A0A096MMA4_PAPAN Loading...

Serine/arginine-rich splicing factor 10

AlphaFold DB (O75494), UniProt , Accession A0A096MMA4, Species PAPAN (Papio anubis, Olive baboon), Gene SRSF10, Length 262 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
1M37.5Very low56.6Low205 Ų205120.8 Ų120.8100%1.0161%0.607SS**  084.50-76.1157.7154.800109R3M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.06Å
2S43.1Very low59.5Low128 Ų128110.8 Ų110.890%0.89556%0.557SS**  trans-92.769.7177.8-53.60000109.9
3R43.2Very low61.9Low215 Ų215104.8 Ų104.881%0.81153%0.525SS*.  trans-89.217.8171.6-69.9-162.7-73.2-167.6-3.1112.3M1M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.06Å
4Y37.7Very low64Low191 Ų19197.4 Ų97.475%0.74949%0.488SS*.SBendtrans-111114.4-168-63.6-68.6000111.1
5L47.8Very low65.8Low158 Ų15898.4 Ų98.483%0.82748%0.484SS*.  trans62.782.9164-56118.8000115.8
6R50.5Low67.3Low134 Ų13496.8 Ų96.851%0.50648%0.478SS..PPolyproline II helixtrans-57.5128.9148.3-168.3177.3-161.3168.93.7106.4Q87 G88 D89R6-Q87 PolarHBondContact NH1-O 3.35Å; R6-Q87 PolarHBondContact NH2-O 2.99Å; R6-G88 VanDerWaalsContact NH2-C 3.3Å; R6-D89 IonicContact CZ-OD1 3.83Å; R6-D89 IonicContact NE-OD1 3.89Å; R6-D89 IonicContact NH2-OD1 2.9Å; R6-D89 PolarHBondContact NH2-OD1 2.8Å
7P58.4Low68.5Low100 Ų10091.3 Ų91.365%0.64945%0.451SS*.PPolyproline II helixtrans-48.8138174-25.432.7000108.9N9P7-N9 PolarHBondContact O-N 2.81Å; P7-N9 VanDerWaalsContact O-N 3.12Å
8P61.9Low69.5Low87 Ų8786.4 Ų86.457%0.56543%0.427SS*.PPolyproline II helixtrans-50.9127.9175.125.7-35.9000107.8T10 V61P8-T10 PolarHBondContact O-N 2.85Å; P8-V61 HydrophobicContact CB-CB 4.24Å; P8-V61 HydrophobicContact CB-CG1 3.81Å; P8-V61 HydrophobicContact CB-CG2 3.45Å; P8-V61 VanDerWaalsContact CB-CG2 3.45Å; P8-V61 HydrophobicContact CG-CG2 3.41Å; P8-V61 VanDerWaalsContact CG-CG2 3.41Å
9N68.6Low70.2Confident53 Ų5385.5 Ų85.528%0.28342%0.424SS..  trans-75.196.2-165.844.3-19.9000109.7P7 S11 F85P7-N9 PolarHBondContact O-N 2.81Å; P7-N9 VanDerWaalsContact O-N 3.12Å; N9-S11 PolarHBondContact O-N 2.9Å; N9-S11 VanDerWaalsContact O-N 3.15Å; N9-F85 HydrophobicContact CB-CD1 4.43Å; N9-F85 VanDerWaalsContact CG-CD1 3.44Å; N9-F85 WeakPolarHBondContact ND2-CB 3.34Å; N9-F85 WeakPolarHBondContact ND2-CD1 3.41Å; N9-F85 VanDerWaalsContact ND2-CG 3.34Å; N9-F85 WeakPolarHBondContact ND2-CG 3.45Å
10T85.1Confident70.9Confident27 Ų2788.1 Ų88.117%0.16644%0.439CS..  trans-70.7-1.1170.5670000113.1P8 F58 V61P8-T10 PolarHBondContact O-N 2.85Å; T10-F58 WeakPolarHBondContact CB-O 3.38Å; T10-F58 PolarHBondContact O-N 3.19Å; T10-F58 PolarHBondContact OG1-O 3.45Å; T10-F58 VanDerWaalsContact OG1-O 3.1Å; T10-V61 HydrophobicContact CG2-CB 4.43Å; T10-V61 HydrophobicContact CG2-CG2 3.59Å
11S88.9Confident71.4Confident31 Ų3184.2 Ų84.222%0.21742%0.421CS..EExtended strand (participates in β ladder)trans-99.3122.5-179.3-60.70000110.9N9 V56 A86N9-S11 PolarHBondContact O-N 2.9Å; N9-S11 VanDerWaalsContact O-N 3.15Å; S11-V56 CarbonylContact C-O 3.58Å; S11-V56 WeakPolarHBondContact CA-O 3.25Å; S11-A86 WeakPolarHBondContact O-CB 3.36Å; S11-A86 PolarHBondContact O-N 3.2Å
12L90.7Very high73.7Confident0 Ų082.8 Ų82.80%040%0.404CS..EExtended strand (participates in β ladder)trans-97.7139.5172.2-60.3-174.9000110.5F30 Y55 V56 F58 A64 A67 L68 I83 F85L12-F30 HydrophobicContact CD1-CD1 4.42Å; L12-F30 HydrophobicContact CD1-CE1 4.13Å; L12-Y55 VanDerWaalsContact O-CA 3.28Å; L12-Y55 WeakPolarHBondContact O-CA 3.42Å; L12-V56 PolarHBondContact N-O 2.9Å; L12-V56 PolarHBondContact O-N 3.17Å; L12-F58 HydrophobicContact CD1-CD2 4.14Å; L12-F58 HydrophobicContact CD1-CE2 3.58Å; L12-F58 HydrophobicContact CG-CD2 4.28Å; L12-F58 HydrophobicContact CG-CE2 4.16Å; L12-A64 HydrophobicContact CD1-CB 4.39Å; L12-A64 WeakPolarHBondContact CD1-O 3.28Å; L12-A64 HydrophobicContact CD2-CB 4.06Å; L12-A64 HydrophobicContact CG-CB 4.12Å; L12-A67 HydrophobicContact CD1-CB 3.93Å; L12-L68 HydrophobicContact CD2-CB 4.36Å; L12-I83 HydrophobicContact CB-CG2 3.98Å; L12-I83 HydrophobicContact CD1-CG2 3.89Å; L12-I83 HydrophobicContact CD2-CG2 4.32Å; L12-I83 HydrophobicContact CG-CG2 4.29Å; L12-F85 HydrophobicContact CD2-CD1 3.96Å; L12-F85 HydrophobicContact CD2-CE1 3.99Å
13F91.3Very high75.9Confident34 Ų3478.8 Ų78.815%0.14938%0.376CS..EExtended strand (participates in β ladder)trans-102.9115.7170.6174.2-114.8000108.9R15 F53 Y55 Q84 A86F13-R15 HydrophobicContact CE1-CB 4.09Å; F13-R15 HydrophobicContact CZ-CB 4.45Å; F13-F53 HydrophobicContact CE2-CB 3.68Å; F13-F53 AromaticContact CE2-CD2 3.66Å; F13-F53 HydrophobicContact CE2-CD2 3.66Å; F13-F53 HydrophobicContact CE2-CE2 4.47Å; F13-F53 AromaticContact CE2-CG 3.85Å; F13-F53 HydrophobicContact CE2-CG 3.85Å; F13-F53 HydrophobicContact CZ-CB 3.97Å; F13-F53 HydrophobicContact CZ-CD2 4.49Å; F13-F53 HydrophobicContact CZ-CG 4.29Å; F13-Y55 HydrophobicContact CB-CD1 4.29Å; F13-Y55 HydrophobicContact CB-CE1 4.09Å; F13-Y55 HydrophobicContact CD2-CD1 4.01Å; F13-Y55 AromaticContact CD2-CE1 3.41Å; F13-Y55 HydrophobicContact CD2-CE1 3.41Å; F13-Y55 VanDerWaalsContact CD2-CE1 3.41Å; F13-Y55 HydrophobicContact CD2-CE2 4.2Å; F13-Y55 AromaticContact CD2-CZ 3.51Å; F13-Y55 HydrophobicContact CE2-CE1 4.24Å; F13-Y55 HydrophobicContact CE2-CE2 4.39Å; F13-Y55 AromaticContact CE2-CZ 3.87Å; F13-Y55 HydrophobicContact CG-CE1 4.14Å; F13-Q84 WeakPolarHBondContact CA-O 3.47Å; F13-Q84 HydrophobicContact CD1-CB 4.46Å; F13-Q84 PolarHBondContact N-O 3.49Å; F13-Q84 PolarHBondContact O-N 3.04Å; F13-A86 HydrophobicContact CB-CB 4.4Å
14V91.2Very high78.1Confident0 Ų073.8 Ų73.80%036%0.362CS..EExtended strand (participates in β ladder)trans-102.2122.4179.6-168.80000108.4V17 F30 F53 A54 V56 I81 E82 I83V14-V17 HydrophobicContact CB-CG2 4.07Å; V14-V17 HydrophobicContact CG1-CG2 3.59Å; V14-F30 HydrophobicContact CG1-CZ 4.36Å; V14-F30 HydrophobicContact CG2-CE1 4.17Å; V14-F30 HydrophobicContact CG2-CE2 4.08Å; V14-F30 HydrophobicContact CG2-CZ 3.48Å; V14-F30 VanDerWaalsContact CG2-CZ 3.48Å; V14-F53 CarbonylContact O-C 3.48Å; V14-F53 WeakPolarHBondContact O-CA 3.32Å; V14-F53 VanDerWaalsContact O-CB 3.23Å; V14-F53 WeakPolarHBondContact O-CB 3.32Å; V14-A54 HydrophobicContact CB-CB 4.37Å; V14-A54 PolarHBondContact N-O 3.07Å; V14-A54 PolarHBondContact O-N 3.38Å; V14-V56 HydrophobicContact CG2-CG2 4.24Å; V14-I81 HydrophobicContact CG1-CB 4.03Å; V14-I81 HydrophobicContact CG1-CD1 4.16Å; V14-I81 HydrophobicContact CG1-CG2 4.24Å; V14-E82 CarbonylContact C-O 3.55Å; V14-E82 WeakPolarHBondContact CA-O 3.14Å; V14-I83 HydrophobicContact CG1-CG1 4.34Å; V14-I83 HydrophobicContact CG2-CG1 4.47Å
15R91Very high80.6Confident113 Ų11366.4 Ų66.443%0.42634%0.336SS..EExtended strand (participates in β ladder)trans-108.9158.2177.5-171.1-172.2-63.3-168.83.2110F13 V17 E82F13-R15 HydrophobicContact CE1-CB 4.09Å; F13-R15 HydrophobicContact CZ-CB 4.45Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.42Å; R15-E82 HydrophobicContact CB-CB 4.24Å; R15-E82 PolarHBondContact N-O 3.5Å; R15-E82 PolarHBondContact O-N 3.22Å
16N89.8Confident82.6Confident73 Ų7359 Ų5939%0.3930%0.296SS..SBendtrans62.635.9179.5-161.139.5000113.5G52 Q80N16-G52 PolarHBondContact N-O 2.86Å; N16-Q80 WeakPolarHBondContact CB-O 3.48Å; N16-Q80 PolarHBondContact ND2-O 3.18Å
17V88.3Confident84.5Confident3 Ų360.3 Ų60.32%0.01830%0.301CS..  trans-69.9139.5174.9-177.50000109.2V14 R15 T21 G52 A54 R79V14-V17 HydrophobicContact CB-CG2 4.07Å; V14-V17 HydrophobicContact CG1-CG2 3.59Å; R15-V17 VanDerWaalsContact C-N 3.31Å; R15-V17 PolarHBondContact O-N 3.42Å; V17-T21 HydrophobicContact CG1-CG2 3.84Å; V17-G52 PolarHBondContact N-O 2.89Å; V17-A54 HydrophobicContact CG2-CB 4.27Å; V17-R79 PolarHBondContact O-NH1 3.31Å
18A85.4Confident86.1Confident3 Ų362 Ų623%0.02530%0.295CS..  trans-67.6151.817700000111.4D20 T21 C77 R79A18-D20 PolarHBondContact O-N 3.12Å; A18-T21 WeakPolarHBondContact CB-OG1 3.47Å; A18-T21 WeakPolarHBondContact O-CB 3.34Å; A18-T21 PolarHBondContact O-N 2.92Å; A18-T21 VanDerWaalsContact O-N 3.12Å; A18-C77 HydrophobicContact CB-CB 3.56Å; A18-R79 HydrophobicContact CB-CB 4.42Å; A18-R79 HydrophobicContact CB-CG 4.15Å
19D83.5Confident87.4Confident70 Ų7059.5 Ų59.537%0.37428%0.276SS..THydrogen-bonded Turntrans-69.4-20.7-177.2-48.8-32.8000111.8P50 R79D19-P50 HydrophobicContact CB-CG 4.06Å; D19-P50 WeakPolarHBondContact O-CG 3.16Å; D19-R79 VanDerWaalsContact CG-NH1 3.27Å; D19-R79 IonicContact OD1-CZ 2.68Å; D19-R79 IonicContact OD1-NH1 3.72Å; D19-R79 PolarHBondContact OD1-NH1 3.23Å; D19-R79 IonicContact OD1-NH2 3.73Å; D19-R79 IonicContact OD2-CZ 3.81Å; D19-R79 IonicContact OD2-NH1 2.85Å; D19-R79 PolarHBondContact OD2-NH1 3.12Å; D19-R79 IonicContact OD2-NH2 3.59Å; D19-R79 PolarHBondContact OD2-NH2 3.38Å
20D83.5Confident88.4Confident136 Ų13657 Ų5773%0.72726%0.262SS*.THydrogen-bonded Turntrans-86.3-12.3177.1-61.5-37.5000113.2A18 R22A18-D20 PolarHBondContact O-N 3.12Å; D20-R22 PolarHBondContact O-N 3.46Å
21T82.5Confident88.7Confident7 Ų757.6 Ų57.64%0.04327%0.274CS..  trans-75.8120.7-176.1-55.50000110.7V17 A18 D25 L26 I76 C77V17-T21 HydrophobicContact CG1-CG2 3.84Å; A18-T21 WeakPolarHBondContact CB-OG1 3.47Å; A18-T21 WeakPolarHBondContact O-CB 3.34Å; A18-T21 PolarHBondContact O-N 2.92Å; A18-T21 VanDerWaalsContact O-N 3.12Å; T21-D25 HydrophobicContact CG2-CB 4.05Å; T21-L26 HydrophobicContact CG2-CD2 3.78Å; T21-L26 HydrophobicContact CG2-CG 3.8Å; T21-I76 HydrophobicContact CG2-CG2 4.39Å; T21-C77 PolarHBondContact OG1-SG 3.06Å
22R84.7Confident88.7Confident176 Ų17665 Ų6566%0.66430%0.297SS*.  trans-92.7166.6176.7-57.6-175.6171179.1-1.8112.3D20 E24 D25 L26D20-R22 PolarHBondContact O-N 3.46Å; R22-E24 WeakPolarHBondContact CB-OE2 3.43Å; R22-E24 PolarHBondContact O-N 3.45Å; R22-D25 PolarHBondContact N-OD2 3.37Å; R22-D25 PolarHBondContact O-N 2.89Å; R22-D25 VanDerWaalsContact O-N 3.14Å; R22-L26 PolarHBondContact O-N 3.47Å
23S89.4Confident88.7Confident44 Ų4468 Ų6831%0.30831%0.309SS..Hα-helixtrans-53.1-36.4172.630.90000112.4R27S23-R27 WeakPolarHBondContact O-CB 3.21Å; S23-R27 PolarHBondContact O-N 2.77Å
24E90.4Very high88.7Confident109 Ų10967 Ų6751%0.50931%0.308SS..Hα-helixtrans-69.9-34.3-178.3-59.868.4-134.200112R22 R27 R28R22-E24 WeakPolarHBondContact CB-OE2 3.43Å; R22-E24 PolarHBondContact O-N 3.45Å; E24-R27 PolarHBondContact O-N 3.12Å; E24-R28 WeakPolarHBondContact O-CB 3.07Å; E24-R28 PolarHBondContact O-N 3.27Å
25D89.2Confident88.7Confident37 Ų3770.2 Ų70.220%0.19833%0.329CS..Hα-helixtrans-70.5-44.3178.3-62.5-48.8000111.3T21 R22 R27 R28 E29T21-D25 HydrophobicContact CG2-CB 4.05Å; R22-D25 PolarHBondContact N-OD2 3.37Å; R22-D25 PolarHBondContact O-N 2.89Å; R22-D25 VanDerWaalsContact O-N 3.14Å; D25-R27 VanDerWaalsContact C-N 3.31Å; D25-R27 PolarHBondContact O-N 2.97Å; D25-R28 PolarHBondContact O-N 2.84Å; D25-R28 IonicContact OD1-CZ 2.75Å; D25-R28 VanDerWaalsContact OD1-CZ 3.28Å; D25-R28 IonicContact OD1-NH1 2.68Å; D25-R28 PolarHBondContact OD1-NH1 2.89Å; D25-R28 IonicContact OD1-NH2 2.86Å; D25-R28 PolarHBondContact OD1-NH2 2.87Å; D25-E29 PolarHBondContact O-N 3.15Å
26L89.7Confident88.8Confident1 Ų166.1 Ų66.11%0.00532%0.315CS..Hα-helixtrans-60.3-45.2172.1-64176.2000110.2T21 R22 R28 E29 F30 V39 V41 A54T21-L26 HydrophobicContact CG2-CD2 3.78Å; T21-L26 HydrophobicContact CG2-CG 3.8Å; R22-L26 PolarHBondContact O-N 3.47Å; L26-R28 PolarHBondContact O-N 3.14Å; L26-E29 PolarHBondContact O-N 2.75Å; L26-F30 HydrophobicContact CB-CD2 4.23Å; L26-F30 HydrophobicContact CD2-CD2 4.37Å; L26-F30 HydrophobicContact CD2-CE2 3.92Å; L26-F30 VanDerWaalsContact O-CB 3.32Å; L26-F30 WeakPolarHBondContact O-CB 3.21Å; L26-F30 VanDerWaalsContact O-CD2 3.23Å; L26-F30 WeakPolarHBondContact O-CD2 3.35Å; L26-F30 PolarHBondContact O-N 3Å; L26-V39 HydrophobicContact CB-CG1 4.22Å; L26-V39 HydrophobicContact CD1-CG1 4.34Å; L26-V41 HydrophobicContact CD1-CG2 3.93Å; L26-A54 HydrophobicContact CD1-CB 3.35Å
27R91.7Very high88.9Confident162 Ų16266.9 Ų66.961%0.61132%0.323SS*.Hα-helixtrans-59-37.5178.1-166.4176.9-178.3-146-0.7112.6S23 E24 D25 G31 I36 V39S23-R27 WeakPolarHBondContact O-CB 3.21Å; S23-R27 PolarHBondContact O-N 2.77Å; E24-R27 PolarHBondContact O-N 3.12Å; D25-R27 VanDerWaalsContact C-N 3.31Å; D25-R27 PolarHBondContact O-N 2.97Å; R27-G31 VanDerWaalsContact O-CA 3.28Å; R27-G31 WeakPolarHBondContact O-CA 3.44Å; R27-G31 PolarHBondContact O-N 2.91Å; R27-I36 HydrophobicContact CB-CD1 4.42Å; R27-I36 HydrophobicContact CG-CD1 3.92Å; R27-I36 WeakPolarHBondContact O-CD1 3.39Å; R27-V39 HydrophobicContact CB-CG2 4.23Å; R27-V39 HydrophobicContact CG-CG2 4.46Å
28R90.5Very high88.9Confident135 Ų13569.4 Ų69.451%0.50934%0.336SS..Hα-helixtrans-71.8-39.7178.1-175.9177.263.6-104.90.1113.1E24 D25 L26E24-R28 WeakPolarHBondContact O-CB 3.07Å; E24-R28 PolarHBondContact O-N 3.27Å; D25-R28 PolarHBondContact O-N 2.84Å; D25-R28 IonicContact OD1-CZ 2.75Å; D25-R28 VanDerWaalsContact OD1-CZ 3.28Å; D25-R28 IonicContact OD1-NH1 2.68Å; D25-R28 PolarHBondContact OD1-NH1 2.89Å; D25-R28 IonicContact OD1-NH2 2.86Å; D25-R28 PolarHBondContact OD1-NH2 2.87Å; L26-R28 PolarHBondContact O-N 3.14Å
29E89.4Confident89.2Confident36 Ų3670.5 Ų70.517%0.16834%0.342CS..Hα-helixtrans-73.5-47.5178.7-71.1-60.7129.600111.7D25 L26 K74 I76D25-E29 PolarHBondContact O-N 3.15Å; L26-E29 PolarHBondContact O-N 2.75Å; E29-K74 IonicContact OE2-NZ 2.77Å; E29-K74 PolarHBondContact OE2-NZ 2.68Å; E29-I76 HydrophobicContact CG-CD1 4.36Å
30F90.6Very high89.5Confident0 Ų069.1 Ų69.10%033%0.332CS..Hα-helixtrans-74.2-28.4180-75.8-91.7000112.4L12 V14 L26 R32 Y33 I36 V56 F58 A67 L71 I81 I83L12-F30 HydrophobicContact CD1-CD1 4.42Å; L12-F30 HydrophobicContact CD1-CE1 4.13Å; V14-F30 HydrophobicContact CG1-CZ 4.36Å; V14-F30 HydrophobicContact CG2-CE1 4.17Å; V14-F30 HydrophobicContact CG2-CE2 4.08Å; V14-F30 HydrophobicContact CG2-CZ 3.48Å; V14-F30 VanDerWaalsContact CG2-CZ 3.48Å; L26-F30 HydrophobicContact CB-CD2 4.23Å; L26-F30 HydrophobicContact CD2-CD2 4.37Å; L26-F30 HydrophobicContact CD2-CE2 3.92Å; L26-F30 VanDerWaalsContact O-CB 3.32Å; L26-F30 WeakPolarHBondContact O-CB 3.21Å; L26-F30 VanDerWaalsContact O-CD2 3.23Å; L26-F30 WeakPolarHBondContact O-CD2 3.35Å; L26-F30 PolarHBondContact O-N 3Å; F30-R32 PolarHBondContact O-N 2.92Å; F30-R32 VanDerWaalsContact O-N 3.1Å; F30-Y33 PolarHBondContact O-N 3.1Å; F30-Y33 VanDerWaalsContact O-N 3.14Å; F30-I36 HydrophobicContact CB-CD1 3.73Å; F30-V56 HydrophobicContact CB-CG1 4.12Å; F30-V56 HydrophobicContact CD1-CG1 4.27Å; F30-V56 HydrophobicContact CD1-CG2 4.41Å; F30-V56 HydrophobicContact CD2-CG2 4.15Å; F30-V56 HydrophobicContact CE2-CG2 4.33Å; F30-V56 HydrophobicContact CG-CG1 4.19Å; F30-V56 HydrophobicContact CG-CG2 4.21Å; F30-F58 HydrophobicContact CB-CZ 3.9Å; F30-F58 HydrophobicContact CD1-CE2 4.03Å; F30-F58 AromaticContact CD1-CZ 3.88Å; F30-F58 HydrophobicContact CD1-CZ 3.88Å; F30-F58 HydrophobicContact CG-CZ 4.39Å; F30-A67 HydrophobicContact CD1-CB 4.22Å; F30-L71 HydrophobicContact CD1-CD1 3.54Å; F30-L71 HydrophobicContact CD2-CD1 4.17Å; F30-L71 HydrophobicContact CE1-CD1 3.59Å; F30-L71 HydrophobicContact CE2-CD1 4.21Å; F30-L71 HydrophobicContact CG-CD1 3.85Å; F30-L71 HydrophobicContact CZ-CD1 3.93Å; F30-I81 HydrophobicContact CZ-CD1 4.27Å; F30-I83 HydrophobicContact CE1-CD1 3.7Å; F30-I83 HydrophobicContact CZ-CD1 3.65Å; F30-I83 HydrophobicContact CZ-CG1 4.23Å
31G90.5Very high89.8Confident40 Ų4064 Ų6441%0.41231%0.305SS..THydrogen-bonded Turntrans-69.6-7.4-178.300000114.2R27 Y33R27-G31 VanDerWaalsContact O-CA 3.28Å; R27-G31 WeakPolarHBondContact O-CA 3.44Å; R27-G31 PolarHBondContact O-N 2.91Å; G31-Y33 VanDerWaalsContact C-N 3.3Å
32R90Very high89.9Confident186 Ų18663.7 Ų63.770%0.70230%0.304SS*.THydrogen-bonded Turntrans-73-23.2172.6-66177.7179.8-1143.3112.9F30F30-R32 PolarHBondContact O-N 2.92Å; F30-R32 VanDerWaalsContact O-N 3.1Å
33Y90.5Very high89.9Confident63 Ų6360.3 Ų60.325%0.24730%0.298CS..THydrogen-bonded Turntrans-94.3-31.5-176.4-60.9-83.8000111.9F30 G31 D66 A67 N70 L71F30-Y33 PolarHBondContact O-N 3.1Å; F30-Y33 VanDerWaalsContact O-N 3.14Å; G31-Y33 VanDerWaalsContact C-N 3.3Å; Y33-D66 HydrophobicContact CD1-CB 4.42Å; Y33-A67 HydrophobicContact CD2-CB 4.03Å; Y33-A67 HydrophobicContact CG-CB 3.86Å; Y33-N70 HydrophobicContact CD1-CB 4.4Å; Y33-N70 HydrophobicContact CE1-CB 3.37Å; Y33-N70 WeakPolarHBondContact OH-CB 3.47Å; Y33-L71 HydrophobicContact CD2-CD1 3.82Å; Y33-L71 HydrophobicContact CD2-CG 4.18Å; Y33-L71 HydrophobicContact CE2-CD1 3.41Å; Y33-L71 VanDerWaalsContact CE2-CD1 3.41Å; Y33-L71 HydrophobicContact CE2-CD2 3.63Å; Y33-L71 HydrophobicContact CE2-CG 3.34Å; Y33-L71 WeakPolarHBondContact OH-CD2 3.21Å
34G90.7Very high89.5Confident13 Ų1359.6 Ų59.613%0.13429%0.291CS..SBendtrans-179.8174.9177.100000114.1I36G34-I36 PolarHBondContact O-N 3.27Å
35P92.3Very high88.6Confident67 Ų6762.3 Ų62.344%0.43530%0.301SS..  trans-61.4127.6173.924.9-34.3000112.1E59 D63P35-E59 HydrophobicContact CB-CB 4.36Å; P35-E59 HydrophobicContact CG-CB 3.94Å; P35-E59 WeakPolarHBondContact CG-OE2 3.4Å; P35-E59 PolarHBondContact O-N 2.83Å; P35-E59 VanDerWaalsContact O-N 3.12Å; P35-D63 WeakPolarHBondContact CD-OD2 3.48Å
36I92.1Very high88.1Confident28 Ų2869.1 Ų69.114%0.14433%0.326CS..EExtended strand (participates in β ladder)trans-99.5126.2178.5-59168.1000109.2R27 F30 G34 V39 V56 Q57 F58R27-I36 HydrophobicContact CB-CD1 4.42Å; R27-I36 HydrophobicContact CG-CD1 3.92Å; R27-I36 WeakPolarHBondContact O-CD1 3.39Å; F30-I36 HydrophobicContact CB-CD1 3.73Å; G34-I36 PolarHBondContact O-N 3.27Å; I36-V39 HydrophobicContact CG2-CG2 3.62Å; I36-V56 HydrophobicContact CD1-CG1 4.31Å; I36-V56 HydrophobicContact CG1-CG1 4.29Å; I36-V56 HydrophobicContact CG2-CG1 3.95Å; I36-Q57 CarbonylContact C-O 3.57Å; I36-Q57 WeakPolarHBondContact CG2-O 3.32Å; I36-F58 HydrophobicContact CG1-CD1 4.28Å; I36-F58 HydrophobicContact CG1-CE1 3.96Å; I36-F58 HydrophobicContact CG1-CZ 4.45Å
37V91.2Very high87.7Confident89 Ų8973 Ų7354%0.53935%0.35SS..EExtended strand (participates in β ladder)trans-78.3-49.7176177.50000111Q57 E59V37-Q57 HydrophobicContact CB-CB 4.34Å; V37-Q57 HydrophobicContact CB-CG 4.09Å; V37-Q57 PolarHBondContact N-O 2.95Å; V37-E59 HydrophobicContact CG2-CB 4.02Å
38D89.5Confident87Confident55 Ų5575.2 Ų75.229%0.29436%0.358SS..EExtended strand (participates in β ladder)trans-150148.1-176.1-16925.3000111.6Q57 R90D38-Q57 HydrophobicContact CB-CB 4.28Å; D38-Q57 PolarHBondContact N-O 2.78Å; D38-Q57 PolarHBondContact O-N 2.73Å; D38-R90 IonicContact OD2-CZ 2.8Å; D38-R90 IonicContact OD2-NH1 3.28Å; D38-R90 PolarHBondContact OD2-NH1 3.12Å
39V91.4Very high86.5Confident26 Ų2676.7 Ų76.716%0.15836%0.364CS..EExtended strand (participates in β ladder)trans-128.4116.4172.7-177.80000108.1L26 R27 I36 V41 Y55L26-V39 HydrophobicContact CB-CG1 4.22Å; L26-V39 HydrophobicContact CD1-CG1 4.34Å; R27-V39 HydrophobicContact CB-CG2 4.23Å; R27-V39 HydrophobicContact CG-CG2 4.46Å; I36-V39 HydrophobicContact CG2-CG2 3.62Å; V39-V41 HydrophobicContact CG1-CG2 4.38Å; V39-Y55 WeakPolarHBondContact CA-O 3.47Å
40Y89Confident86.2Confident41 Ų4176.2 Ų76.216%0.16136%0.364CS..EExtended strand (participates in β ladder)trans-118.7118.1-178.1-179-128.7000110.9P42 A54 Y55 R90Y40-P42 HydrophobicContact CD1-CG 3.85Å; Y40-P42 HydrophobicContact CE1-CB 4.41Å; Y40-P42 HydrophobicContact CE1-CG 3.47Å; Y40-P42 VanDerWaalsContact CE1-CG 3.47Å; Y40-P42 WeakPolarHBondContact O-CD 3.39Å; Y40-A54 CarbonylContact O-C 3.57Å; Y40-A54 WeakPolarHBondContact O-CA 3.35Å; Y40-Y55 HydrophobicContact CD1-CD2 4.03Å; Y40-Y55 PolarHBondContact N-O 2.82Å; Y40-Y55 PolarHBondContact O-N 2.76Å; Y40-R90 HydrophobicContact CD1-CG 4.4Å
41V89.5Confident85.7Confident28 Ų2880.4 Ų80.417%0.1738%0.379CS..  trans-114.599.7176.9-173.50000108.9L26 V39 L43 P50 A54L26-V41 HydrophobicContact CD1-CG2 3.93Å; V39-V41 HydrophobicContact CG1-CG2 4.38Å; V41-L43 PolarHBondContact O-N 2.84Å; V41-P50 HydrophobicContact CG1-CB 4.25Å; V41-A54 HydrophobicContact CG2-CB 3.95Å
42P84.9Confident85.5Confident2 Ų279.2 Ų79.21%0.01337%0.367CS..PPolyproline II helixtrans-65.8119.8178.1-25.838.7000111.6Y40 R51 F53 Y55 M96Y40-P42 HydrophobicContact CD1-CG 3.85Å; Y40-P42 HydrophobicContact CE1-CB 4.41Å; Y40-P42 HydrophobicContact CE1-CG 3.47Å; Y40-P42 VanDerWaalsContact CE1-CG 3.47Å; Y40-P42 WeakPolarHBondContact O-CD 3.39Å; P42-R51 WeakPolarHBondContact O-CG 3.42Å; P42-R51 PolarHBondContact O-N 2.9Å; P42-F53 HydrophobicContact CB-CE2 3.92Å; P42-F53 HydrophobicContact CB-CZ 4.14Å; P42-F53 HydrophobicContact CG-CD2 4.16Å; P42-F53 HydrophobicContact CG-CE2 3.58Å; P42-F53 HydrophobicContact CG-CZ 4.29Å; P42-Y55 HydrophobicContact CG-CD2 4.34Å; P42-Y55 HydrophobicContact CG-CE2 4.28Å; P42-M96 HydrophobicContact CB-CE 3.89Å; P42-M96 HydrophobicContact CB-SD 4.29Å; P42-M96 HydrophobicContact CG-CE 4.39Å; P42-M96 HydrophobicContact CG-SD 4.49Å
43L85.1Confident85.5Confident104 Ų10471.9 Ų71.955%0.54534%0.34SS..BIsolated β-bridgetrans-86.8144.8169.8-56.4175.6000109.4V41 P50V41-L43 PolarHBondContact O-N 2.84Å; L43-P50 HydrophobicContact CD2-CB 4.02Å
44D81.2Confident85.5Confident29 Ų2968.9 Ų68.916%0.15533%0.329CS..PPolyproline II helixtrans-64.1135.4167.7174.430.3000109.7Y46 T47 R48 R49 R51D44-Y46 VanDerWaalsContact C-N 3.31Å; D44-Y46 PolarHBondContact O-N 2.86Å; D44-Y46 PolarHBondContact OD1-N 2.88Å; D44-T47 WeakPolarHBondContact CB-OG1 3.16Å; D44-T47 WeakPolarHBondContact OD2-CB 3.25Å; D44-T47 WeakPolarHBondContact OD2-CG2 3.34Å; D44-T47 PolarHBondContact OD2-N 3.43Å; D44-T47 PolarHBondContact OD2-OG1 3.1Å; D44-R48 WeakPolarHBondContact O-CA 3.43Å; D44-R48 PolarHBondContact O-N 3.23Å; D44-R49 PolarHBondContact N-O 2.76Å; D44-R51 HydrophobicContact CB-CG 4.08Å
45F72.6Confident85.5Confident166 Ų16672.2 Ų72.273%0.72834%0.338SS*.THydrogen-bonded Turntrans-66.2-35-176.5-178.3-95.3000112
46Y77.2Confident85.5Confident181 Ų18169 Ų6971%0.7132%0.317SS*.THydrogen-bonded Turntrans-86.4-51.7-174.3-61.5-79.6000112.1D44D44-Y46 VanDerWaalsContact C-N 3.31Å; D44-Y46 PolarHBondContact O-N 2.86Å; D44-Y46 PolarHBondContact OD1-N 2.88Å
47T81.5Confident85.4Confident83 Ų8371.2 Ų71.251%0.50933%0.326SS..THydrogen-bonded Turntrans-87.2-12.4-175.762.30000113.7D44 R49D44-T47 WeakPolarHBondContact CB-OG1 3.16Å; D44-T47 WeakPolarHBondContact OD2-CB 3.25Å; D44-T47 WeakPolarHBondContact OD2-CG2 3.34Å; D44-T47 PolarHBondContact OD2-N 3.43Å; D44-T47 PolarHBondContact OD2-OG1 3.1Å; T47-R49 PolarHBondContact O-N 3.42Å; T47-R49 PolarHBondContact OG1-N 3.01Å
48R77.7Confident85.5Confident207 Ų20767 Ų6778%0.78130%0.301SS*.  trans53.315.9-168.8-59.8-146.8-176.9-142.45.8114.5D44D44-R48 WeakPolarHBondContact O-CA 3.43Å; D44-R48 PolarHBondContact O-N 3.23Å
49R80.2Confident85.5Confident167 Ų16770.7 Ų70.763%0.6332%0.316SS*.  trans-85.5147175-65.3-176.5178.4-146-0.7109.6D44 T47 R51D44-R49 PolarHBondContact N-O 2.76Å; T47-R49 PolarHBondContact O-N 3.42Å; T47-R49 PolarHBondContact OG1-N 3.01Å; R49-R51 PolarHBondContact O-N 3.15Å
50P82Confident85.4Confident26 Ų2672.6 Ų72.617%0.16933%0.326CS..BIsolated β-bridgetrans-60.3139.8171.628.2-35.7000109.7D19 V41 L43 G52D19-P50 HydrophobicContact CB-CG 4.06Å; D19-P50 WeakPolarHBondContact O-CG 3.16Å; V41-P50 HydrophobicContact CG1-CB 4.25Å; L43-P50 HydrophobicContact CD2-CB 4.02Å; P50-G52 PolarHBondContact O-N 3.39Å
51R80.6Confident85.4Confident87 Ų8772 Ų7233%0.32833%0.326SS..  trans-75.29.8-177.1-63.6175.565.2138.311.7113.6P42 D44 R49 F53 E100P42-R51 WeakPolarHBondContact O-CG 3.42Å; P42-R51 PolarHBondContact O-N 2.9Å; D44-R51 HydrophobicContact CB-CG 4.08Å; R49-R51 PolarHBondContact O-N 3.15Å; R51-F53 VanDerWaalsContact C-N 3.31Å; R51-F53 HydrophobicContact CB-CD1 3.62Å; R51-F53 HydrophobicContact CB-CE1 3.27Å; R51-F53 HydrophobicContact CB-CZ 4.01Å; R51-F53 HydrophobicContact CG-CE1 4.15Å; R51-F53 WeakPolarHBondContact O-CD1 3.18Å; R51-E100 IonicContact CZ-OE1 3.04Å; R51-E100 IonicContact CZ-OE2 3.69Å; R51-E100 VanDerWaalsContact NH1-CD 3.3Å; R51-E100 IonicContact NH1-OE1 3.86Å; R51-E100 PolarHBondContact NH1-OE1 3.03Å; R51-E100 IonicContact NH1-OE2 2.84Å; R51-E100 PolarHBondContact NH1-OE2 3.11Å; R51-E100 IonicContact NH2-OE1 3.06Å; R51-E100 PolarHBondContact NH2-OE1 3.31Å; R51-E100 IonicContact NH2-OE2 3.41Å
52G86.7Confident85.4Confident15 Ų1578.3 Ų78.316%0.15535%0.347CS..SBendtrans72.819-17400000114.3N16 V17 P50N16-G52 PolarHBondContact N-O 2.86Å; V17-G52 PolarHBondContact N-O 2.89Å; P50-G52 PolarHBondContact O-N 3.39Å
53F90Very high85.7Confident33 Ų3379.4 Ų79.415%0.14535%0.353CS..EExtended strand (participates in β ladder)trans-143.7155.4173.164.9-93.7000112.7F13 V14 P42 R51 Y55 M96F13-F53 HydrophobicContact CE2-CB 3.68Å; F13-F53 AromaticContact CE2-CD2 3.66Å; F13-F53 HydrophobicContact CE2-CD2 3.66Å; F13-F53 HydrophobicContact CE2-CE2 4.47Å; F13-F53 AromaticContact CE2-CG 3.85Å; F13-F53 HydrophobicContact CE2-CG 3.85Å; F13-F53 HydrophobicContact CZ-CB 3.97Å; F13-F53 HydrophobicContact CZ-CD2 4.49Å; F13-F53 HydrophobicContact CZ-CG 4.29Å; V14-F53 CarbonylContact O-C 3.48Å; V14-F53 WeakPolarHBondContact O-CA 3.32Å; V14-F53 VanDerWaalsContact O-CB 3.23Å; V14-F53 WeakPolarHBondContact O-CB 3.32Å; P42-F53 HydrophobicContact CB-CE2 3.92Å; P42-F53 HydrophobicContact CB-CZ 4.14Å; P42-F53 HydrophobicContact CG-CD2 4.16Å; P42-F53 HydrophobicContact CG-CE2 3.58Å; P42-F53 HydrophobicContact CG-CZ 4.29Å; R51-F53 VanDerWaalsContact C-N 3.31Å; R51-F53 HydrophobicContact CB-CD1 3.62Å; R51-F53 HydrophobicContact CB-CE1 3.27Å; R51-F53 HydrophobicContact CB-CZ 4.01Å; R51-F53 HydrophobicContact CG-CE1 4.15Å; R51-F53 WeakPolarHBondContact O-CD1 3.18Å; F53-Y55 AromaticContact CD2-CE2 3.85Å; F53-Y55 HydrophobicContact CD2-CE2 3.85Å; F53-Y55 AromaticContact CE2-CE2 3.79Å; F53-Y55 HydrophobicContact CE2-CE2 3.79Å; F53-M96 HydrophobicContact CE2-CE 4.42Å; F53-M96 HydrophobicContact CZ-CE 3.99Å
54A90.7Very high86Confident0 Ų074.5 Ų74.50%033%0.327CS..EExtended strand (participates in β ladder)trans-140.1161.5178.800000111.1V14 V17 L26 Y40 V41V14-A54 HydrophobicContact CB-CB 4.37Å; V14-A54 PolarHBondContact N-O 3.07Å; V14-A54 PolarHBondContact O-N 3.38Å; V17-A54 HydrophobicContact CG2-CB 4.27Å; L26-A54 HydrophobicContact CD1-CB 3.35Å; Y40-A54 CarbonylContact O-C 3.57Å; Y40-A54 WeakPolarHBondContact O-CA 3.35Å; V41-A54 HydrophobicContact CG2-CB 3.95Å
55Y91Very high86.4Confident82 Ų8277.2 Ų77.232%0.32234%0.339SS..EExtended strand (participates in β ladder)trans-120133.2170.5-64.6-89.3000109.1L12 F13 V39 Y40 P42 F53 A86L12-Y55 VanDerWaalsContact O-CA 3.28Å; L12-Y55 WeakPolarHBondContact O-CA 3.42Å; F13-Y55 HydrophobicContact CB-CD1 4.29Å; F13-Y55 HydrophobicContact CB-CE1 4.09Å; F13-Y55 HydrophobicContact CD2-CD1 4.01Å; F13-Y55 AromaticContact CD2-CE1 3.41Å; F13-Y55 HydrophobicContact CD2-CE1 3.41Å; F13-Y55 VanDerWaalsContact CD2-CE1 3.41Å; F13-Y55 HydrophobicContact CD2-CE2 4.2Å; F13-Y55 AromaticContact CD2-CZ 3.51Å; F13-Y55 HydrophobicContact CE2-CE1 4.24Å; F13-Y55 HydrophobicContact CE2-CE2 4.39Å; F13-Y55 AromaticContact CE2-CZ 3.87Å; F13-Y55 HydrophobicContact CG-CE1 4.14Å; V39-Y55 WeakPolarHBondContact CA-O 3.47Å; Y40-Y55 HydrophobicContact CD1-CD2 4.03Å; Y40-Y55 PolarHBondContact N-O 2.82Å; Y40-Y55 PolarHBondContact O-N 2.76Å; P42-Y55 HydrophobicContact CG-CD2 4.34Å; P42-Y55 HydrophobicContact CG-CE2 4.28Å; F53-Y55 AromaticContact CD2-CE2 3.85Å; F53-Y55 HydrophobicContact CD2-CE2 3.85Å; F53-Y55 AromaticContact CE2-CE2 3.79Å; F53-Y55 HydrophobicContact CE2-CE2 3.79Å; Y55-A86 HydrophobicContact CD1-CB 4.36Å; Y55-A86 HydrophobicContact CE1-CB 4.45Å
56V91.5Very high87.3Confident0 Ų073.2 Ų73.20%033%0.325CS..EExtended strand (participates in β ladder)trans-122.7123.2176.4-178.60000107.4S11 L12 V14 F30 I36 F58S11-V56 CarbonylContact C-O 3.58Å; S11-V56 WeakPolarHBondContact CA-O 3.25Å; L12-V56 PolarHBondContact N-O 2.9Å; L12-V56 PolarHBondContact O-N 3.17Å; V14-V56 HydrophobicContact CG2-CG2 4.24Å; F30-V56 HydrophobicContact CB-CG1 4.12Å; F30-V56 HydrophobicContact CD1-CG1 4.27Å; F30-V56 HydrophobicContact CD1-CG2 4.41Å; F30-V56 HydrophobicContact CD2-CG2 4.15Å; F30-V56 HydrophobicContact CE2-CG2 4.33Å; F30-V56 HydrophobicContact CG-CG1 4.19Å; F30-V56 HydrophobicContact CG-CG2 4.21Å; I36-V56 HydrophobicContact CD1-CG1 4.31Å; I36-V56 HydrophobicContact CG1-CG1 4.29Å; I36-V56 HydrophobicContact CG2-CG1 3.95Å; V56-F58 HydrophobicContact CG1-CD2 4.23Å; V56-F58 HydrophobicContact CG1-CE2 3.75Å; V56-F58 HydrophobicContact CG1-CZ 4.18Å
57Q90.8Very high88Confident74 Ų7464.6 Ų64.635%0.34629%0.291SS..EExtended strand (participates in β ladder)trans-104.9120.1176.9-174167.726.500109.6I36 V37 D38I36-Q57 CarbonylContact C-O 3.57Å; I36-Q57 WeakPolarHBondContact CG2-O 3.32Å; V37-Q57 HydrophobicContact CB-CB 4.34Å; V37-Q57 HydrophobicContact CB-CG 4.09Å; V37-Q57 PolarHBondContact N-O 2.95Å; D38-Q57 HydrophobicContact CB-CB 4.28Å; D38-Q57 PolarHBondContact N-O 2.78Å; D38-Q57 PolarHBondContact O-N 2.73Å
58F91.8Very high88.4Confident1 Ų161.7 Ų61.70%0.00427%0.273CS..EExtended strand (participates in β ladder)trans-88.2160.1171.6-73.3-86.9000111.3T10 L12 F30 I36 V56 D60 D63 A64 A67T10-F58 WeakPolarHBondContact CB-O 3.38Å; T10-F58 PolarHBondContact O-N 3.19Å; T10-F58 PolarHBondContact OG1-O 3.45Å; T10-F58 VanDerWaalsContact OG1-O 3.1Å; L12-F58 HydrophobicContact CD1-CD2 4.14Å; L12-F58 HydrophobicContact CD1-CE2 3.58Å; L12-F58 HydrophobicContact CG-CD2 4.28Å; L12-F58 HydrophobicContact CG-CE2 4.16Å; F30-F58 HydrophobicContact CB-CZ 3.9Å; F30-F58 HydrophobicContact CD1-CE2 4.03Å; F30-F58 AromaticContact CD1-CZ 3.88Å; F30-F58 HydrophobicContact CD1-CZ 3.88Å; F30-F58 HydrophobicContact CG-CZ 4.39Å; I36-F58 HydrophobicContact CG1-CD1 4.28Å; I36-F58 HydrophobicContact CG1-CE1 3.96Å; I36-F58 HydrophobicContact CG1-CZ 4.45Å; V56-F58 HydrophobicContact CG1-CD2 4.23Å; V56-F58 HydrophobicContact CG1-CE2 3.75Å; V56-F58 HydrophobicContact CG1-CZ 4.18Å; F58-D60 WeakPolarHBondContact CB-O 3.43Å; F58-D63 HydrophobicContact CD1-CB 3.94Å; F58-D63 HydrophobicContact CE1-CB 4.47Å; F58-D63 HydrophobicContact CG-CB 4.45Å; F58-A64 HydrophobicContact CB-CB 4.15Å; F58-A64 HydrophobicContact CD2-CB 3.74Å; F58-A64 HydrophobicContact CG-CB 4.14Å; F58-A67 HydrophobicContact CE2-CB 3.96Å; F58-A67 HydrophobicContact CZ-CB 3.68Å
59E89.4Confident89Confident132 Ų13258.6 Ų58.662%0.61727%0.267SS*.SBendtrans-73-46.6170.8-169.4173.1173.800110.3P35 V37P35-E59 HydrophobicContact CB-CB 4.36Å; P35-E59 HydrophobicContact CG-CB 3.94Å; P35-E59 WeakPolarHBondContact CG-OE2 3.4Å; P35-E59 PolarHBondContact O-N 2.83Å; P35-E59 VanDerWaalsContact O-N 3.12Å; V37-E59 HydrophobicContact CG2-CB 4.02Å
60D89.2Confident89.4Confident66 Ų6655.4 Ų55.435%0.35326%0.262SS..SBendtrans-106.8149.3-179.2-103.1-13.5000112.2F58 R62 D63 A64F58-D60 WeakPolarHBondContact CB-O 3.43Å; D60-R62 IonicContact OD2-CZ 3.78Å; D60-R62 IonicContact OD2-NE 3.86Å; D60-R62 IonicContact OD2-NH2 2.85Å; D60-R62 PolarHBondContact OD2-NH2 2.93Å; D60-D63 HydrophobicContact CB-CB 4.46Å; D60-A64 PolarHBondContact O-N 3.45Å
61V88.9Confident89.7Confident29 Ų2954.1 Ų54.118%0.17625%0.254CS..Hα-helixtrans-73.3-38.2178.4-176.50000111P8 T10 D63 A64 E65P8-V61 HydrophobicContact CB-CB 4.24Å; P8-V61 HydrophobicContact CB-CG1 3.81Å; P8-V61 HydrophobicContact CB-CG2 3.45Å; P8-V61 VanDerWaalsContact CB-CG2 3.45Å; P8-V61 HydrophobicContact CG-CG2 3.41Å; P8-V61 VanDerWaalsContact CG-CG2 3.41Å; T10-V61 HydrophobicContact CG2-CB 4.43Å; T10-V61 HydrophobicContact CG2-CG2 3.59Å; V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 3.1Å; V61-A64 WeakPolarHBondContact O-CA 3.28Å; V61-A64 WeakPolarHBondContact O-CB 3.1Å; V61-A64 PolarHBondContact O-N 2.73Å; V61-E65 PolarHBondContact O-N 2.76Å
62R90.4Very high90.1Very high160 Ų16052.2 Ų52.260%0.60425%0.25SS*.Hα-helixtrans-59.9-43.6-179.2-62.9174.6-65.5176.21.9110.7D60 A64 E65 D66D60-R62 IonicContact OD2-CZ 3.78Å; D60-R62 IonicContact OD2-NE 3.86Å; D60-R62 IonicContact OD2-NH2 2.85Å; D60-R62 PolarHBondContact OD2-NH2 2.93Å; R62-A64 VanDerWaalsContact C-N 3.28Å; R62-A64 PolarHBondContact O-N 3.38Å; R62-E65 WeakPolarHBondContact O-CB 3.41Å; R62-E65 PolarHBondContact O-N 2.85Å; R62-D66 PolarHBondContact O-N 2.94Å
63D91.4Very high90Very high26 Ų2659.1 Ų59.114%0.13927%0.272CS..Hα-helixtrans-64.3-35.4176.5-55.6-12.9000111.7P35 F58 D60 V61 A67P35-D63 WeakPolarHBondContact CD-OD2 3.48Å; F58-D63 HydrophobicContact CD1-CB 3.94Å; F58-D63 HydrophobicContact CE1-CB 4.47Å; F58-D63 HydrophobicContact CG-CB 4.45Å; D60-D63 HydrophobicContact CB-CB 4.46Å; V61-D63 VanDerWaalsContact C-N 3.3Å; V61-D63 PolarHBondContact O-N 3.1Å; D63-A67 WeakPolarHBondContact O-CB 3.43Å; D63-A67 PolarHBondContact O-N 3.47Å
64A90.5Very high89.8Confident0 Ų061.1 Ų61.10%028%0.28CS..Hα-helixtrans-68.7-39.117500000111.9L12 F58 D60 V61 R62 L68L12-A64 HydrophobicContact CD1-CB 4.39Å; L12-A64 WeakPolarHBondContact CD1-O 3.28Å; L12-A64 HydrophobicContact CD2-CB 4.06Å; L12-A64 HydrophobicContact CG-CB 4.12Å; F58-A64 HydrophobicContact CB-CB 4.15Å; F58-A64 HydrophobicContact CD2-CB 3.74Å; F58-A64 HydrophobicContact CG-CB 4.14Å; D60-A64 PolarHBondContact O-N 3.45Å; V61-A64 WeakPolarHBondContact O-CA 3.28Å; V61-A64 WeakPolarHBondContact O-CB 3.1Å; V61-A64 PolarHBondContact O-N 2.73Å; R62-A64 VanDerWaalsContact C-N 3.28Å; R62-A64 PolarHBondContact O-N 3.38Å; A64-L68 VanDerWaalsContact O-CB 3.25Å; A64-L68 WeakPolarHBondContact O-CB 3.23Å; A64-L68 PolarHBondContact O-N 3.42Å
65E91Very high89.5Confident86 Ų8669.8 Ų69.840%0.40231%0.313SS..Hα-helixtrans-63-48.2172.9-78.1172.7170.500111.2V61 R62 A67 L68 H69 F85V61-E65 PolarHBondContact O-N 2.76Å; R62-E65 WeakPolarHBondContact O-CB 3.41Å; R62-E65 PolarHBondContact O-N 2.85Å; E65-A67 PolarHBondContact O-N 3.4Å; E65-L68 WeakPolarHBondContact O-CB 3.41Å; E65-L68 PolarHBondContact O-N 3Å; E65-H69 PolarHBondContact O-CD2 3.23Å; E65-H69 PolarHBondContact O-N 3.1Å; E65-F85 HydrophobicContact CG-CE1 4.49Å; E65-F85 HydrophobicContact CG-CZ 3.66Å
66D91.3Very high89Confident82 Ų8266.4 Ų66.444%0.43930%0.3SS..Hα-helixtrans-62.6-42.9178-76.1-21.2000111.6Y33 R62 H69 N70Y33-D66 HydrophobicContact CD1-CB 4.42Å; R62-D66 PolarHBondContact O-N 2.94Å; D66-H69 PolarHBondContact O-N 3.25Å; D66-N70 WeakPolarHBondContact O-CB 3.46Å; D66-N70 PolarHBondContact O-N 3.23Å; D66-N70 PolarHBondContact O-ND2 3.26Å
67A91Very high88.3Confident0 Ų069.9 Ų69.90%032%0.324CS..Hα-helixtrans-63-42.6174.500000111.5L12 F30 Y33 F58 D63 E65 L71L12-A67 HydrophobicContact CD1-CB 3.93Å; F30-A67 HydrophobicContact CD1-CB 4.22Å; Y33-A67 HydrophobicContact CD2-CB 4.03Å; Y33-A67 HydrophobicContact CG-CB 3.86Å; F58-A67 HydrophobicContact CE2-CB 3.96Å; F58-A67 HydrophobicContact CZ-CB 3.68Å; D63-A67 WeakPolarHBondContact O-CB 3.43Å; D63-A67 PolarHBondContact O-N 3.47Å; E65-A67 PolarHBondContact O-N 3.4Å; A67-L71 HydrophobicContact CB-CD1 4.46Å; A67-L71 WeakPolarHBondContact O-CB 3.39Å; A67-L71 PolarHBondContact O-N 2.96Å
68L90.8Very high87.9Confident22 Ų2269.3 Ų69.312%0.11534%0.338CS..Hα-helixtrans-58.4-51.1175.9175.973.1000110.8L12 A64 E65 N70 D72 I83 F85L12-L68 HydrophobicContact CD2-CB 4.36Å; A64-L68 VanDerWaalsContact O-CB 3.25Å; A64-L68 WeakPolarHBondContact O-CB 3.23Å; A64-L68 PolarHBondContact O-N 3.42Å; E65-L68 WeakPolarHBondContact O-CB 3.41Å; E65-L68 PolarHBondContact O-N 3Å; L68-N70 PolarHBondContact O-N 2.99Å; L68-D72 WeakPolarHBondContact O-CB 3.23Å; L68-D72 PolarHBondContact O-N 3.01Å; L68-D72 VanDerWaalsContact O-N 3.12Å; L68-I83 VanDerWaalsContact CD1-C 3.45Å; L68-I83 HydrophobicContact CD1-CB 3.76Å; L68-I83 HydrophobicContact CD1-CG2 3.53Å; L68-I83 WeakPolarHBondContact CD1-O 3.43Å; L68-F85 HydrophobicContact CD2-CD2 3.7Å; L68-F85 HydrophobicContact CD2-CE2 3.29Å; L68-F85 HydrophobicContact CD2-CG 4.48Å; L68-F85 HydrophobicContact CD2-CZ 3.77Å
69H89.5Confident87.6Confident143 Ų14373.4 Ų73.466%0.66235%0.353SS*.Hα-helixtrans-67.5-35.5-176.1-73.8-60.8000113.6E65 D66E65-H69 PolarHBondContact O-CD2 3.23Å; E65-H69 PolarHBondContact O-N 3.1Å; D66-H69 PolarHBondContact O-N 3.25Å
70N89.3Confident87.6Confident99 Ų9970.8 Ų70.853%0.52934%0.341SS..Hα-helixtrans-92.7-29-174.5-70-64.9000114.4Y33 D66 L68Y33-N70 HydrophobicContact CD1-CB 4.4Å; Y33-N70 HydrophobicContact CE1-CB 3.37Å; Y33-N70 WeakPolarHBondContact OH-CB 3.47Å; D66-N70 WeakPolarHBondContact O-CB 3.46Å; D66-N70 PolarHBondContact O-N 3.23Å; D66-N70 PolarHBondContact O-ND2 3.26Å; L68-N70 PolarHBondContact O-N 2.99Å
71L87.1Confident87.7Confident0 Ų067.7 Ų67.70%032%0.324CS..Hα-helixtrans-99-12.3-179.1-65.3175.3000113.2F30 Y33 A67 R73 K74 I81 I83F30-L71 HydrophobicContact CD1-CD1 3.54Å; F30-L71 HydrophobicContact CD2-CD1 4.17Å; F30-L71 HydrophobicContact CE1-CD1 3.59Å; F30-L71 HydrophobicContact CE2-CD1 4.21Å; F30-L71 HydrophobicContact CG-CD1 3.85Å; F30-L71 HydrophobicContact CZ-CD1 3.93Å; Y33-L71 HydrophobicContact CD2-CD1 3.82Å; Y33-L71 HydrophobicContact CD2-CG 4.18Å; Y33-L71 HydrophobicContact CE2-CD1 3.41Å; Y33-L71 VanDerWaalsContact CE2-CD1 3.41Å; Y33-L71 HydrophobicContact CE2-CD2 3.63Å; Y33-L71 HydrophobicContact CE2-CG 3.34Å; Y33-L71 WeakPolarHBondContact OH-CD2 3.21Å; A67-L71 HydrophobicContact CB-CD1 4.46Å; A67-L71 WeakPolarHBondContact O-CB 3.39Å; A67-L71 PolarHBondContact O-N 2.96Å; L71-R73 PolarHBondContact O-N 2.84Å; L71-K74 HydrophobicContact CD2-CD 3.47Å; L71-K74 VanDerWaalsContact CD2-CD 3.47Å; L71-K74 VanDerWaalsContact O-CB 3.32Å; L71-K74 WeakPolarHBondContact O-CB 3.36Å; L71-K74 PolarHBondContact O-N 2.78Å; L71-K74 VanDerWaalsContact O-N 3.1Å; L71-I81 HydrophobicContact CB-CD1 4.43Å; L71-I83 HydrophobicContact CB-CD1 3.29Å; L71-I83 HydrophobicContact CD1-CD1 4.46Å
72D88.8Confident87.9Confident46 Ų4670 Ų7025%0.24633%0.333CS..THydrogen-bonded Turntrans-57.9128.6173.7-178.256.1000109.7L68 K74 I83L68-D72 WeakPolarHBondContact O-CB 3.23Å; L68-D72 PolarHBondContact O-N 3.01Å; L68-D72 VanDerWaalsContact O-N 3.12Å; D72-K74 PolarHBondContact O-N 3.24Å; D72-I83 PolarHBondContact OD1-N 2.88Å
73R85Confident87.9Confident160 Ų16062.7 Ų62.760%0.60431%0.306SS*.THydrogen-bonded Turntrans64.321-178-70.6173.7-76.2-1670.1115.3L71 Q80 I81L71-R73 PolarHBondContact O-N 2.84Å; R73-Q80 HydrophobicContact CB-CG 4.14Å; R73-Q80 HydrophobicContact CG-CG 4.39Å; R73-Q80 WeakPolarHBondContact O-CG 3.1Å; R73-Q80 PolarHBondContact O-NE2 2.75Å; R73-I81 WeakPolarHBondContact CA-O 3.46Å; R73-I81 PolarHBondContact N-O 3.14Å
74K86.5Confident87.9Confident75 Ų7565.4 Ų65.433%0.32632%0.318SS..  trans-76.8149.5169.3-164.2-179178.4-170.10111.6E29 L71 D72 Q80 I81E29-K74 IonicContact OE2-NZ 2.77Å; E29-K74 PolarHBondContact OE2-NZ 2.68Å; L71-K74 HydrophobicContact CD2-CD 3.47Å; L71-K74 VanDerWaalsContact CD2-CD 3.47Å; L71-K74 VanDerWaalsContact O-CB 3.32Å; L71-K74 WeakPolarHBondContact O-CB 3.36Å; L71-K74 PolarHBondContact O-N 2.78Å; L71-K74 VanDerWaalsContact O-N 3.1Å; D72-K74 PolarHBondContact O-N 3.24Å; K74-Q80 WeakPolarHBondContact O-CA 3.43Å; K74-I81 HydrophobicContact CB-CG1 4.49Å; K74-I81 VanDerWaalsContact O-CG1 3.32Å; K74-I81 WeakPolarHBondContact O-CG1 3.48Å; K74-I81 PolarHBondContact O-N 2.86Å
75W85.3Confident87.8Confident182 Ų18268.3 Ų68.369%0.68933%0.331SS*.EExtended strand (participates in β ladder)trans-84.6116.8174.4-69.770000110.4R79W75-R79 WeakPolarHBondContact CA-O 3.5Å
76I80.4Confident87.5Confident11 Ų1164.5 Ų64.56%0.05631%0.314CS..EExtended strand (participates in β ladder)trans-124.1124.6174.7-58-174.2000108.1T21 E29 G78 R79 I81T21-I76 HydrophobicContact CG2-CG2 4.39Å; E29-I76 HydrophobicContact CG-CD1 4.36Å; I76-G78 PolarHBondContact O-N 3.41Å; I76-G78 VanDerWaalsContact O-N 3.1Å; I76-R79 PolarHBondContact N-O 2.85Å; I76-R79 PolarHBondContact O-N 2.8Å; I76-I81 HydrophobicContact CB-CG2 4.07Å; I76-I81 HydrophobicContact CD1-CD1 3.38Å; I76-I81 HydrophobicContact CD1-CG1 3.83Å; I76-I81 HydrophobicContact CD1-CG2 4.12Å; I76-I81 HydrophobicContact CG1-CD1 4.17Å; I76-I81 HydrophobicContact CG1-CG1 4.08Å; I76-I81 HydrophobicContact CG1-CG2 4.24Å
77C75.9Confident86.8Confident74 Ų7468.9 Ų68.950%0.533%0.331SS..THydrogen-bonded Turntrans51.336.9178.1-61.70000113.6A18 T21 R79A18-C77 HydrophobicContact CB-CB 3.56Å; T21-C77 PolarHBondContact OG1-SG 3.06Å; C77-R79 VanDerWaalsContact C-N 3.31Å; C77-R79 PolarHBondContact O-N 3.42Å
78G81.5Confident85.7Confident61 Ų6170.4 Ų70.463%0.62935%0.348SS*.THydrogen-bonded Turntrans793.7178.700000115.6I76I76-G78 PolarHBondContact O-N 3.41Å; I76-G78 VanDerWaalsContact O-N 3.1Å
79R86.3Confident84.5Confident88 Ų8875.5 Ų75.533%0.33238%0.375SS..EExtended strand (participates in β ladder)trans-117.7146.2170.2-63.7-167.1-176.2148.60.4110.6V17 A18 D19 W75 I76 C77V17-R79 PolarHBondContact O-NH1 3.31Å; A18-R79 HydrophobicContact CB-CB 4.42Å; A18-R79 HydrophobicContact CB-CG 4.15Å; D19-R79 VanDerWaalsContact CG-NH1 3.27Å; D19-R79 IonicContact OD1-CZ 2.68Å; D19-R79 IonicContact OD1-NH1 3.72Å; D19-R79 PolarHBondContact OD1-NH1 3.23Å; D19-R79 IonicContact OD1-NH2 3.73Å; D19-R79 IonicContact OD2-CZ 3.81Å; D19-R79 IonicContact OD2-NH1 2.85Å; D19-R79 PolarHBondContact OD2-NH1 3.12Å; D19-R79 IonicContact OD2-NH2 3.59Å; D19-R79 PolarHBondContact OD2-NH2 3.38Å; W75-R79 WeakPolarHBondContact CA-O 3.5Å; I76-R79 PolarHBondContact N-O 2.85Å; I76-R79 PolarHBondContact O-N 2.8Å; C77-R79 VanDerWaalsContact C-N 3.31Å; C77-R79 PolarHBondContact O-N 3.42Å
80Q89.7Confident83.4Confident77 Ų7775.9 Ų75.936%0.3637%0.37SS..EExtended strand (participates in β ladder)trans-82.1117.4173.4-177.2170.255.100109.3N16 R73 K74N16-Q80 WeakPolarHBondContact CB-O 3.48Å; N16-Q80 PolarHBondContact ND2-O 3.18Å; R73-Q80 HydrophobicContact CB-CG 4.14Å; R73-Q80 HydrophobicContact CG-CG 4.39Å; R73-Q80 WeakPolarHBondContact O-CG 3.1Å; R73-Q80 PolarHBondContact O-NE2 2.75Å; K74-Q80 WeakPolarHBondContact O-CA 3.43Å
81I91.6Very high82.3Confident0 Ų076.2 Ų76.20%037%0.367CS..  trans-81.2144.7178.557.2151.1000110.9V14 F30 L71 R73 K74 I76 I83V14-I81 HydrophobicContact CG1-CB 4.03Å; V14-I81 HydrophobicContact CG1-CD1 4.16Å; V14-I81 HydrophobicContact CG1-CG2 4.24Å; F30-I81 HydrophobicContact CZ-CD1 4.27Å; L71-I81 HydrophobicContact CB-CD1 4.43Å; R73-I81 WeakPolarHBondContact CA-O 3.46Å; R73-I81 PolarHBondContact N-O 3.14Å; K74-I81 HydrophobicContact CB-CG1 4.49Å; K74-I81 VanDerWaalsContact O-CG1 3.32Å; K74-I81 WeakPolarHBondContact O-CG1 3.48Å; K74-I81 PolarHBondContact O-N 2.86Å; I76-I81 HydrophobicContact CB-CG2 4.07Å; I76-I81 HydrophobicContact CD1-CD1 3.38Å; I76-I81 HydrophobicContact CD1-CG1 3.83Å; I76-I81 HydrophobicContact CD1-CG2 4.12Å; I76-I81 HydrophobicContact CG1-CD1 4.17Å; I76-I81 HydrophobicContact CG1-CG1 4.08Å; I76-I81 HydrophobicContact CG1-CG2 4.24Å; I81-I83 HydrophobicContact CD1-CD1 3.83Å; I81-I83 HydrophobicContact CD1-CG1 3.95Å
82E92.1Very high81.3Confident79 Ų7979.2 Ų79.237%0.36939%0.386SS..EExtended strand (participates in β ladder)trans-112132.5170.4-67.4178.6174.400108.1V14 R15V14-E82 CarbonylContact C-O 3.55Å; V14-E82 WeakPolarHBondContact CA-O 3.14Å; R15-E82 HydrophobicContact CB-CB 4.24Å; R15-E82 PolarHBondContact N-O 3.5Å; R15-E82 PolarHBondContact O-N 3.22Å
83I91.9Very high80.2Confident6 Ų681 Ų813%0.03140%0.4CS..EExtended strand (participates in β ladder)trans-116135.4-179.4-53.9172000108.5L12 V14 F30 L68 L71 D72 I81L12-I83 HydrophobicContact CB-CG2 3.98Å; L12-I83 HydrophobicContact CD1-CG2 3.89Å; L12-I83 HydrophobicContact CD2-CG2 4.32Å; L12-I83 HydrophobicContact CG-CG2 4.29Å; V14-I83 HydrophobicContact CG1-CG1 4.34Å; V14-I83 HydrophobicContact CG2-CG1 4.47Å; F30-I83 HydrophobicContact CE1-CD1 3.7Å; F30-I83 HydrophobicContact CZ-CD1 3.65Å; F30-I83 HydrophobicContact CZ-CG1 4.23Å; L68-I83 VanDerWaalsContact CD1-C 3.45Å; L68-I83 HydrophobicContact CD1-CB 3.76Å; L68-I83 HydrophobicContact CD1-CG2 3.53Å; L68-I83 WeakPolarHBondContact CD1-O 3.43Å; L71-I83 HydrophobicContact CB-CD1 3.29Å; L71-I83 HydrophobicContact CD1-CD1 4.46Å; D72-I83 PolarHBondContact OD1-N 2.88Å; I81-I83 HydrophobicContact CD1-CD1 3.83Å; I81-I83 HydrophobicContact CD1-CG1 3.95Å
84Q90.6Very high79.2Confident83 Ų8379.9 Ų79.939%0.38841%0.406SS..EExtended strand (participates in β ladder)trans-136.7154.5175.2-65.2-176.2-6.100109.8F13 A86F13-Q84 WeakPolarHBondContact CA-O 3.47Å; F13-Q84 HydrophobicContact CD1-CB 4.46Å; F13-Q84 PolarHBondContact N-O 3.49Å; F13-Q84 PolarHBondContact O-N 3.04Å; Q84-A86 PolarHBondContact O-N 3.23Å
85F88.8Confident78.3Confident61 Ų6181.7 Ų81.727%0.26842%0.415SS..EExtended strand (participates in β ladder)trans-60.6128.2168.1-89.9-52.5000111.9N9 L12 E65 L68 Q87N9-F85 HydrophobicContact CB-CD1 4.43Å; N9-F85 VanDerWaalsContact CG-CD1 3.44Å; N9-F85 WeakPolarHBondContact ND2-CB 3.34Å; N9-F85 WeakPolarHBondContact ND2-CD1 3.41Å; N9-F85 VanDerWaalsContact ND2-CG 3.34Å; N9-F85 WeakPolarHBondContact ND2-CG 3.45Å; L12-F85 HydrophobicContact CD2-CD1 3.96Å; L12-F85 HydrophobicContact CD2-CE1 3.99Å; E65-F85 HydrophobicContact CG-CE1 4.49Å; E65-F85 HydrophobicContact CG-CZ 3.66Å; L68-F85 HydrophobicContact CD2-CD2 3.7Å; L68-F85 HydrophobicContact CD2-CE2 3.29Å; L68-F85 HydrophobicContact CD2-CG 4.48Å; L68-F85 HydrophobicContact CD2-CZ 3.77Å; F85-Q87 PolarHBondContact O-N 3.37Å; F85-Q87 VanDerWaalsContact O-N 3.15Å
86A85Confident77.2Confident5 Ų574.6 Ų74.64%0.04139%0.39CS..  trans-67118.6-179.700000110.1S11 F13 Y55 Q84 G88S11-A86 WeakPolarHBondContact O-CB 3.36Å; S11-A86 PolarHBondContact O-N 3.2Å; F13-A86 HydrophobicContact CB-CB 4.4Å; Y55-A86 HydrophobicContact CD1-CB 4.36Å; Y55-A86 HydrophobicContact CE1-CB 4.45Å; Q84-A86 PolarHBondContact O-N 3.23Å; A86-G88 PolarHBondContact O-N 3.42Å
87Q75.4Confident76.3Confident174 Ų17481.3 Ų81.381%0.81342%0.419SS*.  trans-83.86.8179.2-63.8-177.5-13.600113R6 F85R6-Q87 PolarHBondContact NH1-O 3.35Å; R6-Q87 PolarHBondContact NH2-O 2.99Å; F85-Q87 PolarHBondContact O-N 3.37Å; F85-Q87 VanDerWaalsContact O-N 3.15Å
88G69.1Low75.6Confident33 Ų3381 Ų8134%0.3442%0.422SS..SBendtrans-151.6146.5-169.200000111.5R6 A86R6-G88 VanDerWaalsContact NH2-C 3.3Å; A86-G88 PolarHBondContact O-N 3.42Å
89D64.3Low74.6Confident128 Ų12885.2 Ų85.268%0.68442%0.423SS*.  trans-73.1156.4171.5-47.4-30.1000108.9R6 K91R6-D89 IonicContact CZ-OD1 3.83Å; R6-D89 IonicContact NE-OD1 3.89Å; R6-D89 IonicContact NH2-OD1 2.9Å; R6-D89 PolarHBondContact NH2-OD1 2.8Å; D89-K91 PolarHBondContact O-N 3.21Å
90R66Low73.2Confident151 Ų15184.2 Ų84.257%0.5742%0.422SS*.  trans-50.1111-178.4178.6176.4170.8168.9-5.3110.5D38 Y40 T92D38-R90 IonicContact OD2-CZ 2.8Å; D38-R90 IonicContact OD2-NH1 3.28Å; D38-R90 PolarHBondContact OD2-NH1 3.12Å; Y40-R90 HydrophobicContact CD1-CG 4.4Å; R90-T92 PolarHBondContact O-N 3.48Å
91K67.6Low71.5Confident107 Ų10783.1 Ų83.147%0.46543%0.431SS..  trans-77.2126.2172.5-66.4-177.4-177.9178.60108.4D89 Q95 M96D89-K91 PolarHBondContact O-N 3.21Å; K91-Q95 HydrophobicContact CB-CB 4.22Å; K91-M96 HydrophobicContact CB-CG 4.01Å
92T66Low69.6Low63 Ų6391.8 Ų91.839%0.38746%0.464SS..  trans-64.2153.1171.658.60000109.6R90 N94 Q95 M96R90-T92 PolarHBondContact O-N 3.48Å; T92-N94 PolarHBondContact O-N 3.2Å; T92-Q95 WeakPolarHBondContact O-CA 2.94Å; T92-Q95 WeakPolarHBondContact O-CB 3.44Å; T92-Q95 PolarHBondContact O-N 3.11Å; T92-Q95 WeakPolarHBondContact OG1-CG 3.38Å; T92-M96 PolarHBondContact O-N 3.07Å; T92-M96 VanDerWaalsContact O-N 3.11Å
93P65.1Low67.7Low84 Ų8494.5 Ų94.555%0.54548%0.48SS..Hα-helixtrans-53.8-33.117919.9-33.2000112.5Q95 M96 K97P93-Q95 PolarHBondContact O-N 3.23Å; P93-M96 PolarHBondContact O-N 2.83Å; P93-K97 PolarHBondContact O-N 2.68Å; P93-K97 VanDerWaalsContact O-N 3.14Å
94N64Low65.8Low136 Ų136100.4 Ų100.473%0.72752%0.517SS*.Hα-helixtrans-63.7-36.4174.1-74-13.2000113.3T92T92-N94 PolarHBondContact O-N 3.2Å
95Q67.3Low63.8Low113 Ų113103.2 Ų103.253%0.52853%0.525SS..Hα-helixtrans-73.9-30.2175.1-68172.117.500112.1K91 T92 P93K91-Q95 HydrophobicContact CB-CB 4.22Å; T92-Q95 WeakPolarHBondContact O-CA 2.94Å; T92-Q95 WeakPolarHBondContact O-CB 3.44Å; T92-Q95 PolarHBondContact O-N 3.11Å; T92-Q95 WeakPolarHBondContact OG1-CG 3.38Å; P93-Q95 PolarHBondContact O-N 3.23Å
96M62.7Low61.9Low33 Ų33104.2 Ų104.216%0.16354%0.54CS..Hα-helixtrans-68.3-37.4175.9-66.2-177.965.300112.1P42 F53 K91 T92 P93 A98 K99 E100P42-M96 HydrophobicContact CB-CE 3.89Å; P42-M96 HydrophobicContact CB-SD 4.29Å; P42-M96 HydrophobicContact CG-CE 4.39Å; P42-M96 HydrophobicContact CG-SD 4.49Å; F53-M96 HydrophobicContact CE2-CE 4.42Å; F53-M96 HydrophobicContact CZ-CE 3.99Å; K91-M96 HydrophobicContact CB-CG 4.01Å; T92-M96 PolarHBondContact O-N 3.07Å; T92-M96 VanDerWaalsContact O-N 3.11Å; P93-M96 PolarHBondContact O-N 2.83Å; M96-A98 PolarHBondContact O-N 3.46Å; M96-K99 PolarHBondContact O-N 3.04Å; M96-E100 PolarHBondContact O-N 2.63Å
97K62.1Low60.3Low152 Ų152109 Ų10966%0.66157%0.572SS**Hα-helixtrans-53.7-38.9178.1-172.7176.4-179.6177.60113.2P93 K99 E100 G101P93-K97 PolarHBondContact O-N 2.68Å; P93-K97 VanDerWaalsContact O-N 3.14Å; K97-K99 VanDerWaalsContact C-N 3.26Å; K97-K99 PolarHBondContact O-N 2.84Å; K97-E100 PolarHBondContact O-N 3.39Å; K97-G101 PolarHBondContact O-N 3.14Å; K97-G101 VanDerWaalsContact O-N 3.11Å
98A60.6Low59Low67 Ų67105.2 Ų105.255%0.55457%0.565SS**Hα-helixtrans-68.6-23.6-179.500000113.5M96M96-A98 PolarHBondContact O-N 3.46Å
99K60.3Low58Low149 Ų149110.1 Ų110.165%0.64857%0.574SS**Hα-helixtrans-87.1-37.3178.6-159.2-179.8-177.9-165.90111.5M96 K97 R102M96-K99 PolarHBondContact O-N 3.04Å; K97-K99 VanDerWaalsContact C-N 3.26Å; K97-K99 PolarHBondContact O-N 2.84Å; K99-R102 PolarHBondContact O-N 2.82Å
100E57.8Low57.2Low68 Ų68113.6 Ų113.632%0.31858%0.579SS.*Hα-helixtrans-72.7-38.2-178.8-160.2145.6-127.500112R51 M96 K97 R102R51-E100 IonicContact CZ-OE1 3.04Å; R51-E100 IonicContact CZ-OE2 3.69Å; R51-E100 VanDerWaalsContact NH1-CD 3.3Å; R51-E100 IonicContact NH1-OE1 3.86Å; R51-E100 PolarHBondContact NH1-OE1 3.03Å; R51-E100 IonicContact NH1-OE2 2.84Å; R51-E100 PolarHBondContact NH1-OE2 3.11Å; R51-E100 IonicContact NH2-OE1 3.06Å; R51-E100 PolarHBondContact NH2-OE1 3.31Å; R51-E100 IonicContact NH2-OE2 3.41Å; M96-E100 PolarHBondContact O-N 2.63Å; K97-E100 PolarHBondContact O-N 3.39Å; E100-R102 PolarHBondContact O-N 3.39Å
101G52.5Low56.3Low53 Ų53112.7 Ų112.755%0.54659%0.585SS.*Hα-helixtrans-70-17173.600000114.6K97K97-G101 PolarHBondContact O-N 3.14Å; K97-G101 VanDerWaalsContact O-N 3.11Å
102R53.3Low55.4Low183 Ų183112.8 Ų112.869%0.69159%0.591SS**Hα-helixtrans-82.6-20.7-176.6-139.2-162.1-79.8-169.6-5113.2K99 E100 S106K99-R102 PolarHBondContact O-N 2.82Å; E100-R102 PolarHBondContact O-N 3.39Å; R102-S106 WeakPolarHBondContact O-CB 3.37Å
103N51.7Low54.4Low135 Ų135117.8 Ų117.872%0.72260%0.604SS**Hα-helixtrans-91.8-23.1-174.6-113.8-35.5000114.5
104V50.9Low53.7Low131 Ų131119.3 Ų119.379%0.79461%0.607SS**THydrogen-bonded Turntrans-93.3-11.9-175.5-174.10000112.7
105Y48.7Very low53Low141 Ų141122 Ų12255%0.55361%0.607SS**THydrogen-bonded Turntrans-136.2-10.6-174.2-148.8-93.1000115.3R109Y105-R109 VanDerWaalsContact CZ-CZ 3.4Å; Y105-R109 PolarHBondContact OH-NH1 3.01Å
106S50.5Low51.9Low83 Ų83124.6 Ų124.658%0.5861%0.613SS**SBendtrans-91.7-12.7-174.9-162.30000114.7R102R102-S106 WeakPolarHBondContact O-CB 3.37Å
107S50.7Low51.3Low104 Ų104133.6 Ų133.673%0.72765%0.646SS**SBendtrans-102.2-0.1-175.1-166.40000114.5
108S47.8Very low50.6Low96 Ų96135.9 Ų135.967%0.67165%0.65SS**SBendtrans-138.43.5-174.31110000116.3
109R48.3Very low49.7Very low135 Ų135137.1 Ų137.151%0.50965%0.654SS.*SBendtrans-121.23.6-173.8-78.5-177.5-162.3-146.53.7116.7Y105Y105-R109 VanDerWaalsContact CZ-CZ 3.4Å; Y105-R109 PolarHBondContact OH-NH1 3.01Å
110Y46.6Very low48.9Very low202 Ų202139 Ų13979%0.79266%0.657SS**SBendtrans-132.29.2175.9-97.1-87.9000115.3
111D48.7Very low48.2Very low132 Ų132141 Ų14171%0.70668%0.679SS**SBendtrans-103-0.8176.6-105.9-76.2000114.3
112D48.3Very low47.7Very low109 Ų109148.2 Ų148.258%0.58369%0.69SS**SBendtrans-90.8-30.6-177.6-162.9-109.8000113.4D114 R115D112-D114 PolarHBondContact O-N 3.04Å; D112-R115 PolarHBondContact O-N 3.43Å
113Y44.6Very low46.8Very low167 Ų167145 Ų14566%0.65570%0.695SS**Hα-helixtrans-76.4-21.6-178.1-56.7-72.2000113.8
114D51.1Low46.1Very low117 Ų117148.4 Ų148.463%0.62670%0.7SS**Hα-helixtrans-85.6-18.8174.8-81.4-69.6000113.1D112D112-D114 PolarHBondContact O-N 3.04Å
115R48.2Very low45.4Very low193 Ų193150.3 Ų150.373%0.72870%0.7SS**Hα-helixtrans-82.3-29.2178.2-135.3177.3-144.8164.57113D112 R118 S119D112-R115 PolarHBondContact O-N 3.43Å; R115-R118 PolarHBondContact O-N 3.49Å; R115-S119 PolarHBondContact O-OG 3.01Å
116Y45.3Very low44.9Very low167 Ų167155.2 Ų155.266%0.65572%0.717SS**Hα-helixtrans-79.2-22.4177.2-141.3-103.2000113.2R120Y116-R120 PolarHBondContact OH-NH1 3.37Å; Y116-R120 VanDerWaalsContact OH-NH1 3.13Å
117R49.9Very low44.4Very low222 Ų222162.9 Ų162.984%0.83873%0.733SS**Hα-helixtrans-81.5-19.6170.1-92.8-166177.6-136.21.4114.3
118R46.8Very low43.7Very low200 Ų200170 Ų17076%0.75574%0.744SS**SBendtrans-93.42.5-177.8-118.7171.1-178.5172.90.2115.5R115R115-R118 PolarHBondContact O-N 3.49Å
119S42.4Very low43.3Very low92 Ų92170.2 Ų170.264%0.64375%0.746SS**SBendtrans-122.33.8-173.6-47.10000114.5R115R115-S119 PolarHBondContact O-OG 3.01Å
120R43.5Very low42.8Very low188 Ų188175.4 Ų175.471%0.70977%0.765SS**SBendtrans-114.716.8-178-122.2175.9-177.7120.6-3.2115.4Y116Y116-R120 PolarHBondContact OH-NH1 3.37Å; Y116-R120 VanDerWaalsContact OH-NH1 3.13Å
121S41.8Very low42.5Very low110 Ų110171.1 Ų171.177%0.76977%0.765SS**SBendtrans-138.831.1176.7-46.90000113.4
122R41.9Very low42.1Very low205 Ų205176 Ų17677%0.77477%0.773SS**  trans-131.373.6175.6-78.5-177.7171.5137.5-7.9110.4
123S34.6Very low41.5Very low116 Ų116175 Ų17581%0.81178%0.775SS**SBendtrans171.472.9157.638.50000112.6
124Y37.7Very low41.2Very low207 Ų207176.6 Ų176.681%0.81279%0.785SS**SBendtrans-167.2147.7131.362.2-80.1000105.2
125E36.2Very low40.7Very low170 Ų170177 Ų17779%0.79479%0.788SS**SBendtrans81.854.7-173.3-46.4-168.4158.300117.6
126R37.9Very low40.4Very low244 Ų244179.1 Ų179.192%0.92180%0.797SS**  trans-170.378.6142.1-114.8176.4-169.2-166.13.2112.1
127R39.7Very low40.2Very low245 Ų245177.6 Ų177.693%0.92580%0.801SS**  trans-140.685.7145.2-75.6-152.5-174.9-141.24.1110.1S129R127-S129 PolarHBondContact O-N 3.44Å
128R35.8Very low39.5Very low253 Ų253176.3 Ų176.396%0.95580%0.797SS**  trans-80.889.2159.7-167179.3-162.7165.74106.9
129S41.1Very low39.4Very low100 Ų100176.2 Ų176.270%0.69980%0.797SS**  trans-163.195.3166.5-49.20000107.7R127R127-S129 PolarHBondContact O-N 3.44Å
130R36.4Very low39.2Very low245 Ų245183.5 Ų183.593%0.92581%0.81SS**  45.8105.5108.1-80.9-177170.8131.2-2.9114
131S41.6Very low39.1Very low111 Ų111179.8 Ų179.878%0.77681%0.813SS**  trans169.2104.9131.3-71.20000107.8
132R39.1Very low39.2Very low236 Ų236185.6 Ų185.689%0.89182%0.82SS**  75.6109.597.1-86.2-177.3173.6146-3.2114
133S36.3Very low39.4Very low88 Ų88179.8 Ų179.862%0.61581%0.81SS**  trans54.6119.7142.6580000119
134F38.5Very low40.1Very low199 Ų199179.6 Ų179.687%0.87381%0.806SS**  -172.2120.7105.9-99.2-74.5000110
135D41.2Very low40.5Very low126 Ų126180.5 Ų180.567%0.67481%0.809SS**  trans-51.9146.9168.6-69.4-100.9000113.6
136Y41.1Very low40.9Very low237 Ų237179.1 Ų179.193%0.92981%0.806SS**  -158.5111.6129.5-122.5-86.4000110.5
137N41.1Very low41.2Very low136 Ų136173 Ų17373%0.72780%0.801SS**  trans-76.4140.1170.8-75.7-79.7000110.5
138Y36.1Very low41.5Very low194 Ų194172.7 Ų172.776%0.76180%0.8SS**  trans-151.5100.3151.3-164.5-102.1000112.5
139R43.8Very low42.4Very low198 Ų198165.8 Ų165.875%0.74779%0.788SS**  trans49.6122.2142-54.7-171.2-174-138.6-1.7118.5
140R37.2Very low42.9Very low246 Ų246168.1 Ų168.193%0.92880%0.798SS**  cis6594.733.4-147.5175.3-158.8-158.24.6116.6
141S42.5Very low43.2Very low110 Ų110160.4 Ų160.477%0.76980%0.795SS**  trans179.9114.4143.835.60000110.2
142Y43.8Very low43.6Very low231 Ų231166.6 Ų166.691%0.90680%0.801SS**  73130.7100.3-134-105.7000112.3
143S45.8Very low44.3Very low83 Ų83159.8 Ų159.858%0.5879%0.788SS**  cis-171.11707.6-106.90000110.6
144P50.1Low44.7Very low112 Ų112166.8 Ų166.873%0.72780%0.801SS**  trans-104.6157.7-16738.2-31000115.5
145R44.9Very low44.7Very low227 Ų227169.5 Ų169.586%0.85781%0.805SS**  trans166.9142.5141.9-99.6170-173.8-116.31.3114.5
146N45Very low44.9Very low140 Ų140167.7 Ų167.775%0.74980%0.803SS**  trans55.2134.2143.2-83.9-4.3000119.5
147S45.3Very low45Very low115 Ų115167.8 Ų167.880%0.80480%0.801SS**  cis-165.3150.332.4-39.20000110.4
148R45.2Very low45.1Very low239 Ų239166.9 Ų166.990%0.90281%0.806SS**  trans-75.1-165170.6-68.9177.2166.3168-3.5112
149P53.9Low45.5Very low108 Ų108166.3 Ų166.370%0.70181%0.809SS**  -130.6-179.2-66.337.6-21.1000111.9
150T51.4Low45.9Very low149 Ų149162.5 Ų162.591%0.91481%0.813SS**  trans173.2139.5137.445.40000112
151G44.2Very low46.4Very low84 Ų84156.6 Ų156.687%0.86680%0.8SS**  trans126.994.9156.500000117.2
152R49.7Very low46.5Very low241 Ų241159 Ų15991%0.90980%0.804SS**  trans-109.2-171.7174.1-110.4-167.7-174.9-147.62.6107.9
153P52.4Low46.6Very low93 Ų93154.6 Ų154.660%0.60480%0.797SS**  cis-142.2-169.3-4134.1-12000114.4
154R46.2Very low46.3Very low235 Ų235160.1 Ų160.189%0.88781%0.805SS**  trans100.1110.8148-46.1-156.1179.6-164.9-1119.7
155R38.2Very low46.3Very low255 Ų255161.9 Ų161.996%0.96280%0.801SS**  -162.3148.1116.8-130.9169.1-178.9163.9-1111.4
156S44.7Very low46.3Very low89 Ų89159.2 Ų159.262%0.62280%0.796SS**  trans-120.1164.9-15744.40000113.3
157R43.7Very low46.2Very low238 Ų238160.7 Ų160.790%0.89880%0.798SS**  trans94.3127.4164.4-55.8166.3178.3151.2-1.8113.2
158S43.7Very low45.9Very low118 Ų118167 Ų16783%0.82580%0.804SS**  cis-160.7136.628.634.10000111.6
159H44.5Very low45.7Very low181 Ų181162.1 Ų162.184%0.83880%0.796SS**  trans-97.3145.4160.6-88.632.8000108.7
160S51.3Low44.9Very low119 Ų119168.1 Ų168.183%0.83281%0.805SS**  trans-130.8106156.760.60000108.7
161D47.5Very low44.2Very low121 Ų121166.4 Ų166.465%0.64780%0.798SS**  trans-57.2142.5167.1-63.2-90.1000112.7
162N45.2Very low44.1Very low161 Ų161171.6 Ų171.686%0.86180%0.797SS**  trans-157.170.7137.3-109.9-41.8000109.8
163D44.8Very low43.9Very low139 Ų139163.5 Ų163.574%0.74378%0.778SS**  trans-60.4125.4138.9-84-59.8000107.8
164R41Very low43.3Very low199 Ų199170.1 Ų170.175%0.75179%0.791SS**  trans179.6125.6135.3-105.9162.5178.2177.13115.6
165F49.3Very low43.1Very low148 Ų148164 Ų16465%0.64978%0.784SS**  trans80.1139.3148.4-52.8-47.6000117
166K45.4Very low43.2Very low171 Ų171160.8 Ų160.874%0.74378%0.777SS**  cis-168.9140.6-5-116.3159.2-177.1166.80105.3
167H42.4Very low43.1Very low171 Ų171162.4 Ų162.479%0.79279%0.788SS**  trans-43.3140.9163.3-72.4-95.6000113.3
168R38.4Very low42.9Very low248 Ų248157.2 Ų157.294%0.93678%0.778SS**  -162.3101.3127.3-119.3173.1178.4-160.9-1.2112.8
169N41.2Very low42.7Very low136 Ų136156 Ų15673%0.72777%0.769SS**  trans-52.8136.5148-67-52.3000109.5
170R36.5Very low42.3Very low235 Ų235158.1 Ų158.189%0.88777%0.77SS**  157.3111.4127.5-90.9173.3172.1143.4-2.3112.1
171S37.9Very low41.7Very low112 Ų112157.2 Ų157.278%0.78376%0.764SS**  trans46.7107.5134.554.20000119.3
172F41.7Very low41.2Very low193 Ų193163 Ų16385%0.84678%0.777SS**  trans-137.7106.5138.2-166.9-47.8000109.2
173S45.4Very low41.2Very low71 Ų71161 Ų16150%0.49778%0.775SS.*  trans16.2128.3137.180000122.4
174R40.4Very low41.2Very low233 Ų233163.9 Ų163.988%0.87978%0.781SS**  64.4109121.2-63.4176.7171.9164.3-2.7118.4
175S40.8Very low41.5Very low106 Ų106160 Ų16074%0.74179%0.785SS**  91.3136.4121.864.20000120.2
176K41.4Very low41.8Very low187 Ų187161.7 Ų161.781%0.81380%0.795SS**  trans88.9106.1155.6-74.4169170.4169.80119.5
177S42.3Very low42Very low123 Ų123159.3 Ų159.386%0.8680%0.796SS**  -148.681124.5490000107.6
178N40.8Very low42.1Very low130 Ų130161 Ų16170%0.69580%0.802SS**  69.594.379.1-151.735.3000113.1
179S37.5Very low43Very low91 Ų91158.7 Ų158.764%0.63680%0.798SS**  trans-41.4146.214247.30000112.9
180R37Very low43.1Very low226 Ų226161.3 Ų161.385%0.85381%0.806SS**  trans111.2113.4160.3-66.8176.2166.9157.3-3.5116.4
181S39Very low44.2Very low100 Ų100158.5 Ų158.570%0.69981%0.805SS**  101129.6121.372.10000119.8
182R36.5Very low44.5Very low243 Ų243163.1 Ų163.192%0.91781%0.811SS**  trans73.891.1142.2-73168.5172.1165-3.4117.9
183S45.7Very low45Very low118 Ų118157.8 Ų157.883%0.82580%0.802SS**SBendtrans-100.499.5144.944.50000110.1
184K44.9Very low45Very low200 Ų200164 Ų16487%0.8782%0.82SS**  trans62.186.6143-68.3175.1175.6174.70119.2
185S47.6Very low45.6Very low118 Ų118157 Ų15783%0.82581%0.808SS**PPolyproline II helixtrans-69.2130.2144.446.40000110.2
186Q56.2Low45.8Very low184 Ų184163.3 Ų163.386%0.8682%0.815SS**PPolyproline II helixtrans-70.8141.6170.8-71.3-155.5-29.800111.6
187P48.9Very low46.3Very low120 Ų120158.8 Ų158.878%0.77981%0.807SS**PPolyproline II helixtrans-78.1137.5174.231.1-30.9000111.1
188K44.9Very low46.6Very low208 Ų208163.6 Ų163.690%0.90481%0.806SS**PPolyproline II helixtrans-63.1131.3171.2-66.7179.3175-178.50109.8
189K56.8Low47Very low198 Ų198162.8 Ų162.886%0.86181%0.811SS**  trans-82.6110164.8-84.5-178.7174.3179.50108.9
190E43.5Very low47.5Very low191 Ų191162.9 Ų162.989%0.89382%0.817SS**  trans-76.9134.5156.9-92.7178.3133.800109.6
191M58.2Low48Very low177 Ų177157 Ų15787%0.87281%0.811SS**  trans-131115156.9-75.8-165.8167.300109.5
192K46.2Very low48.6Very low209 Ų209160.5 Ų160.591%0.90982%0.816SS**  trans-28155.3149.4-104.3173.4166.6175.60113.2
193A50.4Low49.2Very low80 Ų80153.3 Ų153.366%0.66180%0.799SS**  cis-165.8152.814.800000108.2
194K47.3Very low49.4Very low201 Ų201156.5 Ų156.587%0.87480%0.798SS**  150.5151.5101.7-97.2169.2175.8173.90104.9
195S51.7Low49.7Very low88 Ų88152.5 Ų152.562%0.61579%0.79SS**  cis178.9154.5-19.747.40000105.9
196R46Very low49.6Very low238 Ų238158.6 Ų158.690%0.89880%0.795SS**  trans88.2140.2163.1-56.9172.4169.4169.4-4.2117.2
197S51.5Low49.3Very low92 Ų92153.1 Ų153.164%0.64379%0.788SS**  cis176150.7-4649.20000108
198R47.8Very low49.6Very low224 Ų224153.9 Ų153.985%0.84579%0.791SS**  trans90.6103.8159.5-59.6172.9177.7173-2.6116.1
199S50Low49.9Very low113 Ų113148.7 Ų148.779%0.7978%0.781SS**  68.4136.575.367.90000112.7
200A48.7Very low49.6Very low93 Ų93148 Ų14877%0.76978%0.778SS**  cis-161.5170.824.300000112.1
201S46.8Very low50Low103 Ų103145.1 Ų145.172%0.7277%0.773SS**  trans-49.2156174.555.90000118.4
202H51.7Low49.4Very low173 Ų173143.9 Ų143.980%0.80177%0.77SS**  -175.8166.5104.3-137.656.1000113.3
203T48.7Very low49.8Very low92 Ų92139.1 Ų139.156%0.56476%0.763SS**  trans-93.9174.7-156.350.30000117.8
204K49.8Very low49.6Very low185 Ų185144.1 Ų144.180%0.80477%0.77SS**  trans95.1150.9153.2-60.8175.9-178.41790116.6
205T51.3Low49.9Very low116 Ų116139.3 Ų139.371%0.71276%0.758SS**  cis-173.5163.5-28.137.10000106.1
206R46Very low49.7Very low245 Ų245143.1 Ų143.193%0.92577%0.765SS**  trans79.1120.8163.6-65.6172.4132.2170.9-5.5115.7
207G48.7Very low50Low69 Ų69141 Ų14171%0.71176%0.759SS**  101.5125.963.700000106.4
208T55.2Low50Low136 Ų136146.1 Ų146.183%0.83477%0.77SS**  -173.1143.255.142.60000112.3
209S52.6Low50.3Low99 Ų99141.4 Ų141.469%0.69277%0.771SS**  trans53.5142.8134.673.70000126
210K49.6Very low49.8Very low185 Ų185139.8 Ų139.880%0.80477%0.772SS**  trans101.497.9151.6-65.6-178.3178.4179.10116.3
211T52.4Low50.1Low130 Ų130139 Ų13980%0.79876%0.761SS**  72108.179.560.80000115.8
212D45.4Very low49.9Very low150 Ų150144.6 Ų144.680%0.80277%0.766SS**  trans60.6114.5132.1-131.5-29.2000120.4
213S53.8Low49.7Very low109 Ų109146.1 Ų146.176%0.76277%0.766SS**  177.1107.7127.131.90000113.1
214K47Very low49.7Very low186 Ų186149.6 Ų149.681%0.80978%0.776SS**  trans2.2121.2137.1-154.1172.8-167.81730117.9
215T54.3Low50Low100 Ų100150.9 Ų150.961%0.61378%0.782SS**  trans-138.9128.1153.446.10000112.2Y217T215-Y217 WeakPolarHBondContact CB-OH 3.18Å; T215-Y217 PolarHBondContact OG1-OH 3.13Å
216H47.8Very low50Low167 Ų167153.2 Ų153.277%0.77379%0.785SS**  trans-83.9134173.8-115.3-98.7000109.4
217Y52.3Low49.8Very low193 Ų193146.3 Ų146.376%0.75777%0.774SS**  trans-136.6128.9157.4-27.7-74.6000111.1T215T215-Y217 WeakPolarHBondContact CB-OH 3.18Å; T215-Y217 PolarHBondContact OG1-OH 3.13Å
218K50.4Low50Low201 Ų201153.7 Ų153.787%0.87478%0.78SS**  trans-68.1147.6174.6-75169165.61760112.2
219S54.1Low49.8Very low124 Ų124156.3 Ų156.387%0.86778%0.78SS**  169.5130.9128.844.60000107.6
220G40.6Very low49.9Very low79 Ų79160.6 Ų160.681%0.81479%0.786SS**  cis100.765.218.900000110.8
221S53.1Low49.9Very low77 Ų77160.8 Ų160.854%0.53879%0.79SS.*  trans-146.4102.816264.90000111.9Y223S221-Y223 VanDerWaalsContact OG-CZ 3.24Å; S221-Y223 PolarHBondContact OG-OH 2.69Å
222R44Very low50.5Low220 Ų220159.5 Ų159.583%0.8378%0.784SS**  trans-69131.4163.5174-171.9-89.2176.7-11108.4
223Y47.3Very low51.1Low205 Ų205158.3 Ų158.380%0.80478%0.784SS**  trans-123.893.7163.5-31.8-78.1000108.1S221S221-Y223 VanDerWaalsContact OG-CZ 3.24Å; S221-Y223 PolarHBondContact OG-OH 2.69Å
224E48.1Very low51Low166 Ų166164.5 Ų164.578%0.77679%0.791SS**  trans-83.9136.1154.7-86.6-175.1122.200107.7
225K56.6Low51.4Low211 Ų211160.5 Ų160.592%0.91779%0.786SS**  trans-139.285.5160.8-118.9-175.1-177-177.60110.2
226E50.4Low51.5Low166 Ų166164.8 Ų164.878%0.77680%0.796SS**  trans18.7127.6130.8-149.5169.9150.300120.3
227S43.1Very low51.8Low99 Ų99162 Ų16269%0.69280%0.796SS**  trans-58143.2163.949.30000116.5
228R52.7Low52.1Low224 Ų224162.2 Ų162.285%0.84580%0.803SS**  trans-179.6110.5143.9-101.1162.7-173-142.43.6108.9
229K50.9Low52.3Low192 Ų192157.7 Ų157.784%0.83580%0.797SS**  73.9125.490.1-86.4-169.8-179.8-178.60115.8
230K53.6Low52.3Low188 Ų188163.8 Ų163.882%0.81780%0.801SS**  trans100.6100.3146.3-72179.9173.9-170.10121
231E49.4Very low52.8Low190 Ų190165.1 Ų165.189%0.88880%0.798SS**  65.3149.9120.7-64.7-96.5137.500123.1
232P66.4Low53Low103 Ų103169.8 Ų169.867%0.66981%0.811SS**  trans-111.1177.9-158.141.2-28.9000115.2
233P57.8Low53.4Low124 Ų124164.7 Ų164.781%0.80581%0.809SS**  trans-147.4138.9131.933.3-14.7000117.6
234R50.9Low53.8Low240 Ų240164.8 Ų164.891%0.90681%0.808SS**  trans41140.8132.3-92.3-179.7171.7-160.6-1.4124.9
235S56.6Low53.9Low102 Ų102162.4 Ų162.471%0.71381%0.81SS**  trans94.1136.9144.682.10000116.2
236K55.7Low53.9Low190 Ų190163.5 Ų163.583%0.82681%0.809SS**  cis-150.8135.631.2-75.5173.7178.3168.50113.6
237S54.5Low53.9Low109 Ų109161.1 Ų161.176%0.76281%0.81SS**  trans3.5133.114057.30000121
238Q58.5Low54.6Low196 Ų196166.6 Ų166.692%0.91682%0.822SS**  -159.2129.3117.3-108.3178.8-0.300111.9
239S53.3Low54.7Low106 Ų106161.3 Ų161.374%0.74182%0.819SS**  trans-79.8151.9-177.341.90000112.6
240R55.4Low54.9Low252 Ų252163.5 Ų163.595%0.95182%0.822SS**  trans-175.8103.3133.2-101.8163.1178.5-165.1-0.4112.2
241S51.1Low55.2Low108 Ų108159.8 Ų159.876%0.75582%0.82SS**  trans-75.1134.7160.745.50000111.3
242Q57.5Low55.6Low174 Ų174162.4 Ų162.481%0.81382%0.822SS**  trans-144.797.1151.8-84.6-163.7-18.400111.4
243S51.3Low55.5Low113 Ų113162.9 Ų162.979%0.7983%0.828SS**  trans-73.8122.4154.544.80000109.9
244R56.4Low55.1Low207 Ų207168.2 Ų168.278%0.78183%0.832SS**  trans-147.293.4159.7-74.4-164.4166.6174.6-4.5111.8
245S50.3Low55.9Low117 Ų117163.1 Ų163.182%0.81883%0.828SS**  trans-54.7131.4147.945.40000110.8
246R55.2Low56.2Low233 Ų233163.7 Ų163.788%0.87983%0.831SS**  trans-160.4110155.5-114.7169.9-179.7177.4-0.4111.8
247S51.8Low57.1Low116 Ų116160.7 Ų160.781%0.81183%0.831SS**  trans-49141.9164.5-37.50000112.2
248K58.2Low57.7Low214 Ų214164.9 Ų164.993%0.9384%0.836SS**  trans-152.7101155.7-114.9171.4-176.6178.40111
249S54.6Low57.4Low114 Ų114161.2 Ų161.280%0.79783%0.832SS**  trans-53.7140.6161.8-37.10000111.3
250R54.7Low58Low237 Ų237161.9 Ų161.989%0.89484%0.836SS**  trans-166.185.9150.1-111.2170.5175-175.4-3111.2
251S60.2Low58.3Low111 Ų111153.2 Ų153.278%0.77683%0.826SS**  trans12.3117.7130.6480000118
252R56.3Low58.5Low244 Ų244161 Ų16192%0.92185%0.85SS**  trans-128.2112.4147.2-83-177169.6162.3-3.6108.3
253S64.6Low58.6Low114 Ų114160.3 Ų160.380%0.79785%0.851SS**  trans-70.1145.4-176.936.10000112.4
254W51Low59Low236 Ų236162.8 Ų162.889%0.89486%0.855SS**  trans-86.5133.8165.4-73.458.3000109
255T67.7Low59.1Low133 Ų133160.3 Ų160.382%0.81686%0.859SS**  trans-143.9112.815850.90000109.5
256S62.7Low59.6Low113 Ų113162.9 Ų162.979%0.7986%0.861SS**  trans-118121.1158-60.30000106.5
257P73.7Confident59.9Low127 Ų127158.5 Ų158.583%0.82586%0.86SS**PPolyproline II helixtrans-87.2132.1166.8-3.322.2000109.9
258K67.1Low60.4Low198 Ų198161.3 Ų161.386%0.86186%0.863SS**PPolyproline II helixtrans-68.3150.3170.9-78.2171.8165.3-177.60111.7
259S53.3Low60.6Low119 Ų119157.6 Ų157.683%0.83286%0.858SS**PPolyproline II helixtrans-63.7132.6161.7520000113.5
260S64.4Low61.1Low119 Ų119160.9 Ų160.983%0.83286%0.863SS**  trans-178.5118.1153.551.70000104.6
261G62.2Low61.6Low71 Ų71154.6 Ų154.673%0.73286%0.861SS**  112.892.254.800000106.9
262H56Low61.7Low270 Ų270158.5 Ų158.5100%1.2587%0.868SS**  trans178.50145.9-106-64.7000109.6

Retrieved 262 of 262 residues in 41.9 ms (Link to these results)