| 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 | 40 | Very low | 47.6 | Very low | 237 Ų | 237 | 130.2 Ų | 130.2 | 100% | 1.167 | 72% | 0.724 | S | S | * | * | 0 | 119.8 | 0 | -72.9 | 143.1 | 164 | 0 | 0 | 105.6 | |||||
| 2 | Q | 38.6 | Very low | 48 | Very low | 144 Ų | 144 | 130 Ų | 130 | 67% | 0.673 | 71% | 0.713 | S | S | * | * | cis | -155.5 | 129.4 | 33.7 | -176.2 | 74.2 | 23.8 | 0 | 0 | 108.3 | D4 | Q2-D4 WeakPolarHBondContact CG-OD2 3.27Å; Q2-D4 PolarHBondContact NE2-OD1 2.89Å; Q2-D4 PolarHBondContact NE2-OD2 2.88Å | ||
| 3 | K | 49.3 | Very low | 48.7 | Very low | 197 Ų | 197 | 134.8 Ų | 134.8 | 86% | 0.857 | 72% | 0.717 | S | S | * | * | trans | -86.3 | 116.4 | 164.6 | -104.2 | 167 | 158.9 | 163.1 | 0 | 105.4 | ||||
| 4 | D | 41.4 | Very low | 49.5 | Very low | 124 Ų | 124 | 134.1 Ų | 134.1 | 66% | 0.663 | 71% | 0.712 | S | S | * | * | trans | -137.3 | 101.7 | 163.2 | -71.6 | -50.7 | 0 | 0 | 0 | 106.4 | Q2 | Q2-D4 WeakPolarHBondContact CG-OD2 3.27Å; Q2-D4 PolarHBondContact NE2-OD1 2.89Å; Q2-D4 PolarHBondContact NE2-OD2 2.88Å | ||
| 5 | S | 55.5 | Low | 50.4 | Low | 114 Ų | 114 | 127.7 Ų | 127.7 | 80% | 0.797 | 69% | 0.691 | S | S | * | * | 74.8 | 80 | 70.6 | -59.7 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 6 | G | 44.9 | Very low | 51.4 | Low | 50 Ų | 50 | 130.1 Ų | 130.1 | 52% | 0.515 | 69% | 0.694 | S | S | . | * | trans | -145.5 | 143.4 | 159.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | L8 | G6-L8 WeakPolarHBondContact O-CG 3.31Å; G6-L8 PolarHBondContact O-N 3.39Å | ||
| 7 | P | 44.7 | Very low | 53 | Low | 118 Ų | 118 | 124.6 Ų | 124.6 | 77% | 0.766 | 68% | 0.675 | S | S | * | * | trans | -62.8 | 100.8 | -139.2 | 24.8 | -34.1 | 0 | 0 | 0 | 115.3 | V9 P10 | P7-V9 PolarHBondContact O-N 3.4Å; P7-P10 VanDerWaalsContact O-CD 3.25Å; P7-P10 WeakPolarHBondContact O-CD 3.14Å | ||
| 8 | L | 48.9 | Very low | 53.1 | Low | 128 Ų | 128 | 126.9 Ų | 126.9 | 67% | 0.67 | 67% | 0.674 | S | S | * | * | trans | -79.3 | 39.8 | -179 | -64.4 | 168.5 | 0 | 0 | 0 | 114 | G6 H12 | G6-L8 WeakPolarHBondContact O-CG 3.31Å; G6-L8 PolarHBondContact O-N 3.39Å; L8-H12 PolarHBondContact O-CD2 3.47Å; L8-H12 VanDerWaalsContact O-CD2 3.23Å | ||
| 9 | V | 52.7 | Low | 53.5 | Low | 106 Ų | 106 | 123.3 Ų | 123.3 | 64% | 0.642 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -111.2 | -34.5 | -179.6 | -66.2 | 0 | 0 | 0 | 0 | 115.4 | P7 | P7-V9 PolarHBondContact O-N 3.4Š|
| 10 | P | 52.8 | Low | 54.7 | Low | 77 Ų | 77 | 119.4 Ų | 119.4 | 50% | 0.5 | 65% | 0.649 | S | S | . | * | H | α-helix | trans | -80 | -35.7 | -177 | -11.9 | 28.7 | 0 | 0 | 0 | 113.5 | P7 Y13 L14 | P7-P10 VanDerWaalsContact O-CD 3.25Å; P7-P10 WeakPolarHBondContact O-CD 3.14Å; P10-Y13 PolarHBondContact O-N 2.89Å; P10-L14 WeakPolarHBondContact O-CG 2.89Å; P10-L14 PolarHBondContact O-N 3.39Å |
| 11 | L | 55.2 | Low | 55.7 | Low | 137 Ų | 137 | 119.5 Ų | 119.5 | 72% | 0.717 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -72.7 | -33.3 | -175.3 | -89.7 | 157.4 | 0 | 0 | 0 | 113 | G15 | L11-G15 PolarHBondContact O-N 2.84Å |
| 12 | H | 52.3 | Low | 57.1 | Low | 128 Ų | 128 | 112.1 Ų | 112.1 | 59% | 0.593 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -70.3 | -39 | 175.9 | -74.2 | -83.3 | 0 | 0 | 0 | 111.6 | L8 G15 F16 | L8-H12 PolarHBondContact O-CD2 3.47Å; L8-H12 VanDerWaalsContact O-CD2 3.23Å; H12-G15 PolarHBondContact O-N 2.89Å; H12-F16 VanDerWaalsContact O-CB 3.32Å; H12-F16 WeakPolarHBondContact O-CB 3.19Å; H12-F16 PolarHBondContact O-N 3.46Å |
| 13 | Y | 56.5 | Low | 58.8 | Low | 193 Ų | 193 | 107.8 Ų | 107.8 | 76% | 0.757 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -66.3 | -42 | 174 | -102.7 | -86.4 | 0 | 0 | 0 | 112.3 | P10 F16 G17 | P10-Y13 PolarHBondContact O-N 2.89Å; Y13-F16 PolarHBondContact O-N 2.78Å; Y13-G17 PolarHBondContact O-N 3.19Å |
| 14 | L | 59.6 | Low | 59.8 | Low | 124 Ų | 124 | 101.8 Ų | 101.8 | 65% | 0.649 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -65.4 | -40.4 | 174.2 | -75.6 | 172.2 | 0 | 0 | 0 | 111.9 | P10 G17 Y18 | P10-L14 WeakPolarHBondContact O-CG 2.89Å; P10-L14 PolarHBondContact O-N 3.39Å; L14-G17 PolarHBondContact O-N 2.88Å; L14-Y18 VanDerWaalsContact O-CB 3.28Å; L14-Y18 WeakPolarHBondContact O-CB 3.48Å; L14-Y18 PolarHBondContact O-N 3.48Å |
| 15 | G | 63.7 | Low | 61 | Low | 39 Ų | 39 | 98 Ų | 98 | 40% | 0.402 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.4 | -41.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | L11 H12 Y18 A19 | L11-G15 PolarHBondContact O-N 2.84Å; H12-G15 PolarHBondContact O-N 2.89Å; G15-Y18 PolarHBondContact O-N 2.66Å; G15-A19 VanDerWaalsContact O-CB 3.27Å; G15-A19 WeakPolarHBondContact O-CB 3.43Å; G15-A19 PolarHBondContact O-N 3.05Å |
| 16 | F | 66.9 | Low | 61.2 | Low | 166 Ų | 166 | 94.6 Ų | 94.6 | 73% | 0.728 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -70.1 | -39.1 | 176.7 | -142 | -89.1 | 0 | 0 | 0 | 111.7 | H12 Y13 A19 A20 | H12-F16 VanDerWaalsContact O-CB 3.32Å; H12-F16 WeakPolarHBondContact O-CB 3.19Å; H12-F16 PolarHBondContact O-N 3.46Å; Y13-F16 PolarHBondContact O-N 2.78Å; F16-A19 PolarHBondContact O-N 2.77Å; F16-A20 WeakPolarHBondContact O-CB 3.27Å; F16-A20 PolarHBondContact O-N 2.97Å |
| 17 | G | 77.2 | Confident | 62.1 | Low | 36 Ų | 36 | 97.9 Ų | 97.9 | 37% | 0.371 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -64.1 | -40.9 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y13 L14 A20 L21 | Y13-G17 PolarHBondContact O-N 3.19Å; L14-G17 PolarHBondContact O-N 2.88Å; G17-A20 PolarHBondContact O-N 3.37Å; G17-L21 WeakPolarHBondContact O-CB 3.04Å; G17-L21 PolarHBondContact O-N 2.79Å |
| 18 | Y | 55.7 | Low | 63 | Low | 167 Ų | 167 | 96.8 Ų | 96.8 | 66% | 0.655 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -67.7 | -44.3 | 174.7 | -168.6 | -102.9 | 0 | 0 | 0 | 111.6 | L14 G15 A20 L21 V22 | L14-Y18 VanDerWaalsContact O-CB 3.28Å; L14-Y18 WeakPolarHBondContact O-CB 3.48Å; L14-Y18 PolarHBondContact O-N 3.48Å; G15-Y18 PolarHBondContact O-N 2.66Å; Y18-A20 VanDerWaalsContact C-N 3.34Å; Y18-A20 PolarHBondContact O-N 2.86Å; Y18-L21 PolarHBondContact O-N 2.86Å; Y18-V22 HydrophobicContact CD1-CG2 4.02Å; Y18-V22 HydrophobicContact CE1-CG2 3.78Å; Y18-V22 HydrophobicContact CG-CG2 4.48Å; Y18-V22 WeakPolarHBondContact O-CB 3.28Å; Y18-V22 WeakPolarHBondContact O-CG2 3.19Å; Y18-V22 PolarHBondContact O-N 3.47Å |
| 19 | A | 60.8 | Low | 63.4 | Low | 57 Ų | 57 | 92.4 Ų | 92.4 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.1 | -41 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | G15 F16 V22 A23 | G15-A19 VanDerWaalsContact O-CB 3.27Å; G15-A19 WeakPolarHBondContact O-CB 3.43Å; G15-A19 PolarHBondContact O-N 3.05Å; F16-A19 PolarHBondContact O-N 2.77Å; A19-V22 PolarHBondContact O-N 2.82Å; A19-A23 WeakPolarHBondContact O-CB 3.41Å; A19-A23 PolarHBondContact O-N 3.34Å |
| 20 | A | 76.7 | Confident | 63.3 | Low | 46 Ų | 46 | 95.1 Ų | 95.1 | 38% | 0.38 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.6 | -39.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F16 G17 Y18 A23 T24 | F16-A20 WeakPolarHBondContact O-CB 3.27Å; F16-A20 PolarHBondContact O-N 2.97Å; G17-A20 PolarHBondContact O-N 3.37Å; Y18-A20 VanDerWaalsContact C-N 3.34Å; Y18-A20 PolarHBondContact O-N 2.86Å; A20-A23 PolarHBondContact O-N 2.78Å; A20-T24 WeakPolarHBondContact O-CB 3.08Å; A20-T24 PolarHBondContact O-N 3.37Å; A20-T24 PolarHBondContact O-OG1 2.81Å |
| 21 | L | 76 | Confident | 63.5 | Low | 122 Ų | 122 | 95.4 Ų | 95.4 | 64% | 0.639 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -66.6 | -39.5 | 174.7 | -105.7 | 162.8 | 0 | 0 | 0 | 112.5 | G17 Y18 T24 G25 | G17-L21 WeakPolarHBondContact O-CB 3.04Å; G17-L21 PolarHBondContact O-N 2.79Å; Y18-L21 PolarHBondContact O-N 2.86Å; L21-T24 WeakPolarHBondContact CA-OG1 3.47Å; L21-T24 PolarHBondContact O-OG1 2.9Å; L21-G25 WeakPolarHBondContact O-CA 3.43Å; L21-G25 PolarHBondContact O-N 2.82Å |
| 22 | V | 70.4 | Confident | 63.3 | Low | 81 Ų | 81 | 97.1 Ų | 97.1 | 49% | 0.491 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -70.9 | -39.2 | 176.4 | 173.9 | 0 | 0 | 0 | 0 | 110.2 | Y18 A19 G26 | Y18-V22 HydrophobicContact CD1-CG2 4.02Å; Y18-V22 HydrophobicContact CE1-CG2 3.78Å; Y18-V22 HydrophobicContact CG-CG2 4.48Å; Y18-V22 WeakPolarHBondContact O-CB 3.28Å; Y18-V22 WeakPolarHBondContact O-CG2 3.19Å; Y18-V22 PolarHBondContact O-N 3.47Å; A19-V22 PolarHBondContact O-N 2.82Å; V22-G26 WeakPolarHBondContact O-CA 3.38Å; V22-G26 PolarHBondContact O-N 3.33Å |
| 23 | A | 72.9 | Confident | 63.2 | Low | 54 Ų | 54 | 93.5 Ų | 93.5 | 45% | 0.446 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -66.9 | -47 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | A19 A20 G26 I27 | A19-A23 WeakPolarHBondContact O-CB 3.41Å; A19-A23 PolarHBondContact O-N 3.34Å; A20-A23 PolarHBondContact O-N 2.78Å; A23-G26 PolarHBondContact O-N 2.88Å; A23-I27 WeakPolarHBondContact O-CD1 3.11Å; A23-I27 WeakPolarHBondContact O-CG1 3.34Å; A23-I27 PolarHBondContact O-N 2.8Å |
| 24 | T | 71.8 | Confident | 62.9 | Low | 71 Ų | 71 | 88 Ų | 88 | 44% | 0.436 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67.4 | -41.1 | 175.6 | 42.1 | 0 | 0 | 0 | 0 | 111.7 | A20 L21 G26 I27 I28 | A20-T24 WeakPolarHBondContact O-CB 3.08Å; A20-T24 PolarHBondContact O-N 3.37Å; A20-T24 PolarHBondContact O-OG1 2.81Å; L21-T24 WeakPolarHBondContact CA-OG1 3.47Å; L21-T24 PolarHBondContact O-OG1 2.9Å; T24-G26 VanDerWaalsContact C-N 3.28Å; T24-G26 PolarHBondContact O-N 3.38Å; T24-I27 PolarHBondContact O-N 3.4Å; T24-I28 VanDerWaalsContact O-CB 3.25Å; T24-I28 WeakPolarHBondContact O-CB 3.29Å; T24-I28 WeakPolarHBondContact O-CD1 3.23Å; T24-I28 WeakPolarHBondContact O-CG1 3.15Å; T24-I28 PolarHBondContact O-N 3.49Å |
| 25 | G | 66.4 | Low | 62.6 | Low | 43 Ų | 43 | 84.6 Ų | 84.6 | 44% | 0.443 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.3 | -35.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L21 G29 | L21-G25 WeakPolarHBondContact O-CA 3.43Å; L21-G25 PolarHBondContact O-N 2.82Å; G25-G29 WeakPolarHBondContact O-CA 3.39Å; G25-G29 PolarHBondContact O-N 2.98Å |
| 26 | G | 58.7 | Low | 62.1 | Low | 43 Ų | 43 | 88.5 Ų | 88.5 | 44% | 0.443 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.9 | -46.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | V22 A23 T24 G29 Y30 | V22-G26 WeakPolarHBondContact O-CA 3.38Å; V22-G26 PolarHBondContact O-N 3.33Å; A23-G26 PolarHBondContact O-N 2.88Å; T24-G26 VanDerWaalsContact C-N 3.28Å; T24-G26 PolarHBondContact O-N 3.38Å; G26-G29 PolarHBondContact O-N 3.46Å; G26-Y30 WeakPolarHBondContact O-CB 3.44Å; G26-Y30 PolarHBondContact O-N 3.3Å |
| 27 | I | 65 | Low | 61.4 | Low | 119 Ų | 119 | 84.8 Ų | 84.8 | 61% | 0.61 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -66.2 | -44.2 | 177.8 | -65.5 | 161.6 | 0 | 0 | 0 | 110.8 | A23 T24 Y30 A31 | A23-I27 WeakPolarHBondContact O-CD1 3.11Å; A23-I27 WeakPolarHBondContact O-CG1 3.34Å; A23-I27 PolarHBondContact O-N 2.8Å; T24-I27 PolarHBondContact O-N 3.4Å; I27-Y30 PolarHBondContact O-N 2.84Å; I27-A31 WeakPolarHBondContact O-CB 3.2Å; I27-A31 PolarHBondContact O-N 3.46Å |
| 28 | I | 63.3 | Low | 59.9 | Low | 96 Ų | 96 | 86.5 Ų | 86.5 | 49% | 0.492 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67.8 | -38.9 | 176.7 | -65.9 | 165.7 | 0 | 0 | 0 | 110.3 | T24 Y30 A31 K32 | T24-I28 VanDerWaalsContact O-CB 3.25Å; T24-I28 WeakPolarHBondContact O-CB 3.29Å; T24-I28 WeakPolarHBondContact O-CD1 3.23Å; T24-I28 WeakPolarHBondContact O-CG1 3.15Å; T24-I28 PolarHBondContact O-N 3.49Å; I28-Y30 VanDerWaalsContact C-N 3.33Å; I28-A31 PolarHBondContact O-N 2.79Å; I28-K32 WeakPolarHBondContact O-CB 3.21Å; I28-K32 PolarHBondContact O-N 3.31Å |
| 29 | G | 56.9 | Low | 60.1 | Low | 36 Ų | 36 | 82 Ų | 82 | 37% | 0.371 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | G25 G26 K32 A33 | G25-G29 WeakPolarHBondContact O-CA 3.39Å; G25-G29 PolarHBondContact O-N 2.98Å; G26-G29 PolarHBondContact O-N 3.46Å; G29-K32 PolarHBondContact O-N 2.79Å; G29-A33 WeakPolarHBondContact O-CB 3.48Å; G29-A33 PolarHBondContact O-N 2.81Å |
| 30 | Y | 50.7 | Low | 60.5 | Low | 163 Ų | 163 | 81.7 Ų | 81.7 | 64% | 0.639 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -69.3 | -42.2 | 177.1 | -162.6 | -85.7 | 0 | 0 | 0 | 112.1 | G26 I27 I28 K32 L39 | G26-Y30 WeakPolarHBondContact O-CB 3.44Å; G26-Y30 PolarHBondContact O-N 3.3Å; I27-Y30 PolarHBondContact O-N 2.84Å; I28-Y30 VanDerWaalsContact C-N 3.33Å; Y30-K32 VanDerWaalsContact C-N 3.31Å; Y30-K32 PolarHBondContact O-N 3.03Å; Y30-L39 HydrophobicContact CD2-CD1 4.41Å; Y30-L39 HydrophobicContact CE2-CD1 3.19Å; Y30-L39 WeakPolarHBondContact OH-CD1 3.41Å |
| 31 | A | 56.3 | Low | 59.9 | Low | 83 Ų | 83 | 82.2 Ų | 82.2 | 69% | 0.686 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -66.7 | -31.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I27 I28 | I27-A31 WeakPolarHBondContact O-CB 3.2Å; I27-A31 PolarHBondContact O-N 3.46Å; I28-A31 PolarHBondContact O-N 2.79Å |
| 32 | K | 51 | Low | 59 | Low | 172 Ų | 172 | 78.4 Ų | 78.4 | 75% | 0.748 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -88.9 | -26.5 | -176.8 | -159.7 | 178.7 | -62.5 | -165.3 | 0 | 113.5 | I28 G29 Y30 | I28-K32 WeakPolarHBondContact O-CB 3.21Å; I28-K32 PolarHBondContact O-N 3.31Å; G29-K32 PolarHBondContact O-N 2.79Å; Y30-K32 VanDerWaalsContact C-N 3.31Å; Y30-K32 PolarHBondContact O-N 3.03Å |
| 33 | A | 50 | Low | 59.3 | Low | 52 Ų | 52 | 80.1 Ų | 80.1 | 43% | 0.43 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -76.5 | -24.9 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G29 S35 | G29-A33 WeakPolarHBondContact O-CB 3.48Å; G29-A33 PolarHBondContact O-N 2.81Å; A33-S35 WeakPolarHBondContact O-CB 3.48Å; A33-S35 PolarHBondContact O-N 2.64Å |
| 34 | G | 50.2 | Low | 59.5 | Low | 77 Ų | 77 | 84.1 Ų | 84.1 | 79% | 0.794 | 53% | 0.533 | S | S | * | . | trans | 46.4 | 35.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 35 | S | 53.2 | Low | 59.1 | Low | 53 Ų | 53 | 88.3 Ų | 88.3 | 37% | 0.371 | 55% | 0.546 | S | S | . | . | trans | -147.2 | 105.6 | -164.1 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | A33 P37 S38 L39 | A33-S35 WeakPolarHBondContact O-CB 3.48Å; A33-S35 PolarHBondContact O-N 2.64Å; S35-P37 WeakPolarHBondContact OG-CD 3.15Å; S35-P37 VanDerWaalsContact OG-CG 3.31Å; S35-P37 WeakPolarHBondContact OG-CG 3.17Å; S35-S38 PolarHBondContact O-N 2.81Å; S35-L39 PolarHBondContact O-N 2.62Å | ||
| 36 | V | 53.6 | Low | 59.1 | Low | 121 Ų | 121 | 88.3 Ų | 88.3 | 73% | 0.733 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -42.9 | -38.5 | 167.5 | 179.9 | 0 | 0 | 0 | 0 | 112.6 | S38 L39 A40 | V36-S38 PolarHBondContact O-N 3.37Å; V36-L39 PolarHBondContact O-N 2.84Å; V36-A40 VanDerWaalsContact O-CB 3.27Å; V36-A40 WeakPolarHBondContact O-CB 3.11Å; V36-A40 PolarHBondContact O-N 3.43Å |
| 37 | P | 53.3 | Low | 60 | Low | 89 Ų | 89 | 89.7 Ų | 89.7 | 58% | 0.578 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -56 | -39.6 | 171.1 | -25.5 | 25.3 | 0 | 0 | 0 | 115.5 | S35 A41 | S35-P37 WeakPolarHBondContact OG-CD 3.15Å; S35-P37 VanDerWaalsContact OG-CG 3.31Å; S35-P37 WeakPolarHBondContact OG-CG 3.17Å; P37-A41 WeakPolarHBondContact O-CB 3.2Å; P37-A41 PolarHBondContact O-N 3.31Å |
| 38 | S | 45.8 | Very low | 60.2 | Low | 72 Ų | 72 | 88.7 Ų | 88.7 | 50% | 0.503 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -77.4 | -31.5 | -177.5 | -165.6 | 0 | 0 | 0 | 0 | 111.9 | S35 V36 G42 | S35-S38 PolarHBondContact O-N 2.81Å; V36-S38 PolarHBondContact O-N 3.37Å; S38-G42 PolarHBondContact O-N 2.87Å |
| 39 | L | 59.9 | Low | 60 | Low | 71 Ų | 71 | 87 Ų | 87 | 37% | 0.372 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -66.5 | -48.1 | 168.7 | -168.1 | 86.8 | 0 | 0 | 0 | 111.1 | Y30 S35 V36 A41 G42 L43 | Y30-L39 HydrophobicContact CD2-CD1 4.41Å; Y30-L39 HydrophobicContact CE2-CD1 3.19Å; Y30-L39 WeakPolarHBondContact OH-CD1 3.41Å; S35-L39 PolarHBondContact O-N 2.62Å; V36-L39 PolarHBondContact O-N 2.84Å; L39-A41 VanDerWaalsContact C-N 3.33Å; L39-A41 PolarHBondContact O-N 2.8Å; L39-G42 PolarHBondContact O-N 2.88Å; L39-L43 HydrophobicContact CD2-CD1 4.09Å; L39-L43 HydrophobicContact CG-CD1 4.15Å; L39-L43 WeakPolarHBondContact O-CB 3.26Å; L39-L43 WeakPolarHBondContact O-CG 3.17Å; L39-L43 PolarHBondContact O-N 3.37Å |
| 40 | A | 68.7 | Low | 60.8 | Low | 52 Ų | 52 | 87.2 Ų | 87.2 | 43% | 0.43 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 179 | 0 | 0 | 0 | 0 | 0 | 110.6 | V36 L43 F44 | V36-A40 VanDerWaalsContact O-CB 3.27Å; V36-A40 WeakPolarHBondContact O-CB 3.11Å; V36-A40 PolarHBondContact O-N 3.43Å; A40-L43 PolarHBondContact O-N 2.84Å; A40-F44 WeakPolarHBondContact O-CB 3.21Å; A40-F44 PolarHBondContact O-N 2.71Å |
| 41 | A | 62.8 | Low | 61.5 | Low | 56 Ų | 56 | 87.9 Ų | 87.9 | 46% | 0.463 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.7 | -41.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | P37 L39 F44 F45 | P37-A41 WeakPolarHBondContact O-CB 3.2Å; P37-A41 PolarHBondContact O-N 3.31Å; L39-A41 VanDerWaalsContact C-N 3.33Å; L39-A41 PolarHBondContact O-N 2.8Å; A41-F44 PolarHBondContact O-N 2.82Å; A41-F45 VanDerWaalsContact O-CB 3.29Å; A41-F45 WeakPolarHBondContact O-CB 3.19Å; A41-F45 PolarHBondContact O-N 2.88Å |
| 42 | G | 58.2 | Low | 61.5 | Low | 43 Ų | 43 | 85.5 Ų | 85.5 | 44% | 0.443 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.1 | -40.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | S38 L39 G46 | S38-G42 PolarHBondContact O-N 2.87Å; L39-G42 PolarHBondContact O-N 2.88Å; G42-G46 VanDerWaalsContact O-CA 3.27Å; G42-G46 WeakPolarHBondContact O-CA 3.17Å; G42-G46 PolarHBondContact O-N 3.03Å |
| 43 | L | 75.6 | Confident | 61.5 | Low | 116 Ų | 116 | 80 Ų | 80 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -69.6 | -38 | 173.7 | -75.8 | 173.5 | 0 | 0 | 0 | 111.6 | L39 A40 S47 | L39-L43 HydrophobicContact CD2-CD1 4.09Å; L39-L43 HydrophobicContact CG-CD1 4.15Å; L39-L43 WeakPolarHBondContact O-CB 3.26Å; L39-L43 WeakPolarHBondContact O-CG 3.17Å; L39-L43 PolarHBondContact O-N 3.37Å; A40-L43 PolarHBondContact O-N 2.84Å; L43-S47 WeakPolarHBondContact O-CB 3.24Å; L43-S47 PolarHBondContact O-N 3.1Å; L43-S47 PolarHBondContact O-OG 3.49Å |
| 44 | F | 77.4 | Confident | 61.6 | Low | 138 Ų | 138 | 85.9 Ų | 85.9 | 61% | 0.605 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.5 | -47.9 | 178.9 | -165.2 | -96.8 | 0 | 0 | 0 | 111.7 | A40 A41 S47 L48 | A40-F44 WeakPolarHBondContact O-CB 3.21Å; A40-F44 PolarHBondContact O-N 2.71Å; A41-F44 PolarHBondContact O-N 2.82Å; F44-S47 PolarHBondContact O-OG 3.31Å; F44-L48 HydrophobicContact CD1-CD1 3.75Å; F44-L48 HydrophobicContact CE1-CD1 3.54Å; F44-L48 HydrophobicContact CZ-CD1 4.24Å; F44-L48 WeakPolarHBondContact O-CB 3.36Å; F44-L48 WeakPolarHBondContact O-CG 3.24Å; F44-L48 PolarHBondContact O-N 2.81Å |
| 45 | F | 63.6 | Low | 61.6 | Low | 160 Ų | 160 | 88.9 Ų | 88.9 | 70% | 0.702 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -70.1 | -34.8 | 174.8 | -120.6 | -95.3 | 0 | 0 | 0 | 112 | A41 A49 | A41-F45 VanDerWaalsContact O-CB 3.29Å; A41-F45 WeakPolarHBondContact O-CB 3.19Å; A41-F45 PolarHBondContact O-N 2.88Å; F45-A49 WeakPolarHBondContact O-CB 3.32Å; F45-A49 PolarHBondContact O-N 2.79Å |
| 46 | G | 67.6 | Low | 61.1 | Low | 42 Ų | 42 | 92 Ų | 92 | 43% | 0.433 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -69.9 | -39.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | G42 A49 G50 | G42-G46 VanDerWaalsContact O-CA 3.27Å; G42-G46 WeakPolarHBondContact O-CA 3.17Å; G42-G46 PolarHBondContact O-N 3.03Å; G46-A49 PolarHBondContact O-N 3.42Å; G46-G50 PolarHBondContact O-N 2.74Å |
| 47 | S | 75.9 | Confident | 60.7 | Low | 72 Ų | 72 | 91.5 Ų | 91.5 | 50% | 0.503 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -67.6 | -43.1 | 172.8 | 52.8 | 0 | 0 | 0 | 0 | 111.5 | L43 F44 G50 Y51 | L43-S47 WeakPolarHBondContact O-CB 3.24Å; L43-S47 PolarHBondContact O-N 3.1Å; L43-S47 PolarHBondContact O-OG 3.49Å; F44-S47 PolarHBondContact O-OG 3.31Å; S47-G50 PolarHBondContact O-N 3.21Å; S47-Y51 VanDerWaalsContact O-CB 3.28Å; S47-Y51 WeakPolarHBondContact O-CB 3.17Å; S47-Y51 PolarHBondContact O-N 3.5Å |
| 48 | L | 70.7 | Confident | 60.4 | Low | 99 Ų | 99 | 94 Ų | 94 | 52% | 0.518 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -63.1 | -40.6 | 173.4 | -80.8 | 166.2 | 0 | 0 | 0 | 112.7 | F44 G52 | F44-L48 HydrophobicContact CD1-CD1 3.75Å; F44-L48 HydrophobicContact CE1-CD1 3.54Å; F44-L48 HydrophobicContact CZ-CD1 4.24Å; F44-L48 WeakPolarHBondContact O-CB 3.36Å; F44-L48 WeakPolarHBondContact O-CG 3.24Å; F44-L48 PolarHBondContact O-N 2.81Å; L48-G52 WeakPolarHBondContact O-CA 3.39Å; L48-G52 PolarHBondContact O-N 3.41Å |
| 49 | A | 58 | Low | 60.4 | Low | 60 Ų | 60 | 95.9 Ų | 95.9 | 50% | 0.496 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -70.1 | -37.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F45 G46 A53 | F45-A49 WeakPolarHBondContact O-CB 3.32Å; F45-A49 PolarHBondContact O-N 2.79Å; G46-A49 PolarHBondContact O-N 3.42Å; A49-A53 WeakPolarHBondContact O-CB 3.38Å; A49-A53 PolarHBondContact O-N 2.76Å |
| 50 | G | 73.3 | Confident | 59.8 | Low | 41 Ų | 41 | 98.7 Ų | 98.7 | 42% | 0.423 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.9 | -43.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | G46 S47 A53 Y54 | G46-G50 PolarHBondContact O-N 2.74Å; S47-G50 PolarHBondContact O-N 3.21Å; G50-A53 PolarHBondContact O-N 3.05Å; G50-Y54 PolarHBondContact O-N 3.47Å |
| 51 | Y | 66.8 | Low | 58.8 | Low | 176 Ų | 176 | 106.6 Ų | 106.6 | 69% | 0.69 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.6 | -41.7 | 175.8 | -151.7 | -93.2 | 0 | 0 | 0 | 111.5 | S47 Y54 Q55 | S47-Y51 VanDerWaalsContact O-CB 3.28Å; S47-Y51 WeakPolarHBondContact O-CB 3.17Å; S47-Y51 PolarHBondContact O-N 3.5Å; Y51-Y54 WeakPolarHBondContact O-CB 3.43Å; Y51-Y54 PolarHBondContact O-N 2.81Å; Y51-Q55 WeakPolarHBondContact O-CB 3.5Å; Y51-Q55 PolarHBondContact O-N 3.45Å |
| 52 | G | 55.3 | Low | 58.1 | Low | 34 Ų | 34 | 108.9 Ų | 108.9 | 35% | 0.351 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -65 | -38.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L48 Y54 Q55 L56 | L48-G52 WeakPolarHBondContact O-CA 3.39Å; L48-G52 PolarHBondContact O-N 3.41Å; G52-Y54 VanDerWaalsContact C-N 3.34Å; G52-Q55 PolarHBondContact O-N 3.29Å; G52-L56 WeakPolarHBondContact O-CB 3.15Å; G52-L56 PolarHBondContact O-N 3.25Å |
| 53 | A | 51.8 | Low | 57.9 | Low | 55 Ų | 55 | 111.9 Ų | 111.9 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -68.3 | -34.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | A49 G50 L56 S57 | A49-A53 WeakPolarHBondContact O-CB 3.38Å; A49-A53 PolarHBondContact O-N 2.76Å; G50-A53 PolarHBondContact O-N 3.05Å; A53-L56 PolarHBondContact O-N 3.14Å; A53-S57 PolarHBondContact O-N 2.97Å |
| 54 | Y | 52.8 | Low | 56.8 | Low | 176 Ų | 176 | 116.3 Ų | 116.3 | 69% | 0.69 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -65.5 | -40.5 | 172.6 | -134.6 | -94.8 | 0 | 0 | 0 | 111.5 | G50 Y51 G52 S57 | G50-Y54 PolarHBondContact O-N 3.47Å; Y51-Y54 WeakPolarHBondContact O-CB 3.43Å; Y51-Y54 PolarHBondContact O-N 2.81Å; G52-Y54 VanDerWaalsContact C-N 3.34Å; Y54-S57 PolarHBondContact O-N 2.87Å |
| 55 | Q | 48.3 | Very low | 55.8 | Low | 140 Ų | 140 | 113.3 Ų | 113.3 | 65% | 0.654 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -74.8 | -29.8 | 178.2 | -154 | 152.5 | 30.7 | 0 | 0 | 112.6 | Y51 G52 | Y51-Q55 WeakPolarHBondContact O-CB 3.5Å; Y51-Q55 PolarHBondContact O-N 3.45Å; G52-Q55 PolarHBondContact O-N 3.29Å |
| 56 | L | 43.8 | Very low | 55.1 | Low | 120 Ų | 120 | 112.8 Ų | 112.8 | 63% | 0.628 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -74.7 | -25.2 | 174.9 | -163.2 | 67.3 | 0 | 0 | 0 | 112.5 | G52 A53 F66 | G52-L56 WeakPolarHBondContact O-CB 3.15Å; G52-L56 PolarHBondContact O-N 3.25Å; A53-L56 PolarHBondContact O-N 3.14Å; L56-F66 HydrophobicContact CD1-CE2 4.22Å |
| 57 | S | 44.1 | Very low | 54.8 | Low | 109 Ų | 109 | 116.6 Ų | 116.6 | 76% | 0.762 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76 | -16.2 | 175.4 | -101.3 | 0 | 0 | 0 | 0 | 114.5 | A53 Y54 | A53-S57 PolarHBondContact O-N 2.97Å; Y54-S57 PolarHBondContact O-N 2.87Å |
| 58 | Q | 47.3 | Very low | 54.4 | Low | 141 Ų | 141 | 115.7 Ų | 115.7 | 66% | 0.659 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.5 | -29.5 | -174.7 | -72.6 | -162.3 | -3.8 | 0 | 0 | 115.6 | ||
| 59 | D | 47.1 | Very low | 53.8 | Low | 112 Ų | 112 | 115 Ų | 115 | 60% | 0.599 | 61% | 0.608 | S | S | * | * | trans | -145.6 | 95.6 | -174.6 | -94.1 | -64.9 | 0 | 0 | 0 | 114.5 | R61 | D59-R61 PolarHBondContact O-N 3.35Š| ||
| 60 | P | 46.9 | Very low | 53.8 | Low | 130 Ų | 130 | 115.6 Ų | 115.6 | 84% | 0.844 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.9 | 43.8 | 172.4 | 31.9 | -34.2 | 0 | 0 | 0 | 112.6 | ||
| 61 | R | 46.9 | Very low | 54 | Low | 219 Ų | 219 | 115.8 Ų | 115.8 | 83% | 0.826 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.5 | 2 | -175.4 | -115.5 | -174.9 | -165.5 | -161.7 | 4.7 | 116.8 | D59 | D59-R61 PolarHBondContact O-N 3.35Š|
| 62 | N | 48.2 | Very low | 54.3 | Low | 103 Ų | 103 | 111.5 Ų | 111.5 | 55% | 0.551 | 60% | 0.603 | S | S | * | * | trans | -110.5 | 57.4 | -178.8 | -109.6 | -8.1 | 0 | 0 | 0 | 113.5 | W64 V65 F66 | N62-W64 PolarHBondContact O-N 3.41Å; N62-W64 VanDerWaalsContact O-N 3.14Å; N62-V65 HydrophobicContact CB-CB 4.16Å; N62-V65 HydrophobicContact CB-CG2 3.8Å; N62-V65 WeakPolarHBondContact ND2-CG2 3.25Å; N62-V65 PolarHBondContact O-N 2.8Å; N62-F66 PolarHBondContact O-N 3.4Å | ||
| 63 | V | 53.9 | Low | 54.5 | Low | 107 Ų | 107 | 114.9 Ų | 114.9 | 65% | 0.648 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -51 | -31.6 | 165.5 | -178.2 | 0 | 0 | 0 | 0 | 110.9 | F66 L67 | V63-F66 PolarHBondContact O-N 2.76Å; V63-L67 WeakPolarHBondContact O-CB 3.22Å; V63-L67 PolarHBondContact O-N 2.78Å |
| 64 | W | 53.6 | Low | 55.3 | Low | 209 Ų | 209 | 115.1 Ų | 115.1 | 79% | 0.792 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -63.7 | -36.2 | 174.4 | -94.5 | 84.2 | 0 | 0 | 0 | 114.4 | N62 L67 A68 | N62-W64 PolarHBondContact O-N 3.41Å; N62-W64 VanDerWaalsContact O-N 3.14Å; W64-L67 PolarHBondContact O-N 2.76Å; W64-A68 WeakPolarHBondContact O-CB 3.02Å; W64-A68 PolarHBondContact O-N 3.46Å |
| 65 | V | 56.1 | Low | 56.3 | Low | 75 Ų | 75 | 108.8 Ų | 108.8 | 46% | 0.455 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -74.1 | -37.8 | 178.5 | 178.3 | 0 | 0 | 0 | 0 | 109.8 | N62 T69 | N62-V65 HydrophobicContact CB-CB 4.16Å; N62-V65 HydrophobicContact CB-CG2 3.8Å; N62-V65 WeakPolarHBondContact ND2-CG2 3.25Å; N62-V65 PolarHBondContact O-N 2.8Å; V65-T69 WeakPolarHBondContact O-CB 3.48Å; V65-T69 PolarHBondContact O-N 2.87Å; V65-T69 PolarHBondContact O-OG1 2.8Å |
| 66 | F | 48.4 | Very low | 57.2 | Low | 149 Ų | 149 | 107.1 Ų | 107.1 | 65% | 0.654 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -64.9 | -38.7 | 170.6 | -106.8 | -95.3 | 0 | 0 | 0 | 112.1 | L56 N62 V63 S70 | L56-F66 HydrophobicContact CD1-CE2 4.22Å; N62-F66 PolarHBondContact O-N 3.4Å; V63-F66 PolarHBondContact O-N 2.76Å; F66-S70 WeakPolarHBondContact O-CA 3.07Å; F66-S70 WeakPolarHBondContact O-CB 3.21Å; F66-S70 PolarHBondContact O-N 2.81Å |
| 67 | L | 62.2 | Low | 57.8 | Low | 121 Ų | 121 | 106.2 Ų | 106.2 | 63% | 0.634 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.8 | -44.2 | 176.6 | -129.9 | 77.3 | 0 | 0 | 0 | 112.1 | V63 W64 G71 | V63-L67 WeakPolarHBondContact O-CB 3.22Å; V63-L67 PolarHBondContact O-N 2.78Å; W64-L67 PolarHBondContact O-N 2.76Å; L67-G71 WeakPolarHBondContact O-CA 3.42Å; L67-G71 PolarHBondContact O-N 3.5Å |
| 68 | A | 67.8 | Low | 58.5 | Low | 53 Ų | 53 | 102.9 Ų | 102.9 | 44% | 0.438 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.9 | -42.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | W64 T72 | W64-A68 WeakPolarHBondContact O-CB 3.02Å; W64-A68 PolarHBondContact O-N 3.46Å; A68-T72 WeakPolarHBondContact O-CB 3.27Å; A68-T72 PolarHBondContact O-N 3.46Å; A68-T72 PolarHBondContact O-OG1 2.9Å |
| 69 | T | 58.1 | Low | 58.6 | Low | 84 Ų | 84 | 103 Ų | 103 | 52% | 0.515 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -69.2 | -45.6 | 178.6 | -55.8 | 0 | 0 | 0 | 0 | 110.9 | V65 T72 L73 | V65-T69 WeakPolarHBondContact O-CB 3.48Å; V65-T69 PolarHBondContact O-N 2.87Å; V65-T69 PolarHBondContact O-OG1 2.8Å; T69-T72 PolarHBondContact O-N 3.43Å; T69-L73 WeakPolarHBondContact O-CB 3.43Å; T69-L73 PolarHBondContact O-N 2.61Å |
| 70 | S | 57.8 | Low | 58.7 | Low | 73 Ų | 73 | 105.6 Ų | 105.6 | 51% | 0.51 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -67.5 | -39.5 | 178 | -166.4 | 0 | 0 | 0 | 0 | 111.6 | F66 L73 A74 | F66-S70 WeakPolarHBondContact O-CA 3.07Å; F66-S70 WeakPolarHBondContact O-CB 3.21Å; F66-S70 PolarHBondContact O-N 2.81Å; S70-L73 PolarHBondContact O-N 2.84Å; S70-A74 WeakPolarHBondContact O-CB 3.4Å; S70-A74 PolarHBondContact O-N 3.31Å |
| 71 | G | 76.1 | Confident | 58.7 | Low | 46 Ų | 46 | 107.9 Ų | 107.9 | 47% | 0.474 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -65.9 | -39.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L67 G75 | L67-G71 WeakPolarHBondContact O-CA 3.42Å; L67-G71 PolarHBondContact O-N 3.5Å; G71-G75 PolarHBondContact O-N 2.89Å |
| 72 | T | 73.3 | Confident | 58.8 | Low | 86 Ų | 86 | 107.8 Ų | 107.8 | 53% | 0.528 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -68.5 | -42.3 | 175 | -55.2 | 0 | 0 | 0 | 0 | 110.9 | A68 T69 G75 I76 | A68-T72 WeakPolarHBondContact O-CB 3.27Å; A68-T72 PolarHBondContact O-N 3.46Å; A68-T72 PolarHBondContact O-OG1 2.9Å; T69-T72 PolarHBondContact O-N 3.43Å; T72-G75 PolarHBondContact O-N 2.83Å; T72-I76 HydrophobicContact CG2-CD1 3.84Å; T72-I76 HydrophobicContact CG2-CG1 4.49Å; T72-I76 WeakPolarHBondContact O-CB 3.19Å; T72-I76 VanDerWaalsContact O-CG1 3.23Å; T72-I76 WeakPolarHBondContact O-CG1 3.34Å; T72-I76 PolarHBondContact O-N 3.27Å |
| 73 | L | 60.7 | Low | 58.6 | Low | 104 Ų | 104 | 109.5 Ų | 109.5 | 55% | 0.545 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -68.6 | -40 | 178.6 | -162.8 | 71.5 | 0 | 0 | 0 | 111.6 | T69 S70 M77 | T69-L73 WeakPolarHBondContact O-CB 3.43Å; T69-L73 PolarHBondContact O-N 2.61Å; S70-L73 PolarHBondContact O-N 2.84Å; L73-M77 VanDerWaalsContact O-CB 3.24Å; L73-M77 WeakPolarHBondContact O-CB 3.25Å; L73-M77 VanDerWaalsContact O-CG 3.26Å; L73-M77 WeakPolarHBondContact O-CG 3.19Å; L73-M77 PolarHBondContact O-N 2.78Å |
| 74 | A | 68.6 | Low | 58.2 | Low | 61 Ų | 61 | 107.6 Ų | 107.6 | 50% | 0.504 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -67.6 | -35.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | S70 G78 | S70-A74 WeakPolarHBondContact O-CB 3.4Å; S70-A74 PolarHBondContact O-N 3.31Å; A74-G78 VanDerWaalsContact O-CA 3.32Å; A74-G78 WeakPolarHBondContact O-CA 3.32Å; A74-G78 PolarHBondContact O-N 2.84Å |
| 75 | G | 74 | Confident | 58.1 | Low | 42 Ų | 42 | 101.7 Ų | 101.7 | 43% | 0.433 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.4 | -47.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | G71 T72 G78 M79 | G71-G75 PolarHBondContact O-N 2.89Å; T72-G75 PolarHBondContact O-N 2.83Å; G75-G78 PolarHBondContact O-N 3.42Å; G75-M79 WeakPolarHBondContact O-CB 3.28Å; G75-M79 PolarHBondContact O-N 3.42Å |
| 76 | I | 66.3 | Low | 57.6 | Low | 105 Ų | 105 | 106.5 Ų | 106.5 | 54% | 0.538 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -65.7 | -43.8 | 177.9 | -66.6 | 165.5 | 0 | 0 | 0 | 110.6 | T72 R80 | T72-I76 HydrophobicContact CG2-CD1 3.84Å; T72-I76 HydrophobicContact CG2-CG1 4.49Å; T72-I76 WeakPolarHBondContact O-CB 3.19Å; T72-I76 VanDerWaalsContact O-CG1 3.23Å; T72-I76 WeakPolarHBondContact O-CG1 3.34Å; T72-I76 PolarHBondContact O-N 3.27Å; I76-R80 WeakPolarHBondContact O-CB 3.37Å; I76-R80 PolarHBondContact O-N 3.46Å |
| 77 | M | 56.1 | Low | 57.7 | Low | 102 Ų | 102 | 109.1 Ų | 109.1 | 50% | 0.502 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -72.9 | -31.8 | 177.5 | -70.6 | -69.1 | -179.7 | 0 | 0 | 112.7 | L73 R80 F81 | L73-M77 VanDerWaalsContact O-CB 3.24Å; L73-M77 WeakPolarHBondContact O-CB 3.25Å; L73-M77 VanDerWaalsContact O-CG 3.26Å; L73-M77 WeakPolarHBondContact O-CG 3.19Å; L73-M77 PolarHBondContact O-N 2.78Å; M77-R80 CarbonylContact O-C 3.59Å; M77-R80 PolarHBondContact O-N 3.46Å; M77-F81 VanDerWaalsContact O-CB 3.24Å; M77-F81 WeakPolarHBondContact O-CB 3.15Å; M77-F81 PolarHBondContact O-N 2.89Å |
| 78 | G | 58.7 | Low | 57 | Low | 38 Ų | 38 | 111.9 Ų | 111.9 | 39% | 0.392 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -71.8 | -41.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A74 G75 R80 F81 Y82 | A74-G78 VanDerWaalsContact O-CA 3.32Å; A74-G78 WeakPolarHBondContact O-CA 3.32Å; A74-G78 PolarHBondContact O-N 2.84Å; G75-G78 PolarHBondContact O-N 3.42Å; G78-R80 VanDerWaalsContact C-N 3.31Å; G78-R80 PolarHBondContact O-N 2.83Å; G78-F81 PolarHBondContact O-N 3.43Å; G78-Y82 PolarHBondContact O-N 3.46Å; G78-Y82 VanDerWaalsContact O-N 3.1Å |
| 79 | M | 50.6 | Low | 56.1 | Low | 143 Ų | 143 | 113.6 Ų | 113.6 | 70% | 0.704 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.4 | -33.6 | 173.5 | -153 | -149.8 | -80.6 | 0 | 0 | 111.2 | G75 | G75-M79 WeakPolarHBondContact O-CB 3.28Å; G75-M79 PolarHBondContact O-N 3.42Å |
| 80 | R | 48 | Very low | 55.8 | Low | 168 Ų | 168 | 112.9 Ų | 112.9 | 63% | 0.634 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -71.6 | -27.2 | 172 | -171.3 | -179.3 | 167.3 | -177.3 | -3.1 | 113.1 | I76 M77 G78 S84 | I76-R80 WeakPolarHBondContact O-CB 3.37Å; I76-R80 PolarHBondContact O-N 3.46Å; M77-R80 CarbonylContact O-C 3.59Å; M77-R80 PolarHBondContact O-N 3.46Å; G78-R80 VanDerWaalsContact C-N 3.31Å; G78-R80 PolarHBondContact O-N 2.83Å; R80-S84 WeakPolarHBondContact O-CB 3.49Å; R80-S84 PolarHBondContact O-N 3.46Å |
| 81 | F | 47 | Very low | 55.5 | Low | 178 Ų | 178 | 112.2 Ų | 112.2 | 78% | 0.781 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -77.7 | -31.1 | 177.1 | -168.7 | -103.5 | 0 | 0 | 0 | 112.5 | M77 G78 | M77-F81 VanDerWaalsContact O-CB 3.24Å; M77-F81 WeakPolarHBondContact O-CB 3.15Å; M77-F81 PolarHBondContact O-N 2.89Å; G78-F81 PolarHBondContact O-N 3.43Å |
| 82 | Y | 49.4 | Very low | 54.5 | Low | 216 Ų | 216 | 116.9 Ų | 116.9 | 85% | 0.847 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -75.2 | -27.5 | 177.6 | -134.7 | -87.3 | 0 | 0 | 0 | 113.4 | G78 | G78-Y82 PolarHBondContact O-N 3.46Å; G78-Y82 VanDerWaalsContact O-N 3.1Å |
| 83 | N | 44.7 | Very low | 53.7 | Low | 140 Ų | 140 | 118.3 Ų | 118.3 | 75% | 0.749 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -103.3 | -7.5 | -174.6 | -96.8 | -51.2 | 0 | 0 | 0 | 115.4 | ||
| 84 | S | 44.3 | Very low | 53.5 | Low | 66 Ų | 66 | 116.2 Ų | 116.2 | 46% | 0.462 | 65% | 0.646 | S | S | . | * | trans | -122 | 73.7 | -172.6 | -160.9 | 0 | 0 | 0 | 0 | 110.3 | R80 K86 | R80-S84 WeakPolarHBondContact O-CB 3.49Å; R80-S84 PolarHBondContact O-N 3.46Å; S84-K86 PolarHBondContact O-N 2.86Å | ||
| 85 | G | 51.6 | Low | 53.5 | Low | 85 Ų | 85 | 115.2 Ų | 115.2 | 88% | 0.876 | 64% | 0.642 | S | S | * | * | trans | -62.8 | 62.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 86 | K | 45.5 | Very low | 53 | Low | 176 Ų | 176 | 116.1 Ų | 116.1 | 77% | 0.765 | 65% | 0.645 | S | S | * | * | trans | -142.4 | 98.1 | -179.6 | -144.5 | 85 | 170 | -172.4 | 0 | 109.8 | S84 | S84-K86 PolarHBondContact O-N 2.86Š| ||
| 87 | F | 52 | Low | 52.5 | Low | 204 Ų | 204 | 114.3 Ų | 114.3 | 90% | 0.895 | 64% | 0.641 | S | S | * | * | trans | -50.1 | 132.7 | 160.7 | -85.7 | -103.6 | 0 | 0 | 0 | 111 | ||||
| 88 | M | 47.3 | Very low | 53.1 | Low | 179 Ų | 179 | 115.4 Ų | 115.4 | 88% | 0.882 | 65% | 0.649 | S | S | * | * | trans | 123.5 | 115.1 | 168.1 | -74.3 | 175.7 | 175.1 | 0 | 0 | 110.6 | ||||
| 89 | P | 48.5 | Very low | 53.7 | Low | 89 Ų | 89 | 119.3 Ų | 119.3 | 58% | 0.578 | 66% | 0.66 | S | S | * | * | S | Bend | cis | -127.3 | 24.4 | 38.8 | 39 | -21.7 | 0 | 0 | 0 | 113.2 | G91 L92 I93 | P89-G91 PolarHBondContact O-N 3.14Å; P89-L92 PolarHBondContact O-N 3.5Å; P89-I93 PolarHBondContact O-N 2.96Å |
| 90 | A | 50.8 | Low | 54.2 | Low | 70 Ų | 70 | 119 Ų | 119 | 58% | 0.579 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -62.3 | -25.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | I93 A94 | A90-I93 PolarHBondContact O-N 3.42Å; A90-A94 WeakPolarHBondContact O-CB 3.4Å; A90-A94 PolarHBondContact O-N 3.43Å |
| 91 | G | 51.4 | Low | 55.1 | Low | 58 Ų | 58 | 115.4 Ų | 115.4 | 60% | 0.598 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -69.7 | -34.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.4 | P89 G95 | P89-G91 PolarHBondContact O-N 3.14Å; G91-G95 PolarHBondContact O-N 2.85Å |
| 92 | L | 55.4 | Low | 56.5 | Low | 144 Ų | 144 | 110.9 Ų | 110.9 | 75% | 0.754 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -71.9 | -38 | 173.9 | -86.4 | 166.3 | 0 | 0 | 0 | 111.2 | P89 A96 | P89-L92 PolarHBondContact O-N 3.5Å; L92-A96 VanDerWaalsContact O-CB 3.25Å; L92-A96 WeakPolarHBondContact O-CB 3.32Å; L92-A96 PolarHBondContact O-N 3.48Å |
| 93 | I | 57.3 | Low | 57.1 | Low | 117 Ų | 117 | 107.8 Ų | 107.8 | 60% | 0.6 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -71.9 | -40.3 | 177.1 | -61.6 | 170.5 | 0 | 0 | 0 | 110.5 | P89 A90 A96 S97 | P89-I93 PolarHBondContact O-N 2.96Å; A90-I93 PolarHBondContact O-N 3.42Å; I93-A96 PolarHBondContact O-N 3.38Å; I93-S97 WeakPolarHBondContact O-CB 3.31Å; I93-S97 PolarHBondContact O-N 2.83Å |
| 94 | A | 55.8 | Low | 57.8 | Low | 60 Ų | 60 | 106.1 Ų | 106.1 | 50% | 0.496 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -65.3 | -42.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | A90 S97 L98 | A90-A94 WeakPolarHBondContact O-CB 3.4Å; A90-A94 PolarHBondContact O-N 3.43Å; A94-S97 PolarHBondContact O-N 3.46Å; A94-L98 WeakPolarHBondContact O-CB 3.31Å; A94-L98 PolarHBondContact O-N 3.05Å |
| 95 | G | 69.6 | Low | 59 | Low | 40 Ų | 40 | 105 Ų | 105 | 41% | 0.412 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -62.4 | -46.2 | 174 | 0 | 0 | 0 | 0 | 0 | 112.4 | G91 S97 L98 L99 | G91-G95 PolarHBondContact O-N 2.85Å; G95-S97 PolarHBondContact O-N 2.87Å; G95-L98 PolarHBondContact O-N 3.04Å; G95-L99 WeakPolarHBondContact O-CB 3.36Å; G95-L99 PolarHBondContact O-N 2.84Å |
| 96 | A | 61.8 | Low | 59.7 | Low | 60 Ų | 60 | 105.8 Ų | 105.8 | 50% | 0.496 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -63.3 | -39.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L92 I93 L99 M100 | L92-A96 VanDerWaalsContact O-CB 3.25Å; L92-A96 WeakPolarHBondContact O-CB 3.32Å; L92-A96 PolarHBondContact O-N 3.48Å; I93-A96 PolarHBondContact O-N 3.38Å; A96-L99 PolarHBondContact O-N 2.83Å; A96-M100 PolarHBondContact O-N 3.48Å |
| 97 | S | 55.9 | Low | 60.1 | Low | 67 Ų | 67 | 100.8 Ų | 100.8 | 47% | 0.469 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -68.9 | -42.1 | 178.8 | -159.3 | 0 | 0 | 0 | 0 | 111.8 | I93 A94 G95 L99 M100 V101 | I93-S97 WeakPolarHBondContact O-CB 3.31Å; I93-S97 PolarHBondContact O-N 2.83Å; A94-S97 PolarHBondContact O-N 3.46Å; G95-S97 PolarHBondContact O-N 2.87Å; S97-L99 VanDerWaalsContact C-N 3.31Å; S97-L99 PolarHBondContact O-N 3.23Å; S97-M100 WeakPolarHBondContact O-CB 3.27Å; S97-M100 PolarHBondContact O-N 3.38Å; S97-M100 VanDerWaalsContact O-N 3.14Å; S97-V101 VanDerWaalsContact O-CG2 3.31Å; S97-V101 WeakPolarHBondContact O-CG2 3.41Å; S97-V101 PolarHBondContact O-N 3.5Å |
| 98 | L | 69.1 | Low | 60.1 | Low | 125 Ų | 125 | 98.1 Ų | 98.1 | 65% | 0.654 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -62.8 | -39.5 | 175.1 | -163.5 | 123.6 | 0 | 0 | 0 | 111.4 | A94 G95 M100 V101 V102 | A94-L98 WeakPolarHBondContact O-CB 3.31Å; A94-L98 PolarHBondContact O-N 3.05Å; G95-L98 PolarHBondContact O-N 3.04Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 3.32Å; L98-V101 PolarHBondContact O-N 3Å; L98-V102 WeakPolarHBondContact O-CB 3.48Å; L98-V102 VanDerWaalsContact O-CG2 3.27Å; L98-V102 WeakPolarHBondContact O-CG2 3.45Å; L98-V102 PolarHBondContact O-N 2.94Å |
| 99 | L | 70.7 | Confident | 60.7 | Low | 121 Ų | 121 | 97 Ų | 97 | 63% | 0.634 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.8 | -38.8 | 174.7 | -144.7 | 160 | 0 | 0 | 0 | 111.3 | G95 A96 S97 K103 | G95-L99 WeakPolarHBondContact O-CB 3.36Å; G95-L99 PolarHBondContact O-N 2.84Å; A96-L99 PolarHBondContact O-N 2.83Å; S97-L99 VanDerWaalsContact C-N 3.31Å; S97-L99 PolarHBondContact O-N 3.23Å; L99-K103 VanDerWaalsContact O-CB 3.31Å; L99-K103 WeakPolarHBondContact O-CB 3.25Å; L99-K103 PolarHBondContact O-N 3.39Å |
| 100 | M | 61.2 | Low | 61.1 | Low | 135 Ų | 135 | 96.7 Ų | 96.7 | 67% | 0.665 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.8 | -41.5 | 175.8 | -125.6 | -177.3 | -170.4 | 0 | 0 | 112.4 | A96 S97 L98 K103 L104 | A96-M100 PolarHBondContact O-N 3.48Å; S97-M100 WeakPolarHBondContact O-CB 3.27Å; S97-M100 PolarHBondContact O-N 3.38Å; S97-M100 VanDerWaalsContact O-N 3.14Å; L98-M100 VanDerWaalsContact C-N 3.34Å; L98-M100 PolarHBondContact O-N 3.32Å; M100-K103 PolarHBondContact O-N 3.06Å; M100-L104 WeakPolarHBondContact O-CB 3.26Å; M100-L104 PolarHBondContact O-N 3.05Å |
| 101 | V | 67.4 | Low | 61 | Low | 94 Ų | 94 | 97.1 Ų | 97.1 | 57% | 0.57 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -66.7 | -41.2 | 177.8 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | S97 L98 K103 L104 G105 | S97-V101 VanDerWaalsContact O-CG2 3.31Å; S97-V101 WeakPolarHBondContact O-CG2 3.41Å; S97-V101 PolarHBondContact O-N 3.5Å; L98-V101 PolarHBondContact O-N 3Å; V101-K103 VanDerWaalsContact C-N 3.35Å; V101-L104 PolarHBondContact O-N 3.45Å; V101-G105 PolarHBondContact O-N 2.8Å |
| 102 | V | 76.1 | Confident | 60.6 | Low | 82 Ų | 82 | 99.4 Ų | 99.4 | 50% | 0.497 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63.5 | -43.4 | 173.9 | 170.5 | 0 | 0 | 0 | 0 | 110.4 | L98 L104 G105 I106 | L98-V102 WeakPolarHBondContact O-CB 3.48Å; L98-V102 VanDerWaalsContact O-CG2 3.27Å; L98-V102 WeakPolarHBondContact O-CG2 3.45Å; L98-V102 PolarHBondContact O-N 2.94Å; V102-L104 PolarHBondContact O-N 3.41Å; V102-G105 PolarHBondContact O-N 2.99Å; V102-I106 HydrophobicContact CG1-CD1 3.7Å; V102-I106 HydrophobicContact CG1-CG1 4.4Å; V102-I106 WeakPolarHBondContact O-CD1 3.48Å; V102-I106 WeakPolarHBondContact O-CG1 3.21Å; V102-I106 PolarHBondContact O-N 3.29Å |
| 103 | K | 63 | Low | 60.2 | Low | 152 Ų | 152 | 100.9 Ų | 100.9 | 66% | 0.661 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -64.8 | -39.3 | 177.6 | -163.4 | 176 | 176.6 | -177.1 | 0 | 112.2 | L99 M100 V101 S107 | L99-K103 VanDerWaalsContact O-CB 3.31Å; L99-K103 WeakPolarHBondContact O-CB 3.25Å; L99-K103 PolarHBondContact O-N 3.39Å; M100-K103 PolarHBondContact O-N 3.06Å; V101-K103 VanDerWaalsContact C-N 3.35Å; K103-S107 VanDerWaalsContact O-CB 3.26Å; K103-S107 WeakPolarHBondContact O-CB 3.4Å; K103-S107 PolarHBondContact O-N 2.92Å |
| 104 | L | 59.1 | Low | 59.8 | Low | 105 Ų | 105 | 104.2 Ų | 104.2 | 55% | 0.55 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -66.8 | -41.2 | 173.3 | -106.1 | 153 | 0 | 0 | 0 | 112.2 | M100 V101 V102 S107 M108 | M100-L104 WeakPolarHBondContact O-CB 3.26Å; M100-L104 PolarHBondContact O-N 3.05Å; V101-L104 PolarHBondContact O-N 3.45Å; V102-L104 PolarHBondContact O-N 3.41Å; L104-S107 PolarHBondContact O-N 3.29Å; L104-M108 WeakPolarHBondContact O-CB 3.45Å; L104-M108 WeakPolarHBondContact O-CG 2.9Å; L104-M108 PolarHBondContact O-N 2.79Å |
| 105 | G | 69.8 | Low | 60 | Low | 42 Ų | 42 | 106.4 Ų | 106.4 | 43% | 0.433 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -65.5 | -43.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | V101 V102 S107 M108 L109 | V101-G105 PolarHBondContact O-N 2.8Å; V102-G105 PolarHBondContact O-N 2.99Å; G105-S107 VanDerWaalsContact C-N 3.34Å; G105-M108 PolarHBondContact O-N 3.37Å; G105-L109 WeakPolarHBondContact O-CB 3.21Å; G105-L109 PolarHBondContact O-N 3.06Å |
| 106 | I | 65.1 | Low | 59.5 | Low | 102 Ų | 102 | 109.9 Ų | 109.9 | 52% | 0.523 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -64.8 | -42.4 | 173.4 | -59.5 | 160.3 | 0 | 0 | 0 | 109.6 | V102 M108 L109 S110 | V102-I106 HydrophobicContact CG1-CD1 3.7Å; V102-I106 HydrophobicContact CG1-CG1 4.4Å; V102-I106 WeakPolarHBondContact O-CD1 3.48Å; V102-I106 WeakPolarHBondContact O-CG1 3.21Å; V102-I106 PolarHBondContact O-N 3.29Å; I106-M108 PolarHBondContact O-N 3.47Å; I106-L109 PolarHBondContact O-N 3.36Å; I106-S110 VanDerWaalsContact O-CB 3.28Å; I106-S110 WeakPolarHBondContact O-CB 3.43Å; I106-S110 PolarHBondContact O-N 3.27Å; I106-S110 PolarHBondContact O-OG 3.5Å |
| 107 | S | 55.7 | Low | 59.4 | Low | 70 Ų | 70 | 112.7 Ų | 112.7 | 49% | 0.49 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -65.4 | -34.9 | 178.3 | -164.3 | 0 | 0 | 0 | 0 | 113.3 | K103 L104 G105 S111 | K103-S107 VanDerWaalsContact O-CB 3.26Å; K103-S107 WeakPolarHBondContact O-CB 3.4Å; K103-S107 PolarHBondContact O-N 2.92Å; L104-S107 PolarHBondContact O-N 3.29Å; G105-S107 VanDerWaalsContact C-N 3.34Å; S107-S111 WeakPolarHBondContact O-CB 3.35Å; S107-S111 PolarHBondContact O-N 2.6Å; S107-S111 PolarHBondContact O-OG 2.92Å |
| 108 | M | 51.9 | Low | 59.6 | Low | 148 Ų | 148 | 115.4 Ų | 115.4 | 73% | 0.729 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -75.2 | -36.9 | 175.5 | -81.4 | -156.4 | 148.8 | 0 | 0 | 112.3 | L104 G105 I106 S110 S111 | L104-M108 WeakPolarHBondContact O-CB 3.45Å; L104-M108 WeakPolarHBondContact O-CG 2.9Å; L104-M108 PolarHBondContact O-N 2.79Å; G105-M108 PolarHBondContact O-N 3.37Å; I106-M108 PolarHBondContact O-N 3.47Å; M108-S110 VanDerWaalsContact C-N 3.29Å; M108-S110 PolarHBondContact O-N 2.8Å; M108-S111 PolarHBondContact O-N 2.89Å |
| 109 | L | 59.5 | Low | 59 | Low | 155 Ų | 155 | 114.8 Ų | 114.8 | 81% | 0.812 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -71.3 | -27.3 | 174.6 | -166.5 | 63.3 | 0 | 0 | 0 | 112.1 | G105 I106 S111 | G105-L109 WeakPolarHBondContact O-CB 3.21Å; G105-L109 PolarHBondContact O-N 3.06Å; I106-L109 PolarHBondContact O-N 3.36Å; L109-S111 VanDerWaalsContact C-N 3.35Å |
| 110 | S | 55.6 | Low | 58.2 | Low | 83 Ų | 83 | 114.3 Ų | 114.3 | 58% | 0.58 | 65% | 0.652 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.7 | -7.5 | 176.3 | -48.8 | 0 | 0 | 0 | 0 | 113.8 | I106 M108 P112 | I106-S110 VanDerWaalsContact O-CB 3.28Å; I106-S110 WeakPolarHBondContact O-CB 3.43Å; I106-S110 PolarHBondContact O-N 3.27Å; I106-S110 PolarHBondContact O-OG 3.5Å; M108-S110 VanDerWaalsContact C-N 3.29Å; M108-S110 PolarHBondContact O-N 2.8Å; S110-P112 WeakPolarHBondContact O-CD 3.28Å |
| 111 | S | 48.9 | Very low | 58 | Low | 80 Ų | 80 | 112.9 Ų | 112.9 | 56% | 0.559 | 65% | 0.651 | S | S | * | * | trans | -114.2 | 64.5 | 179 | -52 | 0 | 0 | 0 | 0 | 111.7 | S107 M108 L109 Q113 | S107-S111 WeakPolarHBondContact O-CB 3.35Å; S107-S111 PolarHBondContact O-N 2.6Å; S107-S111 PolarHBondContact O-OG 2.92Å; M108-S111 PolarHBondContact O-N 2.89Å; L109-S111 VanDerWaalsContact C-N 3.35Å; S111-Q113 VanDerWaalsContact C-N 3.32Å; S111-Q113 PolarHBondContact O-N 3.36Å | ||
| 112 | P | 44.8 | Very low | 57.3 | Low | 105 Ų | 105 | 114.3 Ų | 114.3 | 68% | 0.682 | 66% | 0.657 | S | S | * | * | trans | -73.9 | 90.6 | 160.9 | 31.5 | -28.3 | 0 | 0 | 0 | 109.3 | S110 | S110-P112 WeakPolarHBondContact O-CD 3.28Š| ||
| 113 | Q | 46.8 | Very low | 55.7 | Low | 176 Ų | 176 | 117 Ų | 117 | 82% | 0.822 | 67% | 0.671 | S | S | * | * | trans | 59.5 | 163.5 | 145.8 | -74.4 | -150.5 | 28 | 0 | 0 | 118.6 | S111 | S111-Q113 VanDerWaalsContact C-N 3.32Å; S111-Q113 PolarHBondContact O-N 3.36Å | ||
| 114 | P | 48.8 | Very low | 55.1 | Low | 186 Ų | 186 | 113.8 Ų | 113.8 | 100% | 1.208 | 67% | 0.672 | S | S | * | * | cis | -96.5 | 0 | 28.6 | 38.1 | -34.9 | 0 | 0 | 0 | 116.7 |
Retrieved 114 of 114 residues in 19 ms
(Link to these results)