| 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 | 37.7 | Very low | 46 | Very low | 233 Ų | 233 | 146.4 Ų | 146.4 | 100% | 1.148 | 78% | 0.778 | S | S | * | * | 0 | 137.7 | 0 | -72.6 | 179.4 | 158.7 | 0 | 0 | 107.5 | |||||
| 2 | P | 48.7 | Very low | 45.6 | Very low | 111 Ų | 111 | 148.2 Ų | 148.2 | 72% | 0.721 | 78% | 0.779 | S | S | * | * | cis | -113.6 | 148.1 | 2.5 | 13.7 | 11.2 | 0 | 0 | 0 | 111.7 | ||||
| 3 | E | 44.1 | Very low | 45.2 | Very low | 167 Ų | 167 | 146.8 Ų | 146.8 | 78% | 0.78 | 77% | 0.773 | S | S | * | * | 63.5 | 117.4 | 75.9 | -62.3 | -166.9 | 100.1 | 0 | 0 | 114.3 | |||||
| 4 | L | 48.6 | Very low | 44.5 | Very low | 135 Ų | 135 | 150.5 Ų | 150.5 | 71% | 0.707 | 77% | 0.771 | S | S | * | * | 168.9 | 123.8 | 94.7 | -104.4 | 111.2 | 0 | 0 | 0 | 109.3 | |||||
| 5 | D | 48.8 | Very low | 44.3 | Very low | 124 Ų | 124 | 146.8 Ų | 146.8 | 66% | 0.663 | 76% | 0.764 | S | S | * | * | 152.7 | 118 | 106.8 | -101.8 | -48 | 0 | 0 | 0 | 115.4 | |||||
| 6 | N | 44.3 | Very low | 44.2 | Very low | 125 Ų | 125 | 145.1 Ų | 145.1 | 67% | 0.668 | 76% | 0.764 | S | S | * | * | trans | 77.6 | 92.6 | 131.1 | -104.7 | -61.5 | 0 | 0 | 0 | 123 | ||||
| 7 | F | 45.5 | Very low | 44.2 | Very low | 191 Ų | 191 | 144.8 Ų | 144.8 | 84% | 0.838 | 76% | 0.764 | S | S | * | * | 52.7 | 155.9 | 118.2 | -71.8 | -68.4 | 0 | 0 | 0 | 123.5 | |||||
| 8 | P | 49.9 | Very low | 44 | Very low | 112 Ų | 112 | 146.6 Ų | 146.6 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -122.5 | -137.4 | -139.6 | 30 | -3.3 | 0 | 0 | 0 | 113.4 | ||||
| 9 | P | 56.3 | Low | 43.8 | Very low | 110 Ų | 110 | 142.6 Ų | 142.6 | 71% | 0.714 | 77% | 0.77 | S | S | * | * | -98.9 | 163.8 | -99.6 | 37.7 | -23.1 | 0 | 0 | 0 | 114.3 | |||||
| 10 | L | 43.8 | Very low | 43.7 | Very low | 171 Ų | 171 | 143.9 Ų | 143.9 | 90% | 0.895 | 78% | 0.776 | S | S | * | * | trans | -152.7 | 114.4 | 163.6 | -129.4 | 109 | 0 | 0 | 0 | 114.1 | ||||
| 11 | N | 38.3 | Very low | 43.5 | Very low | 131 Ų | 131 | 144.8 Ų | 144.8 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | trans | 19.5 | 137.3 | 145.3 | -80.2 | 5.2 | 0 | 0 | 0 | 123.2 | ||||
| 12 | E | 41.7 | Very low | 43.5 | Very low | 168 Ų | 168 | 137.4 Ų | 137.4 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | 34.8 | 120.1 | 129.2 | -66.2 | 173.4 | 89.6 | 0 | 0 | 118.5 | |||||
| 13 | D | 40.4 | Very low | 43.6 | Very low | 130 Ų | 130 | 138.1 Ų | 138.1 | 70% | 0.695 | 77% | 0.768 | S | S | * | * | 147 | 146.8 | 102.3 | -157.5 | 10 | 0 | 0 | 0 | 111 | |||||
| 14 | R | 35 | Very low | 43.7 | Very low | 199 Ų | 199 | 133.8 Ų | 133.8 | 75% | 0.751 | 76% | 0.761 | S | S | * | * | trans | 84.5 | 111.1 | 154.8 | -130.7 | 177.9 | -130.9 | 85.3 | 6.6 | 120.4 | ||||
| 15 | S | 40.9 | Very low | 43.5 | Very low | 95 Ų | 95 | 132.9 Ų | 132.9 | 66% | 0.664 | 76% | 0.757 | S | S | * | * | trans | -44.3 | 151.9 | 149.8 | -160.1 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 16 | P | 43.6 | Very low | 43.7 | Very low | 119 Ų | 119 | 131 Ų | 131 | 77% | 0.773 | 75% | 0.752 | S | S | * | * | -138.7 | 140.8 | 110.6 | 33.8 | -20.1 | 0 | 0 | 0 | 114.3 | |||||
| 17 | D | 44.3 | Very low | 44.1 | Very low | 141 Ų | 141 | 127.6 Ų | 127.6 | 75% | 0.754 | 74% | 0.741 | S | S | * | * | trans | -43.3 | 132.3 | 155 | -66.2 | -75 | 0 | 0 | 0 | 112.6 | ||||
| 18 | L | 40.7 | Very low | 44.2 | Very low | 177 Ų | 177 | 125.8 Ų | 125.8 | 93% | 0.927 | 74% | 0.735 | S | S | * | * | -174.7 | 117.5 | 128.8 | -131.3 | 76.5 | 0 | 0 | 0 | 113.1 | |||||
| 19 | G | 39.1 | Very low | 44.4 | Very low | 70 Ų | 70 | 124.9 Ų | 124.9 | 72% | 0.722 | 72% | 0.723 | S | S | * | * | 92 | 89.3 | 127.8 | 0 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 20 | L | 42.2 | Very low | 44.2 | Very low | 168 Ų | 168 | 126.2 Ų | 126.2 | 88% | 0.88 | 72% | 0.72 | S | S | * | * | S | Bend | trans | -168.6 | 69.7 | 132 | -138.4 | 81.7 | 0 | 0 | 0 | 112.4 | ||
| 21 | N | 39.4 | Very low | 44.4 | Very low | 163 Ų | 163 | 124 Ų | 124 | 87% | 0.872 | 71% | 0.705 | S | S | * | * | trans | -159.8 | 81.2 | 161 | -85.4 | -50.9 | 0 | 0 | 0 | 108.1 | P23 | N21-P23 WeakPolarHBondContact O-CD 3.29Š| ||
| 22 | G | 38.5 | Very low | 44.9 | Very low | 78 Ų | 78 | 120.7 Ų | 120.7 | 80% | 0.804 | 69% | 0.692 | S | S | * | * | trans | -66.8 | 120.3 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 23 | P | 49.4 | Very low | 45.5 | Very low | 126 Ų | 126 | 116.7 Ų | 116.7 | 82% | 0.818 | 68% | 0.675 | S | S | * | * | trans | -70.7 | 140.9 | 178.8 | 28.5 | -31.4 | 0 | 0 | 0 | 109.9 | N21 | N21-P23 WeakPolarHBondContact O-CD 3.29Š| ||
| 24 | A | 46.8 | Very low | 45.9 | Very low | 76 Ų | 76 | 116 Ų | 116 | 63% | 0.628 | 67% | 0.671 | S | S | * | * | trans | -42.4 | 140.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | P26 I29 | A24-P26 WeakPolarHBondContact O-CD 3.35Å; A24-I29 HydrophobicContact CB-CD1 4.39Å | ||
| 25 | D | 44.7 | Very low | 46.5 | Very low | 116 Ų | 116 | 113.1 Ų | 113.1 | 62% | 0.62 | 67% | 0.666 | S | S | * | * | trans | -58 | 113.7 | -176.1 | -149.7 | -12.7 | 0 | 0 | 0 | 111.1 | A27 Q28 | D25-A27 PolarHBondContact O-N 3.25Å; D25-A27 VanDerWaalsContact O-N 3.11Å; D25-Q28 PolarHBondContact O-N 3.34Å | ||
| 26 | P | 52.1 | Low | 46.8 | Very low | 84 Ų | 84 | 115.3 Ų | 115.3 | 55% | 0.545 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -64.2 | -19.1 | -171.8 | 23.4 | -33.4 | 0 | 0 | 0 | 113.6 | A24 Q28 Q30 | A24-P26 WeakPolarHBondContact O-CD 3.35Å; P26-Q28 PolarHBondContact O-N 2.62Å; P26-Q30 WeakPolarHBondContact O-CB 3.29Å; P26-Q30 VanDerWaalsContact O-CG 3.27Å; P26-Q30 WeakPolarHBondContact O-CG 3.14Å; P26-Q30 PolarHBondContact O-N 2.79Å; P26-Q30 PolarHBondContact O-OE1 3.46Å |
| 27 | A | 52.9 | Low | 46.6 | Very low | 54 Ų | 54 | 114.6 Ų | 114.6 | 45% | 0.446 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -67.2 | -32.9 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | D25 H31 | D25-A27 PolarHBondContact O-N 3.25Å; D25-A27 VanDerWaalsContact O-N 3.11Å; A27-H31 PolarHBondContact O-N 3.46Å |
| 28 | Q | 49.3 | Very low | 46.8 | Very low | 154 Ų | 154 | 112.8 Ų | 112.8 | 72% | 0.72 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -78.8 | -33 | -179.5 | -163.7 | 171.4 | 8.2 | 0 | 0 | 111.8 | D25 P26 H31 S32 | D25-Q28 PolarHBondContact O-N 3.34Å; P26-Q28 PolarHBondContact O-N 2.62Å; Q28-H31 PolarHBondContact O-N 3.3Å; Q28-S32 PolarHBondContact O-N 2.83Å |
| 29 | I | 54.2 | Low | 46.8 | Very low | 93 Ų | 93 | 112 Ų | 112 | 48% | 0.477 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -69.7 | -38.6 | 173.9 | -59.6 | 168.5 | 0 | 0 | 0 | 109.8 | A24 H31 S32 I33 | A24-I29 HydrophobicContact CB-CD1 4.39Å; I29-H31 PolarHBondContact O-N 3.41Å; I29-S32 PolarHBondContact O-OG 3.45Å; I29-S32 VanDerWaalsContact O-OG 3.08Å; I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.18Å; I29-I33 WeakPolarHBondContact O-CG1 3.18Å; I29-I33 PolarHBondContact O-N 2.79Å; I29-I33 VanDerWaalsContact O-N 3.09Å |
| 30 | Q | 51.1 | Low | 47 | Very low | 138 Ų | 138 | 113.6 Ų | 113.6 | 65% | 0.645 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -62.3 | -39.9 | 173.7 | -76.3 | 178.2 | -65 | 0 | 0 | 112.5 | P26 L34 | P26-Q30 WeakPolarHBondContact O-CB 3.29Å; P26-Q30 VanDerWaalsContact O-CG 3.27Å; P26-Q30 WeakPolarHBondContact O-CG 3.14Å; P26-Q30 PolarHBondContact O-N 2.79Å; P26-Q30 PolarHBondContact O-OE1 3.46Å; Q30-L34 VanDerWaalsContact O-CB 3.32Å; Q30-L34 WeakPolarHBondContact O-CB 3.08Å; Q30-L34 PolarHBondContact O-N 3.39Å |
| 31 | H | 47.3 | Very low | 47.2 | Very low | 124 Ų | 124 | 114.9 Ų | 114.9 | 57% | 0.574 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -67.9 | -44 | 179 | -117.4 | -76.3 | 0 | 0 | 0 | 112.7 | A27 Q28 I29 I33 L34 E35 | A27-H31 PolarHBondContact O-N 3.46Å; Q28-H31 PolarHBondContact O-N 3.3Å; I29-H31 PolarHBondContact O-N 3.41Å; H31-I33 VanDerWaalsContact C-N 3.33Å; H31-I33 PolarHBondContact O-N 2.74Å; H31-L34 PolarHBondContact O-N 3.46Å; H31-E35 PolarHBondContact O-N 3.22Å |
| 32 | S | 50.4 | Low | 47.3 | Very low | 61 Ų | 61 | 115.4 Ų | 115.4 | 43% | 0.427 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -65.8 | -34.1 | 177.1 | 68.5 | 0 | 0 | 0 | 0 | 113.4 | Q28 I29 E36 | Q28-S32 PolarHBondContact O-N 2.83Å; I29-S32 PolarHBondContact O-OG 3.45Å; I29-S32 VanDerWaalsContact O-OG 3.08Å; S32-E36 PolarHBondContact O-N 2.92Å |
| 33 | I | 53.4 | Low | 47.3 | Very low | 84 Ų | 84 | 119.2 Ų | 119.2 | 43% | 0.431 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -72.7 | -32.6 | 175.1 | -70.4 | -79.3 | 0 | 0 | 0 | 111.3 | I29 H31 Q37 | I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.18Å; I29-I33 WeakPolarHBondContact O-CG1 3.18Å; I29-I33 PolarHBondContact O-N 2.79Å; I29-I33 VanDerWaalsContact O-N 3.09Å; H31-I33 VanDerWaalsContact C-N 3.33Å; H31-I33 PolarHBondContact O-N 2.74Å; I33-Q37 VanDerWaalsContact O-CB 3.31Å; I33-Q37 WeakPolarHBondContact O-CB 3.23Å; I33-Q37 WeakPolarHBondContact O-CG 3.2Å; I33-Q37 PolarHBondContact O-N 3.49Å |
| 34 | L | 48.7 | Very low | 47 | Very low | 116 Ų | 116 | 122.3 Ų | 122.3 | 61% | 0.607 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -72.3 | -35.1 | 176.3 | -157.1 | 74.5 | 0 | 0 | 0 | 111.3 | Q30 H31 V38 | Q30-L34 VanDerWaalsContact O-CB 3.32Å; Q30-L34 WeakPolarHBondContact O-CB 3.08Å; Q30-L34 PolarHBondContact O-N 3.39Å; H31-L34 PolarHBondContact O-N 3.46Å; L34-V38 WeakPolarHBondContact O-CG2 3.15Å |
| 35 | E | 47.6 | Very low | 46.9 | Very low | 139 Ų | 139 | 123.2 Ų | 123.2 | 65% | 0.65 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -76.6 | -40.4 | 176.2 | -102.2 | 166.2 | 144.6 | 0 | 0 | 113 | H31 | H31-E35 PolarHBondContact O-N 3.22Å |
| 36 | E | 46.8 | Very low | 46.9 | Very low | 140 Ų | 140 | 120.9 Ų | 120.9 | 65% | 0.654 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -74.1 | -25.8 | 178.1 | -85 | -170 | 147.2 | 0 | 0 | 114.1 | S32 | S32-E36 PolarHBondContact O-N 2.92Å |
| 37 | Q | 40.3 | Very low | 46.8 | Very low | 104 Ų | 104 | 119 Ų | 119 | 49% | 0.486 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -82.2 | -20.2 | 177.6 | -76.4 | -153.3 | 30.3 | 0 | 0 | 114.1 | I33 W41 | I33-Q37 VanDerWaalsContact O-CB 3.31Å; I33-Q37 WeakPolarHBondContact O-CB 3.23Å; I33-Q37 WeakPolarHBondContact O-CG 3.2Å; I33-Q37 PolarHBondContact O-N 3.49Å; Q37-W41 VanDerWaalsContact O-CB 3.23Å; Q37-W41 WeakPolarHBondContact O-CB 3.49Å; Q37-W41 PolarHBondContact O-N 2.73Å |
| 38 | V | 47.6 | Very low | 46.6 | Very low | 104 Ų | 104 | 122.4 Ų | 122.4 | 63% | 0.63 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -79.3 | -34.8 | -179 | 169.5 | 0 | 0 | 0 | 0 | 112 | L34 | L34-V38 WeakPolarHBondContact O-CG2 3.15Å |
| 39 | E | 41.4 | Very low | 46.5 | Very low | 159 Ų | 159 | 118 Ų | 118 | 74% | 0.743 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -85.5 | -26.8 | -178.8 | -70.9 | -167.6 | 146.4 | 0 | 0 | 114.5 | ||
| 40 | L | 44.1 | Very low | 46.2 | Very low | 105 Ų | 105 | 118.9 Ų | 118.9 | 55% | 0.55 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -92.4 | -18.1 | 178.9 | -84.6 | 105 | 0 | 0 | 0 | 115.2 | ||
| 41 | W | 46.1 | Very low | 46.1 | Very low | 194 Ų | 194 | 116.3 Ų | 116.3 | 74% | 0.735 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -78.8 | -29.4 | 179.8 | -161.7 | 87 | 0 | 0 | 0 | 112.6 | Q37 F43 | Q37-W41 VanDerWaalsContact O-CB 3.23Å; Q37-W41 WeakPolarHBondContact O-CB 3.49Å; Q37-W41 PolarHBondContact O-N 2.73Å; W41-F43 VanDerWaalsContact C-N 3.29Å; W41-F43 PolarHBondContact O-N 2.79Å |
| 42 | W | 41.6 | Very low | 46.3 | Very low | 175 Ų | 175 | 112.6 Ų | 112.6 | 66% | 0.663 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -69.3 | -25.3 | 175.3 | -163.1 | 83.6 | 0 | 0 | 0 | 113.1 | ||
| 43 | F | 38.4 | Very low | 46.3 | Very low | 157 Ų | 157 | 117.5 Ų | 117.5 | 69% | 0.689 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -91.3 | -14.3 | -174.5 | -103.9 | -81.4 | 0 | 0 | 0 | 115.9 | W41 | W41-F43 VanDerWaalsContact C-N 3.29Å; W41-F43 PolarHBondContact O-N 2.79Å |
| 44 | R | 42.8 | Very low | 46.1 | Very low | 191 Ų | 191 | 116 Ų | 116 | 72% | 0.721 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -82 | -29.8 | -170.5 | -156.1 | 90 | 71.3 | 167.2 | 0.4 | 113.8 | ||
| 45 | D | 44.8 | Very low | 46.3 | Very low | 95 Ų | 95 | 112.7 Ų | 112.7 | 51% | 0.508 | 55% | 0.545 | S | S | . | . | trans | -155 | 62.9 | 177.3 | -88.7 | -52.1 | 0 | 0 | 0 | 112.2 | G47 R48 | D45-G47 PolarHBondContact O-N 2.82Å; D45-G47 VanDerWaalsContact O-N 3.13Å; D45-R48 HydrophobicContact CB-CB 4.49Å; D45-R48 PolarHBondContact O-N 2.9Å; D45-R48 VanDerWaalsContact O-N 3.12Å | ||
| 46 | P | 45 | Very low | 46.5 | Very low | 67 Ų | 67 | 108.3 Ų | 108.3 | 44% | 0.435 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.7 | -29.6 | -175 | 24 | -34.3 | 0 | 0 | 0 | 113 | R48 L50 | P46-R48 PolarHBondContact O-N 3.35Å; P46-L50 WeakPolarHBondContact O-CB 3.36Å; P46-L50 PolarHBondContact O-N 2.85Å; P46-L50 VanDerWaalsContact O-N 3.11Å |
| 47 | G | 48.8 | Very low | 46.9 | Very low | 44 Ų | 44 | 104.5 Ų | 104.5 | 45% | 0.454 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.8 | -35.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | D45 L51 | D45-G47 PolarHBondContact O-N 2.82Å; D45-G47 VanDerWaalsContact O-N 3.13Å; G47-L51 WeakPolarHBondContact O-CB 3.16Å; G47-L51 WeakPolarHBondContact O-CD1 3.2Å; G47-L51 WeakPolarHBondContact O-CG 3.25Å; G47-L51 PolarHBondContact O-N 3.34Å |
| 48 | R | 48.5 | Very low | 47.5 | Very low | 127 Ų | 127 | 105.3 Ų | 105.3 | 48% | 0.479 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -78.4 | -41.5 | -176.4 | -73.9 | -176.7 | 169.2 | 175.6 | -3.4 | 112.5 | D45 P46 L50 L51 C52 Y186 | D45-R48 HydrophobicContact CB-CB 4.49Å; D45-R48 PolarHBondContact O-N 2.9Å; D45-R48 VanDerWaalsContact O-N 3.12Å; P46-R48 PolarHBondContact O-N 3.35Å; R48-L50 VanDerWaalsContact C-N 3.33Å; R48-L51 PolarHBondContact O-N 3.47Å; R48-C52 PolarHBondContact O-N 2.85Å; R48-Y186 WeakPolarHBondContact CG-OH 3.32Å; R48-Y186 PolarHBondContact NE-OH 2.96Å |
| 49 | S | 48 | Very low | 47.8 | Very low | 62 Ų | 62 | 102.7 Ų | 102.7 | 43% | 0.434 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 174.7 | -171.8 | 0 | 0 | 0 | 0 | 110.9 | L51 C52 Y53 | S49-L51 PolarHBondContact O-N 3.05Å; S49-C52 PolarHBondContact O-N 2.7Å; S49-Y53 VanDerWaalsContact O-CB 3.31Å; S49-Y53 WeakPolarHBondContact O-CB 3.15Å; S49-Y53 PolarHBondContact O-N 3.1Å |
| 50 | L | 47.6 | Very low | 48.7 | Very low | 111 Ų | 111 | 100.7 Ų | 100.7 | 58% | 0.581 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.4 | -37.3 | 176.8 | -160.6 | 121.2 | 0 | 0 | 0 | 112.4 | P46 R48 C54 | P46-L50 WeakPolarHBondContact O-CB 3.36Å; P46-L50 PolarHBondContact O-N 2.85Å; P46-L50 VanDerWaalsContact O-N 3.11Å; R48-L50 VanDerWaalsContact C-N 3.33Å; L50-C54 VanDerWaalsContact O-CB 3.3Å; L50-C54 WeakPolarHBondContact O-CB 3.44Å; L50-C54 PolarHBondContact O-N 2.8Å; L50-C54 PolarHBondContact O-SG 3.37Å |
| 51 | L | 49.3 | Very low | 49.3 | Very low | 84 Ų | 84 | 100.6 Ų | 100.6 | 44% | 0.44 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -67.1 | -44.7 | 174.5 | -75.6 | 169.5 | 0 | 0 | 0 | 112.2 | G47 R48 S49 Y53 C54 V55 Y186 | G47-L51 WeakPolarHBondContact O-CB 3.16Å; G47-L51 WeakPolarHBondContact O-CD1 3.2Å; G47-L51 WeakPolarHBondContact O-CG 3.25Å; G47-L51 PolarHBondContact O-N 3.34Å; R48-L51 PolarHBondContact O-N 3.47Å; S49-L51 PolarHBondContact O-N 3.05Å; L51-Y53 VanDerWaalsContact C-N 3.33Å; L51-Y53 PolarHBondContact O-N 3.27Å; L51-C54 PolarHBondContact O-N 2.95Å; L51-V55 WeakPolarHBondContact O-CB 3.3Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 3.43Å; L51-Y186 HydrophobicContact CD1-CD2 4.25Å; L51-Y186 HydrophobicContact CD1-CE2 3.94Å |
| 52 | C | 51.9 | Low | 49.8 | Very low | 46 Ų | 46 | 93.5 Ų | 93.5 | 31% | 0.311 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -62.7 | -41.2 | 176.7 | -171.9 | 0 | 0 | 0 | 0 | 111.5 | R48 S49 V55 S56 | R48-C52 PolarHBondContact O-N 2.85Å; S49-C52 PolarHBondContact O-N 2.7Å; C52-V55 PolarHBondContact O-N 2.81Å; C52-S56 WeakPolarHBondContact O-CB 3.38Å; C52-S56 PolarHBondContact O-N 2.82Å; C52-S56 PolarHBondContact O-OG 3.31Å |
| 53 | Y | 49.6 | Very low | 50.6 | Low | 163 Ų | 163 | 88.1 Ų | 88.1 | 64% | 0.639 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.5 | -49.1 | 173.4 | -179.5 | -100.6 | 0 | 0 | 0 | 111.8 | S49 L51 V55 S56 V57 | S49-Y53 VanDerWaalsContact O-CB 3.31Å; S49-Y53 WeakPolarHBondContact O-CB 3.15Å; S49-Y53 PolarHBondContact O-N 3.1Å; L51-Y53 VanDerWaalsContact C-N 3.33Å; L51-Y53 PolarHBondContact O-N 3.27Å; Y53-V55 PolarHBondContact O-N 2.97Å; Y53-S56 PolarHBondContact O-N 2.83Å; Y53-V57 HydrophobicContact CD1-CG2 4.34Å; Y53-V57 HydrophobicContact CE1-CG2 4Å; Y53-V57 HydrophobicContact CE2-CG2 4.26Å; Y53-V57 VanDerWaalsContact O-CG2 3.29Å; Y53-V57 WeakPolarHBondContact O-CG2 3.26Å; Y53-V57 PolarHBondContact O-N 2.98Å |
| 54 | C | 49.7 | Very low | 51.3 | Low | 53 Ų | 53 | 82.5 Ų | 82.5 | 36% | 0.358 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 177.9 | -72 | 0 | 0 | 0 | 0 | 112.2 | L50 L51 V57 L58 | L50-C54 VanDerWaalsContact O-CB 3.3Å; L50-C54 WeakPolarHBondContact O-CB 3.44Å; L50-C54 PolarHBondContact O-N 2.8Å; L50-C54 PolarHBondContact O-SG 3.37Å; L51-C54 PolarHBondContact O-N 2.95Å; C54-V57 PolarHBondContact O-N 3.01Å; C54-L58 WeakPolarHBondContact O-CB 3.42Å; C54-L58 VanDerWaalsContact O-CG 3.26Å; C54-L58 WeakPolarHBondContact O-CG 3.32Å; C54-L58 PolarHBondContact O-N 2.91Å |
| 55 | V | 53 | Low | 51.8 | Low | 47 Ų | 47 | 79.2 Ų | 79.2 | 29% | 0.285 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.6 | -42.8 | 177.4 | 170 | 0 | 0 | 0 | 0 | 110.9 | L51 C52 Y53 L58 L59 V132 | L51-V55 WeakPolarHBondContact O-CB 3.3Å; L51-V55 WeakPolarHBondContact O-CG2 3.2Å; L51-V55 PolarHBondContact O-N 3.43Å; C52-V55 PolarHBondContact O-N 2.81Å; Y53-V55 PolarHBondContact O-N 2.97Å; V55-L58 PolarHBondContact O-N 2.86Å; V55-L59 HydrophobicContact CG1-CD1 3.86Å; V55-L59 HydrophobicContact CG1-CG 4.35Å; V55-L59 WeakPolarHBondContact O-CB 3.38Å; V55-L59 VanDerWaalsContact O-CG 3.27Å; V55-L59 WeakPolarHBondContact O-CG 3.48Å; V55-L59 PolarHBondContact O-N 3.39Å; V55-V132 HydrophobicContact CG1-CG1 4.1Å; V55-V132 HydrophobicContact CG1-CG2 4.32Å |
| 56 | S | 52.3 | Low | 52.3 | Low | 47 Ų | 47 | 76.1 Ų | 76.1 | 33% | 0.329 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.8 | -44.6 | 176 | -63 | 0 | 0 | 0 | 0 | 111.5 | C52 Y53 L59 I60 | C52-S56 WeakPolarHBondContact O-CB 3.38Å; C52-S56 PolarHBondContact O-N 2.82Å; C52-S56 PolarHBondContact O-OG 3.31Å; Y53-S56 PolarHBondContact O-N 2.83Å; S56-L59 PolarHBondContact O-N 3.48Å; S56-I60 WeakPolarHBondContact O-CB 3.41Å; S56-I60 WeakPolarHBondContact O-CD1 3.28Å; S56-I60 WeakPolarHBondContact O-CG1 3.25Å; S56-I60 PolarHBondContact O-N 3.41Å |
| 57 | V | 53.4 | Low | 52.8 | Low | 59 Ų | 59 | 74.3 Ų | 74.3 | 36% | 0.358 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62 | -46.2 | 176.2 | 170.8 | 0 | 0 | 0 | 0 | 111 | Y53 C54 L59 I60 L61 | Y53-V57 HydrophobicContact CD1-CG2 4.34Å; Y53-V57 HydrophobicContact CE1-CG2 4Å; Y53-V57 HydrophobicContact CE2-CG2 4.26Å; Y53-V57 VanDerWaalsContact O-CG2 3.29Å; Y53-V57 WeakPolarHBondContact O-CG2 3.26Å; Y53-V57 PolarHBondContact O-N 2.98Å; C54-V57 PolarHBondContact O-N 3.01Å; V57-L59 PolarHBondContact O-N 3.45Å; V57-I60 PolarHBondContact O-N 3.31Å; V57-L61 WeakPolarHBondContact O-CB 3.24Å; V57-L61 PolarHBondContact O-N 2.87Å |
| 58 | L | 52.6 | Low | 53.1 | Low | 121 Ų | 121 | 77 Ų | 77 | 63% | 0.634 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -64.5 | -38.1 | 178.6 | -73.4 | 171.5 | 0 | 0 | 0 | 112.6 | C54 V55 L61 G62 | C54-L58 WeakPolarHBondContact O-CB 3.42Å; C54-L58 VanDerWaalsContact O-CG 3.26Å; C54-L58 WeakPolarHBondContact O-CG 3.32Å; C54-L58 PolarHBondContact O-N 2.91Å; V55-L58 PolarHBondContact O-N 2.86Å; L58-L61 PolarHBondContact O-N 3.32Å; L58-G62 PolarHBondContact O-N 3.29Å |
| 59 | L | 54.2 | Low | 53.3 | Low | 49 Ų | 49 | 72.6 Ų | 72.6 | 26% | 0.257 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -67.3 | -42.8 | 175.8 | -75.3 | 172.2 | 0 | 0 | 0 | 111.7 | V55 S56 V57 C63 L139 | V55-L59 HydrophobicContact CG1-CD1 3.86Å; V55-L59 HydrophobicContact CG1-CG 4.35Å; V55-L59 WeakPolarHBondContact O-CB 3.38Å; V55-L59 VanDerWaalsContact O-CG 3.27Å; V55-L59 WeakPolarHBondContact O-CG 3.48Å; V55-L59 PolarHBondContact O-N 3.39Å; S56-L59 PolarHBondContact O-N 3.48Å; V57-L59 PolarHBondContact O-N 3.45Å; L59-C63 WeakPolarHBondContact O-CB 3.4Å; L59-C63 PolarHBondContact O-N 2.88Å; L59-L139 HydrophobicContact CD2-CD1 4.27Å |
| 60 | I | 60.1 | Low | 53.5 | Low | 117 Ų | 117 | 73.7 Ų | 73.7 | 60% | 0.6 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -64.2 | -43.9 | 175.6 | -68.3 | 164.3 | 0 | 0 | 0 | 110.3 | S56 V57 G64 | S56-I60 WeakPolarHBondContact O-CB 3.41Å; S56-I60 WeakPolarHBondContact O-CD1 3.28Å; S56-I60 WeakPolarHBondContact O-CG1 3.25Å; S56-I60 PolarHBondContact O-N 3.41Å; V57-I60 PolarHBondContact O-N 3.31Å; I60-G64 PolarHBondContact O-N 3.13Å |
| 61 | L | 58.3 | Low | 53.8 | Low | 103 Ų | 103 | 73.9 Ų | 73.9 | 54% | 0.539 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -65.1 | -47.8 | 179.3 | -137.5 | 95.9 | 0 | 0 | 0 | 111.3 | V57 L58 G64 L65 | V57-L61 WeakPolarHBondContact O-CB 3.24Å; V57-L61 PolarHBondContact O-N 2.87Å; L58-L61 PolarHBondContact O-N 3.32Å; L61-G64 PolarHBondContact O-N 3.42Å; L61-L65 HydrophobicContact CD2-CD1 3.96Å; L61-L65 HydrophobicContact CG-CD1 4.06Å; L61-L65 WeakPolarHBondContact O-CB 3.28Å; L61-L65 WeakPolarHBondContact O-CD1 3.26Å; L61-L65 PolarHBondContact O-N 2.84Å |
| 62 | G | 56.7 | Low | 53.7 | Low | 46 Ų | 46 | 74.5 Ų | 74.5 | 47% | 0.474 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -64.8 | -39.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L58 G66 | L58-G62 PolarHBondContact O-N 3.29Å; G62-G66 PolarHBondContact O-N 3.33Å |
| 63 | C | 56.8 | Low | 53.7 | Low | 62 Ų | 62 | 75.6 Ų | 75.6 | 42% | 0.419 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -67.1 | -41.9 | 174.6 | -166.6 | 0 | 0 | 0 | 0 | 111.6 | L59 G66 G67 C90 | L59-C63 WeakPolarHBondContact O-CB 3.4Å; L59-C63 PolarHBondContact O-N 2.88Å; C63-G66 PolarHBondContact O-N 3.41Å; C63-G67 PolarHBondContact O-N 3.41Å; C63-C90 PolarHBondContact SG-SG 3.05Å |
| 64 | G | 54.6 | Low | 53.5 | Low | 39 Ų | 39 | 70.1 Ų | 70.1 | 40% | 0.402 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.5 | -47.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I60 L61 G67 V68 | I60-G64 PolarHBondContact O-N 3.13Å; L61-G64 PolarHBondContact O-N 3.42Å; G64-G67 PolarHBondContact O-N 3.11Å; G64-V68 VanDerWaalsContact O-CG2 3.25Å; G64-V68 WeakPolarHBondContact O-CG2 3.4Å; G64-V68 PolarHBondContact O-N 3.45Å |
| 65 | L | 52 | Low | 53.3 | Low | 121 Ų | 121 | 73.9 Ų | 73.9 | 63% | 0.634 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.8 | -39.3 | 176.2 | -89.9 | 127.8 | 0 | 0 | 0 | 112.2 | L61 G69 | L61-L65 HydrophobicContact CD2-CD1 3.96Å; L61-L65 HydrophobicContact CG-CD1 4.06Å; L61-L65 WeakPolarHBondContact O-CB 3.28Å; L61-L65 WeakPolarHBondContact O-CD1 3.26Å; L61-L65 PolarHBondContact O-N 2.84Å; L65-G69 PolarHBondContact O-N 2.83Å |
| 66 | G | 56.5 | Low | 52.6 | Low | 31 Ų | 31 | 76.2 Ų | 76.2 | 32% | 0.32 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -64.8 | -41.7 | 175 | 0 | 0 | 0 | 0 | 0 | 112.8 | G62 C63 G69 L70 | G62-G66 PolarHBondContact O-N 3.33Å; C63-G66 PolarHBondContact O-N 3.41Å; G66-G69 PolarHBondContact O-N 3.24Å; G66-L70 WeakPolarHBondContact O-CB 3.42Å; G66-L70 VanDerWaalsContact O-CG 3.3Å; G66-L70 WeakPolarHBondContact O-CG 3.38Å; G66-L70 PolarHBondContact O-N 3.12Å |
| 67 | G | 54.6 | Low | 52.4 | Low | 28 Ų | 28 | 80.6 Ų | 80.6 | 29% | 0.289 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.8 | -44.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | C63 G64 L70 L71 | C63-G67 PolarHBondContact O-N 3.41Å; G64-G67 PolarHBondContact O-N 3.11Å; G67-L70 PolarHBondContact O-N 3.44Å; G67-L71 WeakPolarHBondContact O-CB 3.13Å; G67-L71 VanDerWaalsContact O-CG 3.27Å; G67-L71 WeakPolarHBondContact O-CG 3.42Å; G67-L71 PolarHBondContact O-N 3.38Å |
| 68 | V | 54.8 | Low | 52 | Low | 100 Ų | 100 | 82.5 Ų | 82.5 | 61% | 0.606 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -65.2 | -41 | 176.9 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | G64 L71 S72 | G64-V68 VanDerWaalsContact O-CG2 3.25Å; G64-V68 WeakPolarHBondContact O-CG2 3.4Å; G64-V68 PolarHBondContact O-N 3.45Å; V68-L71 PolarHBondContact O-N 3.47Å; V68-S72 WeakPolarHBondContact O-CB 3.2Å; V68-S72 PolarHBondContact O-N 3.46Å |
| 69 | G | 53.4 | Low | 52.1 | Low | 35 Ų | 35 | 78.2 Ų | 78.2 | 36% | 0.361 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113 | L65 G66 S72 T73 | L65-G69 PolarHBondContact O-N 2.83Å; G66-G69 PolarHBondContact O-N 3.24Å; G69-S72 PolarHBondContact O-N 2.82Å; G69-T73 PolarHBondContact O-N 2.96Å; G69-T73 PolarHBondContact O-OG1 2.9Å |
| 70 | L | 52 | Low | 52.1 | Low | 85 Ų | 85 | 83.8 Ų | 83.8 | 45% | 0.445 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 176.3 | -75.5 | 169.5 | 0 | 0 | 0 | 112.3 | G66 G67 T74 | G66-L70 WeakPolarHBondContact O-CB 3.42Å; G66-L70 VanDerWaalsContact O-CG 3.3Å; G66-L70 WeakPolarHBondContact O-CG 3.38Å; G66-L70 PolarHBondContact O-N 3.12Å; G67-L70 PolarHBondContact O-N 3.44Å; L70-T74 PolarHBondContact O-OG1 2.89Å |
| 71 | L | 53.5 | Low | 51.5 | Low | 116 Ų | 116 | 86.9 Ų | 86.9 | 61% | 0.607 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -69.3 | -38.9 | 178.3 | -71.7 | 169.3 | 0 | 0 | 0 | 112.1 | G67 V68 T73 T74 | G67-L71 WeakPolarHBondContact O-CB 3.13Å; G67-L71 VanDerWaalsContact O-CG 3.27Å; G67-L71 WeakPolarHBondContact O-CG 3.42Å; G67-L71 PolarHBondContact O-N 3.38Å; V68-L71 PolarHBondContact O-N 3.47Å; L71-T73 VanDerWaalsContact C-N 3.25Å; L71-T73 PolarHBondContact O-N 2.84Å; L71-T74 PolarHBondContact O-N 2.97Å |
| 72 | S | 47.4 | Very low | 51.6 | Low | 97 Ų | 97 | 86.8 Ų | 86.8 | 68% | 0.678 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -67.2 | -23.9 | 179.5 | -172.3 | 0 | 0 | 0 | 0 | 113.7 | V68 G69 | V68-S72 WeakPolarHBondContact O-CB 3.2Å; V68-S72 PolarHBondContact O-N 3.46Å; G69-S72 PolarHBondContact O-N 2.82Å |
| 73 | T | 51.2 | Low | 51.6 | Low | 68 Ų | 68 | 87.4 Ų | 87.4 | 42% | 0.417 | 52% | 0.517 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.3 | -7.9 | -175.6 | -41.3 | 0 | 0 | 0 | 0 | 112.4 | G69 L71 T75 D164 | G69-T73 PolarHBondContact O-N 2.96Å; G69-T73 PolarHBondContact O-OG1 2.9Å; L71-T73 VanDerWaalsContact C-N 3.25Å; L71-T73 PolarHBondContact O-N 2.84Å; T73-T75 PolarHBondContact O-N 2.91Å; T73-D164 HydrophobicContact CG2-CB 4.33Å; T73-D164 WeakPolarHBondContact CG2-OD2 3.3Å; T73-D164 PolarHBondContact OG1-OD2 3.1Å |
| 74 | T | 47.3 | Very low | 51.5 | Low | 49 Ų | 49 | 86.3 Ų | 86.3 | 30% | 0.301 | 52% | 0.517 | S | S | . | . | trans | -103.9 | 66.6 | -170.4 | -53.9 | 0 | 0 | 0 | 0 | 111.9 | L70 L71 S79 L83 | L70-T74 PolarHBondContact O-OG1 2.89Å; L71-T74 PolarHBondContact O-N 2.97Å; T74-S79 WeakPolarHBondContact CG2-OG 3.41Å; T74-L83 HydrophobicContact CG2-CD1 4.29Å | ||
| 75 | T | 45 | Very low | 51.6 | Low | 131 Ų | 131 | 86.9 Ų | 86.9 | 80% | 0.804 | 52% | 0.518 | S | S | * | . | trans | -113.5 | 36.2 | 171.5 | 66.6 | 0 | 0 | 0 | 0 | 113.1 | T73 | T73-T75 PolarHBondContact O-N 2.91Š| ||
| 76 | S | 38.8 | Very low | 52.2 | Low | 97 Ų | 97 | 82.7 Ų | 82.7 | 68% | 0.678 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -156.7 | 84.5 | 168 | -168.2 | 0 | 0 | 0 | 0 | 114.7 | S78 | S76-S78 VanDerWaalsContact C-N 3.3Å; S76-S78 PolarHBondContact O-N 3.1Å |
| 77 | V | 47.2 | Very low | 52.2 | Low | 139 Ų | 139 | 84.6 Ų | 84.6 | 84% | 0.842 | 51% | 0.509 | S | S | * | . | S | Bend | trans | 49 | -2.1 | 137 | -158.7 | 0 | 0 | 0 | 0 | 121.8 | ||
| 78 | S | 45.8 | Very low | 52.2 | Low | 98 Ų | 98 | 85.6 Ų | 85.6 | 69% | 0.685 | 52% | 0.515 | S | S | * | . | S | Bend | trans | -114.3 | 14 | 173.6 | -173.1 | 0 | 0 | 0 | 0 | 114 | S76 | S76-S78 VanDerWaalsContact C-N 3.3Å; S76-S78 PolarHBondContact O-N 3.1Å |
| 79 | S | 53.2 | Low | 52.2 | Low | 32 Ų | 32 | 85.3 Ų | 85.3 | 22% | 0.224 | 51% | 0.509 | C | S | . | . | trans | -102.9 | -0 | -156.6 | 50 | 0 | 0 | 0 | 0 | 116.2 | T74 W81 R82 L83 | T74-S79 WeakPolarHBondContact CG2-OG 3.41Å; S79-W81 PolarHBondContact O-N 3.08Å; S79-R82 PolarHBondContact O-N 2.86Å; S79-L83 WeakPolarHBondContact O-CB 3.22Å; S79-L83 PolarHBondContact O-N 3.47Å | ||
| 80 | E | 55.7 | Low | 52.6 | Low | 166 Ų | 166 | 85.6 Ų | 85.6 | 78% | 0.776 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.2 | -39.2 | -163.2 | -60.2 | 179 | 123.7 | 0 | 0 | 113.9 | G84 | E80-G84 PolarHBondContact O-N 2.86Å |
| 81 | W | 47.5 | Very low | 52.6 | Low | 182 Ų | 182 | 86.8 Ų | 86.8 | 69% | 0.689 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -80.3 | -27 | -178.7 | 57.6 | -86.9 | 0 | 0 | 0 | 113.3 | S79 A85 | S79-W81 PolarHBondContact O-N 3.08Å; W81-A85 VanDerWaalsContact O-CB 3.26Å; W81-A85 WeakPolarHBondContact O-CB 3.2Å; W81-A85 PolarHBondContact O-N 3.32Å |
| 82 | R | 60.3 | Low | 52.7 | Low | 101 Ų | 101 | 86.8 Ų | 86.8 | 38% | 0.381 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -79.5 | -39.4 | 177.5 | -60 | -177.1 | 86 | -173.2 | 5.9 | 111.3 | S79 G86 M165 | S79-R82 PolarHBondContact O-N 2.86Å; R82-G86 PolarHBondContact O-N 3.46Å; R82-M165 PolarHBondContact NH1-SD 3.46Å; R82-M165 PolarHBondContact NH2-SD 2.87Å |
| 83 | L | 56.1 | Low | 53.6 | Low | 58 Ų | 58 | 84.1 Ų | 84.1 | 30% | 0.304 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.6 | -42.3 | 171.8 | -152.4 | 84.9 | 0 | 0 | 0 | 110.1 | T74 S79 G86 T87 | T74-L83 HydrophobicContact CG2-CD1 4.29Å; S79-L83 WeakPolarHBondContact O-CB 3.22Å; S79-L83 PolarHBondContact O-N 3.47Å; L83-G86 PolarHBondContact O-N 3.34Å; L83-T87 WeakPolarHBondContact O-CB 3.31Å; L83-T87 PolarHBondContact O-N 2.88Å; L83-T87 PolarHBondContact O-OG1 3.45Å |
| 84 | G | 55.2 | Low | 53.7 | Low | 40 Ų | 40 | 84.7 Ų | 84.7 | 41% | 0.412 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.6 | -45.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | E80 T87 A88 | E80-G84 PolarHBondContact O-N 2.86Å; G84-T87 PolarHBondContact O-N 3.47Å; G84-A88 VanDerWaalsContact O-CB 3.26Å; G84-A88 WeakPolarHBondContact O-CB 3.38Å; G84-A88 PolarHBondContact O-N 3.4Å |
| 85 | A | 56.8 | Low | 54 | Low | 51 Ų | 51 | 84.1 Ų | 84.1 | 42% | 0.421 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.6 | -42.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | W81 A88 L89 | W81-A85 VanDerWaalsContact O-CB 3.26Å; W81-A85 WeakPolarHBondContact O-CB 3.2Å; W81-A85 PolarHBondContact O-N 3.32Å; A85-A88 PolarHBondContact O-N 2.92Å; A85-L89 WeakPolarHBondContact O-CB 3.4Å; A85-L89 WeakPolarHBondContact O-CD1 3.38Å; A85-L89 VanDerWaalsContact O-CG 3.26Å; A85-L89 WeakPolarHBondContact O-CG 3.39Å; A85-L89 PolarHBondContact O-N 3.35Å |
| 86 | G | 63.5 | Low | 55 | Low | 33 Ų | 33 | 80.9 Ų | 80.9 | 34% | 0.34 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -63.6 | -41.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | R82 L83 L89 C90 | R82-G86 PolarHBondContact O-N 3.46Å; L83-G86 PolarHBondContact O-N 3.34Å; G86-L89 PolarHBondContact O-N 3.18Å; G86-C90 WeakPolarHBondContact O-CB 3.21Å; G86-C90 PolarHBondContact O-N 3.02Å |
| 87 | T | 57.7 | Low | 55.8 | Low | 71 Ų | 71 | 79 Ų | 79 | 44% | 0.436 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -71.7 | -39 | 178.6 | -43.4 | 0 | 0 | 0 | 0 | 111.5 | L83 G84 C90 L91 | L83-T87 WeakPolarHBondContact O-CB 3.31Å; L83-T87 PolarHBondContact O-N 2.88Å; L83-T87 PolarHBondContact O-OG1 3.45Å; G84-T87 PolarHBondContact O-N 3.47Å; T87-C90 WeakPolarHBondContact O-CB 3.31Å; T87-C90 PolarHBondContact O-N 3.31Å; T87-L91 HydrophobicContact CG2-CD1 4.4Å; T87-L91 WeakPolarHBondContact O-CB 3.49Å; T87-L91 VanDerWaalsContact O-CG 3.29Å; T87-L91 WeakPolarHBondContact O-CG 3.36Å; T87-L91 PolarHBondContact O-N 3.03Å |
| 88 | A | 54 | Low | 56.2 | Low | 48 Ų | 48 | 77.2 Ų | 77.2 | 40% | 0.397 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -63 | -42.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | G84 A85 C90 L91 L92 | G84-A88 VanDerWaalsContact O-CB 3.26Å; G84-A88 WeakPolarHBondContact O-CB 3.38Å; G84-A88 PolarHBondContact O-N 3.4Å; A85-A88 PolarHBondContact O-N 2.92Å; A88-C90 VanDerWaalsContact C-N 3.34Å; A88-L91 PolarHBondContact O-N 3.47Å; A88-L92 WeakPolarHBondContact O-CB 3.15Å; A88-L92 VanDerWaalsContact O-CG 3.22Å; A88-L92 WeakPolarHBondContact O-CG 3.4Å; A88-L92 PolarHBondContact O-N 3.4Å |
| 89 | L | 55.2 | Low | 56.5 | Low | 95 Ų | 95 | 79.9 Ų | 79.9 | 50% | 0.497 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -66 | -36.4 | 175.1 | -72.6 | 166.2 | 0 | 0 | 0 | 112 | A85 G86 L92 A93 | A85-L89 WeakPolarHBondContact O-CB 3.4Å; A85-L89 WeakPolarHBondContact O-CD1 3.38Å; A85-L89 VanDerWaalsContact O-CG 3.26Å; A85-L89 WeakPolarHBondContact O-CG 3.39Å; A85-L89 PolarHBondContact O-N 3.35Å; G86-L89 PolarHBondContact O-N 3.18Å; L89-L92 PolarHBondContact O-N 2.84Å; L89-A93 WeakPolarHBondContact O-CB 3.3Å; L89-A93 PolarHBondContact O-N 2.97Å |
| 90 | C | 62 | Low | 56.6 | Low | 41 Ų | 41 | 81 Ų | 81 | 28% | 0.277 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.9 | -44.2 | 172.5 | -175.1 | 0 | 0 | 0 | 0 | 112.3 | C63 G86 T87 A88 L92 A93 L94 | C63-C90 PolarHBondContact SG-SG 3.05Å; G86-C90 WeakPolarHBondContact O-CB 3.21Å; G86-C90 PolarHBondContact O-N 3.02Å; T87-C90 WeakPolarHBondContact O-CB 3.31Å; T87-C90 PolarHBondContact O-N 3.31Å; A88-C90 VanDerWaalsContact C-N 3.34Å; C90-L92 VanDerWaalsContact C-N 3.34Å; C90-A93 PolarHBondContact O-N 2.84Å; C90-L94 WeakPolarHBondContact O-CB 3.3Å; C90-L94 WeakPolarHBondContact O-CG 3.38Å; C90-L94 PolarHBondContact O-N 3.31Å |
| 91 | L | 51.7 | Low | 56.4 | Low | 110 Ų | 110 | 79 Ų | 79 | 58% | 0.576 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.9 | -35.1 | 176.6 | -73.2 | 172.3 | 0 | 0 | 0 | 112 | T87 A88 L94 G95 | T87-L91 HydrophobicContact CG2-CD1 4.4Å; T87-L91 WeakPolarHBondContact O-CB 3.49Å; T87-L91 VanDerWaalsContact O-CG 3.29Å; T87-L91 WeakPolarHBondContact O-CG 3.36Å; T87-L91 PolarHBondContact O-N 3.03Å; A88-L91 PolarHBondContact O-N 3.47Å; L91-L94 PolarHBondContact O-N 3.25Å; L91-G95 PolarHBondContact O-N 2.93Å |
| 92 | L | 54.5 | Low | 56.6 | Low | 116 Ų | 116 | 75.7 Ų | 75.7 | 61% | 0.607 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -66.8 | -41.7 | 172.7 | -74.1 | 171.2 | 0 | 0 | 0 | 111.2 | A88 L89 C90 G95 V96 | A88-L92 WeakPolarHBondContact O-CB 3.15Å; A88-L92 VanDerWaalsContact O-CG 3.22Å; A88-L92 WeakPolarHBondContact O-CG 3.4Å; A88-L92 PolarHBondContact O-N 3.4Å; L89-L92 PolarHBondContact O-N 2.84Å; C90-L92 VanDerWaalsContact C-N 3.34Å; L92-G95 PolarHBondContact O-N 3.01Å; L92-V96 VanDerWaalsContact O-CG2 3.27Å; L92-V96 WeakPolarHBondContact O-CG2 3.23Å; L92-V96 PolarHBondContact O-N 3.47Å |
| 93 | A | 66.3 | Low | 56.5 | Low | 40 Ų | 40 | 73.2 Ų | 73.2 | 33% | 0.331 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | L89 C90 V96 L97 | L89-A93 WeakPolarHBondContact O-CB 3.3Å; L89-A93 PolarHBondContact O-N 2.97Å; C90-A93 PolarHBondContact O-N 2.84Å; A93-V96 PolarHBondContact O-N 3.49Å; A93-L97 VanDerWaalsContact O-CG 3.3Å; A93-L97 WeakPolarHBondContact O-CG 3.25Å; A93-L97 PolarHBondContact O-N 2.78Å |
| 94 | L | 54.8 | Low | 56.3 | Low | 80 Ų | 80 | 74.1 Ų | 74.1 | 42% | 0.419 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 173.6 | -78.4 | 160.9 | 0 | 0 | 0 | 112.2 | C90 L91 L97 L98 | C90-L94 WeakPolarHBondContact O-CB 3.3Å; C90-L94 WeakPolarHBondContact O-CG 3.38Å; C90-L94 PolarHBondContact O-N 3.31Å; L91-L94 PolarHBondContact O-N 3.25Å; L94-L97 PolarHBondContact O-N 3.45Å; L94-L98 WeakPolarHBondContact O-CD1 3.33Å; L94-L98 PolarHBondContact O-N 3.09Å |
| 95 | G | 53.6 | Low | 55.8 | Low | 38 Ų | 38 | 74.9 Ų | 74.9 | 39% | 0.392 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -65.2 | -38.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | L91 L92 K99 | L91-G95 PolarHBondContact O-N 2.93Å; L92-G95 PolarHBondContact O-N 3.01Å; G95-K99 WeakPolarHBondContact O-CB 3.32Å; G95-K99 PolarHBondContact O-N 3.44Å |
| 96 | V | 64.2 | Low | 55.1 | Low | 63 Ų | 63 | 76.9 Ų | 76.9 | 38% | 0.382 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -64.4 | -47 | 172.2 | 171.7 | 0 | 0 | 0 | 0 | 110 | L92 A93 L98 K99 Q100 | L92-V96 VanDerWaalsContact O-CG2 3.27Å; L92-V96 WeakPolarHBondContact O-CG2 3.23Å; L92-V96 PolarHBondContact O-N 3.47Å; A93-V96 PolarHBondContact O-N 3.49Å; V96-L98 PolarHBondContact O-N 3.08Å; V96-K99 PolarHBondContact O-N 3.44Å; V96-Q100 WeakPolarHBondContact O-CG 3.41Å; V96-Q100 PolarHBondContact O-N 3.15Å |
| 97 | L | 56.5 | Low | 54.1 | Low | 56 Ų | 56 | 81 Ų | 81 | 29% | 0.293 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -58.7 | -44.6 | 176.3 | -71.3 | 168.7 | 0 | 0 | 0 | 112.3 | A93 L94 K99 Q100 L101 | A93-L97 VanDerWaalsContact O-CG 3.3Å; A93-L97 WeakPolarHBondContact O-CG 3.25Å; A93-L97 PolarHBondContact O-N 2.78Å; L94-L97 PolarHBondContact O-N 3.45Å; L97-K99 VanDerWaalsContact C-N 3.34Å; L97-K99 PolarHBondContact O-N 3.01Å; L97-Q100 WeakPolarHBondContact O-CB 3.29Å; L97-Q100 PolarHBondContact O-N 2.91Å; L97-L101 WeakPolarHBondContact O-CG 3.37Å; L97-L101 PolarHBondContact O-N 2.92Å; L97-L101 VanDerWaalsContact O-N 3.1Å |
| 98 | L | 55.9 | Low | 53.5 | Low | 103 Ų | 103 | 83.3 Ų | 83.3 | 54% | 0.539 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 175.2 | -100.7 | 73.3 | 0 | 0 | 0 | 111.9 | L94 V96 Q100 L101 L102 | L94-L98 WeakPolarHBondContact O-CD1 3.33Å; L94-L98 PolarHBondContact O-N 3.09Å; V96-L98 PolarHBondContact O-N 3.08Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; L98-Q100 PolarHBondContact O-N 2.89Å; L98-L101 PolarHBondContact O-N 3.43Å; L98-L102 WeakPolarHBondContact O-CB 3.22Å; L98-L102 VanDerWaalsContact O-CG 3.3Å; L98-L102 WeakPolarHBondContact O-CG 3.46Å; L98-L102 PolarHBondContact O-N 3.03Å |
| 99 | K | 51.8 | Low | 52.7 | Low | 153 Ų | 153 | 88.9 Ų | 88.9 | 67% | 0.665 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -64.6 | -33.8 | 177.1 | -165.5 | -172.9 | 171.8 | 76.9 | 0 | 111.5 | G95 V96 L97 S103 | G95-K99 WeakPolarHBondContact O-CB 3.32Å; G95-K99 PolarHBondContact O-N 3.44Å; V96-K99 PolarHBondContact O-N 3.44Å; L97-K99 VanDerWaalsContact C-N 3.34Å; L97-K99 PolarHBondContact O-N 3.01Å; K99-S103 VanDerWaalsContact O-CB 3.24Å; K99-S103 WeakPolarHBondContact O-CB 3.13Å; K99-S103 PolarHBondContact O-N 3.35Å |
| 100 | Q | 56.1 | Low | 52.2 | Low | 57 Ų | 57 | 89.7 Ų | 89.7 | 27% | 0.266 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.1 | -46.3 | 173.6 | -63.2 | -55.5 | -19 | 0 | 0 | 111.9 | V96 L97 L98 L102 S103 S104 V131 | V96-Q100 WeakPolarHBondContact O-CG 3.41Å; V96-Q100 PolarHBondContact O-N 3.15Å; L97-Q100 WeakPolarHBondContact O-CB 3.29Å; L97-Q100 PolarHBondContact O-N 2.91Å; L98-Q100 VanDerWaalsContact C-N 3.28Å; L98-Q100 PolarHBondContact O-N 2.89Å; Q100-L102 VanDerWaalsContact C-N 3.34Å; Q100-L102 PolarHBondContact O-N 3.42Å; Q100-S103 PolarHBondContact O-N 2.91Å; Q100-S104 WeakPolarHBondContact O-CB 3.26Å; Q100-S104 PolarHBondContact O-N 3.29Å; Q100-V131 HydrophobicContact CG-CG1 3.77Å |
| 101 | L | 51.3 | Low | 51.4 | Low | 123 Ų | 123 | 91.2 Ų | 91.2 | 64% | 0.644 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.2 | -41.7 | 178.8 | -66 | 173.3 | 0 | 0 | 0 | 111.5 | L97 L98 S104 A105 | L97-L101 WeakPolarHBondContact O-CG 3.37Å; L97-L101 PolarHBondContact O-N 2.92Å; L97-L101 VanDerWaalsContact O-N 3.1Å; L98-L101 PolarHBondContact O-N 3.43Å; L101-S104 PolarHBondContact O-N 2.96Å; L101-A105 WeakPolarHBondContact O-CB 3.27Å; L101-A105 PolarHBondContact O-N 3.43Å |
| 102 | L | 52.1 | Low | 51 | Low | 113 Ų | 113 | 91.6 Ų | 91.6 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -69.4 | -39.1 | 177.1 | -69 | 168.9 | 0 | 0 | 0 | 112.3 | L98 Q100 S104 A105 V106 | L98-L102 WeakPolarHBondContact O-CB 3.22Å; L98-L102 VanDerWaalsContact O-CG 3.3Å; L98-L102 WeakPolarHBondContact O-CG 3.46Å; L98-L102 PolarHBondContact O-N 3.03Å; Q100-L102 VanDerWaalsContact C-N 3.34Å; Q100-L102 PolarHBondContact O-N 3.42Å; L102-S104 VanDerWaalsContact C-N 3.33Å; L102-A105 PolarHBondContact O-N 3.09Å; L102-V106 WeakPolarHBondContact O-CB 3.14Å; L102-V106 WeakPolarHBondContact O-CG2 3.27Å; L102-V106 PolarHBondContact O-N 3.5Å |
| 103 | S | 57.4 | Low | 50.5 | Low | 48 Ų | 48 | 96.7 Ų | 96.7 | 34% | 0.336 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.7 | -35.9 | 175.4 | -170.6 | 0 | 0 | 0 | 0 | 111.6 | K99 Q100 Q107 | K99-S103 VanDerWaalsContact O-CB 3.24Å; K99-S103 WeakPolarHBondContact O-CB 3.13Å; K99-S103 PolarHBondContact O-N 3.35Å; Q100-S103 PolarHBondContact O-N 2.91Å; S103-Q107 WeakPolarHBondContact O-CB 3.44Å; S103-Q107 WeakPolarHBondContact O-CG 3.2Å; S103-Q107 PolarHBondContact O-N 3Å; S103-Q107 PolarHBondContact OG-NE2 2.8Å |
| 104 | S | 50.7 | Low | 49.4 | Very low | 77 Ų | 77 | 97.4 Ų | 97.4 | 54% | 0.538 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -66.8 | -44.6 | 173.9 | -168.8 | 0 | 0 | 0 | 0 | 111.3 | Q100 L101 L102 Q107 D108 | Q100-S104 WeakPolarHBondContact O-CB 3.26Å; Q100-S104 PolarHBondContact O-N 3.29Å; L101-S104 PolarHBondContact O-N 2.96Å; L102-S104 VanDerWaalsContact C-N 3.33Å; S104-Q107 PolarHBondContact O-N 3.21Å; S104-D108 VanDerWaalsContact O-CB 3.3Å; S104-D108 WeakPolarHBondContact O-CB 3.33Å; S104-D108 PolarHBondContact O-N 3.37Å |
| 105 | A | 45.8 | Very low | 49 | Very low | 57 Ų | 57 | 104.4 Ų | 104.4 | 47% | 0.471 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -67.6 | -37.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.9 | L101 L102 D108 M109 | L101-A105 WeakPolarHBondContact O-CB 3.27Å; L101-A105 PolarHBondContact O-N 3.43Å; L102-A105 PolarHBondContact O-N 3.09Å; A105-D108 PolarHBondContact O-N 2.94Å; A105-M109 PolarHBondContact O-N 3.08Å |
| 106 | V | 42.7 | Very low | 48.5 | Very low | 93 Ų | 93 | 111.3 Ų | 111.3 | 56% | 0.564 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -73.7 | -34.4 | 176.8 | 171.6 | 0 | 0 | 0 | 0 | 111.5 | L102 M109 N110 | L102-V106 WeakPolarHBondContact O-CB 3.14Å; L102-V106 WeakPolarHBondContact O-CG2 3.27Å; L102-V106 PolarHBondContact O-N 3.5Å; V106-M109 PolarHBondContact O-N 3.43Å; V106-N110 PolarHBondContact O-N 3.18Å |
| 107 | Q | 42.1 | Very low | 47.5 | Very low | 120 Ų | 120 | 113.6 Ų | 113.6 | 56% | 0.561 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.9 | -35.8 | 173.1 | -76 | 172 | 9.4 | 0 | 0 | 111.7 | S103 S104 M109 N110 C111 | S103-Q107 WeakPolarHBondContact O-CB 3.44Å; S103-Q107 WeakPolarHBondContact O-CG 3.2Å; S103-Q107 PolarHBondContact O-N 3Å; S103-Q107 PolarHBondContact OG-NE2 2.8Å; S104-Q107 PolarHBondContact O-N 3.21Å; Q107-M109 VanDerWaalsContact C-N 3.26Å; Q107-M109 PolarHBondContact O-N 2.84Å; Q107-N110 PolarHBondContact O-N 3.42Å; Q107-N110 VanDerWaalsContact O-N 3.15Å; Q107-C111 VanDerWaalsContact O-CB 3.27Å; Q107-C111 WeakPolarHBondContact O-CB 3.49Å; Q107-C111 PolarHBondContact O-N 2.84Å |
| 108 | D | 45 | Very low | 46.7 | Very low | 118 Ų | 118 | 116.8 Ų | 116.8 | 63% | 0.631 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -63 | -33 | 174.1 | -160.6 | 38.5 | 0 | 0 | 0 | 112.1 | S104 A105 | S104-D108 VanDerWaalsContact O-CB 3.3Å; S104-D108 WeakPolarHBondContact O-CB 3.33Å; S104-D108 PolarHBondContact O-N 3.37Å; A105-D108 PolarHBondContact O-N 2.94Å |
| 109 | M | 37.3 | Very low | 46.1 | Very low | 166 Ų | 166 | 119.2 Ų | 119.2 | 82% | 0.818 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -74.8 | -27.4 | 174.3 | -149.3 | 98.8 | 154 | 0 | 0 | 113.8 | A105 V106 Q107 | A105-M109 PolarHBondContact O-N 3.08Å; V106-M109 PolarHBondContact O-N 3.43Å; Q107-M109 VanDerWaalsContact C-N 3.26Å; Q107-M109 PolarHBondContact O-N 2.84Å |
| 110 | N | 45 | Very low | 45.5 | Very low | 111 Ų | 111 | 118.5 Ų | 118.5 | 59% | 0.594 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -101.6 | -14.3 | -174.2 | -117.4 | -18.7 | 0 | 0 | 0 | 114 | V106 Q107 V112 R113 | V106-N110 PolarHBondContact O-N 3.18Å; Q107-N110 PolarHBondContact O-N 3.42Å; Q107-N110 VanDerWaalsContact O-N 3.15Å; N110-V112 PolarHBondContact O-N 3.46Å; N110-R113 PolarHBondContact O-N 2.86Å |
| 111 | C | 43.5 | Very low | 44.8 | Very low | 73 Ų | 73 | 120.4 Ų | 120.4 | 49% | 0.493 | 62% | 0.622 | S | S | . | * | G | 310 helix | trans | -75 | -21.9 | -177.2 | -156 | 0 | 0 | 0 | 0 | 113.5 | Q107 R113 | Q107-C111 VanDerWaalsContact O-CB 3.27Å; Q107-C111 WeakPolarHBondContact O-CB 3.49Å; Q107-C111 PolarHBondContact O-N 2.84Å; C111-R113 PolarHBondContact O-N 2.84Å |
| 112 | V | 44.3 | Very low | 44.3 | Very low | 118 Ų | 118 | 122.7 Ų | 122.7 | 72% | 0.715 | 63% | 0.626 | S | S | * | * | G | 310 helix | trans | -65.4 | -21.7 | 174.6 | 161.8 | 0 | 0 | 0 | 0 | 112.7 | N110 | N110-V112 PolarHBondContact O-N 3.46Š|
| 113 | R | 44.4 | Very low | 43.9 | Very low | 223 Ų | 223 | 120.6 Ų | 120.6 | 84% | 0.842 | 62% | 0.621 | S | S | * | * | G | 310 helix | trans | -91.9 | -12.4 | -173.1 | -170.5 | 153.4 | -78.4 | 163.8 | -2.7 | 115.3 | N110 C111 | N110-R113 PolarHBondContact O-N 2.86Å; C111-R113 PolarHBondContact O-N 2.84Å |
| 114 | S | 43 | Very low | 43.3 | Very low | 56 Ų | 56 | 120.2 Ų | 120.2 | 39% | 0.392 | 63% | 0.625 | S | S | . | * | trans | -139.2 | 73.3 | -172.9 | -174.1 | 0 | 0 | 0 | 0 | 113.4 | H116 | S114-H116 PolarHBondContact O-N 3.36Š| ||
| 115 | R | 46 | Very low | 43.1 | Very low | 227 Ų | 227 | 118.6 Ų | 118.6 | 86% | 0.857 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.9 | 5.7 | 167 | -91.7 | -172.2 | 178.8 | 174.2 | 1.4 | 114.4 | I118 | R115-I118 WeakPolarHBondContact O-CD1 3.31Å; R115-I118 WeakPolarHBondContact O-CG1 3.45Å |
| 116 | H | 42.8 | Very low | 43.4 | Very low | 182 Ų | 182 | 121 Ų | 121 | 84% | 0.843 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -106.7 | -3.2 | -173.9 | -156.6 | 48.3 | 0 | 0 | 0 | 115 | S114 | S114-H116 PolarHBondContact O-N 3.36Š|
| 117 | Q | 43 | Very low | 44 | Very low | 111 Ų | 111 | 119.3 Ų | 119.3 | 52% | 0.519 | 62% | 0.617 | S | S | . | * | trans | -107.5 | 33.3 | 175.3 | -75.2 | -172.4 | 0.4 | 0 | 0 | 113.5 | D119 M120 | Q117-D119 PolarHBondContact O-N 2.96Å; Q117-D119 VanDerWaalsContact O-N 3.1Å; Q117-M120 PolarHBondContact O-N 3.33Å | ||
| 118 | I | 41.1 | Very low | 44.9 | Very low | 124 Ų | 124 | 116.9 Ų | 116.9 | 64% | 0.636 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.1 | -13 | -172.5 | -60.2 | 177.2 | 0 | 0 | 0 | 113.1 | R115 | R115-I118 WeakPolarHBondContact O-CD1 3.31Å; R115-I118 WeakPolarHBondContact O-CG1 3.45Å |
| 119 | D | 43.3 | Very low | 45.5 | Very low | 154 Ų | 154 | 112.4 Ų | 112.4 | 82% | 0.824 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87 | -12.7 | 171.9 | -97.7 | -28.7 | 0 | 0 | 0 | 114.9 | Q117 | Q117-D119 PolarHBondContact O-N 2.96Å; Q117-D119 VanDerWaalsContact O-N 3.1Å |
| 120 | M | 38.8 | Very low | 46.4 | Very low | 137 Ų | 137 | 108.6 Ų | 108.6 | 68% | 0.675 | 57% | 0.567 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95 | -8.7 | 179 | -145.3 | 166.5 | 67.8 | 0 | 0 | 113.1 | Q117 | Q117-M120 PolarHBondContact O-N 3.33Š|
| 121 | L | 41.3 | Very low | 47.2 | Very low | 98 Ų | 98 | 104.2 Ų | 104.2 | 51% | 0.513 | 55% | 0.545 | S | S | . | . | trans | -105.2 | 8.8 | 179.1 | -77.4 | 162.5 | 0 | 0 | 0 | 114.3 | S123 G124 | L121-S123 PolarHBondContact O-N 2.86Å; L121-S123 VanDerWaalsContact O-N 3.08Å; L121-G124 PolarHBondContact O-N 3.38Å; L121-G124 VanDerWaalsContact O-N 3.09Å | ||
| 122 | K | 41.3 | Very low | 48.2 | Very low | 170 Ų | 170 | 102.2 Ų | 102.2 | 74% | 0.739 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -6.5 | 158 | -165.4 | 171.6 | 173.3 | -178.4 | 0 | 112.2 | ||
| 123 | S | 43.1 | Very low | 49 | Very low | 69 Ų | 69 | 99.5 Ų | 99.5 | 48% | 0.483 | 51% | 0.511 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.2 | 4.8 | 173.2 | -167.4 | 0 | 0 | 0 | 0 | 114.7 | L121 S127 | L121-S123 PolarHBondContact O-N 2.86Å; L121-S123 VanDerWaalsContact O-N 3.08Å; S123-S127 PolarHBondContact O-N 2.9Å; S123-S127 VanDerWaalsContact O-N 3.15Å |
| 124 | G | 43.7 | Very low | 49.8 | Very low | 40 Ų | 40 | 93.3 Ų | 93.3 | 41% | 0.412 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -69 | -46.2 | -179 | 0 | 0 | 0 | 0 | 0 | 113.9 | L121 L126 S127 | L121-G124 PolarHBondContact O-N 3.38Å; L121-G124 VanDerWaalsContact O-N 3.09Å; G124-L126 VanDerWaalsContact C-N 3.3Å; G124-L126 PolarHBondContact O-N 3.38Å; G124-S127 PolarHBondContact O-N 3.46Å |
| 125 | G | 48.1 | Very low | 50.8 | Low | 43 Ų | 43 | 91.9 Ų | 91.9 | 44% | 0.443 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -75.7 | -17.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | V129 | G125-V129 WeakPolarHBondContact O-CG2 3.21Å; G125-V129 PolarHBondContact O-N 3.24Å |
| 126 | L | 52.3 | Low | 51.5 | Low | 107 Ų | 107 | 81.2 Ų | 81.2 | 56% | 0.56 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -81.8 | -29.1 | 176.4 | -149.8 | 138.9 | 0 | 0 | 0 | 110.8 | G124 L130 | G124-L126 VanDerWaalsContact C-N 3.3Å; G124-L126 PolarHBondContact O-N 3.38Å; L126-L130 WeakPolarHBondContact O-CB 3.38Å; L126-L130 PolarHBondContact O-N 3.26Å |
| 127 | S | 55.1 | Low | 52.2 | Low | 58 Ų | 58 | 76.4 Ų | 76.4 | 41% | 0.406 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.4 | -48.9 | 175 | -170.6 | 0 | 0 | 0 | 0 | 111.7 | S123 G124 V129 L130 V131 | S123-S127 PolarHBondContact O-N 2.9Å; S123-S127 VanDerWaalsContact O-N 3.15Å; G124-S127 PolarHBondContact O-N 3.46Å; S127-V129 PolarHBondContact O-N 2.98Å; S127-L130 PolarHBondContact O-N 3.46Å; S127-V131 WeakPolarHBondContact O-CB 3.25Å; S127-V131 WeakPolarHBondContact O-CG2 3.39Å; S127-V131 PolarHBondContact O-N 3.47Å |
| 128 | D | 60.3 | Low | 52.9 | Low | 69 Ų | 69 | 74.3 Ų | 74.3 | 37% | 0.369 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -61.4 | -44.3 | 177.1 | -172 | 46.2 | 0 | 0 | 0 | 111.7 | L130 V131 V132 | D128-L130 PolarHBondContact O-N 3.15Å; D128-V131 PolarHBondContact O-N 2.92Å; D128-V132 WeakPolarHBondContact O-CG2 3.18Å; D128-V132 PolarHBondContact O-N 2.97Å |
| 129 | V | 57.1 | Low | 53.9 | Low | 25 Ų | 25 | 71.1 Ų | 71.1 | 15% | 0.152 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -60.3 | -44 | 173.7 | 164.2 | 0 | 0 | 0 | 0 | 112.7 | G125 S127 V131 V132 L133 V183 Y186 T187 | G125-V129 WeakPolarHBondContact O-CG2 3.21Å; G125-V129 PolarHBondContact O-N 3.24Å; S127-V129 PolarHBondContact O-N 2.98Å; V129-V131 VanDerWaalsContact C-N 3.27Å; V129-V131 PolarHBondContact O-N 3.39Å; V129-V132 PolarHBondContact O-N 3.5Å; V129-L133 WeakPolarHBondContact O-CB 3.47Å; V129-L133 PolarHBondContact O-N 2.92Å; V129-V183 HydrophobicContact CG1-CG1 3.86Å; V129-Y186 HydrophobicContact CG2-CD1 4.29Å; V129-Y186 HydrophobicContact CG2-CE1 4.02Å; V129-T187 HydrophobicContact CG1-CG2 3.32Å |
| 130 | L | 57.6 | Low | 54.7 | Low | 86 Ų | 86 | 65.7 Ų | 65.7 | 45% | 0.45 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -63.9 | -38.1 | 179.8 | -172.1 | 74.2 | 0 | 0 | 0 | 110.3 | L126 S127 D128 L133 I134 | L126-L130 WeakPolarHBondContact O-CB 3.38Å; L126-L130 PolarHBondContact O-N 3.26Å; S127-L130 PolarHBondContact O-N 3.46Å; D128-L130 PolarHBondContact O-N 3.15Å; L130-L133 WeakPolarHBondContact O-CB 3.47Å; L130-L133 PolarHBondContact O-N 3.42Å; L130-I134 HydrophobicContact CD2-CD1 4.49Å; L130-I134 HydrophobicContact CG-CD1 4.02Å; L130-I134 WeakPolarHBondContact O-CB 3.48Å; L130-I134 WeakPolarHBondContact O-CD1 3.37Å; L130-I134 WeakPolarHBondContact O-CG1 3.12Å; L130-I134 PolarHBondContact O-N 2.83Å |
| 131 | V | 61.3 | Low | 55.8 | Low | 19 Ų | 19 | 64.2 Ų | 64.2 | 12% | 0.115 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -67.8 | -46.6 | 177.7 | 170 | 0 | 0 | 0 | 0 | 111.2 | Q100 S127 D128 V129 L133 I134 T135 | Q100-V131 HydrophobicContact CG-CG1 3.77Å; S127-V131 WeakPolarHBondContact O-CB 3.25Å; S127-V131 WeakPolarHBondContact O-CG2 3.39Å; S127-V131 PolarHBondContact O-N 3.47Å; D128-V131 PolarHBondContact O-N 2.92Å; V129-V131 VanDerWaalsContact C-N 3.27Å; V129-V131 PolarHBondContact O-N 3.39Å; V131-L133 VanDerWaalsContact C-N 3.25Å; V131-L133 PolarHBondContact O-N 2.87Å; V131-I134 PolarHBondContact O-N 2.86Å; V131-T135 PolarHBondContact O-N 2.87Å; V131-T135 PolarHBondContact O-OG1 3.48Å |
| 132 | V | 64.1 | Low | 56.7 | Low | 31 Ų | 31 | 61.3 Ų | 61.3 | 19% | 0.188 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -61.6 | -37.9 | 175 | -179.7 | 0 | 0 | 0 | 0 | 110.7 | V55 D128 V129 T135 G136 V183 | V55-V132 HydrophobicContact CG1-CG1 4.1Å; V55-V132 HydrophobicContact CG1-CG2 4.32Å; D128-V132 WeakPolarHBondContact O-CG2 3.18Å; D128-V132 PolarHBondContact O-N 2.97Å; V129-V132 PolarHBondContact O-N 3.5Å; V132-T135 PolarHBondContact O-N 3.25Å; V132-G136 PolarHBondContact O-N 2.85Å; V132-V183 HydrophobicContact CB-CG2 4.31Å; V132-V183 HydrophobicContact CG1-CG2 3.57Å |
| 133 | L | 61.5 | Low | 57.7 | Low | 61 Ų | 61 | 53.2 Ų | 53.2 | 32% | 0.319 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.8 | -46.2 | 175.3 | -162.7 | 98.4 | 0 | 0 | 0 | 111.7 | V129 L130 V131 T135 G136 M137 V183 | V129-L133 WeakPolarHBondContact O-CB 3.47Å; V129-L133 PolarHBondContact O-N 2.92Å; L130-L133 WeakPolarHBondContact O-CB 3.47Å; L130-L133 PolarHBondContact O-N 3.42Å; V131-L133 VanDerWaalsContact C-N 3.25Å; V131-L133 PolarHBondContact O-N 2.87Å; L133-T135 VanDerWaalsContact C-N 3.34Å; L133-T135 PolarHBondContact O-N 3.31Å; L133-G136 PolarHBondContact O-N 3.31Å; L133-M137 WeakPolarHBondContact O-CB 3.49Å; L133-M137 VanDerWaalsContact O-CG 3.25Å; L133-M137 WeakPolarHBondContact O-CG 3.27Å; L133-M137 PolarHBondContact O-N 2.89Å; L133-V183 HydrophobicContact CD1-CG1 3.96Å |
| 134 | I | 60.8 | Low | 58.4 | Low | 93 Ų | 93 | 51.2 Ų | 51.2 | 48% | 0.477 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.3 | -42.9 | 177.9 | -70.7 | 164.3 | 0 | 0 | 0 | 110.6 | L130 V131 M137 S138 | L130-I134 HydrophobicContact CD2-CD1 4.49Å; L130-I134 HydrophobicContact CG-CD1 4.02Å; L130-I134 WeakPolarHBondContact O-CB 3.48Å; L130-I134 WeakPolarHBondContact O-CD1 3.37Å; L130-I134 WeakPolarHBondContact O-CG1 3.12Å; L130-I134 PolarHBondContact O-N 2.83Å; V131-I134 PolarHBondContact O-N 2.86Å; I134-M137 PolarHBondContact O-N 2.9Å; I134-S138 WeakPolarHBondContact O-CB 3.38Å; I134-S138 PolarHBondContact O-N 2.85Å; I134-S138 PolarHBondContact O-OG 3.5Å |
| 135 | T | 65.1 | Low | 59.2 | Low | 25 Ų | 25 | 53.2 Ų | 53.2 | 15% | 0.153 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -65.3 | -44.2 | 176.5 | -61.2 | 0 | 0 | 0 | 0 | 111.4 | V131 V132 L133 M137 S138 L139 | V131-T135 PolarHBondContact O-N 2.87Å; V131-T135 PolarHBondContact O-OG1 3.48Å; V132-T135 PolarHBondContact O-N 3.25Å; L133-T135 VanDerWaalsContact C-N 3.34Å; L133-T135 PolarHBondContact O-N 3.31Å; T135-M137 PolarHBondContact O-N 3.45Å; T135-S138 PolarHBondContact O-N 3.39Å; T135-L139 HydrophobicContact CG2-CD1 4.2Å; T135-L139 WeakPolarHBondContact O-CG 3.42Å; T135-L139 PolarHBondContact O-N 2.86Å |
| 136 | G | 60.4 | Low | 59.6 | Low | 3 Ų | 3 | 53.5 Ų | 53.5 | 3% | 0.031 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.9 | -41.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | V132 L133 L139 L140 | V132-G136 PolarHBondContact O-N 2.85Å; L133-G136 PolarHBondContact O-N 3.31Å; G136-L139 PolarHBondContact O-N 3.45Å; G136-L140 WeakPolarHBondContact O-CG 3.36Å; G136-L140 PolarHBondContact O-N 2.84Å |
| 137 | M | 56.7 | Low | 60.1 | Low | 82 Ų | 82 | 50 Ų | 50 | 40% | 0.404 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -65.6 | -39.6 | 175 | -73.5 | -61.8 | -64.8 | 0 | 0 | 112 | L133 I134 T135 L139 L140 I141 V180 | L133-M137 WeakPolarHBondContact O-CB 3.49Å; L133-M137 VanDerWaalsContact O-CG 3.25Å; L133-M137 WeakPolarHBondContact O-CG 3.27Å; L133-M137 PolarHBondContact O-N 2.89Å; I134-M137 PolarHBondContact O-N 2.9Å; T135-M137 PolarHBondContact O-N 3.45Å; M137-L139 VanDerWaalsContact C-N 3.34Å; M137-L139 PolarHBondContact O-N 3.35Å; M137-L140 PolarHBondContact O-N 3.47Å; M137-L140 HydrophobicContact SD-CD1 4.26Å; M137-I141 WeakPolarHBondContact O-CB 3.26Å; M137-I141 WeakPolarHBondContact O-CD1 3.35Å; M137-I141 WeakPolarHBondContact O-CG1 3.19Å; M137-I141 PolarHBondContact O-N 3.39Å; M137-V180 HydrophobicContact SD-CG1 4.41Å; M137-V180 HydrophobicContact SD-CG2 4.38Å |
| 138 | S | 59 | Low | 60.3 | Low | 67 Ų | 67 | 53.1 Ų | 53.1 | 47% | 0.469 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -64.1 | -40 | 176.4 | -58.1 | 0 | 0 | 0 | 0 | 111.6 | I134 T135 C142 | I134-S138 WeakPolarHBondContact O-CB 3.38Å; I134-S138 PolarHBondContact O-N 2.85Å; I134-S138 PolarHBondContact O-OG 3.5Å; T135-S138 PolarHBondContact O-N 3.39Å; S138-C142 VanDerWaalsContact O-CB 3.25Å; S138-C142 WeakPolarHBondContact O-CB 3.45Å; S138-C142 PolarHBondContact O-N 3.17Å |
| 139 | L | 60.3 | Low | 60.3 | Low | 56 Ų | 56 | 52.9 Ų | 52.9 | 29% | 0.293 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 173.4 | -76.1 | 160.1 | 0 | 0 | 0 | 112.2 | L59 T135 G136 M137 C142 G143 L172 | L59-L139 HydrophobicContact CD2-CD1 4.27Å; T135-L139 HydrophobicContact CG2-CD1 4.2Å; T135-L139 WeakPolarHBondContact O-CG 3.42Å; T135-L139 PolarHBondContact O-N 2.86Å; G136-L139 PolarHBondContact O-N 3.45Å; M137-L139 VanDerWaalsContact C-N 3.34Å; M137-L139 PolarHBondContact O-N 3.35Å; L139-C142 PolarHBondContact O-N 2.93Å; L139-G143 PolarHBondContact O-N 3.26Å; L139-L172 HydrophobicContact CD2-CG 4.39Å |
| 140 | L | 60.2 | Low | 60.3 | Low | 40 Ų | 40 | 52 Ų | 52 | 21% | 0.209 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.5 | -45.3 | 175.9 | -79.9 | 177.5 | 0 | 0 | 0 | 112.5 | G136 M137 C142 G143 G144 L173 V180 | G136-L140 WeakPolarHBondContact O-CG 3.36Å; G136-L140 PolarHBondContact O-N 2.84Å; M137-L140 PolarHBondContact O-N 3.47Å; M137-L140 HydrophobicContact SD-CD1 4.26Å; L140-C142 VanDerWaalsContact C-N 3.32Å; L140-G143 PolarHBondContact O-N 3.49Å; L140-G144 PolarHBondContact O-N 3.25Å; L140-L173 HydrophobicContact CD2-CD2 3.98Å; L140-L173 HydrophobicContact CD2-CG 4.23Å; L140-L173 WeakPolarHBondContact CD2-O 3.48Å; L140-V180 HydrophobicContact CD1-CB 4.16Å; L140-V180 HydrophobicContact CD1-CG2 3.74Å; L140-V180 HydrophobicContact CG-CG2 4.5Å |
| 141 | I | 61.9 | Low | 60.6 | Low | 106 Ų | 106 | 52.4 Ų | 52.4 | 54% | 0.544 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.7 | -42.6 | 177.7 | -66.6 | 164.3 | 0 | 0 | 0 | 109.5 | M137 G144 V145 | M137-I141 WeakPolarHBondContact O-CB 3.26Å; M137-I141 WeakPolarHBondContact O-CD1 3.35Å; M137-I141 WeakPolarHBondContact O-CG1 3.19Å; M137-I141 PolarHBondContact O-N 3.39Å; I141-G144 PolarHBondContact O-N 3.4Å; I141-V145 HydrophobicContact CG2-CG2 4.45Å; I141-V145 WeakPolarHBondContact O-CB 3.07Å; I141-V145 VanDerWaalsContact O-CG2 3.23Å; I141-V145 WeakPolarHBondContact O-CG2 3.33Å; I141-V145 PolarHBondContact O-N 2.94Å |
| 142 | C | 61.7 | Low | 60.4 | Low | 38 Ų | 38 | 55.8 Ų | 55.8 | 26% | 0.257 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -63.2 | -48.8 | 176.7 | -173.6 | 0 | 0 | 0 | 0 | 112.3 | S138 L139 L140 G144 V145 L146 L172 | S138-C142 VanDerWaalsContact O-CB 3.25Å; S138-C142 WeakPolarHBondContact O-CB 3.45Å; S138-C142 PolarHBondContact O-N 3.17Å; L139-C142 PolarHBondContact O-N 2.93Å; L140-C142 VanDerWaalsContact C-N 3.32Å; C142-G144 VanDerWaalsContact C-N 3.34Å; C142-G144 PolarHBondContact O-N 2.91Å; C142-V145 PolarHBondContact O-N 3.48Å; C142-L146 WeakPolarHBondContact O-CG 3.06Å; C142-L146 PolarHBondContact O-N 3.04Å; C142-L172 HydrophobicContact CB-CD2 4.41Å |
| 143 | G | 60.7 | Low | 60 | Low | 0 Ų | 0 | 60.2 Ų | 60.2 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -61.6 | -40.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L139 L140 L146 L147 | L139-G143 PolarHBondContact O-N 3.26Å; L140-G143 PolarHBondContact O-N 3.49Å; G143-L146 PolarHBondContact O-N 2.81Å; G143-L147 VanDerWaalsContact O-CB 3.3Å; G143-L147 WeakPolarHBondContact O-CB 3.43Å; G143-L147 PolarHBondContact O-N 3.11Å |
| 144 | G | 57.5 | Low | 59.5 | Low | 27 Ų | 27 | 64 Ų | 64 | 28% | 0.278 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.6 | -41.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | L140 I141 C142 L147 H148 | L140-G144 PolarHBondContact O-N 3.25Å; I141-G144 PolarHBondContact O-N 3.4Å; C142-G144 VanDerWaalsContact C-N 3.34Å; C142-G144 PolarHBondContact O-N 2.91Å; G144-L147 PolarHBondContact O-N 2.79Å; G144-H148 VanDerWaalsContact O-CB 3.28Å; G144-H148 WeakPolarHBondContact O-CB 3.34Å; G144-H148 PolarHBondContact O-N 2.89Å |
| 145 | V | 60.8 | Low | 58.5 | Low | 81 Ų | 81 | 67.7 Ų | 67.7 | 49% | 0.491 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -65.6 | -42.3 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 111.1 | I141 C142 L147 H148 L149 | I141-V145 HydrophobicContact CG2-CG2 4.45Å; I141-V145 WeakPolarHBondContact O-CB 3.07Å; I141-V145 VanDerWaalsContact O-CG2 3.23Å; I141-V145 WeakPolarHBondContact O-CG2 3.33Å; I141-V145 PolarHBondContact O-N 2.94Å; C142-V145 PolarHBondContact O-N 3.48Å; V145-L147 VanDerWaalsContact C-N 3.35Å; V145-H148 PolarHBondContact O-N 3.41Å; V145-L149 HydrophobicContact CG1-CD1 3.82Å; V145-L149 WeakPolarHBondContact O-CB 3.32Å; V145-L149 WeakPolarHBondContact O-CD1 3.37Å; V145-L149 VanDerWaalsContact O-CG 3.28Å; V145-L149 WeakPolarHBondContact O-CG 3.26Å; V145-L149 PolarHBondContact O-N 2.82Å |
| 146 | L | 58.2 | Low | 57.6 | Low | 49 Ų | 49 | 71.9 Ų | 71.9 | 26% | 0.257 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -63 | -41.1 | 175 | -72.2 | 171.8 | 0 | 0 | 0 | 112 | C142 G143 L149 A150 | C142-L146 WeakPolarHBondContact O-CG 3.06Å; C142-L146 PolarHBondContact O-N 3.04Å; G143-L146 PolarHBondContact O-N 2.81Å; L146-L149 PolarHBondContact O-N 3.45Å; L146-A150 WeakPolarHBondContact O-CB 3.3Å; L146-A150 PolarHBondContact O-N 3.37Å |
| 147 | L | 61.4 | Low | 57 | Low | 34 Ų | 34 | 81.4 Ų | 81.4 | 18% | 0.178 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -67.3 | -42.5 | 176.9 | -166.9 | 71.1 | 0 | 0 | 0 | 111.7 | G143 G144 V145 A150 L151 Y166 V170 L173 | G143-L147 VanDerWaalsContact O-CB 3.3Å; G143-L147 WeakPolarHBondContact O-CB 3.43Å; G143-L147 PolarHBondContact O-N 3.11Å; G144-L147 PolarHBondContact O-N 2.79Å; V145-L147 VanDerWaalsContact C-N 3.35Å; L147-A150 WeakPolarHBondContact O-CB 3.21Å; L147-A150 PolarHBondContact O-N 3.27Å; L147-L151 HydrophobicContact CG-CD1 4.21Å; L147-L151 WeakPolarHBondContact O-CB 3.47Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 3.45Å; L147-Y166 HydrophobicContact CD1-CD2 3.52Å; L147-Y166 HydrophobicContact CD1-CE2 3.49Å; L147-Y166 VanDerWaalsContact CD1-CE2 3.49Å; L147-Y166 HydrophobicContact CD1-CG 4.46Å; L147-V170 HydrophobicContact CD1-CG2 4.18Å; L147-L173 HydrophobicContact CD2-CD1 3.83Å |
| 148 | H | 59.2 | Low | 56.5 | Low | 124 Ų | 124 | 82.5 Ų | 82.5 | 57% | 0.574 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -65.2 | -41 | 176.7 | -172.6 | -94.3 | 0 | 0 | 0 | 111.4 | G144 V145 A150 L151 V152 | G144-H148 VanDerWaalsContact O-CB 3.28Å; G144-H148 WeakPolarHBondContact O-CB 3.34Å; G144-H148 PolarHBondContact O-N 2.89Å; V145-H148 PolarHBondContact O-N 3.41Å; H148-A150 VanDerWaalsContact C-N 3.32Å; H148-A150 PolarHBondContact O-N 2.91Å; H148-L151 PolarHBondContact O-N 3.44Å; H148-V152 VanDerWaalsContact CE1-CG2 3.42Å; H148-V152 WeakPolarHBondContact CE1-CG2 3.3Å; H148-V152 WeakPolarHBondContact O-CB 3.5Å; H148-V152 VanDerWaalsContact O-CG2 3.26Å; H148-V152 WeakPolarHBondContact O-CG2 3.44Å; H148-V152 PolarHBondContact O-N 3.42Å |
| 149 | L | 60.5 | Low | 56.3 | Low | 63 Ų | 63 | 82.6 Ų | 82.6 | 33% | 0.33 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -63.1 | -37.9 | 173 | -76.6 | 162.6 | 0 | 0 | 0 | 112.1 | V145 L146 H153 | V145-L149 HydrophobicContact CG1-CD1 3.82Å; V145-L149 WeakPolarHBondContact O-CB 3.32Å; V145-L149 WeakPolarHBondContact O-CD1 3.37Å; V145-L149 VanDerWaalsContact O-CG 3.28Å; V145-L149 WeakPolarHBondContact O-CG 3.26Å; V145-L149 PolarHBondContact O-N 2.82Å; L146-L149 PolarHBondContact O-N 3.45Å; L149-H153 WeakPolarHBondContact O-CB 3.19Å; L149-H153 PolarHBondContact O-N 3.45Å; L149-H153 PolarHBondContact O-ND1 3.23Å |
| 150 | A | 57.5 | Low | 55.9 | Low | 7 Ų | 7 | 88 Ų | 88 | 6% | 0.058 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -66.2 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L146 L147 H148 M165 | L146-A150 WeakPolarHBondContact O-CB 3.3Å; L146-A150 PolarHBondContact O-N 3.37Å; L147-A150 WeakPolarHBondContact O-CB 3.21Å; L147-A150 PolarHBondContact O-N 3.27Å; H148-A150 VanDerWaalsContact C-N 3.32Å; H148-A150 PolarHBondContact O-N 2.91Å; A150-M165 HydrophobicContact CB-CE 3.64Å |
| 151 | L | 62.9 | Low | 55.5 | Low | 94 Ų | 94 | 89.1 Ų | 89.1 | 49% | 0.492 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -75.3 | -39.8 | 179.2 | -72.3 | 167.4 | 0 | 0 | 0 | 112.5 | L147 H148 H154 | L147-L151 HydrophobicContact CG-CD1 4.21Å; L147-L151 WeakPolarHBondContact O-CB 3.47Å; L147-L151 VanDerWaalsContact O-CG 3.3Å; L147-L151 WeakPolarHBondContact O-CG 3.27Å; L147-L151 PolarHBondContact O-N 3.45Å; H148-L151 PolarHBondContact O-N 3.44Å; L151-H154 PolarHBondContact O-ND1 2.84Å |
| 152 | V | 58.8 | Low | 55.1 | Low | 90 Ų | 90 | 88.3 Ų | 88.3 | 55% | 0.545 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -75.5 | -32.2 | -176.7 | 171.2 | 0 | 0 | 0 | 0 | 112.8 | H148 H154 | H148-V152 VanDerWaalsContact CE1-CG2 3.42Å; H148-V152 WeakPolarHBondContact CE1-CG2 3.3Å; H148-V152 WeakPolarHBondContact O-CB 3.5Å; H148-V152 VanDerWaalsContact O-CG2 3.26Å; H148-V152 WeakPolarHBondContact O-CG2 3.44Å; H148-V152 PolarHBondContact O-N 3.42Å; V152-H154 PolarHBondContact O-N 2.86Å |
| 153 | H | 55.9 | Low | 54.9 | Low | 125 Ų | 125 | 91.2 Ų | 91.2 | 58% | 0.579 | 50% | 0.504 | S | S | * | . | trans | -83.7 | 40.2 | -178.3 | -71.2 | 91.1 | 0 | 0 | 0 | 114.2 | L149 M155 | L149-H153 WeakPolarHBondContact O-CB 3.19Å; L149-H153 PolarHBondContact O-N 3.45Å; L149-H153 PolarHBondContact O-ND1 3.23Å; H153-M155 PolarHBondContact O-N 3.3Å | ||
| 154 | H | 51.1 | Low | 54.7 | Low | 141 Ų | 141 | 94.7 Ų | 94.7 | 65% | 0.653 | 52% | 0.522 | S | S | * | . | trans | -66.6 | 71 | 173.1 | -93.4 | 68.1 | 0 | 0 | 0 | 112.8 | L151 V152 | L151-H154 PolarHBondContact O-ND1 2.84Å; V152-H154 PolarHBondContact O-N 2.86Å | ||
| 155 | M | 38.8 | Very low | 54.7 | Low | 170 Ų | 170 | 95.5 Ų | 95.5 | 84% | 0.837 | 52% | 0.52 | S | S | * | . | trans | -157.9 | 151.4 | 165.5 | -81.8 | -53.5 | -119.5 | 0 | 0 | 110.6 | H153 | H153-M155 PolarHBondContact O-N 3.3Š| ||
| 156 | P | 46.9 | Very low | 54.8 | Low | 113 Ų | 113 | 96.9 Ų | 96.9 | 73% | 0.734 | 52% | 0.517 | S | S | * | . | -110.7 | 120.5 | -85.6 | 30.5 | -12.1 | 0 | 0 | 0 | 113.1 | |||||
| 157 | K | 47.1 | Very low | 55 | Low | 203 Ų | 203 | 98.5 Ų | 98.5 | 88% | 0.883 | 53% | 0.525 | S | S | * | . | trans | 59.2 | 131 | 170.6 | -72.8 | 175.3 | 177.1 | 170.8 | 0 | 116.6 | ||||
| 158 | P | 46.7 | Very low | 54.9 | Low | 105 Ų | 105 | 98.9 Ų | 98.9 | 68% | 0.682 | 53% | 0.53 | S | S | * | . | cis | -122.4 | 133.9 | 49.3 | 31.9 | -16.2 | 0 | 0 | 0 | 113.7 | Q160 | P158-Q160 VanDerWaalsContact C-N 3.26Å; P158-Q160 PolarHBondContact O-N 3.4Å | ||
| 159 | G | 54.7 | Low | 54.9 | Low | 68 Ų | 68 | 93 Ų | 93 | 70% | 0.701 | 50% | 0.503 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -73.5 | 19.5 | -163.4 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||
| 160 | Q | 50.9 | Low | 55.2 | Low | 170 Ų | 170 | 92.9 Ų | 92.9 | 79% | 0.794 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -108.2 | -40.5 | 178.8 | -161.2 | 157.3 | -16.6 | 0 | 0 | 112.5 | P158 L162 N163 D164 | P158-Q160 VanDerWaalsContact C-N 3.26Å; P158-Q160 PolarHBondContact O-N 3.4Å; Q160-L162 VanDerWaalsContact C-N 3.34Å; Q160-L162 PolarHBondContact O-N 3.49Å; Q160-N163 PolarHBondContact O-N 3.49Å; Q160-D164 PolarHBondContact O-N 2.99Å |
| 161 | A | 52.4 | Low | 55.4 | Low | 63 Ų | 63 | 97.1 Ų | 97.1 | 52% | 0.521 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -70.6 | -28.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | M165 | A161-M165 VanDerWaalsContact O-CB 3.29Å; A161-M165 WeakPolarHBondContact O-CB 3.47Å; A161-M165 PolarHBondContact O-N 3.34Å; A161-M165 VanDerWaalsContact O-N 3.07Å |
| 162 | L | 53.6 | Low | 55.3 | Low | 90 Ų | 90 | 95.1 Ų | 95.1 | 47% | 0.471 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -71.6 | -39 | 179.2 | -125.5 | 115.4 | 0 | 0 | 0 | 112 | Q160 D164 Y166 | Q160-L162 VanDerWaalsContact C-N 3.34Å; Q160-L162 PolarHBondContact O-N 3.49Å; L162-D164 VanDerWaalsContact C-N 3.32Å; L162-Y166 WeakPolarHBondContact O-CB 3.45Å; L162-Y166 PolarHBondContact O-N 3.27Å |
| 163 | N | 57 | Low | 55.7 | Low | 99 Ų | 99 | 93.8 Ų | 93.8 | 53% | 0.529 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.5 | -41.7 | 179 | -149.9 | -1 | 0 | 0 | 0 | 109.6 | Q160 Y166 I167 | Q160-N163 PolarHBondContact O-N 3.49Å; N163-Y166 PolarHBondContact O-N 3.28Å; N163-I167 WeakPolarHBondContact O-CB 3.35Å; N163-I167 VanDerWaalsContact O-CD1 3.26Å; N163-I167 WeakPolarHBondContact O-CD1 3.42Å; N163-I167 WeakPolarHBondContact O-CG1 3.35Å; N163-I167 PolarHBondContact O-N 3.43Å |
| 164 | D | 57.1 | Low | 56.2 | Low | 72 Ų | 72 | 90.5 Ų | 90.5 | 39% | 0.385 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -68.9 | -38.4 | 179.9 | -139.3 | -2.3 | 0 | 0 | 0 | 112.9 | T73 Q160 L162 I167 S168 | T73-D164 HydrophobicContact CG2-CB 4.33Å; T73-D164 WeakPolarHBondContact CG2-OD2 3.3Å; T73-D164 PolarHBondContact OG1-OD2 3.1Å; Q160-D164 PolarHBondContact O-N 2.99Å; L162-D164 VanDerWaalsContact C-N 3.32Å; D164-I167 PolarHBondContact O-N 3.48Å; D164-S168 WeakPolarHBondContact O-CB 3.43Å; D164-S168 PolarHBondContact O-N 3.39Å |
| 165 | M | 57.9 | Low | 56.8 | Low | 44 Ų | 44 | 85.9 Ų | 85.9 | 22% | 0.217 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -72.1 | -34.9 | 176.4 | -160.9 | -179.5 | 97.6 | 0 | 0 | 112.6 | R82 A150 A161 G169 | R82-M165 PolarHBondContact NH1-SD 3.46Å; R82-M165 PolarHBondContact NH2-SD 2.87Å; A150-M165 HydrophobicContact CB-CE 3.64Å; A161-M165 VanDerWaalsContact O-CB 3.29Å; A161-M165 WeakPolarHBondContact O-CB 3.47Å; A161-M165 PolarHBondContact O-N 3.34Å; A161-M165 VanDerWaalsContact O-N 3.07Å; M165-G169 PolarHBondContact O-N 3.42Å |
| 166 | Y | 61.4 | Low | 57.9 | Low | 111 Ų | 111 | 77.9 Ų | 77.9 | 44% | 0.435 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.4 | -44.2 | 171.7 | -179.2 | -95.9 | 0 | 0 | 0 | 110.9 | L147 L162 N163 G169 V170 | L147-Y166 HydrophobicContact CD1-CD2 3.52Å; L147-Y166 HydrophobicContact CD1-CE2 3.49Å; L147-Y166 VanDerWaalsContact CD1-CE2 3.49Å; L147-Y166 HydrophobicContact CD1-CG 4.46Å; L162-Y166 WeakPolarHBondContact O-CB 3.45Å; L162-Y166 PolarHBondContact O-N 3.27Å; N163-Y166 PolarHBondContact O-N 3.28Å; Y166-G169 PolarHBondContact O-N 2.92Å; Y166-V170 HydrophobicContact CD1-CG2 4.04Å; Y166-V170 HydrophobicContact CE1-CG2 3.69Å; Y166-V170 HydrophobicContact CE2-CG2 4.3Å; Y166-V170 HydrophobicContact CG-CG2 4.47Å; Y166-V170 WeakPolarHBondContact O-CB 3.42Å; Y166-V170 VanDerWaalsContact O-CG2 3.27Å; Y166-V170 WeakPolarHBondContact O-CG2 3.28Å; Y166-V170 PolarHBondContact O-N 3.43Å |
| 167 | I | 62.8 | Low | 58.7 | Low | 83 Ų | 83 | 73.5 Ų | 73.5 | 43% | 0.426 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -61.6 | -46.6 | 175.9 | -70.2 | 160.8 | 0 | 0 | 0 | 110.2 | N163 D164 G169 V170 V171 | N163-I167 WeakPolarHBondContact O-CB 3.35Å; N163-I167 VanDerWaalsContact O-CD1 3.26Å; N163-I167 WeakPolarHBondContact O-CD1 3.42Å; N163-I167 WeakPolarHBondContact O-CG1 3.35Å; N163-I167 PolarHBondContact O-N 3.43Å; D164-I167 PolarHBondContact O-N 3.48Å; I167-G169 VanDerWaalsContact C-N 3.35Å; I167-G169 PolarHBondContact O-N 2.91Å; I167-V170 PolarHBondContact O-N 3.18Å; I167-V171 HydrophobicContact CG2-CG2 4.26Å; I167-V171 WeakPolarHBondContact O-CB 3.23Å; I167-V171 WeakPolarHBondContact O-CG2 3.45Å; I167-V171 PolarHBondContact O-N 3.43Å |
| 168 | S | 58.7 | Low | 59.8 | Low | 41 Ų | 41 | 69.1 Ų | 69.1 | 29% | 0.287 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -59.7 | -44.1 | 174.8 | 179.8 | 0 | 0 | 0 | 0 | 111.7 | D164 V171 L172 | D164-S168 WeakPolarHBondContact O-CB 3.43Å; D164-S168 PolarHBondContact O-N 3.39Å; S168-V171 PolarHBondContact O-N 2.91Å; S168-L172 WeakPolarHBondContact O-CB 3.38Å; S168-L172 PolarHBondContact O-N 2.95Å |
| 169 | G | 60.9 | Low | 60.5 | Low | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 175 | 0 | 0 | 0 | 0 | 0 | 113.1 | M165 Y166 I167 L172 L173 | M165-G169 PolarHBondContact O-N 3.42Å; Y166-G169 PolarHBondContact O-N 2.92Å; I167-G169 VanDerWaalsContact C-N 3.35Å; I167-G169 PolarHBondContact O-N 2.91Å; G169-L172 PolarHBondContact O-N 2.91Å; G169-L173 VanDerWaalsContact O-CB 3.26Å; G169-L173 WeakPolarHBondContact O-CB 3.3Å; G169-L173 PolarHBondContact O-N 2.76Å |
| 170 | V | 65.2 | Low | 61 | Low | 61 Ų | 61 | 64 Ų | 64 | 37% | 0.37 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.1 | -42.5 | 178 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | L147 Y166 I167 L173 A174 | L147-V170 HydrophobicContact CD1-CG2 4.18Å; Y166-V170 HydrophobicContact CD1-CG2 4.04Å; Y166-V170 HydrophobicContact CE1-CG2 3.69Å; Y166-V170 HydrophobicContact CE2-CG2 4.3Å; Y166-V170 HydrophobicContact CG-CG2 4.47Å; Y166-V170 WeakPolarHBondContact O-CB 3.42Å; Y166-V170 VanDerWaalsContact O-CG2 3.27Å; Y166-V170 WeakPolarHBondContact O-CG2 3.28Å; Y166-V170 PolarHBondContact O-N 3.43Å; I167-V170 PolarHBondContact O-N 3.18Å; V170-L173 PolarHBondContact O-N 2.94Å; V170-A174 WeakPolarHBondContact O-CB 3.49Å; V170-A174 PolarHBondContact O-N 2.94Å |
| 171 | V | 62.9 | Low | 61.9 | Low | 96 Ų | 96 | 60 Ų | 60 | 58% | 0.582 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -65 | -41.4 | 177.4 | 170.4 | 0 | 0 | 0 | 0 | 110.9 | I167 S168 G175 | I167-V171 HydrophobicContact CG2-CG2 4.26Å; I167-V171 WeakPolarHBondContact O-CB 3.23Å; I167-V171 WeakPolarHBondContact O-CG2 3.45Å; I167-V171 PolarHBondContact O-N 3.43Å; S168-V171 PolarHBondContact O-N 2.91Å; V171-G175 PolarHBondContact O-N 3.24Å |
| 172 | L | 60.9 | Low | 62.7 | Low | 53 Ų | 53 | 59 Ų | 59 | 28% | 0.277 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -66.2 | -40.2 | 177 | -141.5 | 79 | 0 | 0 | 0 | 111.7 | L139 C142 S168 G169 G176 | L139-L172 HydrophobicContact CD2-CG 4.39Å; C142-L172 HydrophobicContact CB-CD2 4.41Å; S168-L172 WeakPolarHBondContact O-CB 3.38Å; S168-L172 PolarHBondContact O-N 2.95Å; G169-L172 PolarHBondContact O-N 2.91Å; L172-G176 PolarHBondContact O-N 2.98Å |
| 173 | L | 66.1 | Low | 63.1 | Low | 62 Ų | 62 | 55.6 Ų | 55.6 | 33% | 0.325 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -71.6 | -40.9 | 179.8 | -148.3 | 162.2 | 0 | 0 | 0 | 111.1 | L140 L147 G169 V170 G177 | L140-L173 HydrophobicContact CD2-CD2 3.98Å; L140-L173 HydrophobicContact CD2-CG 4.23Å; L140-L173 WeakPolarHBondContact CD2-O 3.48Å; L147-L173 HydrophobicContact CD2-CD1 3.83Å; G169-L173 VanDerWaalsContact O-CB 3.26Å; G169-L173 WeakPolarHBondContact O-CB 3.3Å; G169-L173 PolarHBondContact O-N 2.76Å; V170-L173 PolarHBondContact O-N 2.94Å; L173-G177 WeakPolarHBondContact O-CA 3.22Å; L173-G177 PolarHBondContact O-N 3.34Å |
| 174 | A | 67.7 | Low | 63.6 | Low | 56 Ų | 56 | 52 Ų | 52 | 46% | 0.463 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -65.4 | -46.3 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | V170 G177 V178 | V170-A174 WeakPolarHBondContact O-CB 3.49Å; V170-A174 PolarHBondContact O-N 2.94Å; A174-G177 PolarHBondContact O-N 3.15Å; A174-V178 VanDerWaalsContact O-CG2 3.3Å; A174-V178 WeakPolarHBondContact O-CG2 3.39Å; A174-V178 PolarHBondContact O-N 3.41Å |
| 175 | G | 63.1 | Low | 64.3 | Low | 44 Ų | 44 | 53.4 Ų | 53.4 | 45% | 0.454 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.3 | -47 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V171 G177 V178 A179 | V171-G175 PolarHBondContact O-N 3.24Å; G175-G177 VanDerWaalsContact C-N 3.32Å; G175-G177 PolarHBondContact O-N 3.35Å; G175-V178 PolarHBondContact O-N 3.49Å; G175-A179 WeakPolarHBondContact O-CB 3.14Å; G175-A179 PolarHBondContact O-N 3.39Å |
| 176 | G | 61.1 | Low | 64.7 | Low | 2 Ų | 2 | 55 Ų | 55 | 2% | 0.021 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.9 | -39.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | L172 A179 V180 | L172-G176 PolarHBondContact O-N 2.98Å; G176-A179 PolarHBondContact O-N 3.07Å; G176-V180 WeakPolarHBondContact O-CG2 3.11Å; G176-V180 PolarHBondContact O-N 3.49Å |
| 177 | G | 63.9 | Low | 64.8 | Low | 21 Ų | 21 | 51.8 Ų | 51.8 | 22% | 0.216 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -65.2 | -48.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | L173 A174 G175 A179 V180 V181 | L173-G177 WeakPolarHBondContact O-CA 3.22Å; L173-G177 PolarHBondContact O-N 3.34Å; A174-G177 PolarHBondContact O-N 3.15Å; G175-G177 VanDerWaalsContact C-N 3.32Å; G175-G177 PolarHBondContact O-N 3.35Å; G177-A179 VanDerWaalsContact C-N 3.29Å; G177-A179 PolarHBondContact O-N 2.86Å; G177-V180 PolarHBondContact O-N 3.49Å; G177-V181 VanDerWaalsContact O-CB 3.31Å; G177-V181 WeakPolarHBondContact O-CB 3.25Å; G177-V181 WeakPolarHBondContact O-CG2 3.33Å; G177-V181 PolarHBondContact O-N 2.98Å |
| 178 | V | 71.1 | Confident | 65 | Low | 110 Ų | 110 | 51.8 Ų | 51.8 | 67% | 0.667 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -60.1 | -41.3 | 175.7 | 171 | 0 | 0 | 0 | 0 | 110.9 | A174 G175 G182 | A174-V178 VanDerWaalsContact O-CG2 3.3Å; A174-V178 WeakPolarHBondContact O-CG2 3.39Å; A174-V178 PolarHBondContact O-N 3.41Å; G175-V178 PolarHBondContact O-N 3.49Å; V178-G182 PolarHBondContact O-N 3.43Å |
| 179 | A | 60.8 | Low | 65.5 | Low | 36 Ų | 36 | 53.1 Ų | 53.1 | 30% | 0.298 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.2 | -48.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | G175 G176 G177 G182 V183 | G175-A179 WeakPolarHBondContact O-CB 3.14Å; G175-A179 PolarHBondContact O-N 3.39Å; G176-A179 PolarHBondContact O-N 3.07Å; G177-A179 VanDerWaalsContact C-N 3.29Å; G177-A179 PolarHBondContact O-N 2.86Å; A179-G182 PolarHBondContact O-N 3.24Å; A179-V183 VanDerWaalsContact O-CG2 3.25Å; A179-V183 WeakPolarHBondContact O-CG2 3.2Å; A179-V183 PolarHBondContact O-N 3.01Å |
| 180 | V | 65.6 | Low | 65.6 | Low | 29 Ų | 29 | 55 Ų | 55 | 18% | 0.176 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -66.1 | -42 | 179.9 | 172 | 0 | 0 | 0 | 0 | 111.5 | M137 L140 G176 G177 V183 G184 | M137-V180 HydrophobicContact SD-CG1 4.41Å; M137-V180 HydrophobicContact SD-CG2 4.38Å; L140-V180 HydrophobicContact CD1-CB 4.16Å; L140-V180 HydrophobicContact CD1-CG2 3.74Å; L140-V180 HydrophobicContact CG-CG2 4.5Å; G176-V180 WeakPolarHBondContact O-CG2 3.11Å; G176-V180 PolarHBondContact O-N 3.49Å; G177-V180 PolarHBondContact O-N 3.49Å; V180-V183 PolarHBondContact O-N 2.85Å; V180-G184 PolarHBondContact O-N 2.97Å |
| 181 | V | 70.4 | Confident | 65.6 | Low | 88 Ų | 88 | 56 Ų | 56 | 53% | 0.533 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 177 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | G177 V183 G184 I185 | G177-V181 VanDerWaalsContact O-CB 3.31Å; G177-V181 WeakPolarHBondContact O-CB 3.25Å; G177-V181 WeakPolarHBondContact O-CG2 3.33Å; G177-V181 PolarHBondContact O-N 2.98Å; V181-V183 PolarHBondContact O-N 2.92Å; V181-G184 PolarHBondContact O-N 3.38Å; V181-I185 HydrophobicContact CG1-CD1 3.68Å; V181-I185 HydrophobicContact CG1-CG1 4.29Å; V181-I185 VanDerWaalsContact O-CG1 3.28Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 3.03Å |
| 182 | G | 68.3 | Low | 65.9 | Low | 40 Ų | 40 | 56.1 Ų | 56.1 | 41% | 0.412 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.8 | -45.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V178 A179 I185 Y186 | V178-G182 PolarHBondContact O-N 3.43Å; A179-G182 PolarHBondContact O-N 3.24Å; G182-I185 PolarHBondContact O-N 2.99Å; G182-Y186 WeakPolarHBondContact O-CB 3.41Å; G182-Y186 PolarHBondContact O-N 2.96Å |
| 183 | V | 63.1 | Low | 66.2 | Low | 19 Ų | 19 | 58.9 Ų | 58.9 | 12% | 0.115 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -67 | -39.4 | 175.5 | 176.5 | 0 | 0 | 0 | 0 | 111.5 | V129 V132 L133 A179 V180 V181 Y186 T187 | V129-V183 HydrophobicContact CG1-CG1 3.86Å; V132-V183 HydrophobicContact CB-CG2 4.31Å; V132-V183 HydrophobicContact CG1-CG2 3.57Å; L133-V183 HydrophobicContact CD1-CG1 3.96Å; A179-V183 VanDerWaalsContact O-CG2 3.25Å; A179-V183 WeakPolarHBondContact O-CG2 3.2Å; A179-V183 PolarHBondContact O-N 3.01Å; V180-V183 PolarHBondContact O-N 2.85Å; V181-V183 PolarHBondContact O-N 2.92Å; V183-Y186 PolarHBondContact O-N 3.48Å; V183-T187 HydrophobicContact CG1-CG2 4.46Å; V183-T187 WeakPolarHBondContact O-CB 3.29Å; V183-T187 WeakPolarHBondContact O-CG2 3.3Å; V183-T187 PolarHBondContact O-N 3.38Å; V183-T187 PolarHBondContact O-OG1 2.92Å |
| 184 | G | 67 | Low | 65.9 | Low | 25 Ų | 25 | 57.5 Ų | 57.5 | 26% | 0.258 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -60.6 | -46.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V180 V181 T187 V188 | V180-G184 PolarHBondContact O-N 2.97Å; V181-G184 PolarHBondContact O-N 3.38Å; G184-T187 WeakPolarHBondContact CA-OG1 3.45Å; G184-T187 PolarHBondContact O-N 3.32Å; G184-T187 PolarHBondContact O-OG1 3.47Å; G184-V188 WeakPolarHBondContact O-CB 3.46Å; G184-V188 WeakPolarHBondContact O-CG2 3.43Å; G184-V188 PolarHBondContact O-N 3.49Å |
| 185 | I | 71.6 | Confident | 65.6 | Low | 101 Ų | 101 | 63.7 Ų | 63.7 | 52% | 0.518 | 39% | 0.387 | S | S | . | . | H | α-helix | trans | -64.5 | -45.7 | 176.5 | -66.7 | 166 | 0 | 0 | 0 | 110.1 | V181 G182 T187 V188 V189 | V181-I185 HydrophobicContact CG1-CD1 3.68Å; V181-I185 HydrophobicContact CG1-CG1 4.29Å; V181-I185 VanDerWaalsContact O-CG1 3.28Å; V181-I185 WeakPolarHBondContact O-CG1 3.36Å; V181-I185 PolarHBondContact O-N 3.03Å; G182-I185 PolarHBondContact O-N 2.99Å; I185-T187 VanDerWaalsContact C-N 3.35Å; I185-T187 PolarHBondContact O-N 3.31Å; I185-V188 PolarHBondContact O-N 3.47Å; I185-V189 HydrophobicContact CG2-CG2 4.19Å; I185-V189 WeakPolarHBondContact O-CB 3.25Å; I185-V189 VanDerWaalsContact O-CG2 3.24Å; I185-V189 WeakPolarHBondContact O-CG2 3.49Å; I185-V189 PolarHBondContact O-N 3.45Å |
| 186 | Y | 65.1 | Low | 65.3 | Low | 76 Ų | 76 | 66 Ų | 66 | 30% | 0.298 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -59.1 | -44.6 | 178.4 | 175 | -102.2 | 0 | 0 | 0 | 112.3 | R48 L51 V129 G182 V183 V189 A190 | R48-Y186 WeakPolarHBondContact CG-OH 3.32Å; R48-Y186 PolarHBondContact NE-OH 2.96Å; L51-Y186 HydrophobicContact CD1-CD2 4.25Å; L51-Y186 HydrophobicContact CD1-CE2 3.94Å; V129-Y186 HydrophobicContact CG2-CD1 4.29Å; V129-Y186 HydrophobicContact CG2-CE1 4.02Å; G182-Y186 WeakPolarHBondContact O-CB 3.41Å; G182-Y186 PolarHBondContact O-N 2.96Å; V183-Y186 PolarHBondContact O-N 3.48Å; Y186-V189 PolarHBondContact O-N 2.85Å; Y186-A190 VanDerWaalsContact O-CB 3.28Å; Y186-A190 WeakPolarHBondContact O-CB 3.27Å; Y186-A190 PolarHBondContact O-N 3.42Å |
| 187 | T | 63.9 | Low | 65 | Low | 45 Ų | 45 | 74.1 Ų | 74.1 | 28% | 0.276 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -65.1 | -44.7 | 177.2 | 46.9 | 0 | 0 | 0 | 0 | 112.2 | V129 V183 G184 I185 V189 A190 V191 | V129-T187 HydrophobicContact CG1-CG2 3.32Å; V183-T187 HydrophobicContact CG1-CG2 4.46Å; V183-T187 WeakPolarHBondContact O-CB 3.29Å; V183-T187 WeakPolarHBondContact O-CG2 3.3Å; V183-T187 PolarHBondContact O-N 3.38Å; V183-T187 PolarHBondContact O-OG1 2.92Å; G184-T187 WeakPolarHBondContact CA-OG1 3.45Å; G184-T187 PolarHBondContact O-N 3.32Å; G184-T187 PolarHBondContact O-OG1 3.47Å; I185-T187 VanDerWaalsContact C-N 3.35Å; I185-T187 PolarHBondContact O-N 3.31Å; T187-V189 PolarHBondContact O-N 3.27Å; T187-A190 PolarHBondContact O-N 3.2Å; T187-V191 WeakPolarHBondContact O-CB 3.35Å; T187-V191 VanDerWaalsContact O-CG2 3.26Å; T187-V191 WeakPolarHBondContact O-CG2 3.3Å; T187-V191 PolarHBondContact O-N 2.88Å |
| 188 | V | 68.4 | Low | 64.4 | Low | 82 Ų | 82 | 78.6 Ų | 78.6 | 50% | 0.497 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -60.1 | -46.6 | 176.1 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | G184 I185 V191 L192 | G184-V188 WeakPolarHBondContact O-CB 3.46Å; G184-V188 WeakPolarHBondContact O-CG2 3.43Å; G184-V188 PolarHBondContact O-N 3.49Å; I185-V188 PolarHBondContact O-N 3.47Å; V188-V191 PolarHBondContact O-N 2.88Å; V188-L192 HydrophobicContact CG1-CD1 3.86Å; V188-L192 WeakPolarHBondContact O-CB 3.46Å; V188-L192 WeakPolarHBondContact O-CD1 3.33Å; V188-L192 PolarHBondContact O-N 2.9Å |
| 189 | V | 68.6 | Low | 63.5 | Low | 70 Ų | 70 | 75.1 Ų | 75.1 | 42% | 0.424 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.2 | -44.6 | 177.6 | 171.8 | 0 | 0 | 0 | 0 | 110.9 | I185 Y186 T187 V191 L192 L193 | I185-V189 HydrophobicContact CG2-CG2 4.19Å; I185-V189 WeakPolarHBondContact O-CB 3.25Å; I185-V189 VanDerWaalsContact O-CG2 3.24Å; I185-V189 WeakPolarHBondContact O-CG2 3.49Å; I185-V189 PolarHBondContact O-N 3.45Å; Y186-V189 PolarHBondContact O-N 2.85Å; T187-V189 PolarHBondContact O-N 3.27Å; V189-V191 VanDerWaalsContact C-N 3.33Å; V189-V191 PolarHBondContact O-N 2.96Å; V189-L192 PolarHBondContact O-N 3.17Å; V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 WeakPolarHBondContact O-CB 3.26Å; V189-L193 WeakPolarHBondContact O-CD1 3.42Å; V189-L193 PolarHBondContact O-N 2.96Å |
| 190 | A | 63.7 | Low | 63.1 | Low | 40 Ų | 40 | 82.4 Ų | 82.4 | 33% | 0.331 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -62 | -39.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y186 T187 G194 | Y186-A190 VanDerWaalsContact O-CB 3.28Å; Y186-A190 WeakPolarHBondContact O-CB 3.27Å; Y186-A190 PolarHBondContact O-N 3.42Å; T187-A190 PolarHBondContact O-N 3.2Å; A190-G194 PolarHBondContact O-N 2.89Å |
| 191 | V | 63.6 | Low | 62.5 | Low | 81 Ų | 81 | 88.5 Ų | 88.5 | 49% | 0.491 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -69.6 | -41.9 | 175.8 | 170.8 | 0 | 0 | 0 | 0 | 111.2 | T187 V188 V189 G194 R195 | T187-V191 WeakPolarHBondContact O-CB 3.35Å; T187-V191 VanDerWaalsContact O-CG2 3.26Å; T187-V191 WeakPolarHBondContact O-CG2 3.3Å; T187-V191 PolarHBondContact O-N 2.88Å; V188-V191 PolarHBondContact O-N 2.88Å; V189-V191 VanDerWaalsContact C-N 3.33Å; V189-V191 PolarHBondContact O-N 2.96Å; V191-G194 PolarHBondContact O-N 3.46Å; V191-R195 WeakPolarHBondContact O-CB 3.24Å; V191-R195 PolarHBondContact O-N 2.95Å |
| 192 | L | 70.6 | Confident | 61.9 | Low | 99 Ų | 99 | 89.8 Ų | 89.8 | 52% | 0.518 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -63.8 | -44.3 | 176.3 | -102.8 | 77.3 | 0 | 0 | 0 | 111.7 | V188 V189 G194 R195 T196 | V188-L192 HydrophobicContact CG1-CD1 3.86Å; V188-L192 WeakPolarHBondContact O-CB 3.46Å; V188-L192 WeakPolarHBondContact O-CD1 3.33Å; V188-L192 PolarHBondContact O-N 2.9Å; V189-L192 PolarHBondContact O-N 3.17Å; L192-G194 VanDerWaalsContact C-N 3.34Å; L192-R195 PolarHBondContact O-N 2.83Å; L192-T196 WeakPolarHBondContact O-CB 3.34Å; L192-T196 PolarHBondContact O-N 3.3Å; L192-T196 PolarHBondContact O-OG1 3.32Å |
| 193 | L | 67.6 | Low | 61.5 | Low | 111 Ų | 111 | 91.8 Ų | 91.8 | 58% | 0.581 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -64.3 | -39.2 | 174.3 | -96.4 | 70.2 | 0 | 0 | 0 | 111.4 | V189 T196 R197 | V189-L193 HydrophobicContact CG1-CD1 3.89Å; V189-L193 WeakPolarHBondContact O-CB 3.26Å; V189-L193 WeakPolarHBondContact O-CD1 3.42Å; V189-L193 PolarHBondContact O-N 2.96Å; L193-T196 VanDerWaalsContact CA-OG1 3.26Å; L193-T196 WeakPolarHBondContact CA-OG1 3.2Å; L193-T196 PolarHBondContact O-OG1 3.46Å; L193-T196 VanDerWaalsContact O-OG1 3.1Å; L193-R197 VanDerWaalsContact O-CB 3.25Å; L193-R197 WeakPolarHBondContact O-CB 3.44Å; L193-R197 PolarHBondContact O-N 2.92Å |
| 194 | G | 59.8 | Low | 61.2 | Low | 32 Ų | 32 | 95.4 Ų | 95.4 | 33% | 0.33 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64 | -42.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A190 V191 L192 H198 | A190-G194 PolarHBondContact O-N 2.89Å; V191-G194 PolarHBondContact O-N 3.46Å; L192-G194 VanDerWaalsContact C-N 3.34Å; G194-H198 PolarHBondContact O-N 2.97Å; G194-H198 PolarHBondContact O-ND1 2.71Å |
| 195 | R | 59.6 | Low | 60.8 | Low | 187 Ų | 187 | 102.8 Ų | 102.8 | 71% | 0.706 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -67.7 | -45.5 | 175.7 | -98.9 | -168.4 | 179 | 130.9 | -1.2 | 112.2 | V191 L192 R197 H198 G199 | V191-R195 WeakPolarHBondContact O-CB 3.24Å; V191-R195 PolarHBondContact O-N 2.95Å; L192-R195 PolarHBondContact O-N 2.83Å; R195-R197 VanDerWaalsContact C-N 3.29Å; R195-R197 PolarHBondContact O-N 3.41Å; R195-H198 PolarHBondContact O-N 2.7Å; R195-G199 PolarHBondContact O-N 2.99Å |
| 196 | T | 58 | Low | 60.2 | Low | 92 Ų | 92 | 101.2 Ų | 101.2 | 56% | 0.564 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -65 | -34.7 | 177.4 | 41.8 | 0 | 0 | 0 | 0 | 111.3 | L192 L193 R200 | L192-T196 WeakPolarHBondContact O-CB 3.34Å; L192-T196 PolarHBondContact O-N 3.3Å; L192-T196 PolarHBondContact O-OG1 3.32Å; L193-T196 VanDerWaalsContact CA-OG1 3.26Å; L193-T196 WeakPolarHBondContact CA-OG1 3.2Å; L193-T196 PolarHBondContact O-OG1 3.46Å; L193-T196 VanDerWaalsContact O-OG1 3.1Å; T196-R200 WeakPolarHBondContact O-CB 3.28Å; T196-R200 PolarHBondContact O-N 2.95Å |
| 197 | R | 55.4 | Low | 59.8 | Low | 172 Ų | 172 | 102.1 Ų | 102.1 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -70.7 | -34.5 | 174.5 | -151.7 | 175.2 | -161.3 | 174.3 | 5.6 | 113 | L193 R195 R201 | L193-R197 VanDerWaalsContact O-CB 3.25Å; L193-R197 WeakPolarHBondContact O-CB 3.44Å; L193-R197 PolarHBondContact O-N 2.92Å; R195-R197 VanDerWaalsContact C-N 3.29Å; R195-R197 PolarHBondContact O-N 3.41Å; R197-R201 WeakPolarHBondContact O-CG 3.44Å; R197-R201 PolarHBondContact O-N 2.88Å |
| 198 | H | 50.9 | Low | 59.3 | Low | 116 Ų | 116 | 104.4 Ų | 104.4 | 54% | 0.537 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -71.1 | -43.1 | 172 | -83.8 | 73.3 | 0 | 0 | 0 | 112 | G194 R195 R200 R201 L202 | G194-H198 PolarHBondContact O-N 2.97Å; G194-H198 PolarHBondContact O-ND1 2.71Å; R195-H198 PolarHBondContact O-N 2.7Å; H198-R200 VanDerWaalsContact C-N 3.31Å; H198-R200 PolarHBondContact O-N 3.26Å; H198-R201 PolarHBondContact O-N 3.46Å; H198-L202 WeakPolarHBondContact O-CB 3.27Å; H198-L202 PolarHBondContact O-N 3.47Å |
| 199 | G | 51 | Low | 58.6 | Low | 36 Ų | 36 | 105 Ų | 105 | 37% | 0.371 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.7 | -41.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R195 L202 V203 | R195-G199 PolarHBondContact O-N 2.99Å; G199-L202 PolarHBondContact O-N 3.41Å; G199-V203 WeakPolarHBondContact O-CB 3.29Å; G199-V203 WeakPolarHBondContact O-CG2 3.42Å; G199-V203 PolarHBondContact O-N 3.16Å |
| 200 | R | 52.8 | Low | 57.7 | Low | 189 Ų | 189 | 109.2 Ų | 109.2 | 71% | 0.713 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -72.4 | -32.8 | 178.8 | -153.3 | 162.5 | 90.2 | 166.8 | 8.3 | 113.1 | T196 H198 D204 | T196-R200 WeakPolarHBondContact O-CB 3.28Å; T196-R200 PolarHBondContact O-N 2.95Å; H198-R200 VanDerWaalsContact C-N 3.31Å; H198-R200 PolarHBondContact O-N 3.26Å; R200-D204 VanDerWaalsContact O-CB 3.25Å; R200-D204 WeakPolarHBondContact O-CB 3.46Å; R200-D204 PolarHBondContact O-N 2.83Å |
| 201 | R | 53.3 | Low | 57 | Low | 157 Ų | 157 | 111.8 Ų | 111.8 | 59% | 0.592 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -69.9 | -35.4 | 170.3 | -76.7 | -174.7 | -153.9 | -169.4 | 4.8 | 112.8 | R197 H198 R205 | R197-R201 WeakPolarHBondContact O-CG 3.44Å; R197-R201 PolarHBondContact O-N 2.88Å; H198-R201 PolarHBondContact O-N 3.46Å; R201-R205 WeakPolarHBondContact O-CB 3.34Å; R201-R205 PolarHBondContact O-N 2.95Å |
| 202 | L | 58.1 | Low | 56.1 | Low | 116 Ų | 116 | 112.4 Ų | 112.4 | 61% | 0.607 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -72.4 | -41.8 | 177.5 | -147.5 | 114.6 | 0 | 0 | 0 | 110.4 | H198 G199 R205 V206 | H198-L202 WeakPolarHBondContact O-CB 3.27Å; H198-L202 PolarHBondContact O-N 3.47Å; G199-L202 PolarHBondContact O-N 3.41Å; L202-R205 PolarHBondContact O-N 3.33Å; L202-V206 VanDerWaalsContact O-CB 3.3Å; L202-V206 WeakPolarHBondContact O-CB 3.42Å; L202-V206 WeakPolarHBondContact O-CG2 3.38Å; L202-V206 PolarHBondContact O-N 2.79Å |
| 203 | V | 59.3 | Low | 55.1 | Low | 81 Ų | 81 | 113 Ų | 113 | 49% | 0.491 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -65.5 | -42.8 | 172.7 | 171.4 | 0 | 0 | 0 | 0 | 111 | G199 R205 V206 L207 | G199-V203 WeakPolarHBondContact O-CB 3.29Å; G199-V203 WeakPolarHBondContact O-CG2 3.42Å; G199-V203 PolarHBondContact O-N 3.16Å; V203-R205 VanDerWaalsContact C-N 3.34Å; V203-R205 PolarHBondContact O-N 2.91Å; V203-V206 PolarHBondContact O-N 3.3Å; V203-L207 HydrophobicContact CG1-CD1 3.57Å; V203-L207 HydrophobicContact CG1-CG 4.06Å; V203-L207 WeakPolarHBondContact O-CB 3.41Å; V203-L207 WeakPolarHBondContact O-CG 3.26Å; V203-L207 PolarHBondContact O-N 3.03Å |
| 204 | D | 57.9 | Low | 54.1 | Low | 95 Ų | 95 | 111 Ų | 111 | 51% | 0.508 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -61.8 | -42 | 173 | -108.7 | -30.4 | 0 | 0 | 0 | 111.3 | R200 N208 | R200-D204 VanDerWaalsContact O-CB 3.25Å; R200-D204 WeakPolarHBondContact O-CB 3.46Å; R200-D204 PolarHBondContact O-N 2.83Å; D204-N208 VanDerWaalsContact O-CB 3.23Å; D204-N208 WeakPolarHBondContact O-CB 3.22Å; D204-N208 PolarHBondContact O-N 2.99Å |
| 205 | R | 57.2 | Low | 53.5 | Low | 181 Ų | 181 | 116.4 Ų | 116.4 | 68% | 0.683 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -68.3 | -40 | 179.1 | -170.6 | -178 | -69 | -179.3 | -4.6 | 111.6 | R201 L202 V203 V209 | R201-R205 WeakPolarHBondContact O-CB 3.34Å; R201-R205 PolarHBondContact O-N 2.95Å; L202-R205 PolarHBondContact O-N 3.33Å; V203-R205 VanDerWaalsContact C-N 3.34Å; V203-R205 PolarHBondContact O-N 2.91Å; R205-V209 WeakPolarHBondContact O-CB 3.49Å; R205-V209 WeakPolarHBondContact O-CG2 3.34Å; R205-V209 PolarHBondContact O-N 2.85Å |
| 206 | V | 59 | Low | 53 | Low | 67 Ų | 67 | 115.3 Ų | 115.3 | 41% | 0.406 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -68.8 | -45.4 | 175.9 | 171.3 | 0 | 0 | 0 | 0 | 109.8 | L202 V203 N208 V209 F210 | L202-V206 VanDerWaalsContact O-CB 3.3Å; L202-V206 WeakPolarHBondContact O-CB 3.42Å; L202-V206 WeakPolarHBondContact O-CG2 3.38Å; L202-V206 PolarHBondContact O-N 2.79Å; V203-V206 PolarHBondContact O-N 3.3Å; V206-N208 PolarHBondContact O-N 3.47Å; V206-V209 PolarHBondContact O-N 2.87Å; V206-F210 HydrophobicContact CG1-CD2 3.62Å; V206-F210 HydrophobicContact CG1-CE2 3.74Å; V206-F210 WeakPolarHBondContact O-CB 3.46Å; V206-F210 WeakPolarHBondContact O-CD2 3.26Å; V206-F210 PolarHBondContact O-N 2.79Å |
| 207 | L | 56.5 | Low | 52.5 | Low | 95 Ų | 95 | 118 Ų | 118 | 50% | 0.497 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -65.6 | -36.7 | 175.3 | -69.8 | 174.8 | 0 | 0 | 0 | 112.2 | V203 F210 T211 | V203-L207 HydrophobicContact CG1-CD1 3.57Å; V203-L207 HydrophobicContact CG1-CG 4.06Å; V203-L207 WeakPolarHBondContact O-CB 3.41Å; V203-L207 WeakPolarHBondContact O-CG 3.26Å; V203-L207 PolarHBondContact O-N 3.03Å; L207-F210 PolarHBondContact O-N 3.44Å; L207-T211 VanDerWaalsContact O-CB 3.29Å; L207-T211 WeakPolarHBondContact O-CB 3.15Å; L207-T211 VanDerWaalsContact O-CG2 3.29Å; L207-T211 WeakPolarHBondContact O-CG2 3.4Å; L207-T211 PolarHBondContact O-N 3Å; L207-T211 PolarHBondContact O-OG1 3.31Å |
| 208 | N | 54.7 | Low | 52.3 | Low | 93 Ų | 93 | 120.2 Ų | 120.2 | 50% | 0.497 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64.8 | -42.6 | 171.6 | -123.8 | -71.1 | 0 | 0 | 0 | 110.7 | D204 V206 F210 T211 V212 | D204-N208 VanDerWaalsContact O-CB 3.23Å; D204-N208 WeakPolarHBondContact O-CB 3.22Å; D204-N208 PolarHBondContact O-N 2.99Å; V206-N208 PolarHBondContact O-N 3.47Å; N208-F210 VanDerWaalsContact C-N 3.34Å; N208-F210 PolarHBondContact O-N 3.41Å; N208-T211 WeakPolarHBondContact CA-OG1 3.33Å; N208-T211 PolarHBondContact O-N 3.35Å; N208-T211 PolarHBondContact O-OG1 2.93Å; N208-V212 WeakPolarHBondContact O-CB 3.26Å; N208-V212 WeakPolarHBondContact O-CG2 3.39Å; N208-V212 PolarHBondContact O-N 3.42Å |
| 209 | V | 53.6 | Low | 52.1 | Low | 96 Ų | 96 | 122.4 Ų | 122.4 | 58% | 0.582 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -65.3 | -37.4 | 176.6 | 168.5 | 0 | 0 | 0 | 0 | 111.6 | R205 V206 | R205-V209 WeakPolarHBondContact O-CB 3.49Å; R205-V209 WeakPolarHBondContact O-CG2 3.34Å; R205-V209 PolarHBondContact O-N 2.85Å; V206-V209 PolarHBondContact O-N 2.87Å |
| 210 | F | 49.2 | Very low | 51.9 | Low | 158 Ų | 158 | 125.6 Ų | 125.6 | 69% | 0.693 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -78.1 | -23.6 | 175.6 | -81.9 | -75.4 | 0 | 0 | 0 | 113.7 | V206 L207 N208 | V206-F210 HydrophobicContact CG1-CD2 3.62Å; V206-F210 HydrophobicContact CG1-CE2 3.74Å; V206-F210 WeakPolarHBondContact O-CB 3.46Å; V206-F210 WeakPolarHBondContact O-CD2 3.26Å; V206-F210 PolarHBondContact O-N 2.79Å; L207-F210 PolarHBondContact O-N 3.44Å; N208-F210 VanDerWaalsContact C-N 3.34Å; N208-F210 PolarHBondContact O-N 3.41Å |
| 211 | T | 48.5 | Very low | 51.5 | Low | 93 Ų | 93 | 127.9 Ų | 127.9 | 57% | 0.571 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -90 | -17.9 | 173.8 | 51.5 | 0 | 0 | 0 | 0 | 113.3 | L207 N208 S213 G214 | L207-T211 VanDerWaalsContact O-CB 3.29Å; L207-T211 WeakPolarHBondContact O-CB 3.15Å; L207-T211 VanDerWaalsContact O-CG2 3.29Å; L207-T211 WeakPolarHBondContact O-CG2 3.4Å; L207-T211 PolarHBondContact O-N 3Å; L207-T211 PolarHBondContact O-OG1 3.31Å; N208-T211 WeakPolarHBondContact CA-OG1 3.33Å; N208-T211 PolarHBondContact O-N 3.35Å; N208-T211 PolarHBondContact O-OG1 2.93Å; T211-S213 VanDerWaalsContact C-N 3.29Å; T211-S213 PolarHBondContact O-N 2.6Å; T211-G214 PolarHBondContact O-N 2.96Å |
| 212 | V | 46 | Very low | 51.1 | Low | 94 Ų | 94 | 131 Ų | 131 | 57% | 0.57 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.2 | -2.8 | 173 | 166.8 | 0 | 0 | 0 | 0 | 113 | N208 | N208-V212 WeakPolarHBondContact O-CB 3.26Å; N208-V212 WeakPolarHBondContact O-CG2 3.39Å; N208-V212 PolarHBondContact O-N 3.42Å |
| 213 | S | 49 | Very low | 50.5 | Low | 113 Ų | 113 | 133.8 Ų | 133.8 | 79% | 0.79 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -1.8 | 163.5 | -88.2 | 0 | 0 | 0 | 0 | 114.1 | T211 | T211-S213 VanDerWaalsContact C-N 3.29Å; T211-S213 PolarHBondContact O-N 2.6Å |
| 214 | G | 45.6 | Very low | 49.9 | Very low | 67 Ų | 67 | 136.7 Ų | 136.7 | 69% | 0.691 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -104.5 | 0.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115 | T211 | T211-G214 PolarHBondContact O-N 2.96Š|
| 215 | H | 47.3 | Very low | 49.3 | Very low | 147 Ų | 147 | 136.9 Ų | 136.9 | 68% | 0.681 | 71% | 0.711 | S | S | * | * | trans | -128.8 | 48.3 | -178 | -155.6 | 66.9 | 0 | 0 | 0 | 112.3 | ||||
| 216 | M | 49.1 | Very low | 48.8 | Very low | 163 Ų | 163 | 133.4 Ų | 133.4 | 80% | 0.803 | 71% | 0.714 | S | S | * | * | trans | -91.6 | 143.7 | 152 | -91.2 | 165.1 | 53 | 0 | 0 | 108.4 | ||||
| 217 | D | 48.1 | Very low | 48.2 | Very low | 149 Ų | 149 | 135.9 Ų | 135.9 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | S | Bend | trans | 85.7 | 65.1 | 176.3 | -67.3 | -39.4 | 0 | 0 | 0 | 119.2 | ||
| 218 | R | 50.6 | Low | 47.9 | Very low | 219 Ų | 219 | 139.7 Ų | 139.7 | 83% | 0.826 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -156.7 | -13.6 | 140.1 | -111.8 | 159.3 | -162.9 | -179.1 | 5.5 | 118.2 | ||
| 219 | H | 46.8 | Very low | 47.6 | Very low | 162 Ų | 162 | 139.8 Ų | 139.8 | 75% | 0.75 | 77% | 0.768 | S | S | * | * | S | Bend | trans | -102.3 | -9.9 | -178.2 | -84.1 | -54.6 | 0 | 0 | 0 | 116.9 | R221 | H219-R221 VanDerWaalsContact C-N 3.33Å; H219-R221 PolarHBondContact O-N 2.78Å |
| 220 | A | 46.7 | Very low | 47.2 | Very low | 103 Ų | 103 | 142.6 Ų | 142.6 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -3.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 221 | R | 44.9 | Very low | 47.1 | Very low | 236 Ų | 236 | 143.3 Ų | 143.3 | 89% | 0.891 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109 | 32.2 | -175.6 | -154 | -173 | -162.5 | -137 | 2.2 | 113.8 | H219 | H219-R221 VanDerWaalsContact C-N 3.33Å; H219-R221 PolarHBondContact O-N 2.78Å |
| 222 | R | 45.7 | Very low | 46.9 | Very low | 222 Ų | 222 | 150.6 Ų | 150.6 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | S | Bend | trans | -137.7 | 1.4 | 177.9 | -131.2 | 170.3 | -173 | 116.3 | 0.8 | 117.4 | ||
| 223 | E | 44.5 | Very low | 47 | Very low | 176 Ų | 176 | 153.5 Ų | 153.5 | 82% | 0.822 | 84% | 0.836 | S | S | * | * | S | Bend | trans | -110.9 | 2.5 | -176.4 | -62.8 | -166.1 | 170.1 | 0 | 0 | 115.5 | ||
| 224 | T | 47.3 | Very low | 46.9 | Very low | 141 Ų | 141 | 155.6 Ų | 155.6 | 87% | 0.865 | 84% | 0.838 | S | S | * | * | S | Bend | trans | -99.8 | 14.7 | 178.5 | 38.4 | 0 | 0 | 0 | 0 | 115.4 | ||
| 225 | A | 45.9 | Very low | 47 | Very low | 99 Ų | 99 | 160.5 Ų | 160.5 | 82% | 0.818 | 85% | 0.846 | S | S | * | * | S | Bend | trans | -120.6 | 12.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 226 | S | 45.1 | Very low | 46.9 | Very low | 109 Ų | 109 | 161.3 Ų | 161.3 | 76% | 0.762 | 86% | 0.856 | S | S | * | * | S | Bend | trans | -116.4 | 9.6 | -177.3 | 78.9 | 0 | 0 | 0 | 0 | 116.1 | ||
| 227 | S | 47.8 | Very low | 46.8 | Very low | 118 Ų | 118 | 161.2 Ų | 161.2 | 83% | 0.825 | 86% | 0.859 | S | S | * | * | S | Bend | trans | -104.3 | 13.7 | -176.3 | -156.6 | 0 | 0 | 0 | 0 | 115.5 | ||
| 228 | L | 48.9 | Very low | 46.7 | Very low | 175 Ų | 175 | 162 Ų | 162 | 92% | 0.916 | 86% | 0.864 | S | S | * | * | S | Bend | trans | -120.6 | 12.4 | -179.6 | -82.3 | 176.3 | 0 | 0 | 0 | 115.4 | ||
| 229 | A | 49.9 | Very low | 46.4 | Very low | 96 Ų | 96 | 157.9 Ų | 157.9 | 79% | 0.793 | 87% | 0.866 | S | S | * | * | S | Bend | trans | -116 | 17.7 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 230 | N | 44.1 | Very low | 46.4 | Very low | 155 Ų | 155 | 157.6 Ų | 157.6 | 83% | 0.829 | 88% | 0.875 | S | S | * | * | S | Bend | trans | -133.9 | 53.8 | 177.1 | -156.4 | 32.1 | 0 | 0 | 0 | 113.2 | ||
| 231 | L | 47.9 | Very low | 46.4 | Very low | 173 Ų | 173 | 162.2 Ų | 162.2 | 91% | 0.906 | 88% | 0.877 | S | S | * | * | trans | -147 | 91.6 | 157.9 | -106.8 | 115.3 | 0 | 0 | 0 | 108.2 | ||||
| 232 | I | 44.7 | Very low | 46.5 | Very low | 246 Ų | 246 | 155.5 Ų | 155.5 | 100% | 1.262 | 88% | 0.876 | S | S | * | * | trans | -158.6 | 0 | 147.6 | -94.4 | 154.7 | 0 | 0 | 0 | 106.3 |
Retrieved 232 of 232 residues in 58.2 ms
(Link to these results)