| 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 | 51.2 | Low | 53.5 | Low | 235 Ų | 235 | 149 Ų | 149 | 100% | 1.158 | 72% | 0.716 | S | S | * | * | 0 | 58.6 | 0 | -81.1 | 172.1 | 142.5 | 0 | 0 | 111.6 | |||||
| 2 | Y | 52.5 | Low | 53.6 | Low | 202 Ų | 202 | 149.1 Ų | 149.1 | 79% | 0.792 | 71% | 0.711 | S | S | * | * | trans | -121.3 | -9.6 | -177.9 | -81.7 | -80.4 | 0 | 0 | 0 | 114.7 | ||||
| 3 | Y | 52.6 | Low | 53.7 | Low | 209 Ų | 209 | 142.4 Ų | 142.4 | 82% | 0.82 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -82.3 | -33.1 | -177.1 | -83.9 | -85.5 | 0 | 0 | 0 | 113.8 | S5 R6 | Y3-S5 VanDerWaalsContact C-N 3.34Å; Y3-S5 PolarHBondContact O-N 3.32Å; Y3-R6 PolarHBondContact O-N 3.4Å |
| 4 | F | 51.2 | Low | 53.8 | Low | 193 Ų | 193 | 138.7 Ų | 138.7 | 85% | 0.846 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -67.1 | -33.2 | -178.7 | -107.7 | -89.9 | 0 | 0 | 0 | 113.3 | R6 V7 A8 | F4-R6 PolarHBondContact O-N 3.4Å; F4-V7 PolarHBondContact O-N 2.99Å; F4-A8 PolarHBondContact O-N 2.85Å |
| 5 | S | 56 | Low | 54 | Low | 91 Ų | 91 | 134.8 Ų | 134.8 | 64% | 0.636 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -71.2 | -31.9 | -177.5 | -155.8 | 0 | 0 | 0 | 0 | 113.2 | Y3 A9 | Y3-S5 VanDerWaalsContact C-N 3.34Å; Y3-S5 PolarHBondContact O-N 3.32Å; S5-A9 PolarHBondContact O-N 3.33Å |
| 6 | R | 52.6 | Low | 54.3 | Low | 204 Ų | 204 | 131.4 Ų | 131.4 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -75.1 | -30.1 | 178.6 | -75.9 | -170.6 | 173.5 | -176 | -1.2 | 113 | Y3 F4 R10 | Y3-R6 PolarHBondContact O-N 3.4Å; F4-R6 PolarHBondContact O-N 3.4Å; R6-R10 PolarHBondContact O-N 3.33Å |
| 7 | V | 54.5 | Low | 54.4 | Low | 96 Ų | 96 | 132.4 Ų | 132.4 | 58% | 0.582 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -72.1 | -41.8 | 176.8 | -179.9 | 0 | 0 | 0 | 0 | 110.6 | F4 A9 R10 T11 | F4-V7 PolarHBondContact O-N 2.99Å; V7-A9 PolarHBondContact O-N 2.73Å; V7-R10 PolarHBondContact O-N 3.37Å; V7-T11 PolarHBondContact O-N 3.34Å; V7-T11 PolarHBondContact O-OG1 3.1Å |
| 8 | A | 54.8 | Low | 54.5 | Low | 54 Ų | 54 | 133.9 Ų | 133.9 | 45% | 0.446 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -65.7 | -36 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | F4 T11 F12 | F4-A8 PolarHBondContact O-N 2.85Å; A8-T11 PolarHBondContact O-OG1 2.94Å; A8-F12 PolarHBondContact O-N 3.16Å; A8-F12 VanDerWaalsContact O-N 3.16Å |
| 9 | A | 54.8 | Low | 54.7 | Low | 65 Ų | 65 | 131.3 Ų | 131.3 | 54% | 0.537 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -67.1 | -36.6 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | S5 V7 C13 | S5-A9 PolarHBondContact O-N 3.33Å; V7-A9 PolarHBondContact O-N 2.73Å; A9-C13 PolarHBondContact O-N 3.39Å |
| 10 | R | 53.9 | Low | 54.7 | Low | 206 Ų | 206 | 129.2 Ų | 129.2 | 78% | 0.777 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -68.7 | -39.2 | 177 | -98.4 | 179.6 | 162.4 | 157.8 | -4 | 112.8 | R6 V7 C14 | R6-R10 PolarHBondContact O-N 3.33Å; V7-R10 PolarHBondContact O-N 3.37Å; R10-C14 PolarHBondContact O-N 2.68Å |
| 11 | T | 54.8 | Low | 54.6 | Low | 84 Ų | 84 | 125.9 Ų | 125.9 | 52% | 0.515 | 64% | 0.639 | S | S | . | * | H | α-helix | trans | -70.1 | -36.5 | 177.6 | 47.9 | 0 | 0 | 0 | 0 | 112.2 | V7 A8 C13 C14 C15 | V7-T11 PolarHBondContact O-N 3.34Å; V7-T11 PolarHBondContact O-OG1 3.1Å; A8-T11 PolarHBondContact O-OG1 2.94Å; T11-C13 PolarHBondContact O-N 3.28Å; T11-C14 PolarHBondContact O-N 3.48Å; T11-C15 PolarHBondContact O-N 3.37Å; T11-C15 PolarHBondContact O-SG 3.49Å |
| 12 | F | 54.5 | Low | 54.8 | Low | 150 Ų | 150 | 117.6 Ų | 117.6 | 66% | 0.658 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64 | -39.4 | 175.9 | -122.3 | -92 | 0 | 0 | 0 | 112.8 | A8 C15 I16 | A8-F12 PolarHBondContact O-N 3.16Å; A8-F12 VanDerWaalsContact O-N 3.16Å; F12-C15 PolarHBondContact O-N 3.31Å; F12-I16 HydrophobicContact CD1-CD1 4.36Å; F12-I16 WeakPolarHBondContact O-CG1 3.35Å; F12-I16 PolarHBondContact O-N 3.35Å |
| 13 | C | 54.5 | Low | 54.9 | Low | 62 Ų | 62 | 111 Ų | 111 | 42% | 0.419 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -62.1 | -45.8 | 178 | -167.5 | 0 | 0 | 0 | 0 | 111.6 | A9 T11 C15 I16 F17 | A9-C13 PolarHBondContact O-N 3.39Å; T11-C13 PolarHBondContact O-N 3.28Å; C13-C15 VanDerWaalsContact C-N 3.33Å; C13-C15 PolarHBondContact O-N 3.45Å; C13-I16 PolarHBondContact O-N 3.09Å; C13-F17 VanDerWaalsContact O-CD2 3.3Å; C13-F17 WeakPolarHBondContact O-CD2 3.35Å; C13-F17 PolarHBondContact O-N 3.42Å |
| 14 | C | 55.5 | Low | 54.9 | Low | 91 Ų | 91 | 110.8 Ų | 110.8 | 62% | 0.615 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -61.8 | -37 | 177.4 | -69.8 | 0 | 0 | 0 | 0 | 113.2 | R10 T11 F18 | R10-C14 PolarHBondContact O-N 2.68Å; T11-C14 PolarHBondContact O-N 3.48Å; C14-F18 PolarHBondContact O-N 3.18Å; C14-F18 VanDerWaalsContact O-N 3.16Å |
| 15 | C | 56.8 | Low | 54.9 | Low | 80 Ų | 80 | 105.5 Ų | 105.5 | 54% | 0.541 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.8 | -38.9 | 177.4 | -69.7 | 0 | 0 | 0 | 0 | 112.4 | T11 F12 C13 F18 C19 | T11-C15 PolarHBondContact O-N 3.37Å; T11-C15 PolarHBondContact O-SG 3.49Å; F12-C15 PolarHBondContact O-N 3.31Å; C13-C15 VanDerWaalsContact C-N 3.33Å; C13-C15 PolarHBondContact O-N 3.45Å; C15-F18 PolarHBondContact O-N 2.92Å; C15-C19 WeakPolarHBondContact O-CB 3.46Å; C15-C19 PolarHBondContact O-N 3.2Å; C15-C19 PolarHBondContact O-SG 2.91Å |
| 16 | I | 58.6 | Low | 54.6 | Low | 81 Ų | 81 | 110.7 Ų | 110.7 | 42% | 0.415 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -67.3 | -43.3 | 179.8 | -65.5 | 166.5 | 0 | 0 | 0 | 110.9 | F12 C13 F18 C19 L20 | F12-I16 HydrophobicContact CD1-CD1 4.36Å; F12-I16 WeakPolarHBondContact O-CG1 3.35Å; F12-I16 PolarHBondContact O-N 3.35Å; C13-I16 PolarHBondContact O-N 3.09Å; I16-F18 VanDerWaalsContact C-N 3.32Å; I16-F18 PolarHBondContact O-N 3.06Å; I16-C19 PolarHBondContact O-N 3.49Å; I16-L20 HydrophobicContact CG2-CD1 3.86Å; I16-L20 PolarHBondContact O-N 3.4Å |
| 17 | F | 56.4 | Low | 54.6 | Low | 147 Ų | 147 | 105.4 Ų | 105.4 | 65% | 0.645 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.9 | -39.2 | 176 | -83.8 | -75.5 | 0 | 0 | 0 | 112.2 | C13 L20 A21 | C13-F17 VanDerWaalsContact O-CD2 3.3Å; C13-F17 WeakPolarHBondContact O-CD2 3.35Å; C13-F17 PolarHBondContact O-N 3.42Å; F17-L20 PolarHBondContact O-N 2.66Å; F17-A21 WeakPolarHBondContact O-CB 3.2Å; F17-A21 PolarHBondContact O-N 2.93Å |
| 18 | F | 56.3 | Low | 54.5 | Low | 160 Ų | 160 | 107.9 Ų | 107.9 | 70% | 0.702 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -70.3 | -35.7 | 177.2 | -144.7 | -91.5 | 0 | 0 | 0 | 112.6 | C14 C15 I16 T22 | C14-F18 PolarHBondContact O-N 3.18Å; C14-F18 VanDerWaalsContact O-N 3.16Å; C15-F18 PolarHBondContact O-N 2.92Å; I16-F18 VanDerWaalsContact C-N 3.32Å; I16-F18 PolarHBondContact O-N 3.06Å; F18-T22 HydrophobicContact CD1-CG2 4.32Å; F18-T22 HydrophobicContact CE1-CG2 4.38Å; F18-T22 WeakPolarHBondContact O-CG2 3.19Å; F18-T22 PolarHBondContact O-N 2.89Å; F18-T22 VanDerWaalsContact O-N 3.17Å; F18-T22 PolarHBondContact O-OG1 3.49Å |
| 19 | C | 57 | Low | 54.5 | Low | 85 Ų | 85 | 116.2 Ų | 116.2 | 57% | 0.574 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -69 | -36.7 | 174.7 | -72.1 | 0 | 0 | 0 | 0 | 112.9 | C15 I16 T22 A23 | C15-C19 WeakPolarHBondContact O-CB 3.46Å; C15-C19 PolarHBondContact O-N 3.2Å; C15-C19 PolarHBondContact O-SG 2.91Å; I16-C19 PolarHBondContact O-N 3.49Å; C19-T22 WeakPolarHBondContact CA-OG1 3.44Å; C19-T22 PolarHBondContact O-OG1 3.31Å; C19-T22 VanDerWaalsContact O-OG1 3.05Å; C19-A23 WeakPolarHBondContact O-CB 3.28Å; C19-A23 PolarHBondContact O-N 2.71Å; C19-A23 VanDerWaalsContact O-N 3.1Å |
| 20 | L | 56.3 | Low | 54.2 | Low | 88 Ų | 88 | 117.8 Ų | 117.8 | 46% | 0.461 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -70.8 | -43.9 | 176 | -76.3 | 161.9 | 0 | 0 | 0 | 111.3 | I16 F17 T22 A23 Y24 | I16-L20 HydrophobicContact CG2-CD1 3.86Å; I16-L20 PolarHBondContact O-N 3.4Å; F17-L20 PolarHBondContact O-N 2.66Å; L20-T22 PolarHBondContact O-N 3.33Å; L20-A23 PolarHBondContact O-N 3.22Å; L20-A23 VanDerWaalsContact O-N 3.11Å; L20-Y24 HydrophobicContact CD2-CE2 4.37Å; L20-Y24 VanDerWaalsContact O-CD2 3.31Å; L20-Y24 WeakPolarHBondContact O-CD2 3.13Å; L20-Y24 PolarHBondContact O-N 3.5Å; L20-Y24 VanDerWaalsContact O-N 3.14Å |
| 21 | A | 52.4 | Low | 54.1 | Low | 61 Ų | 61 | 113.4 Ų | 113.4 | 50% | 0.504 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -59 | -36.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | F17 S25 | F17-A21 WeakPolarHBondContact O-CB 3.2Å; F17-A21 PolarHBondContact O-N 2.93Å; A21-S25 WeakPolarHBondContact O-CB 3.26Å; A21-S25 PolarHBondContact O-N 3.08Å; A21-S25 PolarHBondContact O-OG 2.78Å |
| 22 | T | 54.8 | Low | 54 | Low | 61 Ų | 61 | 118.9 Ų | 118.9 | 37% | 0.374 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -80.6 | -20 | 177.6 | 52.5 | 0 | 0 | 0 | 0 | 114.2 | F18 C19 L20 S25 R26 | F18-T22 HydrophobicContact CD1-CG2 4.32Å; F18-T22 HydrophobicContact CE1-CG2 4.38Å; F18-T22 WeakPolarHBondContact O-CG2 3.19Å; F18-T22 PolarHBondContact O-N 2.89Å; F18-T22 VanDerWaalsContact O-N 3.17Å; F18-T22 PolarHBondContact O-OG1 3.49Å; C19-T22 WeakPolarHBondContact CA-OG1 3.44Å; C19-T22 PolarHBondContact O-OG1 3.31Å; C19-T22 VanDerWaalsContact O-OG1 3.05Å; L20-T22 PolarHBondContact O-N 3.33Å; T22-S25 WeakPolarHBondContact CA-OG 3.34Å; T22-R26 WeakPolarHBondContact O-CG 3.3Å |
| 23 | A | 54.7 | Low | 53.9 | Low | 63 Ų | 63 | 121.4 Ų | 121.4 | 52% | 0.521 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -76.8 | -39 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112 | C19 L20 | C19-A23 WeakPolarHBondContact O-CB 3.28Å; C19-A23 PolarHBondContact O-N 2.71Å; C19-A23 VanDerWaalsContact O-N 3.1Å; L20-A23 PolarHBondContact O-N 3.22Å; L20-A23 VanDerWaalsContact O-N 3.11Å |
| 24 | Y | 52.1 | Low | 53.9 | Low | 204 Ų | 204 | 125.7 Ų | 125.7 | 80% | 0.8 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -79.6 | -21.3 | 178.9 | -79 | -78.3 | 0 | 0 | 0 | 114.2 | L20 | L20-Y24 HydrophobicContact CD2-CE2 4.37Å; L20-Y24 VanDerWaalsContact O-CD2 3.31Å; L20-Y24 WeakPolarHBondContact O-CD2 3.13Å; L20-Y24 PolarHBondContact O-N 3.5Å; L20-Y24 VanDerWaalsContact O-N 3.14Å |
| 25 | S | 52.4 | Low | 53.8 | Low | 83 Ų | 83 | 128.7 Ų | 128.7 | 58% | 0.58 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 2.5 | 178.2 | 48.7 | 0 | 0 | 0 | 0 | 113.8 | A21 T22 P27 | A21-S25 WeakPolarHBondContact O-CB 3.26Å; A21-S25 PolarHBondContact O-N 3.08Å; A21-S25 PolarHBondContact O-OG 2.78Å; T22-S25 WeakPolarHBondContact CA-OG 3.34Å; S25-P27 WeakPolarHBondContact O-CD 3.39Å |
| 26 | R | 49.6 | Very low | 53.6 | Low | 199 Ų | 199 | 133.8 Ų | 133.8 | 75% | 0.751 | 66% | 0.657 | S | S | * | * | S | Bend | trans | -79.9 | 110.2 | 168.3 | -78.1 | -179.3 | -176.6 | -165.5 | 1.8 | 108.4 | T22 D28 | T22-R26 WeakPolarHBondContact O-CG 3.3Å; R26-D28 PolarHBondContact O-N 3.13Å |
| 27 | P | 51.1 | Low | 53.3 | Low | 93 Ų | 93 | 137.4 Ų | 137.4 | 60% | 0.604 | 67% | 0.67 | S | S | * | * | trans | -56.2 | 136.2 | 169.2 | 25.3 | -33.1 | 0 | 0 | 0 | 107.4 | S25 R29 | S25-P27 WeakPolarHBondContact O-CD 3.39Å; P27-R29 VanDerWaalsContact C-N 3.31Å; P27-R29 WeakPolarHBondContact O-CG 3.29Å; P27-R29 PolarHBondContact O-N 3.44Å | ||
| 28 | D | 53.3 | Low | 53 | Low | 148 Ų | 148 | 137.5 Ų | 137.5 | 79% | 0.791 | 68% | 0.677 | S | S | * | * | trans | -55 | 94.4 | 179 | -165.9 | -4.9 | 0 | 0 | 0 | 109.4 | R26 N30 | R26-D28 PolarHBondContact O-N 3.13Å; D28-N30 PolarHBondContact O-N 3.13Å; D28-N30 VanDerWaalsContact O-N 3.16Å; D28-N30 WeakPolarHBondContact OD1-CB 3.31Å; D28-N30 PolarHBondContact OD1-N 2.96Å | ||
| 29 | R | 54.2 | Low | 53 | Low | 229 Ų | 229 | 137.5 Ų | 137.5 | 86% | 0.864 | 68% | 0.677 | S | S | * | * | trans | -80.1 | 17.5 | -178.5 | -78.7 | -173.1 | -177.6 | -175.9 | 0.8 | 111.6 | P27 P31 | P27-R29 VanDerWaalsContact C-N 3.31Å; P27-R29 WeakPolarHBondContact O-CG 3.29Å; P27-R29 PolarHBondContact O-N 3.44Å; R29-P31 WeakPolarHBondContact O-CD 3.42Å | ||
| 30 | N | 48.9 | Very low | 52.6 | Low | 99 Ų | 99 | 142 Ų | 142 | 53% | 0.529 | 69% | 0.687 | S | S | . | * | trans | -105.3 | 90.9 | 178.1 | -136.2 | -7.2 | 0 | 0 | 0 | 110.2 | D28 R32 | D28-N30 PolarHBondContact O-N 3.13Å; D28-N30 VanDerWaalsContact O-N 3.16Å; D28-N30 WeakPolarHBondContact OD1-CB 3.31Å; D28-N30 PolarHBondContact OD1-N 2.96Å; N30-R32 PolarHBondContact O-N 3.09Å | ||
| 31 | P | 52.5 | Low | 52.5 | Low | 113 Ų | 113 | 147.1 Ų | 147.1 | 73% | 0.734 | 71% | 0.705 | S | S | * | * | trans | -70 | 17.3 | 178 | 30.1 | -36.4 | 0 | 0 | 0 | 113.6 | R29 | R29-P31 WeakPolarHBondContact O-CD 3.42Š| ||
| 32 | R | 52.5 | Low | 52.3 | Low | 200 Ų | 200 | 153.2 Ų | 153.2 | 76% | 0.755 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -114.8 | 73.9 | -170.5 | -72.8 | -171.5 | -88.9 | -152.9 | -8.2 | 110.5 | N30 | N30-R32 PolarHBondContact O-N 3.09Š|
| 33 | K | 50.9 | Low | 51.7 | Low | 202 Ų | 202 | 153.6 Ų | 153.6 | 88% | 0.878 | 74% | 0.737 | S | S | * | * | trans | 158 | 37.5 | 151.2 | -88.4 | 173.2 | 179.6 | -170.1 | 0 | 113.4 | E35 | K33-E35 VanDerWaalsContact C-N 3.28Å; K33-E35 PolarHBondContact O-N 3.12Å | ||
| 34 | I | 54.5 | Low | 51.4 | Low | 153 Ų | 153 | 154.6 Ų | 154.6 | 79% | 0.785 | 75% | 0.745 | S | S | * | * | trans | -71 | 98.9 | 156.3 | -57.1 | 174.2 | 0 | 0 | 0 | 105.1 | K36 | I34-K36 PolarHBondContact O-N 3.27Š| ||
| 35 | E | 55 | Low | 51.2 | Low | 153 Ų | 153 | 150.8 Ų | 150.8 | 72% | 0.715 | 75% | 0.748 | S | S | * | * | trans | -47.3 | 112 | 164.6 | -82.7 | -174.1 | 155.7 | 0 | 0 | 107.4 | K33 K37 | K33-E35 VanDerWaalsContact C-N 3.28Å; K33-E35 PolarHBondContact O-N 3.12Å; E35-K37 PolarHBondContact O-N 3.18Å | ||
| 36 | K | 52.4 | Low | 51.2 | Low | 187 Ų | 187 | 154.9 Ų | 154.9 | 81% | 0.813 | 76% | 0.756 | S | S | * | * | trans | -65.7 | 79.3 | 166 | -72.4 | -178.2 | 178.9 | -178.2 | 0 | 107.2 | I34 D38 | I34-K36 PolarHBondContact O-N 3.27Å; K36-D38 VanDerWaalsContact C-N 3.31Å; K36-D38 PolarHBondContact O-N 2.76Å; K36-D38 VanDerWaalsContact O-N 3.1Å | ||
| 37 | K | 52.3 | Low | 51.2 | Low | 158 Ų | 158 | 153.4 Ų | 153.4 | 69% | 0.687 | 76% | 0.763 | S | S | * | * | trans | -68.8 | 102.8 | 155.3 | -76.8 | -174.6 | 179.4 | 176.3 | 0 | 104.8 | E35 K39 | E35-K37 PolarHBondContact O-N 3.18Å; K37-K39 PolarHBondContact O-N 3.28Å | ||
| 38 | D | 50.1 | Low | 51.3 | Low | 149 Ų | 149 | 154.7 Ų | 154.7 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | -59.9 | 74.2 | 169.2 | -70.5 | -32.8 | 0 | 0 | 0 | 109.3 | K36 K40 | K36-D38 VanDerWaalsContact C-N 3.31Å; K36-D38 PolarHBondContact O-N 2.76Å; K36-D38 VanDerWaalsContact O-N 3.1Å; D38-K40 PolarHBondContact O-N 2.74Å; D38-K40 VanDerWaalsContact O-N 3.09Å | ||
| 39 | K | 55.3 | Low | 51.3 | Low | 159 Ų | 159 | 152.3 Ų | 152.3 | 69% | 0.691 | 76% | 0.756 | S | S | * | * | trans | -69.4 | 104.4 | 160.8 | -74.6 | -173.8 | 178.7 | -178.6 | 0 | 105 | K37 F41 | K37-K39 PolarHBondContact O-N 3.28Å; K39-F41 VanDerWaalsContact C-N 3.27Å; K39-F41 HydrophobicContact CB-CE2 4.45Å; K39-F41 VanDerWaalsContact O-CD2 3.27Å; K39-F41 WeakPolarHBondContact O-CD2 3.19Å; K39-F41 PolarHBondContact O-N 3.37Å | ||
| 40 | K | 49.9 | Very low | 51.4 | Low | 180 Ų | 180 | 146.3 Ų | 146.3 | 78% | 0.783 | 75% | 0.747 | S | S | * | * | trans | -52 | 95.6 | 165.2 | -67.1 | 179.3 | 179.8 | 179.8 | 0 | 107.6 | D38 F42 | D38-K40 PolarHBondContact O-N 2.74Å; D38-K40 VanDerWaalsContact O-N 3.09Å; K40-F42 VanDerWaalsContact C-N 3.3Å; K40-F42 HydrophobicContact CB-CD2 4.4Å; K40-F42 HydrophobicContact CB-CE2 4.22Å; K40-F42 PolarHBondContact O-N 3.36Å | ||
| 41 | F | 53.3 | Low | 51.8 | Low | 195 Ų | 195 | 145 Ų | 145 | 86% | 0.855 | 75% | 0.75 | S | S | * | * | trans | -69.6 | 96.5 | 165.7 | -79.5 | -87.4 | 0 | 0 | 0 | 106 | K39 G43 | K39-F41 VanDerWaalsContact C-N 3.27Å; K39-F41 HydrophobicContact CB-CE2 4.45Å; K39-F41 VanDerWaalsContact O-CD2 3.27Å; K39-F41 WeakPolarHBondContact O-CD2 3.19Å; K39-F41 PolarHBondContact O-N 3.37Å; F41-G43 PolarHBondContact O-N 3.22Å | ||
| 42 | F | 49.3 | Very low | 51.9 | Low | 190 Ų | 190 | 144.9 Ų | 144.9 | 83% | 0.833 | 74% | 0.743 | S | S | * | * | trans | -63.3 | 94.5 | 160.4 | -78.4 | -88.3 | 0 | 0 | 0 | 106.5 | K40 A44 | K40-F42 VanDerWaalsContact C-N 3.3Å; K40-F42 HydrophobicContact CB-CD2 4.4Å; K40-F42 HydrophobicContact CB-CE2 4.22Å; K40-F42 PolarHBondContact O-N 3.36Å; F42-A44 PolarHBondContact O-N 3.49Å | ||
| 43 | G | 42.2 | Very low | 52 | Low | 69 Ų | 69 | 137.9 Ų | 137.9 | 71% | 0.711 | 73% | 0.728 | S | S | * | * | trans | -61.3 | 98.4 | 173 | 0 | 0 | 0 | 0 | 0 | 108.6 | F41 S45 | F41-G43 PolarHBondContact O-N 3.22Å; G43-S45 PolarHBondContact O-N 3.25Å | ||
| 44 | A | 48 | Very low | 52.2 | Low | 84 Ų | 84 | 133.9 Ų | 133.9 | 69% | 0.694 | 71% | 0.714 | S | S | * | * | trans | -63.2 | 98.8 | 156 | 0 | 0 | 0 | 0 | 0 | 105.6 | F42 K46 | F42-A44 PolarHBondContact O-N 3.49Å; A44-K46 PolarHBondContact O-N 3.2Å | ||
| 45 | S | 47.4 | Very low | 52.3 | Low | 123 Ų | 123 | 128.4 Ų | 128.4 | 86% | 0.86 | 70% | 0.695 | S | S | * | * | trans | -64.9 | 69.3 | 169.2 | 63.3 | 0 | 0 | 0 | 0 | 108.7 | G43 N47 | G43-S45 PolarHBondContact O-N 3.25Å; S45-N47 PolarHBondContact O-N 3.2Å | ||
| 46 | K | 52.1 | Low | 52.3 | Low | 169 Ų | 169 | 126.6 Ų | 126.6 | 74% | 0.735 | 69% | 0.69 | S | S | * | * | trans | -74.2 | 119.8 | 164.4 | -77 | -171.2 | 176.2 | -177.6 | 0 | 105.5 | A44 T48 | A44-K46 PolarHBondContact O-N 3.2Å; K46-T48 PolarHBondContact O-N 3.5Å; K46-T48 PolarHBondContact O-OG1 3.18Å | ||
| 47 | N | 50.9 | Low | 52.5 | Low | 168 Ų | 168 | 123.8 Ų | 123.8 | 90% | 0.898 | 68% | 0.683 | S | S | * | * | trans | -55.3 | 78.4 | 175 | -155.1 | 7 | 0 | 0 | 0 | 109.7 | S45 N49 | S45-N47 PolarHBondContact O-N 3.2Å; N47-N49 PolarHBondContact O-N 3.18Å; N47-N49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | T | 51.6 | Low | 52.8 | Low | 121 Ų | 121 | 124.2 Ų | 124.2 | 74% | 0.742 | 69% | 0.686 | S | S | * | * | trans | -81.3 | 91.3 | 180 | 29.9 | 0 | 0 | 0 | 0 | 108.1 | K46 | K46-T48 PolarHBondContact O-N 3.5Å; K46-T48 PolarHBondContact O-OG1 3.18Å | ||
| 49 | N | 54.4 | Low | 53.2 | Low | 98 Ų | 98 | 125.3 Ų | 125.3 | 52% | 0.524 | 68% | 0.683 | S | S | . | * | trans | -52.4 | 120.1 | 168.7 | -149.5 | -6.4 | 0 | 0 | 0 | 108.3 | N47 A51 N52 | N47-N49 PolarHBondContact O-N 3.18Å; N47-N49 VanDerWaalsContact O-N 3.09Å; N49-A51 PolarHBondContact O-N 3.49Å; N49-N52 PolarHBondContact O-N 3.5Å | ||
| 50 | P | 55 | Low | 53.3 | Low | 102 Ų | 102 | 120.2 Ų | 120.2 | 66% | 0.662 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -59.2 | -25.1 | -172.4 | 19.6 | -31.4 | 0 | 0 | 0 | 113.2 | N52 A53 | P50-N52 VanDerWaalsContact C-N 3.27Å; P50-N52 PolarHBondContact O-N 3.08Å; P50-A53 PolarHBondContact O-N 3.47Å |
| 51 | A | 57.1 | Low | 53.6 | Low | 71 Ų | 71 | 116.6 Ų | 116.6 | 59% | 0.587 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -61.1 | -32.3 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | N49 | N49-A51 PolarHBondContact O-N 3.49Å |
| 52 | N | 55.4 | Low | 53.8 | Low | 111 Ų | 111 | 111.1 Ų | 111.1 | 59% | 0.594 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -81 | -17 | 178.9 | -74 | -8.4 | 0 | 0 | 0 | 113 | N49 P50 | N49-N52 PolarHBondContact O-N 3.5Å; P50-N52 VanDerWaalsContact C-N 3.27Å; P50-N52 PolarHBondContact O-N 3.08Å |
| 53 | A | 54.3 | Low | 54.1 | Low | 53 Ų | 53 | 109.1 Ų | 109.1 | 44% | 0.438 | 65% | 0.645 | S | S | . | * | H | α-helix | trans | -73.8 | -39.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | P50 N56 L57 | P50-A53 PolarHBondContact O-N 3.47Å; A53-N56 PolarHBondContact O-N 3.17Å; A53-L57 PolarHBondContact O-N 3.13Å; A53-L57 VanDerWaalsContact O-N 3.16Å |
| 54 | M | 55 | Low | 54.5 | Low | 118 Ų | 118 | 113.5 Ų | 113.5 | 58% | 0.581 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -64.4 | -41.4 | 176.1 | -74.6 | -163.9 | 74.1 | 0 | 0 | 112.3 | N56 L57 F58 | M54-N56 PolarHBondContact O-N 3.4Å; M54-L57 WeakPolarHBondContact O-CB 3.3Å; M54-L57 PolarHBondContact O-N 3.08Å; M54-L57 VanDerWaalsContact O-N 3.15Å; M54-F58 HydrophobicContact CE-CE2 4.04Å; M54-F58 HydrophobicContact CE-CZ 4.31Å; M54-F58 WeakPolarHBondContact O-CD2 3.48Å; M54-F58 PolarHBondContact O-N 3.38Å |
| 55 | G | 56.9 | Low | 54.6 | Low | 38 Ų | 38 | 116.6 Ų | 116.6 | 39% | 0.392 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -62.3 | -28.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||
| 56 | N | 55.5 | Low | 54.8 | Low | 115 Ų | 115 | 114.6 Ų | 114.6 | 62% | 0.615 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -83.9 | -26 | 175.8 | -75.1 | -12.2 | 0 | 0 | 0 | 113.1 | A53 M54 K59 A60 | A53-N56 PolarHBondContact O-N 3.17Å; M54-N56 PolarHBondContact O-N 3.4Å; N56-K59 PolarHBondContact O-N 3.28Å; N56-A60 PolarHBondContact O-N 3.41Å |
| 57 | L | 56.1 | Low | 54.7 | Low | 128 Ų | 128 | 111 Ų | 111 | 67% | 0.67 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -66.3 | -36.6 | 173.2 | -95.1 | 145 | 0 | 0 | 0 | 112.1 | A53 M54 K59 A60 | A53-L57 PolarHBondContact O-N 3.13Å; A53-L57 VanDerWaalsContact O-N 3.16Å; M54-L57 WeakPolarHBondContact O-CB 3.3Å; M54-L57 PolarHBondContact O-N 3.08Å; M54-L57 VanDerWaalsContact O-N 3.15Å; L57-K59 VanDerWaalsContact C-N 3.31Å; L57-K59 PolarHBondContact O-N 2.95Å; L57-A60 WeakPolarHBondContact O-CB 3.27Å; L57-A60 PolarHBondContact O-N 3.27Å |
| 58 | F | 58.5 | Low | 54.6 | Low | 167 Ų | 167 | 109.1 Ų | 109.1 | 73% | 0.732 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -13.5 | 175.9 | -65.8 | -67.9 | 0 | 0 | 0 | 114.3 | M54 | M54-F58 HydrophobicContact CE-CE2 4.04Å; M54-F58 HydrophobicContact CE-CZ 4.31Å; M54-F58 WeakPolarHBondContact O-CD2 3.48Å; M54-F58 PolarHBondContact O-N 3.38Å |
| 59 | K | 59.2 | Low | 54.6 | Low | 173 Ų | 173 | 110.3 Ų | 110.3 | 75% | 0.752 | 60% | 0.599 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.4 | -2.5 | 173.1 | -72 | -176.3 | 179.3 | -177.5 | 0 | 113.1 | N56 L57 | N56-K59 PolarHBondContact O-N 3.28Å; L57-K59 VanDerWaalsContact C-N 3.31Å; L57-K59 PolarHBondContact O-N 2.95Å |
| 60 | A | 57.6 | Low | 54.5 | Low | 52 Ų | 52 | 109.1 Ų | 109.1 | 43% | 0.43 | 60% | 0.595 | S | S | . | * | S | Bend | trans | -67.2 | 134.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 108.8 | N56 L57 T62 | N56-A60 PolarHBondContact O-N 3.41Å; L57-A60 WeakPolarHBondContact O-CB 3.27Å; L57-A60 PolarHBondContact O-N 3.27Å; A60-T62 PolarHBondContact O-N 3.42Å |
| 61 | P | 55.5 | Low | 54.4 | Low | 104 Ų | 104 | 108.6 Ų | 108.6 | 68% | 0.675 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -56 | 118.2 | 175 | 21.8 | -30.6 | 0 | 0 | 0 | 108.7 | ||
| 62 | T | 57.6 | Low | 54.2 | Low | 80 Ų | 80 | 115.1 Ų | 115.1 | 49% | 0.491 | 60% | 0.599 | S | S | . | * | P | Polyproline II helix | trans | -61.5 | 148.8 | 175.6 | 28.8 | 0 | 0 | 0 | 0 | 109.5 | A60 E64 Y65 | A60-T62 PolarHBondContact O-N 3.42Å; T62-E64 PolarHBondContact O-N 3.21Å; T62-Y65 PolarHBondContact O-N 2.75Å |
| 63 | I | 55 | Low | 54.2 | Low | 148 Ų | 148 | 115 Ų | 115 | 76% | 0.759 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -51.6 | -24.5 | -175.7 | -65 | 167 | 0 | 0 | 0 | 112.6 | Y65 V66 | I63-Y65 PolarHBondContact O-N 3.43Å; I63-V66 PolarHBondContact O-N 3.36Å |
| 64 | E | 51.6 | Low | 54 | Low | 160 Ų | 160 | 118.9 Ų | 118.9 | 75% | 0.748 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -62.4 | -35.3 | 176.4 | -65.9 | 177.4 | 167 | 0 | 0 | 113.5 | T62 V66 | T62-E64 PolarHBondContact O-N 3.21Å; E64-V66 PolarHBondContact O-N 3.23Å |
| 65 | Y | 50.2 | Low | 53.7 | Low | 150 Ų | 150 | 120.6 Ų | 120.6 | 59% | 0.588 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -74.5 | -24.9 | -178.6 | -82.2 | -87.1 | 0 | 0 | 0 | 113.7 | T62 I63 V67 | T62-Y65 PolarHBondContact O-N 2.75Å; I63-Y65 PolarHBondContact O-N 3.43Å; Y65-V67 VanDerWaalsContact C-N 3.31Å; Y65-V67 PolarHBondContact O-N 3.37Å |
| 66 | V | 51.2 | Low | 53.4 | Low | 81 Ų | 81 | 124.1 Ų | 124.1 | 49% | 0.491 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -76 | -23.2 | -178.4 | -176.5 | 0 | 0 | 0 | 0 | 111.4 | I63 E64 V70 | I63-V66 PolarHBondContact O-N 3.36Å; E64-V66 PolarHBondContact O-N 3.23Å; V66-V70 HydrophobicContact CG1-CG2 4.43Å; V66-V70 WeakPolarHBondContact O-CG2 3.41Å; V66-V70 PolarHBondContact O-N 3.48Å |
| 67 | V | 49.6 | Very low | 53.2 | Low | 93 Ų | 93 | 125.3 Ų | 125.3 | 56% | 0.564 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -79.9 | -33.6 | -178.4 | -176.3 | 0 | 0 | 0 | 0 | 111.8 | Y65 T71 | Y65-V67 VanDerWaalsContact C-N 3.31Å; Y65-V67 PolarHBondContact O-N 3.37Å; V67-T71 WeakPolarHBondContact O-CB 3.46Å; V67-T71 WeakPolarHBondContact O-CG2 3.47Å; V67-T71 PolarHBondContact O-N 3.49Å; V67-T71 VanDerWaalsContact O-N 3.14Å; V67-T71 PolarHBondContact O-OG1 3.33Å |
| 68 | E | 50.2 | Low | 52.8 | Low | 129 Ų | 129 | 127.7 Ų | 127.7 | 60% | 0.603 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -71.8 | -36.4 | 176.3 | -75.5 | -167.4 | 159.1 | 0 | 0 | 113 | T71 R72 | E68-T71 WeakPolarHBondContact CA-OG1 3.43Å; E68-T71 PolarHBondContact O-OG1 3.16Å; E68-T71 VanDerWaalsContact O-OG1 3.11Å; E68-R72 PolarHBondContact O-N 2.98Å; E68-R72 VanDerWaalsContact O-N 3.13Å |
| 69 | E | 51.4 | Low | 52.3 | Low | 146 Ų | 146 | 128 Ų | 128 | 68% | 0.682 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -71.3 | -40.1 | 177.6 | -72.7 | -168.8 | 159.5 | 0 | 0 | 111.9 | T71 R72 T73 | E69-T71 VanDerWaalsContact C-N 3.31Å; E69-T71 PolarHBondContact O-N 3.23Å; E69-R72 PolarHBondContact O-N 3.34Å; E69-T73 PolarHBondContact O-N 3.13Å; E69-T73 PolarHBondContact O-OG1 3.44Å |
| 70 | V | 52.1 | Low | 51.8 | Low | 73 Ų | 73 | 126.8 Ų | 126.8 | 44% | 0.442 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -67.1 | -34 | 177.3 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | V66 T73 H74 | V66-V70 HydrophobicContact CG1-CG2 4.43Å; V66-V70 WeakPolarHBondContact O-CG2 3.41Å; V66-V70 PolarHBondContact O-N 3.48Å; V70-T73 PolarHBondContact O-OG1 3.14Å; V70-H74 WeakPolarHBondContact O-CB 3.35Å; V70-H74 PolarHBondContact O-N 3.11Å; V70-H74 PolarHBondContact O-ND1 3.2Å |
| 71 | T | 52.8 | Low | 51.6 | Low | 91 Ų | 91 | 130.2 Ų | 130.2 | 56% | 0.558 | 65% | 0.653 | S | S | * | * | H | α-helix | trans | -77.1 | -25.9 | 177.8 | 45.6 | 0 | 0 | 0 | 0 | 113.5 | V67 E68 E69 | V67-T71 WeakPolarHBondContact O-CB 3.46Å; V67-T71 WeakPolarHBondContact O-CG2 3.47Å; V67-T71 PolarHBondContact O-N 3.49Å; V67-T71 VanDerWaalsContact O-N 3.14Å; V67-T71 PolarHBondContact O-OG1 3.33Å; E68-T71 WeakPolarHBondContact CA-OG1 3.43Å; E68-T71 PolarHBondContact O-OG1 3.16Å; E68-T71 VanDerWaalsContact O-OG1 3.11Å; E69-T71 VanDerWaalsContact C-N 3.31Å; E69-T71 PolarHBondContact O-N 3.23Å |
| 72 | R | 51.9 | Low | 51.5 | Low | 207 Ų | 207 | 129 Ų | 129 | 78% | 0.781 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -74.4 | -35.6 | 171.9 | -80.8 | -175.8 | 174.6 | 179.8 | 1 | 113.5 | E68 E69 | E68-R72 PolarHBondContact O-N 2.98Å; E68-R72 VanDerWaalsContact O-N 3.13Å; E69-R72 PolarHBondContact O-N 3.34Å |
| 73 | T | 55.1 | Low | 51.4 | Low | 109 Ų | 109 | 131.9 Ų | 131.9 | 67% | 0.669 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -88.2 | -14.7 | -177.5 | 58.3 | 0 | 0 | 0 | 0 | 114.3 | E69 V70 | E69-T73 PolarHBondContact O-N 3.13Å; E69-T73 PolarHBondContact O-OG1 3.44Å; V70-T73 PolarHBondContact O-OG1 3.14Å |
| 74 | H | 50.2 | Low | 51.4 | Low | 134 Ų | 134 | 132.4 Ų | 132.4 | 62% | 0.62 | 67% | 0.667 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.8 | 37.7 | 177.6 | -62.9 | 82.8 | 0 | 0 | 0 | 112.1 | V70 P76 | V70-H74 WeakPolarHBondContact O-CB 3.35Å; V70-H74 PolarHBondContact O-N 3.11Å; V70-H74 PolarHBondContact O-ND1 3.2Å; H74-P76 VanDerWaalsContact O-CD 3.29Å; H74-P76 WeakPolarHBondContact O-CD 3.48Å |
| 75 | Q | 49.3 | Very low | 51.3 | Low | 155 Ų | 155 | 129.6 Ų | 129.6 | 72% | 0.724 | 66% | 0.655 | S | S | * | * | trans | -62.4 | 119.3 | 155.9 | -70.3 | -171.1 | 6.6 | 0 | 0 | 106 | E77 | Q75-E77 PolarHBondContact O-N 3.33Š| ||
| 76 | P | 51.3 | Low | 51.6 | Low | 112 Ų | 112 | 125.6 Ų | 125.6 | 73% | 0.727 | 65% | 0.649 | S | S | * | * | trans | -53.8 | 131.1 | 167.8 | 25.2 | -31.4 | 0 | 0 | 0 | 105.6 | H74 Q78 | H74-P76 VanDerWaalsContact O-CD 3.29Å; H74-P76 WeakPolarHBondContact O-CD 3.48Å; P76-Q78 VanDerWaalsContact C-N 3.28Å; P76-Q78 PolarHBondContact O-N 3.32Å | ||
| 77 | E | 50.5 | Low | 51.7 | Low | 139 Ų | 139 | 126.7 Ų | 126.7 | 65% | 0.65 | 66% | 0.658 | S | S | * | * | trans | -45.2 | 106.5 | 165.5 | -70.1 | -179.6 | 163.1 | 0 | 0 | 105.8 | Q75 Y79 | Q75-E77 PolarHBondContact O-N 3.33Å; E77-Y79 HydrophobicContact CB-CD2 4.29Å; E77-Y79 HydrophobicContact CB-CE2 3.92Å; E77-Y79 WeakPolarHBondContact O-CD2 3.39Å; E77-Y79 PolarHBondContact O-N 3.31Å; E77-Y79 VanDerWaalsContact OE2-CZ 3.25Å; E77-Y79 PolarHBondContact OE2-OH 3.41Å | ||
| 78 | Q | 47.6 | Very low | 51.9 | Low | 178 Ų | 178 | 128.9 Ų | 128.9 | 83% | 0.832 | 67% | 0.666 | S | S | * | * | trans | -72.1 | 86.8 | 175.7 | -172.3 | 174.3 | -20.3 | 0 | 0 | 102.9 | P76 D80 | P76-Q78 VanDerWaalsContact C-N 3.28Å; P76-Q78 PolarHBondContact O-N 3.32Å; Q78-D80 PolarHBondContact O-N 3.26Å | ||
| 79 | Y | 49.1 | Very low | 52.3 | Low | 174 Ų | 174 | 128.7 Ų | 128.7 | 68% | 0.682 | 67% | 0.666 | S | S | * | * | trans | -55.2 | 109.9 | 170.7 | -72 | -83 | 0 | 0 | 0 | 105.1 | E77 I81 | E77-Y79 HydrophobicContact CB-CD2 4.29Å; E77-Y79 HydrophobicContact CB-CE2 3.92Å; E77-Y79 WeakPolarHBondContact O-CD2 3.39Å; E77-Y79 PolarHBondContact O-N 3.31Å; E77-Y79 VanDerWaalsContact OE2-CZ 3.25Å; E77-Y79 PolarHBondContact OE2-OH 3.41Å; Y79-I81 PolarHBondContact O-N 3.48Å | ||
| 80 | D | 47.6 | Very low | 52.3 | Low | 147 Ų | 147 | 126 Ų | 126 | 79% | 0.786 | 66% | 0.66 | S | S | * | * | trans | -58.7 | 93 | 161.9 | -80 | -33.4 | 0 | 0 | 0 | 105.6 | Q78 P82 | Q78-D80 PolarHBondContact O-N 3.26Å; D80-P82 WeakPolarHBondContact O-CD 3.39Å | ||
| 81 | I | 53.8 | Low | 52.4 | Low | 124 Ų | 124 | 127 Ų | 127 | 64% | 0.636 | 66% | 0.662 | S | S | * | * | trans | -65.4 | 116 | 170.9 | -59.3 | 171.1 | 0 | 0 | 0 | 104 | Y79 T83 M85 | Y79-I81 PolarHBondContact O-N 3.48Å; I81-T83 PolarHBondContact O-N 3.32Å; I81-M85 HydrophobicContact CG2-CE 3.99Å | ||
| 82 | P | 52.5 | Low | 52.3 | Low | 79 Ų | 79 | 125.4 Ų | 125.4 | 51% | 0.513 | 66% | 0.658 | S | S | . | * | trans | -58.9 | 113.1 | 174.7 | 22.3 | -30.1 | 0 | 0 | 0 | 107.7 | D80 D84 M85 | D80-P82 WeakPolarHBondContact O-CD 3.39Å; P82-D84 PolarHBondContact O-N 3.19Å; P82-M85 HydrophobicContact CG-CE 4.22Å; P82-M85 HydrophobicContact CG-CG 4.46Å; P82-M85 PolarHBondContact O-N 3.27Å | ||
| 83 | T | 56.4 | Low | 52.3 | Low | 141 Ų | 141 | 118.4 Ų | 118.4 | 87% | 0.865 | 64% | 0.644 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.9 | -0.3 | -178.5 | -25.9 | 0 | 0 | 0 | 0 | 112.7 | I81 | I81-T83 PolarHBondContact O-N 3.32Š|
| 84 | D | 54.7 | Low | 52 | Low | 158 Ų | 158 | 116 Ų | 116 | 85% | 0.845 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.3 | 4.1 | 179 | -68.1 | -19.6 | 0 | 0 | 0 | 114 | P82 S86 | P82-D84 PolarHBondContact O-N 3.19Å; D84-S86 PolarHBondContact O-N 3.44Å |
| 85 | M | 50.3 | Low | 52.2 | Low | 101 Ų | 101 | 115.3 Ų | 115.3 | 50% | 0.498 | 63% | 0.629 | S | S | . | * | trans | -79.3 | 118.3 | 174.2 | -70.7 | -164 | -69.3 | 0 | 0 | 111.4 | I81 P82 | I81-M85 HydrophobicContact CG2-CE 3.99Å; P82-M85 HydrophobicContact CG-CE 4.22Å; P82-M85 HydrophobicContact CG-CG 4.46Å; P82-M85 PolarHBondContact O-N 3.27Å | ||
| 86 | S | 55.7 | Low | 52.3 | Low | 66 Ų | 66 | 111.6 Ų | 111.6 | 46% | 0.462 | 62% | 0.62 | S | S | . | * | trans | -55.9 | 146.8 | 176.7 | 75.7 | 0 | 0 | 0 | 0 | 110.9 | D84 L88 M89 | D84-S86 PolarHBondContact O-N 3.44Å; S86-L88 PolarHBondContact O-N 3.26Å; S86-M89 PolarHBondContact O-N 3.1Å | ||
| 87 | P | 53.9 | Low | 52.3 | Low | 104 Ų | 104 | 108.7 Ų | 108.7 | 68% | 0.675 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -52.8 | -20.2 | -178.8 | -27.3 | 34.3 | 0 | 0 | 0 | 114.7 | I91 | P87-I91 WeakPolarHBondContact O-CD1 3.49Å; P87-I91 WeakPolarHBondContact O-CG1 3.14Å |
| 88 | L | 54.1 | Low | 52.2 | Low | 139 Ų | 139 | 107.2 Ų | 107.2 | 73% | 0.728 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -67.7 | -36.7 | 177.5 | -117.4 | 92.6 | 0 | 0 | 0 | 113.4 | S86 T90 I91 A92 | S86-L88 PolarHBondContact O-N 3.26Å; L88-T90 VanDerWaalsContact C-N 3.34Å; L88-I91 PolarHBondContact O-N 3.13Å; L88-A92 PolarHBondContact O-N 3.09Å |
| 89 | M | 57.2 | Low | 52.5 | Low | 125 Ų | 125 | 105.9 Ų | 105.9 | 62% | 0.616 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -71.6 | -32.7 | -178.5 | -75.5 | -63.3 | -143.2 | 0 | 0 | 111.9 | S86 I91 A92 A93 | S86-M89 PolarHBondContact O-N 3.1Å; M89-I91 VanDerWaalsContact C-N 3.31Å; M89-I91 PolarHBondContact O-N 3.46Å; M89-A92 PolarHBondContact O-N 2.8Å; M89-A93 PolarHBondContact O-N 2.69Å |
| 90 | T | 52.7 | Low | 52.5 | Low | 91 Ų | 91 | 104.3 Ų | 104.3 | 56% | 0.558 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -67.4 | -33.7 | 176.8 | -32 | 0 | 0 | 0 | 0 | 111.8 | L88 S94 | L88-T90 VanDerWaalsContact C-N 3.34Å; T90-S94 PolarHBondContact O-N 2.95Å; T90-S94 PolarHBondContact O-OG 3.16Å |
| 91 | I | 53.4 | Low | 52.8 | Low | 93 Ų | 93 | 100.3 Ų | 100.3 | 48% | 0.477 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -71.8 | -40.9 | 178.3 | -62.9 | 164.9 | 0 | 0 | 0 | 110.9 | P87 L88 M89 A93 S94 E95 | P87-I91 WeakPolarHBondContact O-CD1 3.49Å; P87-I91 WeakPolarHBondContact O-CG1 3.14Å; L88-I91 PolarHBondContact O-N 3.13Å; M89-I91 VanDerWaalsContact C-N 3.31Å; M89-I91 PolarHBondContact O-N 3.46Å; I91-A93 VanDerWaalsContact C-N 3.31Å; I91-A93 PolarHBondContact O-N 2.76Å; I91-S94 WeakPolarHBondContact CA-OG 3.45Å; I91-S94 PolarHBondContact O-N 2.97Å; I91-S94 VanDerWaalsContact O-N 3.16Å; I91-S94 PolarHBondContact O-OG 3Å; I91-E95 PolarHBondContact O-N 3.29Å; I91-E95 VanDerWaalsContact O-N 3.1Å |
| 92 | A | 52.1 | Low | 52.7 | Low | 57 Ų | 57 | 99.8 Ų | 99.8 | 47% | 0.471 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -63.5 | -36 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | L88 M89 S96 | L88-A92 PolarHBondContact O-N 3.09Å; M89-A92 PolarHBondContact O-N 2.8Å; A92-S96 PolarHBondContact O-N 3.14Å |
| 93 | A | 49.9 | Very low | 52.6 | Low | 60 Ų | 60 | 103.6 Ų | 103.6 | 50% | 0.496 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -66.5 | -38.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | M89 I91 S96 A97 | M89-A93 PolarHBondContact O-N 2.69Å; I91-A93 VanDerWaalsContact C-N 3.31Å; I91-A93 PolarHBondContact O-N 2.76Å; A93-S96 PolarHBondContact O-N 3.11Å; A93-S96 PolarHBondContact O-OG 3.05Å; A93-A97 PolarHBondContact O-N 3.27Å |
| 94 | S | 50.8 | Low | 52.3 | Low | 60 Ų | 60 | 103 Ų | 103 | 42% | 0.42 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.5 | -37.2 | 176.4 | 47.8 | 0 | 0 | 0 | 0 | 113.7 | T90 I91 S96 A97 D98 | T90-S94 PolarHBondContact O-N 2.95Å; T90-S94 PolarHBondContact O-OG 3.16Å; I91-S94 WeakPolarHBondContact CA-OG 3.45Å; I91-S94 PolarHBondContact O-N 2.97Å; I91-S94 VanDerWaalsContact O-N 3.16Å; I91-S94 PolarHBondContact O-OG 3Å; S94-S96 VanDerWaalsContact C-N 3.26Å; S94-S96 PolarHBondContact O-N 3.1Å; S94-A97 PolarHBondContact O-N 3.17Å; S94-D98 PolarHBondContact O-N 3.02Å |
| 95 | E | 53.4 | Low | 52.1 | Low | 119 Ų | 119 | 102.4 Ų | 102.4 | 56% | 0.556 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67.1 | -27.7 | 176.9 | -70.3 | -177 | 176 | 0 | 0 | 112.9 | I91 | I91-E95 PolarHBondContact O-N 3.29Å; I91-E95 VanDerWaalsContact O-N 3.1Å |
| 96 | S | 52.2 | Low | 52.1 | Low | 76 Ų | 76 | 102.3 Ų | 102.3 | 53% | 0.531 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -74.8 | -30.8 | 175.3 | 76.2 | 0 | 0 | 0 | 0 | 112.8 | A92 A93 S94 F100 | A92-S96 PolarHBondContact O-N 3.14Å; A93-S96 PolarHBondContact O-N 3.11Å; A93-S96 PolarHBondContact O-OG 3.05Å; S94-S96 VanDerWaalsContact C-N 3.26Å; S94-S96 PolarHBondContact O-N 3.1Å; S96-F100 PolarHBondContact O-N 2.89Å |
| 97 | A | 50.4 | Low | 51.9 | Low | 52 Ų | 52 | 104.2 Ų | 104.2 | 43% | 0.43 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -72.9 | -38.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112 | A93 S94 K99 F100 T101 | A93-A97 PolarHBondContact O-N 3.27Å; S94-A97 PolarHBondContact O-N 3.17Å; A97-K99 VanDerWaalsContact C-N 3.32Å; A97-K99 PolarHBondContact O-N 2.97Å; A97-F100 WeakPolarHBondContact O-CB 3.47Å; A97-F100 PolarHBondContact O-N 3.29Å; A97-T101 PolarHBondContact O-N 3.37Å; A97-T101 VanDerWaalsContact O-N 3.12Å; A97-T101 PolarHBondContact O-OG1 2.61Å |
| 98 | D | 49.4 | Very low | 51.6 | Low | 107 Ų | 107 | 104.6 Ų | 104.6 | 57% | 0.572 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.9 | -33.9 | 177.2 | -79.3 | -18.7 | 0 | 0 | 0 | 112.5 | S94 F100 T101 D102 | S94-D98 PolarHBondContact O-N 3.02Å; D98-F100 VanDerWaalsContact C-N 3.26Å; D98-F100 PolarHBondContact O-N 3.24Å; D98-T101 PolarHBondContact O-OG1 3.48Å; D98-D102 PolarHBondContact O-N 3.36Å |
| 99 | K | 52.3 | Low | 51.6 | Low | 151 Ų | 151 | 101 Ų | 101 | 66% | 0.657 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -69.7 | -24.3 | 173.1 | -72.3 | 177.2 | -176.3 | 170.3 | 0 | 113.2 | A97 | A97-K99 VanDerWaalsContact C-N 3.32Å; A97-K99 PolarHBondContact O-N 2.97Å |
| 100 | F | 50.3 | Low | 51.4 | Low | 141 Ų | 141 | 97.8 Ų | 97.8 | 62% | 0.618 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -82 | -37.2 | -179.8 | -146.8 | -87.1 | 0 | 0 | 0 | 111.3 | S96 A97 D98 K103 F104 | S96-F100 PolarHBondContact O-N 2.89Å; A97-F100 WeakPolarHBondContact O-CB 3.47Å; A97-F100 PolarHBondContact O-N 3.29Å; D98-F100 VanDerWaalsContact C-N 3.26Å; D98-F100 PolarHBondContact O-N 3.24Å; F100-K103 PolarHBondContact O-N 3.16Å; F100-F104 HydrophobicContact CD1-CD2 4.2Å; F100-F104 AromaticContact CE1-CD2 3.97Å; F100-F104 HydrophobicContact CE1-CD2 3.97Å; F100-F104 HydrophobicContact CE1-CE2 4.08Å; F100-F104 PolarHBondContact O-N 3.24Å; F100-F104 VanDerWaalsContact O-N 3.09Å |
| 101 | T | 53.3 | Low | 51.5 | Low | 63 Ų | 63 | 97 Ų | 97 | 39% | 0.387 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.2 | -44.7 | 176.7 | 52.6 | 0 | 0 | 0 | 0 | 111.1 | A97 D98 K103 F104 F105 | A97-T101 PolarHBondContact O-N 3.37Å; A97-T101 VanDerWaalsContact O-N 3.12Å; A97-T101 PolarHBondContact O-OG1 2.61Å; D98-T101 PolarHBondContact O-OG1 3.48Å; T101-K103 VanDerWaalsContact C-N 3.31Å; T101-K103 PolarHBondContact O-N 3.27Å; T101-F104 PolarHBondContact O-N 3.3Å; T101-F104 VanDerWaalsContact O-N 3.09Å; T101-F105 WeakPolarHBondContact O-CD2 3.41Å; T101-F105 PolarHBondContact O-N 2.74Å |
| 102 | D | 51.1 | Low | 51.4 | Low | 113 Ų | 113 | 99.4 Ų | 99.4 | 60% | 0.604 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.2 | -40.8 | 176.7 | -88.2 | -12.2 | 0 | 0 | 0 | 112.4 | D98 V106 | D98-D102 PolarHBondContact O-N 3.36Å; D102-V106 VanDerWaalsContact O-CG2 3.28Å; D102-V106 WeakPolarHBondContact O-CG2 3.45Å; D102-V106 PolarHBondContact O-N 2.89Å; D102-V106 VanDerWaalsContact O-N 3.13Å |
| 103 | K | 51.4 | Low | 51.5 | Low | 159 Ų | 159 | 104.1 Ų | 104.1 | 69% | 0.691 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65 | -41.1 | 174.5 | -78.5 | -175.2 | 177.7 | -174.4 | 0 | 112.2 | F100 T101 V106 D107 | F100-K103 PolarHBondContact O-N 3.16Å; T101-K103 VanDerWaalsContact C-N 3.31Å; T101-K103 PolarHBondContact O-N 3.27Å; K103-V106 PolarHBondContact O-N 3.45Å; K103-D107 PolarHBondContact O-N 3.16Å; K103-D107 VanDerWaalsContact O-N 3.08Å |
| 104 | F | 49.9 | Very low | 51.7 | Low | 127 Ų | 127 | 108.2 Ų | 108.2 | 56% | 0.557 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -67 | -37.1 | 179.9 | -124.9 | -91 | 0 | 0 | 0 | 112.7 | F100 T101 Q108 | F100-F104 HydrophobicContact CD1-CD2 4.2Å; F100-F104 AromaticContact CE1-CD2 3.97Å; F100-F104 HydrophobicContact CE1-CD2 3.97Å; F100-F104 HydrophobicContact CE1-CE2 4.08Å; F100-F104 PolarHBondContact O-N 3.24Å; F100-F104 VanDerWaalsContact O-N 3.09Å; T101-F104 PolarHBondContact O-N 3.3Å; T101-F104 VanDerWaalsContact O-N 3.09Å; F104-Q108 VanDerWaalsContact O-CG 3.26Å; F104-Q108 WeakPolarHBondContact O-CG 3.09Å; F104-Q108 PolarHBondContact O-N 3.48Å; F104-Q108 VanDerWaalsContact O-N 3.13Å |
| 105 | F | 49.4 | Very low | 51.8 | Low | 147 Ų | 147 | 112.5 Ų | 112.5 | 65% | 0.645 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -70.5 | -38 | 176.6 | -79.7 | -70.5 | 0 | 0 | 0 | 112.6 | T101 S109 | T101-F105 WeakPolarHBondContact O-CD2 3.41Å; T101-F105 PolarHBondContact O-N 2.74Å; F105-S109 PolarHBondContact O-N 2.73Å |
| 106 | V | 52.2 | Low | 51.8 | Low | 99 Ų | 99 | 111.7 Ų | 111.7 | 60% | 0.6 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.8 | -42.5 | 174.7 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | D102 K103 Q108 S109 S110 | D102-V106 VanDerWaalsContact O-CG2 3.28Å; D102-V106 WeakPolarHBondContact O-CG2 3.45Å; D102-V106 PolarHBondContact O-N 2.89Å; D102-V106 VanDerWaalsContact O-N 3.13Å; K103-V106 PolarHBondContact O-N 3.45Å; V106-Q108 PolarHBondContact O-N 2.83Å; V106-S109 PolarHBondContact O-N 2.91Å; V106-S109 PolarHBondContact O-OG 2.93Å; V106-S110 PolarHBondContact O-N 3.39Å |
| 107 | D | 49.8 | Very low | 51.9 | Low | 106 Ų | 106 | 111.5 Ų | 111.5 | 57% | 0.567 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70 | -32.7 | -178.7 | -131.7 | 23.8 | 0 | 0 | 0 | 113.1 | K103 S109 S110 I111 | K103-D107 PolarHBondContact O-N 3.16Å; K103-D107 VanDerWaalsContact O-N 3.08Å; D107-S109 VanDerWaalsContact C-N 3.34Å; D107-S110 PolarHBondContact O-OG 3.44Å; D107-I111 WeakPolarHBondContact O-CD1 3.49Å; D107-I111 VanDerWaalsContact O-CG1 3.3Å; D107-I111 WeakPolarHBondContact O-CG1 3.1Å; D107-I111 PolarHBondContact O-N 2.93Å |
| 108 | Q | 49.2 | Very low | 51.9 | Low | 111 Ų | 111 | 113 Ų | 113 | 52% | 0.519 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -69.5 | -32.6 | 173.1 | -71.2 | -82.9 | -32.7 | 0 | 0 | 112.2 | F104 V106 M112 | F104-Q108 VanDerWaalsContact O-CG 3.26Å; F104-Q108 WeakPolarHBondContact O-CG 3.09Å; F104-Q108 PolarHBondContact O-N 3.48Å; F104-Q108 VanDerWaalsContact O-N 3.13Å; V106-Q108 PolarHBondContact O-N 2.83Å; Q108-M112 PolarHBondContact O-N 2.9Å |
| 109 | S | 53.1 | Low | 52.1 | Low | 63 Ų | 63 | 115.6 Ų | 115.6 | 44% | 0.441 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.3 | -32 | -178.7 | 80.1 | 0 | 0 | 0 | 0 | 113.3 | F105 V106 D107 | F105-S109 PolarHBondContact O-N 2.73Å; V106-S109 PolarHBondContact O-N 2.91Å; V106-S109 PolarHBondContact O-OG 2.93Å; D107-S109 VanDerWaalsContact C-N 3.34Å |
| 110 | S | 53.8 | Low | 52.1 | Low | 59 Ų | 59 | 110.2 Ų | 110.2 | 41% | 0.413 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -71.8 | -43.9 | 176.9 | 62.6 | 0 | 0 | 0 | 0 | 111 | V106 D107 M112 K113 E114 | V106-S110 PolarHBondContact O-N 3.39Å; D107-S110 PolarHBondContact O-OG 3.44Å; S110-M112 VanDerWaalsContact C-N 3.32Å; S110-M112 PolarHBondContact O-N 3.31Å; S110-K113 PolarHBondContact O-N 3.47Å; S110-E114 PolarHBondContact O-N 2.71Å |
| 111 | I | 53.9 | Low | 52.2 | Low | 75 Ų | 75 | 108.7 Ų | 108.7 | 39% | 0.385 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.8 | -33.9 | -179.9 | -62.7 | 167.1 | 0 | 0 | 0 | 111.8 | D107 K115 | D107-I111 WeakPolarHBondContact O-CD1 3.49Å; D107-I111 VanDerWaalsContact O-CG1 3.3Å; D107-I111 WeakPolarHBondContact O-CG1 3.1Å; D107-I111 PolarHBondContact O-N 2.93Å; I111-K115 PolarHBondContact O-N 3.45Å |
| 112 | M | 51.5 | Low | 52.1 | Low | 142 Ų | 142 | 108.6 Ų | 108.6 | 70% | 0.7 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.9 | -35.9 | 176.1 | -80.5 | -159.8 | 86.3 | 0 | 0 | 113.3 | Q108 S110 E114 T116 | Q108-M112 PolarHBondContact O-N 2.9Å; S110-M112 VanDerWaalsContact C-N 3.32Å; S110-M112 PolarHBondContact O-N 3.31Å; M112-E114 VanDerWaalsContact C-N 3.33Å; M112-T116 PolarHBondContact O-N 3.15Å; M112-T116 PolarHBondContact O-OG1 3.38Å; M112-T116 VanDerWaalsContact O-OG1 3.13Å |
| 113 | K | 55.1 | Low | 52.1 | Low | 156 Ų | 156 | 113.7 Ų | 113.7 | 68% | 0.678 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -68.8 | -33.5 | 177.9 | -74.7 | -178.6 | 179 | 177.7 | 0 | 112.3 | S110 T116 S117 | S110-K113 PolarHBondContact O-N 3.47Å; K113-T116 PolarHBondContact O-OG1 3.16Å; K113-T116 VanDerWaalsContact O-OG1 3.08Å; K113-S117 PolarHBondContact O-N 3.34Å |
| 114 | E | 53.6 | Low | 52 | Low | 147 Ų | 147 | 111.6 Ų | 111.6 | 69% | 0.687 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -71.1 | -37.9 | 179.6 | -145.9 | 178.1 | -171.2 | 0 | 0 | 111.9 | S110 M112 T116 S117 S118 | S110-E114 PolarHBondContact O-N 2.71Å; M112-E114 VanDerWaalsContact C-N 3.33Å; E114-T116 PolarHBondContact O-N 3.35Å; E114-S117 PolarHBondContact O-N 2.71Å; E114-S118 PolarHBondContact O-N 3.04Å; E114-S118 VanDerWaalsContact O-N 3.08Å |
| 115 | K | 52.4 | Low | 52 | Low | 150 Ų | 150 | 112.9 Ų | 112.9 | 65% | 0.652 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -68.8 | -30.3 | 177.2 | -83.2 | -179.1 | 177.5 | 170.9 | 0 | 114.1 | I111 K119 | I111-K115 PolarHBondContact O-N 3.45Å; K115-K119 PolarHBondContact O-N 3.41Å |
| 116 | T | 54.3 | Low | 51.8 | Low | 101 Ų | 101 | 116.3 Ų | 116.3 | 62% | 0.62 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -76.3 | -34.8 | 174.4 | 34.6 | 0 | 0 | 0 | 0 | 112.2 | M112 K113 E114 G120 | M112-T116 PolarHBondContact O-N 3.15Å; M112-T116 PolarHBondContact O-OG1 3.38Å; M112-T116 VanDerWaalsContact O-OG1 3.13Å; K113-T116 PolarHBondContact O-OG1 3.16Å; K113-T116 VanDerWaalsContact O-OG1 3.08Å; E114-T116 PolarHBondContact O-N 3.35Å; T116-G120 PolarHBondContact O-N 3.09Å; T116-G120 VanDerWaalsContact O-N 3.16Å |
| 117 | S | 53 | Low | 51.8 | Low | 73 Ų | 73 | 117.2 Ų | 117.2 | 51% | 0.51 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -66.1 | -42.8 | 174.5 | -178.6 | 0 | 0 | 0 | 0 | 112.5 | K113 E114 K119 G120 N121 | K113-S117 PolarHBondContact O-N 3.34Å; E114-S117 PolarHBondContact O-N 2.71Å; S117-K119 PolarHBondContact O-N 3.27Å; S117-G120 PolarHBondContact O-N 3.49Å; S117-N121 PolarHBondContact O-N 3.06Å; S117-N121 VanDerWaalsContact O-N 3.13Å |
| 118 | S | 51.3 | Low | 51.9 | Low | 83 Ų | 83 | 117.7 Ų | 117.7 | 58% | 0.58 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -61.1 | -39.2 | 177 | 165.3 | 0 | 0 | 0 | 0 | 113.3 | E114 A122 | E114-S118 PolarHBondContact O-N 3.04Å; E114-S118 VanDerWaalsContact O-N 3.08Å; S118-A122 PolarHBondContact O-N 2.88Å |
| 119 | K | 53.3 | Low | 52.1 | Low | 162 Ų | 162 | 118.1 Ų | 118.1 | 70% | 0.704 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -74.5 | -25.9 | 175.7 | -77.5 | -176 | 177.9 | 179.3 | 0 | 113.7 | K115 S117 | K115-K119 PolarHBondContact O-N 3.41Å; S117-K119 PolarHBondContact O-N 3.27Å |
| 120 | G | 51.9 | Low | 52 | Low | 37 Ų | 37 | 121.4 Ų | 121.4 | 38% | 0.381 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -67.8 | -49.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | T116 S117 A122 R123 T124 | T116-G120 PolarHBondContact O-N 3.09Å; T116-G120 VanDerWaalsContact O-N 3.16Å; S117-G120 PolarHBondContact O-N 3.49Å; G120-A122 PolarHBondContact O-N 3.26Å; G120-R123 PolarHBondContact O-N 3.33Å; G120-T124 PolarHBondContact O-OG1 3.36Å |
| 121 | N | 52 | Low | 51.9 | Low | 109 Ų | 109 | 125.3 Ų | 125.3 | 58% | 0.583 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -67.7 | -32.4 | 179.9 | -80.3 | -4.2 | 0 | 0 | 0 | 113.5 | S117 R123 T124 | S117-N121 PolarHBondContact O-N 3.06Å; S117-N121 VanDerWaalsContact O-N 3.13Å; N121-R123 PolarHBondContact O-N 3.31Å; N121-T124 PolarHBondContact O-N 3.21Å |
| 122 | A | 52.1 | Low | 51.7 | Low | 62 Ų | 62 | 128.6 Ų | 128.6 | 51% | 0.512 | 67% | 0.673 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69 | -18.1 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | S118 G120 | S118-A122 PolarHBondContact O-N 2.88Å; G120-A122 PolarHBondContact O-N 3.26Å |
| 123 | R | 50.3 | Low | 51.8 | Low | 219 Ų | 219 | 127.6 Ų | 127.6 | 83% | 0.826 | 67% | 0.671 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.3 | -10.5 | 175.1 | -95 | -176.5 | 167.8 | -176.8 | -3.9 | 113.9 | G120 N121 | G120-R123 PolarHBondContact O-N 3.33Å; N121-R123 PolarHBondContact O-N 3.31Å |
| 124 | T | 48.9 | Very low | 51.5 | Low | 115 Ų | 115 | 125.5 Ų | 125.5 | 71% | 0.706 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -100.6 | -4.3 | -179.5 | -38.9 | 0 | 0 | 0 | 0 | 112.5 | G120 N121 | G120-T124 PolarHBondContact O-OG1 3.36Å; N121-T124 PolarHBondContact O-N 3.21Å |
| 125 | L | 51.8 | Low | 51.3 | Low | 154 Ų | 154 | 123.7 Ų | 123.7 | 81% | 0.806 | 67% | 0.669 | S | S | * | * | trans | -112 | 9.3 | -177.5 | -77.7 | 167.8 | 0 | 0 | 0 | 114.4 | ||||
| 126 | L | 44.8 | Very low | 51.2 | Low | 219 Ų | 219 | 121.3 Ų | 121.3 | 100% | 1.147 | 67% | 0.671 | S | S | * | * | trans | -122.5 | 0 | 171 | -77.9 | 168.9 | 0 | 0 | 0 | 108.9 |
Retrieved 126 of 126 residues in 39.8 ms
(Link to these results)