| 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 | 45.4 | Very low | 50.5 | Low | 235 Ų | 235 | 143.7 Ų | 143.7 | 100% | 1.158 | 77% | 0.766 | S | S | * | * | 0 | 153.6 | 0 | -70.8 | -56.3 | -174.1 | 0 | 0 | 108.9 | |||||
| 2 | P | 48.1 | Very low | 50.4 | Low | 119 Ų | 119 | 141.3 Ų | 141.3 | 77% | 0.773 | 75% | 0.753 | S | S | * | * | cis | -113.1 | 153.4 | 2.2 | 38.2 | -28.3 | 0 | 0 | 0 | 114.2 | ||||
| 3 | A | 53 | Low | 50.6 | Low | 97 Ų | 97 | 146.5 Ų | 146.5 | 80% | 0.802 | 76% | 0.756 | S | S | * | * | trans | -114.4 | 133.6 | 156.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 4 | S | 52.9 | Low | 50.3 | Low | 94 Ų | 94 | 144.7 Ų | 144.7 | 66% | 0.657 | 75% | 0.748 | S | S | * | * | trans | -179.4 | -25.5 | 168.2 | 53.6 | 0 | 0 | 0 | 0 | 115.6 | S6 R7 | S4-S6 VanDerWaalsContact C-N 3.26Å; S4-S6 PolarHBondContact O-N 3.49Å; S4-R7 PolarHBondContact O-N 2.98Å | ||
| 5 | Q | 54.8 | Low | 50.3 | Low | 148 Ų | 148 | 142.5 Ų | 142.5 | 69% | 0.692 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -55.7 | -32.4 | -160.3 | -159.2 | -178.7 | 85.2 | 0 | 0 | 115.1 | R7 A8 | Q5-R7 VanDerWaalsContact C-N 3.27Å; Q5-R7 PolarHBondContact O-N 2.9Å; Q5-A8 PolarHBondContact O-N 2.68Å |
| 6 | S | 48.5 | Very low | 50.3 | Low | 114 Ų | 114 | 140.4 Ų | 140.4 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -62 | -27.9 | 178.2 | -47.5 | 0 | 0 | 0 | 0 | 114.2 | S4 | S4-S6 VanDerWaalsContact C-N 3.26Å; S4-S6 PolarHBondContact O-N 3.49Å |
| 7 | R | 51.5 | Low | 50.4 | Low | 227 Ų | 227 | 141.2 Ų | 141.2 | 86% | 0.857 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -79.9 | -20.9 | -174.8 | -144.1 | 175.3 | -165.9 | 174.5 | 4.9 | 113.2 | S4 Q5 | S4-R7 PolarHBondContact O-N 2.98Å; Q5-R7 VanDerWaalsContact C-N 3.27Å; Q5-R7 PolarHBondContact O-N 2.9Å |
| 8 | A | 48.1 | Very low | 50.4 | Low | 68 Ų | 68 | 140.7 Ų | 140.7 | 56% | 0.562 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -71.2 | -49.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q5 A10 R11 | Q5-A8 PolarHBondContact O-N 2.68Å; A8-A10 PolarHBondContact O-N 2.78Å; A8-A10 VanDerWaalsContact O-N 3.12Å; A8-R11 PolarHBondContact O-N 3.05Å; A8-R11 VanDerWaalsContact O-N 3.11Å |
| 9 | R | 51.8 | Low | 50.4 | Low | 191 Ų | 191 | 143.3 Ų | 143.3 | 72% | 0.721 | 74% | 0.735 | S | S | * | * | H | α-helix | trans | -63.2 | -19.3 | -177.4 | -73.8 | -177.6 | 173.3 | 146.4 | -0.4 | 114.4 | ||
| 10 | A | 48.1 | Very low | 50.6 | Low | 72 Ų | 72 | 140.4 Ų | 140.4 | 60% | 0.595 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -74 | -31.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | A8 | A8-A10 PolarHBondContact O-N 2.78Å; A8-A10 VanDerWaalsContact O-N 3.12Å |
| 11 | R | 52.8 | Low | 50.4 | Low | 216 Ų | 216 | 139.5 Ų | 139.5 | 82% | 0.815 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -77.5 | -34 | -174.9 | -165 | 172.5 | -175.5 | 126.6 | 1.1 | 112.7 | A8 R13 N14 | A8-R11 PolarHBondContact O-N 3.05Å; A8-R11 VanDerWaalsContact O-N 3.11Å; R11-R13 PolarHBondContact O-N 2.79Å; R11-N14 PolarHBondContact O-N 2.99Å |
| 12 | D | 49.7 | Very low | 50.4 | Low | 114 Ų | 114 | 137.3 Ų | 137.3 | 61% | 0.61 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -58.9 | -46.8 | -179.5 | -172.1 | -109.4 | 0 | 0 | 0 | 112.7 | N14 N15 | D12-N14 PolarHBondContact O-N 3.15Å; D12-N14 VanDerWaalsContact O-N 3.08Å; D12-N15 WeakPolarHBondContact O-CB 3.5Å; D12-N15 PolarHBondContact O-N 3.08Å |
| 13 | R | 52.5 | Low | 50.3 | Low | 210 Ų | 210 | 138.9 Ų | 138.9 | 79% | 0.792 | 71% | 0.711 | S | S | * | * | H | α-helix | trans | -57.8 | -24.2 | 177.7 | -83.3 | -176.8 | 166.5 | 173.8 | -4 | 115 | R11 | R11-R13 PolarHBondContact O-N 2.79Å |
| 14 | N | 46.7 | Very low | 50.1 | Low | 121 Ų | 121 | 138.3 Ų | 138.3 | 65% | 0.647 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -79 | -24.6 | 178.4 | -168.2 | -115 | 0 | 0 | 0 | 112.1 | R11 D12 | R11-N14 PolarHBondContact O-N 2.99Å; D12-N14 PolarHBondContact O-N 3.15Å; D12-N14 VanDerWaalsContact O-N 3.08Å |
| 15 | N | 50.7 | Low | 49.9 | Very low | 112 Ų | 112 | 141.3 Ų | 141.3 | 60% | 0.599 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -77.5 | -26.1 | -177.5 | -151.5 | 7.5 | 0 | 0 | 0 | 112.7 | D12 L17 N18 | D12-N15 WeakPolarHBondContact O-CB 3.5Å; D12-N15 PolarHBondContact O-N 3.08Å; N15-L17 PolarHBondContact O-N 2.79Å; N15-N18 PolarHBondContact O-N 2.94Å |
| 16 | V | 50.8 | Low | 49.4 | Very low | 109 Ų | 109 | 141.4 Ų | 141.4 | 66% | 0.661 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -62.7 | -25.3 | 178.2 | -173.8 | 0 | 0 | 0 | 0 | 112.4 | N18 | V16-N18 VanDerWaalsContact C-N 3.25Å; V16-N18 PolarHBondContact O-N 3.32Å |
| 17 | L | 51.4 | Low | 49.5 | Very low | 154 Ų | 154 | 142.9 Ų | 142.9 | 81% | 0.806 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -76.2 | -9.5 | 175 | -67.1 | 171.7 | 0 | 0 | 0 | 113.5 | N15 | N15-L17 PolarHBondContact O-N 2.79Š|
| 18 | N | 50.3 | Low | 49.3 | Very low | 132 Ų | 132 | 137.1 Ų | 137.1 | 71% | 0.706 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -107.5 | 35.5 | -177.5 | -166 | 41 | 0 | 0 | 0 | 112.7 | N15 V16 | N15-N18 PolarHBondContact O-N 2.94Å; V16-N18 VanDerWaalsContact C-N 3.25Å; V16-N18 PolarHBondContact O-N 3.32Å |
| 19 | R | 50.6 | Low | 49.3 | Very low | 190 Ų | 190 | 139.9 Ų | 139.9 | 72% | 0.717 | 71% | 0.712 | S | S | * | * | trans | -95.9 | 123.4 | 169.7 | -163.6 | -179 | 174.9 | 114.4 | 1.2 | 109.8 | E21 | R19-E21 HydrophobicContact CG-CG 4.06Å; R19-E21 IonicContact CZ-OE1 3.8Å; R19-E21 IonicContact NE-OE1 2.85Å; R19-E21 PolarHBondContact NE-OE1 3.3Å; R19-E21 IonicContact NH2-OE1 3.85Å; R19-E21 PolarHBondContact O-N 3.24Å | ||
| 20 | A | 53.6 | Low | 48.8 | Very low | 84 Ų | 84 | 140.4 Ų | 140.4 | 69% | 0.694 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -74.9 | 30.2 | -162.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | F22 | A20-F22 VanDerWaalsContact C-N 3.33Å; A20-F22 PolarHBondContact O-N 3.31Å |
| 21 | E | 48 | Very low | 48.5 | Very low | 123 Ų | 123 | 140.6 Ų | 140.6 | 58% | 0.575 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -73.5 | -23.9 | -177.5 | -43.2 | -75.4 | 129.3 | 0 | 0 | 112.3 | R19 | R19-E21 HydrophobicContact CG-CG 4.06Å; R19-E21 IonicContact CZ-OE1 3.8Å; R19-E21 IonicContact NE-OE1 2.85Å; R19-E21 PolarHBondContact NE-OE1 3.3Å; R19-E21 IonicContact NH2-OE1 3.85Å; R19-E21 PolarHBondContact O-N 3.24Å |
| 22 | F | 44.9 | Very low | 47.7 | Very low | 189 Ų | 189 | 133.6 Ų | 133.6 | 83% | 0.829 | 72% | 0.724 | S | S | * | * | G | 310 helix | trans | -89.3 | -1.3 | -168.9 | -96.1 | -89.9 | 0 | 0 | 0 | 116.7 | A20 | A20-F22 VanDerWaalsContact C-N 3.33Å; A20-F22 PolarHBondContact O-N 3.31Å |
| 23 | L | 46.6 | Very low | 47.4 | Very low | 152 Ų | 152 | 134.4 Ų | 134.4 | 80% | 0.796 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -93.9 | -13.8 | 177.2 | -81.2 | 91 | 0 | 0 | 0 | 114.4 | ||
| 24 | S | 47.3 | Very low | 46.9 | Very low | 84 Ų | 84 | 132.5 Ų | 132.5 | 59% | 0.587 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.7 | 3.1 | -171.4 | -163.7 | 0 | 0 | 0 | 0 | 115.8 | ||
| 25 | L | 48.7 | Very low | 47.2 | Very low | 157 Ų | 157 | 131.3 Ų | 131.3 | 82% | 0.822 | 74% | 0.735 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 0.2 | -178.7 | -94.7 | 163.9 | 0 | 0 | 0 | 115 | ||
| 26 | N | 45.1 | Very low | 46.4 | Very low | 151 Ų | 151 | 136.9 Ų | 136.9 | 81% | 0.807 | 75% | 0.747 | S | S | * | * | trans | -113 | 33.4 | 174.3 | -79.5 | -64.4 | 0 | 0 | 0 | 112.7 | P28 | N26-P28 VanDerWaalsContact O-CD 3.31Å; N26-P28 WeakPolarHBondContact O-CD 3.07Å | ||
| 27 | Q | 49.5 | Very low | 45.8 | Very low | 144 Ų | 144 | 137.3 Ų | 137.3 | 67% | 0.673 | 76% | 0.755 | S | S | * | * | trans | -88.7 | 109.7 | 164.4 | -73.9 | -165.7 | 87.3 | 0 | 0 | 109.3 | ||||
| 28 | P | 48.8 | Very low | 45.1 | Very low | 106 Ų | 106 | 135.8 Ų | 135.8 | 69% | 0.688 | 76% | 0.757 | S | S | * | * | trans | -63.8 | 145.3 | 166 | 28.7 | -33.9 | 0 | 0 | 0 | 109.1 | N26 K30 | N26-P28 VanDerWaalsContact O-CD 3.31Å; N26-P28 WeakPolarHBondContact O-CD 3.07Å; P28-K30 PolarHBondContact O-N 3.31Å; P28-K30 VanDerWaalsContact O-N 3.12Å | ||
| 29 | P | 46.8 | Very low | 44.3 | Very low | 126 Ų | 126 | 132.7 Ų | 132.7 | 82% | 0.818 | 76% | 0.756 | S | S | * | * | trans | -60.8 | 120.4 | 174.7 | 25.5 | -33 | 0 | 0 | 0 | 109 | G31 | P29-G31 PolarHBondContact O-N 3.11Å; P29-G31 VanDerWaalsContact O-N 3.08Å | ||
| 30 | K | 43.1 | Very low | 43.7 | Very low | 203 Ų | 203 | 134.6 Ų | 134.6 | 88% | 0.883 | 76% | 0.763 | S | S | * | * | trans | -61.2 | 114.1 | 173.8 | -76.3 | -178.7 | 175.9 | 176.9 | 0 | 108.6 | P28 G32 | P28-K30 PolarHBondContact O-N 3.31Å; P28-K30 VanDerWaalsContact O-N 3.12Å; K30-G32 PolarHBondContact O-N 3.19Å; K30-G32 VanDerWaalsContact O-N 3.15Å | ||
| 31 | G | 40.7 | Very low | 42.9 | Very low | 76 Ų | 76 | 139.9 Ų | 139.9 | 78% | 0.784 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 116.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | P29 | P29-G31 PolarHBondContact O-N 3.11Å; P29-G31 VanDerWaalsContact O-N 3.08Å |
| 32 | G | 36.9 | Very low | 42.2 | Very low | 69 Ų | 69 | 138.1 Ų | 138.1 | 71% | 0.711 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 139.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110 | K30 | K30-G32 PolarHBondContact O-N 3.19Å; K30-G32 VanDerWaalsContact O-N 3.15Å |
| 33 | P | 41.5 | Very low | 41.7 | Very low | 131 Ų | 131 | 135 Ų | 135 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 128.2 | -178.8 | 30.3 | -34.1 | 0 | 0 | 0 | 112.5 | ||
| 34 | E | 43.1 | Very low | 41.2 | Very low | 169 Ų | 169 | 131.3 Ų | 131.3 | 79% | 0.79 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 162.1 | 146 | -87.3 | -84.7 | 83.6 | 0 | 0 | 110.9 | ||
| 35 | P | 52.1 | Low | 41.6 | Very low | 97 Ų | 97 | 133.6 Ų | 133.6 | 63% | 0.63 | 79% | 0.79 | S | S | * | * | cis | -135.1 | -178.9 | 11.1 | 41.8 | -26 | 0 | 0 | 0 | 115.3 | ||||
| 36 | R | 35.2 | Very low | 40.9 | Very low | 229 Ų | 229 | 131.8 Ų | 131.8 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | -178.4 | 107.7 | 125.7 | -100 | 161.5 | -177.3 | -167.4 | 1.1 | 116.4 | |||||
| 37 | S | 38 | Very low | 40.4 | Very low | 118 Ų | 118 | 129.1 Ų | 129.1 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | 38.3 | 137.2 | 126.5 | -162.7 | 0 | 0 | 0 | 0 | 123.1 | |||||
| 38 | S | 36 | Very low | 39.6 | Very low | 121 Ų | 121 | 131 Ų | 131 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | trans | 103 | 126.1 | 153.2 | -161.4 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 39 | G | 34.4 | Very low | 40 | Very low | 67 Ų | 67 | 131 Ų | 131 | 69% | 0.691 | 80% | 0.798 | S | S | * | * | cis | 164.1 | 168 | -11.2 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 40 | R | 37.2 | Very low | 40.8 | Very low | 230 Ų | 230 | 130.6 Ų | 130.6 | 87% | 0.868 | 80% | 0.796 | S | S | * | * | trans | 75.1 | 111.9 | 156.5 | -67.5 | -177.4 | 165.6 | -167.9 | -2.5 | 122.8 | ||||
| 41 | K | 37.5 | Very low | 41.3 | Very low | 195 Ų | 195 | 126.2 Ų | 126.2 | 85% | 0.848 | 79% | 0.788 | S | S | * | * | 79.1 | 117.6 | 126.4 | -69.5 | -171.1 | 170.4 | -165.2 | 0 | 123.6 | |||||
| 42 | A | 33.3 | Very low | 41 | Very low | 86 Ų | 86 | 127.8 Ų | 127.8 | 71% | 0.711 | 79% | 0.794 | S | S | * | * | -174.4 | 122.1 | 126.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | |||||
| 43 | S | 34.3 | Very low | 40.8 | Very low | 123 Ų | 123 | 128.4 Ų | 128.4 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | 53.5 | 124.7 | 74.4 | 64 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 44 | G | 36.8 | Very low | 40.8 | Very low | 75 Ų | 75 | 130.5 Ų | 130.5 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | cis | -164.8 | -166.9 | 5.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 45 | P | 55.8 | Low | 40.2 | Very low | 132 Ų | 132 | 125.6 Ų | 125.6 | 86% | 0.857 | 80% | 0.799 | S | S | * | * | trans | -111.8 | 171.4 | -161.2 | 41.3 | -36 | 0 | 0 | 0 | 117.1 | ||||
| 46 | S | 32.5 | Very low | 39.8 | Very low | 120 Ų | 120 | 125.9 Ų | 125.9 | 84% | 0.839 | 81% | 0.81 | S | S | * | * | 167.6 | 155.4 | 125 | -160.8 | 0 | 0 | 0 | 0 | 116.6 | |||||
| 47 | A | 34.6 | Very low | 39.9 | Very low | 95 Ų | 95 | 126.3 Ų | 126.3 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | 82.7 | 146 | 147.2 | 0 | 0 | 0 | 0 | 0 | 125.3 | ||||
| 48 | Q | 33.6 | Very low | 39.9 | Very low | 184 Ų | 184 | 128 Ų | 128 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | -156.9 | 178.6 | 176 | -92 | -166.2 | -65.9 | 0 | 0 | 106.9 | ||||
| 49 | P | 56.9 | Low | 40.3 | Very low | 104 Ų | 104 | 134.4 Ų | 134.4 | 68% | 0.675 | 81% | 0.812 | S | S | * | * | cis | -133.4 | -139.4 | -37.9 | 38.1 | -17 | 0 | 0 | 0 | 110.2 | ||||
| 50 | P | 64.1 | Low | 40.4 | Very low | 118 Ų | 118 | 141.1 Ų | 141.1 | 77% | 0.766 | 82% | 0.816 | S | S | * | * | -98.4 | -97.1 | -63 | 29.1 | -9.1 | 0 | 0 | 0 | 111 | |||||
| 51 | P | 52.6 | Low | 40.1 | Very low | 111 Ų | 111 | 136.9 Ų | 136.9 | 72% | 0.721 | 81% | 0.806 | S | S | * | * | cis | -127.9 | 168.4 | -21.2 | 42.1 | -26.2 | 0 | 0 | 0 | 117.1 | ||||
| 52 | A | 35.7 | Very low | 40.1 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 90% | 0.901 | 81% | 0.809 | S | S | * | * | trans | 66.1 | 142.1 | 152.8 | 0 | 0 | 0 | 0 | 0 | 123.3 | ||||
| 53 | G | 32.3 | Very low | 40.3 | Very low | 83 Ų | 83 | 136.4 Ų | 136.4 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | 161.3 | 101 | 167.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 54 | D | 39.9 | Very low | 39.9 | Very low | 175 Ų | 175 | 139.7 Ų | 139.7 | 94% | 0.936 | 81% | 0.809 | S | S | * | * | trans | -90.1 | 158.6 | 171.8 | -162.9 | -66.7 | 0 | 0 | 0 | 110.9 | ||||
| 55 | G | 32 | Very low | 40.4 | Very low | 65 Ų | 65 | 143.7 Ų | 143.7 | 67% | 0.67 | 81% | 0.811 | S | S | * | * | trans | 153.6 | 87.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | R57 | G55-R57 PolarHBondContact O-N 3.13Š| ||
| 56 | A | 42.3 | Very low | 39.9 | Very low | 103 Ų | 103 | 141.7 Ų | 141.7 | 85% | 0.851 | 80% | 0.799 | S | S | * | * | trans | -66.6 | 129.3 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 57 | R | 37.6 | Very low | 40.2 | Very low | 239 Ų | 239 | 145 Ų | 145 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | trans | -142.5 | 159.6 | 164.6 | -73.6 | -165.2 | 173.9 | -161.4 | -1.5 | 111.4 | G55 | G55-R57 PolarHBondContact O-N 3.13Š| ||
| 58 | E | 38.1 | Very low | 40.6 | Very low | 153 Ų | 153 | 147.4 Ų | 147.4 | 72% | 0.715 | 80% | 0.796 | S | S | * | * | trans | 59 | 66.6 | 168.3 | -63.5 | -77.4 | 37.1 | 0 | 0 | 117.1 | R60 | E58-R60 PolarHBondContact O-N 3.12Š| ||
| 59 | R | 43.9 | Very low | 41.1 | Very low | 256 Ų | 256 | 145 Ų | 145 | 97% | 0.966 | 79% | 0.789 | S | S | * | * | trans | -70.2 | 56 | 151.4 | -173.8 | -154.6 | 164.6 | -159.8 | -2.8 | 110.5 | ||||
| 60 | R | 38.1 | Very low | 40.3 | Very low | 208 Ų | 208 | 143.9 Ų | 143.9 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | trans | -152.4 | 156.9 | 174.1 | -82.9 | -164.2 | 175.1 | -95.4 | 0.7 | 110.1 | E58 | E58-R60 PolarHBondContact O-N 3.12Š| ||
| 61 | Q | 30.4 | Very low | 39.2 | Very low | 140 Ų | 140 | 144.8 Ų | 144.8 | 65% | 0.654 | 78% | 0.778 | S | S | * | * | trans | 62.6 | 85.6 | 168.2 | -151.4 | 178.2 | 111 | 0 | 0 | 113.2 | Q63 | Q61-Q63 HydrophobicContact CG-CB 4Å; Q61-Q63 HydrophobicContact CG-CG 3.9Å; Q61-Q63 PolarHBondContact O-N 2.7Å | ||
| 62 | S | 38.1 | Very low | 38.7 | Very low | 131 Ų | 131 | 148.8 Ų | 148.8 | 92% | 0.916 | 79% | 0.787 | S | S | * | * | 53.5 | 5 | 70.1 | -158.9 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 63 | Q | 36 | Very low | 39.2 | Very low | 141 Ų | 141 | 150.5 Ų | 150.5 | 66% | 0.659 | 78% | 0.78 | S | S | * | * | trans | -146.8 | 87.3 | 176.8 | -70 | -172.6 | 59.4 | 0 | 0 | 112 | Q61 | Q61-Q63 HydrophobicContact CG-CB 4Å; Q61-Q63 HydrophobicContact CG-CG 3.9Å; Q61-Q63 PolarHBondContact O-N 2.7Å | ||
| 64 | Q | 26.3 | Very low | 39.6 | Very low | 191 Ų | 191 | 151.1 Ų | 151.1 | 89% | 0.893 | 76% | 0.764 | S | S | * | * | trans | -160.2 | 120.8 | 135.4 | -139.6 | 153.5 | -115.6 | 0 | 0 | 110.7 | ||||
| 65 | L | 47.8 | Very low | 40 | Very low | 159 Ų | 159 | 148.4 Ų | 148.4 | 83% | 0.832 | 76% | 0.756 | S | S | * | * | trans | -67.2 | 142.7 | 155.7 | -64.5 | 160.1 | 0 | 0 | 0 | 106.7 | ||||
| 66 | P | 45.5 | Very low | 40.9 | Very low | 91 Ų | 91 | 148 Ų | 148 | 59% | 0.591 | 74% | 0.743 | S | S | * | * | -158 | 83.7 | 86.6 | 38.8 | -16 | 0 | 0 | 0 | 115.1 | E68 | P66-E68 HydrophobicContact CB-CG 4.34Š| |||
| 67 | E | 38.3 | Very low | 41.2 | Very low | 188 Ų | 188 | 150.2 Ų | 150.2 | 88% | 0.879 | 73% | 0.734 | S | S | * | * | trans | -133.8 | 81.5 | 160.6 | -89.5 | 159 | 87.6 | 0 | 0 | 105.5 | ||||
| 68 | E | 43.1 | Very low | 41.9 | Very low | 147 Ų | 147 | 144.9 Ų | 144.9 | 69% | 0.687 | 72% | 0.717 | S | S | * | * | 58.4 | 24 | 52.1 | -58.9 | -135.9 | 104.4 | 0 | 0 | 114.1 | P66 C70 | P66-E68 HydrophobicContact CB-CG 4.34Å; E68-C70 HydrophobicContact CB-CB 4.36Å; E68-C70 CarbonylContact O-C 3.59Å; E68-C70 PolarHBondContact O-N 3.24Å | |||
| 69 | D | 43.9 | Very low | 42.8 | Very low | 133 Ų | 133 | 139.4 Ų | 139.4 | 71% | 0.711 | 70% | 0.701 | S | S | * | * | trans | -68.7 | 23.2 | 144.9 | -139.4 | -70.9 | 0 | 0 | 0 | 112.1 | M71 | D69-M71 PolarHBondContact O-N 3.25Å; D69-M71 WeakPolarHBondContact OD1-CG 3.47Å | ||
| 70 | C | 39.8 | Very low | 43.5 | Very low | 80 Ų | 80 | 131.4 Ų | 131.4 | 54% | 0.541 | 68% | 0.677 | S | S | . | * | trans | -46.2 | 57.2 | 130 | -60.1 | 0 | 0 | 0 | 0 | 112.2 | E68 Q72 | E68-C70 HydrophobicContact CB-CB 4.36Å; E68-C70 CarbonylContact O-C 3.59Å; E68-C70 PolarHBondContact O-N 3.24Å; C70-Q72 PolarHBondContact O-N 2.82Å | ||
| 71 | M | 41.4 | Very low | 44.7 | Very low | 137 Ų | 137 | 123.5 Ų | 123.5 | 68% | 0.675 | 66% | 0.656 | S | S | * | * | trans | -52 | 123.5 | 165.1 | -85.4 | -155.4 | -169.6 | 0 | 0 | 107.9 | D69 L73 | D69-M71 PolarHBondContact O-N 3.25Å; D69-M71 WeakPolarHBondContact OD1-CG 3.47Å; M71-L73 PolarHBondContact O-N 3.43Å | ||
| 72 | Q | 42.9 | Very low | 46.1 | Very low | 195 Ų | 195 | 122.9 Ų | 122.9 | 91% | 0.911 | 65% | 0.652 | S | S | * | * | trans | -69.4 | 54.8 | -160.7 | -164.5 | 177.4 | 94 | 0 | 0 | 112.8 | C70 N74 | C70-Q72 PolarHBondContact O-N 2.82Å; Q72-N74 PolarHBondContact O-N 2.86Å | ||
| 73 | L | 44.7 | Very low | 47 | Very low | 145 Ų | 145 | 121.8 Ų | 121.8 | 76% | 0.759 | 64% | 0.635 | S | S | * | * | trans | -77 | 54 | -178.5 | -71.9 | 167.4 | 0 | 0 | 0 | 111.1 | M71 | M71-L73 PolarHBondContact O-N 3.43Š| ||
| 74 | N | 42.1 | Very low | 48 | Very low | 97 Ų | 97 | 117.7 Ų | 117.7 | 52% | 0.519 | 62% | 0.622 | S | S | . | * | trans | 37.8 | 123.5 | 160 | -164.2 | -26.9 | 0 | 0 | 0 | 115.9 | Q72 S76 F77 | Q72-N74 PolarHBondContact O-N 2.86Å; N74-S76 VanDerWaalsContact CG-CB 3.4Å; N74-S76 CarbonylContact O-C 3.51Å; N74-S76 PolarHBondContact O-N 3.09Å; N74-S76 WeakPolarHBondContact OD1-CB 3.31Å; N74-S76 PolarHBondContact OD1-N 2.97Å; N74-F77 PolarHBondContact O-N 3.37Å | ||
| 75 | P | 47.3 | Very low | 49.7 | Very low | 117 Ų | 117 | 110.7 Ų | 110.7 | 76% | 0.76 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -51.2 | -22.4 | 173.3 | 21.8 | -33.8 | 0 | 0 | 0 | 113.6 | G79 | P75-G79 PolarHBondContact O-N 3.49Å |
| 76 | S | 50.4 | Low | 50.3 | Low | 57 Ų | 57 | 106.8 Ų | 106.8 | 40% | 0.399 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -48.6 | -48.9 | 163.8 | -170.9 | 0 | 0 | 0 | 0 | 114.9 | N74 G79 I80 | N74-S76 VanDerWaalsContact CG-CB 3.4Å; N74-S76 CarbonylContact O-C 3.51Å; N74-S76 PolarHBondContact O-N 3.09Å; N74-S76 WeakPolarHBondContact OD1-CB 3.31Å; N74-S76 PolarHBondContact OD1-N 2.97Å; S76-G79 CarbonylContact O-C 3.52Å; S76-G79 PolarHBondContact O-N 3.01Å; S76-I80 VanDerWaalsContact O-CB 3.31Å; S76-I80 WeakPolarHBondContact O-CB 3.49Å; S76-I80 WeakPolarHBondContact O-CD1 3.31Å; S76-I80 WeakPolarHBondContact O-CG1 3.17Å; S76-I80 PolarHBondContact O-N 2.94Å; S76-I80 VanDerWaalsContact OG-CD1 3.27Å; S76-I80 WeakPolarHBondContact OG-CD1 3.45Å |
| 77 | F | 50.4 | Low | 51.2 | Low | 149 Ų | 149 | 104.6 Ų | 104.6 | 65% | 0.654 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -68.3 | -46.2 | -173.5 | -172 | -100.1 | 0 | 0 | 0 | 112.5 | N74 G79 I80 A81 | N74-F77 PolarHBondContact O-N 3.37Å; F77-G79 VanDerWaalsContact C-N 3.29Å; F77-G79 PolarHBondContact O-N 2.89Å; F77-I80 PolarHBondContact O-N 2.96Å; F77-A81 WeakPolarHBondContact O-CB 3.4Å; F77-A81 PolarHBondContact O-N 3.05Å |
| 78 | K | 51.8 | Low | 52.5 | Low | 128 Ų | 128 | 100.3 Ų | 100.3 | 56% | 0.557 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -60.4 | -39.8 | 172.1 | 178.4 | 174.8 | 169.8 | 178.6 | 0 | 111.4 | F82 V134 | K78-F82 WeakPolarHBondContact O-CB 3.27Å; K78-F82 PolarHBondContact O-N 2.82Å; K78-F82 VanDerWaalsContact O-N 3.09Å; K78-V134 HydrophobicContact CD-CG2 4.09Å; K78-V134 VanDerWaalsContact CE-CG2 3.45Å; K78-V134 VanDerWaalsContact NZ-CG1 3.32Å |
| 79 | G | 56.8 | Low | 53.4 | Low | 37 Ų | 37 | 96.2 Ų | 96.2 | 38% | 0.381 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.1 | -43.2 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | P75 S76 F77 F82 N83 | P75-G79 PolarHBondContact O-N 3.49Å; S76-G79 CarbonylContact O-C 3.52Å; S76-G79 PolarHBondContact O-N 3.01Å; F77-G79 VanDerWaalsContact C-N 3.29Å; F77-G79 PolarHBondContact O-N 2.89Å; G79-F82 PolarHBondContact O-N 3.32Å; G79-N83 WeakPolarHBondContact O-CB 3.14Å; G79-N83 PolarHBondContact O-N 3.27Å |
| 80 | I | 59.3 | Low | 54.4 | Low | 89 Ų | 89 | 93.4 Ų | 93.4 | 46% | 0.456 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.9 | -43.4 | 178.2 | -74.6 | 163.8 | 0 | 0 | 0 | 110.2 | S76 F77 N83 S84 | S76-I80 VanDerWaalsContact O-CB 3.31Å; S76-I80 WeakPolarHBondContact O-CB 3.49Å; S76-I80 WeakPolarHBondContact O-CD1 3.31Å; S76-I80 WeakPolarHBondContact O-CG1 3.17Å; S76-I80 PolarHBondContact O-N 2.94Å; S76-I80 VanDerWaalsContact OG-CD1 3.27Å; S76-I80 WeakPolarHBondContact OG-CD1 3.45Å; F77-I80 PolarHBondContact O-N 2.96Å; I80-N83 PolarHBondContact O-N 3.36Å; I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.26Å; I80-S84 PolarHBondContact O-OG 3.5Å |
| 81 | A | 62.3 | Low | 55.3 | Low | 42 Ų | 42 | 93.1 Ų | 93.1 | 35% | 0.347 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -46.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | F77 S84 L85 | F77-A81 WeakPolarHBondContact O-CB 3.4Å; F77-A81 PolarHBondContact O-N 3.05Å; A81-S84 PolarHBondContact O-N 3.21Å; A81-L85 WeakPolarHBondContact O-CB 3.17Å; A81-L85 PolarHBondContact O-N 3.23Å |
| 82 | F | 60.2 | Low | 55.9 | Low | 127 Ų | 127 | 89.2 Ų | 89.2 | 56% | 0.557 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -68.4 | -40.6 | 178.1 | -167 | -107.3 | 0 | 0 | 0 | 112.8 | K78 G79 L85 L86 | K78-F82 WeakPolarHBondContact O-CB 3.27Å; K78-F82 PolarHBondContact O-N 2.82Å; K78-F82 VanDerWaalsContact O-N 3.09Å; G79-F82 PolarHBondContact O-N 3.32Å; F82-L85 PolarHBondContact O-N 3.43Å; F82-L86 HydrophobicContact CD1-CD1 3.8Å; F82-L86 HydrophobicContact CE1-CD1 3.52Å; F82-L86 HydrophobicContact CE1-CG 4.45Å; F82-L86 HydrophobicContact CZ-CD1 4.21Å; F82-L86 WeakPolarHBondContact O-CB 3.22Å; F82-L86 PolarHBondContact O-N 3.29Å |
| 83 | N | 56.7 | Low | 56.5 | Low | 108 Ų | 108 | 82.8 Ų | 82.8 | 58% | 0.578 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -65.8 | -39.6 | 175.2 | -174.5 | -91.2 | 0 | 0 | 0 | 111.6 | G79 I80 L86 A87 | G79-N83 WeakPolarHBondContact O-CB 3.14Å; G79-N83 PolarHBondContact O-N 3.27Å; I80-N83 PolarHBondContact O-N 3.36Å; N83-L86 PolarHBondContact O-N 2.71Å; N83-A87 VanDerWaalsContact O-CB 3.29Å; N83-A87 WeakPolarHBondContact O-CB 3.29Å; N83-A87 PolarHBondContact O-N 3.23Å |
| 84 | S | 56.4 | Low | 57.1 | Low | 54 Ų | 54 | 82.7 Ų | 82.7 | 38% | 0.378 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -66.7 | -41.7 | 175.1 | -58.2 | 0 | 0 | 0 | 0 | 111.3 | I80 A81 A87 I88 | I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.26Å; I80-S84 PolarHBondContact O-OG 3.5Å; A81-S84 PolarHBondContact O-N 3.21Å; S84-A87 PolarHBondContact O-N 3.27Å; S84-I88 WeakPolarHBondContact O-CB 3.23Å; S84-I88 WeakPolarHBondContact O-CD1 3.46Å; S84-I88 VanDerWaalsContact O-CG1 3.24Å; S84-I88 WeakPolarHBondContact O-CG1 3.2Å; S84-I88 PolarHBondContact O-N 3.41Å |
| 85 | L | 61.8 | Low | 57.6 | Low | 45 Ų | 45 | 87.2 Ų | 87.2 | 24% | 0.236 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -64.1 | -43.6 | 175.4 | -172.6 | 62.8 | 0 | 0 | 0 | 111.2 | A81 F82 I88 D89 I126 I130 | A81-L85 WeakPolarHBondContact O-CB 3.17Å; A81-L85 PolarHBondContact O-N 3.23Å; F82-L85 PolarHBondContact O-N 3.43Å; L85-I88 PolarHBondContact O-N 2.86Å; L85-D89 WeakPolarHBondContact O-CB 3.24Å; L85-D89 PolarHBondContact O-N 3.26Å; L85-I126 HydrophobicContact CD2-CG2 4.44Å; L85-I130 HydrophobicContact CD2-CD1 4.32Å |
| 86 | L | 61.7 | Low | 57.8 | Low | 76 Ų | 76 | 83.9 Ų | 83.9 | 40% | 0.398 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.7 | -40.2 | 171.3 | -92.5 | 163.7 | 0 | 0 | 0 | 112.7 | F82 N83 D89 I90 | F82-L86 HydrophobicContact CD1-CD1 3.8Å; F82-L86 HydrophobicContact CE1-CD1 3.52Å; F82-L86 HydrophobicContact CE1-CG 4.45Å; F82-L86 HydrophobicContact CZ-CD1 4.21Å; F82-L86 WeakPolarHBondContact O-CB 3.22Å; F82-L86 PolarHBondContact O-N 3.29Å; N83-L86 PolarHBondContact O-N 2.71Å; L86-D89 PolarHBondContact O-N 2.98Å; L86-I90 HydrophobicContact CD2-CD1 4.41Å; L86-I90 VanDerWaalsContact O-CB 3.26Å; L86-I90 WeakPolarHBondContact O-CB 3.42Å; L86-I90 WeakPolarHBondContact O-CD1 3.47Å; L86-I90 WeakPolarHBondContact O-CG1 3.47Å; L86-I90 PolarHBondContact O-N 3.44Å |
| 87 | A | 64.9 | Low | 57.9 | Low | 45 Ų | 45 | 83.5 Ų | 83.5 | 37% | 0.372 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -65.9 | -41 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | N83 S84 C91 | N83-A87 VanDerWaalsContact O-CB 3.29Å; N83-A87 WeakPolarHBondContact O-CB 3.29Å; N83-A87 PolarHBondContact O-N 3.23Å; S84-A87 PolarHBondContact O-N 3.27Å; A87-C91 WeakPolarHBondContact O-CB 3.29Å; A87-C91 PolarHBondContact O-N 3.11Å; A87-C91 PolarHBondContact O-SG 2.79Å |
| 88 | I | 65.3 | Low | 57.7 | Low | 99 Ų | 99 | 82.2 Ų | 82.2 | 51% | 0.508 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -63 | -49.9 | 173.3 | -69.4 | 162.3 | 0 | 0 | 0 | 110.1 | S84 L85 I90 C91 M92 | S84-I88 WeakPolarHBondContact O-CB 3.23Å; S84-I88 WeakPolarHBondContact O-CD1 3.46Å; S84-I88 VanDerWaalsContact O-CG1 3.24Å; S84-I88 WeakPolarHBondContact O-CG1 3.2Å; S84-I88 PolarHBondContact O-N 3.41Å; L85-I88 PolarHBondContact O-N 2.86Å; I88-I90 PolarHBondContact O-N 2.67Å; I88-C91 CarbonylContact O-C 3.51Å; I88-C91 PolarHBondContact O-N 2.78Å; I88-C91 VanDerWaalsContact O-N 3.16Å; I88-M92 HydrophobicContact CG2-CG 4.34Å; I88-M92 WeakPolarHBondContact O-CG 3.21Å; I88-M92 PolarHBondContact O-N 3.44Å |
| 89 | D | 61.3 | Low | 57.3 | Low | 61 Ų | 61 | 78.4 Ų | 78.4 | 33% | 0.326 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -60.9 | -43.9 | 179.2 | -177.9 | 78.1 | 0 | 0 | 0 | 112.7 | L85 L86 C91 M92 S93 | L85-D89 WeakPolarHBondContact O-CB 3.24Å; L85-D89 PolarHBondContact O-N 3.26Å; L86-D89 PolarHBondContact O-N 2.98Å; D89-C91 PolarHBondContact O-N 3.45Å; D89-M92 WeakPolarHBondContact O-CB 3.09Å; D89-M92 PolarHBondContact O-N 3.46Å; D89-S93 VanDerWaalsContact O-CB 3.26Å; D89-S93 WeakPolarHBondContact O-CB 3.17Å; D89-S93 PolarHBondContact O-N 3.45Å; D89-S93 PolarHBondContact O-OG 3.41Å |
| 90 | I | 64.1 | Low | 56.8 | Low | 74 Ų | 74 | 80.9 Ų | 80.9 | 38% | 0.379 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -67.3 | -35.5 | 175 | -69.8 | 167.6 | 0 | 0 | 0 | 111.2 | L86 I88 K94 | L86-I90 HydrophobicContact CD2-CD1 4.41Å; L86-I90 VanDerWaalsContact O-CB 3.26Å; L86-I90 WeakPolarHBondContact O-CB 3.42Å; L86-I90 WeakPolarHBondContact O-CD1 3.47Å; L86-I90 WeakPolarHBondContact O-CG1 3.47Å; L86-I90 PolarHBondContact O-N 3.44Å; I88-I90 PolarHBondContact O-N 2.67Å; I90-K94 HydrophobicContact CG2-CD 3.93Å; I90-K94 HydrophobicContact CG2-CG 4.46Å; I90-K94 VanDerWaalsContact O-CB 3.31Å; I90-K94 WeakPolarHBondContact O-CB 3.35Å; I90-K94 VanDerWaalsContact O-CG 3.27Å; I90-K94 WeakPolarHBondContact O-CG 3.25Å; I90-K94 PolarHBondContact O-N 2.92Å |
| 91 | C | 59.2 | Low | 56.1 | Low | 74 Ų | 74 | 78.9 Ų | 78.9 | 50% | 0.5 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -69.7 | -38.6 | 174.4 | -74.7 | 0 | 0 | 0 | 0 | 112.3 | A87 I88 D89 R95 | A87-C91 WeakPolarHBondContact O-CB 3.29Å; A87-C91 PolarHBondContact O-N 3.11Å; A87-C91 PolarHBondContact O-SG 2.79Å; I88-C91 CarbonylContact O-C 3.51Å; I88-C91 PolarHBondContact O-N 2.78Å; I88-C91 VanDerWaalsContact O-N 3.16Å; D89-C91 PolarHBondContact O-N 3.45Å; C91-R95 WeakPolarHBondContact O-CB 3.44Å; C91-R95 VanDerWaalsContact O-CG 3.26Å; C91-R95 WeakPolarHBondContact O-CG 3.39Å; C91-R95 PolarHBondContact O-N 2.82Å |
| 92 | M | 55.3 | Low | 55.3 | Low | 54 Ų | 54 | 89 Ų | 89 | 27% | 0.266 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.9 | -58.6 | 170 | -67.2 | -76.4 | -133.2 | 0 | 0 | 109.1 | I88 D89 K94 R95 L96 L115 | I88-M92 HydrophobicContact CG2-CG 4.34Å; I88-M92 WeakPolarHBondContact O-CG 3.21Å; I88-M92 PolarHBondContact O-N 3.44Å; D89-M92 WeakPolarHBondContact O-CB 3.09Å; D89-M92 PolarHBondContact O-N 3.46Å; M92-K94 VanDerWaalsContact C-N 3.3Å; M92-K94 PolarHBondContact O-N 2.9Å; M92-R95 CarbonylContact O-C 3.51Å; M92-R95 WeakPolarHBondContact O-CA 3.26Å; M92-R95 PolarHBondContact O-N 3.47Å; M92-L96 VanDerWaalsContact O-CG 3.23Å; M92-L96 WeakPolarHBondContact O-CG 3.37Å; M92-L96 PolarHBondContact O-N 2.78Å; M92-L115 HydrophobicContact CE-CD1 4.02Å; M92-L115 HydrophobicContact CE-CD2 4.01Å; M92-L115 HydrophobicContact CE-CG 4.05Å; M92-L115 HydrophobicContact SD-CD2 3.79Å; M92-L115 HydrophobicContact SD-CG 4.48Å |
| 93 | S | 54.8 | Low | 54.8 | Low | 61 Ų | 61 | 87.7 Ų | 87.7 | 43% | 0.427 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -53.2 | -40.8 | 180 | -68 | 0 | 0 | 0 | 0 | 113.4 | D89 L96 G97 | D89-S93 VanDerWaalsContact O-CB 3.26Å; D89-S93 WeakPolarHBondContact O-CB 3.17Å; D89-S93 PolarHBondContact O-N 3.45Å; D89-S93 PolarHBondContact O-OG 3.41Å; S93-L96 PolarHBondContact O-N 2.81Å; S93-G97 PolarHBondContact O-N 2.76Å |
| 94 | K | 56.5 | Low | 54.3 | Low | 142 Ų | 142 | 84.1 Ų | 84.1 | 62% | 0.617 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -68 | -42.7 | 174.1 | -76.2 | 171.9 | 179.3 | 171.7 | 0 | 112.8 | I90 M92 L96 G97 V98 | I90-K94 HydrophobicContact CG2-CD 3.93Å; I90-K94 HydrophobicContact CG2-CG 4.46Å; I90-K94 VanDerWaalsContact O-CB 3.31Å; I90-K94 WeakPolarHBondContact O-CB 3.35Å; I90-K94 VanDerWaalsContact O-CG 3.27Å; I90-K94 WeakPolarHBondContact O-CG 3.25Å; I90-K94 PolarHBondContact O-N 2.92Å; M92-K94 VanDerWaalsContact C-N 3.3Å; M92-K94 PolarHBondContact O-N 2.9Å; K94-L96 VanDerWaalsContact C-N 3.28Å; K94-L96 PolarHBondContact O-N 3.42Å; K94-G97 PolarHBondContact O-N 3.06Å; K94-V98 WeakPolarHBondContact O-CG2 3.1Å; K94-V98 PolarHBondContact O-N 2.77Å |
| 95 | R | 54 | Low | 54.1 | Low | 193 Ų | 193 | 86 Ų | 86 | 73% | 0.728 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -67.1 | -29.8 | 175.8 | -70.8 | 177.4 | 74.1 | -155.5 | 3.8 | 112.5 | C91 M92 | C91-R95 WeakPolarHBondContact O-CB 3.44Å; C91-R95 VanDerWaalsContact O-CG 3.26Å; C91-R95 WeakPolarHBondContact O-CG 3.39Å; C91-R95 PolarHBondContact O-N 2.82Å; M92-R95 CarbonylContact O-C 3.51Å; M92-R95 WeakPolarHBondContact O-CA 3.26Å; M92-R95 PolarHBondContact O-N 3.47Å |
| 96 | L | 50.7 | Low | 53.6 | Low | 46 Ų | 46 | 93 Ų | 93 | 24% | 0.241 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -71.1 | -47.4 | 172.2 | -63.6 | 167.3 | 0 | 0 | 0 | 110.7 | M92 S93 K94 V98 C99 M112 | M92-L96 VanDerWaalsContact O-CG 3.23Å; M92-L96 WeakPolarHBondContact O-CG 3.37Å; M92-L96 PolarHBondContact O-N 2.78Å; S93-L96 PolarHBondContact O-N 2.81Å; K94-L96 VanDerWaalsContact C-N 3.28Å; K94-L96 PolarHBondContact O-N 3.42Å; L96-V98 PolarHBondContact O-N 3.37Å; L96-C99 WeakPolarHBondContact O-CB 3.37Å; L96-C99 PolarHBondContact O-N 2.73Å; L96-C99 VanDerWaalsContact O-N 3.09Å; L96-M112 HydrophobicContact CB-CE 4.24Å; L96-M112 HydrophobicContact CB-SD 4.47Å; L96-M112 HydrophobicContact CD2-CB 4.11Å; L96-M112 HydrophobicContact CD2-CE 3.95Å; L96-M112 HydrophobicContact CD2-CG 3.47Å; L96-M112 VanDerWaalsContact CD2-CG 3.47Å; L96-M112 HydrophobicContact CD2-SD 3.7Å; L96-M112 WeakPolarHBondContact O-CE 3.26Å |
| 97 | G | 52.9 | Low | 53 | Low | 49 Ų | 49 | 93.3 Ų | 93.3 | 51% | 0.505 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.1 | -36.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | S93 K94 C99 A100 | S93-G97 PolarHBondContact O-N 2.76Å; K94-G97 PolarHBondContact O-N 3.06Å; G97-C99 PolarHBondContact O-N 2.78Å; G97-A100 VanDerWaalsContact O-CB 3.26Å; G97-A100 WeakPolarHBondContact O-CB 3.21Å; G97-A100 PolarHBondContact O-N 2.79Å; G97-A100 VanDerWaalsContact O-N 3.09Å |
| 98 | V | 46.7 | Very low | 52.5 | Low | 122 Ų | 122 | 92.7 Ų | 92.7 | 74% | 0.739 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -66 | -22.3 | 175.8 | 172.3 | 0 | 0 | 0 | 0 | 112.3 | K94 L96 A100 | K94-V98 WeakPolarHBondContact O-CG2 3.1Å; K94-V98 PolarHBondContact O-N 2.77Å; L96-V98 PolarHBondContact O-N 3.37Å; V98-A100 VanDerWaalsContact C-N 3.25Å; V98-A100 PolarHBondContact O-N 3.46Å |
| 99 | C | 43 | Very low | 52 | Low | 48 Ų | 48 | 90 Ų | 90 | 32% | 0.324 | 52% | 0.522 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | 4.9 | 173.2 | -74.5 | 0 | 0 | 0 | 0 | 114.5 | L96 G97 G101 A104 M112 | L96-C99 WeakPolarHBondContact O-CB 3.37Å; L96-C99 PolarHBondContact O-N 2.73Å; L96-C99 VanDerWaalsContact O-N 3.09Å; G97-C99 PolarHBondContact O-N 2.78Å; C99-G101 PolarHBondContact O-N 3.1Å; C99-A104 HydrophobicContact CB-CB 4.29Å; C99-M112 HydrophobicContact CB-CE 3.55Å |
| 100 | A | 45.1 | Very low | 51.8 | Low | 90 Ų | 90 | 94.8 Ų | 94.8 | 74% | 0.744 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.8 | -6.1 | 165.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | G97 V98 R102 | G97-A100 VanDerWaalsContact O-CB 3.26Å; G97-A100 WeakPolarHBondContact O-CB 3.21Å; G97-A100 PolarHBondContact O-N 2.79Å; G97-A100 VanDerWaalsContact O-N 3.09Å; V98-A100 VanDerWaalsContact C-N 3.25Å; V98-A100 PolarHBondContact O-N 3.46Å; A100-R102 PolarHBondContact O-N 2.89Å |
| 101 | G | 46 | Very low | 51.5 | Low | 47 Ų | 47 | 95 Ų | 95 | 49% | 0.485 | 54% | 0.544 | S | S | . | . | S | Bend | trans | -58.7 | 124.9 | 164.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | C99 A103 A104 | C99-G101 PolarHBondContact O-N 3.1Å; G101-A103 PolarHBondContact O-N 3.35Å; G101-A104 PolarHBondContact O-N 2.84Å |
| 102 | R | 44.7 | Very low | 51.3 | Low | 254 Ų | 254 | 93.5 Ų | 93.5 | 96% | 0.958 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.2 | 22.7 | -166.3 | -163.3 | 169.1 | 169.6 | 178 | -3.3 | 117.3 | A100 | A100-R102 PolarHBondContact O-N 2.89Š|
| 103 | A | 49.3 | Very low | 51.7 | Low | 99 Ų | 99 | 95.9 Ų | 95.9 | 82% | 0.818 | 55% | 0.547 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -128.6 | -12 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | G101 | G101-A103 PolarHBondContact O-N 3.35Š|
| 104 | A | 47.3 | Very low | 51.9 | Low | 34 Ų | 34 | 100.4 Ų | 100.4 | 28% | 0.281 | 56% | 0.559 | S | S | . | * | trans | -89.4 | 0.7 | -176 | 0 | 0 | 0 | 0 | 0 | 114.7 | C99 G101 W106 S108 | C99-A104 HydrophobicContact CB-CB 4.29Å; G101-A104 PolarHBondContact O-N 2.84Å; A104-W106 PolarHBondContact O-N 3.43Å; A104-W106 VanDerWaalsContact O-N 3.09Å; A104-S108 WeakPolarHBondContact O-CB 3.5Å; A104-S108 PolarHBondContact O-N 2.85Å | ||
| 105 | S | 51.6 | Low | 51.9 | Low | 94 Ų | 94 | 96.6 Ų | 96.6 | 66% | 0.657 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.7 | -12.7 | -149.4 | 51.3 | 0 | 0 | 0 | 0 | 118.2 | A109 | S105-A109 WeakPolarHBondContact O-CB 3.21Š|
| 106 | W | 50.8 | Low | 52.4 | Low | 191 Ų | 191 | 91.7 Ų | 91.7 | 72% | 0.723 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.1 | -49.7 | -179.4 | -159.3 | -107.3 | 0 | 0 | 0 | 113.1 | A104 R110 | A104-W106 PolarHBondContact O-N 3.43Å; A104-W106 VanDerWaalsContact O-N 3.09Å; W106-R110 PolarHBondContact O-N 2.77Å |
| 107 | A | 50.1 | Low | 52.9 | Low | 83 Ų | 83 | 91.6 Ų | 91.6 | 69% | 0.686 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -73.2 | -44 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | S111 | A107-S111 PolarHBondContact O-N 3.41Å |
| 108 | S | 54.5 | Low | 53.3 | Low | 32 Ų | 32 | 94.7 Ų | 94.7 | 22% | 0.224 | 55% | 0.547 | C | S | . | . | H | α-helix | trans | -66.9 | -42.9 | 176.8 | -167.9 | 0 | 0 | 0 | 0 | 110.5 | A104 R110 S111 M112 | A104-S108 WeakPolarHBondContact O-CB 3.5Å; A104-S108 PolarHBondContact O-N 2.85Å; S108-R110 PolarHBondContact O-N 2.89Å; S108-S111 CarbonylContact O-C 3.59Å; S108-S111 WeakPolarHBondContact O-CA 3.4Å; S108-S111 WeakPolarHBondContact O-CB 3.21Å; S108-S111 PolarHBondContact O-N 3Å; S108-M112 VanDerWaalsContact O-CG 3.31Å; S108-M112 WeakPolarHBondContact O-CG 3.25Å; S108-M112 PolarHBondContact O-N 3.47Å |
| 109 | A | 53.3 | Low | 54 | Low | 41 Ų | 41 | 91 Ų | 91 | 34% | 0.339 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -58 | -43.5 | -179 | 0 | 0 | 0 | 0 | 0 | 113.8 | S105 S111 M112 V113 | S105-A109 WeakPolarHBondContact O-CB 3.21Å; A109-S111 VanDerWaalsContact C-N 3.32Å; A109-S111 PolarHBondContact O-N 2.99Å; A109-M112 WeakPolarHBondContact O-CB 3.37Å; A109-M112 PolarHBondContact O-N 3.47Å; A109-V113 WeakPolarHBondContact O-CG2 3.26Å; A109-V113 PolarHBondContact O-N 3.05Å |
| 110 | R | 58.2 | Low | 55 | Low | 163 Ų | 163 | 91.1 Ų | 91.1 | 62% | 0.615 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.3 | -37.6 | 174.7 | -68.6 | -177.2 | -176.2 | -162.6 | -1.3 | 112.3 | W106 S108 V113 K114 | W106-R110 PolarHBondContact O-N 2.77Å; S108-R110 PolarHBondContact O-N 2.89Å; R110-V113 PolarHBondContact O-N 2.78Å; R110-K114 PolarHBondContact O-N 3.42Å |
| 111 | S | 57.6 | Low | 55.9 | Low | 77 Ų | 77 | 93.7 Ų | 93.7 | 54% | 0.538 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.6 | -42.3 | 174.6 | -162.2 | 0 | 0 | 0 | 0 | 111.4 | A107 S108 A109 V113 K114 L115 | A107-S111 PolarHBondContact O-N 3.41Å; S108-S111 CarbonylContact O-C 3.59Å; S108-S111 WeakPolarHBondContact O-CA 3.4Å; S108-S111 WeakPolarHBondContact O-CB 3.21Å; S108-S111 PolarHBondContact O-N 3Å; A109-S111 VanDerWaalsContact C-N 3.32Å; A109-S111 PolarHBondContact O-N 2.99Å; S111-V113 PolarHBondContact O-N 3.43Å; S111-K114 PolarHBondContact O-N 2.84Å; S111-L115 VanDerWaalsContact O-CB 3.24Å; S111-L115 WeakPolarHBondContact O-CB 3.16Å; S111-L115 PolarHBondContact O-N 3.33Å |
| 112 | M | 55.9 | Low | 56.7 | Low | 43 Ų | 43 | 92.7 Ų | 92.7 | 21% | 0.212 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -56.9 | -50.3 | 171.8 | -63.8 | -159.2 | -178.6 | 0 | 0 | 110.8 | L96 C99 S108 A109 K114 L115 I116 | L96-M112 HydrophobicContact CB-CE 4.24Å; L96-M112 HydrophobicContact CB-SD 4.47Å; L96-M112 HydrophobicContact CD2-CB 4.11Å; L96-M112 HydrophobicContact CD2-CE 3.95Å; L96-M112 HydrophobicContact CD2-CG 3.47Å; L96-M112 VanDerWaalsContact CD2-CG 3.47Å; L96-M112 HydrophobicContact CD2-SD 3.7Å; L96-M112 WeakPolarHBondContact O-CE 3.26Å; C99-M112 HydrophobicContact CB-CE 3.55Å; S108-M112 VanDerWaalsContact O-CG 3.31Å; S108-M112 WeakPolarHBondContact O-CG 3.25Å; S108-M112 PolarHBondContact O-N 3.47Å; A109-M112 WeakPolarHBondContact O-CB 3.37Å; A109-M112 PolarHBondContact O-N 3.47Å; M112-K114 PolarHBondContact O-N 2.98Å; M112-L115 CarbonylContact O-C 3.57Å; M112-L115 PolarHBondContact O-N 2.79Å; M112-L115 VanDerWaalsContact O-N 3.14Å; M112-I116 HydrophobicContact CB-CD1 4.21Å; M112-I116 VanDerWaalsContact O-CB 3.24Å; M112-I116 WeakPolarHBondContact O-CB 3.27Å; M112-I116 WeakPolarHBondContact O-CG1 3.49Å; M112-I116 PolarHBondContact O-N 3.48Å |
| 113 | V | 62.9 | Low | 57.7 | Low | 104 Ų | 104 | 83.3 Ų | 83.3 | 63% | 0.63 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -63.8 | -39.2 | -178.6 | 171.2 | 0 | 0 | 0 | 0 | 111.7 | A109 R110 S111 G117 | A109-V113 WeakPolarHBondContact O-CG2 3.26Å; A109-V113 PolarHBondContact O-N 3.05Å; R110-V113 PolarHBondContact O-N 2.78Å; S111-V113 PolarHBondContact O-N 3.43Å; V113-G117 PolarHBondContact O-N 3.22Å |
| 114 | K | 58.2 | Low | 58.9 | Low | 156 Ų | 156 | 82.4 Ų | 82.4 | 68% | 0.678 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -66.2 | -40.9 | 171.9 | -74 | -158.6 | 66.9 | 162.4 | 0 | 112.4 | R110 S111 M112 G117 I118 | R110-K114 PolarHBondContact O-N 3.42Å; S111-K114 PolarHBondContact O-N 2.84Å; M112-K114 PolarHBondContact O-N 2.98Å; K114-G117 PolarHBondContact O-N 2.89Å; K114-I118 WeakPolarHBondContact O-CB 3.13Å; K114-I118 WeakPolarHBondContact O-CD1 3.11Å; K114-I118 VanDerWaalsContact O-CG1 3.25Å; K114-I118 WeakPolarHBondContact O-CG1 3.47Å; K114-I118 PolarHBondContact O-N 2.83Å |
| 115 | L | 58.2 | Low | 60 | Low | 62 Ų | 62 | 87.4 Ų | 87.4 | 33% | 0.325 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -69.3 | -36.4 | -180 | -160.2 | 66.6 | 0 | 0 | 0 | 111.9 | M92 S111 M112 I118 T119 | M92-L115 HydrophobicContact CE-CD1 4.02Å; M92-L115 HydrophobicContact CE-CD2 4.01Å; M92-L115 HydrophobicContact CE-CG 4.05Å; M92-L115 HydrophobicContact SD-CD2 3.79Å; M92-L115 HydrophobicContact SD-CG 4.48Å; S111-L115 VanDerWaalsContact O-CB 3.24Å; S111-L115 WeakPolarHBondContact O-CB 3.16Å; S111-L115 PolarHBondContact O-N 3.33Å; M112-L115 CarbonylContact O-C 3.57Å; M112-L115 PolarHBondContact O-N 2.79Å; M112-L115 VanDerWaalsContact O-N 3.14Å; L115-I118 CarbonylContact O-C 3.58Å; L115-I118 PolarHBondContact O-N 3.48Å; L115-T119 VanDerWaalsContact O-CB 3.25Å; L115-T119 WeakPolarHBondContact O-CB 3.25Å; L115-T119 PolarHBondContact O-N 3.16Å |
| 116 | I | 63.4 | Low | 60.8 | Low | 90 Ų | 90 | 86.3 Ų | 86.3 | 46% | 0.462 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -75 | -31.1 | 174.8 | -68.5 | 165.4 | 0 | 0 | 0 | 111.1 | M112 G120 | M112-I116 HydrophobicContact CB-CD1 4.21Å; M112-I116 VanDerWaalsContact O-CB 3.24Å; M112-I116 WeakPolarHBondContact O-CB 3.27Å; M112-I116 WeakPolarHBondContact O-CG1 3.49Å; M112-I116 PolarHBondContact O-N 3.48Å; I116-G120 WeakPolarHBondContact O-CA 3.42Å; I116-G120 PolarHBondContact O-N 2.8Å |
| 117 | G | 61.8 | Low | 61.8 | Low | 45 Ų | 45 | 78.6 Ų | 78.6 | 46% | 0.464 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -66.7 | -45.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | V113 K114 T119 G120 H121 | V113-G117 PolarHBondContact O-N 3.22Å; K114-G117 PolarHBondContact O-N 2.89Å; G117-T119 VanDerWaalsContact C-N 3.32Å; G117-T119 PolarHBondContact O-N 3.14Å; G117-G120 PolarHBondContact O-N 3Å; G117-H121 PolarHBondContact O-N 3.5Å |
| 118 | I | 60.3 | Low | 62.5 | Low | 113 Ų | 113 | 76.2 Ų | 76.2 | 58% | 0.579 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -65.6 | -34.3 | 174.6 | -69.3 | 165.9 | 0 | 0 | 0 | 111.4 | K114 L115 G122 | K114-I118 WeakPolarHBondContact O-CB 3.13Å; K114-I118 WeakPolarHBondContact O-CD1 3.11Å; K114-I118 VanDerWaalsContact O-CG1 3.25Å; K114-I118 WeakPolarHBondContact O-CG1 3.47Å; K114-I118 PolarHBondContact O-N 2.83Å; L115-I118 CarbonylContact O-C 3.58Å; L115-I118 PolarHBondContact O-N 3.48Å; I118-G122 WeakPolarHBondContact O-CA 3.34Å; I118-G122 PolarHBondContact O-N 2.85Å |
| 119 | T | 62.2 | Low | 62.7 | Low | 45 Ų | 45 | 77 Ų | 77 | 28% | 0.276 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -74.1 | -39.2 | 172.2 | -97.7 | 0 | 0 | 0 | 0 | 112.2 | L115 G117 H121 G122 I123 P124 | L115-T119 VanDerWaalsContact O-CB 3.25Å; L115-T119 WeakPolarHBondContact O-CB 3.25Å; L115-T119 PolarHBondContact O-N 3.16Å; G117-T119 VanDerWaalsContact C-N 3.32Å; G117-T119 PolarHBondContact O-N 3.14Å; T119-H121 VanDerWaalsContact C-N 3.29Å; T119-H121 PolarHBondContact O-N 3.36Å; T119-G122 PolarHBondContact O-N 2.72Å; T119-I123 HydrophobicContact CG2-CD1 3.78Å; T119-I123 HydrophobicContact CG2-CG1 4.19Å; T119-I123 WeakPolarHBondContact O-CA 3.26Å; T119-I123 VanDerWaalsContact O-CB 3.27Å; T119-I123 WeakPolarHBondContact O-CB 3.43Å; T119-I123 PolarHBondContact O-N 2.76Å; T119-P124 WeakPolarHBondContact O-CD 3.31Å |
| 120 | G | 64.6 | Low | 63.2 | Low | 50 Ų | 50 | 78 Ų | 78 | 52% | 0.515 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -72.2 | -22.5 | -178 | 0 | 0 | 0 | 0 | 0 | 113.2 | I116 G117 P124 | I116-G120 WeakPolarHBondContact O-CA 3.42Å; I116-G120 PolarHBondContact O-N 2.8Å; G117-G120 PolarHBondContact O-N 3Å; G120-P124 WeakPolarHBondContact O-CD 3.23Å; G120-P124 VanDerWaalsContact O-CG 3.25Å; G120-P124 WeakPolarHBondContact O-CG 3.5Å |
| 121 | H | 63.3 | Low | 63.5 | Low | 145 Ų | 145 | 75.2 Ų | 75.2 | 67% | 0.671 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -96.3 | -40.9 | 165.9 | -154.7 | -37.4 | 0 | 0 | 0 | 111.9 | G117 T119 W125 | G117-H121 PolarHBondContact O-N 3.5Å; T119-H121 VanDerWaalsContact C-N 3.29Å; T119-H121 PolarHBondContact O-N 3.36Å; H121-W125 WeakPolarHBondContact O-CB 3.27Å; H121-W125 PolarHBondContact O-N 2.93Å |
| 122 | G | 61.9 | Low | 63.4 | Low | 26 Ų | 26 | 72.4 Ų | 72.4 | 27% | 0.268 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -80 | -36.1 | -171.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | I118 T119 W125 I126 | I118-G122 WeakPolarHBondContact O-CA 3.34Å; I118-G122 PolarHBondContact O-N 2.85Å; T119-G122 PolarHBondContact O-N 2.72Å; G122-W125 PolarHBondContact O-N 3.48Å; G122-I126 VanDerWaalsContact O-CB 3.26Å; G122-I126 WeakPolarHBondContact O-CB 3.47Å; G122-I126 VanDerWaalsContact O-CG1 3.25Å; G122-I126 WeakPolarHBondContact O-CG1 3.26Å; G122-I126 PolarHBondContact O-N 3.4Å |
| 123 | I | 66.8 | Low | 63.4 | Low | 56 Ų | 56 | 76.2 Ų | 76.2 | 29% | 0.287 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -72.8 | -40.3 | 173.4 | -61.1 | -173.1 | 0 | 0 | 0 | 110.5 | T119 G127 | T119-I123 HydrophobicContact CG2-CD1 3.78Å; T119-I123 HydrophobicContact CG2-CG1 4.19Å; T119-I123 WeakPolarHBondContact O-CA 3.26Å; T119-I123 VanDerWaalsContact O-CB 3.27Å; T119-I123 WeakPolarHBondContact O-CB 3.43Å; T119-I123 PolarHBondContact O-N 2.76Å; I123-G127 VanDerWaalsContact O-CA 3.26Å; I123-G127 WeakPolarHBondContact O-CA 3.39Å; I123-G127 PolarHBondContact O-N 2.84Å |
| 124 | P | 74.9 | Confident | 62.9 | Low | 81 Ų | 81 | 74.2 Ų | 74.2 | 53% | 0.526 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.3 | -30.5 | 168.5 | -29.9 | 41.2 | 0 | 0 | 0 | 114.4 | T119 G120 G128 | T119-P124 WeakPolarHBondContact O-CD 3.31Å; G120-P124 WeakPolarHBondContact O-CD 3.23Å; G120-P124 VanDerWaalsContact O-CG 3.25Å; G120-P124 WeakPolarHBondContact O-CG 3.5Å; P124-G128 WeakPolarHBondContact O-CA 3.44Å; P124-G128 PolarHBondContact O-N 2.69Å |
| 125 | W | 70.3 | Confident | 62.3 | Low | 139 Ų | 139 | 74 Ų | 74 | 53% | 0.527 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -71.5 | -54 | 173.6 | -172 | 77.1 | 0 | 0 | 0 | 111.4 | H121 G122 G127 G128 T129 | H121-W125 WeakPolarHBondContact O-CB 3.27Å; H121-W125 PolarHBondContact O-N 2.93Å; G122-W125 PolarHBondContact O-N 3.48Å; W125-G127 VanDerWaalsContact C-N 3.3Å; W125-G127 PolarHBondContact O-N 3.3Å; W125-G128 CarbonylContact O-C 3.59Å; W125-G128 WeakPolarHBondContact O-CA 3.24Å; W125-G128 PolarHBondContact O-N 3.49Å; W125-T129 PolarHBondContact O-N 3.24Å; W125-T129 PolarHBondContact O-OG1 2.85Å |
| 126 | I | 67.8 | Low | 61.6 | Low | 71 Ų | 71 | 72.9 Ų | 72.9 | 36% | 0.364 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -61 | -39.3 | 174.7 | -67.1 | -64.8 | 0 | 0 | 0 | 111.3 | L85 G122 T129 I130 | L85-I126 HydrophobicContact CD2-CG2 4.44Å; G122-I126 VanDerWaalsContact O-CB 3.26Å; G122-I126 WeakPolarHBondContact O-CB 3.47Å; G122-I126 VanDerWaalsContact O-CG1 3.25Å; G122-I126 WeakPolarHBondContact O-CG1 3.26Å; G122-I126 PolarHBondContact O-N 3.4Å; I126-T129 PolarHBondContact O-N 2.97Å; I126-I130 HydrophobicContact CG2-CD1 3.74Å; I126-I130 HydrophobicContact CG2-CG1 4.43Å; I126-I130 WeakPolarHBondContact O-CB 3.25Å; I126-I130 WeakPolarHBondContact O-CG1 3.4Å; I126-I130 PolarHBondContact O-N 3.08Å |
| 127 | G | 71 | Confident | 61 | Low | 29 Ų | 29 | 73.8 Ų | 73.8 | 30% | 0.299 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -66.4 | -35.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | I123 W125 L131 | I123-G127 VanDerWaalsContact O-CA 3.26Å; I123-G127 WeakPolarHBondContact O-CA 3.39Å; I123-G127 PolarHBondContact O-N 2.84Å; W125-G127 VanDerWaalsContact C-N 3.3Å; W125-G127 PolarHBondContact O-N 3.3Å; G127-L131 WeakPolarHBondContact O-CB 3.37Å; G127-L131 PolarHBondContact O-N 3.4Å |
| 128 | G | 65.6 | Low | 60.5 | Low | 33 Ų | 33 | 76.1 Ų | 76.1 | 34% | 0.34 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -70 | -41.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | P124 W125 L131 C132 | P124-G128 WeakPolarHBondContact O-CA 3.44Å; P124-G128 PolarHBondContact O-N 2.69Å; W125-G128 CarbonylContact O-C 3.59Å; W125-G128 WeakPolarHBondContact O-CA 3.24Å; W125-G128 PolarHBondContact O-N 3.49Å; G128-L131 PolarHBondContact O-N 3.06Å; G128-C132 WeakPolarHBondContact O-CB 3.37Å; G128-C132 PolarHBondContact O-N 3.34Å |
| 129 | T | 58.9 | Low | 59.9 | Low | 48 Ų | 48 | 76.9 Ų | 76.9 | 29% | 0.294 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -61.2 | -49.7 | 170.8 | -53.3 | 0 | 0 | 0 | 0 | 110.5 | W125 I126 C132 L133 | W125-T129 PolarHBondContact O-N 3.24Å; W125-T129 PolarHBondContact O-OG1 2.85Å; I126-T129 PolarHBondContact O-N 2.97Å; T129-C132 PolarHBondContact O-N 3.22Å; T129-L133 HydrophobicContact CG2-CD1 4.07Å; T129-L133 WeakPolarHBondContact O-CB 3.19Å; T129-L133 VanDerWaalsContact O-CD1 3.29Å; T129-L133 WeakPolarHBondContact O-CD1 3.24Å; T129-L133 PolarHBondContact O-N 3.06Å |
| 130 | I | 64.1 | Low | 59.5 | Low | 61 Ų | 61 | 78 Ų | 78 | 31% | 0.313 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -63 | -44.1 | 177.3 | -69.9 | 166.7 | 0 | 0 | 0 | 110.8 | L85 I126 C132 L133 V134 | L85-I130 HydrophobicContact CD2-CD1 4.32Å; I126-I130 HydrophobicContact CG2-CD1 3.74Å; I126-I130 HydrophobicContact CG2-CG1 4.43Å; I126-I130 WeakPolarHBondContact O-CB 3.25Å; I126-I130 WeakPolarHBondContact O-CG1 3.4Å; I126-I130 PolarHBondContact O-N 3.08Å; I130-C132 VanDerWaalsContact C-N 3.34Å; I130-C132 PolarHBondContact O-N 3.28Å; I130-L133 PolarHBondContact O-N 3.03Å; I130-V134 HydrophobicContact CG2-CG2 4.33Å; I130-V134 VanDerWaalsContact O-CB 3.23Å; I130-V134 WeakPolarHBondContact O-CB 3.36Å; I130-V134 WeakPolarHBondContact O-CG2 3.47Å; I130-V134 PolarHBondContact O-N 3.09Å |
| 131 | L | 63.2 | Low | 58.7 | Low | 105 Ų | 105 | 76.8 Ų | 76.8 | 55% | 0.55 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -66.5 | -36.2 | 178.2 | -177.8 | 60.6 | 0 | 0 | 0 | 111.7 | G127 G128 V134 K135 | G127-L131 WeakPolarHBondContact O-CB 3.37Å; G127-L131 PolarHBondContact O-N 3.4Å; G128-L131 PolarHBondContact O-N 3.06Å; L131-V134 CarbonylContact O-C 3.57Å; L131-V134 PolarHBondContact O-N 3.39Å; L131-K135 HydrophobicContact CD1-CG 4.43Å; L131-K135 WeakPolarHBondContact O-CB 3.43Å; L131-K135 PolarHBondContact O-N 3.04Å |
| 132 | C | 56.8 | Low | 58.1 | Low | 18 Ų | 18 | 75.6 Ų | 75.6 | 12% | 0.122 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -64.2 | -53.6 | 171.2 | -175.9 | 0 | 0 | 0 | 0 | 110.3 | G128 T129 I130 V134 K135 S136 L145 | G128-C132 WeakPolarHBondContact O-CB 3.37Å; G128-C132 PolarHBondContact O-N 3.34Å; T129-C132 PolarHBondContact O-N 3.22Å; I130-C132 VanDerWaalsContact C-N 3.34Å; I130-C132 PolarHBondContact O-N 3.28Å; C132-V134 PolarHBondContact O-N 3.45Å; C132-K135 CarbonylContact O-C 3.51Å; C132-K135 PolarHBondContact O-N 3.49Å; C132-S136 WeakPolarHBondContact O-CA 3.13Å; C132-S136 WeakPolarHBondContact O-CB 3.31Å; C132-S136 PolarHBondContact O-N 2.89Å; C132-S136 PolarHBondContact O-OG 3.45Å; C132-S136 PolarHBondContact SG-OG 3.45Å; C132-L145 HydrophobicContact CB-CD1 4.24Å; C132-L145 HydrophobicContact CB-CD2 4.26Å |
| 133 | L | 54.6 | Low | 57.7 | Low | 123 Ų | 123 | 80.7 Ų | 80.7 | 64% | 0.644 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -57.4 | -25.2 | 175.3 | -92.3 | 64.7 | 0 | 0 | 0 | 113.1 | T129 I130 | T129-L133 HydrophobicContact CG2-CD1 4.07Å; T129-L133 WeakPolarHBondContact O-CB 3.19Å; T129-L133 VanDerWaalsContact O-CD1 3.29Å; T129-L133 WeakPolarHBondContact O-CD1 3.24Å; T129-L133 PolarHBondContact O-N 3.06Å; I130-L133 PolarHBondContact O-N 3.03Å |
| 134 | V | 52.2 | Low | 57.1 | Low | 62 Ų | 62 | 82.6 Ų | 82.6 | 38% | 0.376 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -89.5 | -15.5 | 177.6 | 167.4 | 0 | 0 | 0 | 0 | 113.6 | K78 I130 L131 C132 | K78-V134 HydrophobicContact CD-CG2 4.09Å; K78-V134 VanDerWaalsContact CE-CG2 3.45Å; K78-V134 VanDerWaalsContact NZ-CG1 3.32Å; I130-V134 HydrophobicContact CG2-CG2 4.33Å; I130-V134 VanDerWaalsContact O-CB 3.23Å; I130-V134 WeakPolarHBondContact O-CB 3.36Å; I130-V134 WeakPolarHBondContact O-CG2 3.47Å; I130-V134 PolarHBondContact O-N 3.09Å; L131-V134 CarbonylContact O-C 3.57Å; L131-V134 PolarHBondContact O-N 3.39Å; C132-V134 PolarHBondContact O-N 3.45Å |
| 135 | K | 45.9 | Very low | 56 | Low | 153 Ų | 153 | 82 Ų | 82 | 67% | 0.665 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -104.3 | -32.2 | 174.5 | -86.2 | -77 | 178.8 | 65.2 | 0 | 113.2 | L131 C132 S137 | L131-K135 HydrophobicContact CD1-CG 4.43Å; L131-K135 WeakPolarHBondContact O-CB 3.43Å; L131-K135 PolarHBondContact O-N 3.04Å; C132-K135 CarbonylContact O-C 3.51Å; C132-K135 PolarHBondContact O-N 3.49Å; K135-S137 VanDerWaalsContact C-N 3.29Å; K135-S137 PolarHBondContact O-N 3.35Å |
| 136 | S | 43.9 | Very low | 55.4 | Low | 38 Ų | 38 | 80.1 Ų | 80.1 | 27% | 0.266 | 46% | 0.461 | S | S | . | . | trans | -92.8 | 45.9 | -173.4 | -58.9 | 0 | 0 | 0 | 0 | 112.3 | C132 T138 | C132-S136 WeakPolarHBondContact O-CA 3.13Å; C132-S136 WeakPolarHBondContact O-CB 3.31Å; C132-S136 PolarHBondContact O-N 2.89Å; C132-S136 PolarHBondContact O-OG 3.45Å; C132-S136 PolarHBondContact SG-OG 3.45Å; S136-T138 PolarHBondContact O-N 3.37Å | ||
| 137 | S | 50.9 | Low | 54.7 | Low | 108 Ų | 108 | 82.8 Ų | 82.8 | 76% | 0.755 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -77.2 | 23.7 | 146.4 | -53.5 | 0 | 0 | 0 | 0 | 110.9 | K135 | K135-S137 VanDerWaalsContact C-N 3.29Å; K135-S137 PolarHBondContact O-N 3.35Å |
| 138 | T | 51.5 | Low | 53.9 | Low | 94 Ų | 94 | 88 Ų | 88 | 58% | 0.577 | 50% | 0.496 | S | S | * | . | S | Bend | trans | -142.4 | 132.7 | 174.7 | -175.5 | 0 | 0 | 0 | 0 | 109.2 | S136 A140 G141 | S136-T138 PolarHBondContact O-N 3.37Å; T138-A140 VanDerWaalsContact C-N 3.35Å; T138-A140 PolarHBondContact O-N 2.74Å; T138-G141 PolarHBondContact O-N 2.88Å |
| 139 | L | 48.6 | Very low | 53.1 | Low | 130 Ų | 130 | 90.7 Ų | 90.7 | 68% | 0.681 | 50% | 0.502 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.4 | -34.2 | -157.6 | -141.7 | 150.9 | 0 | 0 | 0 | 113.1 | G141 Q142 | L139-G141 PolarHBondContact O-N 3.43Å; L139-G141 VanDerWaalsContact O-N 3.13Å; L139-Q142 PolarHBondContact O-N 3.3Å |
| 140 | A | 53.8 | Low | 52.8 | Low | 67 Ų | 67 | 95.7 Ų | 95.7 | 55% | 0.554 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.8 | -18.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.8 | T138 Q142 | T138-A140 VanDerWaalsContact C-N 3.35Å; T138-A140 PolarHBondContact O-N 2.74Å; A140-Q142 VanDerWaalsContact C-N 3.34Å |
| 141 | G | 47.8 | Very low | 51.8 | Low | 26 Ų | 26 | 102.4 Ų | 102.4 | 27% | 0.268 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -77.1 | -18.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | T138 L139 | T138-G141 PolarHBondContact O-N 2.88Å; L139-G141 PolarHBondContact O-N 3.43Å; L139-G141 VanDerWaalsContact O-N 3.13Å |
| 142 | Q | 50.5 | Low | 51.2 | Low | 119 Ų | 119 | 102.3 Ų | 102.3 | 56% | 0.556 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -83.7 | -38.3 | -173.8 | -175.6 | 174.7 | -20.2 | 0 | 0 | 112.5 | L139 A140 L145 M146 | L139-Q142 PolarHBondContact O-N 3.3Å; A140-Q142 VanDerWaalsContact C-N 3.34Å; Q142-L145 PolarHBondContact O-N 3.11Å; Q142-M146 PolarHBondContact O-N 3.12Å; Q142-M146 VanDerWaalsContact O-N 3.11Å |
| 143 | E | 52.4 | Low | 50.9 | Low | 133 Ų | 133 | 106.7 Ų | 106.7 | 62% | 0.621 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -68.2 | -43.5 | -178.4 | -58.7 | -179 | 150.9 | 0 | 0 | 111.5 | L145 M146 N147 | E143-L145 VanDerWaalsContact C-N 3.31Å; E143-L145 PolarHBondContact O-N 3.34Å; E143-M146 PolarHBondContact O-N 2.72Å; E143-N147 PolarHBondContact O-N 3.2Å; E143-N147 VanDerWaalsContact O-N 3.11Å |
| 144 | V | 53.7 | Low | 50.7 | Low | 97 Ų | 97 | 105.8 Ų | 105.8 | 59% | 0.588 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -59.8 | -40.6 | 173.1 | 171.7 | 0 | 0 | 0 | 0 | 111.3 | N147 L148 | V144-N147 PolarHBondContact O-N 3.37Å; V144-L148 WeakPolarHBondContact O-CB 3.38Å; V144-L148 PolarHBondContact O-N 3.09Å |
| 145 | L | 53.3 | Low | 50.7 | Low | 68 Ų | 68 | 108.4 Ų | 108.4 | 36% | 0.356 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69.5 | -32.4 | -179.8 | -158.3 | 89.4 | 0 | 0 | 0 | 112.5 | C132 Q142 E143 L149 | C132-L145 HydrophobicContact CB-CD1 4.24Å; C132-L145 HydrophobicContact CB-CD2 4.26Å; Q142-L145 PolarHBondContact O-N 3.11Å; E143-L145 VanDerWaalsContact C-N 3.31Å; E143-L145 PolarHBondContact O-N 3.34Å; L145-L149 VanDerWaalsContact O-CB 3.22Å; L145-L149 WeakPolarHBondContact O-CB 3.26Å; L145-L149 PolarHBondContact O-N 3.43Å |
| 146 | M | 57.3 | Low | 51 | Low | 99 Ų | 99 | 105.6 Ų | 105.6 | 49% | 0.488 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -69.6 | -43.3 | 174.7 | -77 | -69.2 | 154.3 | 0 | 0 | 111.7 | Q142 E143 L148 L149 L150 | Q142-M146 PolarHBondContact O-N 3.12Å; Q142-M146 VanDerWaalsContact O-N 3.11Å; E143-M146 PolarHBondContact O-N 2.72Å; M146-L148 VanDerWaalsContact C-N 3.31Å; M146-L148 PolarHBondContact O-N 3.09Å; M146-L149 PolarHBondContact O-N 2.98Å; M146-L150 WeakPolarHBondContact O-CD1 3.16Å; M146-L150 PolarHBondContact O-N 3.27Å |
| 147 | N | 53.3 | Low | 51.4 | Low | 127 Ų | 127 | 110.1 Ų | 110.1 | 68% | 0.679 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -61.1 | -40.3 | 173 | -79.6 | 2 | 0 | 0 | 0 | 111.8 | E143 V144 L149 D151 | E143-N147 PolarHBondContact O-N 3.2Å; E143-N147 VanDerWaalsContact O-N 3.11Å; V144-N147 PolarHBondContact O-N 3.37Å; N147-L149 PolarHBondContact O-N 3Å; N147-D151 PolarHBondContact O-N 3.37Å |
| 148 | L | 53.4 | Low | 51.5 | Low | 139 Ų | 139 | 110.2 Ų | 110.2 | 73% | 0.728 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -80.7 | 9.3 | 178.9 | -135 | 79.4 | 0 | 0 | 0 | 114.8 | V144 M146 | V144-L148 WeakPolarHBondContact O-CB 3.38Å; V144-L148 PolarHBondContact O-N 3.09Å; M146-L148 VanDerWaalsContact C-N 3.31Å; M146-L148 PolarHBondContact O-N 3.09Å |
| 149 | L | 49.7 | Very low | 51.5 | Low | 90 Ų | 90 | 111.5 Ų | 111.5 | 47% | 0.471 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -121.5 | -11 | 176.7 | -172 | 63.7 | 0 | 0 | 0 | 112.4 | L145 M146 N147 | L145-L149 VanDerWaalsContact O-CB 3.22Å; L145-L149 WeakPolarHBondContact O-CB 3.26Å; L145-L149 PolarHBondContact O-N 3.43Å; M146-L149 PolarHBondContact O-N 2.98Å; N147-L149 PolarHBondContact O-N 3Å |
| 150 | L | 52.7 | Low | 51.7 | Low | 152 Ų | 152 | 109.9 Ų | 109.9 | 80% | 0.796 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -103.7 | -8.4 | 174.3 | -93.3 | 78 | 0 | 0 | 0 | 113.7 | M146 | M146-L150 WeakPolarHBondContact O-CD1 3.16Å; M146-L150 PolarHBondContact O-N 3.27Å |
| 151 | D | 42.5 | Very low | 51.5 | Low | 202 Ų | 202 | 113.8 Ų | 113.8 | 100% | 1.08 | 60% | 0.603 | S | S | * | * | trans | -105.8 | 0 | 177.4 | -160.7 | -114.7 | 0 | 0 | 0 | 110.7 | N147 | N147-D151 PolarHBondContact O-N 3.37Š|
Retrieved 151 of 151 residues in 100.1 ms
(Link to these results)