| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 64.9 | Low | 84 | Confident | 200 Ų | 200 | 109.8 Ų | 109.8 | 99% | 0.985 | 59% | 0.586 | S | S | * | * | 0 | -47.7 | 0 | -59.5 | -174.5 | -164.3 | 0 | 0 | 112.3 | S3 Y4 R5 | M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.09Å; M1-Y4 PolarHBondContact O-N 3.08Å; M1-R5 PolarHBondContact O-N 3.47Å | |||
| 2 | A | 77.8 | Confident | 84 | Confident | 84 Ų | 84 | 108 Ų | 108 | 69% | 0.694 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -57.1 | -40.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | Y4 R5 L6 | A2-Y4 PolarHBondContact O-N 2.98Å; A2-R5 PolarHBondContact O-N 3.41Å; A2-L6 PolarHBondContact O-N 3.21Å |
| 3 | S | 81.4 | Confident | 84.1 | Confident | 94 Ų | 94 | 104.2 Ų | 104.2 | 66% | 0.657 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.7 | -40.2 | 177.1 | 49.8 | 0 | 0 | 0 | 0 | 113.4 | M1 L6 L7 | M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 3.09Å; S3-L6 PolarHBondContact O-N 3.03Å; S3-L7 WeakPolarHBondContact O-CB 3.4Å; S3-L7 PolarHBondContact O-N 2.86Å |
| 4 | Y | 83.7 | Confident | 83.9 | Confident | 148 Ų | 148 | 101.1 Ų | 101.1 | 58% | 0.58 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -66.1 | -43.3 | 176.5 | 179.1 | -100.3 | 0 | 0 | 0 | 111.4 | M1 A2 L6 L7 V8 | M1-Y4 PolarHBondContact O-N 3.08Å; A2-Y4 PolarHBondContact O-N 2.98Å; Y4-L6 VanDerWaalsContact C-N 3.32Å; Y4-L6 PolarHBondContact O-N 2.74Å; Y4-L7 PolarHBondContact O-N 3.15Å; Y4-V8 HydrophobicContact CD1-CG2 4.17Å; Y4-V8 HydrophobicContact CE1-CG2 3.73Å; Y4-V8 HydrophobicContact CE2-CG2 4.14Å; Y4-V8 WeakPolarHBondContact O-CG2 3.4Å; Y4-V8 PolarHBondContact O-N 2.9Å |
| 5 | R | 86.5 | Confident | 83.8 | Confident | 102 Ų | 102 | 101.7 Ų | 101.7 | 39% | 0.385 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -61.2 | -41.8 | 176.5 | -64.1 | -134.2 | 179 | -152.3 | -1.9 | 111.7 | M1 A2 V8 I9 I156 F159 | M1-R5 PolarHBondContact O-N 3.47Å; A2-R5 PolarHBondContact O-N 3.41Å; R5-V8 PolarHBondContact O-N 3.19Å; R5-I9 VanDerWaalsContact O-CG1 3.27Å; R5-I9 WeakPolarHBondContact O-CG1 3.34Å; R5-I9 PolarHBondContact O-N 2.91Å; R5-I156 PolarHBondContact NH1-O 3.42Å; R5-F159 PolarHBondContact NH2-O 3.22Å; R5-F159 PolarHBondContact NH2-OXT 3.34Å |
| 6 | L | 86.8 | Confident | 83.5 | Confident | 111 Ų | 111 | 99.8 Ų | 99.8 | 58% | 0.581 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -65.2 | -40.2 | 176.6 | -168.5 | 144.7 | 0 | 0 | 0 | 112.1 | A2 S3 Y4 I9 L10 | A2-L6 PolarHBondContact O-N 3.21Å; S3-L6 PolarHBondContact O-N 3.03Å; Y4-L6 VanDerWaalsContact C-N 3.32Å; Y4-L6 PolarHBondContact O-N 2.74Å; L6-I9 PolarHBondContact O-N 3.32Å; L6-L10 HydrophobicContact CD2-CD1 3.59Å; L6-L10 HydrophobicContact CD2-CG 4.17Å; L6-L10 WeakPolarHBondContact O-CG 3.38Å; L6-L10 PolarHBondContact O-N 3.09Å |
| 7 | L | 89.8 | Confident | 83.1 | Confident | 101 Ų | 101 | 97.5 Ų | 97.5 | 53% | 0.529 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.7 | -46.3 | 175.6 | -169.3 | 156.6 | 0 | 0 | 0 | 111.5 | S3 Y4 I9 L10 V11 | S3-L7 WeakPolarHBondContact O-CB 3.4Å; S3-L7 PolarHBondContact O-N 2.86Å; Y4-L7 PolarHBondContact O-N 3.15Å; L7-I9 VanDerWaalsContact C-N 3.33Å; L7-I9 PolarHBondContact O-N 3.39Å; L7-L10 PolarHBondContact O-N 3.39Å; L7-V11 HydrophobicContact CD2-CG2 3.86Å; L7-V11 WeakPolarHBondContact O-CG2 3.05Å; L7-V11 PolarHBondContact O-N 3.3Å |
| 8 | V | 88.3 | Confident | 82.5 | Confident | 63 Ų | 63 | 99.8 Ų | 99.8 | 38% | 0.382 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -60.8 | -43.3 | 177.8 | 173 | 0 | 0 | 0 | 0 | 111.2 | Y4 R5 V11 F12 | Y4-V8 HydrophobicContact CD1-CG2 4.17Å; Y4-V8 HydrophobicContact CE1-CG2 3.73Å; Y4-V8 HydrophobicContact CE2-CG2 4.14Å; Y4-V8 WeakPolarHBondContact O-CG2 3.4Å; Y4-V8 PolarHBondContact O-N 2.9Å; R5-V8 PolarHBondContact O-N 3.19Å; V8-V11 PolarHBondContact O-N 3.3Å; V8-F12 WeakPolarHBondContact O-CB 3.25Å; V8-F12 PolarHBondContact O-N 3.24Å |
| 9 | I | 88.6 | Confident | 81.8 | Confident | 110 Ų | 110 | 99.4 Ų | 99.4 | 56% | 0.564 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63 | -44.8 | 176.7 | -67.4 | 165.4 | 0 | 0 | 0 | 110.5 | R5 L6 L7 F12 S13 | R5-I9 VanDerWaalsContact O-CG1 3.27Å; R5-I9 WeakPolarHBondContact O-CG1 3.34Å; R5-I9 PolarHBondContact O-N 2.91Å; L6-I9 PolarHBondContact O-N 3.32Å; L7-I9 VanDerWaalsContact C-N 3.33Å; L7-I9 PolarHBondContact O-N 3.39Å; I9-F12 PolarHBondContact O-N 2.89Å; I9-S13 VanDerWaalsContact O-CB 3.31Å; I9-S13 WeakPolarHBondContact O-CB 3.46Å; I9-S13 PolarHBondContact O-N 2.92Å; I9-S13 PolarHBondContact O-OG 3.07Å |
| 10 | L | 87.9 | Confident | 81 | Confident | 107 Ų | 107 | 97.2 Ų | 97.2 | 56% | 0.56 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -62.1 | -45.3 | 178.2 | -79 | 176.7 | 0 | 0 | 0 | 112.5 | L6 L7 F12 S13 A14 | L6-L10 HydrophobicContact CD2-CD1 3.59Å; L6-L10 HydrophobicContact CD2-CG 4.17Å; L6-L10 WeakPolarHBondContact O-CG 3.38Å; L6-L10 PolarHBondContact O-N 3.09Å; L7-L10 PolarHBondContact O-N 3.39Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.19Å; L10-S13 PolarHBondContact O-N 3.17Å; L10-A14 WeakPolarHBondContact O-CB 3.17Å; L10-A14 PolarHBondContact O-N 3.4Å |
| 11 | V | 88.2 | Confident | 79.7 | Confident | 88 Ų | 88 | 94.6 Ų | 94.6 | 53% | 0.533 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -63.2 | -42.9 | 178 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | L7 V8 A14 L15 | L7-V11 HydrophobicContact CD2-CG2 3.86Å; L7-V11 WeakPolarHBondContact O-CG2 3.05Å; L7-V11 PolarHBondContact O-N 3.3Å; V8-V11 PolarHBondContact O-N 3.3Å; V11-A14 PolarHBondContact O-N 3.03Å; V11-L15 WeakPolarHBondContact O-CB 3.29Å; V11-L15 PolarHBondContact O-N 3.12Å |
| 12 | F | 84.6 | Confident | 79 | Confident | 88 Ų | 88 | 92.7 Ų | 92.7 | 39% | 0.386 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -64.8 | -43 | 176.3 | -173.2 | -97.5 | 0 | 0 | 0 | 111.7 | V8 I9 L10 A14 L15 V16 V148 | V8-F12 WeakPolarHBondContact O-CB 3.25Å; V8-F12 PolarHBondContact O-N 3.24Å; I9-F12 PolarHBondContact O-N 2.89Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.19Å; F12-A14 VanDerWaalsContact C-N 3.33Å; F12-A14 PolarHBondContact O-N 3.07Å; F12-L15 PolarHBondContact O-N 3.13Å; F12-V16 HydrophobicContact CD1-CG2 3.99Å; F12-V16 HydrophobicContact CE1-CG2 3.61Å; F12-V16 HydrophobicContact CE2-CG2 4.42Å; F12-V16 HydrophobicContact CZ-CG2 3.86Å; F12-V16 VanDerWaalsContact O-CG2 3.31Å; F12-V16 WeakPolarHBondContact O-CG2 3.2Å; F12-V16 PolarHBondContact O-N 3.06Å; F12-V148 HydrophobicContact CE2-CG1 4.09Å |
| 13 | S | 84.3 | Confident | 77.7 | Confident | 59 Ų | 59 | 94.7 Ų | 94.7 | 41% | 0.413 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -60.8 | -43.4 | 176.7 | -52.5 | 0 | 0 | 0 | 0 | 111.3 | I9 L10 V16 A17 | I9-S13 VanDerWaalsContact O-CB 3.31Å; I9-S13 WeakPolarHBondContact O-CB 3.46Å; I9-S13 PolarHBondContact O-N 2.92Å; I9-S13 PolarHBondContact O-OG 3.07Å; L10-S13 PolarHBondContact O-N 3.17Å; S13-V16 PolarHBondContact O-N 3.09Å; S13-A17 WeakPolarHBondContact O-CB 3.49Å; S13-A17 PolarHBondContact O-N 3.16Å |
| 14 | A | 81.4 | Confident | 75.9 | Confident | 60 Ų | 60 | 99.4 Ų | 99.4 | 50% | 0.496 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.2 | -39.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L10 V11 F12 A17 L18 | L10-A14 WeakPolarHBondContact O-CB 3.17Å; L10-A14 PolarHBondContact O-N 3.4Å; V11-A14 PolarHBondContact O-N 3.03Å; F12-A14 VanDerWaalsContact C-N 3.33Å; F12-A14 PolarHBondContact O-N 3.07Å; A14-A17 PolarHBondContact O-N 2.99Å; A14-L18 VanDerWaalsContact O-CB 3.27Å; A14-L18 WeakPolarHBondContact O-CB 3.25Å; A14-L18 PolarHBondContact O-N 3.09Å |
| 15 | L | 82 | Confident | 74.3 | Confident | 111 Ų | 111 | 97.5 Ų | 97.5 | 58% | 0.581 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.3 | -42.7 | 176.5 | -160 | 92.6 | 0 | 0 | 0 | 111.5 | V11 F12 L18 A19 | V11-L15 WeakPolarHBondContact O-CB 3.29Å; V11-L15 PolarHBondContact O-N 3.12Å; F12-L15 PolarHBondContact O-N 3.13Å; L15-L18 PolarHBondContact O-N 3.04Å; L15-A19 WeakPolarHBondContact O-CB 3.43Å; L15-A19 PolarHBondContact O-N 3.19Å |
| 16 | V | 80.2 | Confident | 72.8 | Confident | 71 Ų | 71 | 94.7 Ų | 94.7 | 43% | 0.43 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -67 | -42 | 175.2 | 173 | 0 | 0 | 0 | 0 | 110.7 | F12 S13 L18 A19 A20 | F12-V16 HydrophobicContact CD1-CG2 3.99Å; F12-V16 HydrophobicContact CE1-CG2 3.61Å; F12-V16 HydrophobicContact CE2-CG2 4.42Å; F12-V16 HydrophobicContact CZ-CG2 3.86Å; F12-V16 VanDerWaalsContact O-CG2 3.31Å; F12-V16 WeakPolarHBondContact O-CG2 3.2Å; F12-V16 PolarHBondContact O-N 3.06Å; S13-V16 PolarHBondContact O-N 3.09Å; V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 3.44Å; V16-A19 CarbonylContact O-C 3.57Å; V16-A19 PolarHBondContact O-N 3.43Å; V16-A20 WeakPolarHBondContact O-CB 3.34Å; V16-A20 PolarHBondContact O-N 2.77Å |
| 17 | A | 76.6 | Confident | 71.3 | Confident | 60 Ų | 60 | 96.6 Ų | 96.6 | 50% | 0.496 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -65.6 | -33.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S13 A14 G21 | S13-A17 WeakPolarHBondContact O-CB 3.49Å; S13-A17 PolarHBondContact O-N 3.16Å; A14-A17 PolarHBondContact O-N 2.99Å; A17-G21 WeakPolarHBondContact O-CA 3.32Å; A17-G21 PolarHBondContact O-N 3.15Å |
| 18 | L | 72.6 | Confident | 69.5 | Low | 140 Ų | 140 | 95.9 Ų | 95.9 | 73% | 0.733 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -72.8 | -34.3 | 173.2 | -168.8 | 66.2 | 0 | 0 | 0 | 111.6 | A14 L15 V16 | A14-L18 VanDerWaalsContact O-CB 3.27Å; A14-L18 WeakPolarHBondContact O-CB 3.25Å; A14-L18 PolarHBondContact O-N 3.09Å; L15-L18 PolarHBondContact O-N 3.04Å; V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 3.44Å |
| 19 | A | 69.3 | Low | 68.2 | Low | 91 Ų | 91 | 98.8 Ų | 98.8 | 75% | 0.752 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -74.1 | -29.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L15 V16 | L15-A19 WeakPolarHBondContact O-CB 3.43Å; L15-A19 PolarHBondContact O-N 3.19Å; V16-A19 CarbonylContact O-C 3.57Å; V16-A19 PolarHBondContact O-N 3.43Å |
| 20 | A | 65.1 | Low | 66.3 | Low | 56 Ų | 56 | 102.3 Ų | 102.3 | 46% | 0.463 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -92.2 | -25 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | V16 D22 T23 | V16-A20 WeakPolarHBondContact O-CB 3.34Å; V16-A20 PolarHBondContact O-N 2.77Å; A20-D22 PolarHBondContact O-N 2.85Å; A20-T23 PolarHBondContact O-N 2.94Å; A20-T23 PolarHBondContact O-OG1 2.86Å; A20-T23 VanDerWaalsContact O-OG1 3.09Å |
| 21 | G | 53.1 | Low | 65 | Low | 42 Ų | 42 | 101.8 Ų | 101.8 | 43% | 0.433 | 61% | 0.605 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -83.6 | 67.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | A17 | A17-G21 WeakPolarHBondContact O-CA 3.32Å; A17-G21 PolarHBondContact O-N 3.15Å |
| 22 | D | 51.5 | Low | 63.8 | Low | 160 Ų | 160 | 103.4 Ų | 103.4 | 86% | 0.856 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -165.1 | 26.5 | 146.3 | -92.8 | -20.1 | 0 | 0 | 0 | 111.3 | A20 Y24 | A20-D22 PolarHBondContact O-N 2.85Å; D22-Y24 PolarHBondContact O-N 2.91Å |
| 23 | T | 49.8 | Very low | 62.7 | Low | 127 Ų | 127 | 105.8 Ų | 105.8 | 78% | 0.779 | 64% | 0.635 | S | S | * | * | trans | -84.8 | 26 | 165.7 | 37.2 | 0 | 0 | 0 | 0 | 113.5 | A20 P25 | A20-T23 PolarHBondContact O-N 2.94Å; A20-T23 PolarHBondContact O-OG1 2.86Å; A20-T23 VanDerWaalsContact O-OG1 3.09Å; T23-P25 WeakPolarHBondContact O-CD 3.16Å | ||
| 24 | Y | 43 | Very low | 61.7 | Low | 192 Ų | 192 | 110.5 Ų | 110.5 | 75% | 0.753 | 65% | 0.654 | S | S | * | * | trans | -104.9 | 102.3 | 167.8 | -141 | -100.9 | 0 | 0 | 0 | 110.7 | D22 A26 | D22-Y24 PolarHBondContact O-N 2.91Å; Y24-A26 HydrophobicContact CD1-CB 3.73Å; Y24-A26 HydrophobicContact CE1-CB 3.08Å; Y24-A26 HydrophobicContact CE2-CB 4.39Å; Y24-A26 VanDerWaalsContact CZ-CB 3.46Å | ||
| 25 | P | 51.4 | Low | 60.8 | Low | 108 Ų | 108 | 112.9 Ų | 112.9 | 70% | 0.701 | 67% | 0.665 | S | S | * | * | trans | -111.4 | 70.7 | 147.2 | 35.8 | -27.8 | 0 | 0 | 0 | 108.4 | T23 | T23-P25 WeakPolarHBondContact O-CD 3.16Š| ||
| 26 | A | 54.3 | Low | 59.9 | Low | 43 Ų | 43 | 112.9 Ų | 112.9 | 36% | 0.355 | 67% | 0.672 | S | S | . | * | trans | -102.9 | 113.6 | 154.1 | 0 | 0 | 0 | 0 | 0 | 105.4 | Y24 | Y24-A26 HydrophobicContact CD1-CB 3.73Å; Y24-A26 HydrophobicContact CE1-CB 3.08Å; Y24-A26 HydrophobicContact CE2-CB 4.39Å; Y24-A26 VanDerWaalsContact CZ-CB 3.46Å | ||
| 27 | D | 54.4 | Low | 59 | Low | 151 Ų | 151 | 115.1 Ų | 115.1 | 81% | 0.807 | 69% | 0.688 | S | S | * | * | S | Bend | cis | -145 | 66.5 | 22.5 | -70.9 | -66.1 | 0 | 0 | 0 | 109.8 | P29 | D27-P29 WeakPolarHBondContact O-CD 3.38Š|
| 28 | C | 52 | Low | 58.4 | Low | 87 Ų | 87 | 118.1 Ų | 118.1 | 59% | 0.588 | 70% | 0.7 | S | S | * | * | trans | -91.7 | 100.8 | 163.2 | -69.2 | 0 | 0 | 0 | 0 | 106.7 | Y30 | C28-Y30 CarbonylContact O-C 3.58Å; C28-Y30 PolarHBondContact O-N 2.9Å | ||
| 29 | P | 62.6 | Low | 57.8 | Low | 123 Ų | 123 | 116.6 Ų | 116.6 | 80% | 0.799 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -62.1 | -9.2 | -178.1 | 24.8 | -34.5 | 0 | 0 | 0 | 113.4 | D27 | D27-P29 WeakPolarHBondContact O-CD 3.38Š|
| 30 | Y | 48.1 | Very low | 57.3 | Low | 185 Ų | 185 | 118 Ų | 118 | 73% | 0.725 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -111.3 | 116.7 | 168.9 | -87.7 | -92.6 | 0 | 0 | 0 | 109.9 | C28 C32 | C28-Y30 CarbonylContact O-C 3.58Å; C28-Y30 PolarHBondContact O-N 2.9Å; Y30-C32 PolarHBondContact O-N 3.08Å |
| 31 | P | 61.3 | Low | 56.9 | Low | 95 Ų | 95 | 120.8 Ų | 120.8 | 62% | 0.617 | 71% | 0.708 | S | S | * | * | trans | -54.7 | 135.5 | 166.7 | 23.3 | -31.1 | 0 | 0 | 0 | 107.9 | L33 | P31-L33 VanDerWaalsContact C-N 3.26Å; P31-L33 PolarHBondContact O-N 3.4Å | ||
| 32 | C | 61.9 | Low | 57.1 | Low | 122 Ų | 122 | 124 Ų | 124 | 82% | 0.824 | 72% | 0.72 | S | S | * | * | trans | -54.1 | 93.8 | 172.9 | -62 | 0 | 0 | 0 | 0 | 108.4 | Y30 L34 | Y30-C32 PolarHBondContact O-N 3.08Å; C32-L34 PolarHBondContact O-N 2.71Å | ||
| 33 | L | 62.7 | Low | 57.5 | Low | 139 Ų | 139 | 123.4 Ų | 123.4 | 73% | 0.728 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -61 | 127.9 | 174.4 | -63.5 | 177.3 | 0 | 0 | 0 | 106 | P31 | P31-L33 VanDerWaalsContact C-N 3.26Å; P31-L33 PolarHBondContact O-N 3.4Å |
| 34 | L | 63.1 | Low | 58.2 | Low | 157 Ų | 157 | 122.4 Ų | 122.4 | 82% | 0.822 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 139.1 | 169.4 | -89.9 | 75.5 | 0 | 0 | 0 | 107.7 | C32 | C32-L34 PolarHBondContact O-N 2.71Š|
| 35 | P | 63 | Low | 59.6 | Low | 111 Ų | 111 | 118.6 Ų | 118.6 | 72% | 0.721 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 137.6 | 175.2 | 19.3 | -29.1 | 0 | 0 | 0 | 108.5 | ||
| 36 | P | 61.6 | Low | 60.6 | Low | 111 Ų | 111 | 118.9 Ų | 118.9 | 72% | 0.721 | 72% | 0.715 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 144.8 | 179.5 | -24.9 | 31.6 | 0 | 0 | 0 | 109.9 | T38 | P36-T38 PolarHBondContact O-N 3.33Å; P36-T38 VanDerWaalsContact O-N 3.08Å |
| 37 | P | 62.6 | Low | 61.4 | Low | 118 Ų | 118 | 122.2 Ų | 122.2 | 77% | 0.766 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -48.9 | 126.8 | 166.7 | -19.9 | 29.9 | 0 | 0 | 0 | 107.4 | P39 | P37-P39 WeakPolarHBondContact O-CD 3.38Š|
| 38 | T | 63.3 | Low | 62.2 | Low | 123 Ų | 123 | 121 Ų | 121 | 76% | 0.755 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -47.9 | 117.6 | 169.6 | 42.4 | 0 | 0 | 0 | 0 | 106.3 | P36 V40 | P36-T38 PolarHBondContact O-N 3.33Å; P36-T38 VanDerWaalsContact O-N 3.08Å; T38-V40 PolarHBondContact O-N 2.93Å |
| 39 | P | 59.3 | Low | 63 | Low | 107 Ų | 107 | 122.5 Ų | 122.5 | 70% | 0.695 | 74% | 0.744 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 118.3 | 179.1 | 20.1 | -29.3 | 0 | 0 | 0 | 106.3 | P37 T41 | P37-P39 WeakPolarHBondContact O-CD 3.38Å; P39-T41 PolarHBondContact O-N 3.46Å |
| 40 | V | 59.4 | Low | 63.2 | Low | 121 Ų | 121 | 122.7 Ų | 122.7 | 73% | 0.733 | 74% | 0.744 | S | S | * | * | trans | -66.7 | 93.6 | 170.9 | -139.7 | 0 | 0 | 0 | 0 | 104.1 | T38 T42 | T38-V40 PolarHBondContact O-N 2.93Å; V40-T42 WeakPolarHBondContact CG1-OG1 3.46Å; V40-T42 PolarHBondContact O-N 3.42Å; V40-T42 VanDerWaalsContact O-N 3.15Å | ||
| 41 | T | 56 | Low | 63.6 | Low | 114 Ų | 114 | 118.4 Ų | 118.4 | 70% | 0.699 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -72.5 | 3.7 | -177.9 | 46.7 | 0 | 0 | 0 | 0 | 112.5 | P39 D43 | P39-T41 PolarHBondContact O-N 3.46Å; T41-D43 PolarHBondContact O-N 3.28Å |
| 42 | T | 58.1 | Low | 63.4 | Low | 110 Ų | 110 | 119.8 Ų | 119.8 | 68% | 0.675 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -72.8 | -20.9 | -174 | 34.9 | 0 | 0 | 0 | 0 | 114.7 | V40 | V40-T42 WeakPolarHBondContact CG1-OG1 3.46Å; V40-T42 PolarHBondContact O-N 3.42Å; V40-T42 VanDerWaalsContact O-N 3.15Å |
| 43 | D | 60.4 | Low | 62.8 | Low | 147 Ų | 147 | 117.9 Ų | 117.9 | 79% | 0.786 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -126.8 | 31.7 | -175.2 | -72.3 | -49.3 | 0 | 0 | 0 | 114.5 | T41 P45 | T41-D43 PolarHBondContact O-N 3.28Å; D43-P45 WeakPolarHBondContact O-CD 3.48Å |
| 44 | C | 63.6 | Low | 62.1 | Low | 107 Ų | 107 | 115.2 Ų | 115.2 | 72% | 0.723 | 74% | 0.744 | S | S | * | * | trans | -76.4 | 113.9 | 163.2 | -73.9 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 45 | P | 73 | Confident | 61.2 | Low | 112 Ų | 112 | 116.3 Ų | 116.3 | 73% | 0.727 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 145.5 | 173.1 | 25.6 | -33.3 | 0 | 0 | 0 | 109.7 | D43 | D43-P45 WeakPolarHBondContact O-CD 3.48Š|
| 46 | P | 71.6 | Confident | 60.5 | Low | 114 Ų | 114 | 116.4 Ų | 116.4 | 74% | 0.74 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 144.9 | 179 | 24.4 | -33.1 | 0 | 0 | 0 | 110.2 | ||
| 47 | P | 70.8 | Confident | 59.9 | Low | 112 Ų | 112 | 120.7 Ų | 120.7 | 73% | 0.727 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 143.4 | 175 | 24.3 | -32.8 | 0 | 0 | 0 | 109.9 | S49 | P47-S49 PolarHBondContact O-N 3.1Š|
| 48 | P | 72.1 | Confident | 59.5 | Low | 125 Ų | 125 | 120.2 Ų | 120.2 | 81% | 0.812 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 132 | 174.6 | -21.4 | 30.8 | 0 | 0 | 0 | 110.1 | T50 | P48-T50 PolarHBondContact O-N 3Š|
| 49 | S | 69 | Low | 59.3 | Low | 119 Ų | 119 | 120 Ų | 120 | 83% | 0.832 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 122.4 | 172.9 | -51.7 | 0 | 0 | 0 | 0 | 109.1 | P47 P51 | P47-S49 PolarHBondContact O-N 3.1Å; S49-P51 WeakPolarHBondContact O-CD 3.35Å |
| 50 | T | 66.7 | Low | 59.2 | Low | 128 Ų | 128 | 120.5 Ų | 120.5 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 122.6 | 172 | 39.8 | 0 | 0 | 0 | 0 | 108.6 | P48 S52 | P48-T50 PolarHBondContact O-N 3Å; T50-S52 PolarHBondContact O-N 3Å; T50-S52 VanDerWaalsContact O-N 3.09Å |
| 51 | P | 56.1 | Low | 58.7 | Low | 94 Ų | 94 | 120.3 Ų | 120.3 | 61% | 0.61 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 116.1 | 173.4 | 23.6 | -29.8 | 0 | 0 | 0 | 108.7 | S49 S53 Y55 | S49-P51 WeakPolarHBondContact O-CD 3.35Å; P51-S53 PolarHBondContact O-N 3.46Å; P51-Y55 HydrophobicContact CG-CE2 4.47Å |
| 52 | S | 56.5 | Low | 58.6 | Low | 124 Ų | 124 | 120.4 Ų | 120.4 | 87% | 0.867 | 76% | 0.755 | S | S | * | * | trans | -73.1 | 43.3 | 173.7 | -177.8 | 0 | 0 | 0 | 0 | 112.2 | T50 | T50-S52 PolarHBondContact O-N 3Å; T50-S52 VanDerWaalsContact O-N 3.09Å | ||
| 53 | S | 50.5 | Low | 58.2 | Low | 83 Ų | 83 | 120.2 Ų | 120.2 | 58% | 0.58 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -128.2 | 116.7 | 177.2 | -69.9 | 0 | 0 | 0 | 0 | 109 | P51 Y55 | P51-S53 PolarHBondContact O-N 3.46Å; S53-Y55 WeakPolarHBondContact O-CD2 3.39Å; S53-Y55 PolarHBondContact O-N 3.45Å |
| 54 | G | 47.3 | Very low | 57.7 | Low | 83 Ų | 83 | 119.2 Ų | 119.2 | 86% | 0.856 | 76% | 0.763 | S | S | * | * | trans | -54.5 | 107.4 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | S56 | G54-S56 VanDerWaalsContact C-N 3.35Å; G54-S56 PolarHBondContact O-N 3.14Å | ||
| 55 | Y | 44.8 | Very low | 57 | Low | 180 Ų | 180 | 118.5 Ų | 118.5 | 71% | 0.706 | 76% | 0.759 | S | S | * | * | trans | -82 | 90.3 | 160.2 | -69.9 | -78.4 | 0 | 0 | 0 | 107.6 | P51 S53 Y57 | P51-Y55 HydrophobicContact CG-CE2 4.47Å; S53-Y55 WeakPolarHBondContact O-CD2 3.39Å; S53-Y55 PolarHBondContact O-N 3.45Å; Y55-Y57 PolarHBondContact O-N 2.99Å | ||
| 56 | S | 48 | Very low | 55.7 | Low | 113 Ų | 113 | 121 Ų | 121 | 79% | 0.79 | 77% | 0.766 | S | S | * | * | trans | -67.1 | 103.6 | 158.9 | -171.4 | 0 | 0 | 0 | 0 | 107 | G54 P58 | G54-S56 VanDerWaalsContact C-N 3.35Å; G54-S56 PolarHBondContact O-N 3.14Å; S56-P58 WeakPolarHBondContact O-CD 3.22Å | ||
| 57 | Y | 48.8 | Very low | 54.4 | Low | 201 Ų | 201 | 122 Ų | 122 | 79% | 0.788 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 121.5 | 170.5 | -85.6 | -89.7 | 0 | 0 | 0 | 108.3 | Y55 | Y55-Y57 PolarHBondContact O-N 2.99Š|
| 58 | P | 53.8 | Low | 53.4 | Low | 108 Ų | 108 | 122 Ų | 122 | 70% | 0.701 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 140.3 | 171.5 | 26.6 | -31.3 | 0 | 0 | 0 | 109.5 | S56 | S56-P58 WeakPolarHBondContact O-CD 3.22Š|
| 59 | P | 60.3 | Low | 52.2 | Low | 117 Ų | 117 | 121.8 Ų | 121.8 | 76% | 0.76 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 141.9 | 177.6 | 26.6 | -33.6 | 0 | 0 | 0 | 110.3 | S61 | P59-S61 PolarHBondContact O-N 3.38Š|
| 60 | P | 56.4 | Low | 51.2 | Low | 119 Ų | 119 | 121.7 Ų | 121.7 | 77% | 0.773 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 133.5 | 174 | 24.1 | -30.3 | 0 | 0 | 0 | 110.1 | S62 | P60-S62 PolarHBondContact O-N 2.73Š|
| 61 | S | 48.7 | Very low | 50.3 | Low | 116 Ų | 116 | 121 Ų | 121 | 81% | 0.811 | 77% | 0.769 | S | S | * | * | trans | -66.4 | 96.3 | 174.7 | 52.9 | 0 | 0 | 0 | 0 | 109.8 | P59 S63 | P59-S61 PolarHBondContact O-N 3.38Å; S61-S63 PolarHBondContact O-N 2.92Å; S61-S63 VanDerWaalsContact O-N 3.08Å | ||
| 62 | S | 55.2 | Low | 49.8 | Very low | 116 Ų | 116 | 121.5 Ų | 121.5 | 81% | 0.811 | 78% | 0.775 | S | S | * | * | trans | -76.9 | 93 | 171.6 | 34.6 | 0 | 0 | 0 | 0 | 109.4 | P60 | P60-S62 PolarHBondContact O-N 2.73Š| ||
| 63 | S | 49.2 | Very low | 49.3 | Very low | 107 Ų | 107 | 121 Ų | 121 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -54 | 134 | 160.3 | 36.7 | 0 | 0 | 0 | 0 | 110 | S61 S65 | S61-S63 PolarHBondContact O-N 2.92Å; S61-S63 VanDerWaalsContact O-N 3.08Å; S63-S65 PolarHBondContact O-N 3.32Å; S63-S65 VanDerWaalsContact O-N 3.09Å | ||
| 64 | S | 49 | Very low | 48.7 | Very low | 126 Ų | 126 | 126.1 Ų | 126.1 | 88% | 0.881 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -64.6 | 100 | -179.6 | -66.3 | 0 | 0 | 0 | 0 | 111.8 | ||
| 65 | S | 49.6 | Very low | 48.2 | Very low | 91 Ų | 91 | 130 Ų | 130 | 64% | 0.636 | 77% | 0.768 | S | S | * | * | trans | -179.8 | 72.1 | 153.6 | 57.1 | 0 | 0 | 0 | 0 | 111.2 | S63 | S63-S65 PolarHBondContact O-N 3.32Å; S63-S65 VanDerWaalsContact O-N 3.09Å | ||
| 66 | N | 46.2 | Very low | 48.2 | Very low | 164 Ų | 164 | 128.7 Ų | 128.7 | 88% | 0.877 | 77% | 0.774 | S | S | * | * | trans | -147 | 68.8 | 159.4 | -82 | -52.8 | 0 | 0 | 0 | 107.8 | P68 | N66-P68 WeakPolarHBondContact O-CD 3.45Š| ||
| 67 | T | 43.6 | Very low | 48 | Very low | 135 Ų | 135 | 132.2 Ų | 132.2 | 83% | 0.828 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 120.4 | 168.4 | -0.5 | 0 | 0 | 0 | 0 | 108.3 | ||
| 68 | P | 49.8 | Very low | 48 | Very low | 112 Ų | 112 | 127.5 Ų | 127.5 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 139.9 | 174.5 | 25.3 | -30.4 | 0 | 0 | 0 | 110.1 | N66 S70 | N66-P68 WeakPolarHBondContact O-CD 3.45Å; P68-S70 PolarHBondContact O-N 3.09Å |
| 69 | P | 47.3 | Very low | 48.1 | Very low | 121 Ų | 121 | 127.6 Ų | 127.6 | 79% | 0.786 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 136.3 | -176.2 | 24.6 | -31.3 | 0 | 0 | 0 | 111 | S71 | P69-S71 VanDerWaalsContact C-N 3.33Å; P69-S71 PolarHBondContact O-N 3.49Å |
| 70 | S | 48.1 | Very low | 47.5 | Very low | 117 Ų | 117 | 128.1 Ų | 128.1 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -67.8 | 83.7 | 176.6 | 53.9 | 0 | 0 | 0 | 0 | 110.7 | P68 S72 | P68-S70 PolarHBondContact O-N 3.09Å; S70-S72 VanDerWaalsContact C-N 3.34Å; S70-S72 PolarHBondContact O-N 3.34Å; S70-S72 VanDerWaalsContact O-N 3.15Å | ||
| 71 | S | 46.7 | Very low | 47.1 | Very low | 113 Ų | 113 | 132.3 Ų | 132.3 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | trans | -82.8 | 85.1 | 167.2 | 59.7 | 0 | 0 | 0 | 0 | 109.3 | P69 | P69-S71 VanDerWaalsContact C-N 3.33Å; P69-S71 PolarHBondContact O-N 3.49Å | ||
| 72 | S | 46.7 | Very low | 46.7 | Very low | 105 Ų | 105 | 130.2 Ų | 130.2 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | trans | -60.1 | 129.6 | 151.8 | 51.7 | 0 | 0 | 0 | 0 | 108.8 | S70 | S70-S72 VanDerWaalsContact C-N 3.34Å; S70-S72 PolarHBondContact O-N 3.34Å; S70-S72 VanDerWaalsContact O-N 3.15Å | ||
| 73 | S | 44.8 | Very low | 45.8 | Very low | 115 Ų | 115 | 128.4 Ų | 128.4 | 80% | 0.804 | 77% | 0.774 | S | S | * | * | trans | 92.4 | 84.1 | 171.8 | -60.5 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 74 | Y | 39.3 | Very low | 45.4 | Very low | 190 Ų | 190 | 127.3 Ų | 127.3 | 75% | 0.745 | 78% | 0.78 | S | S | * | * | S | Bend | trans | 174 | 113.7 | 144.8 | -127.1 | -144.3 | 0 | 0 | 0 | 106.3 | ||
| 75 | W | 36.4 | Very low | 45.2 | Very low | 164 Ų | 164 | 124.5 Ų | 124.5 | 62% | 0.621 | 77% | 0.771 | S | S | * | * | cis | -148.8 | 131.8 | 12.2 | -78.5 | 90.5 | 0 | 0 | 0 | 106.8 | Y77 | W75-Y77 HydrophobicContact CB-CD2 4.05Å; W75-Y77 HydrophobicContact CB-CE2 3.98Å; W75-Y77 HydrophobicContact CG-CE2 4.37Å; W75-Y77 PolarHBondContact O-N 3.41Å | ||
| 76 | N | 44.6 | Very low | 44.8 | Very low | 153 Ų | 153 | 123.5 Ų | 123.5 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -83.7 | 99.5 | 170.3 | -166.3 | -64.6 | 0 | 0 | 0 | 107.9 | ||||
| 77 | Y | 42.9 | Very low | 44.6 | Very low | 186 Ų | 186 | 126 Ų | 126 | 73% | 0.729 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -87.3 | 120.9 | 163.3 | -81.3 | -84.7 | 0 | 0 | 0 | 107.9 | W75 | W75-Y77 HydrophobicContact CB-CD2 4.05Å; W75-Y77 HydrophobicContact CB-CE2 3.98Å; W75-Y77 HydrophobicContact CG-CE2 4.37Å; W75-Y77 PolarHBondContact O-N 3.41Å |
| 78 | P | 48.4 | Very low | 44.9 | Very low | 103 Ų | 103 | 125.5 Ų | 125.5 | 67% | 0.669 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 138.1 | 176.8 | 26 | -32 | 0 | 0 | 0 | 110.2 | ||
| 79 | P | 56.9 | Low | 45.1 | Very low | 110 Ų | 110 | 125.3 Ų | 125.3 | 71% | 0.714 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 151.9 | 177.5 | 26.9 | -33.4 | 0 | 0 | 0 | 111.3 | Q81 | P79-Q81 PolarHBondContact O-N 3.05Š|
| 80 | P | 47.6 | Very low | 45.1 | Very low | 127 Ų | 127 | 129.8 Ų | 129.8 | 83% | 0.825 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 125 | 178.6 | -18.7 | 29.6 | 0 | 0 | 0 | 111.1 | G82 | P80-G82 PolarHBondContact O-N 3.06Å; P80-G82 VanDerWaalsContact O-N 3.07Å |
| 81 | Q | 48.3 | Very low | 45 | Very low | 208 Ų | 208 | 133.9 Ų | 133.9 | 97% | 0.972 | 77% | 0.765 | S | S | * | * | trans | -81 | 85.1 | 178 | -159.2 | 173.3 | 17.1 | 0 | 0 | 108.6 | P79 | P79-Q81 PolarHBondContact O-N 3.05Š| ||
| 82 | G | 39.6 | Very low | 44.9 | Very low | 71 Ų | 71 | 137.4 Ų | 137.4 | 73% | 0.732 | 77% | 0.769 | S | S | * | * | trans | -168.2 | 98.6 | -179.5 | 0 | 0 | 0 | 0 | 0 | 115 | P80 | P80-G82 PolarHBondContact O-N 3.06Å; P80-G82 VanDerWaalsContact O-N 3.07Å | ||
| 83 | G | 37.2 | Very low | 45.1 | Very low | 78 Ų | 78 | 137.4 Ų | 137.4 | 80% | 0.804 | 77% | 0.767 | S | S | * | * | trans | 77.3 | 92 | 155.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 84 | G | 40.7 | Very low | 45.3 | Very low | 84 Ų | 84 | 138 Ų | 138 | 87% | 0.866 | 77% | 0.768 | S | S | * | * | cis | 66.6 | 68.4 | 48.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | G86 | G84-G86 PolarHBondContact O-N 2.96Š| ||
| 85 | G | 44.7 | Very low | 45.6 | Very low | 67 Ų | 67 | 134.4 Ų | 134.4 | 69% | 0.691 | 78% | 0.778 | S | S | * | * | trans | 66.8 | 41 | 148.1 | 0 | 0 | 0 | 0 | 0 | 118.1 | Y87 | G85-Y87 VanDerWaalsContact C-N 3.34Å; G85-Y87 PolarHBondContact O-N 3.42Å; G85-Y87 VanDerWaalsContact O-N 3.13Å | ||
| 86 | G | 41.1 | Very low | 45.9 | Very low | 71 Ų | 71 | 129.7 Ų | 129.7 | 73% | 0.732 | 78% | 0.78 | S | S | * | * | trans | -79.2 | 82.5 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | G84 I88 | G84-G86 PolarHBondContact O-N 2.96Å; G86-I88 PolarHBondContact O-N 3.49Å | ||
| 87 | Y | 42.3 | Very low | 45.5 | Very low | 216 Ų | 216 | 126.5 Ų | 126.5 | 85% | 0.847 | 78% | 0.783 | S | S | * | * | trans | -54.2 | 109 | 167.8 | -79.3 | -102 | 0 | 0 | 0 | 109.1 | G85 P89 | G85-Y87 VanDerWaalsContact C-N 3.34Å; G85-Y87 PolarHBondContact O-N 3.42Å; G85-Y87 VanDerWaalsContact O-N 3.13Å; Y87-P89 VanDerWaalsContact O-CD 3.25Å; Y87-P89 WeakPolarHBondContact O-CD 3.3Å | ||
| 88 | I | 49.9 | Very low | 45.2 | Very low | 125 Ų | 125 | 121.5 Ų | 121.5 | 64% | 0.641 | 79% | 0.788 | S | S | * | * | trans | -84.3 | 107 | 165.5 | -55.5 | -179.3 | 0 | 0 | 0 | 106 | G86 Y90 | G86-I88 PolarHBondContact O-N 3.49Å; I88-Y90 PolarHBondContact O-N 2.99Å | ||
| 89 | P | 54.4 | Low | 44.7 | Very low | 107 Ų | 107 | 120.7 Ų | 120.7 | 70% | 0.695 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.7 | -13.1 | -168.8 | -20.8 | 33.7 | 0 | 0 | 0 | 114.9 | Y87 | Y87-P89 VanDerWaalsContact O-CD 3.25Å; Y87-P89 WeakPolarHBondContact O-CD 3.3Å |
| 90 | Y | 46.7 | Very low | 43.8 | Very low | 215 Ų | 215 | 119.4 Ų | 119.4 | 84% | 0.843 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.9 | -3.4 | -171.6 | -61.7 | -71.2 | 0 | 0 | 0 | 115 | I88 | I88-Y90 PolarHBondContact O-N 2.99Š|
| 91 | Y | 46.6 | Very low | 43.4 | Very low | 203 Ų | 203 | 117.1 Ų | 117.1 | 80% | 0.796 | 81% | 0.805 | S | S | * | * | trans | -105.8 | 87.3 | 169.9 | -91.6 | -90.7 | 0 | 0 | 0 | 109 | P93 | Y91-P93 WeakPolarHBondContact O-CD 3.19Š| ||
| 92 | Q | 44.1 | Very low | 43.2 | Very low | 187 Ų | 187 | 111.1 Ų | 111.1 | 87% | 0.874 | 80% | 0.799 | S | S | * | * | trans | -78.4 | 106.6 | 157.9 | -94.7 | -177.2 | -60.4 | 0 | 0 | 108 | ||||
| 93 | P | 51.1 | Low | 43.5 | Very low | 106 Ų | 106 | 110.9 Ų | 110.9 | 69% | 0.688 | 80% | 0.796 | S | S | * | * | trans | -66.5 | 148.8 | 164.8 | 28.2 | -33.5 | 0 | 0 | 0 | 109.8 | Y91 A95 | Y91-P93 WeakPolarHBondContact O-CD 3.19Å; P93-A95 PolarHBondContact O-N 3.01Å | ||
| 94 | P | 48.3 | Very low | 44.4 | Very low | 126 Ų | 126 | 115.7 Ų | 115.7 | 82% | 0.818 | 80% | 0.795 | S | S | * | * | trans | -51.2 | 133.8 | -179.3 | -28.1 | 34.8 | 0 | 0 | 0 | 113.1 | G96 | P94-G96 VanDerWaalsContact C-N 3.33Å; P94-G96 PolarHBondContact O-N 3.09Å | ||
| 95 | A | 46.6 | Very low | 45.1 | Very low | 116 Ų | 116 | 119 Ų | 119 | 96% | 0.959 | 79% | 0.793 | S | S | * | * | trans | -71.2 | 84.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | P93 | P93-A95 PolarHBondContact O-N 3.01Š| ||
| 96 | G | 41.7 | Very low | 45.7 | Very low | 65 Ų | 65 | 124.7 Ų | 124.7 | 67% | 0.67 | 80% | 0.795 | S | S | * | * | trans | -159.1 | 90.2 | 163.5 | 0 | 0 | 0 | 0 | 0 | 105.5 | P94 | P94-G96 VanDerWaalsContact C-N 3.33Å; P94-G96 PolarHBondContact O-N 3.09Å | ||
| 97 | G | 36.4 | Very low | 47.1 | Very low | 85 Ų | 85 | 126.3 Ų | 126.3 | 88% | 0.876 | 79% | 0.793 | S | S | * | * | 91.4 | 107.9 | 62 | 0 | 0 | 0 | 0 | 0 | 107.3 | |||||
| 98 | G | 37.5 | Very low | 48.5 | Very low | 81 Ų | 81 | 120.2 Ų | 120.2 | 84% | 0.835 | 79% | 0.787 | S | S | * | * | trans | 113.8 | 102.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 99 | G | 36.1 | Very low | 49.7 | Very low | 87 Ų | 87 | 119.8 Ų | 119.8 | 90% | 0.897 | 79% | 0.792 | S | S | * | * | trans | -69.2 | 162.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 100 | G | 38.3 | Very low | 50.8 | Low | 82 Ų | 82 | 120 Ų | 120 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | trans | 117.8 | 102.3 | 148.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 101 | G | 40.7 | Very low | 52.4 | Low | 80 Ų | 80 | 115.2 Ų | 115.2 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | trans | 85.6 | 102.4 | 165.8 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 102 | G | 42.8 | Very low | 54 | Low | 82 Ų | 82 | 111.2 Ų | 111.2 | 85% | 0.845 | 79% | 0.788 | S | S | * | * | 95 | 91.8 | 57.8 | 0 | 0 | 0 | 0 | 0 | 107.4 | |||||
| 103 | G | 46.8 | Very low | 55.5 | Low | 65 Ų | 65 | 109.5 Ų | 109.5 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | S | Bend | trans | 80.7 | 109.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | N105 | G103-N105 VanDerWaalsContact C-N 3.26Å; G103-N105 PolarHBondContact O-N 2.69Å |
| 104 | F | 55.4 | Low | 56.4 | Low | 180 Ų | 180 | 109.2 Ų | 109.2 | 79% | 0.789 | 78% | 0.783 | S | S | * | * | trans | -54.2 | 97.4 | 163.1 | -59.4 | -83 | 0 | 0 | 0 | 108.2 | Y106 | F104-Y106 HydrophobicContact CB-CD2 3.54Å; F104-Y106 HydrophobicContact CB-CE2 3.72Å; F104-Y106 HydrophobicContact CD1-CD2 4.32Å; F104-Y106 AromaticContact CD1-CE2 3.58Å; F104-Y106 HydrophobicContact CD1-CE2 3.58Å; F104-Y106 HydrophobicContact CG-CD2 4.27Å; F104-Y106 AromaticContact CG-CE2 3.98Å; F104-Y106 HydrophobicContact CG-CE2 3.98Å; F104-Y106 PolarHBondContact O-N 2.77Å | ||
| 105 | N | 55.4 | Low | 57.6 | Low | 153 Ų | 153 | 111.4 Ų | 111.4 | 82% | 0.818 | 79% | 0.786 | S | S | * | * | trans | -75 | 54.4 | 169 | -158.6 | -73.4 | 0 | 0 | 0 | 107.6 | G103 P107 | G103-N105 VanDerWaalsContact C-N 3.26Å; G103-N105 PolarHBondContact O-N 2.69Å; N105-P107 WeakPolarHBondContact O-CD 3.44Å | ||
| 106 | Y | 56.8 | Low | 58.2 | Low | 186 Ų | 186 | 110.7 Ų | 110.7 | 73% | 0.729 | 77% | 0.769 | S | S | * | * | trans | -75.6 | 113.6 | 158.6 | -65.4 | -62.5 | 0 | 0 | 0 | 104.2 | F104 A108 | F104-Y106 HydrophobicContact CB-CD2 3.54Å; F104-Y106 HydrophobicContact CB-CE2 3.72Å; F104-Y106 HydrophobicContact CD1-CD2 4.32Å; F104-Y106 AromaticContact CD1-CE2 3.58Å; F104-Y106 HydrophobicContact CD1-CE2 3.58Å; F104-Y106 HydrophobicContact CG-CD2 4.27Å; F104-Y106 AromaticContact CG-CE2 3.98Å; F104-Y106 HydrophobicContact CG-CE2 3.98Å; F104-Y106 PolarHBondContact O-N 2.77Å; Y106-A108 PolarHBondContact O-N 3.22Å | ||
| 107 | P | 70.6 | Confident | 59.1 | Low | 105 Ų | 105 | 111.8 Ų | 111.8 | 68% | 0.682 | 77% | 0.765 | S | S | * | * | trans | -48.9 | 138.7 | 162.5 | 19.7 | -29.6 | 0 | 0 | 0 | 107.5 | N105 | N105-P107 WeakPolarHBondContact O-CD 3.44Š| ||
| 108 | A | 73.2 | Confident | 60.1 | Low | 89 Ų | 89 | 117 Ų | 117 | 74% | 0.736 | 76% | 0.758 | S | S | * | * | trans | -44.8 | 130.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 108.3 | Y106 | Y106-A108 PolarHBondContact O-N 3.22Š| ||
| 109 | P | 74 | Confident | 61.2 | Low | 115 Ų | 115 | 120.4 Ų | 120.4 | 75% | 0.747 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -54 | 142.2 | -177.2 | 21.9 | -32.1 | 0 | 0 | 0 | 108.8 | ||
| 110 | P | 78.7 | Confident | 62.5 | Low | 112 Ų | 112 | 118.9 Ų | 118.9 | 73% | 0.727 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 147.1 | 179.2 | 23.4 | -33 | 0 | 0 | 0 | 109.4 | ||
| 111 | P | 79.7 | Confident | 63.6 | Low | 115 Ų | 115 | 123.2 Ų | 123.2 | 75% | 0.747 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 140.1 | 177.4 | -25.1 | 32.2 | 0 | 0 | 0 | 110.2 | N113 | P111-N113 PolarHBondContact O-N 2.89Š|
| 112 | P | 79.6 | Confident | 64.3 | Low | 119 Ų | 119 | 128.2 Ų | 128.2 | 77% | 0.773 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 140.5 | 174.2 | -23.8 | 31.7 | 0 | 0 | 0 | 110 | ||
| 113 | N | 76.5 | Confident | 64.8 | Low | 150 Ų | 150 | 133.5 Ų | 133.5 | 80% | 0.802 | 70% | 0.703 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 128.9 | 165.7 | -73.1 | 63.9 | 0 | 0 | 0 | 107.9 | P111 I115 | P111-N113 PolarHBondContact O-N 2.89Å; N113-I115 PolarHBondContact O-N 3.47Å; N113-I115 VanDerWaalsContact O-N 3.07Å |
| 114 | P | 69.9 | Low | 65.5 | Low | 100 Ų | 100 | 139.9 Ų | 139.9 | 65% | 0.649 | 71% | 0.707 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 122.9 | 175.4 | -23.7 | 32 | 0 | 0 | 0 | 108.8 | V116 | P114-V116 WeakPolarHBondContact CB-O 3.44Å; P114-V116 PolarHBondContact O-N 2.68Å; P114-V116 VanDerWaalsContact O-N 3.09Å |
| 115 | I | 73 | Confident | 65.8 | Low | 172 Ų | 172 | 135.6 Ų | 135.6 | 88% | 0.882 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -69.2 | -7.6 | -177.6 | -134.6 | 165.1 | 0 | 0 | 0 | 112.1 | N113 | N113-I115 PolarHBondContact O-N 3.47Å; N113-I115 VanDerWaalsContact O-N 3.07Å |
| 116 | V | 58.4 | Low | 66 | Low | 101 Ų | 101 | 133 Ų | 133 | 61% | 0.612 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -137.1 | 145.7 | 178.3 | -78 | 0 | 0 | 0 | 0 | 110.1 | P114 W118 | P114-V116 WeakPolarHBondContact CB-O 3.44Å; P114-V116 PolarHBondContact O-N 2.68Å; P114-V116 VanDerWaalsContact O-N 3.09Å; V116-W118 PolarHBondContact O-N 2.99Å |
| 117 | P | 62 | Low | 66.2 | Low | 88 Ų | 88 | 130 Ų | 130 | 57% | 0.571 | 69% | 0.694 | S | S | * | * | trans | -57.7 | 123.6 | -178.8 | -19.5 | 29.7 | 0 | 0 | 0 | 110.6 | Y119 | P117-Y119 HydrophobicContact CB-CD2 4.18Å; P117-Y119 HydrophobicContact CB-CE2 3.74Å; P117-Y119 HydrophobicContact CG-CE2 4.12Å; P117-Y119 VanDerWaalsContact O-CD2 3.29Å; P117-Y119 WeakPolarHBondContact O-CD2 3.48Å; P117-Y119 PolarHBondContact O-N 3.43Å | ||
| 118 | W | 56 | Low | 65.8 | Low | 195 Ų | 195 | 130.5 Ų | 130.5 | 74% | 0.739 | 70% | 0.7 | S | S | * | * | trans | -69 | 98.1 | 167.8 | -169.5 | 84.6 | 0 | 0 | 0 | 107.5 | V116 P120 | V116-W118 PolarHBondContact O-N 2.99Å; W118-P120 HydrophobicContact CE3-CB 4.1Å; W118-P120 HydrophobicContact CE3-CG 3.78Å; W118-P120 HydrophobicContact CH2-CB 4.07Å; W118-P120 HydrophobicContact CZ3-CB 3.49Å; W118-P120 VanDerWaalsContact CZ3-CB 3.49Å; W118-P120 HydrophobicContact CZ3-CG 3.55Å; W118-P120 VanDerWaalsContact O-CD 3.25Å; W118-P120 WeakPolarHBondContact O-CD 3.34Å | ||
| 119 | Y | 62.1 | Low | 65.2 | Low | 152 Ų | 152 | 131.4 Ų | 131.4 | 60% | 0.596 | 70% | 0.701 | S | S | * | * | trans | -79.2 | 111.1 | 172.3 | -70.8 | -81.5 | 0 | 0 | 0 | 108.2 | P117 W121 Y122 | P117-Y119 HydrophobicContact CB-CD2 4.18Å; P117-Y119 HydrophobicContact CB-CE2 3.74Å; P117-Y119 HydrophobicContact CG-CE2 4.12Å; P117-Y119 VanDerWaalsContact O-CD2 3.29Å; P117-Y119 WeakPolarHBondContact O-CD2 3.48Å; P117-Y119 PolarHBondContact O-N 3.43Å; Y119-W121 PolarHBondContact O-N 3.43Å; Y119-Y122 PolarHBondContact O-N 2.97Å; Y119-Y122 VanDerWaalsContact O-N 3.16Å | ||
| 120 | P | 62.3 | Low | 64.3 | Low | 56 Ų | 56 | 131.9 Ų | 131.9 | 36% | 0.364 | 70% | 0.704 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.1 | -15.6 | -179.9 | -17.5 | 28.8 | 0 | 0 | 0 | 113.3 | W118 | W118-P120 HydrophobicContact CE3-CB 4.1Å; W118-P120 HydrophobicContact CE3-CG 3.78Å; W118-P120 HydrophobicContact CH2-CB 4.07Å; W118-P120 HydrophobicContact CZ3-CB 3.49Å; W118-P120 VanDerWaalsContact CZ3-CB 3.49Å; W118-P120 HydrophobicContact CZ3-CG 3.55Å; W118-P120 VanDerWaalsContact O-CD 3.25Å; W118-P120 WeakPolarHBondContact O-CD 3.34Å |
| 121 | W | 61.7 | Low | 63.1 | Low | 172 Ų | 172 | 130.9 Ų | 130.9 | 65% | 0.652 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.9 | -15.8 | -174.9 | -38.6 | 112.3 | 0 | 0 | 0 | 113.5 | Y119 Y123 R124 S125 | Y119-W121 PolarHBondContact O-N 3.43Å; W121-Y123 PolarHBondContact O-N 3.46Å; W121-Y123 VanDerWaalsContact O-N 3.09Å; W121-R124 PolarHBondContact O-N 3Å; W121-R124 VanDerWaalsContact O-N 3.12Å; W121-S125 PolarHBondContact O-N 3.49Å |
| 122 | Y | 56.3 | Low | 61.5 | Low | 186 Ų | 186 | 130.9 Ų | 130.9 | 73% | 0.729 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.3 | -27.3 | -173.9 | -163.6 | -95.9 | 0 | 0 | 0 | 112.8 | Y119 | Y119-Y122 PolarHBondContact O-N 2.97Å; Y119-Y122 VanDerWaalsContact O-N 3.16Å |
| 123 | Y | 53 | Low | 60.1 | Low | 192 Ų | 192 | 130.3 Ų | 130.3 | 75% | 0.753 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | -12.9 | 176.8 | -66.8 | -75 | 0 | 0 | 0 | 115.1 | W121 | W121-Y123 PolarHBondContact O-N 3.46Å; W121-Y123 VanDerWaalsContact O-N 3.09Å |
| 124 | R | 60.5 | Low | 58.8 | Low | 200 Ų | 200 | 128.3 Ų | 128.3 | 76% | 0.755 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.7 | -24.9 | -177.1 | -72.9 | -174.8 | 179 | -107.5 | 1 | 113.1 | W121 | W121-R124 PolarHBondContact O-N 3Å; W121-R124 VanDerWaalsContact O-N 3.12Å |
| 125 | S | 62.5 | Low | 57.8 | Low | 90 Ų | 90 | 129.5 Ų | 129.5 | 63% | 0.629 | 71% | 0.707 | S | S | * | * | trans | -125.2 | 74.6 | -178.6 | -50.7 | 0 | 0 | 0 | 0 | 109.5 | W121 | W121-S125 PolarHBondContact O-N 3.49Š| ||
| 126 | P | 58.8 | Low | 56.8 | Low | 98 Ų | 98 | 125.1 Ų | 125.1 | 64% | 0.636 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 140.2 | 165.3 | 25.9 | -32.2 | 0 | 0 | 0 | 107.9 | S128 | P126-S128 PolarHBondContact O-N 3.45Š|
| 127 | P | 61.1 | Low | 56.5 | Low | 122 Ų | 122 | 130.5 Ų | 130.5 | 79% | 0.792 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 131.2 | 179.5 | 20.4 | -30.6 | 0 | 0 | 0 | 108.8 | S129 | P127-S129 PolarHBondContact O-N 2.96Š|
| 128 | S | 62.4 | Low | 55.9 | Low | 116 Ų | 116 | 128.6 Ų | 128.6 | 81% | 0.811 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -47.4 | 118.3 | 173.8 | -41.9 | 0 | 0 | 0 | 0 | 107.8 | P126 P130 | P126-S128 PolarHBondContact O-N 3.45Å; S128-P130 WeakPolarHBondContact O-CD 3.17Å; S128-P130 VanDerWaalsContact O-N 3.14Å |
| 129 | S | 59.9 | Low | 55.7 | Low | 108 Ų | 108 | 129.2 Ų | 129.2 | 76% | 0.755 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 126 | 170.4 | -58.2 | 0 | 0 | 0 | 0 | 106.9 | P127 A131 | P127-S129 PolarHBondContact O-N 2.96Å; S129-A131 VanDerWaalsContact C-N 3.31Å; S129-A131 PolarHBondContact O-N 3.23Å |
| 130 | P | 57.1 | Low | 55.4 | Low | 125 Ų | 125 | 125.4 Ų | 125.4 | 81% | 0.812 | 70% | 0.7 | S | S | * | * | trans | -62.5 | 102 | 176.3 | 24 | -30.8 | 0 | 0 | 0 | 106.7 | S128 T132 | S128-P130 WeakPolarHBondContact O-CD 3.17Å; S128-P130 VanDerWaalsContact O-N 3.14Å; P130-T132 VanDerWaalsContact C-N 3.26Å; P130-T132 PolarHBondContact O-N 2.86Å | ||
| 131 | A | 51.8 | Low | 54.9 | Low | 91 Ų | 91 | 128.1 Ų | 128.1 | 75% | 0.752 | 71% | 0.711 | S | S | * | * | trans | -61.2 | 99.8 | 166 | 0 | 0 | 0 | 0 | 0 | 106 | S129 A133 | S129-A131 VanDerWaalsContact C-N 3.31Å; S129-A131 PolarHBondContact O-N 3.23Å; A131-A133 PolarHBondContact O-N 3.4Å | ||
| 132 | T | 47.7 | Very low | 54.6 | Low | 116 Ų | 116 | 126.3 Ų | 126.3 | 71% | 0.712 | 71% | 0.713 | S | S | * | * | trans | 8.7 | 80.8 | 148.1 | -34.3 | 0 | 0 | 0 | 0 | 113.7 | P130 V134 | P130-T132 VanDerWaalsContact C-N 3.26Å; P130-T132 PolarHBondContact O-N 2.86Å; T132-V134 HydrophobicContact CG2-CB 3.92Å; T132-V134 HydrophobicContact CG2-CG2 3.43Å; T132-V134 VanDerWaalsContact CG2-CG2 3.43Å; T132-V134 PolarHBondContact O-N 2.8Å | ||
| 133 | A | 50 | Low | 54.6 | Low | 106 Ų | 106 | 120 Ų | 120 | 88% | 0.876 | 70% | 0.7 | S | S | * | * | trans | -77 | 52.1 | 164.3 | 0 | 0 | 0 | 0 | 0 | 109.7 | A131 T135 | A131-A133 PolarHBondContact O-N 3.4Å; A133-T135 PolarHBondContact O-N 3.4Å | ||
| 134 | V | 49 | Very low | 54.8 | Low | 108 Ų | 108 | 113.5 Ų | 113.5 | 66% | 0.655 | 68% | 0.682 | S | S | * | * | trans | -87.3 | 94.4 | 165.5 | 177.7 | 0 | 0 | 0 | 0 | 105.2 | T132 | T132-V134 HydrophobicContact CG2-CB 3.92Å; T132-V134 HydrophobicContact CG2-CG2 3.43Å; T132-V134 VanDerWaalsContact CG2-CG2 3.43Å; T132-V134 PolarHBondContact O-N 2.8Å | ||
| 135 | T | 49 | Very low | 55 | Low | 126 Ų | 126 | 108.1 Ų | 108.1 | 77% | 0.773 | 67% | 0.671 | S | S | * | * | S | Bend | trans | 166.9 | 51.6 | 146.6 | 35.7 | 0 | 0 | 0 | 0 | 114.8 | A133 | A133-T135 PolarHBondContact O-N 3.4Š|
| 136 | A | 51.8 | Low | 55.2 | Low | 79 Ų | 79 | 106.5 Ų | 106.5 | 65% | 0.653 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -125.5 | -43.8 | 159.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | G138 | A136-G138 PolarHBondContact O-N 3.47Š|
| 137 | R | 51.4 | Low | 55.8 | Low | 215 Ų | 215 | 106.7 Ų | 106.7 | 81% | 0.811 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -75.2 | -20.9 | -177.3 | -74.1 | -175.7 | 178.6 | 179.3 | -0.3 | 115.4 | S140 L141 | R137-S140 PolarHBondContact O-OG 3.49Å; R137-L141 PolarHBondContact O-N 2.81Å |
| 138 | G | 50.2 | Low | 56.2 | Low | 48 Ų | 48 | 104.4 Ų | 104.4 | 50% | 0.495 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -69 | -32.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | A136 L142 | A136-G138 PolarHBondContact O-N 3.47Å; G138-L142 PolarHBondContact O-N 3.28Å |
| 139 | R | 52.2 | Low | 56.5 | Low | 208 Ų | 208 | 102.5 Ų | 102.5 | 79% | 0.785 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -75.8 | -35.3 | 179.8 | -73.3 | -176.9 | 170.6 | 172.9 | -2.3 | 112.4 | A143 | R139-A143 VanDerWaalsContact O-CB 3.32Å; R139-A143 WeakPolarHBondContact O-CB 3.44Å; R139-A143 PolarHBondContact O-N 2.78Å; R139-A143 VanDerWaalsContact O-N 3.1Å |
| 140 | S | 54.1 | Low | 56.8 | Low | 71 Ų | 71 | 100.3 Ų | 100.3 | 50% | 0.497 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -68.3 | -38.1 | 179.2 | 58 | 0 | 0 | 0 | 0 | 112.3 | R137 S144 | R137-S140 PolarHBondContact O-OG 3.49Å; S140-S144 WeakPolarHBondContact O-CB 3.43Å; S140-S144 PolarHBondContact O-N 3.05Å; S140-S144 PolarHBondContact O-OG 3.42Å |
| 141 | L | 52.6 | Low | 57.1 | Low | 114 Ų | 114 | 96.8 Ų | 96.8 | 60% | 0.597 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -69.9 | -47 | 179.3 | -71.9 | 171.6 | 0 | 0 | 0 | 111.9 | R137 A143 S144 V145 | R137-L141 PolarHBondContact O-N 2.81Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-A143 PolarHBondContact O-N 2.9Å; L141-S144 WeakPolarHBondContact CA-OG 3.42Å; L141-S144 PolarHBondContact O-N 3Å; L141-S144 VanDerWaalsContact O-N 3.14Å; L141-S144 PolarHBondContact O-OG 3.11Å; L141-V145 WeakPolarHBondContact O-CG2 3.48Å; L141-V145 PolarHBondContact O-N 3.26Å |
| 142 | L | 54.4 | Low | 57.6 | Low | 133 Ų | 133 | 94 Ų | 94 | 70% | 0.696 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -61.5 | -39.3 | 176.5 | -73.6 | 170.5 | 0 | 0 | 0 | 112.2 | G138 V145 A146 | G138-L142 PolarHBondContact O-N 3.28Å; L142-V145 PolarHBondContact O-N 2.97Å; L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.37Å |
| 143 | A | 56.8 | Low | 58.5 | Low | 55 Ų | 55 | 91.1 Ų | 91.1 | 46% | 0.455 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.6 | -43.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | R139 L141 A146 V147 | R139-A143 VanDerWaalsContact O-CB 3.32Å; R139-A143 WeakPolarHBondContact O-CB 3.44Å; R139-A143 PolarHBondContact O-N 2.78Å; R139-A143 VanDerWaalsContact O-N 3.1Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-A143 PolarHBondContact O-N 2.9Å; A143-A146 PolarHBondContact O-N 2.94Å; A143-V147 VanDerWaalsContact O-CG2 3.3Å; A143-V147 WeakPolarHBondContact O-CG2 3.31Å; A143-V147 PolarHBondContact O-N 3.36Å |
| 144 | S | 58.7 | Low | 59 | Low | 55 Ų | 55 | 88.4 Ų | 88.4 | 39% | 0.385 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -64.9 | -41.1 | 177.6 | 66.5 | 0 | 0 | 0 | 0 | 112.8 | S140 L141 V147 V148 | S140-S144 WeakPolarHBondContact O-CB 3.43Å; S140-S144 PolarHBondContact O-N 3.05Å; S140-S144 PolarHBondContact O-OG 3.42Å; L141-S144 WeakPolarHBondContact CA-OG 3.42Å; L141-S144 PolarHBondContact O-N 3Å; L141-S144 VanDerWaalsContact O-N 3.14Å; L141-S144 PolarHBondContact O-OG 3.11Å; S144-V147 PolarHBondContact O-N 2.86Å; S144-V148 WeakPolarHBondContact O-CB 3.19Å; S144-V148 VanDerWaalsContact O-CG2 3.22Å; S144-V148 WeakPolarHBondContact O-CG2 3.27Å; S144-V148 PolarHBondContact O-N 2.61Å |
| 145 | V | 64.3 | Low | 59.6 | Low | 86 Ų | 86 | 88.5 Ų | 88.5 | 52% | 0.521 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.6 | -40.9 | 177.7 | 175.2 | 0 | 0 | 0 | 0 | 111.1 | L141 L142 V148 T149 | L141-V145 WeakPolarHBondContact O-CG2 3.48Å; L141-V145 PolarHBondContact O-N 3.26Å; L142-V145 PolarHBondContact O-N 2.97Å; V145-V148 PolarHBondContact O-N 2.81Å; V145-T149 WeakPolarHBondContact O-CB 3.34Å; V145-T149 WeakPolarHBondContact O-CG2 3.25Å; V145-T149 PolarHBondContact O-N 3.31Å; V145-T149 PolarHBondContact O-OG1 3.44Å |
| 146 | A | 65.3 | Low | 60.1 | Low | 57 Ų | 57 | 87.2 Ų | 87.2 | 47% | 0.471 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.7 | -42 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L142 A143 T149 A150 | L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.37Å; A143-A146 PolarHBondContact O-N 2.94Å; A146-T149 WeakPolarHBondContact CA-OG1 3.42Å; A146-T149 PolarHBondContact O-OG1 3.3Å; A146-T149 VanDerWaalsContact O-OG1 3.09Å; A146-A150 WeakPolarHBondContact O-CB 3.45Å; A146-A150 PolarHBondContact O-N 3.24Å |
| 147 | V | 71.4 | Confident | 60.4 | Low | 102 Ų | 102 | 88.7 Ų | 88.7 | 62% | 0.618 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -67.1 | -42.9 | 178 | 173.3 | 0 | 0 | 0 | 0 | 111.1 | A143 S144 A150 A151 | A143-V147 VanDerWaalsContact O-CG2 3.3Å; A143-V147 WeakPolarHBondContact O-CG2 3.31Å; A143-V147 PolarHBondContact O-N 3.36Å; S144-V147 PolarHBondContact O-N 2.86Å; V147-A150 PolarHBondContact O-N 3.41Å; V147-A151 WeakPolarHBondContact O-CB 3.21Å; V147-A151 PolarHBondContact O-N 2.95Å |
| 148 | V | 69.4 | Low | 60.7 | Low | 74 Ų | 74 | 83.7 Ų | 83.7 | 45% | 0.448 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -67.7 | -40.5 | -179.8 | 173.4 | 0 | 0 | 0 | 0 | 111.6 | F12 S144 V145 A151 A152 | F12-V148 HydrophobicContact CE2-CG1 4.09Å; S144-V148 WeakPolarHBondContact O-CB 3.19Å; S144-V148 VanDerWaalsContact O-CG2 3.22Å; S144-V148 WeakPolarHBondContact O-CG2 3.27Å; S144-V148 PolarHBondContact O-N 2.61Å; V145-V148 PolarHBondContact O-N 2.81Å; V148-A151 PolarHBondContact O-N 3.47Å; V148-A152 WeakPolarHBondContact O-CB 3.46Å; V148-A152 PolarHBondContact O-N 3.41Å |
| 149 | T | 69.5 | Low | 60.7 | Low | 75 Ų | 75 | 89.7 Ų | 89.7 | 46% | 0.46 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.9 | -39.3 | 176.6 | 43.3 | 0 | 0 | 0 | 0 | 112.5 | V145 A146 A152 A153 | V145-T149 WeakPolarHBondContact O-CB 3.34Å; V145-T149 WeakPolarHBondContact O-CG2 3.25Å; V145-T149 PolarHBondContact O-N 3.31Å; V145-T149 PolarHBondContact O-OG1 3.44Å; A146-T149 WeakPolarHBondContact CA-OG1 3.42Å; A146-T149 PolarHBondContact O-OG1 3.3Å; A146-T149 VanDerWaalsContact O-OG1 3.09Å; T149-A152 PolarHBondContact O-N 3.49Å; T149-A153 WeakPolarHBondContact O-CB 3.39Å; T149-A153 PolarHBondContact O-N 3.17Å |
| 150 | A | 65.4 | Low | 61.1 | Low | 62 Ų | 62 | 83.8 Ų | 83.8 | 51% | 0.512 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.8 | -42.4 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A146 V147 A153 A154 | A146-A150 WeakPolarHBondContact O-CB 3.45Å; A146-A150 PolarHBondContact O-N 3.24Å; V147-A150 PolarHBondContact O-N 3.41Å; A150-A153 PolarHBondContact O-N 3.04Å; A150-A154 WeakPolarHBondContact O-CB 3.44Å; A150-A154 PolarHBondContact O-N 3.44Å |
| 151 | A | 63.9 | Low | 61.5 | Low | 51 Ų | 51 | 84.5 Ų | 84.5 | 42% | 0.421 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.6 | -40.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | V147 V148 A154 L155 | V147-A151 WeakPolarHBondContact O-CB 3.21Å; V147-A151 PolarHBondContact O-N 2.95Å; V148-A151 PolarHBondContact O-N 3.47Å; A151-A154 PolarHBondContact O-N 3.43Å; A151-L155 WeakPolarHBondContact O-CG 3.45Å; A151-L155 PolarHBondContact O-N 2.66Å |
| 152 | A | 63.4 | Low | 62 | Low | 33 Ų | 33 | 82.8 Ų | 82.8 | 27% | 0.273 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.3 | -43.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | V148 T149 A154 L155 I156 | V148-A152 WeakPolarHBondContact O-CB 3.46Å; V148-A152 PolarHBondContact O-N 3.41Å; T149-A152 PolarHBondContact O-N 3.49Å; A152-A154 PolarHBondContact O-N 3.42Å; A152-L155 PolarHBondContact O-N 2.94Å; A152-I156 WeakPolarHBondContact O-CB 3.27Å; A152-I156 WeakPolarHBondContact O-CD1 3.45Å; A152-I156 WeakPolarHBondContact O-CG1 3.31Å; A152-I156 PolarHBondContact O-N 3.47Å |
| 153 | A | 65.3 | Low | 62.5 | Low | 55 Ų | 55 | 79.9 Ų | 79.9 | 46% | 0.455 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.9 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T149 A150 I156 T157 | T149-A153 WeakPolarHBondContact O-CB 3.39Å; T149-A153 PolarHBondContact O-N 3.17Å; A150-A153 PolarHBondContact O-N 3.04Å; A153-I156 PolarHBondContact O-N 3.5Å; A153-T157 WeakPolarHBondContact O-CG2 3.35Å; A153-T157 PolarHBondContact O-N 3.03Å; A153-T157 VanDerWaalsContact O-N 3.11Å; A153-T157 PolarHBondContact O-OG1 3.23Å |
| 154 | A | 60.9 | Low | 62.8 | Low | 49 Ų | 49 | 81.4 Ų | 81.4 | 41% | 0.405 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | A150 A151 A152 I156 T157 V158 | A150-A154 WeakPolarHBondContact O-CB 3.44Å; A150-A154 PolarHBondContact O-N 3.44Å; A151-A154 PolarHBondContact O-N 3.43Å; A152-A154 PolarHBondContact O-N 3.42Å; A154-I156 VanDerWaalsContact C-N 3.31Å; A154-I156 PolarHBondContact O-N 2.93Å; A154-T157 WeakPolarHBondContact CA-OG1 3.36Å; A154-T157 PolarHBondContact O-N 3.2Å; A154-T157 VanDerWaalsContact O-N 3.17Å; A154-T157 PolarHBondContact O-OG1 2.98Å; A154-V158 VanDerWaalsContact O-CG2 3.25Å; A154-V158 WeakPolarHBondContact O-CG2 3.35Å; A154-V158 PolarHBondContact O-N 3.41Å |
| 155 | L | 62.2 | Low | 63.1 | Low | 110 Ų | 110 | 83.2 Ų | 83.2 | 58% | 0.576 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.3 | -35 | 176.5 | -73.1 | 172.8 | 0 | 0 | 0 | 112.6 | A151 A152 T157 V158 F159 | A151-L155 WeakPolarHBondContact O-CG 3.45Å; A151-L155 PolarHBondContact O-N 2.66Å; A152-L155 PolarHBondContact O-N 2.94Å; L155-T157 VanDerWaalsContact C-N 3.28Å; L155-T157 PolarHBondContact O-N 2.95Å; L155-V158 PolarHBondContact O-N 3.49Å; L155-F159 WeakPolarHBondContact O-CD2 3.47Å; L155-F159 PolarHBondContact O-N 3.35Å |
| 156 | I | 59.5 | Low | 63 | Low | 99 Ų | 99 | 83 Ų | 83 | 51% | 0.508 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.1 | -28.9 | 175.7 | -72.5 | 166.4 | 0 | 0 | 0 | 112.3 | R5 A152 A153 A154 | R5-I156 PolarHBondContact NH1-O 3.42Å; A152-I156 WeakPolarHBondContact O-CB 3.27Å; A152-I156 WeakPolarHBondContact O-CD1 3.45Å; A152-I156 WeakPolarHBondContact O-CG1 3.31Å; A152-I156 PolarHBondContact O-N 3.47Å; A153-I156 PolarHBondContact O-N 3.5Å; A154-I156 VanDerWaalsContact C-N 3.31Å; A154-I156 PolarHBondContact O-N 2.93Å |
| 157 | T | 58.1 | Low | 62.8 | Low | 111 Ų | 111 | 85 Ų | 85 | 68% | 0.681 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -88.1 | -22 | 178.7 | 54.5 | 0 | 0 | 0 | 0 | 114.5 | A153 A154 L155 | A153-T157 WeakPolarHBondContact O-CG2 3.35Å; A153-T157 PolarHBondContact O-N 3.03Å; A153-T157 VanDerWaalsContact O-N 3.11Å; A153-T157 PolarHBondContact O-OG1 3.23Å; A154-T157 WeakPolarHBondContact CA-OG1 3.36Å; A154-T157 PolarHBondContact O-N 3.2Å; A154-T157 VanDerWaalsContact O-N 3.17Å; A154-T157 PolarHBondContact O-OG1 2.98Å; L155-T157 VanDerWaalsContact C-N 3.28Å; L155-T157 PolarHBondContact O-N 2.95Å |
| 158 | V | 57.7 | Low | 62.1 | Low | 110 Ų | 110 | 83.6 Ų | 83.6 | 67% | 0.667 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -86.3 | -15.1 | -179.6 | 173.7 | 0 | 0 | 0 | 0 | 112.1 | A154 L155 | A154-V158 VanDerWaalsContact O-CG2 3.25Å; A154-V158 WeakPolarHBondContact O-CG2 3.35Å; A154-V158 PolarHBondContact O-N 3.41Å; L155-V158 PolarHBondContact O-N 3.49Å |
| 159 | F | 49.9 | Very low | 61.4 | Low | 174 Ų | 174 | 84.5 Ų | 84.5 | 76% | 0.763 | 52% | 0.52 | S | S | * | . | trans | -118.8 | 0 | 171.5 | -68.2 | -78.5 | 0 | 0 | 0 | 111.2 | R5 L155 | R5-F159 PolarHBondContact NH2-O 3.22Å; R5-F159 PolarHBondContact NH2-OXT 3.34Å; L155-F159 WeakPolarHBondContact O-CD2 3.47Å; L155-F159 PolarHBondContact O-N 3.35Å |
Retrieved 159 of 159 residues in 375.1 ms
(Link to these results)