A0A061IQB8_CRIGR Loading...

Ubiquitin-ribosomal protein eL40 fusion protein

AlphaFold DB (P0C276), UniProt , Accession A0A061IQB8, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC100757863, Length 128 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
1M94.3Very high94.7Very high55 Ų5565.7 Ų65.727%0.27136%0.358SS..  0148071.5172.9179.800108.8I3 V17 P19 L56 I61 K63M1-I3 HydrophobicContact CE-CG2 4.32Å; M1-V17 HydrophobicContact CE-CG2 3.84Å; M1-V17 HydrophobicContact CG-CG2 3.81Å; M1-V17 VanDerWaalsContact CG-O 3.26Å; M1-V17 WeakPolarHBondContact CG-O 3.47Å; M1-V17 PolarHBondContact N-O 2.93Å; M1-V17 PolarHBondContact O-N 3.46Å; M1-V17 VanDerWaalsContact O-O 3.08Å; M1-P19 HydrophobicContact CE-CB 4.44Å; M1-P19 HydrophobicContact CE-CG 4.22Å; M1-P19 HydrophobicContact SD-CG 4.06Å; M1-L56 HydrophobicContact CE-CB 4.26Å; M1-L56 HydrophobicContact CE-CD1 3.85Å; M1-I61 WeakPolarHBondContact CE-O 3.41Å; M1-K63 HydrophobicContact CB-CB 4.42Å
2Q95Very high94.8Very high70 Ų7066 Ų6633%0.32736%0.363SS..EExtended strand (participates in β ladder)trans-98133.6-178.7-164.517334.900111L15 E64Q2-L15 WeakPolarHBondContact CA-O 3.46Å; Q2-E64 PolarHBondContact O-N 3.39Å
3I97.2Very high94.9Very high0 Ų061.7 Ų61.70%034%0.339CS..EExtended strand (participates in β ladder)trans-126.6160.917361.4169.6000110.4M1 L15 V17 V26 L56 I61 L67M1-I3 HydrophobicContact CE-CG2 4.32Å; I3-L15 HydrophobicContact CD1-CB 4.46Å; I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 3.49Å; I3-L15 PolarHBondContact O-N 3.47Å; I3-V17 HydrophobicContact CB-CG2 4.41Å; I3-V17 HydrophobicContact CD1-CB 4.44Å; I3-V17 HydrophobicContact CD1-CG1 3.88Å; I3-V17 HydrophobicContact CD1-CG2 3.76Å; I3-V17 HydrophobicContact CG1-CG1 4.16Å; I3-V17 HydrophobicContact CG1-CG2 3.75Å; I3-V17 HydrophobicContact CG2-CG2 3.87Å; I3-V26 HydrophobicContact CD1-CG1 4.44Å; I3-L56 HydrophobicContact CD1-CD1 4.45Å; I3-I61 HydrophobicContact CG2-CG2 4.16Å; I3-L67 HydrophobicContact CB-CD1 4.46Å; I3-L67 HydrophobicContact CD1-CD1 3.69Å
4F97.5Very high95Very high57 Ų5761.5 Ų61.525%0.2534%0.341CS..EExtended strand (participates in β ladder)trans-111.6140.4177.7-58.1-77.1000110.9T12 I13 T14 E64 S65 T66 L67F4-T12 HydrophobicContact CB-CG2 4.01Å; F4-T12 HydrophobicContact CD1-CG2 3.93Å; F4-T12 HydrophobicContact CG-CG2 4.35Å; F4-I13 CarbonylContact C-O 3.54Å; F4-I13 WeakPolarHBondContact CA-O 3.29Å; F4-T14 HydrophobicContact CD1-CG2 3.75Å; F4-T14 HydrophobicContact CE1-CG2 3.61Å; F4-E64 HydrophobicContact CE2-CB 4Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; F4-S65 PolarHBondContact N-O 2.8Å; F4-T66 HydrophobicContact CB-CG2 4.39Å; F4-T66 CarbonylContact O-C 3.57Å; F4-T66 WeakPolarHBondContact O-CA 3.45Å; F4-L67 PolarHBondContact O-N 2.9Å
5V97.2Very high95.1Very high0 Ų057.5 Ų57.50%032%0.319CS..EExtended strand (participates in β ladder)trans-121.3116.9172.8-1780000108.5T12 I13 L15 I30 L43 L67 L69V5-T12 CarbonylContact O-C 3.56Å; V5-T12 WeakPolarHBondContact O-CA 3.44Å; V5-I13 HydrophobicContact CB-CB 4.38Å; V5-I13 PolarHBondContact N-O 3.14Å; V5-I13 PolarHBondContact O-N 2.96Å; V5-L15 HydrophobicContact CG2-CD1 3.59Å; V5-L15 HydrophobicContact CG2-CG 4.37Å; V5-I30 HydrophobicContact CG1-CD1 4.26Å; V5-I30 HydrophobicContact CG2-CD1 4.22Å; V5-L43 HydrophobicContact CG1-CD2 4.27Å; V5-L67 CarbonylContact C-O 3.58Å; V5-L67 WeakPolarHBondContact CA-O 3.46Å; V5-L67 HydrophobicContact CG2-CB 4.42Å; V5-L69 HydrophobicContact CG1-CB 3.54Å; V5-L69 HydrophobicContact CG1-CD2 4.48Å
6K97.2Very high95.2Very high90 Ų9062.1 Ų62.139%0.39134%0.337SS..EExtended strand (participates in β ladder)trans-95.9126.9175.3-76.2-174-179.7179.60110.7K11 T12 T66 L67 H68 L69K6-K11 WeakPolarHBondContact CA-O 3.45Å; K6-T12 HydrophobicContact CG-CG2 4.32Å; K6-T66 HydrophobicContact CB-CG2 4.32Å; K6-T66 HydrophobicContact CD-CG2 3.78Å; K6-T66 HydrophobicContact CG-CG2 3.77Å; K6-L67 PolarHBondContact N-O 3.19Å; K6-H68 CarbonylContact O-C 3.57Å; K6-H68 WeakPolarHBondContact O-CA 3.4Å; K6-L69 PolarHBondContact O-N 2.75Å
7T94.4Very high95.2Very high24 Ų2458.6 Ų58.615%0.14732%0.318CS..EExtended strand (participates in β ladder)trans-81.3164.8171.7680000110.7T9 G10 K11 I13 L69T7-T9 PolarHBondContact O-N 3.48Å; T7-T9 VanDerWaalsContact O-N 3.16Å; T7-T9 PolarHBondContact OG1-N 3.24Å; T7-T9 PolarHBondContact OG1-OG1 2.92Å; T7-G10 PolarHBondContact O-N 3.34Å; T7-K11 HydrophobicContact CG2-CB 4.36Å; T7-K11 PolarHBondContact N-O 3.17Å; T7-K11 WeakPolarHBondContact OG1-CB 3.27Å; T7-K11 PolarHBondContact OG1-N 3.28Å; T7-K11 PolarHBondContact OG1-O 2.94Å; T7-I13 HydrophobicContact CG2-CD1 4.06Å; T7-L69 HydrophobicContact CG2-CD2 4.34Å
8L91.3Very high95.3Very high140 Ų14062.1 Ų62.173%0.73333%0.332SS*.THydrogen-bonded Turntrans-58.1-23.9171.2-68.7-179.4000113.9G10 V70L8-G10 VanDerWaalsContact C-N 3.26Å; L8-G10 PolarHBondContact O-N 3.2Å; L8-V70 HydrophobicContact CD1-CG1 3.9Å; L8-V70 HydrophobicContact CD2-CG1 4.36Å; L8-V70 HydrophobicContact CD2-CG2 4.27Å; L8-V70 HydrophobicContact CG-CG1 4.3Å
9T91.3Very high95.2Very high127 Ų12762.3 Ų62.378%0.77934%0.337SS*.THydrogen-bonded Turntrans-83.90.6178.356.10000113.2T7 K11T7-T9 PolarHBondContact O-N 3.48Å; T7-T9 VanDerWaalsContact O-N 3.16Å; T7-T9 PolarHBondContact OG1-N 3.24Å; T7-T9 PolarHBondContact OG1-OG1 2.92Å; T9-K11 VanDerWaalsContact C-N 3.32Å
10G91.5Very high95.2Very high57 Ų5762.9 Ų62.959%0.58835%0.346SS*.SBendtrans84.10.1-178.300000114.7T7 L8T7-G10 PolarHBondContact O-N 3.34Å; L8-G10 VanDerWaalsContact C-N 3.26Å; L8-G10 PolarHBondContact O-N 3.2Å
11K94.6Very high95.3Very high103 Ų10360.9 Ų60.945%0.44834%0.335SS..  trans-68.4133.7173.6-174.4-179.2172.4-169.70109.4K6 T7 T9 E34K6-K11 WeakPolarHBondContact CA-O 3.45Å; T7-K11 HydrophobicContact CG2-CB 4.36Å; T7-K11 PolarHBondContact N-O 3.17Å; T7-K11 WeakPolarHBondContact OG1-CB 3.27Å; T7-K11 PolarHBondContact OG1-N 3.28Å; T7-K11 PolarHBondContact OG1-O 2.94Å; T9-K11 VanDerWaalsContact C-N 3.32Å; K11-E34 WeakPolarHBondContact CE-OE1 3.25Å; K11-E34 IonicContact NZ-OE1 2.75Å; K11-E34 PolarHBondContact NZ-OE1 3.45Å; K11-E34 IonicContact NZ-OE2 2.75Å; K11-E34 PolarHBondContact NZ-OE2 2.91Å
12T96.4Very high95.4Very high69 Ų6960 Ų6042%0.42333%0.333SS..EExtended strand (participates in β ladder)trans-108128.6176-55.70000109.6F4 V5 K6F4-T12 HydrophobicContact CB-CG2 4.01Å; F4-T12 HydrophobicContact CD1-CG2 3.93Å; F4-T12 HydrophobicContact CG-CG2 4.35Å; V5-T12 CarbonylContact O-C 3.56Å; V5-T12 WeakPolarHBondContact O-CA 3.44Å; K6-T12 HydrophobicContact CG-CG2 4.32Å
13I95.5Very high95.5Very high10 Ų1056.7 Ų56.75%0.05132%0.317CS..EExtended strand (participates in β ladder)trans-112.3134179.1-55154.8000107.7F4 V5 T7 L15 K33 E34F4-I13 CarbonylContact C-O 3.54Å; F4-I13 WeakPolarHBondContact CA-O 3.29Å; V5-I13 HydrophobicContact CB-CB 4.38Å; V5-I13 PolarHBondContact N-O 3.14Å; V5-I13 PolarHBondContact O-N 2.96Å; T7-I13 HydrophobicContact CG2-CD1 4.06Å; I13-L15 HydrophobicContact CG2-CD2 4.3Å; I13-L15 HydrophobicContact CG2-CG 4.49Å; I13-K33 HydrophobicContact CG2-CD 3.97Å; I13-E34 HydrophobicContact CD1-CG 3.4Å; I13-E34 HydrophobicContact CG1-CG 4.28Å
14T96.5Very high95.5Very high59 Ų5962.3 Ų62.336%0.36234%0.344SS..EExtended strand (participates in β ladder)trans-93.8136173.753.20000110.1F4 K33F4-T14 HydrophobicContact CD1-CG2 3.75Å; F4-T14 HydrophobicContact CE1-CG2 3.61Å; T14-K33 PolarHBondContact O-NZ 2.85Å
15L96.4Very high95.4Very high2 Ų263.1 Ų63.11%0.0135%0.351CS..EExtended strand (participates in β ladder)trans-128.5137.6176.1-63172.8000111Q2 I3 V5 I13 V17 V26 K29 I30 K33Q2-L15 WeakPolarHBondContact CA-O 3.46Å; I3-L15 HydrophobicContact CD1-CB 4.46Å; I3-L15 HydrophobicContact CG1-CB 3.95Å; I3-L15 PolarHBondContact N-O 3.49Å; I3-L15 PolarHBondContact O-N 3.47Å; V5-L15 HydrophobicContact CG2-CD1 3.59Å; V5-L15 HydrophobicContact CG2-CG 4.37Å; I13-L15 HydrophobicContact CG2-CD2 4.3Å; I13-L15 HydrophobicContact CG2-CG 4.49Å; L15-V17 HydrophobicContact CB-CG1 4.07Å; L15-V26 HydrophobicContact CD1-CG1 4.12Å; L15-K29 HydrophobicContact CD2-CB 4.26Å; L15-I30 HydrophobicContact CD1-CD1 4.13Å; L15-I30 HydrophobicContact CD1-CG1 3.59Å; L15-K33 HydrophobicContact CD2-CD 3.82Å
16E96.2Very high95.4Very high131 Ų13163.1 Ų63.161%0.61235%0.351SS*.EExtended strand (participates in β ladder)trans-89.7116.8167.5-79.5-74.5163.200108.6K29E16-K29 PolarHBondContact O-NZ 3Å
17V96.4Very high95.4Very high3 Ų359 Ų592%0.01833%0.332CS..  trans-138157.6-174.6-60.80000111.8M1 I3 L15 D21 V26 K29 L56M1-V17 HydrophobicContact CE-CG2 3.84Å; M1-V17 HydrophobicContact CG-CG2 3.81Å; M1-V17 VanDerWaalsContact CG-O 3.26Å; M1-V17 WeakPolarHBondContact CG-O 3.47Å; M1-V17 PolarHBondContact N-O 2.93Å; M1-V17 PolarHBondContact O-N 3.46Å; M1-V17 VanDerWaalsContact O-O 3.08Å; I3-V17 HydrophobicContact CB-CG2 4.41Å; I3-V17 HydrophobicContact CD1-CB 4.44Å; I3-V17 HydrophobicContact CD1-CG1 3.88Å; I3-V17 HydrophobicContact CD1-CG2 3.76Å; I3-V17 HydrophobicContact CG1-CG1 4.16Å; I3-V17 HydrophobicContact CG1-CG2 3.75Å; I3-V17 HydrophobicContact CG2-CG2 3.87Å; L15-V17 HydrophobicContact CB-CG1 4.07Å; V17-D21 WeakPolarHBondContact CA-OD2 3.39Å; V17-V26 HydrophobicContact CG1-CG2 4.25Å; V17-K29 HydrophobicContact CG1-CD 4.21Å; V17-L56 HydrophobicContact CB-CD1 3.72Å; V17-L56 HydrophobicContact CG1-CD1 4.32Å; V17-L56 HydrophobicContact CG2-CD1 3.5Å; V17-L56 VanDerWaalsContact CG2-CD1 3.5Å
18E96.1Very high95.4Very high121 Ų12159.6 Ų59.657%0.56534%0.34SS*.  trans-102.3149.4168.2-63.9-164.916200110.7S20 D21E18-S20 WeakPolarHBondContact CB-OG 3.49Å; E18-S20 PolarHBondContact O-N 3.48Å; E18-S20 VanDerWaalsContact O-N 3.14Å; E18-S20 PolarHBondContact OE2-OG 3.44Å; E18-D21 PolarHBondContact N-OD2 3.09Å; E18-D21 VanDerWaalsContact O-CB 3.27Å; E18-D21 WeakPolarHBondContact O-CB 3.49Å; E18-D21 PolarHBondContact O-N 3.19Å
19P94.5Very high95.7Very high65 Ų6556.1 Ų56.142%0.42232%0.319SS..THydrogen-bonded Turntrans-58.2-26.5176.8-23.133.1000113.8M1 D21 S57M1-P19 HydrophobicContact CE-CB 4.44Å; M1-P19 HydrophobicContact CE-CG 4.22Å; M1-P19 HydrophobicContact SD-CG 4.06Å; P19-D21 VanDerWaalsContact C-N 3.33Å; P19-S57 WeakPolarHBondContact O-CB 3.35Å; P19-S57 PolarHBondContact O-N 2.83Å; P19-S57 PolarHBondContact O-OG 3.24Å
20S95.5Very high95.9Very high75 Ų7550.1 Ų50.152%0.52428%0.282SS..THydrogen-bonded Turntrans-75.6-14.4174.743.10000113.8E18 T22 T55E18-S20 WeakPolarHBondContact CB-OG 3.49Å; E18-S20 PolarHBondContact O-N 3.48Å; E18-S20 VanDerWaalsContact O-N 3.14Å; E18-S20 PolarHBondContact OE2-OG 3.44Å; S20-T22 PolarHBondContact O-N 3.25Å; S20-T55 WeakPolarHBondContact O-CG2 3.26Å
21D96.6Very high96.1Very high20 Ų2051.1 Ų51.111%0.10727%0.272CS..  trans-61132.9179.3-81.5-29000109.9V17 E18 P19 N25 V26 K29 T55 L56V17-D21 WeakPolarHBondContact CA-OD2 3.39Å; E18-D21 PolarHBondContact N-OD2 3.09Å; E18-D21 VanDerWaalsContact O-CB 3.27Å; E18-D21 WeakPolarHBondContact O-CB 3.49Å; E18-D21 PolarHBondContact O-N 3.19Å; P19-D21 VanDerWaalsContact C-N 3.33Å; D21-N25 HydrophobicContact CB-CB 4.41Å; D21-V26 HydrophobicContact CB-CG2 4.3Å; D21-K29 IonicContact OD2-NZ 2.79Å; D21-K29 PolarHBondContact OD2-NZ 3.34Å; D21-T55 CarbonylContact O-C 3.55Å; D21-T55 VanDerWaalsContact O-CA 3.29Å; D21-T55 WeakPolarHBondContact O-CA 3.33Å; D21-L56 HydrophobicContact CB-CD1 4.29Å; D21-L56 PolarHBondContact O-N 3.4Å
22T97Very high96.1Very high38 Ų3852.8 Ų52.823%0.23329%0.285CS..BIsolated β-bridgetrans-71.2157.1170.461.40000110.8S20 E24 N25 V26 R54 T55S20-T22 PolarHBondContact O-N 3.25Å; T22-E24 PolarHBondContact O-N 3.05Å; T22-N25 WeakPolarHBondContact O-CB 3.33Å; T22-N25 PolarHBondContact O-N 3.47Å; T22-N25 VanDerWaalsContact O-N 3.09Å; T22-N25 PolarHBondContact OG1-N 2.79Å; T22-N25 PolarHBondContact OG1-ND2 2.9Å; T22-N25 PolarHBondContact OG1-OD1 3.19Å; T22-V26 WeakPolarHBondContact O-CG2 3.37Å; T22-V26 PolarHBondContact O-N 3.3Å; T22-R54 CarbonylContact C-O 3.56Å; T22-R54 WeakPolarHBondContact CA-O 3.44Å; T22-T55 HydrophobicContact CG2-CG2 4.37Å
23I97.1Very high95.9Very high0 Ų054.9 Ų54.90%029%0.289CS..Hα-helixtrans-61.1-32.5173.9-61.4-54.3000111.3V26 K27 L43 L50 E51 R54 L56 Y59I23-V26 PolarHBondContact O-N 2.93Å; I23-K27 WeakPolarHBondContact O-CG 3.29Å; I23-K27 PolarHBondContact O-N 3.03Å; I23-L43 HydrophobicContact CG2-CD1 4.24Å; I23-L50 HydrophobicContact CD1-CB 4.11Å; I23-L50 HydrophobicContact CD1-CD1 3.62Å; I23-L50 HydrophobicContact CD1-CG 4.46Å; I23-L50 HydrophobicContact CG1-CB 3.98Å; I23-L50 HydrophobicContact CG1-CD1 4.42Å; I23-L50 HydrophobicContact CG2-CB 3.89Å; I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 3.38Å; I23-E51 WeakPolarHBondContact CG1-O 3.34Å; I23-R54 WeakPolarHBondContact CG1-O 3.35Å; I23-R54 PolarHBondContact N-O 2.62Å; I23-L56 HydrophobicContact CD1-CD2 3.85Å; I23-Y59 HydrophobicContact CD1-CD2 4.34Å; I23-Y59 HydrophobicContact CD1-CE2 4.49Å; I23-Y59 HydrophobicContact CG1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CE2 4.14Å
24E96.6Very high95.7Very high118 Ų11857.4 Ų57.455%0.55130%0.3SS*.Hα-helixtrans-59.6-46.9171.3-171.7168.4-153.200112.3T22 V26 K27 A28 D52T22-E24 PolarHBondContact O-N 3.05Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 3.28Å; E24-K27 WeakPolarHBondContact O-CB 3.33Å; E24-K27 PolarHBondContact O-N 3.28Å; E24-K27 VanDerWaalsContact O-N 3.17Å; E24-A28 PolarHBondContact O-N 3.37Å; E24-D52 HydrophobicContact CB-CB 4.28Å; E24-D52 PolarHBondContact N-O 3.05Å
25N96Very high95.5Very high74 Ų7457.4 Ų57.440%0.39631%0.312SS..Hα-helixtrans-61.3-40.6176.4-67.9-6.1000111.7D21 T22 K27 A28 K29D21-N25 HydrophobicContact CB-CB 4.41Å; T22-N25 WeakPolarHBondContact O-CB 3.33Å; T22-N25 PolarHBondContact O-N 3.47Å; T22-N25 VanDerWaalsContact O-N 3.09Å; T22-N25 PolarHBondContact OG1-N 2.79Å; T22-N25 PolarHBondContact OG1-ND2 2.9Å; T22-N25 PolarHBondContact OG1-OD1 3.19Å; N25-K27 VanDerWaalsContact C-N 3.33Å; N25-K27 PolarHBondContact O-N 2.9Å; N25-A28 WeakPolarHBondContact O-CB 3.37Å; N25-A28 PolarHBondContact O-N 2.95Å; N25-K29 WeakPolarHBondContact O-CG 3.45Å; N25-K29 PolarHBondContact O-N 2.73Å
26V96.3Very high95.3Very high0 Ų058.8 Ų58.80%032%0.319CS..Hα-helixtrans-63.1-40.4176.8177.50000111.1I3 L15 V17 D21 T22 I23 E24 K29 I30 L43 L56I3-V26 HydrophobicContact CD1-CG1 4.44Å; L15-V26 HydrophobicContact CD1-CG1 4.12Å; V17-V26 HydrophobicContact CG1-CG2 4.25Å; D21-V26 HydrophobicContact CB-CG2 4.3Å; T22-V26 WeakPolarHBondContact O-CG2 3.37Å; T22-V26 PolarHBondContact O-N 3.3Å; I23-V26 PolarHBondContact O-N 2.93Å; E24-V26 VanDerWaalsContact C-N 3.31Å; E24-V26 PolarHBondContact O-N 3.28Å; V26-K29 PolarHBondContact O-N 3Å; V26-I30 HydrophobicContact CG1-CD1 4.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.41Å; V26-I30 PolarHBondContact O-N 2.87Å; V26-L43 HydrophobicContact CB-CD1 4.45Å; V26-L43 HydrophobicContact CG1-CD1 3.92Å; V26-L56 HydrophobicContact CG2-CD1 3.91Å; V26-L56 HydrophobicContact CG2-CD2 4.06Å; V26-L56 HydrophobicContact CG2-CG 4.06Å
27K96.4Very high95.1Very high2 Ų254.5 Ų54.51%0.00930%0.303CS..Hα-helixtrans-65.7-37.3175.8-72.1173.5170.5-171.90112.9I23 E24 N25 I30 Q31 P38 Q41 L43 D52I23-K27 WeakPolarHBondContact O-CG 3.29Å; I23-K27 PolarHBondContact O-N 3.03Å; E24-K27 WeakPolarHBondContact O-CB 3.33Å; E24-K27 PolarHBondContact O-N 3.28Å; E24-K27 VanDerWaalsContact O-N 3.17Å; N25-K27 VanDerWaalsContact C-N 3.33Å; N25-K27 PolarHBondContact O-N 2.9Å; K27-I30 WeakPolarHBondContact O-CB 3.49Å; K27-I30 PolarHBondContact O-N 3.47Å; K27-Q31 PolarHBondContact O-N 3.22Å; K27-P38 HydrophobicContact CB-CB 3.88Å; K27-P38 HydrophobicContact CD-CB 4.39Å; K27-Q41 HydrophobicContact CD-CB 4.34Å; K27-Q41 HydrophobicContact CG-CB 4.21Å; K27-Q41 PolarHBondContact NZ-O 2.91Å; K27-Q41 PolarHBondContact O-NE2 3.25Å; K27-Q41 PolarHBondContact O-OE1 3.34Å; K27-L43 HydrophobicContact CG-CD1 3.85Å; K27-L43 HydrophobicContact CG-CG 4.4Å; K27-D52 WeakPolarHBondContact CD-OD1 3.41Å; K27-D52 WeakPolarHBondContact CE-OD1 3.45Å; K27-D52 IonicContact NZ-OD1 3.03Å; K27-D52 PolarHBondContact NZ-OD1 2.93Å; K27-D52 IonicContact NZ-OD2 2.63Å; K27-D52 PolarHBondContact NZ-OD2 3.44Å
28A96.2Very high94.9Very high38 Ų3856.1 Ų56.131%0.31431%0.313SS..Hα-helixtrans-61.2-45.5172.900000110.9E24 N25 I30 Q31 D32E24-A28 PolarHBondContact O-N 3.37Å; N25-A28 WeakPolarHBondContact O-CB 3.37Å; N25-A28 PolarHBondContact O-N 2.95Å; A28-I30 VanDerWaalsContact C-N 3.25Å; A28-I30 PolarHBondContact O-N 3.27Å; A28-Q31 WeakPolarHBondContact O-CA 3.17Å; A28-Q31 VanDerWaalsContact O-CB 3.25Å; A28-Q31 WeakPolarHBondContact O-CB 3.48Å; A28-Q31 PolarHBondContact O-N 3.11Å; A28-D32 PolarHBondContact O-N 3.3Å
29K96.3Very high94.6Very high67 Ų6753.3 Ų53.329%0.29130%0.302SS..Hα-helixtrans-60.1-33.8174.6-69.2176.9176.3-179.50113.1L15 E16 V17 D21 N25 V26 K33L15-K29 HydrophobicContact CD2-CB 4.26Å; E16-K29 PolarHBondContact O-NZ 3Å; V17-K29 HydrophobicContact CG1-CD 4.21Å; D21-K29 IonicContact OD2-NZ 2.79Å; D21-K29 PolarHBondContact OD2-NZ 3.34Å; N25-K29 WeakPolarHBondContact O-CG 3.45Å; N25-K29 PolarHBondContact O-N 2.73Å; V26-K29 PolarHBondContact O-N 3Å; K29-K33 PolarHBondContact O-N 3.39Å
30I95.9Very high94.5Very high0 Ų053.9 Ų53.90%030%0.299CS..Hα-helixtrans-70.2-38.8173.3-67.5166.9000111V5 L15 V26 K27 A28 D32 K33 E34 L43 L69V5-I30 HydrophobicContact CG1-CD1 4.26Å; V5-I30 HydrophobicContact CG2-CD1 4.22Å; L15-I30 HydrophobicContact CD1-CD1 4.13Å; L15-I30 HydrophobicContact CD1-CG1 3.59Å; V26-I30 HydrophobicContact CG1-CD1 4.29Å; V26-I30 WeakPolarHBondContact O-CG1 3.41Å; V26-I30 PolarHBondContact O-N 2.87Å; K27-I30 WeakPolarHBondContact O-CB 3.49Å; K27-I30 PolarHBondContact O-N 3.47Å; A28-I30 VanDerWaalsContact C-N 3.25Å; A28-I30 PolarHBondContact O-N 3.27Å; I30-D32 VanDerWaalsContact C-N 3.31Å; I30-D32 PolarHBondContact O-N 3.01Å; I30-K33 PolarHBondContact O-N 2.76Å; I30-E34 PolarHBondContact O-N 3Å; I30-L43 HydrophobicContact CD1-CD1 4.05Å; I30-L43 HydrophobicContact CD1-CD2 3.69Å; I30-L43 HydrophobicContact CD1-CG 4.38Å; I30-L69 HydrophobicContact CG2-CD2 3.9Å
31Q95Very high94.4Very high78 Ų7850.3 Ų50.336%0.36427%0.274SS..Hα-helixtrans-58.8-44.1175.1-179.5-173.90.700110.8K27 A28 K33 G35 I36K27-Q31 PolarHBondContact O-N 3.22Å; A28-Q31 WeakPolarHBondContact O-CA 3.17Å; A28-Q31 VanDerWaalsContact O-CB 3.25Å; A28-Q31 WeakPolarHBondContact O-CB 3.48Å; A28-Q31 PolarHBondContact O-N 3.11Å; Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 3.18Å; Q31-G35 WeakPolarHBondContact O-CA 3.5Å; Q31-G35 PolarHBondContact O-N 3.47Å; Q31-I36 WeakPolarHBondContact CA-O 3.49Å; Q31-I36 VanDerWaalsContact CB-O 3.28Å; Q31-I36 WeakPolarHBondContact CB-O 3.38Å; Q31-I36 WeakPolarHBondContact CG-O 3.11Å
32D94.4Very high94.3Very high138 Ų13854.5 Ų54.574%0.73829%0.289SS*.Hα-helixtrans-63.6-31.9179.9-64.1-32000112.8A28 I30A28-D32 PolarHBondContact O-N 3.3Å; I30-D32 VanDerWaalsContact C-N 3.31Å; I30-D32 PolarHBondContact O-N 3.01Å
33K93.5Very high94.3Very high113 Ų11352.8 Ų52.849%0.49128%0.278SS..Hα-helixtrans-87.6-40.9-178.9-69.1-162.5179.1-164.60114.5I13 T14 L15 K29 I30 Q31I13-K33 HydrophobicContact CG2-CD 3.97Å; T14-K33 PolarHBondContact O-NZ 2.85Å; L15-K33 HydrophobicContact CD2-CD 3.82Å; K29-K33 PolarHBondContact O-N 3.39Å; I30-K33 PolarHBondContact O-N 2.76Å; Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 3.18Å
34E91.5Very high94.3Very high63 Ų6355.2 Ų55.229%0.29429%0.29SS..Hα-helixtrans-110.1-8.7-173.7-64.2-66.6125.200113.5K11 I13 I30 I36K11-E34 WeakPolarHBondContact CE-OE1 3.25Å; K11-E34 IonicContact NZ-OE1 2.75Å; K11-E34 PolarHBondContact NZ-OE1 3.45Å; K11-E34 IonicContact NZ-OE2 2.75Å; K11-E34 PolarHBondContact NZ-OE2 2.91Å; I13-E34 HydrophobicContact CD1-CG 3.4Å; I13-E34 HydrophobicContact CG1-CG 4.28Å; I30-E34 PolarHBondContact O-N 3Å; E34-I36 VanDerWaalsContact C-N 3.26Å; E34-I36 HydrophobicContact CB-CD1 3.74Å; E34-I36 HydrophobicContact CB-CG1 4.06Å; E34-I36 HydrophobicContact CG-CD1 4.5Å; E34-I36 PolarHBondContact O-N 2.9Å
35G91.9Very high94.3Very high59 Ų5951.8 Ų51.861%0.60827%0.274SS*.  trans73.711.4-177.200000114.6Q31 P37Q31-G35 WeakPolarHBondContact O-CA 3.5Å; Q31-G35 PolarHBondContact O-N 3.47Å; G35-P37 WeakPolarHBondContact O-CD 3.17Å
36I91.1Very high94.2Very high32 Ų3252.5 Ų52.516%0.16429%0.29CS..  trans-88.6121.3-176-60.1160000109.6Q31 E34 Q40 Q41 L69 L71Q31-I36 WeakPolarHBondContact CA-O 3.49Å; Q31-I36 VanDerWaalsContact CB-O 3.28Å; Q31-I36 WeakPolarHBondContact CB-O 3.38Å; Q31-I36 WeakPolarHBondContact CG-O 3.11Å; E34-I36 VanDerWaalsContact C-N 3.26Å; E34-I36 HydrophobicContact CB-CD1 3.74Å; E34-I36 HydrophobicContact CB-CG1 4.06Å; E34-I36 HydrophobicContact CG-CD1 4.5Å; E34-I36 PolarHBondContact O-N 2.9Å; I36-Q40 HydrophobicContact CG2-CB 4.23Å; I36-Q41 HydrophobicContact CB-CG 4.35Å; I36-Q41 HydrophobicContact CG2-CG 3.64Å; I36-Q41 PolarHBondContact O-NE2 3.01Å; I36-L69 HydrophobicContact CD1-CD2 4.18Å; I36-L71 HydrophobicContact CD1-CD2 4.13Å; I36-L71 HydrophobicContact CG1-CD2 4.5Å; I36-L71 HydrophobicContact CG2-CD2 3.57Å
37P92.4Very high94.1Very high41 Ų4156.2 Ų56.227%0.26633%0.328SS..  trans-57.7139.2177.2-27.836.9000113.6G35 D39 Q40 Q41G35-P37 WeakPolarHBondContact O-CD 3.17Å; P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 PolarHBondContact O-N 2.99Å; P37-D39 VanDerWaalsContact O-N 3.14Å; P37-Q40 HydrophobicContact CB-CG 4.19Å; P37-Q40 HydrophobicContact CG-CG 4.49Å; P37-Q40 WeakPolarHBondContact O-CA 3.28Å; P37-Q40 WeakPolarHBondContact O-CB 3.43Å; P37-Q40 PolarHBondContact O-N 3.24Å; P37-Q41 WeakPolarHBondContact O-CG 3.37Å; P37-Q41 PolarHBondContact O-N 3.17Å
38P93Very high94Very high37 Ų3762.9 Ų62.924%0.2436%0.357CS..G310 helixtrans-57.6-32.2-175.2-28.235.9000114.3K27 Q40 Q41K27-P38 HydrophobicContact CB-CB 3.88Å; K27-P38 HydrophobicContact CD-CB 4.39Å; P38-Q40 VanDerWaalsContact C-N 3.27Å; P38-Q40 PolarHBondContact O-N 3.39Å; P38-Q41 WeakPolarHBondContact O-CB 3.45Å; P38-Q41 PolarHBondContact O-N 3.05Å; P38-Q41 VanDerWaalsContact O-N 3.1Å
39D90Very high94Very high62 Ų6265.3 Ų65.333%0.33236%0.362SS..G310 helixtrans-73.8-20.3-18071.9-28.1000112.5P37 R72 R74P37-D39 WeakPolarHBondContact CB-OD1 3.48Å; P37-D39 PolarHBondContact O-N 2.99Å; P37-D39 VanDerWaalsContact O-N 3.14Å; D39-R72 WeakPolarHBondContact O-CD 3.42Å; D39-R72 PolarHBondContact O-NH1 3.25Å; D39-R74 VanDerWaalsContact CB-NH2 3.33Å; D39-R74 VanDerWaalsContact CG-NH2 3.31Å; D39-R74 IonicContact OD2-CZ 2.62Å; D39-R74 IonicContact OD2-NH1 2.65Å; D39-R74 PolarHBondContact OD2-NH1 2.95Å; D39-R74 IonicContact OD2-NH2 3.44Å; D39-R74 PolarHBondContact OD2-NH2 3.03Å
40Q91.1Very high94Very high77 Ų7762.2 Ų62.236%0.3635%0.348SS..G310 helixtrans-87-9.7169.2-60.6-177.83.300112.8I36 P37 P38 L71 R72I36-Q40 HydrophobicContact CG2-CB 4.23Å; P37-Q40 HydrophobicContact CB-CG 4.19Å; P37-Q40 HydrophobicContact CG-CG 4.49Å; P37-Q40 WeakPolarHBondContact O-CA 3.28Å; P37-Q40 WeakPolarHBondContact O-CB 3.43Å; P37-Q40 PolarHBondContact O-N 3.24Å; P38-Q40 VanDerWaalsContact C-N 3.27Å; P38-Q40 PolarHBondContact O-N 3.39Å; Q40-L71 CarbonylContact O-C 3.57Å; Q40-L71 WeakPolarHBondContact O-CA 3.15Å; Q40-R72 PolarHBondContact O-N 2.79Å
41Q94Very high94Very high0 Ų067.1 Ų67.10%037%0.371CS..EExtended strand (participates in β ladder)trans-91.3136.8-178.3-60.2177.833.500112.2K27 I36 P37 P38 L69 R72K27-Q41 HydrophobicContact CD-CB 4.34Å; K27-Q41 HydrophobicContact CG-CB 4.21Å; K27-Q41 PolarHBondContact NZ-O 2.91Å; K27-Q41 PolarHBondContact O-NE2 3.25Å; K27-Q41 PolarHBondContact O-OE1 3.34Å; I36-Q41 HydrophobicContact CB-CG 4.35Å; I36-Q41 HydrophobicContact CG2-CG 3.64Å; I36-Q41 PolarHBondContact O-NE2 3.01Å; P37-Q41 WeakPolarHBondContact O-CG 3.37Å; P37-Q41 PolarHBondContact O-N 3.17Å; P38-Q41 WeakPolarHBondContact O-CB 3.45Å; P38-Q41 PolarHBondContact O-N 3.05Å; P38-Q41 VanDerWaalsContact O-N 3.1Å; Q41-L69 HydrophobicContact CB-CD1 3.79Å; Q41-L69 HydrophobicContact CG-CD1 3.96Å; Q41-R72 PolarHBondContact O-NH1 2.9Å
42R94.5Very high93.9Very high108 Ų10866.2 Ų66.241%0.40837%0.369SS..EExtended strand (participates in β ladder)trans-120.3119.8161.2-84.2178.4172.1-177.4-0.2109.3V70 R72R42-V70 WeakPolarHBondContact CA-O 3.49Å; R42-V70 HydrophobicContact CB-CB 4.33Å; R42-V70 WeakPolarHBondContact CB-O 3.4Å; R42-V70 PolarHBondContact N-O 3.46Å; R42-V70 PolarHBondContact O-N 2.76Å; R42-R72 HydrophobicContact CG-CG 3.72Å
43L96.5Very high93.9Very high1 Ų163.3 Ų63.31%0.00537%0.371CS..EExtended strand (participates in β ladder)trans-95.9134.7171.5-65.6175.1000109.4V5 I23 V26 K27 I30 L50 L67 H68 L69V5-L43 HydrophobicContact CG1-CD2 4.27Å; I23-L43 HydrophobicContact CG2-CD1 4.24Å; V26-L43 HydrophobicContact CB-CD1 4.45Å; V26-L43 HydrophobicContact CG1-CD1 3.92Å; K27-L43 HydrophobicContact CG-CD1 3.85Å; K27-L43 HydrophobicContact CG-CG 4.4Å; I30-L43 HydrophobicContact CD1-CD1 4.05Å; I30-L43 HydrophobicContact CD1-CD2 3.69Å; I30-L43 HydrophobicContact CD1-CG 4.38Å; L43-L50 HydrophobicContact CB-CB 4.37Å; L43-L50 HydrophobicContact CB-CD1 4.14Å; L43-L50 HydrophobicContact CB-CG 4.38Å; L43-L50 PolarHBondContact O-N 2.71Å; L43-L67 HydrophobicContact CB-CD2 4.24Å; L43-H68 WeakPolarHBondContact CA-O 3.48Å; L43-L69 HydrophobicContact CD2-CB 4.21Å; L43-L69 HydrophobicContact CD2-CD1 3.91Å
44I97Very high94.1Very high51 Ų5163.1 Ų63.126%0.26237%0.368SS..EExtended strand (participates in β ladder)trans-127.1131.9-179.3-56177.1000108.6K48 H68 V70I44-K48 WeakPolarHBondContact CA-O 3.46Å; I44-H68 HydrophobicContact CB-CB 4.32Å; I44-H68 PolarHBondContact N-O 2.82Å; I44-H68 PolarHBondContact O-N 3.37Å; I44-V70 HydrophobicContact CD1-CG2 3.54Å; I44-V70 HydrophobicContact CG1-CG2 4.29Å
45F97.1Very high94.3Very high47 Ų4761.4 Ų61.421%0.20636%0.361CS..EExtended strand (participates in β ladder)trans-139.4135.7174.3-176.9-112.3000109.4G47 K48 L50 I61 L67F45-G47 PolarHBondContact O-N 2.98Å; F45-G47 VanDerWaalsContact O-N 3.12Å; F45-K48 PolarHBondContact N-O 3.44Å; F45-K48 PolarHBondContact O-N 3.24Å; F45-L50 HydrophobicContact CB-CD1 4.19Å; F45-L50 HydrophobicContact CB-CD2 4.09Å; F45-L50 HydrophobicContact CB-CG 4.42Å; F45-I61 HydrophobicContact CD1-CD1 4.21Å; F45-I61 HydrophobicContact CD1-CG1 3.7Å; F45-I61 HydrophobicContact CE1-CG1 3.74Å; F45-I61 HydrophobicContact CG-CD1 4.35Å; F45-I61 HydrophobicContact CG-CG1 4.15Å; F45-I61 HydrophobicContact CZ-CG1 4.23Å; F45-L67 HydrophobicContact CB-CD2 4.28Å; F45-L67 HydrophobicContact CB-CG 4.41Å; F45-L67 HydrophobicContact CD2-CG 4.39Å
46A94.3Very high94.5Very high89 Ų8958.6 Ų58.674%0.73633%0.332SS*.THydrogen-bonded Turntrans48.240.1-177.500000114.1K48A46-K48 PolarHBondContact O-N 3.31Å
47G93.9Very high94.7Very high77 Ų7759.8 Ų59.879%0.79434%0.344SS*.THydrogen-bonded Turntrans73.11.3-178.700000115.3F45F45-G47 PolarHBondContact O-N 2.98Å; F45-G47 VanDerWaalsContact O-N 3.12Å
48K94.7Very high94.9Very high143 Ų14362.3 Ų62.362%0.62236%0.355SS*.EExtended strand (participates in β ladder)trans-105.1135.8177.8-65.5-176.8-179.51780110.8I44 F45 A46I44-K48 WeakPolarHBondContact CA-O 3.46Å; F45-K48 PolarHBondContact N-O 3.44Å; F45-K48 PolarHBondContact O-N 3.24Å; A46-K48 PolarHBondContact O-N 3.31Å
49Q95Very high95.1Very high88 Ų8862.3 Ų62.341%0.41135%0.35SS..EExtended strand (participates in β ladder)trans-72.2134.5168.1-171.4-171.3-51.600108.9
50L96.4Very high95.3Very high3 Ų365.5 Ų65.52%0.01637%0.367CS..PPolyproline II helixtrans-84.7141.7179.8-53.5-171.5000111.5I23 L43 F45 Y59 I61 L67I23-L50 HydrophobicContact CD1-CB 4.11Å; I23-L50 HydrophobicContact CD1-CD1 3.62Å; I23-L50 HydrophobicContact CD1-CG 4.46Å; I23-L50 HydrophobicContact CG1-CB 3.98Å; I23-L50 HydrophobicContact CG1-CD1 4.42Å; I23-L50 HydrophobicContact CG2-CB 3.89Å; L43-L50 HydrophobicContact CB-CB 4.37Å; L43-L50 HydrophobicContact CB-CD1 4.14Å; L43-L50 HydrophobicContact CB-CG 4.38Å; L43-L50 PolarHBondContact O-N 2.71Å; F45-L50 HydrophobicContact CB-CD1 4.19Å; F45-L50 HydrophobicContact CB-CD2 4.09Å; F45-L50 HydrophobicContact CB-CG 4.42Å; L50-Y59 HydrophobicContact CB-CE2 4.11Å; L50-Y59 HydrophobicContact CD2-CD1 3.65Å; L50-Y59 HydrophobicContact CD2-CD2 3.73Å; L50-Y59 HydrophobicContact CD2-CE1 3.62Å; L50-Y59 HydrophobicContact CD2-CE2 3.67Å; L50-Y59 HydrophobicContact CD2-CG 3.7Å; L50-Y59 HydrophobicContact CG-CE2 4.39Å; L50-I61 HydrophobicContact CD1-CD1 3.92Å; L50-L67 HydrophobicContact CD1-CD2 3.3Å
51E95.9Very high95.5Very high103 Ų10362.1 Ų62.148%0.48135%0.352SS..PPolyproline II helixtrans-96.8138.1179.7-67175.6172.200110.7I23 G53 R54 Y59I23-E51 VanDerWaalsContact CB-O 3.29Å; I23-E51 WeakPolarHBondContact CB-O 3.38Å; I23-E51 WeakPolarHBondContact CG1-O 3.34Å; E51-G53 VanDerWaalsContact C-N 3.28Å; E51-G53 PolarHBondContact O-N 2.63Å; E51-R54 HydrophobicContact CB-CG 4.35Å; E51-R54 PolarHBondContact O-N 3.22Å; E51-R54 IonicContact OE2-CZ 3.46Å; E51-R54 IonicContact OE2-NE 2.87Å; E51-R54 PolarHBondContact OE2-NE 3.14Å; E51-R54 IonicContact OE2-NH2 3.19Å; E51-R54 PolarHBondContact OE2-NH2 3.44Å; E51-Y59 PolarHBondContact N-OH 3.36Å
52D94.3Very high95.5Very high59 Ų5968.8 Ų68.832%0.31638%0.383SS..THydrogen-bonded Turntrans-61.8-33-171.7-66.9-29.1000113.3E24 K27 R54E24-D52 HydrophobicContact CB-CB 4.28Å; E24-D52 PolarHBondContact N-O 3.05Å; K27-D52 WeakPolarHBondContact CD-OD1 3.41Å; K27-D52 WeakPolarHBondContact CE-OD1 3.45Å; K27-D52 IonicContact NZ-OD1 3.03Å; K27-D52 PolarHBondContact NZ-OD1 2.93Å; K27-D52 IonicContact NZ-OD2 2.63Å; K27-D52 PolarHBondContact NZ-OD2 3.44Å; D52-R54 PolarHBondContact O-N 2.8Å
53G94.1Very high95.6Very high76 Ų7670 Ų7078%0.78439%0.391SS*.THydrogen-bonded Turntrans-84.23.2-178.800000116.2E51E51-G53 VanDerWaalsContact C-N 3.28Å; E51-G53 PolarHBondContact O-N 2.63Å
54R96.6Very high95.5Very high110 Ų11075.7 Ų75.742%0.41542%0.417SS..SBendtrans-103.5159.9176.1-65.1-164.5-161.7-146.6-1.3111.1T22 I23 E51 D52 D58 Y59T22-R54 CarbonylContact C-O 3.56Å; T22-R54 WeakPolarHBondContact CA-O 3.44Å; I23-R54 WeakPolarHBondContact CG1-O 3.35Å; I23-R54 PolarHBondContact N-O 2.62Å; E51-R54 HydrophobicContact CB-CG 4.35Å; E51-R54 PolarHBondContact O-N 3.22Å; E51-R54 IonicContact OE2-CZ 3.46Å; E51-R54 IonicContact OE2-NE 2.87Å; E51-R54 PolarHBondContact OE2-NE 3.14Å; E51-R54 IonicContact OE2-NH2 3.19Å; E51-R54 PolarHBondContact OE2-NH2 3.44Å; D52-R54 PolarHBondContact O-N 2.8Å; R54-D58 HydrophobicContact CB-CB 4.24Å; R54-Y59 HydrophobicContact CB-CD2 4.32Å; R54-Y59 HydrophobicContact CB-CE2 3.63Å; R54-Y59 HydrophobicContact CG-CE2 4.34Å
55T96.9Very high95.5Very high26 Ų2674.1 Ų74.116%0.1641%0.411CS..BIsolated β-bridgetrans-94.5168.5177.466.60000112.4S20 D21 T22 S57 D58 Y59S20-T55 WeakPolarHBondContact O-CG2 3.26Å; D21-T55 CarbonylContact O-C 3.55Å; D21-T55 VanDerWaalsContact O-CA 3.29Å; D21-T55 WeakPolarHBondContact O-CA 3.33Å; T22-T55 HydrophobicContact CG2-CG2 4.37Å; T55-S57 VanDerWaalsContact C-N 3.28Å; T55-S57 PolarHBondContact O-N 2.88Å; T55-S57 PolarHBondContact OG1-N 3.1Å; T55-S57 PolarHBondContact OG1-OG 2.93Å; T55-D58 PolarHBondContact N-OD2 2.88Å; T55-D58 PolarHBondContact O-N 2.81Å; T55-D58 PolarHBondContact OG1-N 2.65Å; T55-D58 PolarHBondContact OG1-OD1 2.97Å; T55-D58 PolarHBondContact OG1-OD2 3.12Å; T55-Y59 WeakPolarHBondContact O-CD2 3.42Å
56L96.7Very high95.5Very high0 Ų074.1 Ų74.10%042%0.415CS..THydrogen-bonded Turntrans-61.3-37.6170.8-69.9178.9000111.9M1 I3 V17 D21 I23 V26 D58 Y59 N60 I61M1-L56 HydrophobicContact CE-CB 4.26Å; M1-L56 HydrophobicContact CE-CD1 3.85Å; I3-L56 HydrophobicContact CD1-CD1 4.45Å; V17-L56 HydrophobicContact CB-CD1 3.72Å; V17-L56 HydrophobicContact CG1-CD1 4.32Å; V17-L56 HydrophobicContact CG2-CD1 3.5Å; V17-L56 VanDerWaalsContact CG2-CD1 3.5Å; D21-L56 HydrophobicContact CB-CD1 4.29Å; D21-L56 PolarHBondContact O-N 3.4Å; I23-L56 HydrophobicContact CD1-CD2 3.85Å; V26-L56 HydrophobicContact CG2-CD1 3.91Å; V26-L56 HydrophobicContact CG2-CD2 4.06Å; V26-L56 HydrophobicContact CG2-CG 4.06Å; L56-D58 VanDerWaalsContact C-N 3.33Å; L56-D58 PolarHBondContact O-N 3.21Å; L56-Y59 PolarHBondContact O-N 2.75Å; L56-N60 PolarHBondContact O-N 2.81Å; L56-I61 HydrophobicContact CB-CB 4.24Å; L56-I61 HydrophobicContact CD2-CB 4.15Å; L56-I61 HydrophobicContact CD2-CD1 3.5Å; L56-I61 VanDerWaalsContact CD2-CD1 3.5Å; L56-I61 HydrophobicContact CD2-CG1 4.41Å; L56-I61 HydrophobicContact CD2-CG2 4.09Å; L56-I61 WeakPolarHBondContact O-CB 3.48Å; L56-I61 PolarHBondContact O-N 2.75Å
57S95.3Very high95.6Very high58 Ų5869.9 Ų69.941%0.40638%0.38SS..G310 helixtrans-64.3-36.3176.762.90000112.5P19 T55 Y59 N60P19-S57 WeakPolarHBondContact O-CB 3.35Å; P19-S57 PolarHBondContact O-N 2.83Å; P19-S57 PolarHBondContact O-OG 3.24Å; T55-S57 VanDerWaalsContact C-N 3.28Å; T55-S57 PolarHBondContact O-N 2.88Å; T55-S57 PolarHBondContact OG1-N 3.1Å; T55-S57 PolarHBondContact OG1-OG 2.93Å; S57-Y59 PolarHBondContact O-N 3.39Å; S57-N60 PolarHBondContact O-N 2.88Å
58D96Very high95.8Very high94 Ų9470.9 Ų70.950%0.50336%0.364SS..G310 helixtrans-61.1-27.5178.4-65-22.4000112.6R54 T55 L56R54-D58 HydrophobicContact CB-CB 4.24Å; T55-D58 PolarHBondContact N-OD2 2.88Å; T55-D58 PolarHBondContact O-N 2.81Å; T55-D58 PolarHBondContact OG1-N 2.65Å; T55-D58 PolarHBondContact OG1-OD1 2.97Å; T55-D58 PolarHBondContact OG1-OD2 3.12Å; L56-D58 VanDerWaalsContact C-N 3.33Å; L56-D58 PolarHBondContact O-N 3.21Å
59Y96.2Very high95.9Very high37 Ų3764.4 Ų64.415%0.14534%0.336CS..G310 helixtrans-97.67.3176.6-70.9-70.9000113.5I23 L50 E51 R54 T55 L56 S57 I61I23-Y59 HydrophobicContact CD1-CD2 4.34Å; I23-Y59 HydrophobicContact CD1-CE2 4.49Å; I23-Y59 HydrophobicContact CG1-CD2 4.44Å; I23-Y59 HydrophobicContact CG1-CE2 4.14Å; L50-Y59 HydrophobicContact CB-CE2 4.11Å; L50-Y59 HydrophobicContact CD2-CD1 3.65Å; L50-Y59 HydrophobicContact CD2-CD2 3.73Å; L50-Y59 HydrophobicContact CD2-CE1 3.62Å; L50-Y59 HydrophobicContact CD2-CE2 3.67Å; L50-Y59 HydrophobicContact CD2-CG 3.7Å; L50-Y59 HydrophobicContact CG-CE2 4.39Å; E51-Y59 PolarHBondContact N-OH 3.36Å; R54-Y59 HydrophobicContact CB-CD2 4.32Å; R54-Y59 HydrophobicContact CB-CE2 3.63Å; R54-Y59 HydrophobicContact CG-CE2 4.34Å; T55-Y59 WeakPolarHBondContact O-CD2 3.42Å; L56-Y59 PolarHBondContact O-N 2.75Å; S57-Y59 PolarHBondContact O-N 3.39Å; Y59-I61 PolarHBondContact O-N 2.85Å
60N95.1Very high95.8Very high129 Ų12962 Ų6269%0.6933%0.327SS*.THydrogen-bonded Turntrans52.736.7-173.9-61.9-50.4000112.9L56 S57 Q62L56-N60 PolarHBondContact O-N 2.81Å; S57-N60 PolarHBondContact O-N 2.88Å; N60-Q62 PolarHBondContact O-N 2.87Å
61I95.8Very high95.6Very high6 Ų666 Ų663%0.03135%0.348CS..  trans-77.4119.4176.9-64.4166.9000107.9M1 I3 F45 L50 L56 Y59 L67M1-I61 WeakPolarHBondContact CE-O 3.41Å; I3-I61 HydrophobicContact CG2-CG2 4.16Å; F45-I61 HydrophobicContact CD1-CD1 4.21Å; F45-I61 HydrophobicContact CD1-CG1 3.7Å; F45-I61 HydrophobicContact CE1-CG1 3.74Å; F45-I61 HydrophobicContact CG-CD1 4.35Å; F45-I61 HydrophobicContact CG-CG1 4.15Å; F45-I61 HydrophobicContact CZ-CG1 4.23Å; L50-I61 HydrophobicContact CD1-CD1 3.92Å; L56-I61 HydrophobicContact CB-CB 4.24Å; L56-I61 HydrophobicContact CD2-CB 4.15Å; L56-I61 HydrophobicContact CD2-CD1 3.5Å; L56-I61 VanDerWaalsContact CD2-CD1 3.5Å; L56-I61 HydrophobicContact CD2-CG1 4.41Å; L56-I61 HydrophobicContact CD2-CG2 4.09Å; L56-I61 WeakPolarHBondContact O-CB 3.48Å; L56-I61 PolarHBondContact O-N 2.75Å; Y59-I61 PolarHBondContact O-N 2.85Å; I61-L67 HydrophobicContact CD1-CD2 4.14Å; I61-L67 HydrophobicContact CG2-CD1 4.43Å
62Q94.1Very high95.1Very high140 Ų14064.4 Ų64.465%0.65434%0.338SS*.  trans-107.6175.1-177.1-63.6-175.3-8.600111.7N60 E64 S65N60-Q62 PolarHBondContact O-N 2.87Å; Q62-E64 PolarHBondContact O-N 2.87Å; Q62-S65 PolarHBondContact N-OG 2.8Å; Q62-S65 WeakPolarHBondContact O-CB 3.38Å; Q62-S65 PolarHBondContact O-N 2.86Å; Q62-S65 VanDerWaalsContact O-N 3.11Å; Q62-S65 PolarHBondContact O-OG 3.35Å
63K95.4Very high94.1Very high134 Ų13469.8 Ų69.858%0.58337%0.366SS*.THydrogen-bonded Turntrans-50.8139.4169.4-174-176.9172.6-1670110.2M1 S65M1-K63 HydrophobicContact CB-CB 4.42Å; K63-S65 PolarHBondContact O-N 2.76Å
64E95.1Very high92.8Very high119 Ų11973.2 Ų73.256%0.55636%0.355SS*.THydrogen-bonded Turntrans64.810.3-179.2-67.7161.3-152.200115.2Q2 F4 Q62Q2-E64 PolarHBondContact O-N 3.39Å; F4-E64 HydrophobicContact CE2-CB 4Å; F4-E64 HydrophobicContact CE2-CG 3.93Å; Q62-E64 PolarHBondContact O-N 2.87Å
65S97Very high91.2Very high19 Ų1971.5 Ų71.513%0.13337%0.371CS..  trans-62.9142.9171.1-64.60000111.4F4 Q62 K63F4-S65 PolarHBondContact N-O 2.8Å; Q62-S65 PolarHBondContact N-OG 2.8Å; Q62-S65 WeakPolarHBondContact O-CB 3.38Å; Q62-S65 PolarHBondContact O-N 2.86Å; Q62-S65 VanDerWaalsContact O-N 3.11Å; Q62-S65 PolarHBondContact O-OG 3.35Å; K63-S65 PolarHBondContact O-N 2.76Å
66T96.7Very high89.8Confident47 Ų4773.4 Ų73.429%0.28840%0.396SS..EExtended strand (participates in β ladder)trans-106.9115.6176.4-55.20000111F4 K6F4-T66 HydrophobicContact CB-CG2 4.39Å; F4-T66 CarbonylContact O-C 3.57Å; F4-T66 WeakPolarHBondContact O-CA 3.45Å; K6-T66 HydrophobicContact CB-CG2 4.32Å; K6-T66 HydrophobicContact CD-CG2 3.78Å; K6-T66 HydrophobicContact CG-CG2 3.77Å
67L97.3Very high88.6Confident0 Ų081.3 Ų81.30%044%0.437CS..EExtended strand (participates in β ladder)trans-92.1155167.8-66.5105000111I3 F4 V5 K6 L43 F45 L50 I61I3-L67 HydrophobicContact CB-CD1 4.46Å; I3-L67 HydrophobicContact CD1-CD1 3.69Å; F4-L67 PolarHBondContact O-N 2.9Å; V5-L67 CarbonylContact C-O 3.58Å; V5-L67 WeakPolarHBondContact CA-O 3.46Å; V5-L67 HydrophobicContact CG2-CB 4.42Å; K6-L67 PolarHBondContact N-O 3.19Å; L43-L67 HydrophobicContact CB-CD2 4.24Å; F45-L67 HydrophobicContact CB-CD2 4.28Å; F45-L67 HydrophobicContact CB-CG 4.41Å; F45-L67 HydrophobicContact CD2-CG 4.39Å; L50-L67 HydrophobicContact CD1-CD2 3.3Å; I61-L67 HydrophobicContact CD1-CD2 4.14Å; I61-L67 HydrophobicContact CG2-CD1 4.43Å
68H97.6Very high87.8Confident98 Ų9883.9 Ų83.945%0.45445%0.445SS..EExtended strand (participates in β ladder)trans-107.1125.9172.3-63.774.8000109.7K6 L43 I44K6-H68 CarbonylContact O-C 3.57Å; K6-H68 WeakPolarHBondContact O-CA 3.4Å; L43-H68 WeakPolarHBondContact CA-O 3.48Å; I44-H68 HydrophobicContact CB-CB 4.32Å; I44-H68 PolarHBondContact N-O 2.82Å; I44-H68 PolarHBondContact O-N 3.37Å
69L96.3Very high87.4Confident6 Ų684.8 Ų84.83%0.03145%0.446CS..EExtended strand (participates in β ladder)trans-96.4120.8174176.264.3000109.9V5 K6 T7 I30 I36 Q41 L43V5-L69 HydrophobicContact CG1-CB 3.54Å; V5-L69 HydrophobicContact CG1-CD2 4.48Å; K6-L69 PolarHBondContact O-N 2.75Å; T7-L69 HydrophobicContact CG2-CD2 4.34Å; I30-L69 HydrophobicContact CG2-CD2 3.9Å; I36-L69 HydrophobicContact CD1-CD2 4.18Å; Q41-L69 HydrophobicContact CB-CD1 3.79Å; Q41-L69 HydrophobicContact CG-CD1 3.96Å; L43-L69 HydrophobicContact CD2-CB 4.21Å; L43-L69 HydrophobicContact CD2-CD1 3.91Å
70V93.6Very high87.1Confident37 Ų3787.1 Ų87.122%0.22447%0.466CS..EExtended strand (participates in β ladder)trans-120138.7175.1-164.20000108.1L8 R42 I44L8-V70 HydrophobicContact CD1-CG1 3.9Å; L8-V70 HydrophobicContact CD2-CG1 4.36Å; L8-V70 HydrophobicContact CD2-CG2 4.27Å; L8-V70 HydrophobicContact CG-CG1 4.3Å; R42-V70 WeakPolarHBondContact CA-O 3.49Å; R42-V70 HydrophobicContact CB-CB 4.33Å; R42-V70 WeakPolarHBondContact CB-O 3.4Å; R42-V70 PolarHBondContact N-O 3.46Å; R42-V70 PolarHBondContact O-N 2.76Å; I44-V70 HydrophobicContact CD1-CG2 3.54Å; I44-V70 HydrophobicContact CG1-CG2 4.29Å
71L91.6Very high87Confident87 Ų8784.5 Ų84.546%0.45546%0.458SS..EExtended strand (participates in β ladder)trans-82.2136.5176.1-62.9179.1000110.6I36 Q40 L73I36-L71 HydrophobicContact CD1-CD2 4.13Å; I36-L71 HydrophobicContact CG1-CD2 4.5Å; I36-L71 HydrophobicContact CG2-CD2 3.57Å; Q40-L71 CarbonylContact O-C 3.57Å; Q40-L71 WeakPolarHBondContact O-CA 3.15Å; L71-L73 PolarHBondContact O-N 3.3Å
72R84.9Confident86.8Confident70 Ų7088.9 Ų88.926%0.26448%0.481SS..  trans-69116.9163.8-66.5-163.6176.7109.3-5.2107.5D39 Q40 Q41 R42 R74D39-R72 WeakPolarHBondContact O-CD 3.42Å; D39-R72 PolarHBondContact O-NH1 3.25Å; Q40-R72 PolarHBondContact O-N 2.79Å; Q41-R72 PolarHBondContact O-NH1 2.9Å; R42-R72 HydrophobicContact CG-CG 3.72Å; R72-R74 VanDerWaalsContact C-N 3.31Å; R72-R74 PolarHBondContact O-N 3.4Å
73L74.5Confident86.6Confident172 Ų17289.9 Ų89.990%0.90148%0.478SS*.  trans-69.190.7168.8-61.6175.3000108.3L71L71-L73 PolarHBondContact O-N 3.3Å
74R66.5Low86.4Confident148 Ų14889.7 Ų89.756%0.55848%0.48SS*.PPolyproline II helixtrans-81.3132.1161-73.4-169.7-175.8164.57.3107.9D39 R72 G76D39-R74 VanDerWaalsContact CB-NH2 3.33Å; D39-R74 VanDerWaalsContact CG-NH2 3.31Å; D39-R74 IonicContact OD2-CZ 2.62Å; D39-R74 IonicContact OD2-NH1 2.65Å; D39-R74 PolarHBondContact OD2-NH1 2.95Å; D39-R74 IonicContact OD2-NH2 3.44Å; D39-R74 PolarHBondContact OD2-NH2 3.03Å; R72-R74 VanDerWaalsContact C-N 3.31Å; R72-R74 PolarHBondContact O-N 3.4Å; R74-G76 PolarHBondContact O-N 3.49Å
75G63.3Low86.3Confident74 Ų7488.4 Ų88.476%0.76348%0.476SS*.PPolyproline II helixtrans-54.2128164.800000108.2
76G67.1Low86.1Confident66 Ų6689.6 Ų89.668%0.6849%0.487SS*.PPolyproline II helixtrans-56.6154.2-179.600000111.8R74 I78R74-G76 PolarHBondContact O-N 3.49Å; G76-I78 PolarHBondContact O-N 3.16Å
77I71.4Confident85.9Confident166 Ų16690.8 Ų90.885%0.85149%0.489SS*.  trans-70.2113.6170.5-59.5168.8000106.6E79I77-E79 PolarHBondContact O-N 3.19Å
78I78.5Confident85.6Confident112 Ų11297 Ų9757%0.57452%0.516SS*.  trans-77.2118171.6-59.8175.9000106.9G76 L82 R83G76-I78 PolarHBondContact O-N 3.16Å; I78-L82 HydrophobicContact CG2-CB 3.68Å; I78-R83 HydrophobicContact CG2-CB 4.12Å
79E87Confident85.4Confident114 Ų11499.4 Ų99.453%0.53352%0.522SS..  trans-43.1135.9172.6-84.1-63.313000111.2I77 S81 L82 R83I77-E79 PolarHBondContact O-N 3.19Å; E79-S81 PolarHBondContact O-N 2.99Å; E79-S81 VanDerWaalsContact O-N 3.07Å; E79-L82 HydrophobicContact CB-CB 4.31Å; E79-L82 HydrophobicContact CB-CD1 4.18Å; E79-L82 HydrophobicContact CB-CG 4.15Å; E79-L82 PolarHBondContact O-N 3.31Å; E79-R83 PolarHBondContact O-N 2.94Å
80P90.8Very high85.2Confident86 Ų86103.2 Ų103.256%0.55854%0.542SS*.Hα-helixtrans-53.1-36.4-175.7-28.435.2000113.5R83 Q84P80-R83 WeakPolarHBondContact O-CB 3.48Å; P80-R83 PolarHBondContact O-N 3.37Å; P80-Q84 WeakPolarHBondContact O-CG 3.49Å; P80-Q84 PolarHBondContact O-N 2.96Å
81S92.6Very high85.2Confident74 Ų74103.6 Ų103.652%0.51755%0.546SS..Hα-helixtrans-65.7-43.7176.458.60000112.6E79 R83 Q84 L85E79-S81 PolarHBondContact O-N 2.99Å; E79-S81 VanDerWaalsContact O-N 3.07Å; S81-R83 VanDerWaalsContact C-N 3.32Å; S81-R83 PolarHBondContact O-N 3.48Å; S81-Q84 PolarHBondContact O-N 3.07Å; S81-L85 WeakPolarHBondContact O-CB 3.36Å; S81-L85 PolarHBondContact O-N 3.24Å
82L91.7Very high85.3Confident98 Ų98102.2 Ų102.251%0.51354%0.54SS..Hα-helixtrans-66-35.9174.8-68.4-179.2000111.6I78 E79 L85 A86I78-L82 HydrophobicContact CG2-CB 3.68Å; E79-L82 HydrophobicContact CB-CB 4.31Å; E79-L82 HydrophobicContact CB-CD1 4.18Å; E79-L82 HydrophobicContact CB-CG 4.15Å; E79-L82 PolarHBondContact O-N 3.31Å; L82-L85 PolarHBondContact O-N 2.92Å; L82-A86 WeakPolarHBondContact O-CB 3.31Å; L82-A86 PolarHBondContact O-N 3.4Å
83R89.9Confident85.9Confident161 Ų161100.8 Ų100.861%0.60854%0.535SS*.Hα-helixtrans-63-45.7173.9-174.6179-176.4178.40.7111.2I78 E79 P80 S81 A86 Q87I78-R83 HydrophobicContact CG2-CB 4.12Å; E79-R83 PolarHBondContact O-N 2.94Å; P80-R83 WeakPolarHBondContact O-CB 3.48Å; P80-R83 PolarHBondContact O-N 3.37Å; S81-R83 VanDerWaalsContact C-N 3.32Å; S81-R83 PolarHBondContact O-N 3.48Å; R83-A86 PolarHBondContact O-N 3.46Å; R83-Q87 VanDerWaalsContact O-CG 3.31Å; R83-Q87 WeakPolarHBondContact O-CG 3.36Å; R83-Q87 PolarHBondContact O-N 2.87Å
84Q91.5Very high86.9Confident130 Ų13094.3 Ų94.361%0.60750%0.501SS*.Hα-helixtrans-62.3-43.8175.6-72.8176.37.600111.7P80 S81 A86 Q87 K88P80-Q84 WeakPolarHBondContact O-CG 3.49Å; P80-Q84 PolarHBondContact O-N 2.96Å; S81-Q84 PolarHBondContact O-N 3.07Å; Q84-A86 PolarHBondContact O-N 3.36Å; Q84-Q87 WeakPolarHBondContact O-CB 3.49Å; Q84-Q87 PolarHBondContact O-N 2.91Å; Q84-K88 PolarHBondContact O-N 3.39Å; Q84-K88 VanDerWaalsContact O-N 3.09Å
85L93.4Very high88.4Confident92 Ų9288 Ų8848%0.48248%0.478SS..Hα-helixtrans-58-49.3175.2-177.763.8000110.8S81 L82 Q87 K88 Y89S81-L85 WeakPolarHBondContact O-CB 3.36Å; S81-L85 PolarHBondContact O-N 3.24Å; L82-L85 PolarHBondContact O-N 2.92Å; L85-Q87 VanDerWaalsContact C-N 3.33Å; L85-Q87 PolarHBondContact O-N 3.39Å; L85-K88 WeakPolarHBondContact O-CB 3.34Å; L85-K88 PolarHBondContact O-N 3.48Å; L85-Y89 HydrophobicContact CD1-CD2 4.22Å; L85-Y89 HydrophobicContact CD1-CE2 3.75Å; L85-Y89 HydrophobicContact CG-CE2 4.45Å; L85-Y89 WeakPolarHBondContact O-CD2 3.4Å; L85-Y89 PolarHBondContact O-N 2.86Å
86A92.3Very high90.1Very high43 Ų4384.5 Ų84.536%0.35544%0.442SS..Hα-helixtrans-60.6-40.9177.600000112.3L82 R83 Q84 K88 Y89 N90L82-A86 WeakPolarHBondContact O-CB 3.31Å; L82-A86 PolarHBondContact O-N 3.4Å; R83-A86 PolarHBondContact O-N 3.46Å; Q84-A86 PolarHBondContact O-N 3.36Å; A86-K88 VanDerWaalsContact C-N 3.33Å; A86-K88 PolarHBondContact O-N 2.81Å; A86-Y89 PolarHBondContact O-N 2.8Å; A86-N90 VanDerWaalsContact O-CB 3.3Å; A86-N90 WeakPolarHBondContact O-CB 3.38Å; A86-N90 PolarHBondContact O-N 3.37Å
87Q91.7Very high91.6Very high72 Ų7287.5 Ų87.534%0.33643%0.433SS..Hα-helixtrans-58.3-43.4176.3-77173.7-400111.8R83 Q84 L85 Y89 N90 C91 D92R83-Q87 VanDerWaalsContact O-CG 3.31Å; R83-Q87 WeakPolarHBondContact O-CG 3.36Å; R83-Q87 PolarHBondContact O-N 2.87Å; Q84-Q87 WeakPolarHBondContact O-CB 3.49Å; Q84-Q87 PolarHBondContact O-N 2.91Å; L85-Q87 VanDerWaalsContact C-N 3.33Å; L85-Q87 PolarHBondContact O-N 3.39Å; Q87-Y89 VanDerWaalsContact C-N 3.29Å; Q87-Y89 PolarHBondContact O-N 3.09Å; Q87-N90 PolarHBondContact O-N 2.87Å; Q87-C91 HydrophobicContact CB-CB 4.36Å; Q87-C91 CarbonylContact O-C 3.51Å; Q87-C91 WeakPolarHBondContact O-CA 3.3Å; Q87-C91 WeakPolarHBondContact O-CB 3.4Å; Q87-C91 PolarHBondContact O-N 3.28Å; Q87-D92 PolarHBondContact O-N 3.41Å
88K92.1Very high92.8Very high132 Ų13286 Ų8657%0.57442%0.42SS*.Hα-helixtrans-57.7-38.7177.6-174.3-178.6178.5-178.50113.1Q84 L85 A86 K93Q84-K88 PolarHBondContact O-N 3.39Å; Q84-K88 VanDerWaalsContact O-N 3.09Å; L85-K88 WeakPolarHBondContact O-CB 3.34Å; L85-K88 PolarHBondContact O-N 3.48Å; A86-K88 VanDerWaalsContact C-N 3.33Å; A86-K88 PolarHBondContact O-N 2.81Å; K88-K93 WeakPolarHBondContact O-CE 3.35Å; K88-K93 PolarHBondContact O-NZ 2.73Å
89Y92.8Very high93.8Very high147 Ų14781.5 Ų81.558%0.57640%0.398SS*.Hα-helixtrans-85.2-35.8-179.3-76.3-88.1000113.3L85 A86 Q87 K93L85-Y89 HydrophobicContact CD1-CD2 4.22Å; L85-Y89 HydrophobicContact CD1-CE2 3.75Å; L85-Y89 HydrophobicContact CG-CE2 4.45Å; L85-Y89 WeakPolarHBondContact O-CD2 3.4Å; L85-Y89 PolarHBondContact O-N 2.86Å; A86-Y89 PolarHBondContact O-N 2.8Å; Q87-Y89 VanDerWaalsContact C-N 3.29Å; Q87-Y89 PolarHBondContact O-N 3.09Å; Y89-K93 WeakPolarHBondContact O-CE 3.43Å
90N92.6Very high94.3Very high86 Ų8683.9 Ų83.946%0.4640%0.403SS..Hα-helixtrans-106.9-30.6-167.2-64.7-29.4000113.9A86 Q87 K124A86-N90 VanDerWaalsContact O-CB 3.3Å; A86-N90 WeakPolarHBondContact O-CB 3.38Å; A86-N90 PolarHBondContact O-N 3.37Å; Q87-N90 PolarHBondContact O-N 2.87Å; N90-K124 PolarHBondContact O-NZ 2.98Å
91C92.3Very high94.6Very high45 Ų4580.4 Ų80.430%0.30438%0.382SS..THydrogen-bonded Turntrans-111.5-48.5-170.6-61.50000112.5Q87 K93Q87-C91 HydrophobicContact CB-CB 4.36Å; Q87-C91 CarbonylContact O-C 3.51Å; Q87-C91 WeakPolarHBondContact O-CA 3.3Å; Q87-C91 WeakPolarHBondContact O-CB 3.4Å; Q87-C91 PolarHBondContact O-N 3.28Å; C91-K93 VanDerWaalsContact C-N 3.26Å; C91-K93 PolarHBondContact O-N 3.23Å
92D94.2Very high94.9Very high59 Ų5983 Ų8332%0.31638%0.38SS..SBendtrans-77.677-173.8-59.5-33.6000110.7Q87 P105Q87-D92 PolarHBondContact O-N 3.41Å; D92-P105 WeakPolarHBondContact O-CB 3.48Å; D92-P105 VanDerWaalsContact O-CD 3.28Å; D92-P105 WeakPolarHBondContact O-CD 3.41Å; D92-P105 WeakPolarHBondContact O-CG 3.17Å
93K96.7Very high95.1Very high39 Ų3978.5 Ų78.517%0.1736%0.357CS..  trans-140.2148.1-174.8-59.6-66173.6-140.80110K88 Y89 C91 R102 L103 K124K88-K93 WeakPolarHBondContact O-CE 3.35Å; K88-K93 PolarHBondContact O-NZ 2.73Å; Y89-K93 WeakPolarHBondContact O-CE 3.43Å; C91-K93 VanDerWaalsContact C-N 3.26Å; C91-K93 PolarHBondContact O-N 3.23Å; K93-R102 HydrophobicContact CB-CG 3.79Å; K93-R102 HydrophobicContact CD-CG 4.2Å; K93-R102 HydrophobicContact CG-CG 3.77Å; K93-L103 WeakPolarHBondContact CA-O 3.33Å; K93-L103 WeakPolarHBondContact CB-O 3.45Å; K93-L103 WeakPolarHBondContact CD-O 3.49Å; K93-K124 HydrophobicContact CB-CB 4.41Å; K93-K124 WeakPolarHBondContact O-CB 3.39Å; K93-K124 PolarHBondContact O-N 3.44Å
94M97.3Very high95.5Very high37 Ų3776.2 Ų76.218%0.18235%0.353CS..EExtended strand (participates in β ladder)trans-86.8151.2164.4-67.6-63.8-81.500109.7L103 P105 L121 R122 P123M94-L103 HydrophobicContact CB-CB 4.09Å; M94-L103 PolarHBondContact N-O 2.83Å; M94-L103 PolarHBondContact O-N 3.41Å; M94-P105 VanDerWaalsContact CG-O 3.31Å; M94-P105 WeakPolarHBondContact CG-O 3.31Å; M94-L121 HydrophobicContact CE-CB 3.67Å; M94-R122 CarbonylContact C-O 3.53Å; M94-R122 WeakPolarHBondContact CA-O 3.45Å; M94-P123 HydrophobicContact SD-CB 4.46Å; M94-P123 HydrophobicContact SD-CG 4.17Å
95I98.1Very high95.7Very high15 Ų1572.6 Ų72.68%0.07734%0.341CS..EExtended strand (participates in β ladder)trans-124.5129.7177.6-54.1-62.4000108.2R97 Y100 A101 R102 L121 R122 K124I95-R97 PolarHBondContact O-N 2.71Å; I95-Y100 HydrophobicContact CG2-CD1 4.4Å; I95-A101 WeakPolarHBondContact CA-O 3.22Å; I95-R102 HydrophobicContact CD1-CB 4.24Å; I95-R102 HydrophobicContact CD1-CG 4.27Å; I95-L121 CarbonylContact O-C 3.55Å; I95-L121 WeakPolarHBondContact O-CA 3.5Å; I95-R122 HydrophobicContact CB-CG 4.1Å; I95-R122 PolarHBondContact N-O 2.85Å; I95-R122 PolarHBondContact O-N 3.5Å; I95-K124 HydrophobicContact CD1-CB 4.08Å; I95-K124 HydrophobicContact CD1-CD 4.41Å; I95-K124 HydrophobicContact CD1-CG 4.19Å; I95-K124 HydrophobicContact CG1-CB 3.78Å; I95-K124 HydrophobicContact CG1-CG 4.18Å
96C98.5Very high95.8Very high0 Ų078.9 Ų78.90%036%0.358CS..EExtended strand (participates in β ladder)trans-68.7129.6171.2176.40000110.7K98 C99 Y100 A101 L103 C110 T118 L121C96-K98 VanDerWaalsContact C-N 3.34Å; C96-K98 PolarHBondContact O-N 3.47Å; C96-K98 PolarHBondContact SG-N 2.77Å; C96-C99 PolarHBondContact SG-N 3.21Å; C96-C99 VanDerWaalsContact SG-N 3.42Å; C96-Y100 WeakPolarHBondContact O-CA 3.48Å; C96-Y100 PolarHBondContact O-N 2.85Å; C96-A101 HydrophobicContact CB-CB 4.33Å; C96-A101 PolarHBondContact N-O 3.22Å; C96-A101 VanDerWaalsContact N-O 3.08Å; C96-L103 HydrophobicContact CB-CD1 4.42Å; C96-C110 HydrophobicContact CB-CB 3.99Å; C96-C110 VanDerWaalsContact CB-SG 3.52Å; C96-T118 WeakPolarHBondContact SG-CG2 3.35Å; C96-L121 HydrophobicContact CB-CD2 3.9Å
97R97.9Very high96.1Very high130 Ų13078.1 Ų78.149%0.49135%0.352SS..THydrogen-bonded Turntrans-71.1-28.8179-64-159.3-172-116.31.8113.5I95 N120 R122I95-R97 PolarHBondContact O-N 2.71Å; R97-N120 WeakPolarHBondContact CB-O 3.21Å; R97-N120 WeakPolarHBondContact CD-OD1 3.28Å; R97-N120 WeakPolarHBondContact CG-O 3.34Å; R97-N120 PolarHBondContact N-O 3.12Å; R97-N120 PolarHBondContact NE-OD1 2.85Å; R97-R122 HydrophobicContact CG-CB 4.29Å; R97-R122 HydrophobicContact CG-CG 4.12Å
98K97.6Very high96.3Very high134 Ų13479.9 Ų79.958%0.58337%0.367SS*.THydrogen-bonded Turntrans-81.1-42-179.8-66-168.5-177.8-174.10112.9C96 C115 T118C96-K98 VanDerWaalsContact C-N 3.34Å; C96-K98 PolarHBondContact O-N 3.47Å; C96-K98 PolarHBondContact SG-N 2.77Å; K98-C115 HydrophobicContact CB-CB 3.84Å; K98-C115 HydrophobicContact CD-CB 4.39Å; K98-T118 HydrophobicContact CB-CG2 4.26Å; K98-T118 HydrophobicContact CD-CG2 3.96Å; K98-T118 HydrophobicContact CG-CG2 4.07Å
99C98.1Very high96.6Very high17 Ų1777.7 Ų77.712%0.11536%0.362CS..THydrogen-bonded Turntrans-124.25.1-171.678.10000115.9C96 A101 K114 C115C96-C99 PolarHBondContact SG-N 3.21Å; C96-C99 VanDerWaalsContact SG-N 3.42Å; C99-A101 PolarHBondContact O-N 3.15Å; C99-K114 HydrophobicContact CB-CD 4.09Å; C99-K114 HydrophobicContact CB-CG 4.28Å; C99-C115 HydrophobicContact CB-CB 4.02Å
100Y97.9Very high96.9Very high164 Ų16470.7 Ų70.764%0.64333%0.334SS*.  trans5915.1175.8-59.2-84.4000115.9I95 C96 R102I95-Y100 HydrophobicContact CG2-CD1 4.4Å; C96-Y100 WeakPolarHBondContact O-CA 3.48Å; C96-Y100 PolarHBondContact O-N 2.85Å; Y100-R102 PolarHBondContact O-N 3.14Å
101A97.9Very high97.2Very high14 Ų1474.1 Ų74.112%0.11634%0.341CS..  trans-60.5134.7175.800000111.4I95 C96 C99 L103 K112I95-A101 WeakPolarHBondContact CA-O 3.22Å; C96-A101 HydrophobicContact CB-CB 4.33Å; C96-A101 PolarHBondContact N-O 3.22Å; C96-A101 VanDerWaalsContact N-O 3.08Å; C99-A101 PolarHBondContact O-N 3.15Å; A101-L103 HydrophobicContact CB-CD2 4.24Å; A101-K112 HydrophobicContact CB-CG 3.84Å
102R97.7Very high97.4Very high127 Ų12776.3 Ų76.348%0.47935%0.345SS..EExtended strand (participates in β ladder)trans-80.6120170.8-169.8-171.6-61.8-179.25.2110.2K93 I95 Y100 R111K93-R102 HydrophobicContact CB-CG 3.79Å; K93-R102 HydrophobicContact CD-CG 4.2Å; K93-R102 HydrophobicContact CG-CG 3.77Å; I95-R102 HydrophobicContact CD1-CB 4.24Å; I95-R102 HydrophobicContact CD1-CG 4.27Å; Y100-R102 PolarHBondContact O-N 3.14Å; R102-R111 PolarHBondContact O-NH1 2.96Å; R102-R111 PolarHBondContact O-NH2 2.85Å
103L97.1Very high97.6Very high5 Ų582 Ų823%0.02637%0.367CS..EExtended strand (participates in β ladder)trans-119.9165.2-171.4-56.1171.9000111.1K93 M94 C96 A101 A107 C110 R111 L121K93-L103 WeakPolarHBondContact CA-O 3.33Å; K93-L103 WeakPolarHBondContact CB-O 3.45Å; K93-L103 WeakPolarHBondContact CD-O 3.49Å; M94-L103 HydrophobicContact CB-CB 4.09Å; M94-L103 PolarHBondContact N-O 2.83Å; M94-L103 PolarHBondContact O-N 3.41Å; C96-L103 HydrophobicContact CB-CD1 4.42Å; A101-L103 HydrophobicContact CB-CD2 4.24Å; L103-A107 HydrophobicContact CB-CB 3.88Å; L103-A107 HydrophobicContact CD1-CB 4.4Å; L103-C110 HydrophobicContact CD1-CB 4.26Å; L103-R111 HydrophobicContact CD2-CB 4.29Å; L103-R111 HydrophobicContact CD2-CG 3.81Å; L103-L121 HydrophobicContact CD1-CD1 3.8Å; L103-L121 HydrophobicContact CD1-CD2 3.54Å; L103-L121 HydrophobicContact CD1-CG 4.3Å
104H96.7Very high97.6Very high112 Ų11288.2 Ų88.252%0.51939%0.394SS..  trans-57.9143.3171.1-172.8-98.9000110.2R106 A107H104-R106 PolarHBondContact ND1-N 2.88Å; H104-R106 VanDerWaalsContact ND1-N 3.14Å; H104-R106 PolarHBondContact O-N 3.5Å; H104-R106 VanDerWaalsContact O-N 3.15Å; H104-A107 HydrophobicContact CB-CB 4.41Å; H104-A107 WeakPolarHBondContact O-CB 2.88Å; H104-A107 PolarHBondContact O-N 2.96Å
105P96Very high97.7Very high55 Ų5587 Ų8736%0.35739%0.39SS..THydrogen-bonded Turntrans-58.6-26.4-179.113.8-26.1000114.2D92 M94D92-P105 WeakPolarHBondContact O-CB 3.48Å; D92-P105 VanDerWaalsContact O-CD 3.28Å; D92-P105 WeakPolarHBondContact O-CD 3.41Å; D92-P105 WeakPolarHBondContact O-CG 3.17Å; M94-P105 VanDerWaalsContact CG-O 3.31Å; M94-P105 WeakPolarHBondContact CG-O 3.31Å
106R96.4Very high97.6Very high224 Ų22489.3 Ų89.385%0.84542%0.417SS*.THydrogen-bonded Turntrans-9512.4174.8-56.7-177.7-179.2164.6-2114.5H104 V108H104-R106 PolarHBondContact ND1-N 2.88Å; H104-R106 VanDerWaalsContact ND1-N 3.14Å; H104-R106 PolarHBondContact O-N 3.5Å; H104-R106 VanDerWaalsContact O-N 3.15Å; R106-V108 PolarHBondContact O-N 3.5Å
107A97.5Very high97.6Very high26 Ų2693.7 Ų93.722%0.21544%0.437CS..  trans-70.8131179.500000110.9L103 H104 L121L103-A107 HydrophobicContact CB-CB 3.88Å; L103-A107 HydrophobicContact CD1-CB 4.4Å; H104-A107 HydrophobicContact CB-CB 4.41Å; H104-A107 WeakPolarHBondContact O-CB 2.88Å; H104-A107 PolarHBondContact O-N 2.96Å; A107-L121 HydrophobicContact CB-CD1 4.35Å; A107-L121 WeakPolarHBondContact O-CD1 3.48Å
108V97.9Very high97.6Very high110 Ų11088.2 Ų88.267%0.66742%0.418SS*.SBendtrans-95.4-27.4174.2-700000112.9R106 N119R106-V108 PolarHBondContact O-N 3.5Å; V108-N119 WeakPolarHBondContact O-CA 3.41Å
109N98.4Very high97.6Very high85 Ų8587.6 Ų87.646%0.45542%0.421SS..SBendtrans-126.1151.6177.9-68.980.4000111.3H117N109-H117 PolarHBondContact ND2-O 3.08Å
110C98.5Very high97.6Very high1 Ų190.3 Ų90.31%0.00744%0.435CS..  trans-71.7131.9172.3-171.10000111.1C96 L103 K112 C115 H117 T118 L121C96-C110 HydrophobicContact CB-CB 3.99Å; C96-C110 VanDerWaalsContact CB-SG 3.52Å; L103-C110 HydrophobicContact CD1-CB 4.26Å; C110-K112 PolarHBondContact O-N 3.43Å; C110-K112 VanDerWaalsContact O-N 3.12Å; C110-K112 PolarHBondContact SG-N 3.23Å; C110-C115 WeakPolarHBondContact CB-SG 3.45Å; C110-C115 PolarHBondContact SG-SG 3.1Å; C110-H117 WeakPolarHBondContact O-CA 3.48Å; C110-H117 PolarHBondContact O-ND1 3.49Å; C110-T118 HydrophobicContact CB-CG2 4.28Å; C110-T118 PolarHBondContact N-O 2.93Å; C110-L121 HydrophobicContact CB-CD2 4.06Å
111R97.7Very high97.6Very high157 Ų15783.5 Ų83.559%0.59241%0.409SS*.SBendtrans-67.7-7.5175.374.2178.6179.7-116.3-4.1114.9R102 L103R102-R111 PolarHBondContact O-NH1 2.96Å; R102-R111 PolarHBondContact O-NH2 2.85Å; L103-R111 HydrophobicContact CD2-CB 4.29Å; L103-R111 HydrophobicContact CD2-CG 3.81Å
112K98.2Very high97.6Very high91 Ų9185.6 Ų85.640%0.39641%0.414SS..  trans-97.2121.4-171.4-65.4-62.4-171.4176.80111.3A101 C110 K114 C115A101-K112 HydrophobicContact CB-CG 3.84Å; C110-K112 PolarHBondContact O-N 3.43Å; C110-K112 VanDerWaalsContact O-N 3.12Å; C110-K112 PolarHBondContact SG-N 3.23Å; K112-K114 VanDerWaalsContact C-N 3.28Å; K112-K114 HydrophobicContact CB-CG 4.09Å; K112-K114 PolarHBondContact O-N 2.92Å; K112-C115 PolarHBondContact O-N 3.15Å; K112-C115 PolarHBondContact O-SG 3.47Å
113K97.5Very high97.6Very high179 Ų17983.9 Ų83.978%0.77842%0.42SS*.G310 helixtrans-57.1-36.5175.8-169.1175.3-179.3179.20113.1C115 G116K113-C115 PolarHBondContact O-N 3.04Å; K113-G116 PolarHBondContact O-N 3.42Å
114K97.7Very high97.5Very high169 Ų16986.9 Ų86.974%0.73543%0.432SS*.G310 helixtrans-57.3-17.7179.762.9160.3168171.30116.2C99 K112C99-K114 HydrophobicContact CB-CD 4.09Å; C99-K114 HydrophobicContact CB-CG 4.28Å; K112-K114 VanDerWaalsContact C-N 3.28Å; K112-K114 HydrophobicContact CB-CG 4.09Å; K112-K114 PolarHBondContact O-N 2.92Å
115C97.6Very high97.4Very high13 Ų1390 Ų909%0.08845%0.445CS..G310 helixtrans-108.813.5175.366.40000113.3K98 C99 C110 K112 K113 H117 T118K98-C115 HydrophobicContact CB-CB 3.84Å; K98-C115 HydrophobicContact CD-CB 4.39Å; C99-C115 HydrophobicContact CB-CB 4.02Å; C110-C115 WeakPolarHBondContact CB-SG 3.45Å; C110-C115 PolarHBondContact SG-SG 3.1Å; K112-C115 PolarHBondContact O-N 3.15Å; K112-C115 PolarHBondContact O-SG 3.47Å; K113-C115 PolarHBondContact O-N 3.04Å; C115-H117 VanDerWaalsContact C-N 3.31Å; C115-H117 PolarHBondContact O-N 3.37Å; C115-T118 HydrophobicContact CB-CG2 4.1Å; C115-T118 WeakPolarHBondContact O-CB 3.17Å; C115-T118 PolarHBondContact O-N 3.47Å
116G97.6Very high97Very high63 Ų6395.1 Ų95.165%0.64946%0.461SS*.THydrogen-bonded Turntrans62.235.7-17600000112.9K113 T118K113-G116 PolarHBondContact O-N 3.42Å; G116-T118 PolarHBondContact O-N 3.02Å
117H97.6Very high96.3Very high91 Ų9191 Ų9142%0.42146%0.461SS..THydrogen-bonded Turntrans51.132.7-177.3-60.6-72.7000114.7N109 C110 C115N109-H117 PolarHBondContact ND2-O 3.08Å; C110-H117 WeakPolarHBondContact O-CA 3.48Å; C110-H117 PolarHBondContact O-ND1 3.49Å; C115-H117 VanDerWaalsContact C-N 3.31Å; C115-H117 PolarHBondContact O-N 3.37Å
118T98.1Very high95.4Very high15 Ų15102.6 Ų102.69%0.09251%0.506CS..  trans-50.4142.2-175.4-170.20000112.9C96 K98 C110 C115 G116 N120C96-T118 WeakPolarHBondContact SG-CG2 3.35Å; K98-T118 HydrophobicContact CB-CG2 4.26Å; K98-T118 HydrophobicContact CD-CG2 3.96Å; K98-T118 HydrophobicContact CG-CG2 4.07Å; C110-T118 HydrophobicContact CB-CG2 4.28Å; C110-T118 PolarHBondContact N-O 2.93Å; C115-T118 HydrophobicContact CB-CG2 4.1Å; C115-T118 WeakPolarHBondContact O-CB 3.17Å; C115-T118 PolarHBondContact O-N 3.47Å; G116-T118 PolarHBondContact O-N 3.02Å; T118-N120 VanDerWaalsContact C-N 3.3Å; T118-N120 WeakPolarHBondContact OG1-CB 3.21Å; T118-N120 PolarHBondContact OG1-N 3.04Å; T118-N120 VanDerWaalsContact OG1-N 3.15Å
119N97.9Very high95.2Very high121 Ų121102.3 Ų102.365%0.64750%0.498SS*.  trans-84.7-1.216962.8-8000113V108 L121V108-N119 WeakPolarHBondContact O-CA 3.41Å; N119-L121 VanDerWaalsContact C-N 3.27Å; N119-L121 PolarHBondContact O-N 2.88Å
120N98.1Very high95.1Very high75 Ų75103.2 Ų103.240%0.40150%0.501SS..  trans-76.580.6177.5-167.61.4000110.8R97 T118R97-N120 WeakPolarHBondContact CB-O 3.21Å; R97-N120 WeakPolarHBondContact CD-OD1 3.28Å; R97-N120 WeakPolarHBondContact CG-O 3.34Å; R97-N120 PolarHBondContact N-O 3.12Å; R97-N120 PolarHBondContact NE-OD1 2.85Å; T118-N120 VanDerWaalsContact C-N 3.3Å; T118-N120 WeakPolarHBondContact OG1-CB 3.21Å; T118-N120 PolarHBondContact OG1-N 3.04Å; T118-N120 VanDerWaalsContact OG1-N 3.15Å
121L98.2Very high94.9Very high21 Ų21108.8 Ų108.811%0.1153%0.528CS..EExtended strand (participates in β ladder)trans-109.2164.9-178.2-51.2-175.4000110.9M94 I95 C96 L103 A107 C110 N119M94-L121 HydrophobicContact CE-CB 3.67Å; I95-L121 CarbonylContact O-C 3.55Å; I95-L121 WeakPolarHBondContact O-CA 3.5Å; C96-L121 HydrophobicContact CB-CD2 3.9Å; L103-L121 HydrophobicContact CD1-CD1 3.8Å; L103-L121 HydrophobicContact CD1-CD2 3.54Å; L103-L121 HydrophobicContact CD1-CG 4.3Å; A107-L121 HydrophobicContact CB-CD1 4.35Å; A107-L121 WeakPolarHBondContact O-CD1 3.48Å; C110-L121 HydrophobicContact CB-CD2 4.06Å; N119-L121 VanDerWaalsContact C-N 3.27Å; N119-L121 PolarHBondContact O-N 2.88Å
122R97.2Very high94.7Very high57 Ų57106 Ų10622%0.21552%0.524CS..EExtended strand (participates in β ladder)trans-145.4153.9172.665178.2-179.587.4-6.2111.3M94 I95 R97M94-R122 CarbonylContact C-O 3.53Å; M94-R122 WeakPolarHBondContact CA-O 3.45Å; I95-R122 HydrophobicContact CB-CG 4.1Å; I95-R122 PolarHBondContact N-O 2.85Å; I95-R122 PolarHBondContact O-N 3.5Å; R97-R122 HydrophobicContact CG-CB 4.29Å; R97-R122 HydrophobicContact CG-CG 4.12Å
123P96.8Very high94.5Very high92 Ų92106.9 Ų106.960%0.59753%0.532SS*.EExtended strand (participates in β ladder)trans-58.3144.5166.3-23.634.5000111.5M94 K125M94-P123 HydrophobicContact SD-CB 4.46Å; M94-P123 HydrophobicContact SD-CG 4.17Å; P123-K125 PolarHBondContact O-N 3.3Å
124K96.5Very high94.3Very high67 Ų67102.1 Ų102.129%0.29152%0.516SS..PPolyproline II helixtrans-63.6133.5167.1-172.7178.7173.8-174.10108.1N90 K93 I95 K126N90-K124 PolarHBondContact O-NZ 2.98Å; K93-K124 HydrophobicContact CB-CB 4.41Å; K93-K124 WeakPolarHBondContact O-CB 3.39Å; K93-K124 PolarHBondContact O-N 3.44Å; I95-K124 HydrophobicContact CD1-CB 4.08Å; I95-K124 HydrophobicContact CD1-CD 4.41Å; I95-K124 HydrophobicContact CD1-CG 4.19Å; I95-K124 HydrophobicContact CG1-CB 3.78Å; I95-K124 HydrophobicContact CG1-CG 4.18Å; K124-K126 PolarHBondContact O-N 3.29Å
125K94Very high94Very high179 Ų17997.4 Ų97.478%0.77850%0.5SS*.PPolyproline II helixtrans-63.1131.7178.5-69.9-176177.4-176.60108.9P123P123-K125 PolarHBondContact O-N 3.3Å
126K87.6Confident93.8Very high161 Ų161103.8 Ų103.870%0.753%0.532SS*.PPolyproline II helixtrans-78.1144.7173.7-64.4-175177.2-174.20109.2K124K124-K126 PolarHBondContact O-N 3.29Å
127V82.3Confident93.4Very high139 Ų139107.3 Ų107.384%0.84252%0.522SS*.PPolyproline II helixtrans-70.7133.4169.4-173.70000106.7
128K77.1Confident93.1Very high269 Ų269108.7 Ų108.7100%1.1753%0.531SS*.  trans-71.20174.6-70.9-170.4177.1-1760110

Retrieved 128 of 128 residues in 128.1 ms (Link to these results)

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