A0A096NUN9_PAPAN Loading...

Chromosome 20 open reading frame 173

AlphaFold DB , UniProt , Accession A0A096NUN9, Species PAPAN (Papio anubis, Olive baboon), Gene C20orf173, Length 202 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M58.1Low78.9Confident225 Ų225144.1 Ų144.1100%1.10865%0.652SS**  0-46.60-70.1-173.416700114R3 W4M1-R3 PolarHBondContact O-N 3.44Å; M1-W4 PolarHBondContact O-N 3.03Å
2K64.9Low79.3Confident175 Ų175142.5 Ų142.576%0.76164%0.643SS**Hα-helixtrans-59.6-36-176.9-62.5-176.7179.2-179.80116W4 I6K2-W4 PolarHBondContact O-N 3.21Å; K2-I6 VanDerWaalsContact O-CD1 3.31Å; K2-I6 WeakPolarHBondContact O-CD1 3.5Å; K2-I6 VanDerWaalsContact O-CG1 3.26Å; K2-I6 WeakPolarHBondContact O-CG1 3.3Å; K2-I6 PolarHBondContact O-N 3.45Å
3R67.6Low80Confident225 Ų225143.3 Ų143.385%0.84964%0.638SS**Hα-helixtrans-66-34.1-179.5-92.2-176.7173.9177.9-2.1114.2M1 F7M1-R3 PolarHBondContact O-N 3.44Å; R3-F7 PolarHBondContact O-N 3.03Å; R3-F7 VanDerWaalsContact O-N 3.11Å
4W81.4Confident80.5Confident193 Ų193139.9 Ų139.973%0.73163%0.626SS**Hα-helixtrans-73.2-40-178.9-173.379.8000111.2M1 K2 I6 F7 V8M1-W4 PolarHBondContact O-N 3.03Å; K2-W4 PolarHBondContact O-N 3.21Å; W4-I6 VanDerWaalsContact C-N 3.34Å; W4-I6 PolarHBondContact O-N 3.47Å; W4-F7 WeakPolarHBondContact O-CB 3.42Å; W4-F7 PolarHBondContact O-N 3.45Å; W4-F7 VanDerWaalsContact O-N 3.16Å; W4-V8 HydrophobicContact CD2-CG2 4.08Å; W4-V8 HydrophobicContact CE3-CG2 4.21Å; W4-V8 HydrophobicContact CH2-CG2 4.13Å; W4-V8 HydrophobicContact CZ2-CG2 3.99Å; W4-V8 HydrophobicContact CZ3-CG2 4.23Å; W4-V8 WeakPolarHBondContact O-CG2 3.35Å; W4-V8 PolarHBondContact O-N 3.3Å
5Q78Confident80.4Confident137 Ų137136.9 Ų136.964%0.6462%0.618SS**Hα-helixtrans-64.3-39176.3-155.5178.23.500112F7 V8 L9Q5-F7 VanDerWaalsContact C-N 3.33Å; Q5-V8 PolarHBondContact O-N 3Å; Q5-L9 WeakPolarHBondContact O-CB 3.47Å; Q5-L9 PolarHBondContact O-N 3.38Å
6I86.6Confident80.5Confident118 Ų118132.5 Ų132.561%0.60560%0.6SS**Hα-helixtrans-63.8-40.4173.8-65.8160.8000110.9K2 W4 L9 W10K2-I6 VanDerWaalsContact O-CD1 3.31Å; K2-I6 WeakPolarHBondContact O-CD1 3.5Å; K2-I6 VanDerWaalsContact O-CG1 3.26Å; K2-I6 WeakPolarHBondContact O-CG1 3.3Å; K2-I6 PolarHBondContact O-N 3.45Å; W4-I6 VanDerWaalsContact C-N 3.34Å; W4-I6 PolarHBondContact O-N 3.47Å; I6-L9 PolarHBondContact O-N 3.1Å; I6-W10 VanDerWaalsContact O-CB 3.27Å; I6-W10 WeakPolarHBondContact O-CB 3.32Å; I6-W10 PolarHBondContact O-N 3.47Å
7F83.1Confident80.5Confident120 Ų120130.3 Ų130.353%0.52659%0.594SS.*Hα-helixtrans-65.2-44.3178-175.9-99.6000112.1R3 W4 Q5 W10 V11R3-F7 PolarHBondContact O-N 3.03Å; R3-F7 VanDerWaalsContact O-N 3.11Å; W4-F7 WeakPolarHBondContact O-CB 3.42Å; W4-F7 PolarHBondContact O-N 3.45Å; W4-F7 VanDerWaalsContact O-N 3.16Å; Q5-F7 VanDerWaalsContact C-N 3.33Å; F7-W10 HydrophobicContact CD2-CE3 4.47Å; F7-W10 HydrophobicContact CE2-CE3 4.37Å; F7-W10 HydrophobicContact CE2-CZ3 4.44Å; F7-W10 PolarHBondContact O-N 3.27Å; F7-V11 HydrophobicContact CD1-CG2 4.39Å; F7-V11 HydrophobicContact CE1-CG2 4.02Å; F7-V11 HydrophobicContact CZ-CG2 4.1Å; F7-V11 WeakPolarHBondContact O-CG2 3.35Å; F7-V11 PolarHBondContact O-N 3.43Å
8V83Confident80.4Confident68 Ų68134.2 Ų134.241%0.41260%0.604SS.*Hα-helixtrans-63.4-43.4176.5175.10000110.9W4 Q5 W10 V11 F12W4-V8 HydrophobicContact CD2-CG2 4.08Å; W4-V8 HydrophobicContact CE3-CG2 4.21Å; W4-V8 HydrophobicContact CH2-CG2 4.13Å; W4-V8 HydrophobicContact CZ2-CG2 3.99Å; W4-V8 HydrophobicContact CZ3-CG2 4.23Å; W4-V8 WeakPolarHBondContact O-CG2 3.35Å; W4-V8 PolarHBondContact O-N 3.3Å; Q5-V8 PolarHBondContact O-N 3Å; V8-W10 VanDerWaalsContact C-N 3.28Å; V8-W10 PolarHBondContact O-N 3.31Å; V8-V11 PolarHBondContact O-N 3.28Å; V8-F12 WeakPolarHBondContact O-CB 3.32Å; V8-F12 PolarHBondContact O-N 2.82Å
9L86.9Confident79.8Confident107 Ų107133.1 Ų133.156%0.5660%0.603SS**Hα-helixtrans-62.5-37.8177.1-146.391.8000111.8Q5 I6 W13Q5-L9 WeakPolarHBondContact O-CB 3.47Å; Q5-L9 PolarHBondContact O-N 3.38Å; I6-L9 PolarHBondContact O-N 3.1Å; L9-W13 WeakPolarHBondContact O-CB 3.47Å; L9-W13 PolarHBondContact O-N 3.29Å
10W91Very high79.5Confident149 Ų149131.3 Ų131.356%0.56460%0.596SS**Hα-helixtrans-67.9-45.4179.3-176.569.9000112.3I6 F7 V8 F12 W13 M14I6-W10 VanDerWaalsContact O-CB 3.27Å; I6-W10 WeakPolarHBondContact O-CB 3.32Å; I6-W10 PolarHBondContact O-N 3.47Å; F7-W10 HydrophobicContact CD2-CE3 4.47Å; F7-W10 HydrophobicContact CE2-CE3 4.37Å; F7-W10 HydrophobicContact CE2-CZ3 4.44Å; F7-W10 PolarHBondContact O-N 3.27Å; V8-W10 VanDerWaalsContact C-N 3.28Å; V8-W10 PolarHBondContact O-N 3.31Å; W10-F12 VanDerWaalsContact C-N 3.34Å; W10-F12 PolarHBondContact O-N 3.15Å; W10-W13 PolarHBondContact O-N 3.46Å; W10-M14 HydrophobicContact CZ2-CE 3.98Å; W10-M14 WeakPolarHBondContact O-CG 3.38Å; W10-M14 PolarHBondContact O-N 3.44Å
11V87.1Confident78.9Confident68 Ų68128.7 Ų128.741%0.41259%0.591SS.*Hα-helixtrans-63-42.9175.9173.80000110.9F7 V8 W13 M14 L15F7-V11 HydrophobicContact CD1-CG2 4.39Å; F7-V11 HydrophobicContact CE1-CG2 4.02Å; F7-V11 HydrophobicContact CZ-CG2 4.1Å; F7-V11 WeakPolarHBondContact O-CG2 3.35Å; F7-V11 PolarHBondContact O-N 3.43Å; V8-V11 PolarHBondContact O-N 3.28Å; V11-W13 PolarHBondContact O-N 2.95Å; V11-M14 PolarHBondContact O-N 2.96Å; V11-L15 PolarHBondContact O-N 2.88Å
12F83.6Confident78.8Confident125 Ų125122.6 Ų122.655%0.54857%0.568SS.*Hα-helixtrans-61.7-42.9177.2-176.7-106.1000112.2V8 W10 M14 L15 I16V8-F12 WeakPolarHBondContact O-CB 3.32Å; V8-F12 PolarHBondContact O-N 2.82Å; W10-F12 VanDerWaalsContact C-N 3.34Å; W10-F12 PolarHBondContact O-N 3.15Å; F12-M14 PolarHBondContact O-N 2.79Å; F12-L15 WeakPolarHBondContact O-CB 3.4Å; F12-L15 PolarHBondContact O-N 3.45Å; F12-I16 HydrophobicContact CD1-CD1 3.75Å; F12-I16 HydrophobicContact CE1-CD1 3.3Å; F12-I16 HydrophobicContact CE1-CG1 4.32Å; F12-I16 HydrophobicContact CZ-CD1 3.73Å; F12-I16 HydrophobicContact CZ-CG1 4.4Å; F12-I16 PolarHBondContact O-N 2.87Å; F12-I16 VanDerWaalsContact O-N 3.08Å
13W89Confident78.3Confident153 Ų153122.5 Ų122.558%0.5856%0.564SS**Hα-helixtrans-61.3-42.9175.5-104.792.2000112.8L9 W10 V11 L15 I16 L17L9-W13 WeakPolarHBondContact O-CB 3.47Å; L9-W13 PolarHBondContact O-N 3.29Å; W10-W13 PolarHBondContact O-N 3.46Å; V11-W13 PolarHBondContact O-N 2.95Å; W13-L15 VanDerWaalsContact C-N 3.28Å; W13-L15 PolarHBondContact O-N 3.3Å; W13-I16 PolarHBondContact O-N 3.02Å; W13-L17 HydrophobicContact CE3-CD1 3.88Å; W13-L17 HydrophobicContact CZ3-CD1 4.39Å; W13-L17 WeakPolarHBondContact O-CD1 3.43Å; W13-L17 PolarHBondContact O-N 2.8Å
14M86.1Confident77.5Confident96 Ų96118.8 Ų118.847%0.47356%0.56SS.*Hα-helixtrans-63.8-35.2176.7-69.2-62175.500112.1W10 V11 F12 L17 W18W10-M14 HydrophobicContact CZ2-CE 3.98Å; W10-M14 WeakPolarHBondContact O-CG 3.38Å; W10-M14 PolarHBondContact O-N 3.44Å; V11-M14 PolarHBondContact O-N 2.96Å; F12-M14 PolarHBondContact O-N 2.79Å; M14-L17 PolarHBondContact O-N 3.38Å; M14-W18 WeakPolarHBondContact O-CB 3.19Å; M14-W18 PolarHBondContact O-N 2.78Å
15L80.1Confident75.7Confident95 Ų95115 Ų11550%0.49755%0.554SS.*Hα-helixtrans-68.3-39.2177.4-158.5121.6000112.1V11 F12 W13 W18 L19V11-L15 PolarHBondContact O-N 2.88Å; F12-L15 WeakPolarHBondContact O-CB 3.4Å; F12-L15 PolarHBondContact O-N 3.45Å; W13-L15 VanDerWaalsContact C-N 3.28Å; W13-L15 PolarHBondContact O-N 3.3Å; L15-W18 PolarHBondContact O-N 3.28Å; L15-L19 HydrophobicContact CD2-CD1 3.89Å; L15-L19 WeakPolarHBondContact O-CG 3.39Å; L15-L19 PolarHBondContact O-N 3.36Å
16I81Confident74Confident66 Ų66115.4 Ų115.434%0.33856%0.56SS.*Hα-helixtrans-64.2-46.5173.7-68.5170.1000110.8F12 W13 W18 L19 M20F12-I16 HydrophobicContact CD1-CD1 3.75Å; F12-I16 HydrophobicContact CE1-CD1 3.3Å; F12-I16 HydrophobicContact CE1-CG1 4.32Å; F12-I16 HydrophobicContact CZ-CD1 3.73Å; F12-I16 HydrophobicContact CZ-CG1 4.4Å; F12-I16 PolarHBondContact O-N 2.87Å; F12-I16 VanDerWaalsContact O-N 3.08Å; W13-I16 PolarHBondContact O-N 3.02Å; I16-W18 VanDerWaalsContact C-N 3.25Å; I16-W18 PolarHBondContact O-N 2.88Å; I16-L19 PolarHBondContact O-N 3.3Å; I16-L19 VanDerWaalsContact O-N 3.16Å; I16-M20 HydrophobicContact CG2-CG 4.46Å; I16-M20 WeakPolarHBondContact O-CG 3.31Å; I16-M20 PolarHBondContact O-N 2.98Å
17L80.4Confident71.6Confident95 Ų95114.2 Ų114.250%0.49756%0.559SS.*Hα-helixtrans-59.4-37.4177-87147000112.2W13 M14 M20 T21W13-L17 HydrophobicContact CE3-CD1 3.88Å; W13-L17 HydrophobicContact CZ3-CD1 4.39Å; W13-L17 WeakPolarHBondContact O-CD1 3.43Å; W13-L17 PolarHBondContact O-N 2.8Å; M14-L17 PolarHBondContact O-N 3.38Å; L17-M20 PolarHBondContact O-N 2.95Å; L17-T21 PolarHBondContact O-N 3.44Å; L17-T21 PolarHBondContact O-OG1 3.37Å; L17-T21 VanDerWaalsContact O-OG1 3.1Å
18W78.6Confident69.4Low201 Ų201114.1 Ų114.176%0.76157%0.57SS**Hα-helixtrans-69.7-40.3174.6-167.8-2.3000112.4M14 L15 I16 M20 T21M14-W18 WeakPolarHBondContact O-CB 3.19Å; M14-W18 PolarHBondContact O-N 2.78Å; L15-W18 PolarHBondContact O-N 3.28Å; I16-W18 VanDerWaalsContact C-N 3.25Å; I16-W18 PolarHBondContact O-N 2.88Å; W18-M20 PolarHBondContact O-N 2.82Å; W18-T21 VanDerWaalsContact CA-OG1 3.3Å; W18-T21 WeakPolarHBondContact CA-OG1 3.26Å; W18-T21 WeakPolarHBondContact O-CB 3.4Å; W18-T21 PolarHBondContact O-N 3.17Å; W18-T21 PolarHBondContact O-OG1 2.81Å
19L70.2Confident66.9Low112 Ų112119.7 Ų119.759%0.58659%0.591SS**Hα-helixtrans-65.3-27.1175.2-75.9166.5000113L15 I16 P22L15-L19 HydrophobicContact CD2-CD1 3.89Å; L15-L19 WeakPolarHBondContact O-CG 3.39Å; L15-L19 PolarHBondContact O-N 3.36Å; I16-L19 PolarHBondContact O-N 3.3Å; I16-L19 VanDerWaalsContact O-N 3.16Å; L19-P22 WeakPolarHBondContact O-CD 3.48Å; L19-P22 WeakPolarHBondContact O-CG 3.38Å
20M74Confident64.6Low97 Ų97120.1 Ų120.148%0.47860%0.604SS.*THydrogen-bonded Turntrans-85-10.1177.1-65.1-62.5-108.900113.8I16 L17 W18 Y23 L24I16-M20 HydrophobicContact CG2-CG 4.46Å; I16-M20 WeakPolarHBondContact O-CG 3.31Å; I16-M20 PolarHBondContact O-N 2.98Å; L17-M20 PolarHBondContact O-N 2.95Å; W18-M20 PolarHBondContact O-N 2.82Å; M20-Y23 WeakPolarHBondContact O-CB 3.49Å; M20-Y23 PolarHBondContact O-N 2.92Å; M20-Y23 HydrophobicContact SD-CD2 4.41Å; M20-L24 PolarHBondContact O-N 3.43Å
21T66.5Low61.6Low78 Ų78117 Ų11748%0.47961%0.609SS.*Hα-helixtrans-57.8-44.6177.8-30.10000113.3L17 W18 Y23 L24 D25L17-T21 PolarHBondContact O-N 3.44Å; L17-T21 PolarHBondContact O-OG1 3.37Å; L17-T21 VanDerWaalsContact O-OG1 3.1Å; W18-T21 VanDerWaalsContact CA-OG1 3.3Å; W18-T21 WeakPolarHBondContact CA-OG1 3.26Å; W18-T21 WeakPolarHBondContact O-CB 3.4Å; W18-T21 PolarHBondContact O-N 3.17Å; W18-T21 PolarHBondContact O-OG1 2.81Å; T21-Y23 VanDerWaalsContact C-N 3.26Å; T21-Y23 PolarHBondContact O-N 3.31Å; T21-L24 PolarHBondContact O-N 2.8Å; T21-D25 PolarHBondContact O-N 3.19Å
22P55.2Low58.8Low96 Ų96119.7 Ų119.762%0.62363%0.628SS**Hα-helixtrans-72.2-14.817428.2-36000114.3L19L19-P22 WeakPolarHBondContact O-CD 3.48Å; L19-P22 WeakPolarHBondContact O-CG 3.38Å
23Y55.1Low56.3Low173 Ų173122.6 Ų122.668%0.67864%0.643SS**Hα-helixtrans-85.7-24173.9-88.3-85.5000112.9M20 T21 L26M20-Y23 WeakPolarHBondContact O-CB 3.49Å; M20-Y23 PolarHBondContact O-N 2.92Å; M20-Y23 HydrophobicContact SD-CD2 4.41Å; T21-Y23 VanDerWaalsContact C-N 3.26Å; T21-Y23 PolarHBondContact O-N 3.31Å; Y23-L26 VanDerWaalsContact O-CD1 3.23Å; Y23-L26 WeakPolarHBondContact O-CD1 3.3Å
24L50.8Low53.6Low148 Ų148123.8 Ų123.878%0.77566%0.655SS**Hα-helixtrans-88.7-18.1177.8-71.9166.2000112.5M20 T21 L26M20-L24 PolarHBondContact O-N 3.43Å; T21-L24 PolarHBondContact O-N 2.8Å; L24-L26 PolarHBondContact O-N 3.2Å
25D43.6Very low50.8Low113 Ų113128.1 Ų128.160%0.60467%0.672SS**  trans-88.544.8171.7-158.814.7000112T21 T27T21-D25 PolarHBondContact O-N 3.19Å; D25-T27 PolarHBondContact O-N 3.4Å; D25-T27 PolarHBondContact OD1-OG1 3.06Å
26L41.4Very low48.3Very low145 Ų145132.8 Ų132.876%0.75968%0.683SS**  trans-73.863.4152.2-88.7102.1000108.1Y23 L24 P28Y23-L26 VanDerWaalsContact O-CD1 3.23Å; Y23-L26 WeakPolarHBondContact O-CD1 3.3Å; L24-L26 PolarHBondContact O-N 3.2Å; L26-P28 VanDerWaalsContact O-CD 3.26Å; L26-P28 WeakPolarHBondContact O-CD 3.46Å
27T36.2Very low45.4Very low94 Ų94137.6 Ų137.658%0.57771%0.706SS**  trans-71.9114.2153.6-52.70000105D25 E29D25-T27 PolarHBondContact O-N 3.4Å; D25-T27 PolarHBondContact OD1-OG1 3.06Å; T27-E29 VanDerWaalsContact C-N 3.26Å; T27-E29 PolarHBondContact O-N 2.85Å
28P37.6Very low42.8Very low117 Ų117141.5 Ų141.576%0.7672%0.715SS**  trans-67.594.1174.627.8-30.7000106.7L26 S30L26-P28 VanDerWaalsContact O-CD 3.26Å; L26-P28 WeakPolarHBondContact O-CD 3.46Å; P28-S30 PolarHBondContact O-N 3.24Å
29E31.1Very low40.2Very low185 Ų185140.1 Ų140.186%0.86472%0.722SS**  trans-56.7109.2166-82-167.9155.600106.7T27 A31T27-E29 VanDerWaalsContact C-N 3.26Å; T27-E29 PolarHBondContact O-N 2.85Å; E29-A31 PolarHBondContact O-N 2.97Å
30S37.6Very low38Very low117 Ų117140.6 Ų140.682%0.81873%0.729SS**  trans-59.498.2174.735.80000108.4P28P28-S30 PolarHBondContact O-N 3.24Å
31A29.7Very low35.5Very low82 Ų82143.5 Ų143.568%0.67875%0.746SS**  trans-52.8134.6172.300000110.1E29 Q33E29-A31 PolarHBondContact O-N 2.97Å; A31-Q33 PolarHBondContact O-N 3.41Å
32P27.6Very low33.5Very low126 Ų126150.3 Ų150.382%0.81876%0.762SS**SBendtrans-68.7104.9173.326.9-29.6000108.5E34P32-E34 PolarHBondContact O-N 3.1Å
33Q31.8Very low32.1Very low185 Ų185152.6 Ų152.686%0.86476%0.764SS**  trans26.383.6160.8-76.5-85.9-1400113.7A31 K35A31-Q33 PolarHBondContact O-N 3.41Å; Q33-K35 VanDerWaalsContact C-N 3.33Å; Q33-K35 PolarHBondContact O-N 3.28Å
34E31.8Very low30.6Very low178 Ų178149.3 Ų149.383%0.83277%0.766SS**  trans-55.296.5169.3-169.6-179.8-179.500109.1P32 R36P32-E34 PolarHBondContact O-N 3.1Å; E34-R36 VanDerWaalsContact C-N 3.35Å; E34-R36 PolarHBondContact O-N 3.23Å
35K27.8Very low29.6Very low188 Ų188148.2 Ų148.282%0.81776%0.761SS**  trans-5899.8168.8-167178.5-169.6176.80106.2Q33 M37Q33-K35 VanDerWaalsContact C-N 3.33Å; Q33-K35 PolarHBondContact O-N 3.28Å; K35-M37 VanDerWaalsContact C-N 3.31Å; K35-M37 PolarHBondContact O-N 2.95Å
36R26.4Very low28.8Very low193 Ų193147.9 Ų147.973%0.72877%0.766SS**  trans-43.595.3173.1-87.1-170.2179.8-168.72.2109.6E34 Y38E34-R36 VanDerWaalsContact C-N 3.35Å; E34-R36 PolarHBondContact O-N 3.23Å; R36-Y38 HydrophobicContact CB-CE2 4.23Å; R36-Y38 PolarHBondContact NH1-OH 3.16Å; R36-Y38 PolarHBondContact O-N 3.45Å
37M21.2Very low28Very low167 Ų167147.2 Ų147.282%0.82377%0.771SS**  trans-87.798.3163.3-93.7179151.200105.1K35 L39K35-M37 VanDerWaalsContact C-N 3.31Å; K35-M37 PolarHBondContact O-N 2.95Å; M37-L39 PolarHBondContact O-N 3.44Å
38Y24.2Very low27.8Very low177 Ų177152 Ų15269%0.69478%0.778SS**  trans-57.1107164.1-65.2-86.3000107.1R36 V40R36-Y38 HydrophobicContact CB-CE2 4.23Å; R36-Y38 PolarHBondContact NH1-OH 3.16Å; R36-Y38 PolarHBondContact O-N 3.45Å; Y38-V40 VanDerWaalsContact C-N 3.31Å; Y38-V40 PolarHBondContact O-N 2.97Å
39L24.7Very low27.1Very low172 Ų172152.6 Ų152.690%0.90177%0.769SS**  trans-68.994.1170.4-82.3160.6000107.2M37 L41M37-L39 PolarHBondContact O-N 3.44Å; L39-L41 PolarHBondContact O-N 2.93Å
40V24Very low26.8Very low122 Ų122148 Ų14874%0.73976%0.758SS**  trans-66.9113.2165.31760000106.7Y38 R42Y38-V40 VanDerWaalsContact C-N 3.31Å; Y38-V40 PolarHBondContact O-N 2.97Å; V40-R42 PolarHBondContact O-N 3.23Å
41L22.3Very low26.6Very low158 Ų158148.6 Ų148.683%0.82776%0.762SS**  trans-59.5101.6176.1-168.375.2000109.1L39L39-L41 PolarHBondContact O-N 2.93Å
42R23.7Very low26.5Very low220 Ų220146.8 Ų146.883%0.8375%0.75SS**  trans-111.2110.1176.3-149.7175.6-159.1-178.64.9109V40 C44V40-R42 PolarHBondContact O-N 3.23Å; R42-C44 PolarHBondContact O-N 3.11Å
43H25.5Very low26.5Very low144 Ų144151.1 Ų151.167%0.66776%0.757SS**  trans-55.3126.3173.7-93.162.9000110.8
44C24.5Very low26.3Very low104 Ų104147.7 Ų147.770%0.70375%0.751SS**  trans-129.6112.7170.4-74.60000109R42R42-C44 PolarHBondContact O-N 3.11Å
45N28.3Very low25.9Very low125 Ų125142.6 Ų142.667%0.66875%0.747SS**  trans-91.3109.4164.5-75.3-25.5000107.7
46C26.9Very low25.9Very low107 Ų107139.2 Ų139.272%0.72375%0.746SS**  trans-116.8129.9172.4-72.30000110
47P26.4Very low25.7Very low131 Ų131136 Ų13685%0.85175%0.75SS**  trans-81.5133.7169.832.2-28.9000109.7
48W31.6Very low26.1Very low194 Ų194133.4 Ų133.474%0.73575%0.748SS**  trans-95.5120.9-176.2-171.5-100.6000111.5
49F22.4Very low26.2Very low130 Ų130133 Ų13357%0.5775%0.753SS**  trans78.2101.7160.5-90-119.8000119.7T84F49-T84 HydrophobicContact CE1-CG2 4.3Å; F49-T84 HydrophobicContact CZ-CG2 4.02Å
50S24.5Very low26.5Very low89 Ų89130.6 Ų130.662%0.62275%0.745SS**  trans-137.8119.2130870000109.6G52S50-G52 PolarHBondContact O-N 3.46Å
51S32.7Very low26.6Very low129 Ų129132.6 Ų132.690%0.90275%0.751SS**  trans-68.587.3159.751.30000108
52G28.5Very low26.8Very low43 Ų43133.1 Ų133.144%0.44375%0.754SS.*SBendtrans174.2138.2-177.400000109.9S50 C54S50-G52 PolarHBondContact O-N 3.46Å; G52-C54 PolarHBondContact O-N 3.25Å
53K26.8Very low26.9Very low218 Ų218128.6 Ų128.695%0.94876%0.755SS**  trans-46.7115.1-180-68.3173.1177.4175.10109.8G55K53-G55 PolarHBondContact O-N 3.2Å; K53-G55 VanDerWaalsContact O-N 3.1Å
54C28.1Very low27.1Very low112 Ų112127.4 Ų127.476%0.75776%0.763SS**  trans-73.3101.4178.4-60.30000108.6G52G52-C54 PolarHBondContact O-N 3.25Å
55G24.4Very low27.2Very low72 Ų72127.7 Ų127.774%0.74277%0.766SS**  trans-101.8103.916200000108.4K53K53-G55 PolarHBondContact O-N 3.2Å; K53-G55 VanDerWaalsContact O-N 3.1Å
56C26.4Very low27.3Very low116 Ų116127.5 Ų127.578%0.78477%0.773SS**  trans-88.2131.6169.1-68.30000108.9S58C56-S58 PolarHBondContact O-N 2.77Å
57P23.8Very low27.4Very low126 Ų126125.6 Ų125.682%0.81877%0.772SS**  trans-67.5125165.228.7-29.1000108E59P57-E59 PolarHBondContact O-N 2.67Å
58S27.8Very low27.7Very low113 Ų113129.2 Ų129.279%0.7977%0.77SS**  trans-67108174.7163.40000109.1C56C56-S58 PolarHBondContact O-N 2.77Å
59E26.8Very low27.5Very low169 Ų169126 Ų12679%0.7977%0.772SS**  trans-165.9127.7131.2-114.1166.2160.600112.3P57P57-E59 PolarHBondContact O-N 2.67Å
60T32.3Very low28.2Very low120 Ų120123 Ų12374%0.73677%0.771SS**  trans59.893.2158.851.10000117.2
61L24.7Very low28.7Very low164 Ų164126.8 Ų126.886%0.85978%0.779SS**  179.9138107.4-88.5159000109.9C63L61-C63 PolarHBondContact O-N 3.48Å
62N26.4Very low28.6Very low169 Ų169128.8 Ų128.890%0.90477%0.771SS**  trans-56.5101.1-170.7-69.9-43.3000113.4
63C27.3Very low28.9Very low126 Ų126134.2 Ų134.285%0.85178%0.778SS**  trans-97.4113.4160.8-79.70000109.7L61 S65L61-C63 PolarHBondContact O-N 3.48Å; C63-S65 PolarHBondContact O-N 2.61Å; C63-S65 VanDerWaalsContact O-N 3.07Å
64S28.2Very low29Very low119 Ų119129.2 Ų129.283%0.83276%0.762SS**  trans-69.3102174.355.30000111
65S27.3Very low29.1Very low110 Ų110131.6 Ų131.677%0.76976%0.755SS**  trans34.790152.5173.40000117.7C63 G67C63-S65 PolarHBondContact O-N 2.61Å; C63-S65 VanDerWaalsContact O-N 3.07Å; S65-G67 PolarHBondContact O-N 2.88Å
66C29.2Very low29.2Very low120 Ų120132.1 Ų132.181%0.81174%0.74SS**  trans-67.9111.5157.2-77.20000110Y68C66-Y68 VanDerWaalsContact C-N 3.33Å; C66-Y68 PolarHBondContact O-N 2.75Å
67G30.8Very low29.7Very low67 Ų67131.6 Ų131.669%0.69173%0.73SS**  trans-72.383.617300000111.6S65 T69S65-G67 PolarHBondContact O-N 2.88Å; G67-T69 PolarHBondContact O-N 2.89Å
68Y32Very low29.8Very low207 Ų207128.4 Ų128.481%0.81271%0.714SS**  trans-72.691.3170.8-163.8-97.3000109.4C66 A70C66-Y68 VanDerWaalsContact C-N 3.33Å; C66-Y68 PolarHBondContact O-N 2.75Å; Y68-A70 HydrophobicContact CD1-CB 3.73Å; Y68-A70 HydrophobicContact CE1-CB 3.42Å; Y68-A70 VanDerWaalsContact CE1-CB 3.42Å; Y68-A70 PolarHBondContact O-N 3.35Å
69T27.5Very low29.8Very low127 Ų127126 Ų12678%0.77970%0.697SS**  trans-96.489.2167.726.30000109.2G67 H71G67-T69 PolarHBondContact O-N 2.89Å; T69-H71 PolarHBondContact O-N 3.47Å
70A36.1Very low30.1Very low67 Ų67120.1 Ų120.155%0.55467%0.674SS**THydrogen-bonded Turntrans-62.714.5-170.600000117.1Y68Y68-A70 HydrophobicContact CD1-CB 3.73Å; Y68-A70 HydrophobicContact CE1-CB 3.42Å; Y68-A70 VanDerWaalsContact CE1-CB 3.42Å; Y68-A70 PolarHBondContact O-N 3.35Å
71H34.9Very low30.1Very low168 Ų168123.7 Ų123.778%0.77867%0.674SS**THydrogen-bonded Turntrans-129.4-0.5-164.6-137.5-61.4000116.3T69T69-H71 PolarHBondContact O-N 3.47Å
72K32.2Very low30.3Very low172 Ų172122.3 Ų122.375%0.74866%0.661SS**SBendtrans-115.5-3.5-168.8-142.6171-175.6174.90116.6
73W33.6Very low30.4Very low156 Ų156117.7 Ų117.759%0.59164%0.639SS**  trans-138.836.6-172.3-62.7106.3000114.3W75 L76 D77W73-W75 AromaticContact CE3-CD1 3.94Å; W73-W75 AromaticContact CE3-NE1 3.24Å; W73-W75 HydrophobicContact CZ3-CZ2 4.24Å; W73-W75 AromaticContact CZ3-NE1 3.4Å; W73-W75 PolarHBondContact O-N 2.94Å; W73-L76 HydrophobicContact CB-CB 4.36Å; W73-L76 HydrophobicContact CB-CD1 4.44Å; W73-L76 HydrophobicContact CD2-CD1 3.96Å; W73-L76 HydrophobicContact CE3-CD1 3.39Å; W73-L76 HydrophobicContact CE3-CG 4.29Å; W73-L76 HydrophobicContact CG-CD1 4.41Å; W73-L76 HydrophobicContact CZ3-CD1 3.88Å; W73-L76 PolarHBondContact O-N 3.37Å; W73-L76 VanDerWaalsContact O-N 3.1Å; W73-D77 PolarHBondContact O-N 3.35Å
74N29.3Very low30.7Very low113 Ų113113.2 Ų113.260%0.60461%0.608SS**Hα-helixtrans-55.9-26.4176.8-63.61.4000112.8A78N74-A78 VanDerWaalsContact O-CB 3.29Å; N74-A78 WeakPolarHBondContact O-CB 3.48Å; N74-A78 PolarHBondContact O-N 3.29Å; N74-A78 VanDerWaalsContact O-N 3.11Å
75W29.9Very low30.9Very low162 Ų162109.4 Ų109.461%0.61459%0.588SS**Hα-helixtrans-77-34179.283.6-92.5000113.5W73 C79W73-W75 AromaticContact CE3-CD1 3.94Å; W73-W75 AromaticContact CE3-NE1 3.24Å; W73-W75 HydrophobicContact CZ3-CZ2 4.24Å; W73-W75 AromaticContact CZ3-NE1 3.4Å; W73-W75 PolarHBondContact O-N 2.94Å; W75-C79 VanDerWaalsContact O-CB 3.29Å; W75-C79 WeakPolarHBondContact O-CB 3.48Å; W75-C79 PolarHBondContact O-N 3.23Å
76L27.7Very low31Very low83 Ų83111.2 Ų111.244%0.43558%0.579SS.*Hα-helixtrans-71.7-39.1176.7-94.8163.3000110.6W73 C79 S80W73-L76 HydrophobicContact CB-CB 4.36Å; W73-L76 HydrophobicContact CB-CD1 4.44Å; W73-L76 HydrophobicContact CD2-CD1 3.96Å; W73-L76 HydrophobicContact CE3-CD1 3.39Å; W73-L76 HydrophobicContact CE3-CG 4.29Å; W73-L76 HydrophobicContact CG-CD1 4.41Å; W73-L76 HydrophobicContact CZ3-CD1 3.88Å; W73-L76 PolarHBondContact O-N 3.37Å; W73-L76 VanDerWaalsContact O-N 3.1Å; L76-C79 PolarHBondContact O-N 3.47Å; L76-S80 WeakPolarHBondContact O-CB 3.44Å; L76-S80 PolarHBondContact O-N 3.34Å
77D35.1Very low31.1Very low105 Ų105111.3 Ų111.356%0.56157%0.57SS**Hα-helixtrans-68.5-39.2177-154.335.7000111.1W73 R81W73-D77 PolarHBondContact O-N 3.35Å; D77-R81 VanDerWaalsContact O-CB 3.23Å; D77-R81 WeakPolarHBondContact O-CB 3.39Å; D77-R81 PolarHBondContact O-N 3.5Å
78A26.8Very low31Very low59 Ų59113.4 Ų113.449%0.48857%0.565SS.*Hα-helixtrans-65.3-40.917300000112.8N74 K82N74-A78 VanDerWaalsContact O-CB 3.29Å; N74-A78 WeakPolarHBondContact O-CB 3.48Å; N74-A78 PolarHBondContact O-N 3.29Å; N74-A78 VanDerWaalsContact O-N 3.11Å; A78-K82 WeakPolarHBondContact O-CB 3.38Å; A78-K82 PolarHBondContact O-N 3.02Å; A78-K82 VanDerWaalsContact O-N 3.1Å
79C28.4Very low30.7Very low64 Ų64112.8 Ų112.843%0.43256%0.561SS.*Hα-helixtrans-70.9-42.9179.1-159.80000111.6W75 L76 K82 T83W75-C79 VanDerWaalsContact O-CB 3.29Å; W75-C79 WeakPolarHBondContact O-CB 3.48Å; W75-C79 PolarHBondContact O-N 3.23Å; L76-C79 PolarHBondContact O-N 3.47Å; C79-K82 PolarHBondContact O-N 3.43Å; C79-T83 WeakPolarHBondContact O-CB 3.36Å; C79-T83 PolarHBondContact O-N 3.35Å; C79-T83 PolarHBondContact O-OG1 3.02Å
80S32.9Very low30.8Very low45 Ų45110.1 Ų110.132%0.31555%0.545SS..Hα-helixtrans-59.5-46.6174.31660000112.2L76 K82 T83 T84L76-S80 WeakPolarHBondContact O-CB 3.44Å; L76-S80 PolarHBondContact O-N 3.34Å; S80-K82 VanDerWaalsContact C-N 3.31Å; S80-K82 PolarHBondContact O-N 2.79Å; S80-T83 PolarHBondContact O-N 3.1Å; S80-T84 WeakPolarHBondContact O-CB 3.31Å; S80-T84 PolarHBondContact O-N 3.39Å; S80-T84 PolarHBondContact O-OG1 3.4Å
81R32.8Very low30.7Very low194 Ų194117.4 Ų117.473%0.73256%0.558SS**Hα-helixtrans-65.9-35.3178.9-157.8179.4-145.9146.12.5111.7D77 G85D77-R81 VanDerWaalsContact O-CB 3.23Å; D77-R81 WeakPolarHBondContact O-CB 3.39Å; D77-R81 PolarHBondContact O-N 3.5Å; R81-G85 PolarHBondContact O-N 3.45Å
82K28.1Very low30.7Very low136 Ų136118.1 Ų118.159%0.59156%0.562SS**Hα-helixtrans-68-46.4175.8-141.1-179.8-179.9-179.10111A78 C79 S80 G85 Y86A78-K82 WeakPolarHBondContact O-CB 3.38Å; A78-K82 PolarHBondContact O-N 3.02Å; A78-K82 VanDerWaalsContact O-N 3.1Å; C79-K82 PolarHBondContact O-N 3.43Å; S80-K82 VanDerWaalsContact C-N 3.31Å; S80-K82 PolarHBondContact O-N 2.79Å; K82-G85 PolarHBondContact O-N 3.04Å; K82-Y86 HydrophobicContact CB-CE2 4.46Å; K82-Y86 HydrophobicContact CD-CE2 4.37Å; K82-Y86 HydrophobicContact CG-CE2 3.82Å; K82-Y86 WeakPolarHBondContact O-CD2 3.27Å; K82-Y86 PolarHBondContact O-N 3.42Å
83T28.3Very low31Very low72 Ų72113.4 Ų113.444%0.44255%0.551SS.*Hα-helixtrans-68.1-39.3179.1-54.50000112.4C79 S80 G85 Y86 L87C79-T83 WeakPolarHBondContact O-CB 3.36Å; C79-T83 PolarHBondContact O-N 3.35Å; C79-T83 PolarHBondContact O-OG1 3.02Å; S80-T83 PolarHBondContact O-N 3.1Å; T83-G85 VanDerWaalsContact C-N 3.31Å; T83-G85 PolarHBondContact O-N 3.32Å; T83-Y86 PolarHBondContact O-N 3.08Å; T83-L87 HydrophobicContact CG2-CD1 4.27Å; T83-L87 WeakPolarHBondContact O-CG 3.21Å; T83-L87 PolarHBondContact O-N 3.49Å
84T33.5Very low31Very low32 Ų32112.1 Ų112.120%0.19655%0.553CS.*Hα-helixtrans-64.1-38.4171.8-54.20000110.8F49 S80 Y86 L87 L88F49-T84 HydrophobicContact CE1-CG2 4.3Å; F49-T84 HydrophobicContact CZ-CG2 4.02Å; S80-T84 WeakPolarHBondContact O-CB 3.31Å; S80-T84 PolarHBondContact O-N 3.39Å; S80-T84 PolarHBondContact O-OG1 3.4Å; T84-Y86 VanDerWaalsContact C-N 3.35Å; T84-Y86 PolarHBondContact O-N 3.23Å; T84-L87 PolarHBondContact O-N 3.35Å; T84-L88 HydrophobicContact CG2-CD1 4.09Å; T84-L88 WeakPolarHBondContact O-CB 2.99Å; T84-L88 PolarHBondContact O-N 3.06Å
85G32.4Very low31.5Very low39 Ų39110.8 Ų110.840%0.40255%0.549SS..Hα-helixtrans-61.6-37.8172.600000113.4R81 K82 T83 R89R81-G85 PolarHBondContact O-N 3.45Å; K82-G85 PolarHBondContact O-N 3.04Å; T83-G85 VanDerWaalsContact C-N 3.31Å; T83-G85 PolarHBondContact O-N 3.32Å; G85-R89 WeakPolarHBondContact O-CB 3.26Å; G85-R89 PolarHBondContact O-N 2.93Å
86Y30.1Very low32.2Very low147 Ų147106.4 Ų106.458%0.57654%0.543SS*.Hα-helixtrans-69.8-43.3173.7-69.5-67000112K82 T83 T84 R89 T90K82-Y86 HydrophobicContact CB-CE2 4.46Å; K82-Y86 HydrophobicContact CD-CE2 4.37Å; K82-Y86 HydrophobicContact CG-CE2 3.82Å; K82-Y86 WeakPolarHBondContact O-CD2 3.27Å; K82-Y86 PolarHBondContact O-N 3.42Å; T83-Y86 PolarHBondContact O-N 3.08Å; T84-Y86 VanDerWaalsContact C-N 3.35Å; T84-Y86 PolarHBondContact O-N 3.23Å; Y86-R89 PolarHBondContact O-N 3.37Å; Y86-T90 PolarHBondContact O-N 3.07Å; Y86-T90 VanDerWaalsContact O-N 3.14Å; Y86-T90 PolarHBondContact O-OG1 3.03Å
87L29.9Very low32.8Very low122 Ų122107.9 Ų107.964%0.63955%0.551SS**Hα-helixtrans-68.4-41178.5-73.3168.3000112.7T83 T84 T90T83-L87 HydrophobicContact CG2-CD1 4.27Å; T83-L87 WeakPolarHBondContact O-CG 3.21Å; T83-L87 PolarHBondContact O-N 3.49Å; T84-L87 PolarHBondContact O-N 3.35Å; L87-T90 WeakPolarHBondContact O-CB 3.2Å; L87-T90 PolarHBondContact O-N 2.99Å
88L29.8Very low33.2Very low111 Ų111106.2 Ų106.258%0.58155%0.545SS*.Hα-helixtrans-71-36.2175.8-117.589.5000112.1T84 T90 R91T84-L88 HydrophobicContact CG2-CD1 4.09Å; T84-L88 WeakPolarHBondContact O-CB 2.99Å; T84-L88 PolarHBondContact O-N 3.06Å; L88-T90 PolarHBondContact O-N 3.01Å; L88-R91 WeakPolarHBondContact O-CB 3.4Å; L88-R91 PolarHBondContact O-N 3.26Å
89R26.1Very low33.9Very low194 Ų194105.9 Ų105.973%0.73254%0.537SS*.Hα-helixtrans-67-23.2175.6-164.5173.1-148.9152.15.3112.5G85 Y86 R91 E92G85-R89 WeakPolarHBondContact O-CB 3.26Å; G85-R89 PolarHBondContact O-N 2.93Å; Y86-R89 PolarHBondContact O-N 3.37Å; R89-R91 PolarHBondContact O-N 2.76Å; R89-E92 PolarHBondContact O-N 2.82Å
90T28.6Very low34.5Very low71 Ų71104.5 Ų104.544%0.43653%0.527SS..Hα-helixtrans-69-19.3170.8-45.40000112Y86 L87 L88 M94Y86-T90 PolarHBondContact O-N 3.07Å; Y86-T90 VanDerWaalsContact O-N 3.14Å; Y86-T90 PolarHBondContact O-OG1 3.03Å; L87-T90 WeakPolarHBondContact O-CB 3.2Å; L87-T90 PolarHBondContact O-N 2.99Å; L88-T90 PolarHBondContact O-N 3.01Å; T90-M94 HydrophobicContact CG2-CE 3.97Å; T90-M94 HydrophobicContact CG2-CG 4.18Å; T90-M94 HydrophobicContact CG2-SD 4.25Å
91R33.7Very low34.8Very low220 Ų220112 Ų11283%0.8355%0.548SS*.Hα-helixtrans-79.3-25.7178-159.2-178.5-176.6-174.91.6113.6L88 R89L88-R91 WeakPolarHBondContact O-CB 3.4Å; L88-R91 PolarHBondContact O-N 3.26Å; R89-R91 PolarHBondContact O-N 2.76Å
92E36.4Very low35.1Very low183 Ų183112.8 Ų112.886%0.85555%0.552SS**Hα-helixtrans-106.1-16.1-173.9-82.4-179.8168.800115.6R89R89-E92 PolarHBondContact O-N 2.82Å
93S38.7Very low35.6Very low73 Ų73111.6 Ų111.651%0.5155%0.551SS.*  trans-160.983.6171.567.50000112T95S93-T95 PolarHBondContact O-N 3.42Å
94M32.2Very low36Very low129 Ų129111.3 Ų111.364%0.63556%0.562SS**  trans-83.179.4144.7-90.6-169.2159.900107.1T90T90-M94 HydrophobicContact CG2-CE 3.97Å; T90-M94 HydrophobicContact CG2-CG 4.18Å; T90-M94 HydrophobicContact CG2-SD 4.25Å
95T41.1Very low36.4Very low86 Ų86111.6 Ų111.653%0.52856%0.562SS.*  trans-54.8136.9154.820.30000107.2S93 D97 T98S93-T95 PolarHBondContact O-N 3.42Å; T95-D97 PolarHBondContact O-N 3.26Å; T95-T98 PolarHBondContact O-N 3.33Å
96S44.3Very low36.9Very low69 Ų69116.4 Ų116.448%0.48358%0.578SS.*THydrogen-bonded Turntrans-54.20-170.3-1770000115.8R116S96-R116 PolarHBondContact OG-NH1 3.3Å
97D40.3Very low37.7Very low115 Ų115114.9 Ų114.962%0.61559%0.589SS**THydrogen-bonded Turntrans-109-4.2-162.2-43.6-35.3000112.2T95 P100T95-D97 PolarHBondContact O-N 3.26Å; D97-P100 WeakPolarHBondContact O-CD 3.3Å
98T43Very low38.7Very low69 Ų69112 Ų11242%0.42359%0.588SS.*SBendtrans-93.2-21-176.6-390000114.2T95T95-T98 PolarHBondContact O-N 3.33Å
99V40.8Very low40Very low52 Ų52108.6 Ų108.632%0.31557%0.574SS.*Hα-helixtrans-72.3-37.3176.4-178.80000113.4W101 W102 L103 W115V99-W101 PolarHBondContact O-N 3.09Å; V99-W102 PolarHBondContact O-N 3.4Å; V99-L103 HydrophobicContact CG1-CD1 4.43Å; V99-W115 HydrophobicContact CG1-CZ2 4.5Å
100P41Very low41.3Very low35 Ų35107.2 Ų107.223%0.22758%0.576CS.*Hα-helixtrans-60.8-30.1176.1-23.433.6000113.9D97 L103 G104 M105D97-P100 WeakPolarHBondContact O-CD 3.3Å; P100-L103 PolarHBondContact O-N 2.96Å; P100-G104 PolarHBondContact O-N 3.33Å; P100-G104 VanDerWaalsContact O-N 3.09Å; P100-M105 HydrophobicContact CB-CB 4.23Å; P100-M105 PolarHBondContact O-N 2.75Å
101W39Very low42.2Very low202 Ų202108.7 Ų108.777%0.76558%0.581SS**Hα-helixtrans-70.3-36.5-176.7-172.380.4000112.9V99 L103V99-W101 PolarHBondContact O-N 3.09Å; W101-L103 VanDerWaalsContact C-N 3.33Å
102W38.9Very low43.1Very low212 Ų212100.1 Ų100.180%0.80355%0.55SS*.Hα-helixtrans-71-27.6175.8-89.190.6000113.5V99V99-W102 PolarHBondContact O-N 3.4Å
103L39.8Very low44Very low111 Ų11198.5 Ų98.558%0.58154%0.54SS*.THydrogen-bonded Turntrans-97.70.5-179.6-81.7158.7000113.4V99 P100 W101 M105V99-L103 HydrophobicContact CG1-CD1 4.43Å; P100-L103 PolarHBondContact O-N 2.96Å; W101-L103 VanDerWaalsContact C-N 3.33Å; L103-M105 HydrophobicContact CB-CG 3.93Å; L103-M105 HydrophobicContact CB-SD 3.88Å; L103-M105 HydrophobicContact CD1-SD 4.14Å; L103-M105 PolarHBondContact O-N 3.16Å
104G36.9Very low44.8Very low65 Ų6599.4 Ų99.467%0.6754%0.539SS*.THydrogen-bonded Turntrans61.231.3-177.100000113.5P100P100-G104 PolarHBondContact O-N 3.33Å; P100-G104 VanDerWaalsContact O-N 3.09Å
105M40.8Very low46Very low39 Ų3999.3 Ų99.319%0.19253%0.532CS..PPolyproline II helixtrans-88.3120.6-176.7-72171.763.400111P100 L103 L111 E112P100-M105 HydrophobicContact CB-CB 4.23Å; P100-M105 PolarHBondContact O-N 2.75Å; L103-M105 HydrophobicContact CB-CG 3.93Å; L103-M105 HydrophobicContact CB-SD 3.88Å; L103-M105 HydrophobicContact CD1-SD 4.14Å; L103-M105 PolarHBondContact O-N 3.16Å; M105-L111 HydrophobicContact CE-CB 3.86Å; M105-L111 HydrophobicContact CE-CD2 3.78Å; M105-L111 HydrophobicContact CE-CG 3.91Å; M105-L111 HydrophobicContact CG-CD2 4.3Å; M105-L111 HydrophobicContact SD-CD2 3.98Å; M105-E112 HydrophobicContact CE-CB 4.36Å
106N42.8Very low46.6Very low140 Ų140100.7 Ų100.775%0.74953%0.527SS*.PPolyproline II helixtrans-68.9130.2170.1-71-25.5000110.1G108 S109N106-G108 PolarHBondContact O-N 2.94Å; N106-S109 PolarHBondContact O-N 3.39Å; N106-S109 PolarHBondContact O-OG 3.31Å
107S46.9Very low47.2Very low115 Ų115104.7 Ų104.780%0.80454%0.536SS*.THydrogen-bonded Turntrans-57.4125.1178.461.30000110.7
108G52.3Low47.6Very low60 Ų60103.4 Ų103.462%0.61953%0.529SS*.THydrogen-bonded Turntrans107.1-4.5-179.900000115.4N106 E112N106-G108 PolarHBondContact O-N 2.94Å; G108-E112 PolarHBondContact N-OE2 3.43Å
109S56.1Low47.9Very low41 Ų41102.7 Ų102.729%0.28753%0.526SS..  trans-66.1149.817663.90000112.2N106 L111 E112 K113N106-S109 PolarHBondContact O-N 3.39Å; N106-S109 PolarHBondContact O-OG 3.31Å; S109-L111 PolarHBondContact O-N 3.06Å; S109-L111 VanDerWaalsContact O-N 3.1Å; S109-E112 VanDerWaalsContact O-CB 3.32Å; S109-E112 WeakPolarHBondContact O-CB 3.32Å; S109-E112 PolarHBondContact O-N 3Å; S109-K113 PolarHBondContact O-N 3Å
110Q53.7Low48.3Very low164 Ų164109.1 Ų109.177%0.76655%0.55SS*.Hα-helixtrans-57.5-25.6175.6-153.9178.6-0.500112K113 L114Q110-K113 WeakPolarHBondContact O-CB 3.44Å; Q110-K113 PolarHBondContact O-N 3.48Å; Q110-L114 PolarHBondContact O-N 3.3Å
111L47.7Very low48.2Very low103 Ų103113.1 Ų113.154%0.53957%0.573SS.*Hα-helixtrans-66.9-34.8174.2-155.176.9000112.7M105 S109 L114 W115M105-L111 HydrophobicContact CE-CB 3.86Å; M105-L111 HydrophobicContact CE-CD2 3.78Å; M105-L111 HydrophobicContact CE-CG 3.91Å; M105-L111 HydrophobicContact CG-CD2 4.3Å; M105-L111 HydrophobicContact SD-CD2 3.98Å; S109-L111 PolarHBondContact O-N 3.06Å; S109-L111 VanDerWaalsContact O-N 3.1Å; L111-L114 PolarHBondContact O-N 3.1Å; L111-W115 WeakPolarHBondContact O-CB 3.36Å; L111-W115 PolarHBondContact O-N 3.29Å
112E51.9Low48Very low39 Ų39107.7 Ų107.718%0.18256%0.559CS.*Hα-helixtrans-65.4-40.8171.9-168.4-163.5146.600111M105 G108 S109 W115 R116M105-E112 HydrophobicContact CE-CB 4.36Å; G108-E112 PolarHBondContact N-OE2 3.43Å; S109-E112 VanDerWaalsContact O-CB 3.32Å; S109-E112 WeakPolarHBondContact O-CB 3.32Å; S109-E112 PolarHBondContact O-N 3Å; E112-W115 PolarHBondContact O-N 3.03Å; E112-R116 WeakPolarHBondContact O-CB 3.32Å; E112-R116 WeakPolarHBondContact O-CG 3.28Å; E112-R116 PolarHBondContact O-N 3.34Å; E112-R116 IonicContact OE1-CZ 3.26Å; E112-R116 VanDerWaalsContact OE1-CZ 3.26Å; E112-R116 IonicContact OE1-NE 2.89Å; E112-R116 PolarHBondContact OE1-NE 3.46Å; E112-R116 IonicContact OE1-NH2 2.76Å; E112-R116 PolarHBondContact OE1-NH2 3.47Å
113K56.8Low47.6Very low149 Ų149102.7 Ų102.765%0.64855%0.554SS**Hα-helixtrans-64.8-41176.1-69.2-179.1179.5175.80111.4S109 Q110 K117S109-K113 PolarHBondContact O-N 3Å; Q110-K113 WeakPolarHBondContact O-CB 3.44Å; Q110-K113 PolarHBondContact O-N 3.48Å; K113-K117 PolarHBondContact O-N 2.71Å
114L53.8Low47.4Very low92 Ų92108.4 Ų108.448%0.48257%0.567SS.*Hα-helixtrans-65.1-42.6174-85.9163.9000111.8Q110 L111 K117 L118Q110-L114 PolarHBondContact O-N 3.3Å; L111-L114 PolarHBondContact O-N 3.1Å; L114-K117 PolarHBondContact O-N 3.35Å; L114-L118 WeakPolarHBondContact O-CB 3.07Å; L114-L118 WeakPolarHBondContact O-CG 3.37Å; L114-L118 PolarHBondContact O-N 3.29Å
115W57.4Low47Very low128 Ų128113.8 Ų113.849%0.48558%0.58SS.*Hα-helixtrans-64.2-41.7176-174-106.6000112.5V99 L111 E112 K117 L118 S119V99-W115 HydrophobicContact CG1-CZ2 4.5Å; L111-W115 WeakPolarHBondContact O-CB 3.36Å; L111-W115 PolarHBondContact O-N 3.29Å; E112-W115 PolarHBondContact O-N 3.03Å; W115-K117 VanDerWaalsContact C-N 3.28Å; W115-K117 PolarHBondContact O-N 3.37Å; W115-L118 PolarHBondContact O-N 2.8Å; W115-S119 VanDerWaalsContact O-CB 3.3Å; W115-S119 WeakPolarHBondContact O-CB 3.49Å; W115-S119 PolarHBondContact O-N 3.2Å; W115-S119 PolarHBondContact O-OG 3.24Å
116R54.6Low46.6Very low114 Ų114116.7 Ų116.743%0.4360%0.604SS.*Hα-helixtrans-63.8-30.8173.6-73.6-179.1-172.1-83.92.8113S96 E112 S119 K120S96-R116 PolarHBondContact OG-NH1 3.3Å; E112-R116 WeakPolarHBondContact O-CB 3.32Å; E112-R116 WeakPolarHBondContact O-CG 3.28Å; E112-R116 PolarHBondContact O-N 3.34Å; E112-R116 IonicContact OE1-CZ 3.26Å; E112-R116 VanDerWaalsContact OE1-CZ 3.26Å; E112-R116 IonicContact OE1-NE 2.89Å; E112-R116 PolarHBondContact OE1-NE 3.46Å; E112-R116 IonicContact OE1-NH2 2.76Å; E112-R116 PolarHBondContact OE1-NH2 3.47Å; R116-S119 WeakPolarHBondContact CA-OG 3.43Å; R116-S119 PolarHBondContact O-OG 3Å; R116-K120 WeakPolarHBondContact O-CG 2.98Å
117K56.5Low46.1Very low153 Ų153113.4 Ų113.467%0.66560%0.603SS**Hα-helixtrans-75.5-45.4171.7-78-174.7176.1-174.40111.5K113 L114 W115 K120 V121K113-K117 PolarHBondContact O-N 2.71Å; L114-K117 PolarHBondContact O-N 3.35Å; W115-K117 VanDerWaalsContact C-N 3.28Å; W115-K117 PolarHBondContact O-N 3.37Å; K117-K120 WeakPolarHBondContact O-CB 3.39Å; K117-K120 PolarHBondContact O-N 3.47Å; K117-V121 PolarHBondContact O-N 3.5Å
118L49.1Very low45.1Very low89 Ų89111.1 Ų111.147%0.46659%0.587SS.*Hα-helixtrans-65-41179.9-82.2161.6000112.5L114 W115 K120 V121 I122L114-L118 WeakPolarHBondContact O-CB 3.07Å; L114-L118 WeakPolarHBondContact O-CG 3.37Å; L114-L118 PolarHBondContact O-N 3.29Å; W115-L118 PolarHBondContact O-N 2.8Å; L118-K120 PolarHBondContact O-N 3.02Å; L118-K120 VanDerWaalsContact O-N 3.17Å; L118-V121 CarbonylContact O-C 3.59Å; L118-V121 PolarHBondContact O-N 2.95Å; L118-I122 VanDerWaalsContact O-CG1 3.3Å; L118-I122 WeakPolarHBondContact O-CG1 3.38Å; L118-I122 PolarHBondContact O-N 3.31Å
119S48.8Very low43.9Very low54 Ų54116.5 Ų116.538%0.37860%0.596SS.*Hα-helixtrans-64.1-15.6174.852.80000114.7W115 R116W115-S119 VanDerWaalsContact O-CB 3.3Å; W115-S119 WeakPolarHBondContact O-CB 3.49Å; W115-S119 PolarHBondContact O-N 3.2Å; W115-S119 PolarHBondContact O-OG 3.24Å; R116-S119 WeakPolarHBondContact CA-OG 3.43Å; R116-S119 PolarHBondContact O-OG 3Å
120K50Low42.6Very low186 Ų186121.2 Ų121.281%0.80961%0.611SS**Hα-helixtrans-84.9-26.4169-70.1178.7179.5-175.90112.6R116 K117 L118R116-K120 WeakPolarHBondContact O-CG 2.98Å; K117-K120 WeakPolarHBondContact O-CB 3.39Å; K117-K120 PolarHBondContact O-N 3.47Å; L118-K120 PolarHBondContact O-N 3.02Å; L118-K120 VanDerWaalsContact O-N 3.17Å
121V38.1Very low41.4Very low119 Ų119119 Ų11972%0.72161%0.605SS**Hα-helixtrans-91.1-33.6-177.2177.30000111.6K117 L118 P123K117-V121 PolarHBondContact O-N 3.5Å; L118-V121 CarbonylContact O-C 3.59Å; L118-V121 PolarHBondContact O-N 2.95Å; V121-P123 WeakPolarHBondContact O-CD 3.48Å
122I34.3Very low40.6Very low89 Ų89123 Ų12346%0.45662%0.618SS.*SBendtrans-62122.6169.6-62.5162.6000106.2L118 R124L118-I122 VanDerWaalsContact O-CG1 3.3Å; L118-I122 WeakPolarHBondContact O-CG1 3.38Å; L118-I122 PolarHBondContact O-N 3.31Å; I122-R124 PolarHBondContact O-N 3.36Å
123P30.4Very low39.5Very low107 Ų107131.2 Ų131.270%0.69565%0.649SS**PPolyproline II helixtrans-53.1120.7173.9-15.624.8000106.7V121 L125V121-P123 WeakPolarHBondContact O-CD 3.48Å; P123-L125 PolarHBondContact O-N 2.79Å
124R37.2Very low38.2Very low231 Ų231130.8 Ų130.887%0.87266%0.663SS**PPolyproline II helixtrans-49119.9159.5-72.1-171.5176.7-175.6-1.1103.9I122 S126I122-R124 PolarHBondContact O-N 3.36Å; R124-S126 PolarHBondContact O-N 3.39Å
125L28.9Very low37.1Very low178 Ų178128.3 Ų128.393%0.93266%0.659SS**  trans-59.691178.7-148.676.6000105.3P123 G127P123-L125 PolarHBondContact O-N 2.79Å; L125-G127 PolarHBondContact O-N 3.14Å
126S30.9Very low35.8Very low100 Ų100125.4 Ų125.470%0.69966%0.656SS**  trans-59.2138.2-178.1179.10000105.3R124 S128R124-S126 PolarHBondContact O-N 3.39Å; S126-S128 PolarHBondContact O-N 3.34Å
127G32.4Very low34.8Very low71 Ų71124.8 Ų124.873%0.73267%0.668SS**  trans-57.688.8173.700000109.1L125 H129L125-G127 PolarHBondContact O-N 3.14Å; G127-H129 PolarHBondContact O-N 2.66Å
128S25.8Very low33.5Very low66 Ų66120.5 Ų120.546%0.46266%0.655SS.*  trans-65.6116.415949.40000104.4S126 F130S126-S128 PolarHBondContact O-N 3.34Å; S128-F130 WeakPolarHBondContact O-CD2 3.24Å; S128-F130 PolarHBondContact O-N 2.94Å; S128-F130 WeakPolarHBondContact OG-CE2 3.37Å; S128-F130 WeakPolarHBondContact OG-CZ 3.35Å
129H28.4Very low32.8Very low174 Ų174123.8 Ų123.881%0.80667%0.672SS**  trans-45.696.2157.9-96-94.7000107.5G127 D131G127-H129 PolarHBondContact O-N 2.66Å; H129-D131 PolarHBondContact O-N 3.41Å
130F28.9Very low31.9Very low140 Ų140124.9 Ų124.961%0.61467%0.673SS**  trans-79.899.1162.7-70.9-76.4000104.1S128 F132S128-F130 WeakPolarHBondContact O-CD2 3.24Å; S128-F130 PolarHBondContact O-N 2.94Å; S128-F130 WeakPolarHBondContact OG-CE2 3.37Å; S128-F130 WeakPolarHBondContact OG-CZ 3.35Å; F130-F132 VanDerWaalsContact C-N 3.26Å; F130-F132 HydrophobicContact CB-CD1 4.11Å; F130-F132 HydrophobicContact CB-CD2 4.44Å; F130-F132 HydrophobicContact CB-CE1 3.65Å; F130-F132 HydrophobicContact CB-CE2 4.01Å; F130-F132 HydrophobicContact CB-CG 4.48Å; F130-F132 HydrophobicContact CB-CZ 3.6Å; F130-F132 HydrophobicContact CG-CE1 4.45Å; F130-F132 HydrophobicContact CG-CZ 4.48Å; F130-F132 WeakPolarHBondContact O-CD2 3.48Å; F130-F132 VanDerWaalsContact O-CE2 3.24Å; F130-F132 WeakPolarHBondContact O-CE2 2.9Å; F130-F132 WeakPolarHBondContact O-CG 3.36Å; F130-F132 PolarHBondContact O-N 2.97Å
131D27.5Very low30.9Very low117 Ų117118.4 Ų118.463%0.62666%0.659SS**  trans-65.697.7164.5-71.1-34.2000106.4H129 Y133H129-D131 PolarHBondContact O-N 3.41Å; D131-Y133 HydrophobicContact CB-CE2 4.2Å; D131-Y133 WeakPolarHBondContact O-CD2 3.46Å; D131-Y133 PolarHBondContact O-N 3.22Å
132F30.3Very low30.6Very low188 Ų188116.6 Ų116.683%0.82565%0.651SS**  trans-73.696.7-173.4-64.3-76.8000109.8F130F130-F132 VanDerWaalsContact C-N 3.26Å; F130-F132 HydrophobicContact CB-CD1 4.11Å; F130-F132 HydrophobicContact CB-CD2 4.44Å; F130-F132 HydrophobicContact CB-CE1 3.65Å; F130-F132 HydrophobicContact CB-CE2 4.01Å; F130-F132 HydrophobicContact CB-CG 4.48Å; F130-F132 HydrophobicContact CB-CZ 3.6Å; F130-F132 HydrophobicContact CG-CE1 4.45Å; F130-F132 HydrophobicContact CG-CZ 4.48Å; F130-F132 WeakPolarHBondContact O-CD2 3.48Å; F130-F132 VanDerWaalsContact O-CE2 3.24Å; F130-F132 WeakPolarHBondContact O-CE2 2.9Å; F130-F132 WeakPolarHBondContact O-CG 3.36Å; F130-F132 PolarHBondContact O-N 2.97Å
133Y28.8Very low30.5Very low211 Ų211115.9 Ų115.983%0.82765%0.652SS**  trans-76.7139.1165-68.6-84.6000110.1D131 G135D131-Y133 HydrophobicContact CB-CE2 4.2Å; D131-Y133 WeakPolarHBondContact O-CD2 3.46Å; D131-Y133 PolarHBondContact O-N 3.22Å; Y133-G135 PolarHBondContact O-N 2.99Å
134C30.8Very low30.8Very low140 Ų140120.3 Ų120.395%0.94666%0.663SS**  trans-62.2108.2176.5-170.50000109.4
135G30.6Very low30.8Very low39 Ų39114.3 Ų114.340%0.40265%0.652SS.*  trans-134.8139.9179.800000111.5Y133Y133-G135 PolarHBondContact O-N 2.99Å
136T30.4Very low31.3Very low67 Ų67109.3 Ų109.341%0.41163%0.626SS.*  trans-74.4126.5173.6-46.10000109.2
137C31.9Very low31.6Very low102 Ų102114 Ų11469%0.68964%0.636SS**  trans-104.5131.7178.7-59.80000110.5
138V30.5Very low31.9Very low63 Ų63114 Ų11438%0.38264%0.636SS.*  trans-106.8122.7172.3177.30000108.8Y158V138-Y158 HydrophobicContact CG2-CD1 4.02Å; V138-Y158 HydrophobicContact CG2-CE1 3.53Å; V138-Y158 HydrophobicContact CG2-CE2 4.16Å
139L33Very low32.5Very low158 Ų158118.4 Ų118.483%0.82765%0.648SS**EExtended strand (participates in β ladder)trans-96.7105.9173.4-173.571.9000108.8
140L32Very low33Very low77 Ų77117 Ų11740%0.40365%0.651SS.*EExtended strand (participates in β ladder)trans-95.3102.2179.6-152.179.4000109.6
141G28.1Very low33.8Very low49 Ų49113.7 Ų113.751%0.50564%0.64SS.*  trans-75.3147.516600000110.1P143G141-P143 VanDerWaalsContact C-CD 3.48Å; G141-P143 WeakPolarHBondContact O-CD 3.48Å
142C32.6Very low34.5Very low82 Ų82110.4 Ų110.455%0.55463%0.634SS**  trans-93.397.9176.5-70.90000111.4
143P32.2Very low34.9Very low74 Ų74108.9 Ų108.948%0.48163%0.634SS.*  trans-85.1145.8153.232.1-30.3000109.4G141 T145G141-P143 VanDerWaalsContact C-CD 3.48Å; G141-P143 WeakPolarHBondContact O-CD 3.48Å; P143-T145 PolarHBondContact O-N 2.95Å
144H34.9Very low35.6Very low200 Ų200102.5 Ų102.593%0.92661%0.614SS**THydrogen-bonded Turntrans-57.38.2176-98.6-78.9000115.6
145T38.5Very low36.2Very low104 Ų10497.7 Ų97.764%0.63858%0.579SS**THydrogen-bonded Turntrans-99.75.8-173.552.30000114.5P143 Q147P143-T145 PolarHBondContact O-N 2.95Å; T145-Q147 VanDerWaalsContact C-N 3.3Å; T145-Q147 PolarHBondContact O-N 2.8Å
146L39.7Very low36.9Very low74 Ų74102.7 Ų102.739%0.38760%0.596SS.*  trans-85.69.7-177.9-100.7153.5000114.9G148 F149L146-G148 PolarHBondContact O-N 2.91Å; L146-G148 VanDerWaalsContact O-N 3.1Å; L146-F149 HydrophobicContact CD2-CB 4.36Å
147Q36.9Very low37.4Very low197 Ų197107 Ų10792%0.92161%0.612SS**THydrogen-bonded Turntrans-81.191.2172.6-164.2168.421.200109.8T145T145-Q147 VanDerWaalsContact C-N 3.3Å; T145-Q147 PolarHBondContact O-N 2.8Å
148G38.2Very low37.7Very low71 Ų71105.6 Ų105.673%0.73259%0.593SS**THydrogen-bonded Turntrans133.5-6170.600000116.5L146L146-G148 PolarHBondContact O-N 2.91Å; L146-G148 VanDerWaalsContact O-N 3.1Å
149F39Very low37.8Very low160 Ų160107.7 Ų107.770%0.70261%0.607SS**  trans-84.6119.4172.7-75.3-84.2000110.1L146 L151L146-F149 HydrophobicContact CD2-CB 4.36Å; F149-L151 PolarHBondContact O-N 2.64Å
150T39Very low37.9Very low143 Ų143103.9 Ų103.988%0.87759%0.591SS**  trans-71.260.9173.3-35.50000110.4G152T150-G152 VanDerWaalsContact C-N 3.27Å
151L44.8Very low38Very low72 Ų72103.2 Ų103.238%0.37759%0.59SS.*  trans-96.634.3174.3-160.573.5000110.1F149 D154 I155F149-L151 PolarHBondContact O-N 2.64Å; L151-D154 HydrophobicContact CD1-CB 4.34Å; L151-I155 HydrophobicContact CD2-CD1 4.43Å; L151-I155 HydrophobicContact CG-CD1 4.39Å; L151-I155 HydrophobicContact CG-CG1 4.39Å; L151-I155 WeakPolarHBondContact O-CD1 3.32Å; L151-I155 WeakPolarHBondContact O-CG1 3.45Å
152G41.9Very low38.4Very low48 Ų48107.4 Ų107.450%0.49559%0.594SS.*SBendtrans-79.7-32.7178.700000112.8T150T150-G152 VanDerWaalsContact C-N 3.27Å
153N39.3Very low38.5Very low156 Ų156112.6 Ų112.683%0.83460%0.602SS**SBendtrans-96.4-10.2-167.2-69.512.9000114.7
154D42.9Very low38.5Very low77 Ų77115.3 Ų115.341%0.41261%0.612SS.*SBendtrans-100.2-6-175.3-162.435.5000112.8L151 Y158L151-D154 HydrophobicContact CD1-CB 4.34Å; D154-Y158 VanDerWaalsContact O-CE2 3.28Å; D154-Y158 WeakPolarHBondContact O-CE2 3.4Å
155I43.3Very low38.4Very low38 Ų38109.5 Ų109.520%0.19560%0.599CS.*SBendtrans-86.4-26-174.5-60.5178.2000111.8L151 Q157 V161L151-I155 HydrophobicContact CD2-CD1 4.43Å; L151-I155 HydrophobicContact CG-CD1 4.39Å; L151-I155 HydrophobicContact CG-CG1 4.39Å; L151-I155 WeakPolarHBondContact O-CD1 3.32Å; L151-I155 WeakPolarHBondContact O-CG1 3.45Å; I155-Q157 PolarHBondContact O-N 3.2Å; I155-V161 HydrophobicContact CG2-CG1 3.99Å; I155-V161 HydrophobicContact CG2-CG2 3.96Å
156D45Very low38.6Very low145 Ų145108.2 Ų108.278%0.77559%0.594SS**THydrogen-bonded Turntrans-73.5-6.4179.7-69.7-24.3000113.3Y158D156-Y158 VanDerWaalsContact C-N 3.34Å
157Q41.7Very low38.8Very low157 Ų157110.7 Ų110.773%0.73461%0.608SS**THydrogen-bonded Turntrans-85-5.9-178.8-138.7174.523.800113.7I155I155-Q157 PolarHBondContact O-N 3.2Å
158Y38.5Very low39.1Very low73 Ų73109.5 Ų109.529%0.28660%0.602SS.*SBendtrans-102.8134.6-178.1-61.4-82.5000112V138 D154 D156 V160V138-Y158 HydrophobicContact CG2-CD1 4.02Å; V138-Y158 HydrophobicContact CG2-CE1 3.53Å; V138-Y158 HydrophobicContact CG2-CE2 4.16Å; D154-Y158 VanDerWaalsContact O-CE2 3.28Å; D154-Y158 WeakPolarHBondContact O-CE2 3.4Å; D156-Y158 VanDerWaalsContact C-N 3.34Å; Y158-V160 VanDerWaalsContact C-N 3.28Å; Y158-V160 PolarHBondContact O-N 3.04Å
159P32.7Very low39.1Very low106 Ų106108.4 Ų108.469%0.68859%0.592SS**SBendtrans-69.4-22.6-175.825.3-32.6000113.8
160V33.6Very low39.4Very low79 Ų79103.9 Ų103.948%0.47958%0.58SS.*  trans-143.5122.7174.9-177.60000109.5Y158 F162Y158-V160 VanDerWaalsContact C-N 3.28Å; Y158-V160 PolarHBondContact O-N 3.04Å; V160-F162 HydrophobicContact CG1-CD2 4.06Å; V160-F162 HydrophobicContact CG1-CE2 3.59Å; V160-F162 HydrophobicContact CG1-CZ 4Å
161V35.5Very low39.3Very low63 Ų63104.8 Ų104.838%0.38257%0.567SS.*  trans-113.5113.8177.8-177.90000109I155 R163I155-V161 HydrophobicContact CG2-CG1 3.99Å; I155-V161 HydrophobicContact CG2-CG2 3.96Å; V161-R163 HydrophobicContact CG1-CG 3.93Å; V161-R163 PolarHBondContact O-N 2.82Å
162F35.1Very low39.2Very low137 Ų137107.8 Ų107.860%0.60158%0.581SS**EExtended strand (participates in β ladder)trans-86.9107.1171.6-72.7-83.4000109.3V160V160-F162 HydrophobicContact CG1-CD2 4.06Å; V160-F162 HydrophobicContact CG1-CE2 3.59Å; V160-F162 HydrophobicContact CG1-CZ 4Å
163R35.9Very low39.4Very low190 Ų190112 Ų11272%0.71759%0.587SS**EExtended strand (participates in β ladder)trans-97.4126172.7-63.7-173.4177.3179.40.2109.1V161 A165V161-R163 HydrophobicContact CG1-CG 3.93Å; V161-R163 PolarHBondContact O-N 2.82Å; R163-A165 PolarHBondContact O-N 3.43Å
164N31.4Very low39.8Very low131 Ų131108.9 Ų108.970%0.70157%0.57SS**  trans-79.3109.6164.9-129.39.6000106.9S166N164-S166 PolarHBondContact O-N 2.82Å
165A34.3Very low40.2Very low78 Ų78110.6 Ų110.665%0.64558%0.576SS**  trans-70.1100.917800000108.9R163 D167R163-A165 PolarHBondContact O-N 3.43Å; A165-D167 PolarHBondContact O-N 3.36Å
166S42.2Very low40.7Very low78 Ų78114.2 Ų114.255%0.54559%0.594SS.*  trans-75111.9167.458.30000109.6N164 Q168N164-S166 PolarHBondContact O-N 2.82Å; S166-Q168 PolarHBondContact O-N 3.48Å
167D44.2Very low41Very low125 Ų125112 Ų11267%0.66858%0.581SS**SBendtrans69.213.4138.4-44.8-26.5000121.9A165A165-D167 PolarHBondContact O-N 3.36Å
168Q42.1Very low41.6Very low172 Ų172109.6 Ų109.680%0.80457%0.573SS**SBendtrans-133.3-30.4165.3-83.2-174.1-19.700115.9S166S166-Q168 PolarHBondContact O-N 3.48Å
169G38.5Very low42.3Very low49 Ų49112 Ų11251%0.50559%0.587SS.*Hα-helixtrans-82.1-29.5-17800000114.9Q173G169-Q173 PolarHBondContact O-N 3.22Å
170S44.9Very low43.2Very low65 Ų65114.2 Ų114.246%0.45559%0.585SS.*Hα-helixtrans-73.7-29.5-177.171.30000112.7Q173 L174S170-Q173 PolarHBondContact O-N 3.01Å; S170-L174 VanDerWaalsContact O-CB 3.26Å; S170-L174 WeakPolarHBondContact O-CB 3.45Å; S170-L174 PolarHBondContact O-N 3.21Å
171W37.6Very low43.9Very low162 Ų162115.1 Ų115.161%0.61459%0.587SS**Hα-helixtrans-69.7-44177.7-77100.3000112.5Q173 L174 E175W171-Q173 VanDerWaalsContact C-N 3.28Å; W171-Q173 PolarHBondContact O-N 3.49Å; W171-L174 PolarHBondContact O-N 2.97Å; W171-E175 WeakPolarHBondContact O-CB 3.26Å; W171-E175 WeakPolarHBondContact O-CG 3.16Å; W171-E175 PolarHBondContact O-N 2.92Å
172M43.1Very low44.3Very low135 Ų135114.9 Ų114.967%0.66559%0.588SS**Hα-helixtrans-63.3-35.2174-81.5-159.385.500112.3M176M172-M176 WeakPolarHBondContact O-CB 3.36Å; M172-M176 PolarHBondContact O-N 3.41Å
173Q46.1Very low44.8Very low135 Ų135113.6 Ų113.663%0.63159%0.587SS**Hα-helixtrans-74.7-34178.6-166167.2-37.100112G169 S170 W171 L177G169-Q173 PolarHBondContact O-N 3.22Å; S170-Q173 PolarHBondContact O-N 3.01Å; W171-Q173 VanDerWaalsContact C-N 3.28Å; W171-Q173 PolarHBondContact O-N 3.49Å; Q173-L177 WeakPolarHBondContact O-CB 3.35Å; Q173-L177 PolarHBondContact O-N 2.88Å
174L47.8Very low45.2Very low91 Ų91110.3 Ų110.348%0.47658%0.584SS.*Hα-helixtrans-71.2-40.2172.7-161.282.7000111.3S170 W171 L177 L178S170-L174 VanDerWaalsContact O-CB 3.26Å; S170-L174 WeakPolarHBondContact O-CB 3.45Å; S170-L174 PolarHBondContact O-N 3.21Å; W171-L174 PolarHBondContact O-N 2.97Å; L174-L177 PolarHBondContact O-N 3.26Å; L174-L178 HydrophobicContact CD2-CD1 4.32Å; L174-L178 HydrophobicContact CG-CD1 4.15Å; L174-L178 VanDerWaalsContact O-CB 3.31Å; L174-L178 WeakPolarHBondContact O-CB 3.23Å; L174-L178 WeakPolarHBondContact O-CD1 3.46Å; L174-L178 WeakPolarHBondContact O-CG 3.3Å; L174-L178 PolarHBondContact O-N 2.97Å
175E51.4Low45.5Very low114 Ų114109 Ų10953%0.53358%0.58SS.*Hα-helixtrans-64.4-42.6173.2-81-176.715700111.6W171 L177 L178 Q179W171-E175 WeakPolarHBondContact O-CB 3.26Å; W171-E175 WeakPolarHBondContact O-CG 3.16Å; W171-E175 PolarHBondContact O-N 2.92Å; E175-L177 VanDerWaalsContact C-N 3.33Å; E175-L177 PolarHBondContact O-N 2.95Å; E175-L178 PolarHBondContact O-N 2.96Å; E175-Q179 WeakPolarHBondContact O-CB 3.09Å; E175-Q179 WeakPolarHBondContact O-CG 3.34Å; E175-Q179 PolarHBondContact O-N 3.1Å
176M52.2Low45.6Very low114 Ų114115.4 Ų115.456%0.56259%0.587SS**Hα-helixtrans-62.3-39.8172.7-102.6-17853.100112.2M172 K180M172-M176 WeakPolarHBondContact O-CB 3.36Å; M172-M176 PolarHBondContact O-N 3.41Å; M176-K180 WeakPolarHBondContact O-CB 2.94Å; M176-K180 PolarHBondContact O-N 2.72Å
177L52.7Low45.3Very low98 Ų98116.1 Ų116.151%0.51359%0.589SS.*Hα-helixtrans-67.4-40.4176-103.4156.1000111.4Q173 L174 E175 L181Q173-L177 WeakPolarHBondContact O-CB 3.35Å; Q173-L177 PolarHBondContact O-N 2.88Å; L174-L177 PolarHBondContact O-N 3.26Å; E175-L177 VanDerWaalsContact C-N 3.33Å; E175-L177 PolarHBondContact O-N 2.95Å; L177-L181 WeakPolarHBondContact O-CB 3.5Å; L177-L181 WeakPolarHBondContact O-CD1 3.29Å; L177-L181 WeakPolarHBondContact O-CG 3.38Å; L177-L181 PolarHBondContact O-N 2.96Å
178L53.6Low45Very low106 Ų106113.6 Ų113.656%0.55558%0.581SS**Hα-helixtrans-67.4-40.3176.1-83.2158.7000112L174 E175 L181 S182L174-L178 HydrophobicContact CD2-CD1 4.32Å; L174-L178 HydrophobicContact CG-CD1 4.15Å; L174-L178 VanDerWaalsContact O-CB 3.31Å; L174-L178 WeakPolarHBondContact O-CB 3.23Å; L174-L178 WeakPolarHBondContact O-CD1 3.46Å; L174-L178 WeakPolarHBondContact O-CG 3.3Å; L174-L178 PolarHBondContact O-N 2.97Å; E175-L178 PolarHBondContact O-N 2.96Å; L178-L181 PolarHBondContact O-N 3.1Å; L178-S182 PolarHBondContact O-N 2.89Å; L178-S182 PolarHBondContact O-OG 3.35Å
179Q52.8Low44.9Very low125 Ų125111 Ų11158%0.58457%0.573SS**Hα-helixtrans-64.9-44.3173.7-82.2-178.7-26.100112E175 L181 S182 D183E175-Q179 WeakPolarHBondContact O-CB 3.09Å; E175-Q179 WeakPolarHBondContact O-CG 3.34Å; E175-Q179 PolarHBondContact O-N 3.1Å; Q179-L181 PolarHBondContact O-N 3.28Å; Q179-S182 WeakPolarHBondContact CA-OG 3.49Å; Q179-S182 PolarHBondContact O-N 3.04Å; Q179-S182 VanDerWaalsContact O-N 3.15Å; Q179-S182 PolarHBondContact O-OG 2.98Å; Q179-D183 PolarHBondContact O-N 3.28Å
180K51.6Low44.9Very low152 Ų152115.7 Ų115.766%0.66159%0.586SS**Hα-helixtrans-63-31.7174.5-84-161.8171.1-166.50112.9M176 L184M176-K180 WeakPolarHBondContact O-CB 2.94Å; M176-K180 PolarHBondContact O-N 2.72Å; K180-L184 WeakPolarHBondContact O-CB 3.15Å; K180-L184 PolarHBondContact O-N 3.07Å
181L48.3Very low44.5Very low98 Ų98118.2 Ų118.251%0.51359%0.594SS.*Hα-helixtrans-76.3-33.2175-72.5167.1000111.7L177 L178 Q179 L184 V185L177-L181 WeakPolarHBondContact O-CB 3.5Å; L177-L181 WeakPolarHBondContact O-CD1 3.29Å; L177-L181 WeakPolarHBondContact O-CG 3.38Å; L177-L181 PolarHBondContact O-N 2.96Å; L178-L181 PolarHBondContact O-N 3.1Å; Q179-L181 PolarHBondContact O-N 3.28Å; L181-L184 PolarHBondContact O-N 2.85Å; L181-V185 WeakPolarHBondContact O-CG2 3.23Å; L181-V185 PolarHBondContact O-N 2.95Å; L181-V185 VanDerWaalsContact O-N 3.1Å
182S45.4Very low44.6Very low58 Ų58114.3 Ų114.341%0.40659%0.591SS.*Hα-helixtrans-70.6-38175.4620000112.9L178 Q179 L184 V185 W186L178-S182 PolarHBondContact O-N 2.89Å; L178-S182 PolarHBondContact O-OG 3.35Å; Q179-S182 WeakPolarHBondContact CA-OG 3.49Å; Q179-S182 PolarHBondContact O-N 3.04Å; Q179-S182 VanDerWaalsContact O-N 3.15Å; Q179-S182 PolarHBondContact O-OG 2.98Å; S182-L184 VanDerWaalsContact C-N 3.27Å; S182-L184 PolarHBondContact O-N 3.39Å; S182-V185 PolarHBondContact O-N 3.11Å; S182-W186 PolarHBondContact O-N 3.1Å
183D45.1Very low44.5Very low109 Ų109114.3 Ų114.358%0.58359%0.594SS**Hα-helixtrans-64.5-35.2174.6-69.9-22.3000111.4Q179 W186 T187Q179-D183 PolarHBondContact O-N 3.28Å; D183-W186 PolarHBondContact O-N 2.94Å; D183-T187 PolarHBondContact O-N 3.28Å; D183-T187 PolarHBondContact O-OG1 2.98Å
184L43.3Very low44.1Very low122 Ų122115.9 Ų115.964%0.63960%0.601SS**Hα-helixtrans-72.6-30.7177.7-148.274.9000112.8K180 L181 S182 T187K180-L184 WeakPolarHBondContact O-CB 3.15Å; K180-L184 PolarHBondContact O-N 3.07Å; L181-L184 PolarHBondContact O-N 2.85Å; S182-L184 VanDerWaalsContact C-N 3.27Å; S182-L184 PolarHBondContact O-N 3.39Å; L184-T187 PolarHBondContact O-OG1 3.49Å
185V37.6Very low43.7Very low102 Ų102118.4 Ų118.462%0.61861%0.614SS**Hα-helixtrans-73.6-36174.2167.40000110.9L181 S182 T187 S188L181-V185 WeakPolarHBondContact O-CG2 3.23Å; L181-V185 PolarHBondContact O-N 2.95Å; L181-V185 VanDerWaalsContact O-N 3.1Å; S182-V185 PolarHBondContact O-N 3.11Å; V185-T187 VanDerWaalsContact C-N 3.35Å; V185-T187 PolarHBondContact O-N 2.82Å; V185-S188 VanDerWaalsContact O-CB 3.3Å; V185-S188 WeakPolarHBondContact O-CB 3.29Å; V185-S188 PolarHBondContact O-N 3.05Å
186W36.2Very low43.2Very low213 Ų213120.3 Ų120.381%0.80763%0.627SS**Hα-helixtrans-73.9-22.7179.7-145.6-75.3000113.7S182 D183 S188S182-W186 PolarHBondContact O-N 3.1Å; D183-W186 PolarHBondContact O-N 2.94Å; W186-S188 VanDerWaalsContact C-N 3.26Å; W186-S188 PolarHBondContact O-N 3.06Å
187T36.6Very low42.7Very low94 Ų94123.2 Ų123.258%0.57764%0.639SS**THydrogen-bonded Turntrans-79.1-4.7171.151.40000114D183 L184 V185D183-T187 PolarHBondContact O-N 3.28Å; D183-T187 PolarHBondContact O-OG1 2.98Å; L184-T187 PolarHBondContact O-OG1 3.49Å; V185-T187 VanDerWaalsContact C-N 3.35Å; V185-T187 PolarHBondContact O-N 2.82Å
188S38.1Very low42.1Very low72 Ų72126.8 Ų126.850%0.50366%0.659SS.*THydrogen-bonded Turntrans-81.2-20.6179.3-177.30000113.4V185 W186 D190 L191V185-S188 VanDerWaalsContact O-CB 3.3Å; V185-S188 WeakPolarHBondContact O-CB 3.29Å; V185-S188 PolarHBondContact O-N 3.05Å; W186-S188 VanDerWaalsContact C-N 3.26Å; W186-S188 PolarHBondContact O-N 3.06Å; S188-D190 VanDerWaalsContact C-N 3.28Å; S188-L191 PolarHBondContact O-N 2.86Å
189D40.2Very low41.4Very low117 Ų117125.3 Ų125.363%0.62667%0.669SS**G310 helixtrans-77.2-18179.5-71.3-25000111.9L191D189-L191 VanDerWaalsContact C-N 3.34Å
190D38.9Very low40.7Very low148 Ų148127.7 Ų127.779%0.79169%0.685SS**G310 helixtrans-84.7-7175.5-127.912.9000113S188S188-D190 VanDerWaalsContact C-N 3.28Å
191L35.8Very low39.7Very low118 Ų118127.1 Ų127.162%0.61869%0.693SS**G310 helixtrans-112.615.2176.3-154.791000112.6S188 D189S188-L191 PolarHBondContact O-N 2.86Å; D189-L191 VanDerWaalsContact C-N 3.34Å
192S40.8Very low39.6Very low79 Ų79131.7 Ų131.755%0.55273%0.729SS**SBendtrans-97.5-17.7171.3-171.30000112.8
193D39.8Very low39.3Very low136 Ų136135.4 Ų135.473%0.72775%0.745SS**G310 helixtrans-87.3-13.4-177.8-77.2-23.5000113.7
194E38.2Very low39Very low167 Ų167136.7 Ų136.778%0.7875%0.754SS**G310 helixtrans-88.1-0.9178.6-103-169.1167.600114.9
195I38.8Very low38.8Very low144 Ų144137.6 Ų137.674%0.73876%0.76SS**G310 helixtrans-101.1-0.5-176-55.5177.7000112.7
196L41.4Very low38.9Very low155 Ų155139.6 Ų139.681%0.81277%0.768SS**SBendtrans-108.46-175.8-121.1164.5000115.8
197E41.6Very low39Very low174 Ų174135.1 Ų135.181%0.81377%0.766SS**SBendtrans-117.912.5-174.9-84.9-95.1129.200115.5
198D39.8Very low39.2Very low174 Ų174137.8 Ų137.893%0.9378%0.779SS**SBendtrans-129.192.8173.3-99.4-29.9000111.9
199G38.3Very low39.3Very low74 Ų74142.5 Ų142.576%0.76380%0.798SS**SBendtrans161.425.8167.700000118.9
200L39.3Very low39.2Very low176 Ų176144.5 Ų144.592%0.92181%0.811SS**  trans-136.1101.4160.9-95.3168.3000109.7
201V31.2Very low39.2Very low139 Ų139144.2 Ų144.284%0.84281%0.813SS**  trans-135.6140.1165178.30000107.2
202P45.8Very low39.5Very low194 Ų194146.5 Ų146.5100%1.2683%0.831SS**  trans-89.40-144.835.3-34.8000116.3

Retrieved 202 of 202 residues in 176.9 ms (Link to these results)