 PolarHBondContact O-N 2.89Å; A179-T182 VanDerWaalsContact O-N 3.14Å; A179-F183 PolarHBondContact O-N 3.05Å
180K91.8Very high88.5Confident140 Ų14061.5 Ų61.561%0.60935%0.347SS*.Hα-helixtrans-61.6-41.1177.7-76.5-178.8176.5-172.50113.2C130 G176 N177 T182 F183 D184C130-K180 HydrophobicContact CB-CB 3.98Å; G176-K180 WeakPolarHBondContact O-CB 3.41Å; G176-K180 VanDerWaalsContact O-CG 3.29Å; G176-K180 WeakPolarHBondContact O-CG 3.5Å; G176-K180 PolarHBondContact O-N 3.07Å; N177-K180 PolarHBondContact O-N 3.09Å; K180-T182 VanDerWaalsContact C-N 3.27Å; K180-T182 PolarHBondContact O-N 3.45Å; K180-F183 PolarHBondContact O-N 3Å; K180-D184 VanDerWaalsContact O-CB 3.3Å; K180-D184 WeakPolarHBondContact O-CB 3.18Å; K180-D184 PolarHBondContact O-N 3.31Å
181A93.7Very high88Confident0 Ų063.6 Ų63.60%035%0.354CS..Hα-helixtrans-65.4-31175.800000112.3G128 C130 V133 V135 N177 A179 A185G128-A181 CarbonylContact C-O 3.53Å; G128-A181 WeakPolarHBondContact CA-O 3.44Å; C130-A181 HydrophobicContact CB-CB 3.84Å; V133-A181 HydrophobicContact CB-CB 4.43Å; V133-A181 HydrophobicContact CG1-CB 4.22Å; V135-A181 HydrophobicContact CB-CB 4.38Å; V135-A181 HydrophobicContact CG2-CB 3.77Å; N177-A181 VanDerWaalsContact O-CB 3.23Å; N177-A181 WeakPolarHBondContact O-CB 3.24Å; N177-A181 PolarHBondContact O-N 2.9Å; A179-A181 PolarHBondContact O-N 2.88Å; A181-A185 PolarHBondContact O-N 3.43Å
182T91.3Very high87.3Confident0 Ų066.9 Ų66.90%036%0.358CS..Hα-helixtrans-71.2-46.8172.2-53.60000111P152 L155 F178 A179 K180 D184 A185 I186P152-T182 HydrophobicContact CB-CG2 3.67Å; P152-T182 WeakPolarHBondContact CB-OG1 3.38Å; L155-T182 HydrophobicContact CB-CG2 4.13Å; L155-T182 HydrophobicContact CD1-CG2 3.9Å; F178-T182 PolarHBondContact O-N 2.89Å; F178-T182 VanDerWaalsContact O-N 3.11Å; F178-T182 PolarHBondContact O-OG1 3.41Å; A179-T182 WeakPolarHBondContact O-CB 3.42Å; A179-T182 PolarHBondContact O-N 2.89Å; A179-T182 VanDerWaalsContact O-N 3.14Å; K180-T182 VanDerWaalsContact C-N 3.27Å; K180-T182 PolarHBondContact O-N 3.45Å; T182-D184 VanDerWaalsContact C-N 3.34Å; T182-D184 PolarHBondContact O-N 2.81Å; T182-A185 WeakPolarHBondContact O-CA 3.4Å; T182-A185 VanDerWaalsContact O-CB 3.31Å; T182-A185 WeakPolarHBondContact O-CB 3.23Å; T182-A185 PolarHBondContact O-N 3.38Å; T182-I186 HydrophobicContact CG2-CD1 4.3Å; T182-I186 WeakPolarHBondContact O-CG1 3.43Å; T182-I186 PolarHBondContact O-N 3.35Å; T182-I186 VanDerWaalsContact O-N 3.11Å
183F90.8Very high86.8Confident140 Ų14069.7 Ų69.761%0.61437%0.371SS*.Hα-helixtrans-60.7-42.2178.1-175-95.4000112.1A179 K180 A185 I186 S187A179-F183 PolarHBondContact O-N 3.05Å; K180-F183 PolarHBondContact O-N 3Å; F183-A185 VanDerWaalsContact C-N 3.25Å; F183-A185 PolarHBondContact O-N 2.9Å; F183-I186 PolarHBondContact O-N 3.32Å; F183-S187 PolarHBondContact O-N 2.94Å; F183-S187 PolarHBondContact O-OG 3.49Å
184D92Very high86.2Confident40 Ų4065.7 Ų65.721%0.21434%0.337CS..Hα-helixtrans-63.2-26.8173176.862000113.2G128 R129 K180 T182 S187 K188G128-D184 WeakPolarHBondContact CA-OD2 3.13Å; R129-D184 PolarHBondContact N-OD2 3.44Å; K180-D184 VanDerWaalsContact O-CB 3.3Å; K180-D184 WeakPolarHBondContact O-CB 3.18Å; K180-D184 PolarHBondContact O-N 3.31Å; T182-D184 VanDerWaalsContact C-N 3.34Å; T182-D184 PolarHBondContact O-N 2.81Å; D184-S187 WeakPolarHBondContact CA-OG 3.36Å; D184-S187 PolarHBondContact O-OG 2.6Å; D184-K188 VanDerWaalsContact O-CD 3.26Å; D184-K188 WeakPolarHBondContact O-CD 3.4Å; D184-K188 VanDerWaalsContact O-CG 3.25Å; D184-K188 WeakPolarHBondContact O-CG 3.29Å; D184-K188 WeakPolarHBondContact OD1-CE 3.4Å; D184-K188 IonicContact OD1-NZ 2.87Å; D184-K188 PolarHBondContact OD1-NZ 3.4Å; D184-K188 IonicContact OD2-NZ 2.71Å; D184-K188 PolarHBondContact OD2-NZ 3.27Å
185A88.3Confident85.7Confident0 Ų067.1 Ų67.10%035%0.347CS..Hα-helixtrans-73.6-35.2171.500000111.7V126 L137 A181 T182 F183V126-A185 HydrophobicContact CG2-CB 4.38Å; V126-A185 VanDerWaalsContact CG2-O 3.28Å; V126-A185 WeakPolarHBondContact CG2-O 3.45Å; L137-A185 HydrophobicContact CD1-CB 3.85Å; L137-A185 HydrophobicContact CG-CB 3.95Å; A181-A185 PolarHBondContact O-N 3.43Å; T182-A185 WeakPolarHBondContact O-CA 3.4Å; T182-A185 VanDerWaalsContact O-CB 3.31Å; T182-A185 WeakPolarHBondContact O-CB 3.23Å; T182-A185 PolarHBondContact O-N 3.38Å; F183-A185 VanDerWaalsContact C-N 3.25Å; F183-A185 PolarHBondContact O-N 2.9Å
186I86.6Confident85.2Confident34 Ų3468.9 Ų68.917%0.17436%0.357CS..Hα-helixtrans-74.6-43.6179-62.8168000110.9L137 L156 A159 T182 F183 K188 T189L137-I186 HydrophobicContact CD1-CG1 4.04Å; L156-I186 HydrophobicContact CD2-CD1 4.1Å; L156-I186 HydrophobicContact CD2-CG1 4.35Å; A159-I186 HydrophobicContact CB-CD1 4.22Å; T182-I186 HydrophobicContact CG2-CD1 4.3Å; T182-I186 WeakPolarHBondContact O-CG1 3.43Å; T182-I186 PolarHBondContact O-N 3.35Å; T182-I186 VanDerWaalsContact O-N 3.11Å; F183-I186 PolarHBondContact O-N 3.32Å; I186-K188 PolarHBondContact O-N 3.34Å; I186-T189 WeakPolarHBondContact O-CG2 3.2Å; I186-T189 PolarHBondContact O-N 3.01Å; I186-T189 VanDerWaalsContact O-N 3.14Å; I186-T189 PolarHBondContact O-OG1 3.39Å
187S87.3Confident84.7Confident57 Ų5771.8 Ų71.840%0.39936%0.362SS..Hα-helixtrans-61.1-32.5177.960.30000112.7F183 D184 T189F183-S187 PolarHBondContact O-N 2.94Å; F183-S187 PolarHBondContact O-OG 3.49Å; D184-S187 WeakPolarHBondContact CA-OG 3.36Å; D184-S187 PolarHBondContact O-OG 2.6Å; S187-T189 VanDerWaalsContact C-N 3.27Å; S187-T189 PolarHBondContact O-N 3.05Å
188K86.3Confident84.5Confident79 Ų7977.5 Ų77.534%0.34338%0.379SS..THydrogen-bonded Turntrans-74.3-5.5178.2-74.5172.2-178.31580115.2D184 I186 S191 Y192D184-K188 VanDerWaalsContact O-CD 3.26Å; D184-K188 WeakPolarHBondContact O-CD 3.4Å; D184-K188 VanDerWaalsContact O-CG 3.25Å; D184-K188 WeakPolarHBondContact O-CG 3.29Å; D184-K188 WeakPolarHBondContact OD1-CE 3.4Å; D184-K188 IonicContact OD1-NZ 2.87Å; D184-K188 PolarHBondContact OD1-NZ 3.4Å; D184-K188 IonicContact OD2-NZ 2.71Å; D184-K188 PolarHBondContact OD2-NZ 3.27Å; I186-K188 PolarHBondContact O-N 3.34Å; K188-S191 PolarHBondContact O-N 3.42Å; K188-Y192 PolarHBondContact O-N 2.88Å
189T80.1Confident84.4Confident61 Ų6185 Ų8537%0.37441%0.411SS..THydrogen-bonded Turntrans-63.5-44.8176.358.70000111.2V126 I186 S187 S191 Y192V126-T189 HydrophobicContact CG1-CG2 4.28Å; V126-T189 HydrophobicContact CG2-CG2 4.21Å; I186-T189 WeakPolarHBondContact O-CG2 3.2Å; I186-T189 PolarHBondContact O-N 3.01Å; I186-T189 VanDerWaalsContact O-N 3.14Å; I186-T189 PolarHBondContact O-OG1 3.39Å; S187-T189 VanDerWaalsContact C-N 3.27Å; S187-T189 PolarHBondContact O-N 3.05Å; T189-S191 VanDerWaalsContact C-N 3.3Å; T189-S191 PolarHBondContact O-N 3.46Å; T189-Y192 PolarHBondContact O-N 2.81Å
190Y79.1Confident84.2Confident222 Ų22293.1 Ų93.187%0.87145%0.447SS*.THydrogen-bonded Turntrans-75.2-16.3175.2-68.5-74.7000113.7Y192Y190-Y192 VanDerWaalsContact C-N 3.29Å
191S81.8Confident84Confident95 Ų9590.7 Ų90.766%0.66444%0.444SS*.THydrogen-bonded Turntrans-79.2-11.3173.4-47.50000113.5K188 T189K188-S191 PolarHBondContact O-N 3.42Å; T189-S191 VanDerWaalsContact C-N 3.3Å; T189-S191 PolarHBondContact O-N 3.46Å
192Y74.7Confident83.9Confident133 Ų13396.9 Ų96.952%0.52248%0.482SS..SBendtrans-90.4111.4-178.3-156.9-94.5000110F124 K188 T189 Y190 T194F124-Y192 AromaticContact CD1-CD1 3.94Å; F124-Y192 HydrophobicContact CD1-CD1 3.94Å; F124-Y192 AromaticContact CD1-CE1 3.96Å; F124-Y192 HydrophobicContact CD1-CE1 3.96Å; F124-Y192 HydrophobicContact CG-CD1 4.38Å; K188-Y192 PolarHBondContact O-N 2.88Å; T189-Y192 PolarHBondContact O-N 2.81Å; Y190-Y192 VanDerWaalsContact C-N 3.29Å; Y192-T194 HydrophobicContact CD1-CG2 4.05Å; Y192-T194 PolarHBondContact O-N 3.42Å
193L75.4Confident83.8Confident116 Ų116105.6 Ų105.661%0.60752%0.52SS*.  trans-75.2123.3178.9-17468000110.7L197L193-L197 HydrophobicContact CD1-CB 3.9Å
194T72.5Confident83.8Confident9 Ų9102.9 Ų102.96%0.05552%0.515CS..  trans-113.7155.2-177.261.10000110.7F124 Y192 D196 L197 W198F124-T194 HydrophobicContact CD1-CG2 4.02Å; F124-T194 HydrophobicContact CD2-CG2 4.14Å; F124-T194 HydrophobicContact CE1-CG2 3.46Å; F124-T194 VanDerWaalsContact CE1-CG2 3.46Å; F124-T194 HydrophobicContact CE2-CG2 3.6Å; F124-T194 HydrophobicContact CG-CG2 4.34Å; F124-T194 HydrophobicContact CZ-CG2 3.23Å; Y192-T194 HydrophobicContact CD1-CG2 4.05Å; Y192-T194 PolarHBondContact O-N 3.42Å; T194-D196 WeakPolarHBondContact CB-OD1 3.31Å; T194-D196 PolarHBondContact O-N 3.04Å; T194-D196 VanDerWaalsContact O-N 3.15Å; T194-D196 VanDerWaalsContact OG1-CG 3.32Å; T194-D196 PolarHBondContact OG1-OD1 3.3Å; T194-L197 CarbonylContact O-C 3.6Å; T194-L197 WeakPolarHBondContact O-CA 2.97Å; T194-L197 WeakPolarHBondContact O-CB 3.33Å; T194-L197 PolarHBondContact O-N 3.48Å; T194-L197 WeakPolarHBondContact OG1-CD1 3.24Å; T194-L197 WeakPolarHBondContact OG1-CG 3.32Å; T194-W198 PolarHBondContact O-N 3.27Å; T194-W198 PolarHBondContact O-NE1 3.12Å
195P77.3Confident83.8Confident83 Ų83107.7 Ų107.754%0.53953%0.534SS..G310 helixtrans-60.8-26.2-174-26.736.2000115.6L197 W198P195-L197 VanDerWaalsContact C-N 3.27Å; P195-L197 PolarHBondContact O-N 3.42Å; P195-W198 HydrophobicContact CB-CD2 4.14Å; P195-W198 HydrophobicContact CB-CE3 4.16Å; P195-W198 HydrophobicContact CB-CH2 4.34Å; P195-W198 HydrophobicContact CB-CZ2 4.3Å; P195-W198 HydrophobicContact CB-CZ3 4.26Å; P195-W198 HydrophobicContact CG-CH2 4.17Å; P195-W198 HydrophobicContact CG-CZ2 3.97Å; P195-W198 WeakPolarHBondContact O-CB 3.4Å; P195-W198 PolarHBondContact O-N 3.37Å
196D75.9Confident83.9Confident108 Ų108109.2 Ų109.258%0.57854%0.544SS*.G310 helixtrans-68.2-24171.850.5-51.8000113.5T194T194-D196 WeakPolarHBondContact CB-OD1 3.31Å; T194-D196 PolarHBondContact O-N 3.04Å; T194-D196 VanDerWaalsContact O-N 3.15Å; T194-D196 VanDerWaalsContact OG1-CG 3.32Å; T194-D196 PolarHBondContact OG1-OD1 3.3Å
197L79.2Confident84.1Confident103 Ų103107.9 Ų107.954%0.53954%0.538SS..G310 helixtrans-95.75.9175.8-61.2176.3000113.3L193 T194 P195 K199L193-L197 HydrophobicContact CD1-CB 3.9Å; T194-L197 CarbonylContact O-C 3.6Å; T194-L197 WeakPolarHBondContact O-CA 2.97Å; T194-L197 WeakPolarHBondContact O-CB 3.33Å; T194-L197 PolarHBondContact O-N 3.48Å; T194-L197 WeakPolarHBondContact OG1-CD1 3.24Å; T194-L197 WeakPolarHBondContact OG1-CG 3.32Å; P195-L197 VanDerWaalsContact C-N 3.27Å; P195-L197 PolarHBondContact O-N 3.42Å; L197-K199 PolarHBondContact O-N 3.39Å
198W87.8Confident84.2Confident180 Ų180108.7 Ų108.768%0.68253%0.533SS*.  trans-78-2.1175.7-66.9-3.6000114.1T194 P195T194-W198 PolarHBondContact O-N 3.27Å; T194-W198 PolarHBondContact O-NE1 3.12Å; P195-W198 HydrophobicContact CB-CD2 4.14Å; P195-W198 HydrophobicContact CB-CE3 4.16Å; P195-W198 HydrophobicContact CB-CH2 4.34Å; P195-W198 HydrophobicContact CB-CZ2 4.3Å; P195-W198 HydrophobicContact CB-CZ3 4.26Å; P195-W198 HydrophobicContact CG-CH2 4.17Å; P195-W198 HydrophobicContact CG-CZ2 3.97Å; P195-W198 WeakPolarHBondContact O-CB 3.4Å; P195-W198 PolarHBondContact O-N 3.37Å
199K88.1Confident84.4Confident171 Ų171110.6 Ų110.674%0.74354%0.543SS*.SBendtrans-65.3140.9173.3-65.4178-179176.90109.6L197 T201L197-K199 PolarHBondContact O-N 3.39Å; K199-T201 PolarHBondContact O-N 2.81Å
200E89.3Confident84.9Confident185 Ų185113.4 Ų113.486%0.86455%0.552SS**PPolyproline II helixtrans-58.9131.8178.8-170.3170.8-166.900111.3
201T87.6Confident85.4Confident88 Ų88104.7 Ų104.754%0.5452%0.519SS..PPolyproline II helixtrans-78.9122.4-175.551.40000111K199 F203K199-T201 PolarHBondContact O-N 2.81Å; T201-F203 PolarHBondContact O-N 3.37Å; T201-F203 WeakPolarHBondContact OG1-CZ 3.25Å
202V90.1Very high85.8Confident131 Ų131103.3 Ų103.379%0.79451%0.506SS*.  trans-73109.6171.5-178.90000109.2T204V202-T204 PolarHBondContact O-N 2.69Å
203F88.9Confident86.4Confident182 Ų182102.7 Ų102.780%0.79851%0.512SS*.  trans-73.5108.3178-63.1-72.1000111.3T201T201-F203 PolarHBondContact O-N 3.37Å; T201-F203 WeakPolarHBondContact OG1-CZ 3.25Å
204T91.4Very high87Confident83 Ų8399.4 Ų99.451%0.50949%0.493SS..PPolyproline II helixtrans-85.6159.9170.751.20000111.2F84 V202F84-T204 WeakPolarHBondContact CZ-OG1 3.45Å; V202-T204 PolarHBondContact O-N 2.69Å
205K91.7Very high87.7Confident141 Ų14199.5 Ų99.561%0.61349%0.494SS*.PPolyproline II helixtrans-69.5141.9175.9-66.5177.9-177.3174.20109.8F84F84-K205 WeakPolarHBondContact CZ-O 3.3Å
206S91Very high88.1Confident32 Ų3299.5 Ų99.522%0.22449%0.492CS..PPolyproline II helixtrans-68.8147.5175.8720000111.5Y208 Q209 E210S206-Y208 PolarHBondContact O-N 2.93Å; S206-Y208 VanDerWaalsContact O-N 3.13Å; S206-Q209 WeakPolarHBondContact O-CA 3.44Å; S206-Q209 WeakPolarHBondContact O-CB 3.44Å; S206-Q209 PolarHBondContact O-N 2.85Å; S206-Q209 WeakPolarHBondContact OG-CB 3.4Å; S206-Q209 PolarHBondContact OG-N 2.96Å; S206-E210 PolarHBondContact O-N 3.27Å
207P91.3Very high88.4Confident6 Ų6101.6 Ų101.64%0.03950%0.496CS..Hα-helixtrans-56.3-31.1176.7-28.634.5000113.5L69 I75 F84 F211L69-P207 HydrophobicContact CD1-CB 4.4Å; I75-P207 HydrophobicContact CD1-CB 3.99Å; I75-P207 HydrophobicContact CD1-CG 4.42Å; I75-P207 HydrophobicContact CG1-CB 4.04Å; I75-P207 HydrophobicContact CG1-CG 4.41Å; F84-P207 HydrophobicContact CD2-CG 4.14Å; F84-P207 HydrophobicContact CE2-CG 4.39Å; P207-F211 HydrophobicContact CB-CD2 4.19Å; P207-F211 HydrophobicContact CB-CE2 4.37Å; P207-F211 WeakPolarHBondContact O-CB 3.33Å; P207-F211 WeakPolarHBondContact O-CD2 3.33Å; P207-F211 PolarHBondContact O-N 3.12Å
208Y89.3Confident88.3Confident74 Ų7498.8 Ų98.829%0.2948%0.483SS..Hα-helixtrans-68.7-34.3174.4-66.8-32.2000113.1K65 L69 L86 S206 T212 L215K65-Y208 HydrophobicContact CB-CD1 4.3Å; K65-Y208 HydrophobicContact CB-CE1 3.75Å; L69-Y208 HydrophobicContact CD1-CD1 3.97Å; L69-Y208 HydrophobicContact CD1-CE1 4.27Å; L86-Y208 HydrophobicContact CD1-CE2 4.09Å; L86-Y208 HydrophobicContact CD2-CD2 4.16Å; L86-Y208 HydrophobicContact CD2-CE2 3.67Å; L86-Y208 HydrophobicContact CG-CE2 4.46Å; S206-Y208 PolarHBondContact O-N 2.93Å; S206-Y208 VanDerWaalsContact O-N 3.13Å; Y208-T212 PolarHBondContact O-N 3.47Å; Y208-T212 PolarHBondContact O-OG1 3.45Å; Y208-L215 HydrophobicContact CD1-CD1 4.21Å
209Q89.6Confident87.3Confident119 Ų11993 Ų9356%0.55646%0.463SS*.Hα-helixtrans-75.2-47.7176.5-174179.77.500110.9S206 T212S206-Q209 WeakPolarHBondContact O-CA 3.44Å; S206-Q209 WeakPolarHBondContact O-CB 3.44Å; S206-Q209 PolarHBondContact O-N 2.85Å; S206-Q209 WeakPolarHBondContact OG-CB 3.4Å; S206-Q209 PolarHBondContact OG-N 2.96Å; Q209-T212 PolarHBondContact O-N 2.8Å; Q209-T212 PolarHBondContact O-OG1 3.19Å
210E90.6Very high85.9Confident120 Ų12088.5 Ų88.556%0.56145%0.45SS*.Hα-helixtrans-63.3-43.3-179.4-172.9173.4165.700112.3S206S206-E210 PolarHBondContact O-N 3.27Å
211F90.9Very high84.2Confident39 Ų3988.6 Ų88.617%0.17144%0.443CS..THydrogen-bonded Turntrans-98.325.4-178.3-53.2-58000113.6L69 K74 P207 D213 H214 L215L69-F211 HydrophobicContact CD1-CB 4.34Å; L69-F211 HydrophobicContact CD1-CD2 4.26Å; L69-F211 HydrophobicContact CD2-CB 3.39Å; L69-F211 HydrophobicContact CD2-CD2 3.96Å; L69-F211 HydrophobicContact CD2-CG 3.88Å; K74-F211 HydrophobicContact CB-CD1 4.2Å; K74-F211 HydrophobicContact CB-CD2 3.85Å; K74-F211 HydrophobicContact CB-CE1 4.13Å; K74-F211 HydrophobicContact CB-CE2 3.78Å; K74-F211 HydrophobicContact CB-CG 4.08Å; K74-F211 HydrophobicContact CB-CZ 3.93Å; K74-F211 HydrophobicContact CD-CD1 4.29Å; K74-F211 HydrophobicContact CD-CE1 4.22Å; K74-F211 HydrophobicContact CG-CD1 4.32Å; K74-F211 HydrophobicContact CG-CG 4.42Å; P207-F211 HydrophobicContact CB-CD2 4.19Å; P207-F211 HydrophobicContact CB-CE2 4.37Å; P207-F211 WeakPolarHBondContact O-CB 3.33Å; P207-F211 WeakPolarHBondContact O-CD2 3.33Å; P207-F211 PolarHBondContact O-N 3.12Å; F211-D213 PolarHBondContact O-N 3.01Å; F211-H214 HydrophobicContact CB-CB 4.24Å; F211-H214 WeakPolarHBondContact O-CB 3.43Å; F211-H214 PolarHBondContact O-N 3.15Å; F211-L215 WeakPolarHBondContact O-CG 3.3Å; F211-L215 PolarHBondContact O-N 3.34Å
212T89.3Confident82.4Confident66 Ų6689.1 Ų89.141%0.40545%0.445SS..Hα-helixtrans-54.1-52.1177.6-61.20000111.5Y208 Q209 H214 L215 V216Y208-T212 PolarHBondContact O-N 3.47Å; Y208-T212 PolarHBondContact O-OG1 3.45Å; Q209-T212 PolarHBondContact O-N 2.8Å; Q209-T212 PolarHBondContact O-OG1 3.19Å; T212-H214 PolarHBondContact O-N 3.26Å; T212-L215 PolarHBondContact O-N 3.17Å; T212-L215 VanDerWaalsContact O-N 3.15Å; T212-V216 HydrophobicContact CG2-CG2 4.49Å; T212-V216 WeakPolarHBondContact O-CG2 3.32Å; T212-V216 PolarHBondContact O-N 2.64Å
213D88.3Confident80.1Confident121 Ų12187.5 Ų87.565%0.64744%0.44SS*.Hα-helixtrans-63.3-30.1-177.6-61.8-30.3000113F211 K217F211-D213 PolarHBondContact O-N 3.01Å; D213-K217 WeakPolarHBondContact O-CD 3.27Å; D213-K217 WeakPolarHBondContact O-CG 3.34Å; D213-K217 PolarHBondContact O-N 3.06Å
214H87.6Confident77.9Confident46 Ų4683.9 Ų83.921%0.21343%0.432CS..Hα-helixtrans-71.6-47.2175.9-171.5-103.2000110.6D72 K74 F211 T212 V216 K217 T218D72-H214 IonicContact OD2-CE1 3.24Å; D72-H214 PolarHBondContact OD2-CE1 2.99Å; D72-H214 VanDerWaalsContact OD2-CE1 3.24Å; K74-H214 WeakPolarHBondContact CE-NE2 3.21Å; F211-H214 HydrophobicContact CB-CB 4.24Å; F211-H214 WeakPolarHBondContact O-CB 3.43Å; F211-H214 PolarHBondContact O-N 3.15Å; T212-H214 PolarHBondContact O-N 3.26Å; H214-V216 VanDerWaalsContact C-N 3.32Å; H214-V216 PolarHBondContact O-N 3.14Å; H214-K217 WeakPolarHBondContact O-CB 3.43Å; H214-K217 PolarHBondContact O-N 3.07Å; H214-T218 PolarHBondContact O-N 3.07Å; H214-T218 PolarHBondContact O-OG1 3.12Å
215L86.3Confident75.4Confident12 Ų1288.2 Ų88.26%0.06345%0.447CS..Hα-helixtrans-61.4-37.3175.5-71.9171.7000112.2K65 L69 Y208 F211 T212 K217 T218 H219K65-L215 HydrophobicContact CB-CD1 4.11Å; K65-L215 HydrophobicContact CB-CD2 3.88Å; K65-L215 HydrophobicContact CD-CD1 4.23Å; K65-L215 HydrophobicContact CG-CD1 4.32Å; K65-L215 HydrophobicContact CG-CD2 4.17Å; L69-L215 HydrophobicContact CD1-CD1 4.19Å; L69-L215 HydrophobicContact CD2-CD2 4.18Å; L69-L215 HydrophobicContact CD2-CG 4.17Å; L69-L215 HydrophobicContact CG-CD2 4.08Å; L69-L215 HydrophobicContact CG-CG 4.4Å; Y208-L215 HydrophobicContact CD1-CD1 4.21Å; F211-L215 WeakPolarHBondContact O-CG 3.3Å; F211-L215 PolarHBondContact O-N 3.34Å; T212-L215 PolarHBondContact O-N 3.17Å; T212-L215 VanDerWaalsContact O-N 3.15Å; L215-K217 PolarHBondContact O-N 2.88Å; L215-T218 PolarHBondContact O-N 2.83Å; L215-H219 HydrophobicContact CB-CB 4.45Å; L215-H219 HydrophobicContact CD2-CB 4.37Å; L215-H219 WeakPolarHBondContact O-CA 3.36Å; L215-H219 WeakPolarHBondContact O-CB 3.06Å; L215-H219 PolarHBondContact O-N 2.71Å
216V85.4Confident73.1Confident82 Ų8292.8 Ų92.850%0.49746%0.461SS..Hα-helixtrans-62.8-26.4174.9173.40000112.2T212 H214 T220T212-V216 HydrophobicContact CG2-CG2 4.49Å; T212-V216 WeakPolarHBondContact O-CG2 3.32Å; T212-V216 PolarHBondContact O-N 2.64Å; H214-V216 VanDerWaalsContact C-N 3.32Å; H214-V216 PolarHBondContact O-N 3.14Å; V216-T220 PolarHBondContact O-OG1 3.22Å
217K83.3Confident70.8Confident153 Ų15396.8 Ų96.867%0.66548%0.483SS*.Hα-helixtrans-83.9-40.6176.1-66.3167.2-172.7175.40112.6D213 H214 L215D213-K217 WeakPolarHBondContact O-CD 3.27Å; D213-K217 WeakPolarHBondContact O-CG 3.34Å; D213-K217 PolarHBondContact O-N 3.06Å; H214-K217 WeakPolarHBondContact O-CB 3.43Å; H214-K217 PolarHBondContact O-N 3.07Å; L215-K217 PolarHBondContact O-N 2.88Å
218T76.6Confident68.2Low43 Ų43105.4 Ų105.426%0.26452%0.523SS..Hα-helixtrans-102.8-22.3-170.765.80000115.6R68 H214 L215R68-T218 PolarHBondContact NE-O 3.02Å; H214-T218 PolarHBondContact O-N 3.07Å; H214-T218 PolarHBondContact O-OG1 3.12Å; L215-T218 PolarHBondContact O-N 2.83Å
219H66.1Low65.9Low58 Ų58106.4 Ų106.427%0.26955%0.547SS..THydrogen-bonded Turntrans-91.3-44-174.1-173.562000113.3K65 R68 L215K65-H219 WeakPolarHBondContact CE-NE2 3.43Å; R68-H219 PolarHBondContact NH1-ND1 2.85Å; L215-H219 HydrophobicContact CB-CB 4.45Å; L215-H219 HydrophobicContact CD2-CB 4.37Å; L215-H219 WeakPolarHBondContact O-CA 3.36Å; L215-H219 WeakPolarHBondContact O-CB 3.06Å; L215-H219 PolarHBondContact O-N 2.71Å
220T59.4Low63.8Low77 Ų77106.4 Ų106.447%0.47256%0.557SS.*SBendtrans-87.6-20.9-167.652.80000114.7V216 S223V216-T220 PolarHBondContact O-OG1 3.22Å; T220-S223 PolarHBondContact O-OG 2.94Å
221R54Low61.8Low188 Ų188105.4 Ų105.471%0.70957%0.569SS**SBendtrans-88.9-17.4-171.4-68.7-173.3171.6-164.1-3.9115.4S223 V224R221-S223 VanDerWaalsContact C-N 3.31Å; R221-S223 PolarHBondContact O-N 2.89Å; R221-V224 PolarHBondContact O-N 2.86Å
222V49.1Very low59.8Low98 Ų98109.6 Ų109.659%0.59460%0.598SS**THydrogen-bonded Turntrans-72.7-20.9-173.9-1750000113V224V222-V224 VanDerWaalsContact C-N 3.34Å; V222-V224 PolarHBondContact O-N 2.78Å
223S42.9Very low57.8Low97 Ų97110.8 Ų110.868%0.67861%0.614SS**THydrogen-bonded Turntrans-74.9-18.917751.10000114.4T220 R221T220-S223 PolarHBondContact O-OG 2.94Å; R221-S223 VanDerWaalsContact C-N 3.31Å; R221-S223 PolarHBondContact O-N 2.89Å
224V42Very low56.1Low106 Ų106111.4 Ų111.464%0.64262%0.623SS**THydrogen-bonded Turntrans-89.1-20.5-170.7-1770000112.8R221 V222 R226R221-V224 PolarHBondContact O-N 2.86Å; V222-V224 VanDerWaalsContact C-N 3.34Å; V222-V224 PolarHBondContact O-N 2.78Å; V224-R226 VanDerWaalsContact C-N 3.31Å; V224-R226 PolarHBondContact O-N 2.81Å
225Q38.6Very low54.7Low174 Ų174118.8 Ų118.881%0.81367%0.671SS**THydrogen-bonded Turntrans-84.18.9-173.7-70.2-178.5-32.400115.1
226R43.6Very low53.1Low238 Ų238124.2 Ų124.290%0.89870%0.702SS**THydrogen-bonded Turntrans-909.3-179.3-146.6-176.4178177.5-0.2115V224V224-R226 VanDerWaalsContact C-N 3.31Å; V224-R226 PolarHBondContact O-N 2.81Å
227T42.1Very low51.4Low115 Ų115126.4 Ų126.471%0.70671%0.713SS**  trans-137.989.717639.80000111.4
228Q36.3Very low49.6Very low188 Ų188124.9 Ų124.988%0.87972%0.715SS**  trans-177.198.2135.4-99.3163.232.300108.3
229A41.2Very low48Very low94 Ų94129.7 Ų129.778%0.77774%0.742SS**  trans-71.9133153.800000106.7A231A229-A231 PolarHBondContact O-N 3.39Å
230P46.3Very low46.9Very low119 Ų119134.2 Ų134.277%0.77377%0.771SS**  trans-64.2124175.526.7-32.6000108.7V232P230-V232 PolarHBondContact O-N 2.87Å; P230-V232 VanDerWaalsContact O-N 3.1Å
231A48.8Very low46.1Very low99 Ų99138 Ų13882%0.81879%0.791SS**  trans-65.8111.5171.200000108.1A229 A233A229-A231 PolarHBondContact O-N 3.39Å; A231-A233 PolarHBondContact O-N 2.88Å; A231-A233 VanDerWaalsContact O-N 3.1Å
232V48.8Very low45.5Very low127 Ų127134.4 Ų134.477%0.7780%0.797SS**  trans-66.2109.7170.61770000107P230 T234P230-V232 PolarHBondContact O-N 2.87Å; P230-V232 VanDerWaalsContact O-N 3.1Å; V232-T234 PolarHBondContact O-N 3.29Å
233A47.4Very low45.2Very low91 Ų91137.2 Ų137.275%0.75281%0.813SS**  trans-72.6105.4169.700000108.2A231A231-A233 PolarHBondContact O-N 2.88Å; A231-A233 VanDerWaalsContact O-N 3.1Å
234T52.4Low45.4Very low135 Ų135140.6 Ų140.683%0.82882%0.824SS**  trans-81.2121.5164.9-52.40000108V232V232-T234 PolarHBondContact O-N 3.29Å
235T57.7Low45.7Very low201 Ų201143.7 Ų143.7100%1.23384%0.841SS**  trans-100.50167.7-39.30000109.2

Retrieved 235 of 235 residues in 905.4 ms (Link to these results)