A0A077Z3T6_TRITR Loading...

Small ribosomal subunit protein uS12m

AlphaFold DB , UniProt , Accession A0A077Z3T6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 360 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
1M35.2Very low38.4Very low248 Ų248134.5 Ų134.5100%1.22280%0.802SS**  0102.80-79.1179.8150.300108
2S34.7Very low38.6Very low118 Ų118134.4 Ų134.483%0.82579%0.793SS**  trans-158.788.5176.133.60000108.8
3L34.1Very low39.3Very low168 Ų168127.3 Ų127.388%0.8877%0.766SS**  trans-78.6126.8166.2-80155.6000108.5
4P40.2Very low40.1Very low119 Ų119126.6 Ų126.677%0.77376%0.756SS**  trans-84.8118.9168.431-27.5000109.9C6P4-C6 PolarHBondContact O-N 2.99Å; P4-C6 VanDerWaalsContact O-N 3.15Å
5V36.5Very low40.5Very low124 Ų124125.7 Ų125.775%0.75275%0.745SS**  trans-63.6103.1171.11760000108.6T7V5-T7 PolarHBondContact O-N 3.37Å
6C37.9Very low41.3Very low127 Ų127122.9 Ų122.986%0.85873%0.729SS**  trans-71.796.9166.2-97.50000108.7P4 F8P4-C6 PolarHBondContact O-N 2.99Å; P4-C6 VanDerWaalsContact O-N 3.15Å; C6-F8 PolarHBondContact O-N 3.46Å
7T37.1Very low42.1Very low124 Ų124121.2 Ų121.276%0.76172%0.72SS**  trans-64.4127.1178.66.20000111.2V5 C9V5-T7 PolarHBondContact O-N 3.37Å; T7-C9 PolarHBondContact O-N 2.94Å
8F36.3Very low42.4Very low185 Ų185126.6 Ų126.681%0.81173%0.726SS**  trans-64.444.7-176.5-125-103.9000114.8C6 G10C6-F8 PolarHBondContact O-N 3.46Å; F8-G10 PolarHBondContact O-N 3.1Å
9C41Very low42.7Very low112 Ų112127.1 Ų127.176%0.75773%0.725SS**Hα-helixtrans-78.8-12.4-171.7-157.30000114.6T7T7-C9 PolarHBondContact O-N 2.94Å
10G41.3Very low43Very low58 Ų58129.2 Ų129.260%0.59873%0.726SS**Hα-helixtrans-82.2-27.4-173.600000116.1F8F8-G10 PolarHBondContact O-N 3.1Å
11V48.1Very low42.8Very low97 Ų97126.1 Ų126.159%0.58872%0.717SS**Hα-helixtrans-91.7-32.5-168.1-175.70000112.3
12L40.8Very low42.9Very low133 Ų133117.5 Ų117.570%0.69668%0.681SS**Hα-helixtrans-73-33.6-179.5-122.183.6000113.1N14 L15 V16L12-N14 VanDerWaalsContact C-N 3.27Å; L12-N14 PolarHBondContact O-N 3.47Å; L12-L15 PolarHBondContact O-N 3.3Å; L12-L15 VanDerWaalsContact O-N 3.15Å; L12-V16 PolarHBondContact O-N 3.06Å
13G48Very low43.5Very low42 Ų42117.7 Ų117.743%0.43368%0.679SS.*Hα-helixtrans-58.9-37.5-178.400000113.2L15 T17G13-L15 VanDerWaalsContact C-N 3.35Å; G13-L15 PolarHBondContact O-N 3.33Å; G13-T17 PolarHBondContact O-N 2.99Å; G13-T17 PolarHBondContact O-OG1 3.49Å; G13-T17 VanDerWaalsContact O-OG1 3.1Å
14N49.6Very low44Very low117 Ų117119.2 Ų119.263%0.62668%0.679SS**Hα-helixtrans-73.8-23.8-179.3-78.6-25.5000113.8L12 T17L12-N14 VanDerWaalsContact C-N 3.27Å; L12-N14 PolarHBondContact O-N 3.47Å; N14-T17 WeakPolarHBondContact CA-OG1 3.22Å; N14-T17 PolarHBondContact O-OG1 3.4Å; N14-T17 VanDerWaalsContact O-OG1 3.05Å
15L47.3Very low44Very low114 Ų114117.8 Ų117.860%0.59767%0.672SS**Hα-helixtrans-84.6-37.9-177.3-142.4125.9000111.3L12 G13 R18 L19L12-L15 PolarHBondContact O-N 3.3Å; L12-L15 VanDerWaalsContact O-N 3.15Å; G13-L15 VanDerWaalsContact C-N 3.35Å; G13-L15 PolarHBondContact O-N 3.33Å; L15-R18 PolarHBondContact O-N 3Å; L15-L19 HydrophobicContact CD2-CD1 3.97Å; L15-L19 PolarHBondContact O-N 2.89Å
16V53.3Low44.2Very low80 Ų80113.8 Ų113.849%0.48566%0.656SS.*Hα-helixtrans-64.8-40.4175.4-179.40000111L12 R18 L19 F20L12-V16 PolarHBondContact O-N 3.06Å; V16-R18 PolarHBondContact O-N 3.08Å; V16-L19 PolarHBondContact O-N 2.63Å; V16-F20 HydrophobicContact CG1-CD2 3.88Å; V16-F20 HydrophobicContact CG1-CE2 4.19Å; V16-F20 PolarHBondContact O-N 2.78Å
17T53.4Low44.4Very low95 Ų95112.9 Ų112.958%0.58365%0.649SS**Hα-helixtrans-65.5-22.5176.443.40000114.3G13 N14 A21G13-T17 PolarHBondContact O-N 2.99Å; G13-T17 PolarHBondContact O-OG1 3.49Å; G13-T17 VanDerWaalsContact O-OG1 3.1Å; N14-T17 WeakPolarHBondContact CA-OG1 3.22Å; N14-T17 PolarHBondContact O-OG1 3.4Å; N14-T17 VanDerWaalsContact O-OG1 3.05Å; T17-A21 WeakPolarHBondContact O-CB 3.08Å
18R47.5Very low44.6Very low217 Ų217114.6 Ų114.682%0.81965%0.652SS**Hα-helixtrans-88.5-27.2178.5-75.3-171.7178.4-162.51.6113.5L15 V16L15-R18 PolarHBondContact O-N 3Å; V16-R18 PolarHBondContact O-N 3.08Å
19L49.1Very low44.9Very low136 Ų136109 Ų10971%0.71265%0.647SS**Hα-helixtrans-83.6-29.3179.8-73.5170.2000113L15 V16L15-L19 HydrophobicContact CD2-CD1 3.97Å; L15-L19 PolarHBondContact O-N 2.89Å; V16-L19 PolarHBondContact O-N 2.63Å
20F48.1Very low45Very low170 Ų170111.3 Ų111.375%0.74665%0.647SS**SBendtrans-96.5-0.7179.1-74-78.7000114.8V16 S22V16-F20 HydrophobicContact CG1-CD2 3.88Å; V16-F20 HydrophobicContact CG1-CE2 4.19Å; V16-F20 PolarHBondContact O-N 2.78Å; F20-S22 PolarHBondContact O-N 3.25Å
21A39.6Very low45.4Very low64 Ų64113.4 Ų113.453%0.52965%0.652SS.*  trans-75.191.4172.400000109.5T17T17-A21 WeakPolarHBondContact O-CB 3.08Å
22S36.9Very low45.6Very low68 Ų68113 Ų11348%0.47665%0.65SS.*  trans-42.7125.2164.351.80000109.8F20 F24 S25F20-S22 PolarHBondContact O-N 3.25Å; S22-F24 PolarHBondContact O-N 3.03Å; S22-S25 PolarHBondContact O-N 3.47Å; S22-S25 PolarHBondContact O-OG 3Å; S22-S25 PolarHBondContact OG-OG 2.89Å
23P47.3Very low45.8Very low121 Ų121117.2 Ų117.279%0.78666%0.656SS**THydrogen-bonded Turntrans-67.6-2.5-169.925.9-33.8000113.9
24F44.9Very low46.1Very low200 Ų200119.9 Ų119.988%0.87765%0.653SS**THydrogen-bonded Turntrans-103.2-5.4-174.7-130.2-98.5000115.1S22S22-F24 PolarHBondContact O-N 3.03Å
25S39.5Very low46.6Very low89 Ų89122.7 Ų122.762%0.62266%0.66SS**  trans-108.313.218059.40000114.2S22S22-S25 PolarHBondContact O-N 3.47Å; S22-S25 PolarHBondContact O-OG 3Å; S22-S25 PolarHBondContact OG-OG 2.89Å
26G41.2Very low47.8Very low41 Ų41122.4 Ų122.442%0.42366%0.659SS.*SBendtrans-72.7137161.300000109.4L28G26-L28 PolarHBondContact O-N 3.23Å
27P42.1Very low48.6Very low108 Ų108125.4 Ų125.470%0.70167%0.672SS**  trans-72.768.317830.7-32.9000110.3G29P27-G29 PolarHBondContact O-N 3.28Å
28L40.7Very low49.7Very low160 Ų160128 Ų12884%0.83868%0.675SS**THydrogen-bonded Turntrans-7572.8171.2-79.2160.4000108.4G26G26-L28 PolarHBondContact O-N 3.23Å
29G43.3Very low51.1Low68 Ų68121.6 Ų121.670%0.70166%0.655SS**THydrogen-bonded Turntrans157.7-11174.500000116.2P27 S31P27-G29 PolarHBondContact O-N 3.28Å; G29-S31 PolarHBondContact O-N 2.99Å
30Q43.2Very low52.3Low159 Ų159116.9 Ų116.974%0.74363%0.629SS**  trans-73.790167.3-67.9-167.68.700108V32Q30-V32 VanDerWaalsContact C-N 3.31Å; Q30-V32 PolarHBondContact O-N 3.39Å
31S49.6Very low53.6Low102 Ų102116.1 Ų116.171%0.71363%0.628SS**  trans-48.2108.615359.40000105.4G29 R33G29-S31 PolarHBondContact O-N 2.99Å; S31-R33 PolarHBondContact O-N 2.96Å
32V52.3Low55.4Low89 Ų89119 Ų11954%0.53963%0.634SS.*  trans-69.776.2177.1-171.40000106Q30 W34Q30-V32 VanDerWaalsContact C-N 3.31Å; Q30-V32 PolarHBondContact O-N 3.39Å; V32-W34 VanDerWaalsContact C-N 3.31Å; V32-W34 PolarHBondContact O-N 2.8Å
33R44.7Very low57Low222 Ų222124.1 Ų124.184%0.83864%0.643SS**  trans-68.5101.3166.1-175.9175.2-176.1174.30.3103.5S31 K35S31-R33 PolarHBondContact O-N 2.96Å; R33-K35 PolarHBondContact O-N 2.93Å; R33-K35 VanDerWaalsContact O-N 3.08Å
34W54.3Low58.1Low97 Ų97123.1 Ų123.137%0.36765%0.645SS.*  trans-44.3118.3175.5-51.591.5000108.3V32 M40 R43V32-W34 VanDerWaalsContact C-N 3.31Å; V32-W34 PolarHBondContact O-N 2.8Å; W34-M40 HydrophobicContact CD2-CB 4.35Å; W34-M40 HydrophobicContact CD2-CG 4.43Å; W34-M40 HydrophobicContact CE3-CB 3.83Å; W34-M40 HydrophobicContact CE3-CG 4.19Å; W34-M40 HydrophobicContact CZ3-CB 4.15Å; W34-M40 HydrophobicContact CZ3-CG 4.28Å; W34-R43 HydrophobicContact CZ3-CB 4.28Å
35K60.5Low59.4Low176 Ų176114.8 Ų114.877%0.76562%0.615SS**SBendtrans-72.9-45.1177.4-79.2-178.2176.4178.50108.9R33 E39R33-K35 PolarHBondContact O-N 2.93Å; R33-K35 VanDerWaalsContact O-N 3.08Å; K35-E39 PolarHBondContact N-OE2 2.89Å
36N73.3Confident61Low109 Ų109119.9 Ų119.958%0.58362%0.62SS**  trans-136.7153.5-175.9-67.2-22.6000113.6F38 E39 M40N36-F38 PolarHBondContact O-N 3.25Å; N36-E39 PolarHBondContact O-N 3.49Å; N36-M40 PolarHBondContact O-N 3.12Å
37L69.3Low62.6Low142 Ų142122.3 Ų122.374%0.74363%0.629SS**Hα-helixtrans-56.4-32.5175.2-164.885.5000112.4M40 H41L37-M40 HydrophobicContact CD1-CE 3.72Å; L37-M40 HydrophobicContact CG-CE 4.35Å; L37-M40 WeakPolarHBondContact O-CB 3.5Å; L37-M40 PolarHBondContact O-N 3.38Å; L37-H41 PolarHBondContact O-N 3.49Å
38F76.6Confident64.3Low151 Ų151127 Ų12766%0.66264%0.638SS**Hα-helixtrans-64.1-43.8179.9-162.2-100.4000112.4N36 M40 H41 L42N36-F38 PolarHBondContact O-N 3.25Å; F38-M40 VanDerWaalsContact C-N 3.25Å; F38-M40 PolarHBondContact O-N 3.2Å; F38-H41 PolarHBondContact O-N 2.95Å; F38-H41 VanDerWaalsContact O-N 3.12Å; F38-L42 HydrophobicContact CD1-CD1 3.7Å; F38-L42 HydrophobicContact CD1-CG 4.19Å; F38-L42 HydrophobicContact CE1-CD1 3.65Å; F38-L42 HydrophobicContact CE1-CD2 4.39Å; F38-L42 HydrophobicContact CE1-CG 4.1Å; F38-L42 WeakPolarHBondContact O-CG 3.28Å; F38-L42 PolarHBondContact O-N 3.35Å
39E76.1Confident66.2Low82 Ų82130.2 Ų130.238%0.38364%0.639SS.*Hα-helixtrans-62.3-35.5175-67.2-179.6159.500111.9K35 N36 R43K35-E39 PolarHBondContact N-OE2 2.89Å; N36-E39 PolarHBondContact O-N 3.49Å; E39-R43 PolarHBondContact O-N 3.03Å
40M75.6Confident68Low36 Ų36137.8 Ų137.818%0.17765%0.647CS.*Hα-helixtrans-67-38.7175.7-171.3-172.569.800111.3W34 N36 L37 F38 G45 R46W34-M40 HydrophobicContact CD2-CB 4.35Å; W34-M40 HydrophobicContact CD2-CG 4.43Å; W34-M40 HydrophobicContact CE3-CB 3.83Å; W34-M40 HydrophobicContact CE3-CG 4.19Å; W34-M40 HydrophobicContact CZ3-CB 4.15Å; W34-M40 HydrophobicContact CZ3-CG 4.28Å; N36-M40 PolarHBondContact O-N 3.12Å; L37-M40 HydrophobicContact CD1-CE 3.72Å; L37-M40 HydrophobicContact CG-CE 4.35Å; L37-M40 WeakPolarHBondContact O-CB 3.5Å; L37-M40 PolarHBondContact O-N 3.38Å; F38-M40 VanDerWaalsContact C-N 3.25Å; F38-M40 PolarHBondContact O-N 3.2Å; M40-G45 VanDerWaalsContact O-CA 3.24Å; M40-G45 WeakPolarHBondContact O-CA 3.21Å; M40-G45 PolarHBondContact O-N 3.46Å; M40-R46 HydrophobicContact CE-CG 4.4Å; M40-R46 HydrophobicContact SD-CG 3.51Å; M40-R46 VanDerWaalsContact SD-CG 3.51Å
41H75.3Confident69.8Low155 Ų155136.2 Ų136.272%0.71865%0.65SS**Hα-helixtrans-67.9-44177.2-161.480.8000111.7L37 F38 R43 A44L37-H41 PolarHBondContact O-N 3.49Å; F38-H41 PolarHBondContact O-N 2.95Å; F38-H41 VanDerWaalsContact O-N 3.12Å; H41-R43 PolarHBondContact O-N 3.32Å; H41-A44 PolarHBondContact O-N 3.26Å
42L77.3Confident71Confident125 Ų125139.1 Ų139.165%0.65465%0.652SS**Hα-helixtrans-61.1-29.7177.2-71.1173.4000113.5F38F38-L42 HydrophobicContact CD1-CD1 3.7Å; F38-L42 HydrophobicContact CD1-CG 4.19Å; F38-L42 HydrophobicContact CE1-CD1 3.65Å; F38-L42 HydrophobicContact CE1-CD2 4.39Å; F38-L42 HydrophobicContact CE1-CG 4.1Å; F38-L42 WeakPolarHBondContact O-CG 3.28Å; F38-L42 PolarHBondContact O-N 3.35Å
43R69.7Low72Confident175 Ų175139.6 Ų139.666%0.6666%0.657SS**THydrogen-bonded Turntrans-94.826.1179.6-68.8-171.7179.9-166.31.2114.3W34 E39 H41 G45W34-R43 HydrophobicContact CZ3-CB 4.28Å; E39-R43 PolarHBondContact O-N 3.03Å; H41-R43 PolarHBondContact O-N 3.32Å; R43-G45 PolarHBondContact O-N 2.96Å
44A70.2Confident73.5Confident100 Ų100137 Ų13783%0.82665%0.652SS**THydrogen-bonded Turntrans66.828.3178.800000115.4H41H41-A44 PolarHBondContact O-N 3.26Å
45G72.9Confident74.9Confident25 Ų25134.5 Ų134.526%0.25865%0.65SS.*SBendtrans86-168.4170.700000114.8M40 R43M40-G45 VanDerWaalsContact O-CA 3.24Å; M40-G45 WeakPolarHBondContact O-CA 3.21Å; M40-G45 PolarHBondContact O-N 3.46Å; R43-G45 PolarHBondContact O-N 2.96Å
46R73.1Confident76.1Confident195 Ų195127.2 Ų127.274%0.73662%0.621SS**SBendtrans-61.5139-178.6-69-178.8178.1177.2-0.5110M40 K48M40-R46 HydrophobicContact CE-CG 4.4Å; M40-R46 HydrophobicContact SD-CG 3.51Å; M40-R46 VanDerWaalsContact SD-CG 3.51Å; R46-K48 PolarHBondContact O-N 3.28Å
47P74.2Confident76.8Confident92 Ų92122.1 Ų122.160%0.59759%0.593SS**PPolyproline II helixtrans-57138173.124.3-33000109.7R49P47-R49 PolarHBondContact O-N 3.18Å
48K79Confident77.6Confident207 Ų207117.2 Ų117.290%0.957%0.571SS**PPolyproline II helixtrans-54.3126.9176.1-71.2-177.4179.9177.40108.7R46 R50R46-K48 PolarHBondContact O-N 3.28Å; K48-R50 PolarHBondContact O-N 3Å
49R79.4Confident78Confident227 Ų227113.1 Ų113.186%0.85757%0.572SS**PPolyproline II helixtrans-58.3134.5175.5-72.8-178.6173.6173.9-1.8108.5P47P47-R49 PolarHBondContact O-N 3.18Å
50R82.1Confident78.7Confident227 Ų227114.1 Ų114.186%0.85758%0.576SS**PPolyproline II helixtrans-59139173.3-65.5-178-177.7-179.60.3109.1K48 Q52K48-R50 PolarHBondContact O-N 3Å; R50-Q52 PolarHBondContact O-N 2.69Å
51P80.1Confident79.5Confident126 Ų126117 Ų11782%0.81860%0.597SS**PPolyproline II helixtrans-60.2133.3175.724.3-32.3000109.9
52Q75Confident80.5Confident163 Ų163114.6 Ų114.676%0.76259%0.586SS**PPolyproline II helixtrans-74.3144.9178.1-63.9-64.7-21.100110.2R50 K54R50-Q52 PolarHBondContact O-N 2.69Å; Q52-K54 PolarHBondContact O-N 2.84Å
53P73.8Confident81.3Confident99 Ų99109.1 Ų109.164%0.64356%0.558SS**PPolyproline II helixtrans-63.1124.1178.525.4-32.9000110
54K76.7Confident82.6Confident167 Ų167106.5 Ų106.573%0.72655%0.548SS*.PPolyproline II helixtrans-59.2148179-65.9-177.9179.9-178.70110.4Q52Q52-K54 PolarHBondContact O-N 2.84Å
55S82.5Confident83.9Confident46 Ų46101.9 Ų101.932%0.32251%0.509SS..PPolyproline II helixtrans-56.5159.216865.80000109.6I57 S58S55-I57 PolarHBondContact O-N 3.45Å; S55-I57 VanDerWaalsContact O-N 3.11Å; S55-S58 PolarHBondContact O-N 2.85Å
56P85.9Confident85Confident23 Ų23103.1 Ų103.115%0.14951%0.512CS..THydrogen-bonded Turntrans-65.9-17.8-179.7-15.228.5000113.6S58 L90 T96 I128P56-S58 PolarHBondContact O-N 3.01Å; P56-L90 HydrophobicContact CB-CD1 4.41Å; P56-T96 HydrophobicContact CB-CG2 3.25Å; P56-T96 HydrophobicContact CG-CG2 3.69Å; P56-I128 HydrophobicContact CB-CD1 3.5Å; P56-I128 VanDerWaalsContact CB-CD1 3.5Å; P56-I128 HydrophobicContact CB-CG1 4.44Å; P56-I128 HydrophobicContact CG-CD1 3.48Å; P56-I128 VanDerWaalsContact CG-CD1 3.48Å; P56-I128 HydrophobicContact CG-CG1 3.91Å
57I88.7Confident86Confident1 Ų193.9 Ų93.91%0.00548%0.477CS..THydrogen-bonded Turntrans-76.21.3171.1-60.6163.3000112.5S55 G59 H60 M63 V115 I128S55-I57 PolarHBondContact O-N 3.45Å; S55-I57 VanDerWaalsContact O-N 3.11Å; I57-G59 PolarHBondContact O-N 3.09Å; I57-H60 HydrophobicContact CG2-CB 3.56Å; I57-H60 WeakPolarHBondContact CG2-O 2.84Å; I57-H60 PolarHBondContact O-N 3.25Å; I57-H60 PolarHBondContact O-ND1 3.34Å; I57-M63 HydrophobicContact CB-CE 4.15Å; I57-M63 HydrophobicContact CG1-CB 4.45Å; I57-M63 HydrophobicContact CG1-CE 4.06Å; I57-M63 HydrophobicContact CG2-CB 3.83Å; I57-M63 HydrophobicContact CG2-CE 4Å; I57-M63 HydrophobicContact CG2-SD 4.3Å; I57-V115 HydrophobicContact CD1-CG1 4.46Å; I57-I128 HydrophobicContact CD1-CD1 4.43Å; I57-I128 HydrophobicContact CD1-CG2 3.39Å; I57-I128 HydrophobicContact CG1-CD1 4.08Å; I57-I128 HydrophobicContact CG1-CG2 4.13Å
58S85.5Confident86.9Confident39 Ų3991.9 Ų91.927%0.27346%0.461SS..THydrogen-bonded Turntrans57.721.2176.3-55.30000114.7S55 P56 K94S55-S58 PolarHBondContact O-N 2.85Å; P56-S58 PolarHBondContact O-N 3.01Å; S58-K94 PolarHBondContact OG-NZ 3.42Å; S58-K94 VanDerWaalsContact OG-NZ 3.15Å
59G84.9Confident87.4Confident66 Ų6686.7 Ų86.768%0.6844%0.439SS*.THydrogen-bonded Turntrans102.8-8.1178.500000115.9I57I57-G59 PolarHBondContact O-N 3.09Å
60H90.9Very high88Confident102 Ų10278 Ų7847%0.47241%0.41SS..  trans-69.7146.9174.5-49.781.3000111.1I57I57-H60 HydrophobicContact CG2-CB 3.56Å; I57-H60 WeakPolarHBondContact CG2-O 2.84Å; I57-H60 PolarHBondContact O-N 3.25Å; I57-H60 PolarHBondContact O-ND1 3.34Å
61P93.1Very high88.3Confident96 Ų9669.2 Ų69.262%0.62338%0.38SS*.SBendtrans-66.2-50.6179.323.9-32.3000112.1E116P61-E116 WeakPolarHBondContact O-CB 3.25Å
62Q94.9Very high88.9Confident105 Ų10568.2 Ų68.249%0.49137%0.367SS..EExtended strand (participates in β ladder)trans-129.6156.3171.459.5-93.3-500110.6L114 V115 I131Q62-L114 HydrophobicContact CB-CD1 4.1Å; Q62-L114 HydrophobicContact CB-CD2 4.31Å; Q62-L114 HydrophobicContact CB-CG 4.18Å; Q62-L114 HydrophobicContact CG-CD1 4.16Å; Q62-L114 HydrophobicContact CG-CD2 4.26Å; Q62-L114 HydrophobicContact CG-CG 4.49Å; Q62-V115 CarbonylContact C-O 3.49Å; Q62-V115 VanDerWaalsContact CA-O 3.3Å; Q62-V115 WeakPolarHBondContact CA-O 3.47Å; Q62-I131 HydrophobicContact CB-CD1 4.48Å
63M95.7Very high89.7Confident11 Ų1163.3 Ų63.35%0.05434%0.343CS..EExtended strand (participates in β ladder)trans-148.2143.9175.5-162.8163.558.300111I57 L90 T91 N92 V115I57-M63 HydrophobicContact CB-CE 4.15Å; I57-M63 HydrophobicContact CG1-CB 4.45Å; I57-M63 HydrophobicContact CG1-CE 4.06Å; I57-M63 HydrophobicContact CG2-CB 3.83Å; I57-M63 HydrophobicContact CG2-CE 4Å; I57-M63 HydrophobicContact CG2-SD 4.3Å; M63-L90 HydrophobicContact CE-CB 3.39Å; M63-L90 HydrophobicContact CE-CD1 3.42Å; M63-L90 VanDerWaalsContact CE-CD1 3.42Å; M63-L90 HydrophobicContact CE-CD2 3.71Å; M63-L90 HydrophobicContact CE-CG 3.62Å; M63-T91 WeakPolarHBondContact CG-OG1 3.31Å; M63-T91 PolarHBondContact SD-OG1 2.95Å; M63-T91 VanDerWaalsContact SD-OG1 3.4Å; M63-N92 HydrophobicContact CE-CB 4.45Å; M63-N92 HydrophobicContact SD-CB 4.35Å; M63-N92 PolarHBondContact SD-ND2 3.36Å; M63-N92 PolarHBondContact SD-OD1 3.29Å; M63-N92 VanDerWaalsContact SD-OD1 3.4Å; M63-V115 PolarHBondContact N-O 3.14Å; M63-V115 WeakPolarHBondContact O-CB 3.15Å; M63-V115 PolarHBondContact O-N 2.78Å
64R96.9Very high90.5Very high120 Ų12065.7 Ų65.745%0.45334%0.343SS..EExtended strand (participates in β ladder)trans-75.5147.2174.1-175.7173.3175.2-162-1.4109.5T91 Q112 V113 L135R64-T91 HydrophobicContact CB-CG2 4.03Å; R64-T91 PolarHBondContact O-N 2.96Å; R64-T91 VanDerWaalsContact O-N 3.16Å; R64-Q112 VanDerWaalsContact NH2-NE2 3.14Å; R64-V113 WeakPolarHBondContact CA-O 3.36Å; R64-L135 HydrophobicContact CG-CD1 3.98Å
65G96.1Very high91.3Very high2 Ų258.6 Ų58.62%0.02131%0.314CS..EExtended strand (participates in β ladder)trans-149.1158.8170.300000111.6R89 V113G65-R89 CarbonylContact C-O 3.41Å; G65-R89 WeakPolarHBondContact CA-O 3.37Å; G65-V113 PolarHBondContact N-O 3.38Å; G65-V113 WeakPolarHBondContact O-CG2 3.46Å; G65-V113 PolarHBondContact O-N 3.41Å
66V96.8Very high91.8Very high52 Ų5261.1 Ų61.132%0.31532%0.32SS..EExtended strand (participates in β ladder)trans-103.2130.5175-179.80000107.9L68 V88 R89V66-L68 PolarHBondContact O-N 3.09Å; V66-V88 CarbonylContact O-C 3.6Å; V66-V88 WeakPolarHBondContact O-CA 3.43Å; V66-R89 PolarHBondContact N-O 3.13Å; V66-R89 PolarHBondContact O-N 3.16Å
67V94.8Very high91.9Very high0 Ų069.7 Ų69.70%036%0.355CS..EExtended strand (participates in β ladder)trans-67.7122.7174.1173.30000108.8V86 V88 L107 Q108 H110 S111 V113V67-V86 HydrophobicContact CB-CG1 3.74Å; V67-V86 HydrophobicContact CG1-CG1 3.14Å; V67-V86 HydrophobicContact CG2-CG1 3.44Å; V67-V86 VanDerWaalsContact CG2-CG1 3.44Å; V67-V88 HydrophobicContact CG2-CG2 4.44Å; V67-L107 HydrophobicContact CG2-CD1 4.44Å; V67-Q108 WeakPolarHBondContact CB-O 3.32Å; V67-Q108 WeakPolarHBondContact CG1-O 3.14Å; V67-H110 VanDerWaalsContact O-CA 3.26Å; V67-H110 WeakPolarHBondContact O-CA 3.48Å; V67-H110 PolarHBondContact O-N 3.42Å; V67-S111 WeakPolarHBondContact CB-O 3.35Å; V67-S111 VanDerWaalsContact CG2-O 3.31Å; V67-S111 WeakPolarHBondContact CG2-O 3.23Å; V67-S111 PolarHBondContact N-O 2.99Å; V67-V113 HydrophobicContact CG2-CG1 3.84Å; V67-V113 HydrophobicContact CG2-CG2 3.97Å
68L92.4Very high92.1Very high51 Ų5175.4 Ų75.427%0.26739%0.392SS..EExtended strand (participates in β ladder)trans-87-45.3169.3-62.9-179.1000110.2V66 L87 R89 E95V66-L68 PolarHBondContact O-N 3.09Å; L68-L87 HydrophobicContact CB-CD2 3.63Å; L68-L87 HydrophobicContact CD1-CD2 3.33Å; L68-L87 HydrophobicContact CG-CD2 3.91Å; L68-L87 PolarHBondContact N-O 3.39Å; L68-R89 HydrophobicContact CD1-CB 3.97Å; L68-R89 HydrophobicContact CD2-CB 4.2Å; L68-R89 HydrophobicContact CG-CB 4.03Å; L68-E95 HydrophobicContact CD1-CG 3.99Å
69K89.2Confident92.4Very high97 Ų9777 Ų7742%0.42240%0.397SS..EExtended strand (participates in β ladder)trans-156.1148.1177.856.7179.1175-177.20113L71 V86 L87K69-L71 HydrophobicContact CD-CD2 3.75Å; K69-L71 HydrophobicContact CD-CG 4.37Å; K69-L71 HydrophobicContact CG-CD2 4.01Å; K69-L71 HydrophobicContact CG-CG 4.13Å; K69-V86 WeakPolarHBondContact O-CA 3.35Å; K69-V86 WeakPolarHBondContact O-CG1 3.34Å; K69-L87 HydrophobicContact CG-CB 3.73Å; K69-L87 PolarHBondContact N-O 3.03Å; K69-L87 PolarHBondContact O-N 3.16Å
70V91.6Very high92.5Very high44 Ų4479.1 Ų79.127%0.26740%0.401SS..EExtended strand (participates in β ladder)trans-81.6130.1169.9-178.90000109H105 L107V70-H105 WeakPolarHBondContact CG1-NE2 3.41Å; V70-L107 WeakPolarHBondContact CG2-O 3.41Å
71L89.9Confident92.4Very high43 Ų4376.7 Ų76.723%0.22540%0.399CS..EExtended strand (participates in β ladder)trans-123.3144-176.5-66.3179.7000111.3K69 C85 L87 V97K69-L71 HydrophobicContact CD-CD2 3.75Å; K69-L71 HydrophobicContact CD-CG 4.37Å; K69-L71 HydrophobicContact CG-CD2 4.01Å; K69-L71 HydrophobicContact CG-CG 4.13Å; L71-C85 CarbonylContact C-O 3.55Å; L71-C85 HydrophobicContact CB-CB 4.35Å; L71-C85 PolarHBondContact N-O 3.08Å; L71-C85 CarbonylContact O-C 3.13Å; L71-C85 WeakPolarHBondContact O-CA 3.34Å; L71-C85 PolarHBondContact O-N 2.88Å; L71-L87 HydrophobicContact CD1-CB 3.9Å; L71-L87 HydrophobicContact CD1-CD1 4.25Å; L71-L87 HydrophobicContact CG-CB 4.46Å; L71-V97 HydrophobicContact CD1-CG2 4.19Å
72I92.6Very high92.3Very high106 Ų10676.3 Ų76.354%0.54439%0.392SS..EExtended strand (participates in β ladder)trans-107.9112.1167-59.3175.1000107.8N82 R83I72-N82 HydrophobicContact CG2-CB 3.59Å; I72-R83 WeakPolarHBondContact CA-O 3.49Å
73K90.2Very high92.2Very high60 Ų6075.1 Ų75.126%0.26138%0.383SS..EExtended strand (participates in β ladder)trans-98.7136.7176.2-73.6-169.6167.4-174.40110.9R83 V97 L123 V126K73-R83 PolarHBondContact N-O 3.16Å; K73-R83 PolarHBondContact O-N 2.78Å; K73-R83 VanDerWaalsContact O-N 3.1Å; K73-V97 HydrophobicContact CD-CG1 4.14Å; K73-L123 HydrophobicContact CB-CD2 3.7Å; K73-V126 HydrophobicContact CD-CG2 3.96Å
74K91.2Very high92.1Very high148 Ų14878.4 Ų78.464%0.64340%0.397SS*.PPolyproline II helixtrans-75.4133.9169.4-63.9-67-174.9172.50109.7N82K74-N82 VanDerWaalsContact CD-OD1 3.27Å; K74-N82 WeakPolarHBondContact CD-OD1 3.33Å; K74-N82 WeakPolarHBondContact CE-OD1 3.41Å; K74-N82 PolarHBondContact NZ-OD1 3.16Å
75P93.3Very high92Very high18 Ų1872.7 Ų72.712%0.11738%0.376CS..PPolyproline II helixtrans-73.5166.3177.732.5-36.9000112.1N79 A81 D122P75-N79 HydrophobicContact CB-CB 4.14Å; P75-N79 HydrophobicContact CG-CB 3.95Å; P75-N79 WeakPolarHBondContact CG-O 3.47Å; P75-A81 WeakPolarHBondContact CD-O 3.45Å; P75-A81 VanDerWaalsContact CG-O 3.31Å; P75-A81 WeakPolarHBondContact CG-O 3.38Å; P75-D122 CarbonylContact C-O 3.32Å; P75-D122 HydrophobicContact CB-CB 3.94Å
76K93Very high91.9Very high100 Ų10072.6 Ų72.644%0.43538%0.375SS..PPolyproline II helixtrans-61.5140.9166.3-70.3179176.2-167.90110.1N79 D122K76-N79 PolarHBondContact O-N 2.93Å; K76-D122 WeakPolarHBondContact CG-O 3.04Å; K76-D122 PolarHBondContact N-O 3.37Å
77K87.9Confident91.9Very high203 Ų20371.7 Ų71.788%0.88337%0.368SS*.THydrogen-bonded Turntrans-54119.9165-166.8173.6-175.5179.60107.1
78P94.2Very high91.9Very high120 Ų12071.7 Ų71.778%0.77937%0.368SS*.THydrogen-bonded Turncis-101-10.142.536.5-38.1000116.6
79N91.4Very high92.1Very high74 Ų7475.6 Ų75.640%0.39638%0.379SS..  trans-83148.6-174.8-66.7-32.7000110.9P75 K76 D122P75-N79 HydrophobicContact CB-CB 4.14Å; P75-N79 HydrophobicContact CG-CB 3.95Å; P75-N79 WeakPolarHBondContact CG-O 3.47Å; K76-N79 PolarHBondContact O-N 2.93Å; N79-D122 PolarHBondContact ND2-OD1 2.91Å
80S87.4Confident92.5Very high109 Ų10971.2 Ų71.276%0.76236%0.36SS*.  trans-116.3-16.6178.659.50000114.3
81A88.8Confident92.6Very high52 Ų5273.8 Ų73.843%0.4338%0.376SS..  trans-67.9133.2-174.300000113.4P75 R83P75-A81 WeakPolarHBondContact CD-O 3.45Å; P75-A81 VanDerWaalsContact CG-O 3.31Å; P75-A81 WeakPolarHBondContact CG-O 3.38Å; A81-R83 PolarHBondContact O-N 3.03Å
82N90.8Very high92.7Very high88 Ų8875 Ų7547%0.47138%0.382SS..  trans-61.5132176-75.6-14.5000111.9I72 K74I72-N82 HydrophobicContact CG2-CB 3.59Å; K74-N82 VanDerWaalsContact CD-OD1 3.27Å; K74-N82 WeakPolarHBondContact CD-OD1 3.33Å; K74-N82 WeakPolarHBondContact CE-OD1 3.41Å; K74-N82 PolarHBondContact NZ-OD1 3.16Å
83R93Very high92.6Very high80 Ų8071.8 Ų71.830%0.30238%0.376SS..EExtended strand (participates in β ladder)trans-106.8127.8176.8-58.2-56.3-163.8-167.6-0.8110.6I72 K73 A81 D122 L123I72-R83 WeakPolarHBondContact CA-O 3.49Å; K73-R83 PolarHBondContact N-O 3.16Å; K73-R83 PolarHBondContact O-N 2.78Å; K73-R83 VanDerWaalsContact O-N 3.1Å; A81-R83 PolarHBondContact O-N 3.03Å; R83-D122 IonicContact CZ-OD2 3.18Å; R83-D122 IonicContact NE-OD2 3.57Å; R83-D122 PolarHBondContact NE-OD2 2.9Å; R83-D122 IonicContact NH2-OD2 2.72Å; R83-D122 PolarHBondContact NH2-OD2 3.31Å; R83-L123 HydrophobicContact CB-CD1 3.96Å; R83-L123 HydrophobicContact CB-CD2 4.14Å; R83-L123 HydrophobicContact CB-CG 4.43Å; R83-L123 HydrophobicContact CG-CD1 4.37Å; R83-L123 HydrophobicContact CG-CD2 4.14Å; R83-L123 HydrophobicContact CG-CG 4.39Å
84K93.1Very high92.7Very high80 Ų8073.8 Ų73.835%0.34839%0.385SS..EExtended strand (participates in β ladder)trans-78120.9176.6-59.2-175178.1-167.20109.5I100 H105 I175K84-I100 HydrophobicContact CB-CD1 4.32Å; K84-I100 PolarHBondContact O-N 3.45Å; K84-I100 VanDerWaalsContact O-N 3.11Å; K84-H105 WeakPolarHBondContact CD-ND1 3.44Å; K84-I175 VanDerWaalsContact NZ-CG2 3.34Å
85C93.5Very high92.9Very high0 Ų072.1 Ų72.10%038%0.379CS..EExtended strand (participates in β ladder)trans-132.4168.7-178-67.40000109.9L71 V97 A98 L123L71-C85 CarbonylContact C-O 3.55Å; L71-C85 HydrophobicContact CB-CB 4.35Å; L71-C85 PolarHBondContact N-O 3.08Å; L71-C85 CarbonylContact O-C 3.13Å; L71-C85 WeakPolarHBondContact O-CA 3.34Å; L71-C85 PolarHBondContact O-N 2.88Å; C85-V97 HydrophobicContact CB-CG1 3.7Å; C85-A98 CarbonylContact C-O 3.5Å; C85-A98 VanDerWaalsContact CA-O 3.26Å; C85-A98 WeakPolarHBondContact CA-O 3.43Å; C85-A98 WeakPolarHBondContact CB-O 3.44Å; C85-L123 WeakPolarHBondContact SG-CD1 3.23Å
86V95.2Very high93Very high0 Ų072.6 Ų72.60%038%0.382CS..EExtended strand (participates in β ladder)trans-140.5134.6179.3-1700000108.5V67 K69 V88 V97 A98 I100 L107V67-V86 HydrophobicContact CB-CG1 3.74Å; V67-V86 HydrophobicContact CG1-CG1 3.14Å; V67-V86 HydrophobicContact CG2-CG1 3.44Å; V67-V86 VanDerWaalsContact CG2-CG1 3.44Å; K69-V86 WeakPolarHBondContact O-CA 3.35Å; K69-V86 WeakPolarHBondContact O-CG1 3.34Å; V86-V88 HydrophobicContact CB-CG2 4.03Å; V86-V88 HydrophobicContact CG1-CG2 3.81Å; V86-V97 CarbonylContact O-C 3.51Å; V86-V97 WeakPolarHBondContact O-CA 3.45Å; V86-A98 PolarHBondContact N-O 3.43Å; V86-A98 PolarHBondContact O-N 3.4Å; V86-I100 HydrophobicContact CG2-CD1 3.47Å; V86-I100 VanDerWaalsContact CG2-CD1 3.47Å; V86-I100 HydrophobicContact CG2-CG1 3.65Å; V86-L107 HydrophobicContact CG2-CD1 3.81Å
87L96.1Very high93.1Very high32 Ų3268.9 Ų68.917%0.16837%0.367CS..EExtended strand (participates in β ladder)trans-84.3116.7168.3-166.7140.4000107.6L68 K69 L71 V97L68-L87 HydrophobicContact CB-CD2 3.63Å; L68-L87 HydrophobicContact CD1-CD2 3.33Å; L68-L87 HydrophobicContact CG-CD2 3.91Å; L68-L87 PolarHBondContact N-O 3.39Å; K69-L87 HydrophobicContact CG-CB 3.73Å; K69-L87 PolarHBondContact N-O 3.03Å; K69-L87 PolarHBondContact O-N 3.16Å; L71-L87 HydrophobicContact CD1-CB 3.9Å; L71-L87 HydrophobicContact CD1-CD1 4.25Å; L71-L87 HydrophobicContact CG-CB 4.46Å; L87-V97 HydrophobicContact CD1-CG2 4.32Å
88V96Very high93.5Very high0 Ų059.2 Ų59.20%033%0.325CS..EExtended strand (participates in β ladder)trans-119.2127.1-171178.10000109V66 V67 V86 L90 E95 T96 A98 V113 V115V66-V88 CarbonylContact O-C 3.6Å; V66-V88 WeakPolarHBondContact O-CA 3.43Å; V67-V88 HydrophobicContact CG2-CG2 4.44Å; V86-V88 HydrophobicContact CB-CG2 4.03Å; V86-V88 HydrophobicContact CG1-CG2 3.81Å; V88-L90 HydrophobicContact CG1-CD2 4.06Å; V88-E95 WeakPolarHBondContact O-CA 3.16Å; V88-T96 PolarHBondContact N-O 2.73Å; V88-T96 PolarHBondContact O-N 3.36Å; V88-A98 HydrophobicContact CG2-CB 4.29Å; V88-V113 HydrophobicContact CG1-CG2 3.95Å; V88-V113 HydrophobicContact CG2-CG2 3.91Å; V88-V115 HydrophobicContact CG1-CG2 4.36Å
89R96.6Very high93.6Very high134 Ų13455.3 Ų55.351%0.50630%0.295SS..EExtended strand (participates in β ladder)trans-85.8113.3165.3-174.3173178.6-172.8-1.2108.6G65 V66 L68 E95G65-R89 CarbonylContact C-O 3.41Å; G65-R89 WeakPolarHBondContact CA-O 3.37Å; V66-R89 PolarHBondContact N-O 3.13Å; V66-R89 PolarHBondContact O-N 3.16Å; L68-R89 HydrophobicContact CD1-CB 3.97Å; L68-R89 HydrophobicContact CD2-CB 4.2Å; L68-R89 HydrophobicContact CG-CB 4.03Å; R89-E95 HydrophobicContact CB-CG 4.18Å; R89-E95 HydrophobicContact CG-CG 4.17Å
90L95.9Very high93.7Very high5 Ų552.3 Ų52.33%0.02628%0.279CS..EExtended strand (participates in β ladder)trans-77160.6-179.9-65.1169.8000110.8P56 M63 V88 N92 G93 K94 T96 V115 I128P56-L90 HydrophobicContact CB-CD1 4.41Å; M63-L90 HydrophobicContact CE-CB 3.39Å; M63-L90 HydrophobicContact CE-CD1 3.42Å; M63-L90 VanDerWaalsContact CE-CD1 3.42Å; M63-L90 HydrophobicContact CE-CD2 3.71Å; M63-L90 HydrophobicContact CE-CG 3.62Å; V88-L90 HydrophobicContact CG1-CD2 4.06Å; L90-N92 PolarHBondContact O-N 2.86Å; L90-N92 VanDerWaalsContact O-N 3.11Å; L90-G93 WeakPolarHBondContact O-CA 3.43Å; L90-G93 PolarHBondContact O-N 3.47Å; L90-K94 VanDerWaalsContact CB-O 3.31Å; L90-K94 WeakPolarHBondContact CB-O 3.35Å; L90-K94 PolarHBondContact N-O 3.17Å; L90-T96 WeakPolarHBondContact CD1-OG1 3.24Å; L90-V115 HydrophobicContact CD2-CB 4.44Å; L90-V115 HydrophobicContact CD2-CG1 4.42Å; L90-I128 HydrophobicContact CD1-CD1 4.31Å
91T94.8Very high94Very high97 Ų9748.7 Ų48.760%0.59525%0.253SS*.THydrogen-bonded Turntrans-56.8-26.4174.149.40000113.3M63 R64 G93M63-T91 WeakPolarHBondContact CG-OG1 3.31Å; M63-T91 PolarHBondContact SD-OG1 2.95Å; M63-T91 VanDerWaalsContact SD-OG1 3.4Å; R64-T91 HydrophobicContact CB-CG2 4.03Å; R64-T91 PolarHBondContact O-N 2.96Å; R64-T91 VanDerWaalsContact O-N 3.16Å; T91-G93 PolarHBondContact O-N 2.92Å; T91-G93 VanDerWaalsContact O-N 3.12Å
92N91.6Very high94Very high68 Ų6849 Ų4936%0.36426%0.261SS..THydrogen-bonded Turntrans-71.13.2173.6-65.4-9.5000113.9M63 L90 K94M63-N92 HydrophobicContact CE-CB 4.45Å; M63-N92 HydrophobicContact SD-CB 4.35Å; M63-N92 PolarHBondContact SD-ND2 3.36Å; M63-N92 PolarHBondContact SD-OD1 3.29Å; M63-N92 VanDerWaalsContact SD-OD1 3.4Å; L90-N92 PolarHBondContact O-N 2.86Å; L90-N92 VanDerWaalsContact O-N 3.11Å; N92-K94 PolarHBondContact O-N 3.34Å; N92-K94 VanDerWaalsContact O-N 3.12Å
93G91.6Very high93.7Very high40 Ų4053.1 Ų53.141%0.41228%0.278SS..SBendtrans76.2-13.6-172.800000114.5L90 T91L90-G93 WeakPolarHBondContact O-CA 3.43Å; L90-G93 PolarHBondContact O-N 3.47Å; T91-G93 PolarHBondContact O-N 2.92Å; T91-G93 VanDerWaalsContact O-N 3.12Å
94K92.3Very high93.2Very high101 Ų10150 Ų5044%0.43927%0.27SS..  trans-70.4131.8178.4-67.9-178.4-179173.80111.6S58 L90 N92S58-K94 PolarHBondContact OG-NZ 3.42Å; S58-K94 VanDerWaalsContact OG-NZ 3.15Å; L90-K94 VanDerWaalsContact CB-O 3.31Å; L90-K94 WeakPolarHBondContact CB-O 3.35Å; L90-K94 PolarHBondContact N-O 3.17Å; N92-K94 PolarHBondContact O-N 3.34Å; N92-K94 VanDerWaalsContact O-N 3.12Å
95E95.4Very high92.9Very high114 Ų11447.3 Ų47.353%0.53326%0.259SS..EExtended strand (participates in β ladder)trans-95.7127.5173.7-64-178.6-175.500110.6L68 V88 R89L68-E95 HydrophobicContact CD1-CG 3.99Å; V88-E95 WeakPolarHBondContact O-CA 3.16Å; R89-E95 HydrophobicContact CB-CG 4.18Å; R89-E95 HydrophobicContact CG-CG 4.17Å
96T94.5Very high92.6Very high27 Ų2750.6 Ų50.617%0.16628%0.276CS..EExtended strand (participates in β ladder)trans-146155.9178.151.40000113.1P56 V88 L90 I128P56-T96 HydrophobicContact CB-CG2 3.25Å; P56-T96 HydrophobicContact CG-CG2 3.69Å; V88-T96 PolarHBondContact N-O 2.73Å; V88-T96 PolarHBondContact O-N 3.36Å; L90-T96 WeakPolarHBondContact CD1-OG1 3.24Å; T96-I128 HydrophobicContact CG2-CD1 4.45Å; T96-I128 WeakPolarHBondContact OG1-CD1 3.25Å
97V95.3Very high92.3Very high22 Ų2251 Ų5113%0.13328%0.278CS..EExtended strand (participates in β ladder)trans-87122.3174.6-176.60000109.8L71 K73 C85 V86 L87 V126L71-V97 HydrophobicContact CD1-CG2 4.19Å; K73-V97 HydrophobicContact CD-CG1 4.14Å; C85-V97 HydrophobicContact CB-CG1 3.7Å; V86-V97 CarbonylContact O-C 3.51Å; V86-V97 WeakPolarHBondContact O-CA 3.45Å; L87-V97 HydrophobicContact CD1-CG2 4.32Å; V97-V126 HydrophobicContact CB-CG2 4.3Å; V97-V126 HydrophobicContact CG1-CG2 3.99Å; V97-V126 WeakPolarHBondContact O-CG1 3.28Å
98A95.9Very high92.1Very high0 Ų055.1 Ų55.10%030%0.297CS..EExtended strand (participates in β ladder)trans-104.9144.1170.400000110.2C85 V86 V88 V115 I128 V130C85-A98 CarbonylContact C-O 3.5Å; C85-A98 VanDerWaalsContact CA-O 3.26Å; C85-A98 WeakPolarHBondContact CA-O 3.43Å; C85-A98 WeakPolarHBondContact CB-O 3.44Å; V86-A98 PolarHBondContact N-O 3.43Å; V86-A98 PolarHBondContact O-N 3.4Å; V88-A98 HydrophobicContact CG2-CB 4.29Å; A98-V115 HydrophobicContact CB-CG1 4.28Å; A98-I128 VanDerWaalsContact CA-O 3.27Å; A98-I128 WeakPolarHBondContact CA-O 3.44Å; A98-V130 HydrophobicContact CB-CG2 3.71Å
99W96Very high91.8Very high38 Ų3861 Ų6114%0.14432%0.324CS..EExtended strand (participates in β ladder)trans-94.7150.6171.664.8-77.2000111P101 G118 K120 L123 V126 I128 R129 V130W99-P101 HydrophobicContact CE3-CB 4.29Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CZ3-CB 3.55Å; W99-P101 HydrophobicContact CZ3-CG 4.5Å; W99-G118 PolarHBondContact NE1-O 2.97Å; W99-K120 HydrophobicContact CD2-CB 4.3Å; W99-K120 HydrophobicContact CD2-CD 3.88Å; W99-K120 HydrophobicContact CD2-CG 4.41Å; W99-K120 HydrophobicContact CE3-CD 4.04Å; W99-K120 HydrophobicContact CG-CB 3.98Å; W99-K120 HydrophobicContact CG-CD 4.33Å; W99-K120 HydrophobicContact CG-CG 4.35Å; W99-K120 HydrophobicContact CH2-CD 4.45Å; W99-K120 HydrophobicContact CZ2-CD 4.3Å; W99-K120 HydrophobicContact CZ3-CD 4.3Å; W99-L123 HydrophobicContact CB-CD1 4.36Å; W99-V126 HydrophobicContact CB-CG1 3.97Å; W99-V126 HydrophobicContact CG-CG1 4.2Å; W99-I128 PolarHBondContact N-O 2.94Å; W99-I128 VanDerWaalsContact N-O 3.08Å; W99-R129 HydrophobicContact CD2-CB 4.14Å; W99-R129 VanDerWaalsContact CE2-CB 3.43Å; W99-R129 HydrophobicContact CH2-CB 4.44Å; W99-R129 HydrophobicContact CZ2-CB 3.61Å; W99-R129 HydrophobicContact CZ2-CG 4.42Å; W99-R129 WeakPolarHBondContact O-CA 3.17Å; W99-V130 PolarHBondContact O-N 3.4Å
100I95Very high91.5Very high12 Ų1261 Ų616%0.06233%0.33CS..PPolyproline II helixtrans-100.2123.5-179-43.1174.1000109.1K84 V86 H105 L107 V130K84-I100 HydrophobicContact CB-CD1 4.32Å; K84-I100 PolarHBondContact O-N 3.45Å; K84-I100 VanDerWaalsContact O-N 3.11Å; V86-I100 HydrophobicContact CG2-CD1 3.47Å; V86-I100 VanDerWaalsContact CG2-CD1 3.47Å; V86-I100 HydrophobicContact CG2-CG1 3.65Å; I100-H105 HydrophobicContact CD1-CB 3.83Å; I100-H105 VanDerWaalsContact CD1-CG 3.47Å; I100-H105 WeakPolarHBondContact CD1-ND1 3.1Å; I100-H105 HydrophobicContact CG2-CB 4.24Å; I100-L107 HydrophobicContact CD1-CD1 4.06Å; I100-L107 HydrophobicContact CG1-CD1 4.49Å; I100-V130 HydrophobicContact CG1-CG2 4.48Å
101P93.1Very high91.4Very high32 Ų3261.6 Ų61.621%0.20833%0.334CS..PPolyproline II helixtrans-77.1154.5175.530.2-32.7000112.2W99 V130 R132W99-P101 HydrophobicContact CE3-CB 4.29Å; W99-P101 HydrophobicContact CH2-CB 3.99Å; W99-P101 HydrophobicContact CZ3-CB 3.55Å; W99-P101 HydrophobicContact CZ3-CG 4.5Å; P101-V130 WeakPolarHBondContact CD-O 3.1Å; P101-V130 VanDerWaalsContact CG-O 3.23Å; P101-V130 WeakPolarHBondContact CG-O 3.45Å; P101-R132 HydrophobicContact CG-CG 3.87Å; P101-R132 PolarHBondContact O-NE 3.04Å; P101-R132 PolarHBondContact O-NH2 2.88Å
102G89Confident91.5Very high59 Ų5960.1 Ų60.161%0.60832%0.32SS*.SBendtrans78.9-175.3177.500000114.9
103E83.4Confident91.7Very high175 Ų17556.9 Ų56.982%0.81830%0.303SS*.SBendtrans-89.5133.7177.3-62.9-177.7179.300110.4
104G83.9Confident92Very high13 Ų1356.5 Ų56.513%0.13429%0.291CS..  trans68.4146.9173.300000116.5R132G104-R132 PolarHBondContact O-NH1 2.91Å; G104-R132 PolarHBondContact O-NH2 3.46Å
105H85.4Confident92.2Very high25 Ų2551.7 Ų51.712%0.11627%0.27CS..  trans-142.1160172.662.1-90.7000111.8V70 K84 I100V70-H105 WeakPolarHBondContact CG1-NE2 3.41Å; K84-H105 WeakPolarHBondContact CD-ND1 3.44Å; I100-H105 HydrophobicContact CD1-CB 3.83Å; I100-H105 VanDerWaalsContact CD1-CG 3.47Å; I100-H105 WeakPolarHBondContact CD1-ND1 3.1Å; I100-H105 HydrophobicContact CG2-CB 4.24Å
106N87.3Confident92.1Very high68 Ų6848.4 Ų48.436%0.36426%0.255SS..  trans-109.313.6176.1-170.637.5000112.8V173N106-V173 HydrophobicContact CB-CG1 4.19Å
107L89.9Confident92.1Very high9 Ų949.3 Ų49.35%0.04727%0.27CS..  trans-75.6133.2-178.4-66.2177.3000111.7V67 V70 V86 I100 V113 D136 C137V67-L107 HydrophobicContact CG2-CD1 4.44Å; V70-L107 WeakPolarHBondContact CG2-O 3.41Å; V86-L107 HydrophobicContact CG2-CD1 3.81Å; I100-L107 HydrophobicContact CD1-CD1 4.06Å; I100-L107 HydrophobicContact CG1-CD1 4.49Å; L107-V113 HydrophobicContact CD1-CG1 3.7Å; L107-V113 HydrophobicContact CD2-CG1 3.34Å; L107-V113 HydrophobicContact CG-CG1 4.14Å; L107-D136 HydrophobicContact CD2-CB 4.42Å; L107-C137 VanDerWaalsContact CD1-SG 3.53Å; L107-C137 VanDerWaalsContact CD2-SG 3.5Å
108Q90.5Very high91.9Very high119 Ų11949.1 Ų49.156%0.55627%0.272SS*.  trans-117.8176.5174-61.2175.425.400109.4V67 S111V67-Q108 WeakPolarHBondContact CB-O 3.32Å; V67-Q108 WeakPolarHBondContact CG1-O 3.14Å; Q108-S111 PolarHBondContact N-OG 3.23Å; Q108-S111 VanDerWaalsContact O-CB 3.3Å; Q108-S111 WeakPolarHBondContact O-CB 3.28Å; Q108-S111 PolarHBondContact O-N 2.99Å; Q108-S111 PolarHBondContact O-OG 3.2Å; Q108-S111 VanDerWaalsContact O-OG 3.1Å
109E90.2Very high91.8Very high123 Ų12357.7 Ų57.758%0.57530%0.304SS*.THydrogen-bonded Turntrans-56.5145.1166.8-58.3-168.816100110.1S111E109-S111 PolarHBondContact O-N 2.99Å
110H91.7Very high91.7Very high135 Ų13558.1 Ų58.163%0.62531%0.308SS*.THydrogen-bonded Turntrans62.40.8-176.6-53.3-69.6000116.6V67V67-H110 VanDerWaalsContact O-CA 3.26Å; V67-H110 WeakPolarHBondContact O-CA 3.48Å; V67-H110 PolarHBondContact O-N 3.42Å
111S92.8Very high91.6Very high16 Ų1661.9 Ų61.911%0.11233%0.333CS..  trans-60.8147.5171.5-62.40000111.3V67 Q108 E109 D136V67-S111 WeakPolarHBondContact CB-O 3.35Å; V67-S111 VanDerWaalsContact CG2-O 3.31Å; V67-S111 WeakPolarHBondContact CG2-O 3.23Å; V67-S111 PolarHBondContact N-O 2.99Å; Q108-S111 PolarHBondContact N-OG 3.23Å; Q108-S111 VanDerWaalsContact O-CB 3.3Å; Q108-S111 WeakPolarHBondContact O-CB 3.28Å; Q108-S111 PolarHBondContact O-N 2.99Å; Q108-S111 PolarHBondContact O-OG 3.2Å; Q108-S111 VanDerWaalsContact O-OG 3.1Å; E109-S111 PolarHBondContact O-N 2.99Å; S111-D136 WeakPolarHBondContact CA-OD2 3.26Å
112Q96.3Very high91.5Very high67 Ų6761.7 Ų61.731%0.31333%0.33SS..EExtended strand (participates in β ladder)trans-98.7131.4-178.9-57.1-179.52.500110.3R64 L135 D136R64-Q112 VanDerWaalsContact NH2-NE2 3.14Å; Q112-L135 HydrophobicContact CB-CB 4.44Å; Q112-L135 HydrophobicContact CB-CD1 4.11Å; Q112-L135 VanDerWaalsContact O-CB 3.23Å; Q112-L135 WeakPolarHBondContact O-CB 3.48Å; Q112-D136 PolarHBondContact N-OD2 3.04Å; Q112-D136 WeakPolarHBondContact O-CB 3.23Å; Q112-D136 PolarHBondContact O-N 3.15Å; Q112-D136 VanDerWaalsContact O-N 3.16Å
113V96.3Very high91.7Very high0 Ų059.1 Ų59.10%030%0.302CS..EExtended strand (participates in β ladder)trans-132.2142.2-175.6-690000111.7R64 G65 V67 V88 L107 V115 V130R64-V113 WeakPolarHBondContact CA-O 3.36Å; G65-V113 PolarHBondContact N-O 3.38Å; G65-V113 WeakPolarHBondContact O-CG2 3.46Å; G65-V113 PolarHBondContact O-N 3.41Å; V67-V113 HydrophobicContact CG2-CG1 3.84Å; V67-V113 HydrophobicContact CG2-CG2 3.97Å; V88-V113 HydrophobicContact CG1-CG2 3.95Å; V88-V113 HydrophobicContact CG2-CG2 3.91Å; L107-V113 HydrophobicContact CD1-CG1 3.7Å; L107-V113 HydrophobicContact CD2-CG1 3.34Å; L107-V113 HydrophobicContact CG-CG1 4.14Å; V113-V115 HydrophobicContact CB-CG2 4.2Å; V113-V115 HydrophobicContact CG2-CG2 3.67Å; V113-V130 HydrophobicContact CB-CG1 3.94Å; V113-V130 HydrophobicContact CG1-CG1 4.01Å
114L97.3Very high92.2Very high32 Ų3256.9 Ų56.917%0.16829%0.294CS..EExtended strand (participates in β ladder)trans-93131.6167.8-168.668.3000108.3Q62 I131 K134 L135Q62-L114 HydrophobicContact CB-CD1 4.1Å; Q62-L114 HydrophobicContact CB-CD2 4.31Å; Q62-L114 HydrophobicContact CB-CG 4.18Å; Q62-L114 HydrophobicContact CG-CD1 4.16Å; Q62-L114 HydrophobicContact CG-CD2 4.26Å; Q62-L114 HydrophobicContact CG-CG 4.49Å; L114-I131 HydrophobicContact CB-CB 4.43Å; L114-I131 HydrophobicContact CD2-CD1 3.85Å; L114-I131 HydrophobicContact CG-CD1 3.98Å; L114-I131 WeakPolarHBondContact O-CB 3.12Å; L114-I131 PolarHBondContact O-N 3.01Å; L114-K134 HydrophobicContact CB-CB 4.25Å; L114-K134 HydrophobicContact CB-CG 3.75Å; L114-K134 HydrophobicContact CD2-CD 4.45Å; L114-K134 HydrophobicContact CD2-CG 3.65Å; L114-K134 HydrophobicContact CG-CG 4.33Å; L114-L135 HydrophobicContact CB-CD1 4.35Å
115V96.3Very high92.5Very high0 Ų059 Ų590%032%0.317CS..EExtended strand (participates in β ladder)trans-130.3137.3-166.2177.90000108.8I57 Q62 M63 V88 L90 A98 V113 I128 R129 V130I57-V115 HydrophobicContact CD1-CG1 4.46Å; Q62-V115 CarbonylContact C-O 3.49Å; Q62-V115 VanDerWaalsContact CA-O 3.3Å; Q62-V115 WeakPolarHBondContact CA-O 3.47Å; M63-V115 PolarHBondContact N-O 3.14Å; M63-V115 WeakPolarHBondContact O-CB 3.15Å; M63-V115 PolarHBondContact O-N 2.78Å; V88-V115 HydrophobicContact CG1-CG2 4.36Å; L90-V115 HydrophobicContact CD2-CB 4.44Å; L90-V115 HydrophobicContact CD2-CG1 4.42Å; A98-V115 HydrophobicContact CB-CG1 4.28Å; V113-V115 HydrophobicContact CB-CG2 4.2Å; V113-V115 HydrophobicContact CG2-CG2 3.67Å; V115-I128 HydrophobicContact CB-CG2 4.44Å; V115-I128 HydrophobicContact CG1-CB 4.03Å; V115-I128 HydrophobicContact CG1-CG2 3.06Å; V115-R129 WeakPolarHBondContact CA-O 3.41Å; V115-R129 WeakPolarHBondContact CG1-O 3.37Å; V115-V130 HydrophobicContact CG2-CG2 4.48Å
116E94.7Very high92.9Very high45 Ų4557.9 Ų57.921%0.2131%0.312CS..EExtended strand (participates in β ladder)trans-136.2162-179.264.6-179.2157.400112.4P61 G118 I128 R129 I131P61-E116 WeakPolarHBondContact O-CB 3.25Å; E116-G118 PolarHBondContact O-N 3.34Å; E116-I128 WeakPolarHBondContact O-CG2 3.36Å; E116-R129 VanDerWaalsContact CD-NE 3.27Å; E116-R129 HydrophobicContact CG-CG 3.6Å; E116-R129 PolarHBondContact N-O 3.13Å; E116-R129 PolarHBondContact O-N 3.24Å; E116-R129 IonicContact OE1-CZ 2.78Å; E116-R129 IonicContact OE1-NE 3.41Å; E116-R129 PolarHBondContact OE1-NE 3.32Å; E116-R129 IonicContact OE1-NH2 3.22Å; E116-R129 PolarHBondContact OE1-NH2 2.99Å; E116-R129 IonicContact OE2-NH2 2.65Å; E116-R129 PolarHBondContact OE2-NH2 3.48Å; E116-I131 HydrophobicContact CB-CD1 3.96Å; E116-I131 HydrophobicContact CB-CG1 4.23Å; E116-I131 HydrophobicContact CG-CD1 3.87Å; E116-I131 HydrophobicContact CG-CG1 3.7Å; E116-I131 WeakPolarHBondContact OE1-CG1 3.48Å
117G93.2Very high93.2Very high46 Ų4659 Ų5947%0.47431%0.313SS..EExtended strand (participates in β ladder)trans-53.9131175.900000112.4
118G92.6Very high93.4Very high18 Ų1858.6 Ų58.619%0.18631%0.311CS..  trans176.190.8-179.100000111W99 E116 K120 K127 I128W99-G118 PolarHBondContact NE1-O 2.97Å; E116-G118 PolarHBondContact O-N 3.34Å; G118-K120 PolarHBondContact O-N 2.92Å; G118-K127 CarbonylContact C-O 3.59Å; G118-K127 PolarHBondContact N-O 3.49Å; G118-K127 CarbonylContact O-C 3.57Å; G118-K127 VanDerWaalsContact O-C 3.32Å; G118-I128 CarbonylContact O-C 3.45Å; G118-I128 PolarHBondContact O-N 2.85Å
119R93.2Very high93.7Very high179 Ų17957.5 Ų57.568%0.67530%0.302SS*.  trans-70.9129.3179.4-179.4-179.4172.3-175.3-4.1110.5P121 K127R119-P121 WeakPolarHBondContact O-CD 3.48Å; R119-K127 PolarHBondContact N-O 3.35Å
120K94.5Very high93.9Very high48 Ų4851.7 Ų51.721%0.20928%0.275CS..  trans-88.6114.5169.4-165.670.3175.3178.80108.9W99 G118 D122 L123 V126W99-K120 HydrophobicContact CD2-CB 4.3Å; W99-K120 HydrophobicContact CD2-CD 3.88Å; W99-K120 HydrophobicContact CD2-CG 4.41Å; W99-K120 HydrophobicContact CE3-CD 4.04Å; W99-K120 HydrophobicContact CG-CB 3.98Å; W99-K120 HydrophobicContact CG-CD 4.33Å; W99-K120 HydrophobicContact CG-CG 4.35Å; W99-K120 HydrophobicContact CH2-CD 4.45Å; W99-K120 HydrophobicContact CZ2-CD 4.3Å; W99-K120 HydrophobicContact CZ3-CD 4.3Å; G118-K120 PolarHBondContact O-N 2.92Å; K120-D122 VanDerWaalsContact C-N 3.26Å; K120-D122 HydrophobicContact CG-CB 4.34Å; K120-D122 PolarHBondContact O-N 2.85Å; K120-L123 HydrophobicContact CB-CB 4.32Å; K120-L123 HydrophobicContact CB-CD1 4.28Å; K120-L123 HydrophobicContact CB-CG 4.46Å; K120-L123 HydrophobicContact CG-CB 4.49Å; K120-L123 HydrophobicContact CG-CD1 4.07Å; K120-L123 HydrophobicContact CG-CG 4.15Å; K120-L123 PolarHBondContact O-N 3.47Å; K120-V126 PolarHBondContact N-O 3.45Å
121P92Very high94.1Very high91 Ų9147 Ų4759%0.59125%0.254SS*.THydrogen-bonded Turntrans-62.8-34.1-175.523.7-33.2000112.7R119 L123R119-P121 WeakPolarHBondContact O-CD 3.48Å; P121-L123 VanDerWaalsContact C-N 3.26Å; P121-L123 PolarHBondContact O-N 3.46Å
122D91.9Very high94.1Very high27 Ų2748.5 Ų48.514%0.14426%0.257CS..THydrogen-bonded Turntrans-62.3-29.7178.4-60.8-14.5000113.5P75 K76 N79 R83 K120P75-D122 CarbonylContact C-O 3.32Å; P75-D122 HydrophobicContact CB-CB 3.94Å; K76-D122 WeakPolarHBondContact CG-O 3.04Å; K76-D122 PolarHBondContact N-O 3.37Å; N79-D122 PolarHBondContact ND2-OD1 2.91Å; R83-D122 IonicContact CZ-OD2 3.18Å; R83-D122 IonicContact NE-OD2 3.57Å; R83-D122 PolarHBondContact NE-OD2 2.9Å; R83-D122 IonicContact NH2-OD2 2.72Å; R83-D122 PolarHBondContact NH2-OD2 3.31Å; K120-D122 VanDerWaalsContact C-N 3.26Å; K120-D122 HydrophobicContact CG-CB 4.34Å; K120-D122 PolarHBondContact O-N 2.85Å
123L93.4Very high93.8Very high5 Ų547.7 Ų47.73%0.02627%0.267CS..SBendtrans-109.8128.1-168-64.1175.1000111K73 R83 C85 W99 K120 P121 G125 V126K73-L123 HydrophobicContact CB-CD2 3.7Å; R83-L123 HydrophobicContact CB-CD1 3.96Å; R83-L123 HydrophobicContact CB-CD2 4.14Å; R83-L123 HydrophobicContact CB-CG 4.43Å; R83-L123 HydrophobicContact CG-CD1 4.37Å; R83-L123 HydrophobicContact CG-CD2 4.14Å; R83-L123 HydrophobicContact CG-CG 4.39Å; C85-L123 WeakPolarHBondContact SG-CD1 3.23Å; W99-L123 HydrophobicContact CB-CD1 4.36Å; K120-L123 HydrophobicContact CB-CB 4.32Å; K120-L123 HydrophobicContact CB-CD1 4.28Å; K120-L123 HydrophobicContact CB-CG 4.46Å; K120-L123 HydrophobicContact CG-CB 4.49Å; K120-L123 HydrophobicContact CG-CD1 4.07Å; K120-L123 HydrophobicContact CG-CG 4.15Å; K120-L123 PolarHBondContact O-N 3.47Å; P121-L123 VanDerWaalsContact C-N 3.26Å; P121-L123 PolarHBondContact O-N 3.46Å; L123-G125 PolarHBondContact O-N 3.46Å; L123-V126 HydrophobicContact CB-CB 3.79Å; L123-V126 HydrophobicContact CB-CG2 3.64Å; L123-V126 HydrophobicContact CD1-CB 4.22Å; L123-V126 HydrophobicContact CD1-CG1 4.32Å; L123-V126 HydrophobicContact CD1-CG2 3.99Å; L123-V126 HydrophobicContact CG-CG2 4.44Å
124I92Very high93.6Very high128 Ų12853 Ų5366%0.65629%0.29SS*.THydrogen-bonded Turntrans-68.2130.9173.2-16477.1000110.1V126I124-V126 PolarHBondContact O-N 3.27Å; I124-V126 VanDerWaalsContact O-N 3.16Å
125G90.7Very high93.4Very high59 Ų5955 Ų5561%0.60830%0.301SS*.THydrogen-bonded Turntrans74-3.2175.500000116.6L123 K127L123-G125 PolarHBondContact O-N 3.46Å; G125-K127 PolarHBondContact O-N 2.88Å
126V94.3Very high93.3Very high1 Ų158.6 Ų58.61%0.00632%0.32CS..  trans-92.395-178.7-173.20000110K73 V97 W99 K120 L123 I124K73-V126 HydrophobicContact CD-CG2 3.96Å; V97-V126 HydrophobicContact CB-CG2 4.3Å; V97-V126 HydrophobicContact CG1-CG2 3.99Å; V97-V126 WeakPolarHBondContact O-CG1 3.28Å; W99-V126 HydrophobicContact CB-CG1 3.97Å; W99-V126 HydrophobicContact CG-CG1 4.2Å; K120-V126 PolarHBondContact N-O 3.45Å; L123-V126 HydrophobicContact CB-CB 3.79Å; L123-V126 HydrophobicContact CB-CG2 3.64Å; L123-V126 HydrophobicContact CD1-CB 4.22Å; L123-V126 HydrophobicContact CD1-CG1 4.32Å; L123-V126 HydrophobicContact CD1-CG2 3.99Å; L123-V126 HydrophobicContact CG-CG2 4.44Å; I124-V126 PolarHBondContact O-N 3.27Å; I124-V126 VanDerWaalsContact O-N 3.16Å
127K92.8Very high92.9Very high91 Ų9156.5 Ų56.540%0.39631%0.31SS..  trans-98.7-6.1-173.7-63.7-179.2-177.8178.20114.2G118 R119 G125G118-K127 CarbonylContact C-O 3.59Å; G118-K127 PolarHBondContact N-O 3.49Å; G118-K127 CarbonylContact O-C 3.57Å; G118-K127 VanDerWaalsContact O-C 3.32Å; R119-K127 PolarHBondContact N-O 3.35Å; G125-K127 PolarHBondContact O-N 2.88Å
128I95.4Very high92.8Very high1 Ų156.3 Ų56.31%0.00530%0.304CS..EExtended strand (participates in β ladder)trans-132.2144.3-166.3-38.6175.3000110.2P56 I57 L90 T96 A98 W99 V115 E116 G118P56-I128 HydrophobicContact CB-CD1 3.5Å; P56-I128 VanDerWaalsContact CB-CD1 3.5Å; P56-I128 HydrophobicContact CB-CG1 4.44Å; P56-I128 HydrophobicContact CG-CD1 3.48Å; P56-I128 VanDerWaalsContact CG-CD1 3.48Å; P56-I128 HydrophobicContact CG-CG1 3.91Å; I57-I128 HydrophobicContact CD1-CD1 4.43Å; I57-I128 HydrophobicContact CD1-CG2 3.39Å; I57-I128 HydrophobicContact CG1-CD1 4.08Å; I57-I128 HydrophobicContact CG1-CG2 4.13Å; L90-I128 HydrophobicContact CD1-CD1 4.31Å; T96-I128 HydrophobicContact CG2-CD1 4.45Å; T96-I128 WeakPolarHBondContact OG1-CD1 3.25Å; A98-I128 VanDerWaalsContact CA-O 3.27Å; A98-I128 WeakPolarHBondContact CA-O 3.44Å; W99-I128 PolarHBondContact N-O 2.94Å; W99-I128 VanDerWaalsContact N-O 3.08Å; V115-I128 HydrophobicContact CB-CG2 4.44Å; V115-I128 HydrophobicContact CG1-CB 4.03Å; V115-I128 HydrophobicContact CG1-CG2 3.06Å; E116-I128 WeakPolarHBondContact O-CG2 3.36Å; G118-I128 CarbonylContact O-C 3.45Å; G118-I128 PolarHBondContact O-N 2.85Å
129R95.5Very high92.6Very high96 Ų9659.7 Ų59.736%0.36232%0.323SS..EExtended strand (participates in β ladder)trans-115.6150.4177.874.2-179.2-174.4-165.2-2.8111.4W99 V115 E116W99-R129 HydrophobicContact CD2-CB 4.14Å; W99-R129 VanDerWaalsContact CE2-CB 3.43Å; W99-R129 HydrophobicContact CH2-CB 4.44Å; W99-R129 HydrophobicContact CZ2-CB 3.61Å; W99-R129 HydrophobicContact CZ2-CG 4.42Å; W99-R129 WeakPolarHBondContact O-CA 3.17Å; V115-R129 WeakPolarHBondContact CA-O 3.41Å; V115-R129 WeakPolarHBondContact CG1-O 3.37Å; E116-R129 VanDerWaalsContact CD-NE 3.27Å; E116-R129 HydrophobicContact CG-CG 3.6Å; E116-R129 PolarHBondContact N-O 3.13Å; E116-R129 PolarHBondContact O-N 3.24Å; E116-R129 IonicContact OE1-CZ 2.78Å; E116-R129 IonicContact OE1-NE 3.41Å; E116-R129 PolarHBondContact OE1-NE 3.32Å; E116-R129 IonicContact OE1-NH2 3.22Å; E116-R129 PolarHBondContact OE1-NH2 2.99Å; E116-R129 IonicContact OE2-NH2 2.65Å; E116-R129 PolarHBondContact OE2-NH2 3.48Å
130V96Very high92.3Very high0 Ų053.7 Ų53.70%031%0.306CS..EExtended strand (participates in β ladder)trans-84.3134.4171.5-176.50000109.7A98 W99 I100 P101 V113 V115 C137A98-V130 HydrophobicContact CB-CG2 3.71Å; W99-V130 PolarHBondContact O-N 3.4Å; I100-V130 HydrophobicContact CG1-CG2 4.48Å; P101-V130 WeakPolarHBondContact CD-O 3.1Å; P101-V130 VanDerWaalsContact CG-O 3.23Å; P101-V130 WeakPolarHBondContact CG-O 3.45Å; V113-V130 HydrophobicContact CB-CG1 3.94Å; V113-V130 HydrophobicContact CG1-CG1 4.01Å; V115-V130 HydrophobicContact CG2-CG2 4.48Å; V130-C137 HydrophobicContact CG1-CB 4.42Å; V130-C137 WeakPolarHBondContact CG1-SG 3.44Å
131I95.6Very high91.6Very high37 Ų3757.1 Ų57.119%0.1933%0.325CS..PPolyproline II helixtrans-81.8126.4174.5-55.5-174.4000108.9Q62 L114 E116 K134 C137Q62-I131 HydrophobicContact CB-CD1 4.48Å; L114-I131 HydrophobicContact CB-CB 4.43Å; L114-I131 HydrophobicContact CD2-CD1 3.85Å; L114-I131 HydrophobicContact CG-CD1 3.98Å; L114-I131 WeakPolarHBondContact O-CB 3.12Å; L114-I131 PolarHBondContact O-N 3.01Å; E116-I131 HydrophobicContact CB-CD1 3.96Å; E116-I131 HydrophobicContact CB-CG1 4.23Å; E116-I131 HydrophobicContact CG-CD1 3.87Å; E116-I131 HydrophobicContact CG-CG1 3.7Å; E116-I131 WeakPolarHBondContact OE1-CG1 3.48Å; I131-K134 HydrophobicContact CG2-CB 4.25Å; I131-C137 WeakPolarHBondContact O-CB 3.18Å
132R91.2Very high90.8Very high47 Ų4761.2 Ų61.218%0.17733%0.334CS..THydrogen-bonded Turntrans-86.8150.8175.9-67.7-70.6-163.9136.512.5111.3P101 G104 K134 A138P101-R132 HydrophobicContact CG-CG 3.87Å; P101-R132 PolarHBondContact O-NE 3.04Å; P101-R132 PolarHBondContact O-NH2 2.88Å; G104-R132 PolarHBondContact O-NH1 2.91Å; G104-R132 PolarHBondContact O-NH2 3.46Å; R132-K134 VanDerWaalsContact C-N 3.3Å; R132-A138 WeakPolarHBondContact CD-O 3.41Å; R132-A138 PolarHBondContact NH1-O 3.06Å
133G90.5Very high89.9Confident51 Ų5164.6 Ų64.653%0.52635%0.352SS..THydrogen-bonded Turntrans7715.8-17600000113.6C137G133-C137 VanDerWaalsContact CA-O 3.24Å; G133-C137 WeakPolarHBondContact CA-O 3.33Å; G133-C137 PolarHBondContact N-O 2.83Å
134K91.9Very high88.4Confident110 Ų11072.2 Ų72.248%0.47839%0.385SS..BIsolated β-bridgetrans-135.8138.9-178.3-168.666.5-176.6-179.10111.4L114 I131 R132 D136 C137L114-K134 HydrophobicContact CB-CB 4.25Å; L114-K134 HydrophobicContact CB-CG 3.75Å; L114-K134 HydrophobicContact CD2-CD 4.45Å; L114-K134 HydrophobicContact CD2-CG 3.65Å; L114-K134 HydrophobicContact CG-CG 4.33Å; I131-K134 HydrophobicContact CG2-CB 4.25Å; R132-K134 VanDerWaalsContact C-N 3.3Å; K134-D136 PolarHBondContact O-N 3.35Å; K134-C137 PolarHBondContact N-O 3.33Å; K134-C137 WeakPolarHBondContact O-CB 3.49Å; K134-C137 PolarHBondContact O-N 3.28Å
135L94Very high86.8Confident76 Ų7669.3 Ų69.340%0.39838%0.38SS..THydrogen-bonded Turntrans51.5-128.5-170.4-56.9178.1000109.4R64 Q112 L114 C137R64-L135 HydrophobicContact CG-CD1 3.98Å; Q112-L135 HydrophobicContact CB-CB 4.44Å; Q112-L135 HydrophobicContact CB-CD1 4.11Å; Q112-L135 VanDerWaalsContact O-CB 3.23Å; Q112-L135 WeakPolarHBondContact O-CB 3.48Å; L114-L135 HydrophobicContact CB-CD1 4.35Å; L135-C137 VanDerWaalsContact C-N 3.32Å; L135-C137 PolarHBondContact O-N 2.93Å
136D92.8Very high85.3Confident74 Ų7467.9 Ų67.940%0.39636%0.362SS..THydrogen-bonded Turntrans-84.2-9.9-174.4-55.6-19.5000112.6L107 S111 Q112 K134 A138L107-D136 HydrophobicContact CD2-CB 4.42Å; S111-D136 WeakPolarHBondContact CA-OD2 3.26Å; Q112-D136 PolarHBondContact N-OD2 3.04Å; Q112-D136 WeakPolarHBondContact O-CB 3.23Å; Q112-D136 PolarHBondContact O-N 3.15Å; Q112-D136 VanDerWaalsContact O-N 3.16Å; K134-D136 PolarHBondContact O-N 3.35Å; D136-A138 PolarHBondContact O-N 3.48Å
137C87.6Confident84Confident2 Ų274.3 Ų74.31%0.01439%0.387CS..BIsolated β-bridgetrans-7499.5175.8-88.20000111.8L107 V130 I131 G133 K134 L135L107-C137 VanDerWaalsContact CD1-SG 3.53Å; L107-C137 VanDerWaalsContact CD2-SG 3.5Å; V130-C137 HydrophobicContact CG1-CB 4.42Å; V130-C137 WeakPolarHBondContact CG1-SG 3.44Å; I131-C137 WeakPolarHBondContact O-CB 3.18Å; G133-C137 VanDerWaalsContact CA-O 3.24Å; G133-C137 WeakPolarHBondContact CA-O 3.33Å; G133-C137 PolarHBondContact N-O 2.83Å; K134-C137 PolarHBondContact N-O 3.33Å; K134-C137 WeakPolarHBondContact O-CB 3.49Å; K134-C137 PolarHBondContact O-N 3.28Å; L135-C137 VanDerWaalsContact C-N 3.32Å; L135-C137 PolarHBondContact O-N 2.93Å
138A89.8Confident82.8Confident42 Ų4272 Ų7235%0.34738%0.381SS..PPolyproline II helixtrans-56.8144.8170.300000112.5R132 D136R132-A138 WeakPolarHBondContact CD-O 3.41Å; R132-A138 PolarHBondContact NH1-O 3.06Å; D136-A138 PolarHBondContact O-N 3.48Å
139P89.3Confident81.8Confident89 Ų8976.5 Ų76.558%0.57840%0.404SS*.PPolyproline II helixtrans-65.2158.4173.229.7-34.4000111.3I141P139-I141 PolarHBondContact O-N 2.92Å
140V86.6Confident80.9Confident52 Ų5278 Ų7832%0.31541%0.41SS..PPolyproline II helixtrans-74.4118.2175.1-178.70000108.3K142V140-K142 PolarHBondContact O-N 3.26Å
141I80.5Confident80Confident121 Ų12184.2 Ų84.262%0.62144%0.442SS*.  trans-69.5114.1174.9-57.6169.3000107.2P139P139-I141 PolarHBondContact O-N 2.92Å
142K75.9Confident79Confident176 Ų17683.5 Ų83.577%0.76544%0.444SS*.  trans-102.7134.8171.7-66.4-177.4178.9-1790108.4V140 K144V140-K142 PolarHBondContact O-N 3.26Å; K142-K144 PolarHBondContact O-N 3.49Å
143D71.4Confident78.5Confident98 Ų9893.7 Ų93.752%0.52448%0.483SS..  trans-59.3126.8170-61.7-30.4000108.8A145 T163D143-A145 PolarHBondContact O-N 3.4Å; D143-T163 HydrophobicContact CB-CG2 4.38Å
144K61.9Low78Confident165 Ų16598.1 Ų98.172%0.71750%0.495SS*.  trans-67.7100.9170.6-71.7-176.2-179.4-179.90106.9K142 A146K142-K144 PolarHBondContact O-N 3.49Å; K144-A146 PolarHBondContact O-N 2.91Å
145A58.3Low77.4Confident67 Ų6795.5 Ų95.555%0.55450%0.498SS*.EExtended strand (participates in β ladder)trans-65.2103.4168.800000108.2D143 I161D143-A145 PolarHBondContact O-N 3.4Å; A145-I161 HydrophobicContact CB-CG2 4.2Å
146A60.9Low76.6Confident29 Ų2997.7 Ų97.724%0.2451%0.51CS..EExtended strand (participates in β ladder)trans-81.1129164.900000108.1K144 R162 L164K144-A146 PolarHBondContact O-N 2.91Å; A146-R162 PolarHBondContact N-O 3.03Å; A146-R162 CarbonylContact O-C 3.44Å; A146-R162 WeakPolarHBondContact O-CA 3.47Å; A146-R162 PolarHBondContact O-N 2.9Å; A146-L164 HydrophobicContact CB-CB 4.49Å; A146-L164 HydrophobicContact CB-CD1 3.3Å; A146-L164 HydrophobicContact CB-CD2 4.46Å; A146-L164 HydrophobicContact CB-CG 3.48Å; A146-L164 VanDerWaalsContact CB-CG 3.48Å
147Y66.8Low75.4Confident136 Ų136100 Ų10053%0.53352%0.522SS..EExtended strand (participates in β ladder)trans-87.2131.6169.154.2-85.7000107.8I149 K159Y147-I149 HydrophobicContact CD2-CD1 4.35Å; Y147-I149 HydrophobicContact CD2-CG1 3.89Å; Y147-I149 HydrophobicContact CE2-CD1 4.18Å; Y147-I149 HydrophobicContact CE2-CG1 4.21Å; Y147-K159 HydrophobicContact CD2-CD 4.44Å; Y147-K159 HydrophobicContact CD2-CG 4.27Å; Y147-K159 HydrophobicContact CG-CD 4.26Å; Y147-K159 HydrophobicContact CG-CG 4.17Å
148T67.1Low74.8Confident42 Ų42106.7 Ų106.726%0.25855%0.55SS.*EExtended strand (participates in β ladder)trans-99.5124.9160.5-56.40000106.9R150 T160 R162T148-R150 HydrophobicContact CG2-CG 4.13Å; T148-T160 PolarHBondContact N-O 3.07Å; T148-T160 PolarHBondContact O-N 2.99Å; T148-R162 WeakPolarHBondContact OG1-CD 3.23Å; T148-R162 PolarHBondContact OG1-NH1 3.33Å
149I74.8Confident74Confident96 Ų96111.8 Ų111.849%0.49257%0.565SS.*EExtended strand (participates in β ladder)trans-81.7120.8171.4-52.1176.5000106.4Y147 L157Y147-I149 HydrophobicContact CD2-CD1 4.35Å; Y147-I149 HydrophobicContact CD2-CG1 3.89Å; Y147-I149 HydrophobicContact CE2-CD1 4.18Å; Y147-I149 HydrophobicContact CE2-CG1 4.21Å; I149-L157 HydrophobicContact CG2-CB 3.87Å; I149-L157 HydrophobicContact CG2-CD2 3.36Å; I149-L157 HydrophobicContact CG2-CG 4.09Å
150R76Confident73Confident129 Ų129110.5 Ų110.549%0.48756%0.556SS.*EExtended strand (participates in β ladder)trans-118.4139.1173.2-68.2-175.1173.6179.3-7109T148 G152 K158T148-R150 HydrophobicContact CG2-CG 4.13Å; R150-G152 PolarHBondContact O-N 3.46Å; R150-K158 PolarHBondContact N-O 2.69Å; R150-K158 PolarHBondContact O-N 3.33Å
151L77.9Confident72Confident129 Ų129114.1 Ų114.168%0.67557%0.572SS**EExtended strand (participates in β ladder)trans-68.8121.4166.7-99136.1000108.9G155 L157L151-G155 WeakPolarHBondContact CD2-O 3.33Å; L151-L157 HydrophobicContact CD1-CD2 4.43Å; L151-L157 HydrophobicContact CG-CD2 4.07Å
152G74.2Confident70.9Confident23 Ų23114 Ų11424%0.23756%0.564CS.*  trans-77.4162171.800000111.5R150 N154 G155 L156R150-G152 PolarHBondContact O-N 3.46Å; G152-N154 PolarHBondContact O-N 2.94Å; G152-G155 PolarHBondContact O-N 2.86Å; G152-L156 PolarHBondContact N-O 3.3Å
153R79.5Confident69.8Low260 Ų260110.4 Ų110.498%0.98156%0.556SS**THydrogen-bonded Turntrans-51.3-24.5177-83.2-176.9176.7173.9-2.2114.5G155R153-G155 VanDerWaalsContact C-N 3.34Å
154N81.4Confident69Low145 Ų145110.4 Ų110.478%0.77556%0.556SS**THydrogen-bonded Turntrans-93.116-179-55.414.7000112.8G152 L156G152-N154 PolarHBondContact O-N 2.94Å; N154-L156 PolarHBondContact O-N 2.85Å; N154-L156 VanDerWaalsContact O-N 3.14Å
155G79.1Confident68.5Low54 Ų54107.9 Ų107.956%0.55756%0.559SS**SBendtrans75.2-6.8-177.500000115.6L151 G152 R153L151-G155 WeakPolarHBondContact CD2-O 3.33Å; G152-G155 PolarHBondContact O-N 2.86Å; R153-G155 VanDerWaalsContact C-N 3.34Å
156L76.2Confident68.2Low122 Ų122106.2 Ų106.264%0.63955%0.545SS*.  trans-83.7134.3179.4-69.9168.6000112.4G152 N154 K158G152-L156 PolarHBondContact N-O 3.3Å; N154-L156 PolarHBondContact O-N 2.85Å; N154-L156 VanDerWaalsContact O-N 3.14Å; L156-K158 PolarHBondContact O-N 3.43Å
157L68.3Low67.5Low123 Ų123109 Ų10964%0.64456%0.561SS**EExtended strand (participates in β ladder)trans-67114.4171.7-71.5163.1000110I149 L151I149-L157 HydrophobicContact CG2-CB 3.87Å; I149-L157 HydrophobicContact CG2-CD2 3.36Å; I149-L157 HydrophobicContact CG2-CG 4.09Å; L151-L157 HydrophobicContact CD1-CD2 4.43Å; L151-L157 HydrophobicContact CG-CD2 4.07Å
158K74.1Confident66.6Low142 Ų142112 Ų11262%0.61758%0.579SS**EExtended strand (participates in β ladder)trans-100.7122.4172-72.2-171.3177.6-174.20110R150 L156 T160R150-K158 PolarHBondContact N-O 2.69Å; R150-K158 PolarHBondContact O-N 3.33Å; L156-K158 PolarHBondContact O-N 3.43Å; K158-T160 PolarHBondContact O-N 2.97Å
159K73.6Confident65.5Low149 Ų149115.3 Ų115.365%0.64861%0.605SS**EExtended strand (participates in β ladder)trans-78102.1170.6-164.3176.8-173.6171.80108.5Y147Y147-K159 HydrophobicContact CD2-CD 4.44Å; Y147-K159 HydrophobicContact CD2-CG 4.27Å; Y147-K159 HydrophobicContact CG-CD 4.26Å; Y147-K159 HydrophobicContact CG-CG 4.17Å
160T68.6Low64Low63 Ų63113.5 Ų113.539%0.38760%0.6SS.*EExtended strand (participates in β ladder)trans-95.1125.6174-540000108.6T148 K158 R162T148-T160 PolarHBondContact N-O 3.07Å; T148-T160 PolarHBondContact O-N 2.99Å; K158-T160 PolarHBondContact O-N 2.97Å; T160-R162 PolarHBondContact O-N 2.98Å
161I64.6Low62.1Low127 Ų127116.3 Ų116.365%0.65162%0.616SS**EExtended strand (participates in β ladder)trans-68.4113.9173.1-59.6172.2000107A145A145-I161 HydrophobicContact CB-CG2 4.2Å
162R57.8Low60Low120 Ų120119.7 Ų119.745%0.45363%0.625SS.*EExtended strand (participates in β ladder)trans-97.7114.9160.6-77.1-167.4169.7160.6-26.3106.7A146 T148 T160 L164A146-R162 PolarHBondContact N-O 3.03Å; A146-R162 CarbonylContact O-C 3.44Å; A146-R162 WeakPolarHBondContact O-CA 3.47Å; A146-R162 PolarHBondContact O-N 2.9Å; T148-R162 WeakPolarHBondContact OG1-CD 3.23Å; T148-R162 PolarHBondContact OG1-NH1 3.33Å; T160-R162 PolarHBondContact O-N 2.98Å; R162-L164 VanDerWaalsContact C-N 3.28Å; R162-L164 PolarHBondContact O-N 3.29Å
163T53.7Low58.5Low99 Ų99122.7 Ų122.761%0.60764%0.639SS**EExtended strand (participates in β ladder)trans-64.797165.4-37.40000106.3D143 S165D143-T163 HydrophobicContact CB-CG2 4.38Å; T163-S165 PolarHBondContact O-N 2.98Å; T163-S165 VanDerWaalsContact O-N 3.13Å
164L55.1Low56.2Low99 Ų99111.8 Ų111.852%0.51861%0.608SS.*  trans-64.4117164-71.6-179.4000104.6A146 R162 A166A146-L164 HydrophobicContact CB-CB 4.49Å; A146-L164 HydrophobicContact CB-CD1 3.3Å; A146-L164 HydrophobicContact CB-CD2 4.46Å; A146-L164 HydrophobicContact CB-CG 3.48Å; A146-L164 VanDerWaalsContact CB-CG 3.48Å; R162-L164 VanDerWaalsContact C-N 3.28Å; R162-L164 PolarHBondContact O-N 3.29Å; L164-A166 PolarHBondContact O-N 3.4Å
165S49.5Very low54.1Low112 Ų112108.5 Ų108.578%0.78359%0.589SS**  trans-44120.8168.544.30000107.7T163T163-S165 PolarHBondContact O-N 2.98Å; T163-S165 VanDerWaalsContact O-N 3.13Å
166A53.3Low52Low31 Ų31109.7 Ų109.726%0.25659%0.586SS.*  trans-44.1149.8-174.800000111.7L164 Q168L164-A166 PolarHBondContact O-N 3.4Å; A166-Q168 PolarHBondContact O-N 3.41Å
167P45.8Very low50.3Low89 Ų89108.3 Ų108.358%0.57859%0.586SS**  trans-49.4125170.821.4-31.9000108.4S169 S170P167-S169 CarbonylContact O-C 3.56Å; P167-S169 PolarHBondContact O-N 3.37Å; P167-S170 PolarHBondContact O-N 2.83Å
168Q47.4Very low48.9Very low197 Ų197108.2 Ų108.292%0.92159%0.586SS**SBendtrans-64.114.3175.9-69.7-154-4.100113.3A166 S170A166-Q168 PolarHBondContact O-N 3.41Å; Q168-S170 PolarHBondContact O-N 3.5Å
169S43.8Very low47.1Very low113 Ų113104.9 Ų104.979%0.7958%0.581SS**  trans-76.252.1151.2-160.90000110.6P167P167-S169 CarbonylContact O-C 3.56Å; P167-S169 PolarHBondContact O-N 3.37Å
170S43.7Very low45.6Very low58 Ų58103.2 Ų103.241%0.40659%0.586SS.*  trans-11889.4146.6-81.10000104P167 Q168 K172P167-S170 PolarHBondContact O-N 2.83Å; Q168-S170 PolarHBondContact O-N 3.5Å; S170-K172 PolarHBondContact O-N 3.49Å
171K37Very low44.4Very low188 Ų188108.2 Ų108.282%0.81760%0.604SS**  -41111.3128.9-110.6179.1-178.8175.30103.1V173K171-V173 PolarHBondContact O-N 2.95Å
172K33.8Very low43.4Very low200 Ų200113.7 Ų113.787%0.8762%0.617SS**  trans-53.788.9169.5-164.4178.3-170.7178.40103.3S170 G174S170-K172 PolarHBondContact O-N 3.49Å; K172-G174 PolarHBondContact O-N 3.32Å
173V41.3Very low43.3Very low85 Ų85111.7 Ų111.752%0.51561%0.613SS.*  trans-69.982.5164.7174.4000099.7N106 K171 I175N106-V173 HydrophobicContact CB-CG1 4.19Å; K171-V173 PolarHBondContact O-N 2.95Å; V173-I175 PolarHBondContact O-N 3.36Å
174G31.6Very low43.8Very low32 Ų32114.6 Ų114.633%0.3362%0.617SS.*  trans-50120.2177.200000103.4K172 T176K172-G174 PolarHBondContact O-N 3.32Å; G174-T176 PolarHBondContact O-N 2.8Å; G174-T176 PolarHBondContact O-OG1 3.44Å
175I37.1Very low44.2Very low76 Ų76114 Ų11439%0.3962%0.618SS.*  trans-70.869.7148.5-50.9126.3000103.4K84 V173 S177K84-I175 VanDerWaalsContact NZ-CG2 3.34Å; V173-I175 PolarHBondContact O-N 3.36Å; I175-S177 PolarHBondContact O-N 3.24Å
176T34.8Very low45.3Very low79 Ų79114.6 Ų114.649%0.48561%0.611SS.*  trans-65.788.6155.2-30.70000101G174 D178 S179G174-T176 PolarHBondContact O-N 2.8Å; G174-T176 PolarHBondContact O-OG1 3.44Å; T176-D178 PolarHBondContact O-N 3Å; T176-S179 VanDerWaalsContact CG2-CB 3.41Å; T176-S179 VanDerWaalsContact CG2-N 3.27Å; T176-S179 WeakPolarHBondContact CG2-OG 3.25Å
177S40.2Very low46.7Very low92 Ų92113.4 Ų113.464%0.64360%0.601SS**  trans-43.3104.6142.143.30000103.5I175 S179I175-S177 PolarHBondContact O-N 3.24Å; S177-S179 VanDerWaalsContact C-N 3.25Å; S177-S179 PolarHBondContact O-N 2.85Å
178D39.3Very low48.8Very low121 Ų121114 Ų11465%0.64760%0.598SS**  trans-22.892.8-166.5-61.9-54.5000109.1T176 P180T176-D178 PolarHBondContact O-N 3Å; D178-P180 VanDerWaalsContact O-CD 3.28Å; D178-P180 WeakPolarHBondContact O-CD 3.37Å
179S36.6Very low50.8Low73 Ų73105.1 Ų105.151%0.5156%0.557SS.*  trans-62.8110.2167.357000098.1T176 S177 Q181T176-S179 VanDerWaalsContact CG2-CB 3.41Å; T176-S179 VanDerWaalsContact CG2-N 3.27Å; T176-S179 WeakPolarHBondContact CG2-OG 3.25Å; S177-S179 VanDerWaalsContact C-N 3.25Å; S177-S179 PolarHBondContact O-N 2.85Å; S179-Q181 WeakPolarHBondContact O-CA 3.33Å; S179-Q181 PolarHBondContact O-N 3.4Å
180P41.4Very low52.9Low114 Ų114100.7 Ų100.774%0.7453%0.525SS*.  trans-44.5112.7-164.216.8-31000104.1D178 R182D178-P180 VanDerWaalsContact O-CD 3.28Å; D178-P180 WeakPolarHBondContact O-CD 3.37Å; P180-R182 VanDerWaalsContact C-N 3.35Å; P180-R182 VanDerWaalsContact O-CA 3.31Å; P180-R182 WeakPolarHBondContact O-CA 3.36Å; P180-R182 PolarHBondContact O-N 3.49Å
181Q44.7Very low55.1Low167 Ų167102.6 Ų102.678%0.7853%0.53SS*.  trans-41.9112.3-169.4-77.1-170.7-13.900103.5S179 E183S179-Q181 WeakPolarHBondContact O-CA 3.33Å; S179-Q181 PolarHBondContact O-N 3.4Å; Q181-E183 VanDerWaalsContact O-CA 3.3Å; Q181-E183 WeakPolarHBondContact O-CA 3.31Å; Q181-E183 WeakPolarHBondContact O-CG 3.36Å; Q181-E183 PolarHBondContact O-N 2.85Å
182R44.3Very low57.6Low242 Ų24295.6 Ų95.691%0.91350%0.501SS*.  trans-59.596.9-166.6178.8-177.3-178.8-167.10.6103.4P180 K184P180-R182 VanDerWaalsContact C-N 3.35Å; P180-R182 VanDerWaalsContact O-CA 3.31Å; P180-R182 WeakPolarHBondContact O-CA 3.36Å; P180-R182 PolarHBondContact O-N 3.49Å; R182-K184 PolarHBondContact O-N 3.14Å; R182-K184 VanDerWaalsContact O-N 3.12Å
183E54.9Low60.4Low79 Ų7986.3 Ų86.337%0.36946%0.461SS..  trans-58.6131.6-164.9-70-174.9-169.500102.8Q181 V185 I242Q181-E183 VanDerWaalsContact O-CA 3.3Å; Q181-E183 WeakPolarHBondContact O-CA 3.31Å; Q181-E183 WeakPolarHBondContact O-CG 3.36Å; Q181-E183 PolarHBondContact O-N 2.85Å; E183-V185 VanDerWaalsContact O-CG2 3.24Å; E183-V185 WeakPolarHBondContact O-CG2 3.33Å; E183-V185 PolarHBondContact O-N 3.25Å; E183-I242 VanDerWaalsContact OE1-CD1 3.29Å; E183-I242 WeakPolarHBondContact OE1-CD1 3.26Å; E183-I242 PolarHBondContact OE2-N 3.45Å
184K63.4Low62.7Low159 Ų15985 Ų8569%0.69146%0.456SS*.  trans-64.490.3179.1-172.2178.4179.1-176.40105.3R182 L186 T187R182-K184 PolarHBondContact O-N 3.14Å; R182-K184 VanDerWaalsContact O-N 3.12Å; K184-L186 PolarHBondContact O-N 2.92Å; K184-L186 VanDerWaalsContact O-N 3.12Å; K184-T187 VanDerWaalsContact O-CG2 3.23Å; K184-T187 WeakPolarHBondContact O-CG2 3.34Å; K184-T187 PolarHBondContact O-N 3.29Å
185V64Low65.6Low88 Ų8886 Ų8653%0.53346%0.462SS..SBendtrans-60.6-30.9-169.5-178.80000109.5E183 T187 N190 L243E183-V185 VanDerWaalsContact O-CG2 3.24Å; E183-V185 WeakPolarHBondContact O-CG2 3.33Å; E183-V185 PolarHBondContact O-N 3.25Å; V185-T187 PolarHBondContact O-N 3.37Å; V185-N190 WeakPolarHBondContact O-CB 3.35Å; V185-N190 PolarHBondContact O-ND2 3.4Å; V185-L243 HydrophobicContact CG1-CD1 4.03Å; V185-L243 HydrophobicContact CG2-CD1 4.49Å
186L72.1Confident68.3Low123 Ų12382.7 Ų82.764%0.64444%0.444SS*.  trans-89.575.7173.7-157.476.9000110.8K184 L191K184-L186 PolarHBondContact O-N 2.92Å; K184-L186 VanDerWaalsContact O-N 3.12Å; L186-L191 HydrophobicContact CD1-CD1 4.31Å
187T84.2Confident71.1Confident7 Ų781.5 Ų81.54%0.04343%0.434CS..  trans-90161.3162.158.50000110.3K184 V185 P189 N190 L191 Q239 T241K184-T187 VanDerWaalsContact O-CG2 3.23Å; K184-T187 WeakPolarHBondContact O-CG2 3.34Å; K184-T187 PolarHBondContact O-N 3.29Å; V185-T187 PolarHBondContact O-N 3.37Å; T187-P189 VanDerWaalsContact C-N 3.33Å; T187-N190 PolarHBondContact O-N 2.96Å; T187-L191 PolarHBondContact O-N 3.48Å; T187-L191 VanDerWaalsContact O-N 3.08Å; T187-Q239 PolarHBondContact OG1-O 3.29Å; T187-T241 HydrophobicContact CG2-CG2 3.55Å
188I88.7Confident73.7Confident101 Ų10180.4 Ų80.452%0.51843%0.43SS..Hα-helixtrans-56.2-45177.1-59.6167.5000110.7N190 L191 L192I188-N190 PolarHBondContact O-N 2.88Å; I188-L191 PolarHBondContact O-N 3.45Å; I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 WeakPolarHBondContact O-CG 3.11Å; I188-L192 PolarHBondContact O-N 3.36Å; I188-L192 VanDerWaalsContact O-N 3.1Å
189P88.9Confident76.3Confident10 Ų1075.5 Ų75.57%0.06541%0.407CS..Hα-helixtrans-60.4-44.2176.3-27.137.6000114.1T187 L191 L192 C193 D229 I232 A233 Q239T187-P189 VanDerWaalsContact C-N 3.33Å; P189-L191 VanDerWaalsContact C-N 3.27Å; P189-L191 PolarHBondContact O-N 3.28Å; P189-L192 PolarHBondContact O-N 2.92Å; P189-C193 WeakPolarHBondContact O-CB 3.38Å; P189-C193 PolarHBondContact O-N 2.8Å; P189-D229 HydrophobicContact CB-CB 4Å; P189-I232 HydrophobicContact CG-CB 4.48Å; P189-I232 HydrophobicContact CG-CG2 4.07Å; P189-A233 HydrophobicContact CG-CB 4.18Å; P189-Q239 HydrophobicContact CG-CB 4.43Å
190N89.4Confident79Confident21 Ų2172 Ų7211%0.11238%0.383CS..Hα-helixtrans-66.7-30.3-179.4-69.92.7000112.4V185 T187 I188 S194 T241 G244V185-N190 WeakPolarHBondContact O-CB 3.35Å; V185-N190 PolarHBondContact O-ND2 3.4Å; T187-N190 PolarHBondContact O-N 2.96Å; I188-N190 PolarHBondContact O-N 2.88Å; N190-S194 WeakPolarHBondContact O-CB 3.43Å; N190-S194 PolarHBondContact O-N 2.9Å; N190-S194 PolarHBondContact O-OG 2.99Å; N190-T241 PolarHBondContact ND2-OG1 3.42Å; N190-T241 PolarHBondContact OD1-OG1 3.18Å; N190-T241 VanDerWaalsContact OD1-OG1 3.1Å; N190-G244 WeakPolarHBondContact OD1-CA 3.31Å
191L89.4Confident81.6Confident97 Ų9770.7 Ų70.751%0.50837%0.374SS..Hα-helixtrans-70.8-39.8174.1-176.368.2000111.9L186 T187 I188 P189 S194 A195L186-L191 HydrophobicContact CD1-CD1 4.31Å; T187-L191 PolarHBondContact O-N 3.48Å; T187-L191 VanDerWaalsContact O-N 3.08Å; I188-L191 PolarHBondContact O-N 3.45Å; P189-L191 VanDerWaalsContact C-N 3.27Å; P189-L191 PolarHBondContact O-N 3.28Å; L191-S194 WeakPolarHBondContact CA-OG 3.44Å; L191-S194 PolarHBondContact O-OG 3.2Å; L191-A195 WeakPolarHBondContact O-CB 3.2Å; L191-A195 PolarHBondContact O-N 3.47Å
192L90.3Very high84Confident42 Ų4267.1 Ų67.122%0.2236%0.36CS..Hα-helixtrans-66.9-43.1175.8-69.2173.4000111.3I188 P189 A195 R196 T225 D229I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 WeakPolarHBondContact O-CG 3.11Å; I188-L192 PolarHBondContact O-N 3.36Å; I188-L192 VanDerWaalsContact O-N 3.1Å; P189-L192 PolarHBondContact O-N 2.92Å; L192-A195 WeakPolarHBondContact O-CB 3.39Å; L192-A195 PolarHBondContact O-N 3.46Å; L192-R196 PolarHBondContact O-N 3.47Å; L192-T225 HydrophobicContact CD2-CG2 4.32Å; L192-D229 HydrophobicContact CB-CB 4.05Å; L192-D229 HydrophobicContact CD1-CB 3.84Å
193C91.1Very high86.4Confident4 Ų455.7 Ų55.73%0.02732%0.317CS..Hα-helixtrans-62.8-42.4175-171.20000112.3P189 A195 R196 I197 A251P189-C193 WeakPolarHBondContact O-CB 3.38Å; P189-C193 PolarHBondContact O-N 2.8Å; C193-A195 VanDerWaalsContact C-N 3.34Å; C193-A195 PolarHBondContact O-N 3.13Å; C193-R196 WeakPolarHBondContact O-CB 3.39Å; C193-R196 PolarHBondContact O-N 2.83Å; C193-I197 PolarHBondContact O-N 2.84Å; C193-I197 VanDerWaalsContact O-N 3.14Å; C193-A251 VanDerWaalsContact SG-CB 3.56Å
194S90.8Very high88.4Confident58 Ų5852.2 Ų52.241%0.40630%0.302SS..Hα-helixtrans-67-34.917668.60000112.6N190 L191 R196 I197 A198N190-S194 WeakPolarHBondContact O-CB 3.43Å; N190-S194 PolarHBondContact O-N 2.9Å; N190-S194 PolarHBondContact O-OG 2.99Å; L191-S194 WeakPolarHBondContact CA-OG 3.44Å; L191-S194 PolarHBondContact O-OG 3.2Å; S194-R196 VanDerWaalsContact C-N 3.35Å; S194-I197 PolarHBondContact O-N 3.48Å; S194-A198 PolarHBondContact O-N 3.16Å
195A92.9Very high90Very high54 Ų5452 Ų5245%0.44630%0.298SS..Hα-helixtrans-62.2-39.2171.500000112L191 L192 C193 A198 A199L191-A195 WeakPolarHBondContact O-CB 3.2Å; L191-A195 PolarHBondContact O-N 3.47Å; L192-A195 WeakPolarHBondContact O-CB 3.39Å; L192-A195 PolarHBondContact O-N 3.46Å; C193-A195 VanDerWaalsContact C-N 3.34Å; C193-A195 PolarHBondContact O-N 3.13Å; A195-A198 PolarHBondContact O-N 3.1Å; A195-A199 WeakPolarHBondContact O-CB 3.24Å; A195-A199 PolarHBondContact O-N 3.13Å
196R93.9Very high91.5Very high5 Ų549.5 Ų49.52%0.01928%0.282CS..Hα-helixtrans-62.2-42.8174.1-73-172-80.4151.3-9.6112.7L192 C193 S194 A198 A199 S200 A222 D226 D229 D248 D252L192-R196 PolarHBondContact O-N 3.47Å; C193-R196 WeakPolarHBondContact O-CB 3.39Å; C193-R196 PolarHBondContact O-N 2.83Å; S194-R196 VanDerWaalsContact C-N 3.35Å; R196-A198 VanDerWaalsContact C-N 3.35Å; R196-A199 PolarHBondContact O-N 3.45Å; R196-S200 PolarHBondContact O-N 3.34Å; R196-S200 PolarHBondContact O-OG 3.35Å; R196-A222 HydrophobicContact CG-CB 4.39Å; R196-D226 IonicContact CZ-OD1 2.72Å; R196-D226 VanDerWaalsContact CZ-OD1 3.25Å; R196-D226 VanDerWaalsContact NH1-CG 3.32Å; R196-D226 IonicContact NH1-OD1 3.37Å; R196-D226 PolarHBondContact NH1-OD1 3.29Å; R196-D226 IonicContact NH2-OD1 2.69Å; R196-D226 PolarHBondContact NH2-OD1 3.44Å; R196-D229 IonicContact CZ-OD2 3.51Å; R196-D229 IonicContact NE-OD2 3.33Å; R196-D229 IonicContact NH2-OD1 3.52Å; R196-D229 PolarHBondContact NH2-OD1 2.97Å; R196-D229 IonicContact NH2-OD2 3.42Å; R196-D229 PolarHBondContact NH2-OD2 3.44Å; R196-D248 IonicContact CZ-OD1 2.78Å; R196-D248 IonicContact NH1-OD1 2.93Å; R196-D248 PolarHBondContact NH1-OD1 3.03Å; R196-D248 IonicContact NH2-OD1 3.25Å; R196-D248 PolarHBondContact NH2-OD1 3.32Å; R196-D252 IonicContact NH1-OD1 3.07Å; R196-D252 PolarHBondContact NH1-OD1 3.44Å
197I93.7Very high92.7Very high54 Ų5443.7 Ų43.728%0.27725%0.251SS..Hα-helixtrans-62.2-44.6176-65.4171.6000110.5C193 S194 A199 S200 P201 I247 L250 A251C193-I197 PolarHBondContact O-N 2.84Å; C193-I197 VanDerWaalsContact O-N 3.14Å; S194-I197 PolarHBondContact O-N 3.48Å; I197-A199 VanDerWaalsContact C-N 3.32Å; I197-A199 PolarHBondContact O-N 2.95Å; I197-S200 PolarHBondContact O-N 2.79Å; I197-P201 WeakPolarHBondContact O-CD 3.34Å; I197-I247 HydrophobicContact CD1-CG2 3.78Å; I197-L250 HydrophobicContact CD1-CD2 4.39Å; I197-A251 HydrophobicContact CD1-CB 4.11Å; I197-A251 HydrophobicContact CG1-CB 3.68Å
198A93.8Very high93.2Very high69 Ų6946.3 Ų46.357%0.5727%0.267SS*.Hα-helixtrans-67.2-32.9176.900000112.7S194 A195 R196 P201S194-A198 PolarHBondContact O-N 3.16Å; A195-A198 PolarHBondContact O-N 3.1Å; R196-A198 VanDerWaalsContact C-N 3.35Å; A198-P201 WeakPolarHBondContact O-CD 3.33Å; A198-P201 WeakPolarHBondContact O-CG 3.34Å
199A93.3Very high93.5Very high19 Ų1945 Ų4516%0.15727%0.266CS..Hα-helixtrans-75.7-22.7178.500000113.6A195 R196 I197 L202 L203 L218A195-A199 WeakPolarHBondContact O-CB 3.24Å; A195-A199 PolarHBondContact O-N 3.13Å; R196-A199 PolarHBondContact O-N 3.45Å; I197-A199 VanDerWaalsContact C-N 3.32Å; I197-A199 PolarHBondContact O-N 2.95Å; A199-L202 WeakPolarHBondContact O-CB 3.3Å; A199-L202 PolarHBondContact O-N 2.86Å; A199-L203 VanDerWaalsContact O-CB 3.24Å; A199-L203 WeakPolarHBondContact O-CB 3.41Å; A199-L203 PolarHBondContact O-N 3.02Å; A199-L218 HydrophobicContact CB-CD2 3.69Å
200S94.2Very high93.7Very high0 Ų046.2 Ų46.20%028%0.28CS..Hα-helixtrans-57.9-52.8-179.6-600000113.7R196 I197 L202 L203 G204 L255R196-S200 PolarHBondContact O-N 3.34Å; R196-S200 PolarHBondContact O-OG 3.35Å; I197-S200 PolarHBondContact O-N 2.79Å; S200-L202 VanDerWaalsContact C-N 3.32Å; S200-L202 PolarHBondContact O-N 3.18Å; S200-L203 PolarHBondContact O-N 3.03Å; S200-G204 PolarHBondContact O-N 2.85Å; S200-L255 WeakPolarHBondContact OG-CA 3.24Å
201P95.5Very high93.9Very high86 Ų8646.8 Ų46.856%0.55829%0.288SS*.Hα-helixtrans-65.8-33.4174.926-34.6000112.8I197 A198 L203 G204 Y205I197-P201 WeakPolarHBondContact O-CD 3.34Å; A198-P201 WeakPolarHBondContact O-CD 3.33Å; A198-P201 WeakPolarHBondContact O-CG 3.34Å; P201-L203 VanDerWaalsContact C-N 3.34Å; P201-G204 PolarHBondContact O-N 2.95Å; P201-Y205 WeakPolarHBondContact O-CB 3.37Å; P201-Y205 PolarHBondContact O-N 3.08Å
202L94.9Very high94.1Very high92 Ų9244.3 Ų44.348%0.48227%0.272SS..Hα-helixtrans-63.4-42.2175.4177.464.3000111.3A199 S200 Y205 L206 L218A199-L202 WeakPolarHBondContact O-CB 3.3Å; A199-L202 PolarHBondContact O-N 2.86Å; S200-L202 VanDerWaalsContact C-N 3.32Å; S200-L202 PolarHBondContact O-N 3.18Å; L202-Y205 WeakPolarHBondContact O-CB 3.43Å; L202-Y205 PolarHBondContact O-N 2.91Å; L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 3.38Å; L202-L218 HydrophobicContact CD2-CD1 3.84Å; L202-L218 HydrophobicContact CG-CD1 4.15Å
203L95.9Very high94.3Very high1 Ų144.1 Ų44.11%0.00528%0.28CS..Hα-helixtrans-67.1-43177.6-163.2162.7000110.5A199 S200 P201 Y205 L206 V207 L218 F219 L259A199-L203 VanDerWaalsContact O-CB 3.24Å; A199-L203 WeakPolarHBondContact O-CB 3.41Å; A199-L203 PolarHBondContact O-N 3.02Å; S200-L203 PolarHBondContact O-N 3.03Å; P201-L203 VanDerWaalsContact C-N 3.34Å; L203-Y205 VanDerWaalsContact C-N 3.32Å; L203-Y205 PolarHBondContact O-N 3.09Å; L203-L206 PolarHBondContact O-N 3.13Å; L203-V207 HydrophobicContact CD2-CG2 4.07Å; L203-V207 WeakPolarHBondContact O-CG2 3.4Å; L203-V207 PolarHBondContact O-N 2.98Å; L203-L218 HydrophobicContact CB-CD2 4.32Å; L203-L218 HydrophobicContact CD1-CB 4.4Å; L203-L218 HydrophobicContact CD1-CD2 3.75Å; L203-L218 HydrophobicContact CG-CD2 4.37Å; L203-F219 HydrophobicContact CD1-CB 3.87Å; L203-F219 HydrophobicContact CD1-CD2 4.3Å; L203-L259 HydrophobicContact CD1-CD1 4.44Å; L203-L259 HydrophobicContact CD2-CD1 3.77Å; L203-L259 HydrophobicContact CD2-CD2 3.12Å; L203-L259 HydrophobicContact CD2-CG 3.49Å; L203-L259 VanDerWaalsContact CD2-CG 3.49Å
204G96.3Very high94.5Very high6 Ų647.2 Ų47.26%0.06230%0.3CS..Hα-helixtrans-57.2-44.1171.900000112.6S200 P201 V207 V208 T262S200-G204 PolarHBondContact O-N 2.85Å; P201-G204 PolarHBondContact O-N 2.95Å; G204-V207 PolarHBondContact O-N 3.44Å; G204-V208 WeakPolarHBondContact O-CG2 3.45Å; G204-V208 PolarHBondContact O-N 3.33Å; G204-T262 VanDerWaalsContact CA-CG2 3.43Å
205Y96.8Very high94.7Very high156 Ų15644.4 Ų44.461%0.61228%0.281SS*.Hα-helixtrans-60.3-46.3175176.7-99.2000112.3P201 L202 L203 V207 V208 C209P201-Y205 WeakPolarHBondContact O-CB 3.37Å; P201-Y205 PolarHBondContact O-N 3.08Å; L202-Y205 WeakPolarHBondContact O-CB 3.43Å; L202-Y205 PolarHBondContact O-N 2.91Å; L203-Y205 VanDerWaalsContact C-N 3.32Å; L203-Y205 PolarHBondContact O-N 3.09Å; Y205-V207 VanDerWaalsContact C-N 3.32Å; Y205-V207 PolarHBondContact O-N 3.08Å; Y205-V208 PolarHBondContact O-N 3.26Å; Y205-C209 VanDerWaalsContact CZ-SG 3.54Å; Y205-C209 PolarHBondContact O-N 3.49Å; Y205-C209 PolarHBondContact O-SG 3.21Å
206L96.3Very high94.8Very high35 Ų3543.5 Ų43.518%0.18327%0.268CS..Hα-helixtrans-60.9-40.2177.9-72.5170000112.7L202 L203 C209 G210 A211 P214 A215 L218L202-L206 WeakPolarHBondContact O-CG 3.22Å; L202-L206 PolarHBondContact O-N 3.38Å; L203-L206 PolarHBondContact O-N 3.13Å; L206-C209 PolarHBondContact O-N 3.34Å; L206-G210 PolarHBondContact O-N 2.83Å; L206-A211 HydrophobicContact CD2-CB 4.41Å; L206-A211 PolarHBondContact O-N 3.46Å; L206-P214 HydrophobicContact CD1-CB 4.48Å; L206-P214 HydrophobicContact CD2-CG 4.32Å; L206-A215 HydrophobicContact CB-CB 4.12Å; L206-L218 HydrophobicContact CD1-CD1 4.04Å
207V96Very high94.9Very high0 Ų046 Ų460%029%0.29CS..Hα-helixtrans-64.3-50175.9172.40000110.1L203 G204 Y205 C209 G210 Y212 A215 L259 L263 N266 L343L203-V207 HydrophobicContact CD2-CG2 4.07Å; L203-V207 WeakPolarHBondContact O-CG2 3.4Å; L203-V207 PolarHBondContact O-N 2.98Å; G204-V207 PolarHBondContact O-N 3.44Å; Y205-V207 VanDerWaalsContact C-N 3.32Å; Y205-V207 PolarHBondContact O-N 3.08Å; V207-C209 PolarHBondContact O-N 3.14Å; V207-G210 WeakPolarHBondContact O-CA 3.42Å; V207-G210 PolarHBondContact O-N 2.93Å; V207-Y212 HydrophobicContact CG1-CE1 4.31Å; V207-A215 HydrophobicContact CG2-CB 3.82Å; V207-L259 HydrophobicContact CG2-CD2 3.97Å; V207-L263 HydrophobicContact CG1-CD2 3.76Å; V207-L263 HydrophobicContact CG1-CG 4.21Å; V207-N266 PolarHBondContact O-ND2 3.02Å; V207-L343 HydrophobicContact CG2-CD1 4.05Å
208V95.6Very high94.9Very high63 Ų6345.2 Ų45.238%0.38229%0.286SS..Hα-helixtrans-59.1-36.1178.7171.40000112.1G204 Y205 G210 T262 Y265G204-V208 WeakPolarHBondContact O-CG2 3.45Å; G204-V208 PolarHBondContact O-N 3.33Å; Y205-V208 PolarHBondContact O-N 3.26Å; V208-G210 PolarHBondContact O-N 2.83Å; V208-T262 HydrophobicContact CG2-CG2 3.96Å; V208-Y265 HydrophobicContact CG1-CD1 4.1Å; V208-Y265 HydrophobicContact CG1-CE1 3.84Å; V208-Y265 HydrophobicContact CG2-CD1 4.03Å
209C94.9Very high95Very high74 Ų7442.7 Ų42.750%0.526%0.262SS..THydrogen-bonded Turntrans-70-3.1173.6-68.90000114.3Y205 L206 V207 A211Y205-C209 VanDerWaalsContact CZ-SG 3.54Å; Y205-C209 PolarHBondContact O-N 3.49Å; Y205-C209 PolarHBondContact O-SG 3.21Å; L206-C209 PolarHBondContact O-N 3.34Å; V207-C209 PolarHBondContact O-N 3.14Å; C209-A211 PolarHBondContact O-N 3.03Å
210G92.6Very high95Very high35 Ų3545 Ų4536%0.36128%0.277SS..THydrogen-bonded Turntrans73.39.8-176.300000114L206 V207 V208 Y212L206-G210 PolarHBondContact O-N 2.83Å; V207-G210 WeakPolarHBondContact O-CA 3.42Å; V207-G210 PolarHBondContact O-N 2.93Å; V208-G210 PolarHBondContact O-N 2.83Å; G210-Y212 VanDerWaalsContact C-N 3.27Å; G210-Y212 WeakPolarHBondContact O-CD2 3.46Å; G210-Y212 WeakPolarHBondContact O-CE2 3.49Å; G210-Y212 PolarHBondContact O-N 3.32Å
211A94.5Very high95Very high32 Ų3249.3 Ų49.326%0.26430%0.303SS..  trans-85.167.5-179.300000110.6L206 C209 G213 P214 A215L206-A211 HydrophobicContact CD2-CB 4.41Å; L206-A211 PolarHBondContact O-N 3.46Å; C209-A211 PolarHBondContact O-N 3.03Å; A211-G213 VanDerWaalsContact C-N 3.34Å; A211-G213 PolarHBondContact O-N 3.48Å; A211-P214 HydrophobicContact CB-CG 3.72Å; A211-P214 VanDerWaalsContact O-CD 3.23Å; A211-P214 WeakPolarHBondContact O-CD 3.43Å; A211-P214 VanDerWaalsContact O-CG 3.28Å; A211-P214 WeakPolarHBondContact O-CG 3.26Å; A211-A215 WeakPolarHBondContact O-CB 3.23Å; A211-A215 PolarHBondContact O-N 2.9Å
212Y93.9Very high94.9Very high45 Ų4545.5 Ų45.518%0.17628%0.279CS..Hα-helixtrans-66.7-31.7-173.6-55-69.2000113.8V207 G210 A215 L216 N266 L268 P346V207-Y212 HydrophobicContact CG1-CE1 4.31Å; G210-Y212 VanDerWaalsContact C-N 3.27Å; G210-Y212 WeakPolarHBondContact O-CD2 3.46Å; G210-Y212 WeakPolarHBondContact O-CE2 3.49Å; G210-Y212 PolarHBondContact O-N 3.32Å; Y212-A215 PolarHBondContact O-N 3.02Å; Y212-L216 WeakPolarHBondContact O-CB 3.32Å; Y212-L216 PolarHBondContact O-N 3.49Å; Y212-N266 PolarHBondContact OH-ND2 3.05Å; Y212-L268 HydrophobicContact CE1-CD1 4.43Å; Y212-L268 HydrophobicContact CE1-CD2 4.12Å; Y212-P346 HydrophobicContact CD1-CG 3.77Å; Y212-P346 HydrophobicContact CD2-CB 3.54Å; Y212-P346 HydrophobicContact CD2-CG 3.56Å; Y212-P346 HydrophobicContact CE1-CG 4.19Å; Y212-P346 HydrophobicContact CE2-CB 3.81Å; Y212-P346 HydrophobicContact CE2-CG 4Å; Y212-P346 HydrophobicContact CG-CB 3.97Å; Y212-P346 HydrophobicContact CG-CG 3.42Å; Y212-P346 VanDerWaalsContact CG-CG 3.42Å
213G94.2Very high94.7Very high39 Ų3943 Ų4340%0.40228%0.275SS..Hα-helixtrans-56.7-60.8176.200000113.3A211 A215 L216 A217A211-G213 VanDerWaalsContact C-N 3.34Å; A211-G213 PolarHBondContact O-N 3.48Å; G213-A215 VanDerWaalsContact C-N 3.28Å; G213-A215 PolarHBondContact O-N 3.17Å; G213-L216 PolarHBondContact O-N 3.33Å; G213-A217 PolarHBondContact O-N 3.47Å; G213-A217 VanDerWaalsContact O-N 3.14Å
214P95.1Very high94.6Very high68 Ų6845.7 Ų45.744%0.44230%0.298SS..Hα-helixtrans-65.4-30175.924.7-33.3000112.7L206 A211 A217 L218L206-P214 HydrophobicContact CD1-CB 4.48Å; L206-P214 HydrophobicContact CD2-CG 4.32Å; A211-P214 HydrophobicContact CB-CG 3.72Å; A211-P214 VanDerWaalsContact O-CD 3.23Å; A211-P214 WeakPolarHBondContact O-CD 3.43Å; A211-P214 VanDerWaalsContact O-CG 3.28Å; A211-P214 WeakPolarHBondContact O-CG 3.26Å; P214-A217 PolarHBondContact O-N 2.86Å; P214-L218 WeakPolarHBondContact O-CB 3.37Å; P214-L218 PolarHBondContact O-N 2.92Å
215A95.5Very high94.4Very high0 Ų046.8 Ų46.80%030%0.303CS..Hα-helixtrans-62.9-41.7173.700000112.1L206 V207 A211 Y212 G213 L218 F219 L343L206-A215 HydrophobicContact CB-CB 4.12Å; V207-A215 HydrophobicContact CG2-CB 3.82Å; A211-A215 WeakPolarHBondContact O-CB 3.23Å; A211-A215 PolarHBondContact O-N 2.9Å; Y212-A215 PolarHBondContact O-N 3.02Å; G213-A215 VanDerWaalsContact C-N 3.28Å; G213-A215 PolarHBondContact O-N 3.17Å; A215-L218 PolarHBondContact O-N 3.09Å; A215-F219 VanDerWaalsContact O-CB 3.24Å; A215-F219 WeakPolarHBondContact O-CB 3.36Å; A215-F219 PolarHBondContact O-N 2.72Å; A215-L343 HydrophobicContact CB-CD1 4.45Å; A215-L343 HydrophobicContact CB-CD2 4.3Å
216L94.6Very high94.1Very high35 Ų3541.2 Ų41.218%0.18328%0.284CS..Hα-helixtrans-66.7-41.7177.9-17269.6000111.4Y212 G213 F219 S220 L343 A344 V347Y212-L216 WeakPolarHBondContact O-CB 3.32Å; Y212-L216 PolarHBondContact O-N 3.49Å; G213-L216 PolarHBondContact O-N 3.33Å; L216-F219 PolarHBondContact O-N 3.2Å; L216-S220 WeakPolarHBondContact O-CB 3.2Å; L216-S220 PolarHBondContact O-N 3.39Å; L216-S220 PolarHBondContact O-OG 2.96Å; L216-L343 HydrophobicContact CB-CD2 3.44Å; L216-L343 VanDerWaalsContact CB-CD2 3.44Å; L216-L343 HydrophobicContact CD1-CD2 3.5Å; L216-L343 VanDerWaalsContact CD1-CD2 3.5Å; L216-L343 HydrophobicContact CG-CD2 4.06Å; L216-A344 HydrophobicContact CD1-CB 4.05Å; L216-A344 HydrophobicContact CD2-CB 4.3Å; L216-V347 HydrophobicContact CD2-CG1 4.39Å; L216-V347 HydrophobicContact CD2-CG2 4.36Å
217A95.2Very high93.7Very high56 Ų5645.2 Ų45.246%0.46331%0.305SS..Hα-helixtrans-61.7-46174.200000111.3G213 P214 S220 V221G213-A217 PolarHBondContact O-N 3.47Å; G213-A217 VanDerWaalsContact O-N 3.14Å; P214-A217 PolarHBondContact O-N 2.86Å; A217-S220 WeakPolarHBondContact CA-OG 3.46Å; A217-S220 PolarHBondContact O-OG 3.04Å; A217-V221 WeakPolarHBondContact O-CB 3.28Å; A217-V221 VanDerWaalsContact O-CG2 3.24Å; A217-V221 WeakPolarHBondContact O-CG2 3.47Å; A217-V221 PolarHBondContact O-N 3.08Å
218L94.4Very high93.5Very high38 Ų3849.6 Ų49.620%0.19933%0.328CS..Hα-helixtrans-65.1-46.3178.5-156.3161.9000111A199 L202 L203 L206 P214 A215 S220 V221 A222A199-L218 HydrophobicContact CB-CD2 3.69Å; L202-L218 HydrophobicContact CD2-CD1 3.84Å; L202-L218 HydrophobicContact CG-CD1 4.15Å; L203-L218 HydrophobicContact CB-CD2 4.32Å; L203-L218 HydrophobicContact CD1-CB 4.4Å; L203-L218 HydrophobicContact CD1-CD2 3.75Å; L203-L218 HydrophobicContact CG-CD2 4.37Å; L206-L218 HydrophobicContact CD1-CD1 4.04Å; P214-L218 WeakPolarHBondContact O-CB 3.37Å; P214-L218 PolarHBondContact O-N 2.92Å; A215-L218 PolarHBondContact O-N 3.09Å; L218-S220 PolarHBondContact O-N 3.22Å; L218-V221 PolarHBondContact O-N 3.37Å; L218-A222 WeakPolarHBondContact O-CB 3.24Å; L218-A222 PolarHBondContact O-N 2.78Å
219F94.5Very high93.3Very high17 Ų1746.8 Ų46.88%0.07531%0.311CS..Hα-helixtrans-60.1-45.2179.1179.9-113.3000112.4L203 A215 L216 A222 G223 L255 L259 V339 C340L203-F219 HydrophobicContact CD1-CB 3.87Å; L203-F219 HydrophobicContact CD1-CD2 4.3Å; A215-F219 VanDerWaalsContact O-CB 3.24Å; A215-F219 WeakPolarHBondContact O-CB 3.36Å; A215-F219 PolarHBondContact O-N 2.72Å; L216-F219 PolarHBondContact O-N 3.2Å; F219-A222 PolarHBondContact O-N 3.25Å; F219-G223 PolarHBondContact O-N 3.28Å; F219-L255 HydrophobicContact CD2-CD2 3.89Å; F219-L255 HydrophobicContact CE2-CD2 3.65Å; F219-L259 HydrophobicContact CD2-CD1 3.32Å; F219-L259 HydrophobicContact CE2-CD1 3.47Å; F219-L259 VanDerWaalsContact CE2-CD1 3.47Å; F219-L259 HydrophobicContact CG-CD1 4.18Å; F219-L259 HydrophobicContact CZ-CD1 4.41Å; F219-V339 HydrophobicContact CE1-CG1 4.35Å; F219-V339 HydrophobicContact CE2-CG1 4.09Å; F219-V339 HydrophobicContact CZ-CB 4.47Å; F219-V339 HydrophobicContact CZ-CG1 3.84Å; F219-C340 HydrophobicContact CE1-CB 4.41Å; F219-C340 VanDerWaalsContact CE1-SG 3.5Å
220S93.6Very high92.9Very high67 Ų6744.3 Ų44.347%0.46930%0.297SS..Hα-helixtrans-64.7-41.7177.154.10000112.3L216 A217 L218 G223 A224L216-S220 WeakPolarHBondContact O-CB 3.2Å; L216-S220 PolarHBondContact O-N 3.39Å; L216-S220 PolarHBondContact O-OG 2.96Å; A217-S220 WeakPolarHBondContact CA-OG 3.46Å; A217-S220 PolarHBondContact O-OG 3.04Å; L218-S220 PolarHBondContact O-N 3.22Å; S220-G223 PolarHBondContact O-N 2.93Å; S220-A224 WeakPolarHBondContact O-CB 3.46Å; S220-A224 PolarHBondContact O-N 2.71Å
221V94.4Very high92.8Very high91 Ų9147.9 Ų47.955%0.55231%0.308SS*.Hα-helixtrans-61.1-44.9172.6171.20000110.7A217 L218 G223 A224 T225A217-V221 WeakPolarHBondContact O-CB 3.28Å; A217-V221 VanDerWaalsContact O-CG2 3.24Å; A217-V221 WeakPolarHBondContact O-CG2 3.47Å; A217-V221 PolarHBondContact O-N 3.08Å; L218-V221 PolarHBondContact O-N 3.37Å; V221-G223 PolarHBondContact O-N 3.02Å; V221-A224 PolarHBondContact O-N 3.22Å; V221-T225 HydrophobicContact CG1-CG2 4.38Å; V221-T225 WeakPolarHBondContact O-CG2 3.35Å; V221-T225 PolarHBondContact O-N 3.17Å; V221-T225 PolarHBondContact O-OG1 2.75Å
222A93.4Very high92.5Very high6 Ų648.1 Ų48.15%0.0530%0.304CS..Hα-helixtrans-61.3-45.5178.400000112R196 L218 F219 A224 T225 D226 L255R196-A222 HydrophobicContact CG-CB 4.39Å; L218-A222 WeakPolarHBondContact O-CB 3.24Å; L218-A222 PolarHBondContact O-N 2.78Å; F219-A222 PolarHBondContact O-N 3.25Å; A222-A224 PolarHBondContact O-N 3.49Å; A222-T225 WeakPolarHBondContact CA-OG1 3.38Å; A222-T225 PolarHBondContact O-N 3.43Å; A222-T225 PolarHBondContact O-OG1 2.9Å; A222-D226 PolarHBondContact O-N 3.49Å; A222-L255 HydrophobicContact CB-CD1 3.77Å
223G91.7Very high92.2Very high39 Ų3947.7 Ų47.740%0.40231%0.31SS..Hα-helixtrans-64-38175.300000113.3F219 S220 V221 D226 L227F219-G223 PolarHBondContact O-N 3.28Å; S220-G223 PolarHBondContact O-N 2.93Å; V221-G223 PolarHBondContact O-N 3.02Å; G223-D226 PolarHBondContact O-N 2.88Å; G223-L227 PolarHBondContact O-N 3.47Å
224A92.4Very high91.8Very high58 Ų5856.4 Ų56.448%0.47933%0.33SS..Hα-helixtrans-67-36.7174.200000112.2S220 V221 A222 D226 L227 L228S220-A224 WeakPolarHBondContact O-CB 3.46Å; S220-A224 PolarHBondContact O-N 2.71Å; V221-A224 PolarHBondContact O-N 3.22Å; A222-A224 PolarHBondContact O-N 3.49Å; A224-D226 VanDerWaalsContact C-N 3.33Å; A224-D226 PolarHBondContact O-N 3.09Å; A224-L227 PolarHBondContact O-N 2.98Å; A224-L228 WeakPolarHBondContact O-CB 3.47Å; A224-L228 PolarHBondContact O-N 3.02Å
225T92.4Very high91.5Very high29 Ų2963.1 Ų63.118%0.17835%0.349CS..Hα-helixtrans-67.8-30.1178.153.80000113.6L192 V221 A222 L228 D229L192-T225 HydrophobicContact CD2-CG2 4.32Å; V221-T225 HydrophobicContact CG1-CG2 4.38Å; V221-T225 WeakPolarHBondContact O-CG2 3.35Å; V221-T225 PolarHBondContact O-N 3.17Å; V221-T225 PolarHBondContact O-OG1 2.75Å; A222-T225 WeakPolarHBondContact CA-OG1 3.38Å; A222-T225 PolarHBondContact O-N 3.43Å; A222-T225 PolarHBondContact O-OG1 2.9Å; T225-L228 PolarHBondContact O-N 2.95Å; T225-D229 WeakPolarHBondContact O-CB 3.46Å; T225-D229 PolarHBondContact O-N 2.85Å
226D90.3Very high91Very high39 Ų3965.9 Ų65.921%0.20937%0.365CS..Hα-helixtrans-67.1-43.3174.2178.858.7000112.5R196 A222 G223 A224 L228 D229 G230 D248R196-D226 IonicContact CZ-OD1 2.72Å; R196-D226 VanDerWaalsContact CZ-OD1 3.25Å; R196-D226 VanDerWaalsContact NH1-CG 3.32Å; R196-D226 IonicContact NH1-OD1 3.37Å; R196-D226 PolarHBondContact NH1-OD1 3.29Å; R196-D226 IonicContact NH2-OD1 2.69Å; R196-D226 PolarHBondContact NH2-OD1 3.44Å; A222-D226 PolarHBondContact O-N 3.49Å; G223-D226 PolarHBondContact O-N 2.88Å; A224-D226 VanDerWaalsContact C-N 3.33Å; A224-D226 PolarHBondContact O-N 3.09Å; D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 2.95Å; D226-D229 WeakPolarHBondContact CA-OD1 3.38Å; D226-G230 PolarHBondContact O-N 3.27Å; D226-D248 VanDerWaalsContact OD1-OD1 3.14Å
227L89.1Confident90.2Very high119 Ų11970.1 Ų70.162%0.62340%0.395SS*.Hα-helixtrans-65.2-40.4173.5-63.6178.3000110.6G223 A224 L231G223-L227 PolarHBondContact O-N 3.47Å; A224-L227 PolarHBondContact O-N 2.98Å; L227-L231 WeakPolarHBondContact O-CB 3.49Å; L227-L231 WeakPolarHBondContact O-CG 3.46Å; L227-L231 PolarHBondContact O-N 2.93Å
228L91.5Very high89.3Confident91 Ų9171 Ų7148%0.47641%0.409SS..Hα-helixtrans-68.3-46.3-177.6-173.666.7000112.4A224 T225 D226 L231 I232A224-L228 WeakPolarHBondContact O-CB 3.47Å; A224-L228 PolarHBondContact O-N 3.02Å; T225-L228 PolarHBondContact O-N 2.95Å; D226-L228 VanDerWaalsContact C-N 3.29Å; D226-L228 PolarHBondContact O-N 2.95Å; L228-L231 PolarHBondContact O-N 3.24Å; L228-I232 HydrophobicContact CD1-CD1 4.17Å; L228-I232 HydrophobicContact CD1-CG1 4.46Å; L228-I232 HydrophobicContact CD2-CD1 4.35Å; L228-I232 HydrophobicContact CG-CD1 3.76Å; L228-I232 HydrophobicContact CG-CG1 4.43Å; L228-I232 WeakPolarHBondContact O-CB 3.39Å; L228-I232 WeakPolarHBondContact O-CG1 3.4Å; L228-I232 PolarHBondContact O-N 3.28Å
229D90.8Very high88.7Confident5 Ų571.3 Ų71.33%0.02741%0.41CS..Hα-helixtrans-68.2-37-17961.920.5000112P189 L192 R196 T225 D226 I232 A233P189-D229 HydrophobicContact CB-CB 4Å; L192-D229 HydrophobicContact CB-CB 4.05Å; L192-D229 HydrophobicContact CD1-CB 3.84Å; R196-D229 IonicContact CZ-OD2 3.51Å; R196-D229 IonicContact NE-OD2 3.33Å; R196-D229 IonicContact NH2-OD1 3.52Å; R196-D229 PolarHBondContact NH2-OD1 2.97Å; R196-D229 IonicContact NH2-OD2 3.42Å; R196-D229 PolarHBondContact NH2-OD2 3.44Å; T225-D229 WeakPolarHBondContact O-CB 3.46Å; T225-D229 PolarHBondContact O-N 2.85Å; D226-D229 WeakPolarHBondContact CA-OD1 3.38Å; D229-I232 PolarHBondContact O-N 2.94Å; D229-A233 WeakPolarHBondContact O-CB 3.43Å; D229-A233 PolarHBondContact O-N 3.23Å
230G88.1Confident87.9Confident21 Ų2172.9 Ų72.922%0.21643%0.43CS..Hα-helixtrans-61.7-40.9170.200000113.3D226 R234D226-G230 PolarHBondContact O-N 3.27Å; G230-R234 VanDerWaalsContact O-CG 3.26Å; G230-R234 WeakPolarHBondContact O-CG 3.23Å; G230-R234 PolarHBondContact O-N 3.01Å
231L88.8Confident87.3Confident110 Ų11070.3 Ų70.358%0.57641%0.412SS*.Hα-helixtrans-69.5-42.6175.5-72.2172.7000112.1L227 L228 A233 R234 Y235L227-L231 WeakPolarHBondContact O-CB 3.49Å; L227-L231 WeakPolarHBondContact O-CG 3.46Å; L227-L231 PolarHBondContact O-N 2.93Å; L228-L231 PolarHBondContact O-N 3.24Å; L231-A233 VanDerWaalsContact C-N 3.35Å; L231-A233 PolarHBondContact O-N 3.37Å; L231-R234 PolarHBondContact O-N 3.36Å; L231-Y235 WeakPolarHBondContact O-CB 3.38Å; L231-Y235 PolarHBondContact O-N 3.01Å
232I88.9Confident86.5Confident38 Ų3869.7 Ų69.720%0.19540%0.404CS..Hα-helixtrans-62.5-43.3177.3-69.1165.8000110.4P189 L228 D229 R234 V236P189-I232 HydrophobicContact CG-CB 4.48Å; P189-I232 HydrophobicContact CG-CG2 4.07Å; L228-I232 HydrophobicContact CD1-CD1 4.17Å; L228-I232 HydrophobicContact CD1-CG1 4.46Å; L228-I232 HydrophobicContact CD2-CD1 4.35Å; L228-I232 HydrophobicContact CG-CD1 3.76Å; L228-I232 HydrophobicContact CG-CG1 4.43Å; L228-I232 WeakPolarHBondContact O-CB 3.39Å; L228-I232 WeakPolarHBondContact O-CG1 3.4Å; L228-I232 PolarHBondContact O-N 3.28Å; D229-I232 PolarHBondContact O-N 2.94Å; I232-R234 VanDerWaalsContact C-N 3.26Å; I232-R234 PolarHBondContact O-N 3.02Å; I232-V236 HydrophobicContact CG2-CB 4.48Å; I232-V236 HydrophobicContact CG2-CG2 4.13Å; I232-V236 VanDerWaalsContact O-CB 3.3Å; I232-V236 WeakPolarHBondContact O-CB 3.39Å; I232-V236 PolarHBondContact O-N 3.34Å
233A87.1Confident85.8Confident35 Ų3571.9 Ų71.929%0.28942%0.415SS..Hα-helixtrans-63.6-30.7178.400000113P189 D229 L231P189-A233 HydrophobicContact CG-CB 4.18Å; D229-A233 WeakPolarHBondContact O-CB 3.43Å; D229-A233 PolarHBondContact O-N 3.23Å; L231-A233 VanDerWaalsContact C-N 3.35Å; L231-A233 PolarHBondContact O-N 3.37Å
234R86.6Confident85.4Confident222 Ų22270.6 Ų70.684%0.83840%0.402SS*.Hα-helixtrans-85-41.1179.3-70.9174.9-173.5-170.55.4113.3G230 L231 I232G230-R234 VanDerWaalsContact O-CG 3.26Å; G230-R234 WeakPolarHBondContact O-CG 3.23Å; G230-R234 PolarHBondContact O-N 3.01Å; L231-R234 PolarHBondContact O-N 3.36Å; I232-R234 VanDerWaalsContact C-N 3.26Å; I232-R234 PolarHBondContact O-N 3.02Å
235Y88.4Confident84.9Confident210 Ų21071.8 Ų71.882%0.82440%0.403SS*.Hα-helixtrans-86.5-32.5-173.5-171.7-103.2000112.6L231 P237L231-Y235 WeakPolarHBondContact O-CB 3.38Å; L231-Y235 PolarHBondContact O-N 3.01Å; Y235-P237 WeakPolarHBondContact O-CD 3.45Å
236V84.8Confident84.3Confident58 Ų5875.2 Ų75.235%0.35242%0.419SS..SBendtrans-96.8109.9-177.8-171.90000110.5I232 G238 Q239I232-V236 HydrophobicContact CG2-CB 4.48Å; I232-V236 HydrophobicContact CG2-CG2 4.13Å; I232-V236 VanDerWaalsContact O-CB 3.3Å; I232-V236 WeakPolarHBondContact O-CB 3.39Å; I232-V236 PolarHBondContact O-N 3.34Å; V236-G238 PolarHBondContact O-N 2.93Å; V236-Q239 HydrophobicContact CB-CB 4.39Å; V236-Q239 HydrophobicContact CB-CG 3.9Å; V236-Q239 HydrophobicContact CG1-CG 3.58Å; V236-Q239 PolarHBondContact O-N 3.05Å
237P78.4Confident84.1Confident124 Ų12476.6 Ų76.681%0.80543%0.425SS*.THydrogen-bonded Turntrans-63.6131.5-178.425.9-33.4000111Y235Y235-P237 WeakPolarHBondContact O-CD 3.45Å
238G77Confident84.1Confident73 Ų7372.9 Ų72.975%0.75341%0.406SS*.THydrogen-bonded Turntrans88.12178.800000115.9V236V236-G238 PolarHBondContact O-N 2.93Å
239Q80.1Confident83.9Confident46 Ų4672 Ų7222%0.21541%0.406CS..  trans-93-19.3173.4-65.6-62.9-33.500113.8T187 P189 V236 T241T187-Q239 PolarHBondContact OG1-O 3.29Å; P189-Q239 HydrophobicContact CG-CB 4.43Å; V236-Q239 HydrophobicContact CB-CB 4.39Å; V236-Q239 HydrophobicContact CB-CG 3.9Å; V236-Q239 HydrophobicContact CG1-CG 3.58Å; V236-Q239 PolarHBondContact O-N 3.05Å; Q239-T241 PolarHBondContact O-N 2.69Å
240G79Confident83.8Confident49 Ų4976.3 Ų76.351%0.50543%0.428SS..  trans-70125.5172.800000111.3
241T81.4Confident84Confident14 Ų1475.3 Ų75.39%0.08642%0.418CS..  trans-117.6150.7175.565.90000110.3T187 N190 Q239 L243 G244 T245T187-T241 HydrophobicContact CG2-CG2 3.55Å; N190-T241 PolarHBondContact ND2-OG1 3.42Å; N190-T241 PolarHBondContact OD1-OG1 3.18Å; N190-T241 VanDerWaalsContact OD1-OG1 3.1Å; Q239-T241 PolarHBondContact O-N 2.69Å; T241-L243 PolarHBondContact O-N 3.48Å; T241-G244 PolarHBondContact O-N 3.38Å; T241-G244 WeakPolarHBondContact OG1-CA 3.43Å; T241-G244 PolarHBondContact OG1-N 2.89Å; T241-T245 PolarHBondContact O-N 3.27Å
242I77Confident84Confident77 Ų7772.5 Ų72.540%0.39540%0.403SS..Hα-helixtrans-61.3-40.4177.5-59177000109.6E183 T245 M246 I310E183-I242 VanDerWaalsContact OE1-CD1 3.29Å; E183-I242 WeakPolarHBondContact OE1-CD1 3.26Å; E183-I242 PolarHBondContact OE2-N 3.45Å; I242-T245 PolarHBondContact O-N 2.72Å; I242-T245 PolarHBondContact O-OG1 3.39Å; I242-M246 WeakPolarHBondContact O-CG 3.34Å; I242-I310 HydrophobicContact CG2-CG2 3.89Å
243L77.4Confident84.2Confident53 Ų5373.2 Ų73.228%0.27741%0.405SS..Hα-helixtrans-61.2-47.6175.8-68.1177.3000112.2V185 T241 T245 M246 I247 I310V185-L243 HydrophobicContact CG1-CD1 4.03Å; V185-L243 HydrophobicContact CG2-CD1 4.49Å; T241-L243 PolarHBondContact O-N 3.48Å; L243-T245 VanDerWaalsContact C-N 3.32Å; L243-T245 PolarHBondContact O-N 3.47Å; L243-M246 PolarHBondContact O-N 3.27Å; L243-I247 HydrophobicContact CB-CD1 4.24Å; L243-I247 VanDerWaalsContact O-CG1 3.31Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.83Å; L243-I310 HydrophobicContact CD2-CD1 3.87Å; L243-I310 HydrophobicContact CD2-CG2 4.26Å
244G83.5Confident84.5Confident12 Ų1274.3 Ų74.312%0.12441%0.406CS..Hα-helixtrans-56.5-45.5179.700000112.3N190 T241 M246 I247 D248N190-G244 WeakPolarHBondContact OD1-CA 3.31Å; T241-G244 PolarHBondContact O-N 3.38Å; T241-G244 WeakPolarHBondContact OG1-CA 3.43Å; T241-G244 PolarHBondContact OG1-N 2.89Å; G244-M246 PolarHBondContact O-N 3.16Å; G244-M246 VanDerWaalsContact O-N 3.09Å; G244-I247 PolarHBondContact O-N 3.07Å; G244-D248 WeakPolarHBondContact O-CB 3.42Å; G244-D248 PolarHBondContact O-N 3.43Å
245T81.7Confident84.8Confident82 Ų8264.4 Ų64.450%0.50337%0.369SS..Hα-helixtrans-62.2-20.5178.462.20000114.3T241 I242 L243T241-T245 PolarHBondContact O-N 3.27Å; I242-T245 PolarHBondContact O-N 2.72Å; I242-T245 PolarHBondContact O-OG1 3.39Å; L243-T245 VanDerWaalsContact C-N 3.32Å; L243-T245 PolarHBondContact O-N 3.47Å
246M81.7Confident85.1Confident102 Ų10254.8 Ų54.850%0.50233%0.332SS..Hα-helixtrans-95.2-38.4178.7-63.2-66.5102.800112.4I242 L243 G244 D248 V314I242-M246 WeakPolarHBondContact O-CG 3.34Å; L243-M246 PolarHBondContact O-N 3.27Å; G244-M246 PolarHBondContact O-N 3.16Å; G244-M246 VanDerWaalsContact O-N 3.09Å; M246-D248 VanDerWaalsContact C-N 3.34Å; M246-V314 HydrophobicContact SD-CG2 4.33Å
247I85.6Confident85.5Confident67 Ų6753.9 Ų53.934%0.34433%0.328SS..Hα-helixtrans-74.1-31.1-177.3-62.6167.8000110.6I197 L243 G244 L250 A251I197-I247 HydrophobicContact CD1-CG2 3.78Å; L243-I247 HydrophobicContact CB-CD1 4.24Å; L243-I247 VanDerWaalsContact O-CG1 3.31Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.83Å; G244-I247 PolarHBondContact O-N 3.07Å; I247-L250 CarbonylContact O-C 3.47Å; I247-L250 WeakPolarHBondContact O-CA 3.44Å; I247-L250 WeakPolarHBondContact O-CB 3.2Å; I247-L250 PolarHBondContact O-N 3.09Å; I247-L250 VanDerWaalsContact O-N 3.08Å; I247-A251 PolarHBondContact O-N 3.03Å
248D89Confident86.3Confident41 Ų4149.7 Ų49.722%0.21930%0.3CS..Hα-helixtrans-59.2-57.3-174.8179.939.9000113.7R196 D226 G244 M246 L250 A251 D252R196-D248 IonicContact CZ-OD1 2.78Å; R196-D248 IonicContact NH1-OD1 2.93Å; R196-D248 PolarHBondContact NH1-OD1 3.03Å; R196-D248 IonicContact NH2-OD1 3.25Å; R196-D248 PolarHBondContact NH2-OD1 3.32Å; D226-D248 VanDerWaalsContact OD1-OD1 3.14Å; G244-D248 WeakPolarHBondContact O-CB 3.42Å; G244-D248 PolarHBondContact O-N 3.43Å; M246-D248 VanDerWaalsContact C-N 3.34Å; D248-L250 PolarHBondContact O-N 3.45Å; D248-A251 WeakPolarHBondContact O-CB 3.35Å; D248-A251 PolarHBondContact O-N 3.32Å; D248-D252 PolarHBondContact O-N 3.26Å
249P86.7Confident87.2Confident74 Ų7446.2 Ų46.248%0.48126%0.264SS..Hα-helixtrans-59.6-21.9173-2533.5000114.9K253P249-K253 VanDerWaalsContact O-CG 3.22Å; P249-K253 WeakPolarHBondContact O-CG 3.45Å; P249-K253 PolarHBondContact O-N 2.86Å
250L88Confident87.9Confident95 Ų9544.1 Ų44.150%0.49725%0.254SS..Hα-helixtrans-79.5-39.3177.4174.7144.3000110.9I197 I247 D248 K253 I254I197-L250 HydrophobicContact CD1-CD2 4.39Å; I247-L250 CarbonylContact O-C 3.47Å; I247-L250 WeakPolarHBondContact O-CA 3.44Å; I247-L250 WeakPolarHBondContact O-CB 3.2Å; I247-L250 PolarHBondContact O-N 3.09Å; I247-L250 VanDerWaalsContact O-N 3.08Å; D248-L250 PolarHBondContact O-N 3.45Å; L250-K253 PolarHBondContact O-N 3.2Å; L250-I254 HydrophobicContact CD2-CD1 3.5Å; L250-I254 HydrophobicContact CD2-CG1 4.44Å; L250-I254 HydrophobicContact CG-CD1 4.15Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 3.44Å
251A92.6Very high88.7Confident0 Ų045.5 Ų45.50%025%0.253CS..Hα-helixtrans-60.1-45.1174.500000111.2C193 I197 I247 D248 K253 I254 L255C193-A251 VanDerWaalsContact SG-CB 3.56Å; I197-A251 HydrophobicContact CD1-CB 4.11Å; I197-A251 HydrophobicContact CG1-CB 3.68Å; I247-A251 PolarHBondContact O-N 3.03Å; D248-A251 WeakPolarHBondContact O-CB 3.35Å; D248-A251 PolarHBondContact O-N 3.32Å; A251-K253 VanDerWaalsContact C-N 3.31Å; A251-K253 PolarHBondContact O-N 3.36Å; A251-I254 PolarHBondContact O-N 2.86Å; A251-L255 WeakPolarHBondContact O-CB 3.5Å; A251-L255 PolarHBondContact O-N 3.36Å
252D90.4Very high89.4Confident50 Ų5045.7 Ų45.727%0.26725%0.254SS..Hα-helixtrans-59.6-41.3176.8-69.7-22.5000112.8R196 D248 L255 L256R196-D252 IonicContact NH1-OD1 3.07Å; R196-D252 PolarHBondContact NH1-OD1 3.44Å; D248-D252 PolarHBondContact O-N 3.26Å; D252-L255 PolarHBondContact O-N 3.34Å; D252-L256 WeakPolarHBondContact O-CB 3.09Å; D252-L256 WeakPolarHBondContact O-CG 3.49Å; D252-L256 PolarHBondContact O-N 2.89Å
253K91.5Very high90.2Very high54 Ų5442 Ų4224%0.23524%0.235CC..Hα-helixtrans-69.6-40.7179.4-70-67.8174-170.70111.9P249 L250 A251 S257 D281P249-K253 VanDerWaalsContact O-CG 3.22Å; P249-K253 WeakPolarHBondContact O-CG 3.45Å; P249-K253 PolarHBondContact O-N 2.86Å; L250-K253 PolarHBondContact O-N 3.2Å; A251-K253 VanDerWaalsContact C-N 3.31Å; A251-K253 PolarHBondContact O-N 3.36Å; K253-S257 WeakPolarHBondContact O-CB 3.26Å; K253-S257 PolarHBondContact O-N 3.44Å; K253-S257 PolarHBondContact O-OG 3.33Å; K253-D281 WeakPolarHBondContact CD-OD2 3.39Å; K253-D281 VanDerWaalsContact NZ-CG 3.32Å; K253-D281 IonicContact NZ-OD1 2.69Å; K253-D281 PolarHBondContact NZ-OD1 3.37Å; K253-D281 IonicContact NZ-OD2 3.06Å; K253-D281 PolarHBondContact NZ-OD2 2.81Å
254I93.7Very high91Very high58 Ų5840.3 Ų40.330%0.29723%0.227SC..Hα-helixtrans-60.6-51.9173.6-70172.6000109.3L250 A251 L256 S257 T258L250-I254 HydrophobicContact CD2-CD1 3.5Å; L250-I254 HydrophobicContact CD2-CG1 4.44Å; L250-I254 HydrophobicContact CG-CD1 4.15Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 3.44Å; A251-I254 PolarHBondContact O-N 2.86Å; I254-L256 PolarHBondContact O-N 2.99Å; I254-S257 PolarHBondContact O-N 3.36Å; I254-S257 PolarHBondContact O-OG 3.27Å; I254-T258 HydrophobicContact CG2-CG2 4.39Å; I254-T258 WeakPolarHBondContact O-CG2 3.33Å; I254-T258 PolarHBondContact O-N 2.85Å; I254-T258 PolarHBondContact O-OG1 3.08Å
255L94Very high91.5Very high13 Ų1347.8 Ų47.87%0.06825%0.253CS..Hα-helixtrans-56.8-53.6-178.8-172.7154.3000111.6S200 F219 A222 A251 D252 S257 T258 L259S200-L255 WeakPolarHBondContact OG-CA 3.24Å; F219-L255 HydrophobicContact CD2-CD2 3.89Å; F219-L255 HydrophobicContact CE2-CD2 3.65Å; A222-L255 HydrophobicContact CB-CD1 3.77Å; A251-L255 WeakPolarHBondContact O-CB 3.5Å; A251-L255 PolarHBondContact O-N 3.36Å; D252-L255 PolarHBondContact O-N 3.34Å; L255-S257 PolarHBondContact O-N 3.25Å; L255-T258 PolarHBondContact O-N 3.1Å; L255-T258 PolarHBondContact O-OG1 3.33Å; L255-L259 HydrophobicContact CD2-CD1 4.02Å; L255-L259 PolarHBondContact O-N 3.47Å; L255-L259 VanDerWaalsContact O-N 3.13Å
256L93.7Very high92.1Very high9 Ų945.4 Ų45.45%0.04724%0.237CC..Hα-helixtrans-64.3-42.2178.9-71174.8000112.2D252 I254 T258 L259 F260 I336 V339D252-L256 WeakPolarHBondContact O-CB 3.09Å; D252-L256 WeakPolarHBondContact O-CG 3.49Å; D252-L256 PolarHBondContact O-N 2.89Å; I254-L256 PolarHBondContact O-N 2.99Å; L256-T258 PolarHBondContact O-N 3.2Å; L256-L259 PolarHBondContact O-N 3.37Å; L256-F260 VanDerWaalsContact O-CD2 3.23Å; L256-F260 WeakPolarHBondContact O-CD2 3.37Å; L256-F260 PolarHBondContact O-N 2.92Å; L256-I336 HydrophobicContact CD1-CG1 3.97Å; L256-I336 HydrophobicContact CD2-CG1 4.17Å; L256-V339 HydrophobicContact CD2-CG2 4.27Å
257S93.9Very high92.5Very high38 Ų3847.3 Ų47.327%0.26625%0.249SC..Hα-helixtrans-62.3-42.7179.568.60000112.4K253 I254 L255 L259 F260 V261K253-S257 WeakPolarHBondContact O-CB 3.26Å; K253-S257 PolarHBondContact O-N 3.44Å; K253-S257 PolarHBondContact O-OG 3.33Å; I254-S257 PolarHBondContact O-N 3.36Å; I254-S257 PolarHBondContact O-OG 3.27Å; L255-S257 PolarHBondContact O-N 3.25Å; S257-L259 VanDerWaalsContact C-N 3.32Å; S257-L259 PolarHBondContact O-N 3.25Å; S257-F260 PolarHBondContact O-N 3.22Å; S257-V261 WeakPolarHBondContact O-CG2 3.15Å; S257-V261 PolarHBondContact O-N 3.24Å; S257-V261 VanDerWaalsContact O-N 3.16Å
258T95.5Very high92.5Very high36 Ų3645.7 Ų45.722%0.22124%0.241CC..Hα-helixtrans-61.4-42.7175.7550000111.2I254 L255 L256 V261 T262I254-T258 HydrophobicContact CG2-CG2 4.39Å; I254-T258 WeakPolarHBondContact O-CG2 3.33Å; I254-T258 PolarHBondContact O-N 2.85Å; I254-T258 PolarHBondContact O-OG1 3.08Å; L255-T258 PolarHBondContact O-N 3.1Å; L255-T258 PolarHBondContact O-OG1 3.33Å; L256-T258 PolarHBondContact O-N 3.2Å; T258-V261 PolarHBondContact O-N 3.29Å; T258-T262 WeakPolarHBondContact O-CG2 3.49Å; T258-T262 PolarHBondContact O-N 3.38Å; T258-T262 PolarHBondContact O-OG1 3.49Å; T258-T262 VanDerWaalsContact O-OG1 3.09Å
259L95Very high92.5Very high0 Ų043.9 Ų43.90%023%0.232CC..Hα-helixtrans-64.4-45.6178.7-94.6175.6000113.8L203 V207 F219 L255 L256 S257 V261 T262 L263 V339 L343L203-L259 HydrophobicContact CD1-CD1 4.44Å; L203-L259 HydrophobicContact CD2-CD1 3.77Å; L203-L259 HydrophobicContact CD2-CD2 3.12Å; L203-L259 HydrophobicContact CD2-CG 3.49Å; L203-L259 VanDerWaalsContact CD2-CG 3.49Å; V207-L259 HydrophobicContact CG2-CD2 3.97Å; F219-L259 HydrophobicContact CD2-CD1 3.32Å; F219-L259 HydrophobicContact CE2-CD1 3.47Å; F219-L259 VanDerWaalsContact CE2-CD1 3.47Å; F219-L259 HydrophobicContact CG-CD1 4.18Å; F219-L259 HydrophobicContact CZ-CD1 4.41Å; L255-L259 HydrophobicContact CD2-CD1 4.02Å; L255-L259 PolarHBondContact O-N 3.47Å; L255-L259 VanDerWaalsContact O-N 3.13Å; L256-L259 PolarHBondContact O-N 3.37Å; S257-L259 VanDerWaalsContact C-N 3.32Å; S257-L259 PolarHBondContact O-N 3.25Å; L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.1Å; L259-T262 PolarHBondContact O-N 2.77Å; L259-T262 PolarHBondContact O-OG1 3.18Å; L259-L263 HydrophobicContact CD2-CD1 4.25Å; L259-L263 HydrophobicContact CD2-CG 4.37Å; L259-L263 VanDerWaalsContact O-CB 3.25Å; L259-L263 WeakPolarHBondContact O-CB 3.41Å; L259-L263 VanDerWaalsContact O-CG 3.24Å; L259-L263 WeakPolarHBondContact O-CG 3.2Å; L259-L263 PolarHBondContact O-N 3.27Å; L259-V339 HydrophobicContact CB-CG1 4.12Å; L259-V339 HydrophobicContact CD1-CG1 3.6Å; L259-V339 HydrophobicContact CG-CG1 4.32Å; L259-L343 HydrophobicContact CD2-CD1 3.64Å
260F95.2Very high92.7Very high2 Ų242.7 Ų42.71%0.00922%0.224CC..Hα-helixtrans-58.2-44.8176-87.9-73.4000111L256 S257 T264 I269 L273 T274 V277 Q335 L338 V339L256-F260 VanDerWaalsContact O-CD2 3.23Å; L256-F260 WeakPolarHBondContact O-CD2 3.37Å; L256-F260 PolarHBondContact O-N 2.92Å; S257-F260 PolarHBondContact O-N 3.22Å; F260-T264 WeakPolarHBondContact O-CB 3.24Å; F260-T264 PolarHBondContact O-N 2.91Å; F260-T264 PolarHBondContact O-OG1 3.4Å; F260-I269 HydrophobicContact CD1-CD1 3.85Å; F260-I269 HydrophobicContact CE1-CD1 4.11Å; F260-L273 HydrophobicContact CD1-CD2 4.32Å; F260-L273 HydrophobicContact CE1-CD2 3.79Å; F260-T274 HydrophobicContact CB-CG2 4.19Å; F260-T274 HydrophobicContact CD1-CG2 3.79Å; F260-T274 HydrophobicContact CG-CG2 4.47Å; F260-V277 HydrophobicContact CD2-CG1 4Å; F260-V277 HydrophobicContact CE1-CG1 4.45Å; F260-V277 HydrophobicContact CE1-CG2 4.36Å; F260-V277 HydrophobicContact CE2-CG1 3.88Å; F260-V277 HydrophobicContact CG-CG1 4.39Å; F260-V277 HydrophobicContact CZ-CG1 4.11Å; F260-V277 HydrophobicContact CZ-CG2 4.41Å; F260-Q335 HydrophobicContact CE2-CB 4.34Å; F260-Q335 HydrophobicContact CZ-CB 4.23Å; F260-Q335 HydrophobicContact CZ-CG 4.26Å; F260-L338 HydrophobicContact CE1-CD2 3.78Å; F260-L338 HydrophobicContact CZ-CD2 4.19Å; F260-V339 HydrophobicContact CD2-CG2 4.09Å; F260-V339 HydrophobicContact CE1-CG2 4.13Å; F260-V339 HydrophobicContact CE2-CG2 3.56Å; F260-V339 HydrophobicContact CZ-CG2 3.59Å
261V95.7Very high93Very high78 Ų7842.2 Ų42.247%0.47322%0.224SC..Hα-helixtrans-63.7-48.3178.6174.60000111.2S257 T258 L259 T264 Y265 L278S257-V261 WeakPolarHBondContact O-CG2 3.15Å; S257-V261 PolarHBondContact O-N 3.24Å; S257-V261 VanDerWaalsContact O-N 3.16Å; T258-V261 PolarHBondContact O-N 3.29Å; L259-V261 VanDerWaalsContact C-N 3.29Å; L259-V261 PolarHBondContact O-N 3.1Å; V261-T264 WeakPolarHBondContact O-CB 3.47Å; V261-T264 PolarHBondContact O-N 2.88Å; V261-Y265 PolarHBondContact O-N 3.28Å; V261-L278 HydrophobicContact CG2-CD1 3.75Å
262T95.5Very high93Very high18 Ų1847 Ų4711%0.1126%0.255CS..Hα-helixtrans-71.4-33.2-17757.20000113.3G204 V208 T258 L259 Y265 N266G204-T262 VanDerWaalsContact CA-CG2 3.43Å; V208-T262 HydrophobicContact CG2-CG2 3.96Å; T258-T262 WeakPolarHBondContact O-CG2 3.49Å; T258-T262 PolarHBondContact O-N 3.38Å; T258-T262 PolarHBondContact O-OG1 3.49Å; T258-T262 VanDerWaalsContact O-OG1 3.09Å; L259-T262 PolarHBondContact O-N 2.77Å; L259-T262 PolarHBondContact O-OG1 3.18Å; T262-Y265 WeakPolarHBondContact O-CB 3.37Å; T262-Y265 PolarHBondContact O-N 3.04Å; T262-N266 PolarHBondContact O-N 2.87Å
263L93.8Very high93.1Very high0 Ų045.7 Ų45.70%025%0.248CC..Hα-helixtrans-71.6-32.2173.1-70169.7000111.9V207 L259 Y265 N266 L268 I269 V339V207-L263 HydrophobicContact CG1-CD2 3.76Å; V207-L263 HydrophobicContact CG1-CG 4.21Å; L259-L263 HydrophobicContact CD2-CD1 4.25Å; L259-L263 HydrophobicContact CD2-CG 4.37Å; L259-L263 VanDerWaalsContact O-CB 3.25Å; L259-L263 WeakPolarHBondContact O-CB 3.41Å; L259-L263 VanDerWaalsContact O-CG 3.24Å; L259-L263 WeakPolarHBondContact O-CG 3.2Å; L259-L263 PolarHBondContact O-N 3.27Å; L263-Y265 VanDerWaalsContact C-N 3.34Å; L263-N266 PolarHBondContact O-N 2.99Å; L263-L268 HydrophobicContact CB-CB 4.45Å; L263-L268 HydrophobicContact CD2-CB 4.39Å; L263-L268 HydrophobicContact CD2-CD2 3.95Å; L263-L268 WeakPolarHBondContact O-CB 3.19Å; L263-L268 PolarHBondContact O-N 3.27Å; L263-I269 HydrophobicContact CB-CD1 3.66Å; L263-I269 HydrophobicContact CB-CG1 3.91Å; L263-I269 HydrophobicContact CD1-CD1 3.79Å; L263-I269 HydrophobicContact CG-CD1 4.38Å; L263-I269 PolarHBondContact O-N 2.81Å; L263-V339 HydrophobicContact CD1-CG1 4.28Å
264T94.3Very high93.1Very high18 Ų1843.4 Ų43.411%0.1124%0.239CC..Hα-helixtrans-64.5-41.6170.5-51.50000111F260 V261 N266 D267 V271 T274F260-T264 WeakPolarHBondContact O-CB 3.24Å; F260-T264 PolarHBondContact O-N 2.91Å; F260-T264 PolarHBondContact O-OG1 3.4Å; V261-T264 WeakPolarHBondContact O-CB 3.47Å; V261-T264 PolarHBondContact O-N 2.88Å; T264-N266 PolarHBondContact O-N 2.69Å; T264-D267 PolarHBondContact O-N 3.46Å; T264-V271 HydrophobicContact CG2-CB 4.27Å; T264-V271 HydrophobicContact CG2-CG2 3.66Å; T264-T274 VanDerWaalsContact OG1-CB 3.31Å; T264-T274 WeakPolarHBondContact OG1-CB 3.23Å; T264-T274 WeakPolarHBondContact OG1-CG2 3.29Å; T264-T274 PolarHBondContact OG1-OG1 3.45Å; T264-T274 VanDerWaalsContact OG1-OG1 3.06Å
265Y95Very high93.2Very high169 Ų16944.8 Ų44.866%0.66325%0.25SS*.Hα-helixtrans-60.1-33.8-179.8179.2-94.5000112.5V208 V261 T262 L263 D267V208-Y265 HydrophobicContact CG1-CD1 4.1Å; V208-Y265 HydrophobicContact CG1-CE1 3.84Å; V208-Y265 HydrophobicContact CG2-CD1 4.03Å; V261-Y265 PolarHBondContact O-N 3.28Å; T262-Y265 WeakPolarHBondContact O-CB 3.37Å; T262-Y265 PolarHBondContact O-N 3.04Å; L263-Y265 VanDerWaalsContact C-N 3.34Å; Y265-D267 VanDerWaalsContact C-N 3.26Å; Y265-D267 PolarHBondContact O-N 3.15Å
266N93Very high93.1Very high31 Ų3149.7 Ų49.717%0.16628%0.276CS..THydrogen-bonded Turntrans-86.812175-69.3-0.3000113.6V207 Y212 T262 L263 T264 L268V207-N266 PolarHBondContact O-ND2 3.02Å; Y212-N266 PolarHBondContact OH-ND2 3.05Å; T262-N266 PolarHBondContact O-N 2.87Å; L263-N266 PolarHBondContact O-N 2.99Å; T264-N266 PolarHBondContact O-N 2.69Å; N266-L268 HydrophobicContact CB-CD1 3.63Å; N266-L268 WeakPolarHBondContact O-CD1 3.3Å; N266-L268 PolarHBondContact O-N 3.1Å; N266-L268 VanDerWaalsContact O-N 3.1Å
267D89.5Confident93Very high143 Ų14349.8 Ų49.877%0.76528%0.276SS*.THydrogen-bonded Turntrans5917.8-176.8-61.4-54.5000115T264 Y265T264-D267 PolarHBondContact O-N 3.46Å; Y265-D267 VanDerWaalsContact C-N 3.26Å; Y265-D267 PolarHBondContact O-N 3.15Å
268L87.5Confident93Very high33 Ų3350.1 Ų50.117%0.17328%0.275CS..SBendtrans-77.8-24.1174.9-88.476.8000112.6Y212 L263 N266 T342 P346 W360Y212-L268 HydrophobicContact CE1-CD1 4.43Å; Y212-L268 HydrophobicContact CE1-CD2 4.12Å; L263-L268 HydrophobicContact CB-CB 4.45Å; L263-L268 HydrophobicContact CD2-CB 4.39Å; L263-L268 HydrophobicContact CD2-CD2 3.95Å; L263-L268 WeakPolarHBondContact O-CB 3.19Å; L263-L268 PolarHBondContact O-N 3.27Å; N266-L268 HydrophobicContact CB-CD1 3.63Å; N266-L268 WeakPolarHBondContact O-CD1 3.3Å; N266-L268 PolarHBondContact O-N 3.1Å; N266-L268 VanDerWaalsContact O-N 3.1Å; L268-T342 WeakPolarHBondContact CD2-O 3.47Å; L268-P346 HydrophobicContact CD2-CG 3.95Å; L268-W360 WeakPolarHBondContact O-CZ2 3.27Å
269I88.6Confident92.9Very high3 Ų351.4 Ų51.42%0.01529%0.285CS..SBendtrans-127.4132.4177.1-59.9179.6000108.6F260 L263 V271 L273 T274 L338 T342F260-I269 HydrophobicContact CD1-CD1 3.85Å; F260-I269 HydrophobicContact CE1-CD1 4.11Å; L263-I269 HydrophobicContact CB-CD1 3.66Å; L263-I269 HydrophobicContact CB-CG1 3.91Å; L263-I269 HydrophobicContact CD1-CD1 3.79Å; L263-I269 HydrophobicContact CG-CD1 4.38Å; L263-I269 PolarHBondContact O-N 2.81Å; I269-V271 PolarHBondContact O-N 3.47Å; I269-L273 HydrophobicContact CG2-CB 4.27Å; I269-L273 HydrophobicContact CG2-CD2 3.86Å; I269-L273 HydrophobicContact CG2-CG 4.47Å; I269-T274 HydrophobicContact CB-CG2 4.07Å; I269-T274 HydrophobicContact CG2-CG2 3.37Å; I269-L338 HydrophobicContact CD1-CD2 3.87Å; I269-T342 HydrophobicContact CD1-CG2 4.27Å; I269-T342 HydrophobicContact CG1-CG2 3.96Å
270P91.1Very high92.7Very high49 Ų4954 Ų5432%0.31830%0.295SS..  trans-65135.6179.226.6-35.2000111.9P272 L273 T274 W360P270-P272 VanDerWaalsContact C-CD 3.41Å; P270-P272 VanDerWaalsContact C-N 3.33Å; P270-L273 HydrophobicContact CG-CB 4Å; P270-L273 WeakPolarHBondContact O-CB 3.33Å; P270-L273 PolarHBondContact O-N 2.56Å; P270-T274 PolarHBondContact O-N 3.12Å; P270-W360 HydrophobicContact CG-CD2 4.04Å; P270-W360 HydrophobicContact CG-CE3 3.88Å; P270-W360 HydrophobicContact CG-CG 4.41Å; P270-W360 HydrophobicContact CG-CZ3 4.33Å
271V93.1Very high92.5Very high84 Ų8454.5 Ų54.551%0.50930%0.298SS..Hα-helixtrans-50.5-42.3-179.9-176.70000113.6T264 I269 L273 T274 V275T264-V271 HydrophobicContact CG2-CB 4.27Å; T264-V271 HydrophobicContact CG2-CG2 3.66Å; I269-V271 PolarHBondContact O-N 3.47Å; V271-L273 VanDerWaalsContact C-N 3.27Å; V271-L273 PolarHBondContact O-N 2.63Å; V271-T274 PolarHBondContact O-N 3.12Å; V271-T274 PolarHBondContact O-OG1 3.48Å; V271-T274 VanDerWaalsContact O-OG1 3.08Å; V271-V275 HydrophobicContact CG1-CG2 4.1Å; V271-V275 WeakPolarHBondContact O-CG2 3.28Å; V271-V275 PolarHBondContact O-N 3.48Å
272P93.5Very high92.3Very high100 Ų10054 Ų5465%0.64930%0.295SS*.Hα-helixtrans-58.4-37177.6-26.135.5000113.7P270 L276P270-P272 VanDerWaalsContact C-CD 3.41Å; P270-P272 VanDerWaalsContact C-N 3.33Å; P272-L276 WeakPolarHBondContact O-CB 3.3Å; P272-L276 PolarHBondContact O-N 3.24Å
273L90.9Very high92.1Very high23 Ų2355.8 Ų55.812%0.1231%0.312CS..Hα-helixtrans-67.8-43.4179.7-171.1155.1000110.4F260 I269 P270 V271 L276 V277 L338 W360F260-L273 HydrophobicContact CD1-CD2 4.32Å; F260-L273 HydrophobicContact CE1-CD2 3.79Å; I269-L273 HydrophobicContact CG2-CB 4.27Å; I269-L273 HydrophobicContact CG2-CD2 3.86Å; I269-L273 HydrophobicContact CG2-CG 4.47Å; P270-L273 HydrophobicContact CG-CB 4Å; P270-L273 WeakPolarHBondContact O-CB 3.33Å; P270-L273 PolarHBondContact O-N 2.56Å; V271-L273 VanDerWaalsContact C-N 3.27Å; V271-L273 PolarHBondContact O-N 2.63Å; L273-L276 WeakPolarHBondContact O-CB 2.98Å; L273-L276 PolarHBondContact O-N 3.49Å; L273-V277 HydrophobicContact CD2-CG2 3.85Å; L273-V277 WeakPolarHBondContact O-CG2 3.31Å; L273-V277 PolarHBondContact O-N 3.49Å; L273-L338 HydrophobicContact CD1-CD1 4Å; L273-L338 HydrophobicContact CD2-CD1 4.24Å; L273-W360 HydrophobicContact CD1-CB 3.67Å; L273-W360 HydrophobicContact CD1-CG 3.96Å
274T93.3Very high91.8Very high7 Ų758.9 Ų58.94%0.04333%0.328CS..Hα-helixtrans-72.5-36.8-177.558.90000112.5F260 T264 I269 P270 V271 L276 V277 L278F260-T274 HydrophobicContact CB-CG2 4.19Å; F260-T274 HydrophobicContact CD1-CG2 3.79Å; F260-T274 HydrophobicContact CG-CG2 4.47Å; T264-T274 VanDerWaalsContact OG1-CB 3.31Å; T264-T274 WeakPolarHBondContact OG1-CB 3.23Å; T264-T274 WeakPolarHBondContact OG1-CG2 3.29Å; T264-T274 PolarHBondContact OG1-OG1 3.45Å; T264-T274 VanDerWaalsContact OG1-OG1 3.06Å; I269-T274 HydrophobicContact CB-CG2 4.07Å; I269-T274 HydrophobicContact CG2-CG2 3.37Å; P270-T274 PolarHBondContact O-N 3.12Å; V271-T274 PolarHBondContact O-N 3.12Å; V271-T274 PolarHBondContact O-OG1 3.48Å; V271-T274 VanDerWaalsContact O-OG1 3.08Å; T274-L276 VanDerWaalsContact C-N 3.33Å; T274-L276 PolarHBondContact O-N 2.95Å; T274-V277 PolarHBondContact O-N 3.27Å; T274-L278 VanDerWaalsContact O-CB 3.28Å; T274-L278 WeakPolarHBondContact O-CB 3.36Å; T274-L278 VanDerWaalsContact O-CG 3.26Å; T274-L278 WeakPolarHBondContact O-CG 3.43Å; T274-L278 PolarHBondContact O-N 2.88Å
275V94.8Very high91.5Very high87 Ų8762.2 Ų62.253%0.52734%0.344SS..Hα-helixtrans-59.8-43.5169.2173.40000111.1V271 S279V271-V275 HydrophobicContact CG1-CG2 4.1Å; V271-V275 WeakPolarHBondContact O-CG2 3.28Å; V271-V275 PolarHBondContact O-N 3.48Å; V275-S279 WeakPolarHBondContact O-CB 3.2Å; V275-S279 PolarHBondContact O-N 2.71Å; V275-S279 PolarHBondContact O-OG 3.34Å
276L92.2Very high91.3Very high116 Ų11661 Ų6161%0.60734%0.343SS*.Hα-helixtrans-63.3-46.9177.6-172.8158.4000111.7P272 L273 T274 S279 R280P272-L276 WeakPolarHBondContact O-CB 3.3Å; P272-L276 PolarHBondContact O-N 3.24Å; L273-L276 WeakPolarHBondContact O-CB 2.98Å; L273-L276 PolarHBondContact O-N 3.49Å; T274-L276 VanDerWaalsContact C-N 3.33Å; T274-L276 PolarHBondContact O-N 2.95Å; L276-S279 PolarHBondContact O-OG 2.73Å; L276-R280 WeakPolarHBondContact O-CB 3.31Å; L276-R280 PolarHBondContact O-N 2.66Å; L276-R280 VanDerWaalsContact O-N 3.13Å
277V91.7Very high91Very high10 Ų1061.7 Ų61.76%0.06135%0.353CS..Hα-helixtrans-64.9-47.5-179.8167.90000111.7F260 L273 T274 R280 D281 Q335F260-V277 HydrophobicContact CD2-CG1 4Å; F260-V277 HydrophobicContact CE1-CG1 4.45Å; F260-V277 HydrophobicContact CE1-CG2 4.36Å; F260-V277 HydrophobicContact CE2-CG1 3.88Å; F260-V277 HydrophobicContact CG-CG1 4.39Å; F260-V277 HydrophobicContact CZ-CG1 4.11Å; F260-V277 HydrophobicContact CZ-CG2 4.41Å; L273-V277 HydrophobicContact CD2-CG2 3.85Å; L273-V277 WeakPolarHBondContact O-CG2 3.31Å; L273-V277 PolarHBondContact O-N 3.49Å; T274-V277 PolarHBondContact O-N 3.27Å; V277-R280 PolarHBondContact O-N 2.87Å; V277-D281 PolarHBondContact O-N 2.84Å; V277-D281 VanDerWaalsContact O-N 3.08Å; V277-Q335 VanDerWaalsContact CG1-NE2 3.25Å
278L93.1Very high90.7Very high46 Ų4658.6 Ų58.624%0.24134%0.342CS..Hα-helixtrans-69-39.7-179.2-69.5174.4000112.1V261 T274 R280 D281 T282V261-L278 HydrophobicContact CG2-CD1 3.75Å; T274-L278 VanDerWaalsContact O-CB 3.28Å; T274-L278 WeakPolarHBondContact O-CB 3.36Å; T274-L278 VanDerWaalsContact O-CG 3.26Å; T274-L278 WeakPolarHBondContact O-CG 3.43Å; T274-L278 PolarHBondContact O-N 2.88Å; L278-R280 VanDerWaalsContact C-N 3.32Å; L278-R280 PolarHBondContact O-N 3.42Å; L278-D281 PolarHBondContact O-N 3.06Å; L278-T282 WeakPolarHBondContact O-CB 3.48Å; L278-T282 VanDerWaalsContact O-CG2 3.32Å; L278-T282 WeakPolarHBondContact O-CG2 3.41Å; L278-T282 PolarHBondContact O-N 3.15Å; L278-T282 PolarHBondContact O-OG1 2.67Å
279S93.2Very high90.5Very high62 Ų6260.2 Ų60.243%0.43435%0.351SS..Hα-helixtrans-62.5-39.8176.260.80000111.7V275 L276 T282 A283V275-S279 WeakPolarHBondContact O-CB 3.2Å; V275-S279 PolarHBondContact O-N 2.71Å; V275-S279 PolarHBondContact O-OG 3.34Å; L276-S279 PolarHBondContact O-OG 2.73Å; S279-T282 WeakPolarHBondContact CA-OG1 3.46Å; S279-T282 PolarHBondContact O-OG1 3.05Å; S279-A283 WeakPolarHBondContact O-CB 3.37Å; S279-A283 PolarHBondContact O-N 3.08Å
280R91.9Very high90.4Very high55 Ų5565.4 Ų65.421%0.20837%0.373CS..Hα-helixtrans-62.6-48.7173.6-175.9-151.467.9-164.8-8.4111.8L276 V277 L278 A283 L284 N331L276-R280 WeakPolarHBondContact O-CB 3.31Å; L276-R280 PolarHBondContact O-N 2.66Å; L276-R280 VanDerWaalsContact O-N 3.13Å; V277-R280 PolarHBondContact O-N 2.87Å; L278-R280 VanDerWaalsContact C-N 3.32Å; L278-R280 PolarHBondContact O-N 3.42Å; R280-A283 PolarHBondContact O-N 3.46Å; R280-L284 HydrophobicContact CG-CD1 4.46Å; R280-L284 WeakPolarHBondContact O-CG 3.46Å; R280-L284 PolarHBondContact O-N 2.88Å; R280-N331 PolarHBondContact NH1-ND2 2.74Å; R280-N331 PolarHBondContact NH1-OD1 3.21Å
281D91Very high89.9Confident13 Ų1367.7 Ų67.77%0.0738%0.382CS..Hα-helixtrans-67.1-42.4-176.8-83.5-6.7000112.5K253 V277 L278 L284 I285K253-D281 WeakPolarHBondContact CD-OD2 3.39Å; K253-D281 VanDerWaalsContact NZ-CG 3.32Å; K253-D281 IonicContact NZ-OD1 2.69Å; K253-D281 PolarHBondContact NZ-OD1 3.37Å; K253-D281 IonicContact NZ-OD2 3.06Å; K253-D281 PolarHBondContact NZ-OD2 2.81Å; V277-D281 PolarHBondContact O-N 2.84Å; V277-D281 VanDerWaalsContact O-N 3.08Å; L278-D281 PolarHBondContact O-N 3.06Å; D281-L284 PolarHBondContact O-N 3.5Å; D281-I285 WeakPolarHBondContact O-CG1 3.26Å; D281-I285 PolarHBondContact O-N 3.34Å
282T90.8Very high89.3Confident66 Ų6665.8 Ų65.841%0.40537%0.365SS..Hα-helixtrans-62.5-43.9172.953.50000111.4L278 S279 L284 I285 F286L278-T282 WeakPolarHBondContact O-CB 3.48Å; L278-T282 VanDerWaalsContact O-CG2 3.32Å; L278-T282 WeakPolarHBondContact O-CG2 3.41Å; L278-T282 PolarHBondContact O-N 3.15Å; L278-T282 PolarHBondContact O-OG1 2.67Å; S279-T282 WeakPolarHBondContact CA-OG1 3.46Å; S279-T282 PolarHBondContact O-OG1 3.05Å; T282-L284 VanDerWaalsContact C-N 3.31Å; T282-L284 PolarHBondContact O-N 3.01Å; T282-I285 PolarHBondContact O-N 3.16Å; T282-I285 VanDerWaalsContact O-N 3.15Å; T282-F286 WeakPolarHBondContact O-CD2 3.43Å; T282-F286 PolarHBondContact O-N 3.35Å
283A90.9Very high88.6Confident56 Ų5664.9 Ų64.946%0.46336%0.355SS..Hα-helixtrans-59.3-39175.300000112.6S279 R280 F286 A287S279-A283 WeakPolarHBondContact O-CB 3.37Å; S279-A283 PolarHBondContact O-N 3.08Å; R280-A283 PolarHBondContact O-N 3.46Å; A283-F286 PolarHBondContact O-N 2.79Å; A283-A287 VanDerWaalsContact O-CB 3.25Å; A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 2.84Å
284L87.4Confident88.1Confident66 Ų6670 Ų7035%0.34638%0.376SS..Hα-helixtrans-65.9-40175.1-72.8174.3000112.3R280 D281 T282 S288R280-L284 HydrophobicContact CG-CD1 4.46Å; R280-L284 WeakPolarHBondContact O-CG 3.46Å; R280-L284 PolarHBondContact O-N 2.88Å; D281-L284 PolarHBondContact O-N 3.5Å; T282-L284 VanDerWaalsContact C-N 3.31Å; T282-L284 PolarHBondContact O-N 3.01Å; L284-S288 WeakPolarHBondContact O-CB 3.42Å; L284-S288 PolarHBondContact O-N 2.79Å; L284-S288 PolarHBondContact O-OG 2.88Å
285I88.5Confident87Confident88 Ų8872 Ų7245%0.45139%0.39SS..Hα-helixtrans-63.2-49.2174.9-66.2164.3000109.7D281 T282 A287 S288 I289D281-I285 WeakPolarHBondContact O-CG1 3.26Å; D281-I285 PolarHBondContact O-N 3.34Å; T282-I285 PolarHBondContact O-N 3.16Å; T282-I285 VanDerWaalsContact O-N 3.15Å; I285-A287 PolarHBondContact O-N 2.78Å; I285-S288 WeakPolarHBondContact O-CB 3.39Å; I285-S288 PolarHBondContact O-N 3.22Å; I285-I289 HydrophobicContact CG2-CD1 3.89Å; I285-I289 WeakPolarHBondContact O-CG1 3.32Å; I285-I289 PolarHBondContact O-N 3.1Å
286F90.7Very high85.7Confident143 Ų14369.2 Ų69.263%0.62737%0.372SS*.Hα-helixtrans-61.8-43.2178-78.9-65.6000112.8T282 A283 S288 I289 F290T282-F286 WeakPolarHBondContact O-CD2 3.43Å; T282-F286 PolarHBondContact O-N 3.35Å; A283-F286 PolarHBondContact O-N 2.79Å; F286-S288 VanDerWaalsContact C-N 3.3Å; F286-S288 PolarHBondContact O-N 2.79Å; F286-I289 PolarHBondContact O-N 2.77Å; F286-F290 WeakPolarHBondContact O-CB 3.26Å; F286-F290 PolarHBondContact O-N 3.11Å
287A86.8Confident84.1Confident46 Ų4668.4 Ų68.438%0.3838%0.376SS..Hα-helixtrans-61.1-41.2175.700000111.5A283 I285 F290 I291A283-A287 VanDerWaalsContact O-CB 3.25Å; A283-A287 WeakPolarHBondContact O-CB 3.48Å; A283-A287 PolarHBondContact O-N 2.84Å; I285-A287 PolarHBondContact O-N 2.78Å; A287-F290 PolarHBondContact O-N 2.98Å; A287-I291 VanDerWaalsContact O-CG1 3.26Å; A287-I291 WeakPolarHBondContact O-CG1 3.17Å; A287-I291 PolarHBondContact O-N 3.32Å
288S82.7Confident82.5Confident78 Ų7873.7 Ų73.755%0.54541%0.408SS..Hα-helixtrans-62.6-45.3177.5-580000111.5L284 I285 F286 R292L284-S288 WeakPolarHBondContact O-CB 3.42Å; L284-S288 PolarHBondContact O-N 2.79Å; L284-S288 PolarHBondContact O-OG 2.88Å; I285-S288 WeakPolarHBondContact O-CB 3.39Å; I285-S288 PolarHBondContact O-N 3.22Å; F286-S288 VanDerWaalsContact C-N 3.3Å; F286-S288 PolarHBondContact O-N 2.79Å; S288-R292 PolarHBondContact O-N 3.31Å; S288-R292 VanDerWaalsContact O-N 3.1Å
289I84.7Confident80.6Confident67 Ų6777.9 Ų77.934%0.34443%0.431SS..Hα-helixtrans-63.2-45.6176-66.5167.1000110.3I285 F286 I291 R292 L293 F307I285-I289 HydrophobicContact CG2-CD1 3.89Å; I285-I289 WeakPolarHBondContact O-CG1 3.32Å; I285-I289 PolarHBondContact O-N 3.1Å; F286-I289 PolarHBondContact O-N 2.77Å; I289-I291 PolarHBondContact O-N 3.46Å; I289-R292 WeakPolarHBondContact O-CB 3.49Å; I289-R292 PolarHBondContact O-N 2.84Å; I289-R292 VanDerWaalsContact O-N 3.16Å; I289-L293 HydrophobicContact CG2-CD1 3.83Å; I289-L293 HydrophobicContact CG2-CG 4.19Å; I289-L293 VanDerWaalsContact O-CG 3.3Å; I289-L293 WeakPolarHBondContact O-CG 3.45Å; I289-L293 PolarHBondContact O-N 2.79Å; I289-F307 HydrophobicContact CG2-CE2 4.31Å; I289-F307 HydrophobicContact CG2-CZ 4.07Å
290F85.3Confident78.7Confident111 Ų11178.3 Ų78.349%0.48743%0.434SS..Hα-helixtrans-61.8-43.1-179.5-177.7-105000113F286 A287 R292 L293 K294F286-F290 WeakPolarHBondContact O-CB 3.26Å; F286-F290 PolarHBondContact O-N 3.11Å; A287-F290 PolarHBondContact O-N 2.98Å; F290-R292 VanDerWaalsContact C-N 3.32Å; F290-R292 PolarHBondContact O-N 2.8Å; F290-L293 PolarHBondContact O-N 3.39Å; F290-K294 HydrophobicContact CD1-CD 4.36Å; F290-K294 HydrophobicContact CE1-CD 3.76Å; F290-K294 VanDerWaalsContact CE1-CE 3.5Å; F290-K294 HydrophobicContact CZ-CD 3.97Å; F290-K294 PolarHBondContact O-N 3.32Å
291I82.3Confident76.9Confident98 Ų9878.9 Ų78.950%0.50346%0.456SS..Hα-helixtrans-63.2-39.9175.2-68.4165.9000110.6A287 I289 K294 S295A287-I291 VanDerWaalsContact O-CG1 3.26Å; A287-I291 WeakPolarHBondContact O-CG1 3.17Å; A287-I291 PolarHBondContact O-N 3.32Å; I289-I291 PolarHBondContact O-N 3.46Å; I291-K294 PolarHBondContact O-N 2.87Å; I291-S295 PolarHBondContact O-N 3.37Å; I291-S295 PolarHBondContact O-OG 3.2Å; I291-S295 VanDerWaalsContact O-OG 3.13Å
292R78.5Confident75.1Confident43 Ų4388.9 Ų88.916%0.16250%0.499CS..Hα-helixtrans-65.9-42.6175.5-174.360.7167.9-165.4-7.2111.9S288 I289 F290 K294 S295 I296 F307 K312 P313S288-R292 PolarHBondContact O-N 3.31Å; S288-R292 VanDerWaalsContact O-N 3.1Å; I289-R292 WeakPolarHBondContact O-CB 3.49Å; I289-R292 PolarHBondContact O-N 2.84Å; I289-R292 VanDerWaalsContact O-N 3.16Å; F290-R292 VanDerWaalsContact C-N 3.32Å; F290-R292 PolarHBondContact O-N 2.8Å; R292-K294 VanDerWaalsContact C-N 3.34Å; R292-K294 PolarHBondContact O-N 3.12Å; R292-S295 WeakPolarHBondContact CA-OG 3.38Å; R292-S295 PolarHBondContact O-N 3.35Å; R292-S295 PolarHBondContact O-OG 2.72Å; R292-I296 HydrophobicContact CG-CD1 4.01Å; R292-I296 WeakPolarHBondContact O-CG1 3.42Å; R292-I296 PolarHBondContact O-N 3.1Å; R292-I296 VanDerWaalsContact O-N 3.17Å; R292-F307 HydrophobicContact CB-CE2 4.29Å; R292-F307 HydrophobicContact CG-CD2 4.25Å; R292-F307 HydrophobicContact CG-CE2 3.93Å; R292-K312 PolarHBondContact NH2-O 3.44Å; R292-K312 VanDerWaalsContact NH2-O 3.07Å; R292-P313 PolarHBondContact NH1-O 3.12Å
293L80.9Confident73.4Confident82 Ų8288.5 Ų88.543%0.42950%0.499SS..Hα-helixtrans-61.8-39.9176.6-70.4172000112I289 F290 S297 F307I289-L293 HydrophobicContact CG2-CD1 3.83Å; I289-L293 HydrophobicContact CG2-CG 4.19Å; I289-L293 VanDerWaalsContact O-CG 3.3Å; I289-L293 WeakPolarHBondContact O-CG 3.45Å; I289-L293 PolarHBondContact O-N 2.79Å; F290-L293 PolarHBondContact O-N 3.39Å; L293-S297 PolarHBondContact O-N 2.76Å; L293-S297 PolarHBondContact O-OG 2.98Å; L293-F307 HydrophobicContact CD2-CD2 3.56Å; L293-F307 HydrophobicContact CD2-CE2 3.71Å; L293-F307 HydrophobicContact CD2-CG 4.43Å; L293-F307 HydrophobicContact CG-CD2 4.3Å; L293-F307 HydrophobicContact CG-CE2 4Å
294K79Confident71.9Confident131 Ų13196.1 Ų96.157%0.5752%0.516SS*.Hα-helixtrans-68-38.9174.9-81.3-171.2167.8179.40113.5F290 I291 R292F290-K294 HydrophobicContact CD1-CD 4.36Å; F290-K294 HydrophobicContact CE1-CD 3.76Å; F290-K294 VanDerWaalsContact CE1-CE 3.5Å; F290-K294 HydrophobicContact CZ-CD 3.97Å; F290-K294 PolarHBondContact O-N 3.32Å; I291-K294 PolarHBondContact O-N 2.87Å; R292-K294 VanDerWaalsContact C-N 3.34Å; R292-K294 PolarHBondContact O-N 3.12Å
295S70.5Confident70.8Confident47 Ų47103 Ų10333%0.32954%0.538SS..Hα-helixtrans-71.5-31.7-17953.60000113.8I291 R292I291-S295 PolarHBondContact O-N 3.37Å; I291-S295 PolarHBondContact O-OG 3.2Å; I291-S295 VanDerWaalsContact O-OG 3.13Å; R292-S295 WeakPolarHBondContact CA-OG 3.38Å; R292-S295 PolarHBondContact O-N 3.35Å; R292-S295 PolarHBondContact O-OG 2.72Å
296I67.3Low69.6Low30 Ų30100.1 Ų100.115%0.15452%0.524CS..Hα-helixtrans-75-33.7178.2-65.5169.2000112.1R292 V298 D299 T306 F307R292-I296 HydrophobicContact CG-CD1 4.01Å; R292-I296 WeakPolarHBondContact O-CG1 3.42Å; R292-I296 PolarHBondContact O-N 3.1Å; R292-I296 VanDerWaalsContact O-N 3.17Å; I296-V298 PolarHBondContact O-N 3.28Å; I296-D299 PolarHBondContact O-N 3.03Å; I296-T306 HydrophobicContact CG2-CG2 3.95Å; I296-F307 HydrophobicContact CD1-CB 4.44Å; I296-F307 HydrophobicContact CD1-CD2 4.15Å
297S59.2Low68.2Low99 Ų9996 Ų9669%0.69251%0.506SS*.THydrogen-bonded Turntrans-61.4-16.6-174.8-62.80000114.1L293L293-S297 PolarHBondContact O-N 2.76Å; L293-S297 PolarHBondContact O-OG 2.98Å
298V58.4Low67.2Low120 Ų120100.6 Ų100.673%0.72752%0.518SS*.THydrogen-bonded Turntrans-84-29.1-178.2179.30000112.9I296I296-V298 PolarHBondContact O-N 3.28Å
299D52.1Low66.2Low134 Ų134100.1 Ų100.172%0.71751%0.509SS*.THydrogen-bonded Turntrans-113.6-14.7-163.5-85.7-20.7000116.9I296I296-D299 PolarHBondContact O-N 3.03Å
300S53.3Low64.8Low72 Ų72101.6 Ų101.650%0.50352%0.517SS..SBendtrans-164.8145.9-179.7-80.60000113.2
301G53.9Low63.3Low66 Ų66101.8 Ų101.868%0.6853%0.527SS*.  trans-47.5144.2-174.500000115.7S303G301-S303 PolarHBondContact O-N 3.47Å
302K53.4Low61.9Low224 Ų224100.7 Ų100.797%0.97452%0.519SS*.  trans-48.994.9-176.5-62.7170.7-178.5171.60112.4
303S55Low60.5Low58 Ų58104 Ų10441%0.40655%0.546SS..  trans-139.3126.3167.6-174.10000110.6G301 R305 T306G301-S303 PolarHBondContact O-N 3.47Å; S303-R305 PolarHBondContact O-N 2.95Å; S303-R305 VanDerWaalsContact O-N 3.09Å; S303-R305 PolarHBondContact OG-N 3.08Å; S303-T306 WeakPolarHBondContact O-CB 3.31Å; S303-T306 PolarHBondContact O-N 2.91Å
304W61.2Low59.2Low215 Ų215104.2 Ų104.281%0.81455%0.551SS**Hα-helixtrans-51.9-29.4173.4-67.689.5000112.4T306 F307 F308W304-T306 VanDerWaalsContact C-N 3.26Å; W304-T306 PolarHBondContact O-N 2.81Å; W304-F307 WeakPolarHBondContact O-CB 3.5Å; W304-F307 PolarHBondContact O-N 2.82Å; W304-F307 VanDerWaalsContact O-N 3.17Å; W304-F308 VanDerWaalsContact O-CD2 3.28Å; W304-F308 WeakPolarHBondContact O-CD2 3.46Å; W304-F308 PolarHBondContact O-N 3.36Å
305R63.2Low57.8Low211 Ų211102.7 Ų102.780%0.79655%0.552SS**Hα-helixtrans-64.1-30.6177.8-62.6-176.6178.1170.3-0.2113S303 F307 F308 D309S303-R305 PolarHBondContact O-N 2.95Å; S303-R305 VanDerWaalsContact O-N 3.09Å; S303-R305 PolarHBondContact OG-N 3.08Å; R305-F307 VanDerWaalsContact C-N 3.34Å; R305-F308 PolarHBondContact O-N 2.87Å; R305-D309 PolarHBondContact O-N 2.8Å
306T63.1Low57.1Low27 Ų27106.4 Ų106.417%0.16657%0.572CS.*Hα-helixtrans-74.8-27.3177.7-50.50000112.1I296 S303 W304 D309I296-T306 HydrophobicContact CG2-CG2 3.95Å; S303-T306 WeakPolarHBondContact O-CB 3.31Å; S303-T306 PolarHBondContact O-N 2.91Å; W304-T306 VanDerWaalsContact C-N 3.26Å; W304-T306 PolarHBondContact O-N 2.81Å; T306-D309 WeakPolarHBondContact O-CB 3.42Å; T306-D309 PolarHBondContact O-N 3.32Å
307F61.5Low56.1Low58 Ų58110.4 Ų110.425%0.25459%0.593SS.*Hα-helixtrans-64.7-44.7172.3178.4-96.6000111.1I289 R292 L293 I296 W304 R305 D309I289-F307 HydrophobicContact CG2-CE2 4.31Å; I289-F307 HydrophobicContact CG2-CZ 4.07Å; R292-F307 HydrophobicContact CB-CE2 4.29Å; R292-F307 HydrophobicContact CG-CD2 4.25Å; R292-F307 HydrophobicContact CG-CE2 3.93Å; L293-F307 HydrophobicContact CD2-CD2 3.56Å; L293-F307 HydrophobicContact CD2-CE2 3.71Å; L293-F307 HydrophobicContact CD2-CG 4.43Å; L293-F307 HydrophobicContact CG-CD2 4.3Å; L293-F307 HydrophobicContact CG-CE2 4Å; I296-F307 HydrophobicContact CD1-CB 4.44Å; I296-F307 HydrophobicContact CD1-CD2 4.15Å; W304-F307 WeakPolarHBondContact O-CB 3.5Å; W304-F307 PolarHBondContact O-N 2.82Å; W304-F307 VanDerWaalsContact O-N 3.17Å; R305-F307 VanDerWaalsContact C-N 3.34Å; F307-D309 PolarHBondContact O-N 3.02Å
308F66Low55.6Low141 Ų141110.8 Ų110.862%0.61859%0.591SS**THydrogen-bonded Turntrans-81.59.1177-65.6-70.2000114.2W304 R305 I310W304-F308 VanDerWaalsContact O-CD2 3.28Å; W304-F308 WeakPolarHBondContact O-CD2 3.46Å; W304-F308 PolarHBondContact O-N 3.36Å; R305-F308 PolarHBondContact O-N 2.87Å; F308-I310 PolarHBondContact O-N 3.11Å
309D61.6Low55.3Low69 Ų69109.1 Ų109.137%0.36958%0.583SS.*  trans-79.291.6179-1554.6000109.5R305 T306 F307 T311 K312R305-D309 PolarHBondContact O-N 2.8Å; T306-D309 WeakPolarHBondContact O-CB 3.42Å; T306-D309 PolarHBondContact O-N 3.32Å; F307-D309 PolarHBondContact O-N 3.02Å; D309-T311 PolarHBondContact O-N 2.9Å; D309-T311 VanDerWaalsContact O-N 3.16Å; D309-K312 PolarHBondContact O-N 2.84Å
310I54.9Low55.4Low97 Ų97107.9 Ų107.950%0.49758%0.584SS.*THydrogen-bonded Turntrans-62.5-20.9-172.2-62.9155.8000112I242 L243 F308 K312I242-I310 HydrophobicContact CG2-CG2 3.89Å; L243-I310 HydrophobicContact CD2-CD1 3.87Å; L243-I310 HydrophobicContact CD2-CG2 4.26Å; F308-I310 PolarHBondContact O-N 3.11Å; I310-K312 VanDerWaalsContact C-N 3.32Å; I310-K312 PolarHBondContact O-N 3.33Å
311T54Low55.2Low116 Ų116109 Ų10971%0.71258%0.584SS**THydrogen-bonded Turntrans-74.1-18.3-175.6-43.40000113.7D309D309-T311 PolarHBondContact O-N 2.9Å; D309-T311 VanDerWaalsContact O-N 3.16Å
312K52.5Low55.3Low74 Ų74112.9 Ų112.932%0.32259%0.588SS.*SBendtrans-80.3121.6178.8-70.2-175.1-177.2-175.50110.3R292 D309 I310 V314R292-K312 PolarHBondContact NH2-O 3.44Å; R292-K312 VanDerWaalsContact NH2-O 3.07Å; D309-K312 PolarHBondContact O-N 2.84Å; I310-K312 VanDerWaalsContact C-N 3.32Å; I310-K312 PolarHBondContact O-N 3.33Å; K312-V314 PolarHBondContact O-N 3.11Å
313P49.8Very low55.6Low113 Ų113105.8 Ų105.873%0.73457%0.566SS**PPolyproline II helixtrans-55.1131-178.222.5-32.3000110R292 V315R292-P313 PolarHBondContact NH1-O 3.12Å; P313-V315 PolarHBondContact O-N 2.89Å
314V52.9Low56.3Low87 Ų87110.3 Ų110.353%0.52758%0.579SS.*PPolyproline II helixtrans-61.8129.2166.4-175.30000105.5M246 K312 V316M246-V314 HydrophobicContact SD-CG2 4.33Å; K312-V314 PolarHBondContact O-N 3.11Å; V314-V316 PolarHBondContact O-N 3.22Å
315V50Low56.4Low98 Ų98101.7 Ų101.759%0.59455%0.554SS**  trans-53.2111177.2175.60000106.8P313 I317P313-V315 PolarHBondContact O-N 2.89Å; V315-I317 HydrophobicContact CG1-CG1 4.16Å; V315-I317 PolarHBondContact O-N 2.86Å
316V55.5Low56.6Low125 Ų12594.5 Ų94.576%0.75854%0.535SS*.  trans-70.791.2171.3-176.80000104.4V314 T318V314-V316 PolarHBondContact O-N 3.22Å; V316-T318 PolarHBondContact O-N 3.15Å
317I46.9Very low57.1Low114 Ų11497.9 Ų97.959%0.58556%0.556SS**  trans-64.299.4167.3-61.4165.9000103.4V315 P319V315-I317 HydrophobicContact CG1-CG1 4.16Å; V315-I317 PolarHBondContact O-N 2.86Å; I317-P319 VanDerWaalsContact O-CD 3.23Å; I317-P319 WeakPolarHBondContact O-CD 3.3Å
318T49.3Very low57.6Low107 Ų107100.8 Ų100.866%0.65657%0.568SS**  trans-49.6114.8163.342.60000105.1V316 S320V316-T318 PolarHBondContact O-N 3.15Å; T318-S320 VanDerWaalsContact C-N 3.3Å; T318-S320 PolarHBondContact O-N 3.39Å
319P50.7Low58.2Low85 Ų8598.5 Ų98.555%0.55256%0.562SS**  trans-63.2100.9-178.623.9-31.2000106.5I317 L321 A325I317-P319 VanDerWaalsContact O-CD 3.23Å; I317-P319 WeakPolarHBondContact O-CD 3.3Å; P319-L321 PolarHBondContact O-N 3.2Å; P319-L321 VanDerWaalsContact O-N 3.09Å; P319-A325 HydrophobicContact CB-CB 3.96Å; P319-A325 HydrophobicContact CG-CB 4.41Å
320S54.9Low59.2Low108 Ų10899.8 Ų99.876%0.75557%0.572SS**SBendtrans-73.60.4-172.552.20000112.9T318T318-S320 VanDerWaalsContact C-N 3.3Å; T318-S320 PolarHBondContact O-N 3.39Å
321L48.3Very low60.5Low96 Ų9697.9 Ų97.950%0.50356%0.563SS.*SBendtrans-141.9105174.6-65.6170.5000108.5P319 S323 K324P319-L321 PolarHBondContact O-N 3.2Å; P319-L321 VanDerWaalsContact O-N 3.09Å; L321-S323 PolarHBondContact O-N 3.04Å; L321-K324 PolarHBondContact O-N 3.25Å; L321-K324 VanDerWaalsContact O-N 3.08Å
322I55.8Low61.9Low148 Ų14894.3 Ų94.376%0.75954%0.541SS*.Hα-helixtrans-48.2-22.9178-66.3156.8000112.5S326I322-S326 WeakPolarHBondContact O-CB 3.47Å; I322-S326 PolarHBondContact O-OG 3.25Å
323S60.8Low63.6Low74 Ų7497.6 Ų97.652%0.51756%0.555SS.*Hα-helixtrans-71.9-44.6177.559.20000114L321 V327L321-S323 PolarHBondContact O-N 3.04Å; S323-V327 WeakPolarHBondContact O-CB 3.48Å; S323-V327 WeakPolarHBondContact O-CG2 3.27Å; S323-V327 PolarHBondContact O-N 3.23Å
324K68.5Low65.4Low153 Ų15397 Ų9767%0.66555%0.546SS*.Hα-helixtrans-72-39.5-170.7-66.1-176.3-177.7179.60112.8L321 K328L321-K324 PolarHBondContact O-N 3.25Å; L321-K324 VanDerWaalsContact O-N 3.08Å; K324-K328 PolarHBondContact O-N 3.49Å; K324-K328 VanDerWaalsContact O-N 3.09Å
325A63.6Low67.1Low35 Ų3593.2 Ų93.229%0.28952%0.522SS..Hα-helixtrans-69.1-45.7178.300000111.3P319 V327 K328 I329P319-A325 HydrophobicContact CB-CB 3.96Å; P319-A325 HydrophobicContact CG-CB 4.41Å; A325-V327 VanDerWaalsContact C-N 3.35Å; A325-V327 PolarHBondContact O-N 3.38Å; A325-K328 WeakPolarHBondContact O-CB 3.44Å; A325-K328 PolarHBondContact O-N 3.21Å; A325-K328 VanDerWaalsContact O-N 3.13Å; A325-I329 WeakPolarHBondContact O-CG1 3.31Å; A325-I329 PolarHBondContact O-N 3.25Å
326S68Low69.1Low59 Ų5991.5 Ų91.541%0.41351%0.509SS..Hα-helixtrans-60.3-43.6176-600000111.8I322 K328 I329 V330I322-S326 WeakPolarHBondContact O-CB 3.47Å; I322-S326 PolarHBondContact O-OG 3.25Å; S326-K328 VanDerWaalsContact C-N 3.31Å; S326-K328 PolarHBondContact O-N 3.5Å; S326-I329 PolarHBondContact O-N 3.27Å; S326-V330 VanDerWaalsContact O-CG2 3.32Å; S326-V330 WeakPolarHBondContact O-CG2 3.42Å; S326-V330 PolarHBondContact O-N 2.97Å
327V73.3Confident70.7Confident98 Ų9886.8 Ų86.859%0.59449%0.486SS*.Hα-helixtrans-60.6-39.4174.8170.30000111.7S323 A325 I329 V330 N331S323-V327 WeakPolarHBondContact O-CB 3.48Å; S323-V327 WeakPolarHBondContact O-CG2 3.27Å; S323-V327 PolarHBondContact O-N 3.23Å; A325-V327 VanDerWaalsContact C-N 3.35Å; A325-V327 PolarHBondContact O-N 3.38Å; V327-I329 PolarHBondContact O-N 2.99Å; V327-V330 PolarHBondContact O-N 3.12Å; V327-N331 WeakPolarHBondContact O-CB 3.42Å; V327-N331 PolarHBondContact O-N 3.35Å
328K72.4Confident72.8Confident119 Ų11981.9 Ų81.952%0.51746%0.46SS..Hα-helixtrans-63.9-40.4176-173.4-178177.7-1760112.1K324 A325 S326 T332K324-K328 PolarHBondContact O-N 3.49Å; K324-K328 VanDerWaalsContact O-N 3.09Å; A325-K328 WeakPolarHBondContact O-CB 3.44Å; A325-K328 PolarHBondContact O-N 3.21Å; A325-K328 VanDerWaalsContact O-N 3.13Å; S326-K328 VanDerWaalsContact C-N 3.31Å; S326-K328 PolarHBondContact O-N 3.5Å; K328-T332 PolarHBondContact O-N 2.86Å; K328-T332 PolarHBondContact O-OG1 3.47Å
329I77.8Confident74.9Confident93 Ų9376.8 Ų76.848%0.47743%0.429SS..Hα-helixtrans-65.9-49.7178.1-68.5161.9000110A325 S326 V327 N331 T332 F333A325-I329 WeakPolarHBondContact O-CG1 3.31Å; A325-I329 PolarHBondContact O-N 3.25Å; S326-I329 PolarHBondContact O-N 3.27Å; V327-I329 PolarHBondContact O-N 2.99Å; I329-N331 VanDerWaalsContact C-N 3.3Å; I329-N331 PolarHBondContact O-N 2.6Å; I329-T332 PolarHBondContact O-N 2.8Å; I329-T332 VanDerWaalsContact O-N 3.08Å; I329-F333 HydrophobicContact CG2-CD2 3.55Å; I329-F333 HydrophobicContact CG2-CE2 3.34Å; I329-F333 VanDerWaalsContact O-CD2 3.23Å; I329-F333 WeakPolarHBondContact O-CD2 3.43Å; I329-F333 PolarHBondContact O-N 3.06Å
330V82.3Confident76.8Confident97 Ų9775 Ų7559%0.58842%0.418SS*.Hα-helixtrans-57.4-44.1177173.20000111.1S326 V327 T332 F333 L334S326-V330 VanDerWaalsContact O-CG2 3.32Å; S326-V330 WeakPolarHBondContact O-CG2 3.42Å; S326-V330 PolarHBondContact O-N 2.97Å; V327-V330 PolarHBondContact O-N 3.12Å; V330-T332 VanDerWaalsContact C-N 3.33Å; V330-T332 PolarHBondContact O-N 2.78Å; V330-F333 PolarHBondContact O-N 3.07Å; V330-L334 WeakPolarHBondContact O-CB 3.35Å; V330-L334 PolarHBondContact O-N 3.47Å
331N83.9Confident78.5Confident57 Ų5773.6 Ų73.631%0.30540%0.402SS..Hα-helixtrans-63.4-38.9177.1-166.5-9.7000112.1R280 V327 I329 L334 Q335R280-N331 PolarHBondContact NH1-ND2 2.74Å; R280-N331 PolarHBondContact NH1-OD1 3.21Å; V327-N331 WeakPolarHBondContact O-CB 3.42Å; V327-N331 PolarHBondContact O-N 3.35Å; I329-N331 VanDerWaalsContact C-N 3.3Å; I329-N331 PolarHBondContact O-N 2.6Å; N331-L334 PolarHBondContact O-N 2.6Å; N331-Q335 VanDerWaalsContact O-CG 3.31Å; N331-Q335 WeakPolarHBondContact O-CG 2.92Å; N331-Q335 PolarHBondContact O-N 3.16Å
332T83.1Confident80.5Confident41 Ų4169.1 Ų69.125%0.25238%0.378SS..Hα-helixtrans-66.6-43.1177.9-52.30000111.2K328 I329 V330 Q335 I336K328-T332 PolarHBondContact O-N 2.86Å; K328-T332 PolarHBondContact O-OG1 3.47Å; I329-T332 PolarHBondContact O-N 2.8Å; I329-T332 VanDerWaalsContact O-N 3.08Å; V330-T332 VanDerWaalsContact C-N 3.33Å; V330-T332 PolarHBondContact O-N 2.78Å; T332-Q335 PolarHBondContact O-N 3.4Å; T332-I336 HydrophobicContact CG2-CD1 4.35Å; T332-I336 WeakPolarHBondContact O-CG1 3.17Å; T332-I336 PolarHBondContact O-N 2.96Å
333F87.5Confident82.2Confident142 Ų14262 Ų6262%0.62334%0.342SS*.Hα-helixtrans-64.1-40.1173.6-78-65.1000112.8I329 V330 Q335 I336 G337I329-F333 HydrophobicContact CG2-CD2 3.55Å; I329-F333 HydrophobicContact CG2-CE2 3.34Å; I329-F333 VanDerWaalsContact O-CD2 3.23Å; I329-F333 WeakPolarHBondContact O-CD2 3.43Å; I329-F333 PolarHBondContact O-N 3.06Å; V330-F333 PolarHBondContact O-N 3.07Å; F333-Q335 VanDerWaalsContact C-N 3.27Å; F333-Q335 PolarHBondContact O-N 2.7Å; F333-I336 PolarHBondContact O-N 2.88Å; F333-G337 PolarHBondContact O-N 2.81Å
334L87.8Confident83.6Confident101 Ų10158.8 Ų58.853%0.52932%0.319SS..Hα-helixtrans-60.5-39.5175.9-174.569000111.1V330 N331 G337 L338V330-L334 WeakPolarHBondContact O-CB 3.35Å; V330-L334 PolarHBondContact O-N 3.47Å; N331-L334 PolarHBondContact O-N 2.6Å; L334-G337 PolarHBondContact O-N 3.23Å; L334-L338 WeakPolarHBondContact O-CB 3.39Å; L334-L338 PolarHBondContact O-N 2.88Å
335Q89.6Confident84.6Confident8 Ų852.2 Ų52.24%0.03729%0.293CS..Hα-helixtrans-68.2-44176.4-75.2-177.9-22.100113.4F260 V277 N331 T332 F333 G337 L338 V339F260-Q335 HydrophobicContact CE2-CB 4.34Å; F260-Q335 HydrophobicContact CZ-CB 4.23Å; F260-Q335 HydrophobicContact CZ-CG 4.26Å; V277-Q335 VanDerWaalsContact CG1-NE2 3.25Å; N331-Q335 VanDerWaalsContact O-CG 3.31Å; N331-Q335 WeakPolarHBondContact O-CG 2.92Å; N331-Q335 PolarHBondContact O-N 3.16Å; T332-Q335 PolarHBondContact O-N 3.4Å; F333-Q335 VanDerWaalsContact C-N 3.27Å; F333-Q335 PolarHBondContact O-N 2.7Å; Q335-G337 VanDerWaalsContact C-N 3.27Å; Q335-G337 PolarHBondContact O-N 2.65Å; Q335-L338 PolarHBondContact O-N 2.83Å; Q335-V339 WeakPolarHBondContact O-CG2 3.24Å; Q335-V339 PolarHBondContact O-N 3.22Å
336I90.5Very high85.7Confident61 Ų6152.4 Ų52.431%0.31329%0.292SS..Hα-helixtrans-59.1-46.1174-66.6165.9000108.9L256 T332 F333 L338 V339 C340L256-I336 HydrophobicContact CD1-CG1 3.97Å; L256-I336 HydrophobicContact CD2-CG1 4.17Å; T332-I336 HydrophobicContact CG2-CD1 4.35Å; T332-I336 WeakPolarHBondContact O-CG1 3.17Å; T332-I336 PolarHBondContact O-N 2.96Å; F333-I336 PolarHBondContact O-N 2.88Å; I336-L338 PolarHBondContact O-N 3.35Å; I336-V339 PolarHBondContact O-N 3.4Å; I336-C340 PolarHBondContact O-N 2.81Å; I336-C340 PolarHBondContact O-SG 2.87Å
337G90.7Very high86.7Confident26 Ų2652 Ų5227%0.26829%0.287SS..Hα-helixtrans-58.9-44.817600000113.3F333 L334 Q335 V339 C340 I341F333-G337 PolarHBondContact O-N 2.81Å; L334-G337 PolarHBondContact O-N 3.23Å; Q335-G337 VanDerWaalsContact C-N 3.27Å; Q335-G337 PolarHBondContact O-N 2.65Å; G337-V339 PolarHBondContact O-N 3.25Å; G337-C340 WeakPolarHBondContact O-CB 3.46Å; G337-C340 PolarHBondContact O-N 3.06Å; G337-I341 WeakPolarHBondContact O-CB 3.05Å; G337-I341 VanDerWaalsContact O-CG1 3.26Å; G337-I341 WeakPolarHBondContact O-CG1 3.25Å; G337-I341 PolarHBondContact O-N 3.01Å
338L90.5Very high87.3Confident11 Ų1155.5 Ų55.56%0.05829%0.289CS..Hα-helixtrans-59.5-46.9175.5-176.2160.4000111.2F260 I269 L273 L334 Q335 I336 I341 T342 L359F260-L338 HydrophobicContact CE1-CD2 3.78Å; F260-L338 HydrophobicContact CZ-CD2 4.19Å; I269-L338 HydrophobicContact CD1-CD2 3.87Å; L273-L338 HydrophobicContact CD1-CD1 4Å; L273-L338 HydrophobicContact CD2-CD1 4.24Å; L334-L338 WeakPolarHBondContact O-CB 3.39Å; L334-L338 PolarHBondContact O-N 2.88Å; Q335-L338 PolarHBondContact O-N 2.83Å; I336-L338 PolarHBondContact O-N 3.35Å; L338-I341 PolarHBondContact O-N 3.16Å; L338-T342 HydrophobicContact CD2-CG2 3.93Å; L338-T342 HydrophobicContact CG-CG2 4.47Å; L338-T342 WeakPolarHBondContact O-CB 3.39Å; L338-T342 VanDerWaalsContact O-CG2 3.23Å; L338-T342 WeakPolarHBondContact O-CG2 3.49Å; L338-T342 PolarHBondContact O-N 3.4Å; L338-T342 PolarHBondContact O-OG1 3.23Å; L338-L359 HydrophobicContact CB-CD2 3.62Å; L338-L359 HydrophobicContact CD1-CD2 4.03Å; L338-L359 HydrophobicContact CG-CD2 3.64Å
339V92.4Very high87.6Confident0 Ų056.4 Ų56.40%030%0.3CS..Hα-helixtrans-64.5-42.6177.8172.80000111.2F219 L256 L259 F260 L263 Q335 I336 G337 I341 T342 L343F219-V339 HydrophobicContact CE1-CG1 4.35Å; F219-V339 HydrophobicContact CE2-CG1 4.09Å; F219-V339 HydrophobicContact CZ-CB 4.47Å; F219-V339 HydrophobicContact CZ-CG1 3.84Å; L256-V339 HydrophobicContact CD2-CG2 4.27Å; L259-V339 HydrophobicContact CB-CG1 4.12Å; L259-V339 HydrophobicContact CD1-CG1 3.6Å; L259-V339 HydrophobicContact CG-CG1 4.32Å; F260-V339 HydrophobicContact CD2-CG2 4.09Å; F260-V339 HydrophobicContact CE1-CG2 4.13Å; F260-V339 HydrophobicContact CE2-CG2 3.56Å; F260-V339 HydrophobicContact CZ-CG2 3.59Å; L263-V339 HydrophobicContact CD1-CG1 4.28Å; Q335-V339 WeakPolarHBondContact O-CG2 3.24Å; Q335-V339 PolarHBondContact O-N 3.22Å; I336-V339 PolarHBondContact O-N 3.4Å; G337-V339 PolarHBondContact O-N 3.25Å; V339-I341 PolarHBondContact O-N 3.06Å; V339-T342 WeakPolarHBondContact CA-OG1 3.42Å; V339-T342 PolarHBondContact O-OG1 3.35Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 PolarHBondContact O-N 3.31Å
340C91.6Very high87.6Confident48 Ų4855.7 Ų55.732%0.32430%0.296SS..Hα-helixtrans-56.3-51.7174-67.60000111.6F219 I336 G337 A344F219-C340 HydrophobicContact CE1-CB 4.41Å; F219-C340 VanDerWaalsContact CE1-SG 3.5Å; I336-C340 PolarHBondContact O-N 2.81Å; I336-C340 PolarHBondContact O-SG 2.87Å; G337-C340 WeakPolarHBondContact O-CB 3.46Å; G337-C340 PolarHBondContact O-N 3.06Å; C340-A344 VanDerWaalsContact O-CB 3.23Å; C340-A344 WeakPolarHBondContact O-CB 3.23Å; C340-A344 PolarHBondContact O-N 2.69Å
341I90.6Very high86.6Confident79 Ų7960 Ų6041%0.40531%0.31SS..Hα-helixtrans-68.2-45.2-174.1-68.2165.7000110.5G337 L338 V339 L343 A344 A345 L356 L359G337-I341 WeakPolarHBondContact O-CB 3.05Å; G337-I341 VanDerWaalsContact O-CG1 3.26Å; G337-I341 WeakPolarHBondContact O-CG1 3.25Å; G337-I341 PolarHBondContact O-N 3.01Å; L338-I341 PolarHBondContact O-N 3.16Å; V339-I341 PolarHBondContact O-N 3.06Å; I341-L343 PolarHBondContact O-N 2.76Å; I341-A344 PolarHBondContact O-N 3.33Å; I341-A345 WeakPolarHBondContact O-CB 3.5Å; I341-A345 PolarHBondContact O-N 3.2Å; I341-L356 HydrophobicContact CG2-CD1 4.47Å; I341-L359 HydrophobicContact CD1-CD1 3.64Å
342T90.1Very high85.4Confident1 Ų159 Ų591%0.00631%0.307CS..Hα-helixtrans-62.4-42.1178.449.10000111.8L268 I269 L338 V339 A344 P346 L356L268-T342 WeakPolarHBondContact CD2-O 3.47Å; I269-T342 HydrophobicContact CD1-CG2 4.27Å; I269-T342 HydrophobicContact CG1-CG2 3.96Å; L338-T342 HydrophobicContact CD2-CG2 3.93Å; L338-T342 HydrophobicContact CG-CG2 4.47Å; L338-T342 WeakPolarHBondContact O-CB 3.39Å; L338-T342 VanDerWaalsContact O-CG2 3.23Å; L338-T342 WeakPolarHBondContact O-CG2 3.49Å; L338-T342 PolarHBondContact O-N 3.4Å; L338-T342 PolarHBondContact O-OG1 3.23Å; V339-T342 WeakPolarHBondContact CA-OG1 3.42Å; V339-T342 PolarHBondContact O-OG1 3.35Å; T342-A344 VanDerWaalsContact C-N 3.35Å; T342-P346 WeakPolarHBondContact O-CD 3.46Å; T342-L356 HydrophobicContact CG2-CD2 3.74Å
343L91.2Very high84.6Confident0 Ų060.8 Ų60.80%032%0.321CS..Hα-helixtrans-72.5-29.9179.7-162.2146.4000112.4V207 A215 L216 L259 V339 I341 P346V207-L343 HydrophobicContact CG2-CD1 4.05Å; A215-L343 HydrophobicContact CB-CD1 4.45Å; A215-L343 HydrophobicContact CB-CD2 4.3Å; L216-L343 HydrophobicContact CB-CD2 3.44Å; L216-L343 VanDerWaalsContact CB-CD2 3.44Å; L216-L343 HydrophobicContact CD1-CD2 3.5Å; L216-L343 VanDerWaalsContact CD1-CD2 3.5Å; L216-L343 HydrophobicContact CG-CD2 4.06Å; L259-L343 HydrophobicContact CD2-CD1 3.64Å; V339-L343 WeakPolarHBondContact O-CB 3.49Å; V339-L343 PolarHBondContact O-N 3.31Å; I341-L343 PolarHBondContact O-N 2.76Å; L343-P346 WeakPolarHBondContact O-CD 3.23Å
344A91.3Very high83.6Confident5 Ų561 Ų614%0.04132%0.324CS..Hα-helixtrans-82.5-23.9176.900000114.2L216 C340 I341 T342 V347 W348L216-A344 HydrophobicContact CD1-CB 4.05Å; L216-A344 HydrophobicContact CD2-CB 4.3Å; C340-A344 VanDerWaalsContact O-CB 3.23Å; C340-A344 WeakPolarHBondContact O-CB 3.23Å; C340-A344 PolarHBondContact O-N 2.69Å; I341-A344 PolarHBondContact O-N 3.33Å; T342-A344 VanDerWaalsContact C-N 3.35Å; A344-V347 WeakPolarHBondContact O-CB 3.3Å; A344-V347 PolarHBondContact O-N 3Å; A344-W348 HydrophobicContact CB-CE3 3.6Å; A344-W348 HydrophobicContact CB-CH2 4.19Å; A344-W348 HydrophobicContact CB-CZ3 3.39Å; A344-W348 PolarHBondContact O-N 2.91Å
345A88.2Confident82.6Confident15 Ų1561.8 Ų61.812%0.12433%0.328CS..THydrogen-bonded Turntrans-51.5-50.6178.700000114.1I341 V347 N349 I350 L356I341-A345 WeakPolarHBondContact O-CB 3.5Å; I341-A345 PolarHBondContact O-N 3.2Å; A345-V347 VanDerWaalsContact C-N 3.29Å; A345-V347 PolarHBondContact O-N 3.13Å; A345-N349 PolarHBondContact O-N 2.86Å; A345-N349 VanDerWaalsContact O-N 3.16Å; A345-I350 PolarHBondContact O-N 3.27Å; A345-I350 VanDerWaalsContact O-N 3.09Å; A345-L356 HydrophobicContact CB-CD1 4.24Å
346P86.6Confident81.6Confident40 Ų4062.3 Ų62.326%0.2633%0.331SS..THydrogen-bonded Turntrans-70.9-22.4177.130.5-38.8000113.4Y212 L268 T342 L343Y212-P346 HydrophobicContact CD1-CG 3.77Å; Y212-P346 HydrophobicContact CD2-CB 3.54Å; Y212-P346 HydrophobicContact CD2-CG 3.56Å; Y212-P346 HydrophobicContact CE1-CG 4.19Å; Y212-P346 HydrophobicContact CE2-CB 3.81Å; Y212-P346 HydrophobicContact CE2-CG 4Å; Y212-P346 HydrophobicContact CG-CB 3.97Å; Y212-P346 HydrophobicContact CG-CG 3.42Å; Y212-P346 VanDerWaalsContact CG-CG 3.42Å; L268-P346 HydrophobicContact CD2-CG 3.95Å; T342-P346 WeakPolarHBondContact O-CD 3.46Å; L343-P346 WeakPolarHBondContact O-CD 3.23Å
347V88.5Confident80.7Confident50 Ų5068 Ų6830%0.30335%0.349SS..THydrogen-bonded Turntrans-75.3-41-179.6179.60000111.1L216 A344 A345L216-V347 HydrophobicContact CD2-CG1 4.39Å; L216-V347 HydrophobicContact CD2-CG2 4.36Å; A344-V347 WeakPolarHBondContact O-CB 3.3Å; A344-V347 PolarHBondContact O-N 3Å; A345-V347 VanDerWaalsContact C-N 3.29Å; A345-V347 PolarHBondContact O-N 3.13Å
348W86.3Confident80Confident171 Ų17171.9 Ų71.965%0.64837%0.367SS*.THydrogen-bonded Turntrans-95.47.3179.5-69.5-46.2000113.8A344 I350A344-W348 HydrophobicContact CB-CE3 3.6Å; A344-W348 HydrophobicContact CB-CH2 4.19Å; A344-W348 HydrophobicContact CB-CZ3 3.39Å; A344-W348 PolarHBondContact O-N 2.91Å; W348-I350 HydrophobicContact CB-CD1 3.72Å; W348-I350 HydrophobicContact CB-CG1 3.63Å; W348-I350 HydrophobicContact CE3-CD1 4.02Å; W348-I350 HydrophobicContact CG-CD1 4.47Å; W348-I350 PolarHBondContact O-N 3.47Å; W348-I350 VanDerWaalsContact O-N 3.16Å
349N79.9Confident79.1Confident139 Ų13974.1 Ų74.174%0.74338%0.379SS*.THydrogen-bonded Turntrans48.938-175.2-67.3-50.2000112.7A345 E351A345-N349 PolarHBondContact O-N 2.86Å; A345-N349 VanDerWaalsContact O-N 3.16Å; N349-E351 PolarHBondContact O-N 3.04Å; N349-E351 VanDerWaalsContact O-N 3.16Å
350I76.7Confident77.9Confident78 Ų7879.5 Ų79.540%0.440%0.399SS..  trans-79.8105.2-178.8-61.8173.5000107.4A345 W348 C352A345-I350 PolarHBondContact O-N 3.27Å; A345-I350 VanDerWaalsContact O-N 3.09Å; W348-I350 HydrophobicContact CB-CD1 3.72Å; W348-I350 HydrophobicContact CB-CG1 3.63Å; W348-I350 HydrophobicContact CE3-CD1 4.02Å; W348-I350 HydrophobicContact CG-CD1 4.47Å; W348-I350 PolarHBondContact O-N 3.47Å; W348-I350 VanDerWaalsContact O-N 3.16Å; I350-C352 HydrophobicContact CG2-CB 3.64Å; I350-C352 WeakPolarHBondContact CG2-SG 3.46Å; I350-C352 PolarHBondContact O-N 2.95Å
351E61Low77.3Confident188 Ų18881.1 Ų81.188%0.87940%0.403SS*.  trans-69.554.8170.4-64.8-178.1176.100111.6N349 S353N349-E351 PolarHBondContact O-N 3.04Å; N349-E351 VanDerWaalsContact O-N 3.16Å; E351-S353 PolarHBondContact O-N 2.78Å
352C59.7Low76.6Confident34 Ų3481.2 Ų81.223%0.2340%0.403CS..  trans-8460-178.4-93.70000111.7I350 H354 L355 L356I350-C352 HydrophobicContact CG2-CB 3.64Å; I350-C352 WeakPolarHBondContact CG2-SG 3.46Å; I350-C352 PolarHBondContact O-N 2.95Å; C352-H354 VanDerWaalsContact C-N 3.27Å; C352-H354 PolarHBondContact O-N 3.26Å; C352-L355 HydrophobicContact CB-CB 4.03Å; C352-L356 HydrophobicContact CB-CD1 3.65Å; C352-L356 WeakPolarHBondContact O-CB 3.36Å; C352-L356 WeakPolarHBondContact O-CD1 3.24Å; C352-L356 PolarHBondContact O-N 2.96Å
353S65Low75.8Confident80 Ų8085.7 Ų85.756%0.55943%0.425SS*.Hα-helixtrans-60-38.3177.364.50000112E351 R357E351-S353 PolarHBondContact O-N 2.78Å; S353-R357 VanDerWaalsContact O-CB 3.28Å; S353-R357 WeakPolarHBondContact O-CB 3.45Å; S353-R357 VanDerWaalsContact O-CD 3.22Å; S353-R357 WeakPolarHBondContact O-CD 3.49Å; S353-R357 WeakPolarHBondContact O-CG 3.49Å; S353-R357 PolarHBondContact O-N 3.42Å
354H68.1Low74.9Confident146 Ų14690.7 Ų90.768%0.67645%0.45SS*.Hα-helixtrans-79.2-48.2176.9-86.8-64.6000113.4C352 L356 R357 T358C352-H354 VanDerWaalsContact C-N 3.27Å; C352-H354 PolarHBondContact O-N 3.26Å; H354-L356 PolarHBondContact O-N 3.14Å; H354-R357 PolarHBondContact O-N 3.25Å; H354-T358 WeakPolarHBondContact O-CG2 3.08Å; H354-T358 PolarHBondContact O-N 3.4Å; H354-T358 PolarHBondContact O-OG1 3Å
355L66.5Low73.9Confident117 Ų11796.1 Ų96.161%0.61348%0.475SS*.Hα-helixtrans-66.4-39.8-175.8-71.3-180000112.6C352 T358 L359C352-L355 HydrophobicContact CB-CB 4.03Å; L355-T358 WeakPolarHBondContact CA-OG1 3.19Å; L355-T358 PolarHBondContact O-N 3.27Å; L355-T358 PolarHBondContact O-OG1 3.01Å; L355-L359 VanDerWaalsContact O-CB 3.25Å; L355-L359 WeakPolarHBondContact O-CB 3.34Å; L355-L359 PolarHBondContact O-N 2.99Å; L355-L359 VanDerWaalsContact O-N 3.17Å
356L68.4Low72.9Confident20 Ų20101.5 Ų101.511%0.10550%0.499CS..Hα-helixtrans-64.9-43.1173.5-93.597.1000111.3I341 T342 A345 C352 H354 T358 L359 W360I341-L356 HydrophobicContact CG2-CD1 4.47Å; T342-L356 HydrophobicContact CG2-CD2 3.74Å; A345-L356 HydrophobicContact CB-CD1 4.24Å; C352-L356 HydrophobicContact CB-CD1 3.65Å; C352-L356 WeakPolarHBondContact O-CB 3.36Å; C352-L356 WeakPolarHBondContact O-CD1 3.24Å; C352-L356 PolarHBondContact O-N 2.96Å; H354-L356 PolarHBondContact O-N 3.14Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 2.96Å; L356-L359 PolarHBondContact O-N 2.89Å; L356-L359 VanDerWaalsContact O-N 3.12Å; L356-W360 HydrophobicContact CB-CD2 4.47Å; L356-W360 HydrophobicContact CB-CH2 4.38Å; L356-W360 HydrophobicContact CB-CZ2 3.92Å; L356-W360 HydrophobicContact CD2-CH2 4.2Å; L356-W360 HydrophobicContact CD2-CZ2 3.29Å; L356-W360 HydrophobicContact CG-CZ2 4.21Å; L356-W360 WeakPolarHBondContact O-CB 3.4Å; L356-W360 PolarHBondContact O-N 2.82Å
357R72.1Confident71.9Confident181 Ų181105.9 Ų105.968%0.68352%0.516SS*.Hα-helixtrans-64.9-30.4178.9-77.8178.7-176.1-139.62.1114S353 H354 L359 W360S353-R357 VanDerWaalsContact O-CB 3.28Å; S353-R357 WeakPolarHBondContact O-CB 3.45Å; S353-R357 VanDerWaalsContact O-CD 3.22Å; S353-R357 WeakPolarHBondContact O-CD 3.49Å; S353-R357 WeakPolarHBondContact O-CG 3.49Å; S353-R357 PolarHBondContact O-N 3.42Å; H354-R357 PolarHBondContact O-N 3.25Å; R357-L359 VanDerWaalsContact C-N 3.35Å; R357-W360 HydrophobicContact CG-CE3 4.24Å; R357-W360 HydrophobicContact CG-CZ3 4.25Å
358T75.4Confident70.7Confident106 Ų106110.2 Ų110.265%0.6553%0.532SS*.Hα-helixtrans-77.6-24.4174.250.50000113.1H354 L355 L356H354-T358 WeakPolarHBondContact O-CG2 3.08Å; H354-T358 PolarHBondContact O-N 3.4Å; H354-T358 PolarHBondContact O-OG1 3Å; L355-T358 WeakPolarHBondContact CA-OG1 3.19Å; L355-T358 PolarHBondContact O-N 3.27Å; L355-T358 PolarHBondContact O-OG1 3.01Å; L356-T358 VanDerWaalsContact C-N 3.31Å; L356-T358 PolarHBondContact O-N 2.96Å
359L70.9Confident69.4Low58 Ų58105.1 Ų105.130%0.30452%0.523SS..Hα-helixtrans-89.7-28.7-176.7-166.4138.3000111.9L338 I341 L355 L356 R357L338-L359 HydrophobicContact CB-CD2 3.62Å; L338-L359 HydrophobicContact CD1-CD2 4.03Å; L338-L359 HydrophobicContact CG-CD2 3.64Å; I341-L359 HydrophobicContact CD1-CD1 3.64Å; L355-L359 VanDerWaalsContact O-CB 3.25Å; L355-L359 WeakPolarHBondContact O-CB 3.34Å; L355-L359 PolarHBondContact O-N 2.99Å; L355-L359 VanDerWaalsContact O-N 3.17Å; L356-L359 PolarHBondContact O-N 2.89Å; L356-L359 VanDerWaalsContact O-N 3.12Å; R357-L359 VanDerWaalsContact C-N 3.35Å
360W68.8Low68.4Low114 Ų114102 Ų10243%0.43250%0.503SS..  trans-69.80163.5-61.1-16000111.2L268 P270 L273 L356 R357L268-W360 WeakPolarHBondContact O-CZ2 3.27Å; P270-W360 HydrophobicContact CG-CD2 4.04Å; P270-W360 HydrophobicContact CG-CE3 3.88Å; P270-W360 HydrophobicContact CG-CG 4.41Å; P270-W360 HydrophobicContact CG-CZ3 4.33Å; L273-W360 HydrophobicContact CD1-CB 3.67Å; L273-W360 HydrophobicContact CD1-CG 3.96Å; L356-W360 HydrophobicContact CB-CD2 4.47Å; L356-W360 HydrophobicContact CB-CH2 4.38Å; L356-W360 HydrophobicContact CB-CZ2 3.92Å; L356-W360 HydrophobicContact CD2-CH2 4.2Å; L356-W360 HydrophobicContact CD2-CZ2 3.29Å; L356-W360 HydrophobicContact CG-CZ2 4.21Å; L356-W360 WeakPolarHBondContact O-CB 3.4Å; L356-W360 PolarHBondContact O-N 2.82Å; R357-W360 HydrophobicContact CG-CE3 4.24Å; R357-W360 HydrophobicContact CG-CZ3 4.25Å

Retrieved 360 of 360 residues in 140.3 ms (Link to these results)