| 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 | 46.9 | Very low | 60.3 | Low | 243 Ų | 243 | 158.4 Ų | 158.4 | 100% | 1.197 | 77% | 0.769 | S | S | * | * | 0 | 79.2 | 0 | -160.7 | 158.3 | 67.5 | 0 | 0 | 109.3 | |||||
| 2 | V | 55.6 | Low | 60.7 | Low | 155 Ų | 155 | 155.8 Ų | 155.8 | 94% | 0.939 | 76% | 0.761 | S | S | * | * | trans | -128.1 | 109.3 | -173.2 | -178.4 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 3 | G | 58.5 | Low | 61.3 | Low | 60 Ų | 60 | 151.5 Ų | 151.5 | 62% | 0.619 | 74% | 0.738 | S | S | * | * | trans | 164.5 | 34 | 177.3 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 4 | K | 62.8 | Low | 61.8 | Low | 190 Ų | 190 | 147.6 Ų | 147.6 | 83% | 0.826 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -122 | -6.6 | 175.4 | -63.6 | -171.7 | -177.8 | 178.6 | 0 | 116.4 | ||
| 5 | I | 62 | Low | 61.8 | Low | 153 Ų | 153 | 142.7 Ų | 142.7 | 79% | 0.785 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -88.2 | -19.9 | -175.4 | -62.6 | 166.2 | 0 | 0 | 0 | 113 | R7 | I5-R7 PolarHBondContact O-N 3.36Š|
| 6 | K | 61.7 | Low | 61.8 | Low | 182 Ų | 182 | 138.8 Ų | 138.8 | 79% | 0.791 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -63.3 | -39 | -176.1 | -72.6 | -172.4 | 175.5 | -176.4 | 0 | 113.5 | V8 E10 | K6-V8 PolarHBondContact O-N 3.06Å; K6-E10 WeakPolarHBondContact O-CB 3.44Å; K6-E10 PolarHBondContact O-N 3.07Å |
| 7 | R | 61.8 | Low | 61.8 | Low | 195 Ų | 195 | 137.4 Ų | 137.4 | 74% | 0.736 | 71% | 0.707 | S | S | * | * | H | α-helix | trans | -68.9 | -32.6 | -171.7 | -64.6 | -175.2 | -161.4 | 147.5 | 2.3 | 114.2 | I5 K11 | I5-R7 PolarHBondContact O-N 3.36Å; R7-K11 WeakPolarHBondContact O-CB 3.5Å; R7-K11 PolarHBondContact O-N 3.05Å; R7-K11 VanDerWaalsContact O-N 3.11Å |
| 8 | V | 60.7 | Low | 62 | Low | 110 Ų | 110 | 138.7 Ų | 138.7 | 67% | 0.667 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -71.9 | -44.5 | -176.8 | 179.8 | 0 | 0 | 0 | 0 | 110.8 | K6 E10 K11 L12 | K6-V8 PolarHBondContact O-N 3.06Å; V8-E10 VanDerWaalsContact C-N 3.33Å; V8-E10 PolarHBondContact O-N 3.03Å; V8-K11 PolarHBondContact O-N 3.46Å; V8-L12 PolarHBondContact O-N 3.04Å |
| 9 | R | 64.1 | Low | 61.4 | Low | 183 Ų | 183 | 139.5 Ų | 139.5 | 69% | 0.691 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -65.5 | -39.8 | 178.4 | -174.3 | 174.1 | 178 | -178 | 0.6 | 111.4 | L12 H13 | R9-L12 PolarHBondContact O-N 3.14Å; R9-H13 PolarHBondContact NE-NE2 3.37Å; R9-H13 PolarHBondContact O-CD2 3.35Å; R9-H13 PolarHBondContact O-N 3.46Å |
| 10 | E | 64.4 | Low | 61 | Low | 108 Ų | 108 | 140.8 Ų | 140.8 | 51% | 0.505 | 72% | 0.72 | S | S | . | * | H | α-helix | trans | -62 | -44.1 | 176.6 | -168.8 | -179.6 | 168.2 | 0 | 0 | 112.4 | K6 V8 L12 H13 Q14 | K6-E10 WeakPolarHBondContact O-CB 3.44Å; K6-E10 PolarHBondContact O-N 3.07Å; V8-E10 VanDerWaalsContact C-N 3.33Å; V8-E10 PolarHBondContact O-N 3.03Å; E10-L12 VanDerWaalsContact C-N 3.28Å; E10-L12 PolarHBondContact O-N 2.96Å; E10-H13 PolarHBondContact O-N 3.13Å; E10-Q14 WeakPolarHBondContact O-CG 3.4Å; E10-Q14 PolarHBondContact O-N 2.98Å; E10-Q14 PolarHBondContact OE1-NE2 3.12Å |
| 11 | K | 65.3 | Low | 60.4 | Low | 163 Ų | 163 | 139.5 Ų | 139.5 | 71% | 0.709 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -61.8 | -35.5 | 178.9 | -160.5 | 174.3 | -175.4 | -178.1 | 0 | 112.8 | R7 V8 A15 | R7-K11 WeakPolarHBondContact O-CB 3.5Å; R7-K11 PolarHBondContact O-N 3.05Å; R7-K11 VanDerWaalsContact O-N 3.11Å; V8-K11 PolarHBondContact O-N 3.46Å; K11-A15 PolarHBondContact O-N 3.07Å |
| 12 | L | 64.9 | Low | 60.3 | Low | 127 Ų | 127 | 133.2 Ų | 133.2 | 67% | 0.665 | 70% | 0.701 | S | S | * | * | H | α-helix | trans | -72.5 | -37.1 | 179.4 | -154.3 | 144.2 | 0 | 0 | 0 | 111.8 | V8 R9 E10 A16 | V8-L12 PolarHBondContact O-N 3.04Å; R9-L12 PolarHBondContact O-N 3.14Å; E10-L12 VanDerWaalsContact C-N 3.28Å; E10-L12 PolarHBondContact O-N 2.96Å; L12-A16 PolarHBondContact O-N 2.9Å |
| 13 | H | 67.9 | Low | 59.8 | Low | 101 Ų | 101 | 132.2 Ų | 132.2 | 47% | 0.468 | 70% | 0.698 | S | S | . | * | H | α-helix | trans | -68.7 | -40.1 | 174.4 | -70.7 | -59.5 | 0 | 0 | 0 | 112.3 | R9 E10 A15 A16 V17 | R9-H13 PolarHBondContact NE-NE2 3.37Å; R9-H13 PolarHBondContact O-CD2 3.35Å; R9-H13 PolarHBondContact O-N 3.46Å; E10-H13 PolarHBondContact O-N 3.13Å; H13-A15 VanDerWaalsContact C-N 3.33Å; H13-A15 PolarHBondContact O-N 3.37Å; H13-A16 PolarHBondContact O-N 3.05Å; H13-V17 WeakPolarHBondContact O-CG2 3.42Å; H13-V17 PolarHBondContact O-N 3.09Å |
| 14 | Q | 68.2 | Low | 58.8 | Low | 97 Ų | 97 | 135.1 Ų | 135.1 | 45% | 0.453 | 71% | 0.708 | S | S | . | * | H | α-helix | trans | -64.3 | -35.2 | 177.4 | -69.8 | -176.1 | 27.5 | 0 | 0 | 113.1 | E10 A16 V17 K18 | E10-Q14 WeakPolarHBondContact O-CG 3.4Å; E10-Q14 PolarHBondContact O-N 2.98Å; E10-Q14 PolarHBondContact OE1-NE2 3.12Å; Q14-A16 VanDerWaalsContact C-N 3.34Å; Q14-V17 PolarHBondContact O-N 3.16Å; Q14-K18 WeakPolarHBondContact O-CG 3.45Å; Q14-K18 PolarHBondContact O-N 3.36Å |
| 15 | A | 62.1 | Low | 57.4 | Low | 74 Ų | 74 | 129.7 Ų | 129.7 | 61% | 0.612 | 71% | 0.706 | S | S | * | * | H | α-helix | trans | -67.6 | -33.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | K11 H13 | K11-A15 PolarHBondContact O-N 3.07Å; H13-A15 VanDerWaalsContact C-N 3.33Å; H13-A15 PolarHBondContact O-N 3.37Å |
| 16 | A | 61.9 | Low | 55.9 | Low | 79 Ų | 79 | 125.9 Ų | 125.9 | 65% | 0.653 | 71% | 0.705 | S | S | * | * | H | α-helix | trans | -78.5 | -20.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | L12 H13 Q14 | L12-A16 PolarHBondContact O-N 2.9Å; H13-A16 PolarHBondContact O-N 3.05Å; Q14-A16 VanDerWaalsContact C-N 3.34Å |
| 17 | V | 61.5 | Low | 54.6 | Low | 115 Ų | 115 | 122.1 Ų | 122.1 | 70% | 0.697 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -89.7 | -20.7 | -179.2 | 174.5 | 0 | 0 | 0 | 0 | 112.3 | H13 Q14 L19 | H13-V17 WeakPolarHBondContact O-CG2 3.42Å; H13-V17 PolarHBondContact O-N 3.09Å; Q14-V17 PolarHBondContact O-N 3.16Å; V17-L19 PolarHBondContact O-N 3.43Å |
| 18 | K | 65.7 | Low | 53.3 | Low | 162 Ų | 162 | 123.7 Ų | 123.7 | 70% | 0.704 | 71% | 0.714 | S | S | * | * | trans | -78.9 | 85.8 | 176.4 | -70 | 177.7 | -178.8 | -174.2 | 0 | 110 | Q14 D20 | Q14-K18 WeakPolarHBondContact O-CG 3.45Å; Q14-K18 PolarHBondContact O-N 3.36Å; K18-D20 PolarHBondContact O-N 3.02Å | ||
| 19 | L | 51.2 | Low | 52.1 | Low | 154 Ų | 154 | 122.9 Ų | 122.9 | 81% | 0.806 | 71% | 0.713 | S | S | * | * | trans | -70.9 | 118.1 | 161 | -67.2 | 171.3 | 0 | 0 | 0 | 108.2 | V17 | V17-L19 PolarHBondContact O-N 3.43Š| ||
| 20 | D | 52.7 | Low | 50.8 | Low | 165 Ų | 165 | 119.8 Ų | 119.8 | 88% | 0.882 | 72% | 0.715 | S | S | * | * | trans | 22 | 101.4 | 162.5 | -59 | -31.9 | 0 | 0 | 0 | 117.5 | K18 | K18-D20 PolarHBondContact O-N 3.02Š| ||
| 21 | S | 49.2 | Very low | 49.2 | Very low | 113 Ų | 113 | 122.2 Ų | 122.2 | 79% | 0.79 | 73% | 0.731 | S | S | * | * | trans | -112.7 | 134.8 | 158.9 | -171.1 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 22 | P | 44.3 | Very low | 47.9 | Very low | 111 Ų | 111 | 122.8 Ų | 122.8 | 72% | 0.721 | 74% | 0.741 | S | S | * | * | trans | -68.1 | 153.3 | -170.1 | 27.3 | -34.7 | 0 | 0 | 0 | 112.8 | S24 | P22-S24 PolarHBondContact O-N 3.17Š| ||
| 23 | P | 44.7 | Very low | 46.7 | Very low | 134 Ų | 134 | 125.4 Ų | 125.4 | 87% | 0.87 | 75% | 0.75 | S | S | * | * | trans | -78.8 | 105.2 | -175.3 | 31.3 | -32.8 | 0 | 0 | 0 | 111 | ||||
| 24 | S | 37 | Very low | 45.2 | Very low | 121 Ų | 121 | 128.9 Ų | 128.9 | 85% | 0.846 | 76% | 0.764 | S | S | * | * | trans | -93 | 99 | 165 | 176 | 0 | 0 | 0 | 0 | 110.3 | P22 | P22-S24 PolarHBondContact O-N 3.17Š| ||
| 25 | G | 34 | Very low | 43.7 | Very low | 76 Ų | 76 | 128.6 Ų | 128.6 | 78% | 0.784 | 78% | 0.778 | S | S | * | * | trans | 54.1 | 119 | 136.6 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 26 | G | 31.2 | Very low | 42.9 | Very low | 74 Ų | 74 | 131 Ų | 131 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | trans | 155.1 | 88.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 27 | A | 34.3 | Very low | 41.8 | Very low | 103 Ų | 103 | 134.5 Ų | 134.5 | 85% | 0.851 | 79% | 0.793 | S | S | * | * | trans | 50.1 | 138.4 | 138.5 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 28 | R | 33.6 | Very low | 40.9 | Very low | 228 Ų | 228 | 134.6 Ų | 134.6 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | cis | -179.5 | 157.8 | 14.2 | 161.2 | -179 | 169.5 | -176.5 | -1.4 | 108.4 | ||||
| 29 | S | 36.8 | Very low | 39.5 | Very low | 93 Ų | 93 | 132.9 Ų | 132.9 | 65% | 0.65 | 80% | 0.799 | S | S | * | * | trans | 67.1 | 138 | 157.9 | 49.3 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 30 | T | 35.2 | Very low | 38.9 | Very low | 118 Ų | 118 | 133.5 Ų | 133.5 | 72% | 0.724 | 80% | 0.802 | S | S | * | * | cis | -165.2 | 143.2 | 5.9 | 23.9 | 0 | 0 | 0 | 0 | 109 | ||||
| 31 | D | 32.7 | Very low | 38.1 | Very low | 159 Ų | 159 | 131 Ų | 131 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | 61.8 | 113.4 | 145 | -55.5 | -26.9 | 0 | 0 | 0 | 123 | ||||
| 32 | L | 37.6 | Very low | 37.6 | Very low | 175 Ų | 175 | 131.1 Ų | 131.1 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | trans | -90.3 | 136.3 | 164.6 | -80.7 | 141.8 | 0 | 0 | 0 | 110.2 | ||||
| 33 | E | 40 | Very low | 37.2 | Very low | 181 Ų | 181 | 129 Ų | 129 | 85% | 0.846 | 79% | 0.791 | S | S | * | * | trans | -118.4 | 99.7 | 153.3 | -108.1 | -90.8 | 130.6 | 0 | 0 | 108.5 | ||||
| 34 | K | 34.9 | Very low | 36.7 | Very low | 174 Ų | 174 | 127.6 Ų | 127.6 | 76% | 0.757 | 79% | 0.785 | S | S | * | * | trans | 57.6 | 90.9 | 134.3 | -135.2 | 154.4 | -176.3 | 177.5 | 0 | 122.4 | ||||
| 35 | A | 38.1 | Very low | 36.6 | Very low | 91 Ų | 91 | 131.3 Ų | 131.3 | 75% | 0.752 | 79% | 0.786 | S | S | * | * | 34.7 | 162.7 | 120.3 | 0 | 0 | 0 | 0 | 0 | 123.6 | |||||
| 36 | P | 44.2 | Very low | 36.8 | Very low | 124 Ų | 124 | 134.7 Ų | 134.7 | 81% | 0.805 | 79% | 0.785 | S | S | * | * | cis | -132.6 | 158.9 | -9.3 | 30.1 | -8.7 | 0 | 0 | 0 | 116.1 | ||||
| 37 | I | 39.5 | Very low | 36.9 | Very low | 153 Ų | 153 | 139.9 Ų | 139.9 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | trans | -107.1 | 136 | 166.5 | -63 | 166.3 | 0 | 0 | 0 | 107.8 | V39 | I37-V39 PolarHBondContact O-N 3.05Š| ||
| 38 | P | 42.8 | Very low | 37 | Very low | 118 Ų | 118 | 142.3 Ų | 142.3 | 77% | 0.766 | 79% | 0.785 | S | S | * | * | trans | -75.6 | 123 | 171.9 | 29.1 | -31.6 | 0 | 0 | 0 | 111.6 | ||||
| 39 | V | 36.3 | Very low | 37.4 | Very low | 126 Ų | 126 | 136 Ų | 136 | 76% | 0.764 | 77% | 0.772 | S | S | * | * | trans | -78.8 | 126.3 | 166.5 | 171.7 | 0 | 0 | 0 | 0 | 108.5 | I37 | I37-V39 PolarHBondContact O-N 3.05Š| ||
| 40 | I | 37.1 | Very low | 37.6 | Very low | 166 Ų | 166 | 138.8 Ų | 138.8 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | trans | -133.1 | 125.1 | 154.2 | -59.8 | -177 | 0 | 0 | 0 | 109.7 | ||||
| 41 | T | 37.3 | Very low | 37.7 | Very low | 113 Ų | 113 | 142 Ų | 142 | 69% | 0.693 | 78% | 0.784 | S | S | * | * | trans | -62.2 | 141.5 | -173.3 | -52.9 | 0 | 0 | 0 | 0 | 113.8 | G43 | T41-G43 PolarHBondContact O-N 3.39Š| ||
| 42 | S | 37.7 | Very low | 38.1 | Very low | 116 Ų | 116 | 141.3 Ų | 141.3 | 81% | 0.811 | 79% | 0.785 | S | S | * | * | trans | -63.2 | 106.2 | 165.9 | 47.9 | 0 | 0 | 0 | 0 | 111 | ||||
| 43 | G | 35.9 | Very low | 38.3 | Very low | 65 Ų | 65 | 139.8 Ų | 139.8 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | trans | -78.4 | 115.4 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | T41 F45 | T41-G43 PolarHBondContact O-N 3.39Å; G43-F45 PolarHBondContact O-N 3.47Å | ||
| 44 | S | 35 | Very low | 38.1 | Very low | 106 Ų | 106 | 138 Ų | 138 | 74% | 0.741 | 77% | 0.774 | S | S | * | * | trans | -72.7 | 112.7 | 161.6 | -179.5 | 0 | 0 | 0 | 0 | 108.7 | I46 | S44-I46 PolarHBondContact O-N 3.1Š| ||
| 45 | F | 33.8 | Very low | 38.2 | Very low | 199 Ų | 199 | 134.6 Ų | 134.6 | 87% | 0.873 | 78% | 0.778 | S | S | * | * | trans | -86 | 102.8 | 173 | -99.3 | -93.8 | 0 | 0 | 0 | 109.1 | G43 | G43-F45 PolarHBondContact O-N 3.47Š| ||
| 46 | I | 38.3 | Very low | 38 | Very low | 146 Ų | 146 | 137.8 Ų | 137.8 | 75% | 0.749 | 78% | 0.778 | S | S | * | * | trans | -96 | 122 | 161.4 | -61.9 | -175.4 | 0 | 0 | 0 | 106.8 | S44 D48 | S44-I46 PolarHBondContact O-N 3.1Å; I46-D48 PolarHBondContact O-N 3.5Å | ||
| 47 | F | 33.5 | Very low | 37.5 | Very low | 183 Ų | 183 | 137.9 Ų | 137.9 | 80% | 0.803 | 77% | 0.771 | S | S | * | * | trans | -78.6 | 109.1 | 179.3 | -138.1 | -96.3 | 0 | 0 | 0 | 108.4 | V49 | F47-V49 HydrophobicContact CD1-CG2 4.28Å; F47-V49 PolarHBondContact O-N 3.49Å | ||
| 48 | D | 36 | Very low | 37.1 | Very low | 154 Ų | 154 | 138.3 Ų | 138.3 | 82% | 0.824 | 77% | 0.769 | S | S | * | * | trans | -90.1 | 96.4 | 174.9 | -153.4 | -11.1 | 0 | 0 | 0 | 108.9 | I46 | I46-D48 PolarHBondContact O-N 3.5Š| ||
| 49 | V | 43.8 | Very low | 36.9 | Very low | 96 Ų | 96 | 139.8 Ų | 139.8 | 58% | 0.582 | 77% | 0.769 | S | S | * | * | trans | -81.7 | 111.2 | 167.8 | 145.8 | 0 | 0 | 0 | 0 | 106.2 | F47 | F47-V49 HydrophobicContact CD1-CG2 4.28Å; F47-V49 PolarHBondContact O-N 3.49Å | ||
| 50 | N | 39.6 | Very low | 37 | Very low | 152 Ų | 152 | 143.6 Ų | 143.6 | 81% | 0.813 | 78% | 0.775 | S | S | * | * | trans | 156.1 | 92.2 | 140.9 | -75.3 | -31.1 | 0 | 0 | 0 | 111.4 | ||||
| 51 | K | 37.6 | Very low | 37.1 | Very low | 186 Ų | 186 | 144.3 Ų | 144.3 | 81% | 0.809 | 77% | 0.772 | S | S | * | * | trans | -139.4 | 95.2 | 162.4 | -171.2 | 174.6 | -175.2 | 177.4 | 0 | 110.1 | ||||
| 52 | T | 41.8 | Very low | 37.1 | Very low | 143 Ų | 143 | 146.9 Ų | 146.9 | 88% | 0.877 | 78% | 0.782 | S | S | * | * | trans | -142.7 | 135.3 | 146.9 | 49.3 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 53 | N | 40.3 | Very low | 37.5 | Very low | 143 Ų | 143 | 149.8 Ų | 149.8 | 77% | 0.765 | 78% | 0.782 | S | S | * | * | trans | -81.6 | 128.5 | -171.4 | -68.5 | -62.4 | 0 | 0 | 0 | 111.3 | ||||
| 54 | N | 36.9 | Very low | 37.7 | Very low | 145 Ų | 145 | 153.8 Ų | 153.8 | 78% | 0.775 | 79% | 0.788 | S | S | * | * | 25.3 | 109.9 | 128.9 | -134.1 | -18.7 | 0 | 0 | 0 | 118.3 | |||||
| 55 | A | 36.4 | Very low | 38 | Very low | 101 Ų | 101 | 152.7 Ų | 152.7 | 84% | 0.835 | 79% | 0.786 | S | S | * | * | trans | -128.6 | 135.4 | 148.8 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 56 | Q | 33.4 | Very low | 38.9 | Very low | 159 Ų | 159 | 152.9 Ų | 152.9 | 74% | 0.743 | 79% | 0.786 | S | S | * | * | trans | -86.3 | 157.8 | -157.5 | -174.4 | 131.9 | -19 | 0 | 0 | 113.2 | ||||
| 57 | L | 33.6 | Very low | 39.8 | Very low | 126 Ų | 126 | 155.2 Ų | 155.2 | 66% | 0.66 | 79% | 0.791 | S | S | * | * | trans | 90.5 | 108.5 | 152.7 | -48.3 | 176.1 | 0 | 0 | 0 | 120.4 | ||||
| 58 | H | 31.2 | Very low | 40.6 | Very low | 162 Ų | 162 | 152.6 Ų | 152.6 | 75% | 0.75 | 79% | 0.792 | S | S | * | * | 175 | 122 | 82.8 | -101.3 | -71.2 | 0 | 0 | 0 | 112.3 | |||||
| 59 | I | 39.5 | Very low | 41.7 | Very low | 148 Ų | 148 | 153.6 Ų | 153.6 | 76% | 0.759 | 80% | 0.797 | S | S | * | * | trans | 1.7 | 122.2 | 150.5 | -52.1 | 175.6 | 0 | 0 | 0 | 118 | ||||
| 60 | K | 37.5 | Very low | 42.7 | Very low | 206 Ų | 206 | 153.9 Ų | 153.9 | 90% | 0.896 | 80% | 0.803 | S | S | * | * | -149.6 | 127.8 | 111.5 | -72.5 | -159.7 | 179.4 | 173.3 | 0 | 110.2 | |||||
| 61 | K | 39.4 | Very low | 43.7 | Very low | 181 Ų | 181 | 151.6 Ų | 151.6 | 79% | 0.787 | 80% | 0.799 | S | S | * | * | trans | -83.3 | 138.6 | 170.1 | -70.8 | 177 | 173.4 | -179.5 | 0 | 107.7 | ||||
| 62 | D | 37.3 | Very low | 45.2 | Very low | 167 Ų | 167 | 151 Ų | 151 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | trans | -143.1 | 139.1 | 140.5 | -85.3 | -40.6 | 0 | 0 | 0 | 109.2 | ||||
| 63 | E | 46.6 | Very low | 46.7 | Very low | 177 Ų | 177 | 148.3 Ų | 148.3 | 83% | 0.827 | 78% | 0.782 | S | S | * | * | trans | -68.6 | 152 | -168.9 | -66.3 | -100.1 | 138.5 | 0 | 0 | 113.1 | ||||
| 64 | N | 39.3 | Very low | 48.2 | Very low | 149 Ų | 149 | 147.9 Ų | 147.9 | 80% | 0.797 | 79% | 0.79 | S | S | * | * | 137 | 125.2 | 122 | -154.7 | 0.7 | 0 | 0 | 0 | 115.3 | |||||
| 65 | A | 42.1 | Very low | 49.9 | Very low | 84 Ų | 84 | 143 Ų | 143 | 69% | 0.694 | 77% | 0.773 | S | S | * | * | trans | 58.4 | 118.1 | 151.8 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 66 | K | 52.4 | Low | 51.9 | Low | 202 Ų | 202 | 143 Ų | 143 | 88% | 0.878 | 76% | 0.759 | S | S | * | * | trans | -24.8 | 128.4 | 149.1 | -57.1 | 170.2 | -179.8 | 175.9 | 0 | 115.5 | ||||
| 67 | K | 57.7 | Low | 54 | Low | 196 Ų | 196 | 143.3 Ų | 143.3 | 85% | 0.852 | 76% | 0.758 | S | S | * | * | 176.7 | 148.2 | 128.1 | -95.1 | 165.6 | -169.8 | -175.3 | 0 | 111.6 | L69 | K67-L69 PolarHBondContact O-N 3.44Š| |||
| 68 | P | 51.1 | Low | 56.2 | Low | 127 Ų | 127 | 141.3 Ų | 141.3 | 83% | 0.825 | 76% | 0.76 | S | S | * | * | trans | -69.5 | 127.9 | 179.4 | 29 | -33.1 | 0 | 0 | 0 | 111.1 | S70 | P68-S70 PolarHBondContact O-N 2.99Å; P68-S70 VanDerWaalsContact O-N 3.13Å | ||
| 69 | L | 58.2 | Low | 58.4 | Low | 175 Ų | 175 | 137 Ų | 137 | 92% | 0.916 | 76% | 0.758 | S | S | * | * | trans | -82.7 | 81.2 | -178.9 | -155.4 | 83.6 | 0 | 0 | 0 | 110.2 | K67 | K67-L69 PolarHBondContact O-N 3.44Š| ||
| 70 | S | 64.3 | Low | 60.4 | Low | 103 Ų | 103 | 133.7 Ų | 133.7 | 72% | 0.72 | 75% | 0.745 | S | S | * | * | trans | -119.3 | 69 | 150.8 | 81.7 | 0 | 0 | 0 | 0 | 108.8 | P68 F72 | P68-S70 PolarHBondContact O-N 2.99Å; P68-S70 VanDerWaalsContact O-N 3.13Å; S70-F72 PolarHBondContact O-N 3.19Å | ||
| 71 | S | 61.7 | Low | 62.6 | Low | 103 Ų | 103 | 132.6 Ų | 132.6 | 72% | 0.72 | 74% | 0.744 | S | S | * | * | trans | -95.1 | 76.5 | 166.2 | -167.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 72 | F | 68.1 | Low | 64.6 | Low | 175 Ų | 175 | 129.4 Ų | 129.4 | 77% | 0.768 | 73% | 0.734 | S | S | * | * | trans | -85.2 | 123.8 | 153.7 | -72.6 | -74.2 | 0 | 0 | 0 | 106.1 | S70 S74 | S70-F72 PolarHBondContact O-N 3.19Å; F72-S74 PolarHBondContact O-N 3.49Å | ||
| 73 | P | 73.4 | Confident | 66.8 | Low | 85 Ų | 85 | 124.5 Ų | 124.5 | 55% | 0.552 | 71% | 0.712 | S | S | * | * | trans | -60.3 | 118 | 175 | 19.9 | -26.3 | 0 | 0 | 0 | 108.4 | G75 I76 | P73-G75 PolarHBondContact O-N 3.22Å; P73-I76 HydrophobicContact CB-CG1 4.49Å; P73-I76 HydrophobicContact CG-CD1 4.12Å; P73-I76 HydrophobicContact CG-CG1 3.75Å; P73-I76 WeakPolarHBondContact O-CG1 3.26Å | ||
| 74 | S | 71.8 | Confident | 68.3 | Low | 134 Ų | 134 | 121 Ų | 121 | 94% | 0.937 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.9 | 108.5 | 167.7 | 173.4 | 0 | 0 | 0 | 0 | 106.8 | F72 | F72-S74 PolarHBondContact O-N 3.49Š|
| 75 | G | 73.5 | Confident | 70.2 | Confident | 42 Ų | 42 | 121.6 Ų | 121.6 | 43% | 0.433 | 70% | 0.703 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 122.5 | 17.4 | 178 | 0 | 0 | 0 | 0 | 0 | 116.7 | P73 F77 A78 | P73-G75 PolarHBondContact O-N 3.22Å; G75-F77 PolarHBondContact O-N 3.49Å; G75-A78 WeakPolarHBondContact O-CB 3.46Å; G75-A78 PolarHBondContact O-N 3.27Å |
| 76 | I | 78.6 | Confident | 71.9 | Confident | 102 Ų | 102 | 121 Ų | 121 | 52% | 0.523 | 70% | 0.698 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -53.4 | -31 | 174.5 | -58.2 | 160.6 | 0 | 0 | 0 | 112 | P73 | P73-I76 HydrophobicContact CB-CG1 4.49Å; P73-I76 HydrophobicContact CG-CD1 4.12Å; P73-I76 HydrophobicContact CG-CG1 3.75Å; P73-I76 WeakPolarHBondContact O-CG1 3.26Å |
| 77 | F | 76.9 | Confident | 73.1 | Confident | 165 Ų | 165 | 117.5 Ų | 117.5 | 72% | 0.724 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.9 | 6.2 | 178.4 | -55.8 | -71.8 | 0 | 0 | 0 | 113.6 | G75 G79 T80 | G75-F77 PolarHBondContact O-N 3.49Å; F77-G79 PolarHBondContact O-N 3.41Å; F77-T80 WeakPolarHBondContact CA-OG1 3.35Å; F77-T80 PolarHBondContact O-N 3.41Å; F77-T80 VanDerWaalsContact O-N 3.14Å; F77-T80 PolarHBondContact O-OG1 3.03Å |
| 78 | A | 79.8 | Confident | 74.1 | Confident | 85 Ų | 85 | 112.8 Ų | 112.8 | 70% | 0.702 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | 104 | 179 | 0 | 0 | 0 | 0 | 0 | 108.8 | G75 | G75-A78 WeakPolarHBondContact O-CB 3.46Å; G75-A78 PolarHBondContact O-N 3.27Å |
| 79 | G | 77.5 | Confident | 75.3 | Confident | 70 Ų | 70 | 114.5 Ų | 114.5 | 72% | 0.722 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 109.8 | -1.8 | -176.4 | 0 | 0 | 0 | 0 | 0 | 114.5 | F77 Q81 | F77-G79 PolarHBondContact O-N 3.41Å; G79-Q81 PolarHBondContact O-N 3.27Å; G79-Q81 VanDerWaalsContact O-N 3.07Å |
| 80 | T | 82 | Confident | 75.8 | Confident | 79 Ų | 79 | 111.1 Ų | 111.1 | 49% | 0.485 | 66% | 0.66 | S | S | . | * | trans | -73.2 | 103 | 172.6 | -46.3 | 0 | 0 | 0 | 0 | 109.7 | F77 I82 | F77-T80 WeakPolarHBondContact CA-OG1 3.35Å; F77-T80 PolarHBondContact O-N 3.41Å; F77-T80 VanDerWaalsContact O-N 3.14Å; F77-T80 PolarHBondContact O-OG1 3.03Å; T80-I82 HydrophobicContact CG2-CG1 3.97Å; T80-I82 PolarHBondContact O-N 3.26Å | ||
| 81 | Q | 83.5 | Confident | 75.6 | Confident | 184 Ų | 184 | 112.9 Ų | 112.9 | 86% | 0.86 | 66% | 0.66 | S | S | * | * | trans | -85.5 | 98.8 | 174.7 | -63.1 | -70.4 | 16.3 | 0 | 0 | 109.3 | G79 | G79-Q81 PolarHBondContact O-N 3.27Å; G79-Q81 VanDerWaalsContact O-N 3.07Å | ||
| 82 | I | 80.6 | Confident | 75.6 | Confident | 113 Ų | 113 | 117.1 Ų | 117.1 | 58% | 0.579 | 67% | 0.666 | S | S | * | * | trans | -91.8 | 112.5 | 174.3 | -49.2 | 175.3 | 0 | 0 | 0 | 107.3 | T80 A86 L87 | T80-I82 HydrophobicContact CG2-CG1 3.97Å; T80-I82 PolarHBondContact O-N 3.26Å; I82-A86 HydrophobicContact CG2-CB 4.17Å; I82-L87 HydrophobicContact CG2-CD1 4.03Å; I82-L87 HydrophobicContact CG2-CG 4.3Å | ||
| 83 | S | 84.5 | Confident | 74.6 | Confident | 64 Ų | 64 | 114.4 Ų | 114.4 | 45% | 0.448 | 67% | 0.667 | S | S | . | * | trans | -67.7 | 145.9 | 175.3 | 65.2 | 0 | 0 | 0 | 0 | 110.2 | E85 A86 | S83-E85 PolarHBondContact O-N 3.45Å; S83-E85 VanDerWaalsContact O-N 3.12Å; S83-A86 WeakPolarHBondContact O-CB 3.44Å; S83-A86 PolarHBondContact O-N 3.1Å | ||
| 84 | P | 77.1 | Confident | 73.6 | Confident | 105 Ų | 105 | 119.2 Ų | 119.2 | 68% | 0.682 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -60 | -26.5 | -177.6 | 23.2 | -33.4 | 0 | 0 | 0 | 113.1 | L87 | P84-L87 PolarHBondContact O-N 2.66Š|
| 85 | E | 79.6 | Confident | 72.7 | Confident | 161 Ų | 161 | 121 Ų | 121 | 75% | 0.752 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -68.8 | -31.9 | 175.7 | -65 | -177.9 | 174 | 0 | 0 | 112.7 | S83 L87 V88 | S83-E85 PolarHBondContact O-N 3.45Å; S83-E85 VanDerWaalsContact O-N 3.12Å; E85-L87 PolarHBondContact O-N 2.62Å; E85-V88 WeakPolarHBondContact O-CB 3.46Å; E85-V88 PolarHBondContact O-N 2.91Å; E85-V88 VanDerWaalsContact O-N 3.07Å |
| 86 | A | 77.6 | Confident | 71.4 | Confident | 71 Ų | 71 | 124.2 Ų | 124.2 | 59% | 0.587 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -70.7 | -19.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | I82 S83 V88 | I82-A86 HydrophobicContact CG2-CB 4.17Å; S83-A86 WeakPolarHBondContact O-CB 3.44Å; S83-A86 PolarHBondContact O-N 3.1Å; A86-V88 VanDerWaalsContact C-N 3.25Å |
| 87 | L | 76.9 | Confident | 70 | Confident | 128 Ų | 128 | 124 Ų | 124 | 67% | 0.67 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -76.4 | -14.4 | 171.7 | -73.6 | 121.6 | 0 | 0 | 0 | 112.6 | I82 P84 E85 Q89 | I82-L87 HydrophobicContact CG2-CD1 4.03Å; I82-L87 HydrophobicContact CG2-CG 4.3Å; P84-L87 PolarHBondContact O-N 2.66Å; E85-L87 PolarHBondContact O-N 2.62Å; L87-Q89 VanDerWaalsContact C-N 3.32Å; L87-Q89 PolarHBondContact O-N 3.17Å |
| 88 | V | 79.5 | Confident | 68.2 | Low | 98 Ų | 98 | 123.5 Ų | 123.5 | 59% | 0.594 | 70% | 0.701 | S | S | * | * | trans | -84.9 | 80.6 | 178 | -168.9 | 0 | 0 | 0 | 0 | 108.7 | E85 A86 T90 | E85-V88 WeakPolarHBondContact O-CB 3.46Å; E85-V88 PolarHBondContact O-N 2.91Å; E85-V88 VanDerWaalsContact O-N 3.07Å; A86-V88 VanDerWaalsContact C-N 3.25Å; V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 HydrophobicContact CG1-CG2 4.01Å; V88-T90 PolarHBondContact O-N 2.6Å | ||
| 89 | Q | 76.9 | Confident | 66.3 | Low | 163 Ų | 163 | 126.8 Ų | 126.8 | 76% | 0.762 | 71% | 0.707 | S | S | * | * | trans | -67.6 | 92 | 171.7 | -173.2 | 174.6 | 1.2 | 0 | 0 | 109.5 | L87 L91 | L87-Q89 VanDerWaalsContact C-N 3.32Å; L87-Q89 PolarHBondContact O-N 3.17Å; Q89-L91 HydrophobicContact CG-CD2 4.49Å; Q89-L91 PolarHBondContact O-N 3.47Å | ||
| 90 | T | 68.9 | Low | 64.6 | Low | 104 Ų | 104 | 131 Ų | 131 | 64% | 0.638 | 71% | 0.712 | S | S | * | * | trans | -82.9 | 103.8 | 169.4 | 53.6 | 0 | 0 | 0 | 0 | 108.7 | V88 K92 | V88-T90 VanDerWaalsContact C-N 3.34Å; V88-T90 HydrophobicContact CG1-CG2 4.01Å; V88-T90 PolarHBondContact O-N 2.6Å; T90-K92 PolarHBondContact O-N 3.22Å; T90-K92 VanDerWaalsContact O-N 3.09Å | ||
| 91 | L | 59.4 | Low | 62.7 | Low | 139 Ų | 139 | 134 Ų | 134 | 73% | 0.728 | 73% | 0.725 | S | S | * | * | trans | -68.4 | 105.3 | 168 | -67.9 | 175.1 | 0 | 0 | 0 | 107.8 | Q89 C93 | Q89-L91 HydrophobicContact CG-CD2 4.49Å; Q89-L91 PolarHBondContact O-N 3.47Å; L91-C93 PolarHBondContact O-N 3.03Å; L91-C93 VanDerWaalsContact O-N 3.16Å | ||
| 92 | K | 61.7 | Low | 60.6 | Low | 193 Ų | 193 | 131.4 Ų | 131.4 | 84% | 0.839 | 72% | 0.722 | S | S | * | * | trans | -74.8 | 98.6 | 164 | -67.7 | -116.8 | 179.3 | 177.3 | 0 | 106.8 | T90 E94 | T90-K92 PolarHBondContact O-N 3.22Å; T90-K92 VanDerWaalsContact O-N 3.09Å; K92-E94 PolarHBondContact O-N 3.25Å | ||
| 93 | C | 47.3 | Very low | 59 | Low | 117 Ų | 117 | 131.7 Ų | 131.7 | 79% | 0.791 | 73% | 0.731 | S | S | * | * | trans | -66.3 | 101.9 | 163.9 | -63.9 | 0 | 0 | 0 | 0 | 106.9 | L91 E95 | L91-C93 PolarHBondContact O-N 3.03Å; L91-C93 VanDerWaalsContact O-N 3.16Å; C93-E95 PolarHBondContact O-N 3.38Å | ||
| 94 | E | 52.6 | Low | 56.7 | Low | 186 Ų | 186 | 133.4 Ų | 133.4 | 87% | 0.869 | 75% | 0.749 | S | S | * | * | trans | -69 | 105.4 | 161.9 | -170.9 | 170 | -179.7 | 0 | 0 | 106.5 | K92 P96 | K92-E94 PolarHBondContact O-N 3.25Å; E94-P96 VanDerWaalsContact O-CD 3.26Å; E94-P96 WeakPolarHBondContact O-CD 3.48Å | ||
| 95 | E | 52.3 | Low | 55 | Low | 171 Ų | 171 | 136.9 Ų | 136.9 | 80% | 0.799 | 76% | 0.756 | S | S | * | * | trans | -81.9 | 111 | 176.1 | -176.9 | 168 | -170.1 | 0 | 0 | 107.6 | C93 S97 | C93-E95 PolarHBondContact O-N 3.38Å; E95-S97 PolarHBondContact O-N 3.44Å | ||
| 96 | P | 46 | Very low | 53.3 | Low | 111 Ų | 111 | 139 Ų | 139 | 72% | 0.721 | 76% | 0.763 | S | S | * | * | trans | -73.1 | 101.3 | 170.6 | 28.8 | -30.9 | 0 | 0 | 0 | 108 | E94 N98 | E94-P96 VanDerWaalsContact O-CD 3.26Å; E94-P96 WeakPolarHBondContact O-CD 3.48Å; P96-N98 PolarHBondContact O-N 3.32Å; P96-N98 VanDerWaalsContact O-N 3.1Å | ||
| 97 | S | 49.3 | Very low | 51.3 | Low | 96 Ų | 96 | 140 Ų | 140 | 67% | 0.671 | 76% | 0.762 | S | S | * | * | trans | -53.6 | 108.6 | 160.2 | 54.8 | 0 | 0 | 0 | 0 | 109.2 | E95 | E95-S97 PolarHBondContact O-N 3.44Š| ||
| 98 | N | 40.2 | Very low | 49.7 | Very low | 155 Ų | 155 | 139.1 Ų | 139.1 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | trans | -149.4 | 104.1 | 150.6 | -80.5 | -55.2 | 0 | 0 | 0 | 108.2 | P96 I100 | P96-N98 PolarHBondContact O-N 3.32Å; P96-N98 VanDerWaalsContact O-N 3.1Å; N98-I100 PolarHBondContact O-N 3.3Å | ||
| 99 | D | 38.8 | Very low | 48.2 | Very low | 154 Ų | 154 | 143.3 Ų | 143.3 | 82% | 0.824 | 78% | 0.776 | S | S | * | * | trans | -56 | 121.4 | 173.7 | -62.4 | -62.5 | 0 | 0 | 0 | 112.2 | ||||
| 100 | I | 43.1 | Very low | 46.8 | Very low | 159 Ų | 159 | 143 Ų | 143 | 82% | 0.815 | 78% | 0.775 | S | S | * | * | trans | -145.6 | 96.1 | 141.6 | -54.5 | -176.8 | 0 | 0 | 0 | 108.1 | N98 | N98-I100 PolarHBondContact O-N 3.3Š| ||
| 101 | D | 40.8 | Very low | 46.2 | Very low | 142 Ų | 142 | 147.4 Ų | 147.4 | 76% | 0.759 | 79% | 0.785 | S | S | * | * | trans | 33.8 | 92.9 | 145.3 | -58.2 | -35.1 | 0 | 0 | 0 | 121.6 | ||||
| 102 | T | 40.3 | Very low | 46.4 | Very low | 130 Ų | 130 | 148.8 Ų | 148.8 | 80% | 0.798 | 79% | 0.785 | S | S | * | * | trans | 35.3 | 164.4 | 130.5 | 51.3 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 103 | P | 45.7 | Very low | 47.1 | Very low | 119 Ų | 119 | 148.8 Ų | 148.8 | 77% | 0.773 | 79% | 0.788 | S | S | * | * | cis | -138.2 | 140.5 | -40.4 | 35.9 | -18.1 | 0 | 0 | 0 | 113.1 | ||||
| 104 | A | 37.6 | Very low | 48.7 | Very low | 100 Ų | 100 | 146.5 Ų | 146.5 | 83% | 0.826 | 77% | 0.766 | S | S | * | * | trans | -160.1 | 104 | 149 | 0 | 0 | 0 | 0 | 0 | 110.1 | K106 | A104-K106 PolarHBondContact O-N 3.39Š| ||
| 105 | Q | 40.3 | Very low | 50.6 | Low | 177 Ų | 177 | 141.8 Ų | 141.8 | 83% | 0.827 | 75% | 0.75 | S | S | * | * | trans | -43 | 110.5 | 174.6 | -66.8 | 172.4 | -33.6 | 0 | 0 | 111.7 | V107 | Q105-V107 HydrophobicContact CB-CG2 3.81Å; Q105-V107 PolarHBondContact O-N 3.11Å | ||
| 106 | K | 43.3 | Very low | 52.6 | Low | 206 Ų | 206 | 142.4 Ų | 142.4 | 90% | 0.896 | 75% | 0.75 | S | S | * | * | trans | -73.3 | 82.7 | 145.6 | -80.7 | -175.6 | -178.7 | 173.2 | 0 | 106.2 | A104 P108 | A104-K106 PolarHBondContact O-N 3.39Å; K106-P108 WeakPolarHBondContact O-CD 3.47Å | ||
| 107 | V | 37.3 | Very low | 54.9 | Low | 93 Ų | 93 | 145.6 Ų | 145.6 | 56% | 0.564 | 75% | 0.753 | S | S | * | * | trans | -50.5 | 121.7 | 162.5 | -177.7 | 0 | 0 | 0 | 0 | 106 | Q105 E109 | Q105-V107 HydrophobicContact CB-CG2 3.81Å; Q105-V107 PolarHBondContact O-N 3.11Å; V107-E109 PolarHBondContact O-N 3.5Å; V107-E109 VanDerWaalsContact O-N 3.1Å | ||
| 108 | P | 42.7 | Very low | 57 | Low | 108 Ų | 108 | 145.6 Ų | 145.6 | 70% | 0.701 | 74% | 0.742 | S | S | * | * | trans | -55.5 | 120.5 | 166.8 | -15.3 | 27.8 | 0 | 0 | 0 | 105.4 | K106 E110 | K106-P108 WeakPolarHBondContact O-CD 3.47Å; P108-E110 PolarHBondContact O-N 3.4Å | ||
| 109 | E | 48.2 | Very low | 59.6 | Low | 186 Ų | 186 | 143.9 Ų | 143.9 | 87% | 0.869 | 73% | 0.727 | S | S | * | * | trans | -57.9 | 95.3 | 170 | -85.1 | -158.2 | 162.1 | 0 | 0 | 106.9 | V107 K111 | V107-E109 PolarHBondContact O-N 3.5Å; V107-E109 VanDerWaalsContact O-N 3.1Å; E109-K111 VanDerWaalsContact C-N 3.35Å; E109-K111 PolarHBondContact O-N 3.24Å | ||
| 110 | E | 48 | Very low | 62.3 | Low | 156 Ų | 156 | 142.2 Ų | 142.2 | 73% | 0.729 | 72% | 0.716 | S | S | * | * | trans | -49.1 | 110.5 | 159.5 | -67.7 | 179.6 | 173.3 | 0 | 0 | 103.9 | P108 K112 | P108-E110 PolarHBondContact O-N 3.4Å; E110-K112 PolarHBondContact O-N 2.99Å | ||
| 111 | K | 56.1 | Low | 64.9 | Low | 197 Ų | 197 | 141 Ų | 141 | 86% | 0.857 | 71% | 0.705 | S | S | * | * | trans | -64.1 | 77.3 | 174.3 | -67 | 179.5 | -179.1 | 170.8 | 0 | 106.8 | E109 Q113 | E109-K111 VanDerWaalsContact C-N 3.35Å; E109-K111 PolarHBondContact O-N 3.24Å; K111-Q113 PolarHBondContact O-N 3.07Å; K111-Q113 VanDerWaalsContact O-N 3.17Å | ||
| 112 | K | 63.4 | Low | 67.5 | Low | 168 Ų | 168 | 137.1 Ų | 137.1 | 73% | 0.73 | 68% | 0.682 | S | S | * | * | trans | -48.2 | 126.7 | 163.2 | -67.7 | -169.8 | 178.8 | -175.3 | 0 | 104.2 | E110 Q114 | E110-K112 PolarHBondContact O-N 2.99Å; K112-Q114 VanDerWaalsContact C-N 3.3Å; K112-Q114 PolarHBondContact O-N 3.32Å | ||
| 113 | Q | 76.1 | Confident | 70.2 | Confident | 193 Ų | 193 | 139.9 Ų | 139.9 | 90% | 0.902 | 68% | 0.678 | S | S | * | * | trans | -50.4 | 100 | -177.6 | -75.7 | 176.8 | -15 | 0 | 0 | 108.5 | K111 T115 | K111-Q113 PolarHBondContact O-N 3.07Å; K111-Q113 VanDerWaalsContact O-N 3.17Å; Q113-T115 PolarHBondContact O-N 3.48Å | ||
| 114 | Q | 81.4 | Confident | 72.7 | Confident | 69 Ų | 69 | 141.3 Ų | 141.3 | 32% | 0.322 | 67% | 0.668 | S | S | . | * | trans | -58.8 | 131.2 | -171.9 | -72.9 | 177.8 | -27.9 | 0 | 0 | 108.2 | K112 E118 K119 E122 | K112-Q114 VanDerWaalsContact C-N 3.3Å; K112-Q114 PolarHBondContact O-N 3.32Å; Q114-E118 HydrophobicContact CB-CB 4.34Å; Q114-E118 HydrophobicContact CB-CG 4.31Å; Q114-E118 HydrophobicContact CG-CG 4.3Å; Q114-K119 HydrophobicContact CB-CD 4.41Å; Q114-K119 HydrophobicContact CB-CG 3.75Å; Q114-K119 WeakPolarHBondContact O-CE 3.49Å; Q114-E122 PolarHBondContact NE2-OE2 2.81Å; Q114-E122 PolarHBondContact OE1-OE2 3.3Å | ||
| 115 | T | 91.3 | Very high | 75.5 | Confident | 88 Ų | 88 | 139.1 Ų | 139.1 | 54% | 0.54 | 64% | 0.642 | S | S | . | * | trans | -60.6 | 151 | 177.1 | 66.1 | 0 | 0 | 0 | 0 | 109.5 | Q113 K117 E118 K119 | Q113-T115 PolarHBondContact O-N 3.48Å; T115-K117 PolarHBondContact O-N 2.9Å; T115-E118 WeakPolarHBondContact O-CB 3.47Å; T115-E118 PolarHBondContact O-N 3.42Å; T115-E118 PolarHBondContact OG1-N 2.98Å; T115-K119 PolarHBondContact O-N 2.69Å | ||
| 116 | K | 94.5 | Very high | 78.3 | Confident | 184 Ų | 184 | 138.4 Ų | 138.4 | 80% | 0.8 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -51.6 | -34.6 | 177.2 | -176.8 | 177.6 | 178.4 | 179.3 | 0 | 112.5 | M120 | K116-M120 WeakPolarHBondContact O-CB 3.31Å; K116-M120 PolarHBondContact O-N 2.68Å |
| 117 | K | 94.5 | Very high | 80.9 | Confident | 178 Ų | 178 | 136.2 Ų | 136.2 | 77% | 0.774 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -63.2 | -43.2 | 176.3 | -176.1 | 177.2 | 179.5 | 179.9 | 0 | 112 | T115 M120 K121 | T115-K117 PolarHBondContact O-N 2.9Å; K117-M120 PolarHBondContact O-N 3.45Å; K117-K121 WeakPolarHBondContact O-CB 3.46Å; K117-K121 PolarHBondContact O-N 3.35Å |
| 118 | E | 93.6 | Very high | 83.8 | Confident | 96 Ų | 96 | 134.8 Ų | 134.8 | 45% | 0.449 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -68.4 | -46 | 178.5 | -175 | 174 | -163 | 0 | 0 | 111.7 | Q114 T115 M120 K121 E122 | Q114-E118 HydrophobicContact CB-CB 4.34Å; Q114-E118 HydrophobicContact CB-CG 4.31Å; Q114-E118 HydrophobicContact CG-CG 4.3Å; T115-E118 WeakPolarHBondContact O-CB 3.47Å; T115-E118 PolarHBondContact O-N 3.42Å; T115-E118 PolarHBondContact OG1-N 2.98Å; E118-M120 VanDerWaalsContact C-N 3.28Å; E118-M120 PolarHBondContact O-N 2.93Å; E118-K121 WeakPolarHBondContact O-CB 3.44Å; E118-K121 PolarHBondContact O-N 3.47Å; E118-K121 VanDerWaalsContact O-N 3.13Å; E118-E122 WeakPolarHBondContact O-CB 3.36Å; E118-E122 PolarHBondContact O-N 3.45Å |
| 119 | K | 95.6 | Very high | 86.4 | Confident | 118 Ų | 118 | 134.3 Ų | 134.3 | 51% | 0.513 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -58.8 | -38.7 | 175.1 | -66.8 | -171.2 | 178.7 | -177.6 | 0 | 112.7 | Q114 T115 R123 | Q114-K119 HydrophobicContact CB-CD 4.41Å; Q114-K119 HydrophobicContact CB-CG 3.75Å; Q114-K119 WeakPolarHBondContact O-CE 3.49Å; T115-K119 PolarHBondContact O-N 2.69Å; K119-R123 WeakPolarHBondContact O-CB 3.33Å; K119-R123 PolarHBondContact O-N 3.41Å |
| 120 | M | 95.4 | Very high | 88.8 | Confident | 119 Ų | 119 | 132.1 Ų | 132.1 | 59% | 0.586 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -67.1 | -44.4 | 176.1 | -176.2 | 64.2 | 76.2 | 0 | 0 | 111.6 | K116 K117 E118 R123 R124 | K116-M120 WeakPolarHBondContact O-CB 3.31Å; K116-M120 PolarHBondContact O-N 2.68Å; K117-M120 PolarHBondContact O-N 3.45Å; E118-M120 VanDerWaalsContact C-N 3.28Å; E118-M120 PolarHBondContact O-N 2.93Å; M120-R123 PolarHBondContact O-N 3.41Å; M120-R124 PolarHBondContact O-N 3.46Å |
| 121 | K | 96.6 | Very high | 91.2 | Very high | 134 Ų | 134 | 127.2 Ų | 127.2 | 58% | 0.583 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61.3 | -47.9 | 176.7 | -175 | -171.2 | 172.2 | -164.6 | 0 | 110.7 | K117 E118 R123 R124 D125 | K117-K121 WeakPolarHBondContact O-CB 3.46Å; K117-K121 PolarHBondContact O-N 3.35Å; E118-K121 WeakPolarHBondContact O-CB 3.44Å; E118-K121 PolarHBondContact O-N 3.47Å; E118-K121 VanDerWaalsContact O-N 3.13Å; K121-R123 VanDerWaalsContact C-N 3.32Å; K121-R123 PolarHBondContact O-N 3.06Å; K121-R124 WeakPolarHBondContact O-CB 3.46Å; K121-R124 PolarHBondContact O-N 3.43Å; K121-R124 VanDerWaalsContact O-N 3.1Å; K121-D125 WeakPolarHBondContact CE-OD2 3.29Å; K121-D125 WeakPolarHBondContact O-CB 3.38Å; K121-D125 VanDerWaalsContact O-CG 3.29Å; K121-D125 PolarHBondContact O-N 3.25Å |
| 122 | E | 95.8 | Very high | 93.1 | Very high | 61 Ų | 61 | 120.8 Ų | 120.8 | 29% | 0.285 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -59.1 | -43.9 | 177.8 | -178.3 | 177.7 | -160.5 | 0 | 0 | 111.6 | Q114 E118 R124 D125 R126 | Q114-E122 PolarHBondContact NE2-OE2 2.81Å; Q114-E122 PolarHBondContact OE1-OE2 3.3Å; E118-E122 WeakPolarHBondContact O-CB 3.36Å; E118-E122 PolarHBondContact O-N 3.45Å; E122-R124 VanDerWaalsContact C-N 3.32Å; E122-R124 PolarHBondContact O-N 3.26Å; E122-D125 PolarHBondContact O-N 2.96Å; E122-R126 HydrophobicContact CG-CG 4.19Å; E122-R126 VanDerWaalsContact O-CB 3.29Å; E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 WeakPolarHBondContact O-CG 3.44Å; E122-R126 PolarHBondContact O-N 3.02Å; E122-R126 IonicContact OE1-CZ 3.13Å; E122-R126 IonicContact OE1-NE 3.02Å; E122-R126 PolarHBondContact OE1-NE 3.37Å; E122-R126 IonicContact OE1-NH2 2.6Å; E122-R126 PolarHBondContact OE1-NH2 3.01Å; E122-R126 IonicContact OE2-NH2 3.85Å |
| 123 | R | 97.1 | Very high | 94.8 | Very high | 187 Ų | 187 | 116.2 Ų | 116.2 | 71% | 0.706 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -58.7 | -44.7 | 175.1 | -175 | -177 | -66.7 | -156.5 | -2.3 | 111.7 | K119 M120 K121 W127 | K119-R123 WeakPolarHBondContact O-CB 3.33Å; K119-R123 PolarHBondContact O-N 3.41Å; M120-R123 PolarHBondContact O-N 3.41Å; K121-R123 VanDerWaalsContact C-N 3.32Å; K121-R123 PolarHBondContact O-N 3.06Å; R123-W127 WeakPolarHBondContact O-CB 3.21Å; R123-W127 PolarHBondContact O-N 3.5Å |
| 124 | R | 97.6 | Very high | 95.8 | Very high | 149 Ų | 149 | 111 Ų | 111 | 56% | 0.562 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.5 | -45.8 | 177.4 | -178.9 | -179.6 | 178.4 | -82.8 | 0.2 | 111.3 | M120 K121 E122 W127 L128 | M120-R124 PolarHBondContact O-N 3.46Å; K121-R124 WeakPolarHBondContact O-CB 3.46Å; K121-R124 PolarHBondContact O-N 3.43Å; K121-R124 VanDerWaalsContact O-N 3.1Å; E122-R124 VanDerWaalsContact C-N 3.32Å; E122-R124 PolarHBondContact O-N 3.26Å; R124-W127 PolarHBondContact O-N 3.06Å; R124-L128 HydrophobicContact CG-CD1 4.14Å; R124-L128 HydrophobicContact CG-CG 4.47Å; R124-L128 VanDerWaalsContact NH1-CD1 3.28Å; R124-L128 WeakPolarHBondContact O-CG 3.29Å; R124-L128 PolarHBondContact O-N 3.06Å |
| 125 | D | 97.3 | Very high | 96.6 | Very high | 55 Ų | 55 | 114.4 Ų | 114.4 | 29% | 0.294 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -67.1 | -43.3 | -178.1 | -67.8 | -13.2 | 0 | 0 | 0 | 110.6 | K121 E122 W127 L128 N129 | K121-D125 WeakPolarHBondContact CE-OD2 3.29Å; K121-D125 WeakPolarHBondContact O-CB 3.38Å; K121-D125 VanDerWaalsContact O-CG 3.29Å; K121-D125 PolarHBondContact O-N 3.25Å; E122-D125 PolarHBondContact O-N 2.96Å; D125-W127 VanDerWaalsContact C-N 3.31Å; D125-W127 PolarHBondContact O-N 3.25Å; D125-L128 PolarHBondContact O-N 2.99Å; D125-N129 VanDerWaalsContact O-CB 3.3Å; D125-N129 WeakPolarHBondContact O-CB 3.43Å; D125-N129 PolarHBondContact O-N 2.92Å; D125-N129 PolarHBondContact O-ND2 3.05Å; D125-N129 PolarHBondContact O-OD1 3.39Å |
| 126 | R | 97.6 | Very high | 96.9 | Very high | 161 Ų | 161 | 114.6 Ų | 114.6 | 61% | 0.608 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -57.4 | -43.1 | 171.5 | -72.5 | 174.9 | -178.8 | -161.2 | 2.6 | 111.7 | E122 K130 | E122-R126 HydrophobicContact CG-CG 4.19Å; E122-R126 VanDerWaalsContact O-CB 3.29Å; E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 WeakPolarHBondContact O-CG 3.44Å; E122-R126 PolarHBondContact O-N 3.02Å; E122-R126 IonicContact OE1-CZ 3.13Å; E122-R126 IonicContact OE1-NE 3.02Å; E122-R126 PolarHBondContact OE1-NE 3.37Å; E122-R126 IonicContact OE1-NH2 2.6Å; E122-R126 PolarHBondContact OE1-NH2 3.01Å; E122-R126 IonicContact OE2-NH2 3.85Å; R126-K130 WeakPolarHBondContact O-CB 3.37Å; R126-K130 PolarHBondContact O-N 3.28Å |
| 127 | W | 97.9 | Very high | 97 | Very high | 160 Ų | 160 | 108 Ų | 108 | 61% | 0.606 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -66.6 | -44.1 | 177.8 | 178.1 | 58.5 | 0 | 0 | 0 | 112.5 | R123 R124 D125 K130 I131 | R123-W127 WeakPolarHBondContact O-CB 3.21Å; R123-W127 PolarHBondContact O-N 3.5Å; R124-W127 PolarHBondContact O-N 3.06Å; D125-W127 VanDerWaalsContact C-N 3.31Å; D125-W127 PolarHBondContact O-N 3.25Å; W127-K130 WeakPolarHBondContact O-CB 3.43Å; W127-K130 PolarHBondContact O-N 3.28Å; W127-I131 HydrophobicContact CD2-CD1 3.86Å; W127-I131 HydrophobicContact CE3-CD1 4.38Å; W127-I131 HydrophobicContact CG-CD1 4.35Å; W127-I131 HydrophobicContact CH2-CD1 4.13Å; W127-I131 HydrophobicContact CZ2-CD1 3.55Å; W127-I131 WeakPolarHBondContact O-CG1 3.35Å; W127-I131 PolarHBondContact O-N 3.48Å |
| 128 | L | 98.3 | Very high | 97.2 | Very high | 63 Ų | 63 | 105.9 Ų | 105.9 | 33% | 0.33 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 175.9 | -73 | 176 | 0 | 0 | 0 | 112 | R124 D125 K130 I131 S132 | R124-L128 HydrophobicContact CG-CD1 4.14Å; R124-L128 HydrophobicContact CG-CG 4.47Å; R124-L128 VanDerWaalsContact NH1-CD1 3.28Å; R124-L128 WeakPolarHBondContact O-CG 3.29Å; R124-L128 PolarHBondContact O-N 3.06Å; D125-L128 PolarHBondContact O-N 2.99Å; L128-K130 VanDerWaalsContact C-N 3.3Å; L128-K130 PolarHBondContact O-N 3.01Å; L128-I131 PolarHBondContact O-N 3.38Å; L128-S132 PolarHBondContact O-N 3.39Å; L128-S132 PolarHBondContact O-OG 3.41Å |
| 129 | N | 97.8 | Very high | 97.3 | Very high | 98 Ų | 98 | 108.1 Ų | 108.1 | 52% | 0.524 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.8 | -37.8 | 175.6 | -70.4 | -10.1 | 0 | 0 | 0 | 111.5 | D125 S132 S133 | D125-N129 VanDerWaalsContact O-CB 3.3Å; D125-N129 WeakPolarHBondContact O-CB 3.43Å; D125-N129 PolarHBondContact O-N 2.92Å; D125-N129 PolarHBondContact O-ND2 3.05Å; D125-N129 PolarHBondContact O-OD1 3.39Å; N129-S132 WeakPolarHBondContact CA-OG 3.32Å; N129-S132 PolarHBondContact O-OG 2.84Å; N129-S133 WeakPolarHBondContact O-CB 3.36Å; N129-S133 PolarHBondContact O-N 3.03Å; N129-S133 PolarHBondContact O-OG 2.82Å |
| 130 | K | 98.3 | Very high | 97.2 | Very high | 140 Ų | 140 | 107.6 Ų | 107.6 | 61% | 0.609 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.9 | -45.6 | 173.4 | -174.2 | 177 | -176.6 | 179.2 | 0 | 111.2 | R126 W127 L128 S133 I134 | R126-K130 WeakPolarHBondContact O-CB 3.37Å; R126-K130 PolarHBondContact O-N 3.28Å; W127-K130 WeakPolarHBondContact O-CB 3.43Å; W127-K130 PolarHBondContact O-N 3.28Å; L128-K130 VanDerWaalsContact C-N 3.3Å; L128-K130 PolarHBondContact O-N 3.01Å; K130-S133 PolarHBondContact O-N 3.48Å; K130-I134 HydrophobicContact CG-CD1 4.05Å; K130-I134 VanDerWaalsContact O-CG1 3.29Å; K130-I134 WeakPolarHBondContact O-CG1 3.14Å; K130-I134 PolarHBondContact O-N 3.36Å |
| 131 | I | 98.2 | Very high | 97.2 | Very high | 54 Ų | 54 | 108.2 Ų | 108.2 | 28% | 0.277 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.2 | -46.2 | 178.5 | -68.4 | 167.5 | 0 | 0 | 0 | 111.1 | W127 L128 S133 I134 K135 | W127-I131 HydrophobicContact CD2-CD1 3.86Å; W127-I131 HydrophobicContact CE3-CD1 4.38Å; W127-I131 HydrophobicContact CG-CD1 4.35Å; W127-I131 HydrophobicContact CH2-CD1 4.13Å; W127-I131 HydrophobicContact CZ2-CD1 3.55Å; W127-I131 WeakPolarHBondContact O-CG1 3.35Å; W127-I131 PolarHBondContact O-N 3.48Å; L128-I131 PolarHBondContact O-N 3.38Å; I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 2.88Å; I131-I134 PolarHBondContact O-N 3.19Å; I131-K135 HydrophobicContact CG2-CD 4.22Å; I131-K135 WeakPolarHBondContact O-CG 3.43Å; I131-K135 PolarHBondContact O-N 3.33Å |
| 132 | S | 97.8 | Very high | 97.2 | Very high | 62 Ų | 62 | 105.7 Ų | 105.7 | 43% | 0.434 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.9 | -41.7 | 179.3 | 61.8 | 0 | 0 | 0 | 0 | 111.5 | L128 N129 I134 K135 L136 | L128-S132 PolarHBondContact O-N 3.39Å; L128-S132 PolarHBondContact O-OG 3.41Å; N129-S132 WeakPolarHBondContact CA-OG 3.32Å; N129-S132 PolarHBondContact O-OG 2.84Å; S132-I134 PolarHBondContact O-N 3.11Å; S132-K135 PolarHBondContact O-N 3.29Å; S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 PolarHBondContact O-N 3Å |
| 133 | S | 97.4 | Very high | 97 | Very high | 71 Ų | 71 | 104.2 Ų | 104.2 | 50% | 0.497 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60.9 | -43.2 | 177 | -56.5 | 0 | 0 | 0 | 0 | 111.8 | N129 K130 I131 L136 A137 | N129-S133 WeakPolarHBondContact O-CB 3.36Å; N129-S133 PolarHBondContact O-N 3.03Å; N129-S133 PolarHBondContact O-OG 2.82Å; K130-S133 PolarHBondContact O-N 3.48Å; I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 2.88Å; S133-L136 PolarHBondContact O-N 3.26Å; S133-A137 WeakPolarHBondContact O-CB 3.27Å; S133-A137 PolarHBondContact O-N 2.82Å |
| 134 | I | 97.8 | Very high | 96.6 | Very high | 83 Ų | 83 | 100.7 Ų | 100.7 | 43% | 0.426 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.4 | -42.5 | 176.8 | -67.3 | 164.7 | 0 | 0 | 0 | 111.2 | K130 I131 S132 A137 K138 | K130-I134 HydrophobicContact CG-CD1 4.05Å; K130-I134 VanDerWaalsContact O-CG1 3.29Å; K130-I134 WeakPolarHBondContact O-CG1 3.14Å; K130-I134 PolarHBondContact O-N 3.36Å; I131-I134 PolarHBondContact O-N 3.19Å; S132-I134 PolarHBondContact O-N 3.11Å; I134-A137 PolarHBondContact O-N 3.19Å; I134-K138 HydrophobicContact CG2-CD 4.37Å; I134-K138 WeakPolarHBondContact O-CG 3.48Å; I134-K138 PolarHBondContact O-N 3.43Å |
| 135 | K | 98.2 | Very high | 96.3 | Very high | 142 Ų | 142 | 96.6 Ų | 96.6 | 62% | 0.617 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.9 | -47.1 | 178.3 | -74.3 | -179.5 | 178.1 | -173.8 | 0 | 111.3 | I131 S132 K138 E139 | I131-K135 HydrophobicContact CG2-CD 4.22Å; I131-K135 WeakPolarHBondContact O-CG 3.43Å; I131-K135 PolarHBondContact O-N 3.33Å; S132-K135 PolarHBondContact O-N 3.29Å; K135-K138 PolarHBondContact O-N 2.98Å; K135-E139 WeakPolarHBondContact O-CB 3.37Å; K135-E139 PolarHBondContact O-N 3.43Å |
| 136 | L | 97.4 | Very high | 96 | Very high | 92 Ų | 92 | 100.6 Ų | 100.6 | 48% | 0.482 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 178.4 | -174.1 | 160.5 | 0 | 0 | 0 | 110.8 | S132 S133 K138 E139 Q140 | S132-L136 WeakPolarHBondContact O-CB 3.35Å; S132-L136 PolarHBondContact O-N 3Å; S133-L136 PolarHBondContact O-N 3.26Å; L136-K138 VanDerWaalsContact C-N 3.35Å; L136-K138 PolarHBondContact O-N 3.36Å; L136-E139 PolarHBondContact O-N 2.87Å; L136-Q140 VanDerWaalsContact CD2-CD 3.4Å; L136-Q140 HydrophobicContact CD2-CG 4.05Å; L136-Q140 VanDerWaalsContact CD2-NE2 3.26Å; L136-Q140 WeakPolarHBondContact O-CG 3.43Å; L136-Q140 PolarHBondContact O-N 2.85Å |
| 137 | A | 97.3 | Very high | 95.5 | Very high | 45 Ų | 45 | 96.4 Ų | 96.4 | 37% | 0.372 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61 | -41.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S133 I134 Q140 Q141 | S133-A137 WeakPolarHBondContact O-CB 3.27Å; S133-A137 PolarHBondContact O-N 2.82Å; I134-A137 PolarHBondContact O-N 3.19Å; A137-Q140 PolarHBondContact O-N 2.98Å; A137-Q141 WeakPolarHBondContact O-CG 3.49Å; A137-Q141 PolarHBondContact O-N 3.44Å |
| 138 | K | 97.7 | Very high | 94.8 | Very high | 133 Ų | 133 | 93 Ų | 93 | 58% | 0.578 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -64.8 | -43.2 | 175.5 | -74.9 | -177.4 | 176.6 | -171.2 | 0 | 112.2 | I134 K135 L136 Q140 Q141 V142 | I134-K138 HydrophobicContact CG2-CD 4.37Å; I134-K138 WeakPolarHBondContact O-CG 3.48Å; I134-K138 PolarHBondContact O-N 3.43Å; K135-K138 PolarHBondContact O-N 2.98Å; L136-K138 VanDerWaalsContact C-N 3.35Å; L136-K138 PolarHBondContact O-N 3.36Å; K138-Q140 VanDerWaalsContact C-N 3.32Å; K138-Q140 PolarHBondContact O-N 3.26Å; K138-Q141 PolarHBondContact O-N 2.87Å; K138-V142 WeakPolarHBondContact O-CG2 3.34Å; K138-V142 PolarHBondContact O-N 3.3Å |
| 139 | E | 96.6 | Very high | 94.3 | Very high | 144 Ų | 144 | 94 Ų | 94 | 67% | 0.673 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -61.2 | -42.7 | 176.7 | -177.5 | 174.3 | -169.8 | 0 | 0 | 111.3 | K135 L136 V142 A143 | K135-E139 WeakPolarHBondContact O-CB 3.37Å; K135-E139 PolarHBondContact O-N 3.43Å; L136-E139 PolarHBondContact O-N 2.87Å; E139-V142 PolarHBondContact O-N 2.91Å; E139-A143 WeakPolarHBondContact O-CB 3.46Å; E139-A143 PolarHBondContact O-N 3.26Å |
| 140 | Q | 93.9 | Very high | 93.4 | Very high | 107 Ų | 107 | 95.6 Ų | 95.6 | 50% | 0.5 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.7 | -44.7 | 174.3 | -74.4 | 179.9 | -16 | 0 | 0 | 112.3 | L136 A137 K138 V142 A143 Q144 | L136-Q140 VanDerWaalsContact CD2-CD 3.4Å; L136-Q140 HydrophobicContact CD2-CG 4.05Å; L136-Q140 VanDerWaalsContact CD2-NE2 3.26Å; L136-Q140 WeakPolarHBondContact O-CG 3.43Å; L136-Q140 PolarHBondContact O-N 2.85Å; A137-Q140 PolarHBondContact O-N 2.98Å; K138-Q140 VanDerWaalsContact C-N 3.32Å; K138-Q140 PolarHBondContact O-N 3.26Å; Q140-V142 PolarHBondContact O-N 3.49Å; Q140-A143 PolarHBondContact O-N 3.41Å; Q140-Q144 WeakPolarHBondContact O-CB 3.33Å; Q140-Q144 VanDerWaalsContact O-CG 3.31Å; Q140-Q144 WeakPolarHBondContact O-CG 3.37Å; Q140-Q144 PolarHBondContact O-N 3.46Å |
| 141 | Q | 95.6 | Very high | 92.3 | Very high | 132 Ų | 132 | 95.1 Ų | 95.1 | 62% | 0.617 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.3 | -45.1 | 175.9 | -76.9 | -176.1 | -5.8 | 0 | 0 | 112 | A137 K138 A143 Q144 A145 | A137-Q141 WeakPolarHBondContact O-CG 3.49Å; A137-Q141 PolarHBondContact O-N 3.44Å; K138-Q141 PolarHBondContact O-N 2.87Å; Q141-A143 VanDerWaalsContact C-N 3.33Å; Q141-A143 PolarHBondContact O-N 3.48Å; Q141-Q144 PolarHBondContact O-N 3.37Å; Q141-A145 WeakPolarHBondContact O-CB 3.41Å; Q141-A145 PolarHBondContact O-N 2.97Å |
| 142 | V | 95.8 | Very high | 90.9 | Very high | 80 Ų | 80 | 97 Ų | 97 | 49% | 0.485 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.5 | -43 | 176.5 | 170.9 | 0 | 0 | 0 | 0 | 110.7 | K138 E139 Q140 A145 K146 | K138-V142 WeakPolarHBondContact O-CG2 3.34Å; K138-V142 PolarHBondContact O-N 3.3Å; E139-V142 PolarHBondContact O-N 2.91Å; Q140-V142 PolarHBondContact O-N 3.49Å; V142-A145 PolarHBondContact O-N 2.93Å; V142-K146 HydrophobicContact CG1-CD 4.25Å; V142-K146 WeakPolarHBondContact O-CB 3.4Å; V142-K146 VanDerWaalsContact O-CG 3.32Å; V142-K146 WeakPolarHBondContact O-CG 3.32Å; V142-K146 PolarHBondContact O-N 3.29Å |
| 143 | A | 91 | Very high | 89.8 | Confident | 30 Ų | 30 | 101.2 Ų | 101.2 | 25% | 0.248 | 56% | 0.563 | C | S | . | * | H | α-helix | trans | -63 | -42 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | E139 Q140 Q141 K146 R147 | E139-A143 WeakPolarHBondContact O-CB 3.46Å; E139-A143 PolarHBondContact O-N 3.26Å; Q140-A143 PolarHBondContact O-N 3.41Å; Q141-A143 VanDerWaalsContact C-N 3.33Å; Q141-A143 PolarHBondContact O-N 3.48Å; A143-K146 PolarHBondContact O-N 3.49Å; A143-R147 VanDerWaalsContact O-CG 3.27Å; A143-R147 WeakPolarHBondContact O-CG 3.47Å; A143-R147 PolarHBondContact O-N 3.04Å |
| 144 | Q | 89.6 | Confident | 88.7 | Confident | 114 Ų | 114 | 100.8 Ų | 100.8 | 53% | 0.533 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.7 | -43.3 | 176.3 | -73.8 | 174.6 | -0.4 | 0 | 0 | 112.2 | Q140 Q141 K146 R147 A148 | Q140-Q144 WeakPolarHBondContact O-CB 3.33Å; Q140-Q144 VanDerWaalsContact O-CG 3.31Å; Q140-Q144 WeakPolarHBondContact O-CG 3.37Å; Q140-Q144 PolarHBondContact O-N 3.46Å; Q141-Q144 PolarHBondContact O-N 3.37Å; Q144-K146 VanDerWaalsContact C-N 3.32Å; Q144-K146 PolarHBondContact O-N 3.44Å; Q144-R147 WeakPolarHBondContact O-CB 3.42Å; Q144-R147 PolarHBondContact O-N 2.9Å; Q144-A148 WeakPolarHBondContact O-CB 3.44Å; Q144-A148 PolarHBondContact O-N 3.23Å |
| 145 | A | 91.4 | Very high | 87.8 | Confident | 62 Ų | 62 | 99.8 Ų | 99.8 | 51% | 0.512 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.6 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q141 V142 A148 A149 | Q141-A145 WeakPolarHBondContact O-CB 3.41Å; Q141-A145 PolarHBondContact O-N 2.97Å; V142-A145 PolarHBondContact O-N 2.93Å; A145-A148 PolarHBondContact O-N 3.02Å; A145-A149 WeakPolarHBondContact O-CB 3.5Å; A145-A149 PolarHBondContact O-N 3.49Å |
| 146 | K | 89.9 | Confident | 87.2 | Confident | 139 Ų | 139 | 99 Ų | 99 | 60% | 0.604 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -61.1 | -44 | 173.3 | -74.6 | 177.5 | 178.3 | -176.7 | 0 | 111.9 | V142 A143 Q144 A149 M150 | V142-K146 HydrophobicContact CG1-CD 4.25Å; V142-K146 WeakPolarHBondContact O-CB 3.4Å; V142-K146 VanDerWaalsContact O-CG 3.32Å; V142-K146 WeakPolarHBondContact O-CG 3.32Å; V142-K146 PolarHBondContact O-N 3.29Å; A143-K146 PolarHBondContact O-N 3.49Å; Q144-K146 VanDerWaalsContact C-N 3.32Å; Q144-K146 PolarHBondContact O-N 3.44Å; K146-A149 PolarHBondContact O-N 2.97Å; K146-M150 WeakPolarHBondContact O-CG 3.3Å; K146-M150 PolarHBondContact O-N 3.34Å; K146-M150 VanDerWaalsContact O-N 3.11Å |
| 147 | R | 86.8 | Confident | 86.5 | Confident | 74 Ų | 74 | 100.4 Ų | 100.4 | 28% | 0.279 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -61.2 | -45.7 | 175.7 | -69.9 | 170.4 | -148.9 | 171.1 | 5 | 111.6 | A143 Q144 A149 M150 D155 R157 | A143-R147 VanDerWaalsContact O-CG 3.27Å; A143-R147 WeakPolarHBondContact O-CG 3.47Å; A143-R147 PolarHBondContact O-N 3.04Å; Q144-R147 WeakPolarHBondContact O-CB 3.42Å; Q144-R147 PolarHBondContact O-N 2.9Å; R147-A149 PolarHBondContact O-N 2.94Å; R147-M150 PolarHBondContact O-N 2.87Å; R147-D155 WeakPolarHBondContact CD-OD2 3.37Å; R147-R157 VanDerWaalsContact CZ-CG 3.49Å |
| 148 | A | 84.9 | Confident | 86 | Confident | 88 Ų | 88 | 102 Ų | 102 | 73% | 0.727 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.2 | -30.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q144 A145 | Q144-A148 WeakPolarHBondContact O-CB 3.44Å; Q144-A148 PolarHBondContact O-N 3.23Å; A145-A148 PolarHBondContact O-N 3.02Å |
| 149 | A | 86.3 | Confident | 85.4 | Confident | 84 Ų | 84 | 100.8 Ų | 100.8 | 69% | 0.694 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -79.1 | -23.8 | 177 | 0 | 0 | 0 | 0 | 0 | 113.6 | A145 K146 R147 | A145-A149 WeakPolarHBondContact O-CB 3.5Å; A145-A149 PolarHBondContact O-N 3.49Å; K146-A149 PolarHBondContact O-N 2.97Å; R147-A149 PolarHBondContact O-N 2.94Å |
| 150 | M | 80.4 | Confident | 84.9 | Confident | 131 Ų | 131 | 96.1 Ų | 96.1 | 65% | 0.645 | 56% | 0.556 | S | S | * | * | S | Bend | trans | -86.1 | 124.4 | 177.1 | -68.7 | 177.6 | 71.7 | 0 | 0 | 109.1 | K146 R147 V152 | K146-M150 WeakPolarHBondContact O-CG 3.3Å; K146-M150 PolarHBondContact O-N 3.34Å; K146-M150 VanDerWaalsContact O-N 3.11Å; R147-M150 PolarHBondContact O-N 2.87Å; M150-V152 WeakPolarHBondContact O-CG2 3.48Å; M150-V152 PolarHBondContact O-N 3.19Å |
| 151 | P | 74.1 | Confident | 84.5 | Confident | 130 Ų | 130 | 95.3 Ų | 95.3 | 84% | 0.844 | 56% | 0.555 | S | S | * | * | trans | -62 | 113.3 | 178 | 22.6 | -30.6 | 0 | 0 | 0 | 110.1 | V153 | P151-V153 PolarHBondContact O-N 3.01Š| ||
| 152 | V | 70.1 | Confident | 84.2 | Confident | 94 Ų | 94 | 92.9 Ų | 92.9 | 57% | 0.57 | 56% | 0.557 | S | S | * | * | trans | -86.3 | 94.8 | -165.7 | -178.3 | 0 | 0 | 0 | 0 | 111 | M150 D155 | M150-V152 WeakPolarHBondContact O-CG2 3.48Å; M150-V152 PolarHBondContact O-N 3.19Å; V152-D155 HydrophobicContact CG1-CB 3.71Å | ||
| 153 | V | 73.2 | Confident | 84 | Confident | 151 Ų | 151 | 94.9 Ų | 94.9 | 92% | 0.915 | 57% | 0.565 | S | S | * | * | S | Bend | trans | -115.5 | 105.6 | 147.3 | -178.9 | 0 | 0 | 0 | 0 | 106.3 | P151 | P151-V153 PolarHBondContact O-N 3.01Š|
| 154 | G | 74.6 | Confident | 83.8 | Confident | 62 Ų | 62 | 97 Ų | 97 | 64% | 0.639 | 58% | 0.576 | S | S | * | * | trans | 102.9 | 30 | 173.5 | 0 | 0 | 0 | 0 | 0 | 117.8 | M156 | G154-M156 PolarHBondContact O-N 3.29Å; G154-M156 VanDerWaalsContact O-N 3.07Å | ||
| 155 | D | 79.2 | Confident | 83.5 | Confident | 61 Ų | 61 | 97.7 Ų | 97.7 | 33% | 0.326 | 58% | 0.579 | S | S | . | * | trans | -66.4 | 108 | 167.9 | -174.7 | 6.6 | 0 | 0 | 0 | 110.1 | R147 V152 R157 P158 | R147-D155 WeakPolarHBondContact CD-OD2 3.37Å; V152-D155 HydrophobicContact CG1-CB 3.71Å; D155-R157 VanDerWaalsContact C-N 3.27Å; D155-R157 WeakPolarHBondContact OD1-CB 3.43Å; D155-R157 PolarHBondContact OD1-N 2.83Å; D155-P158 WeakPolarHBondContact O-CD 3.4Å | ||
| 156 | M | 85 | Confident | 83 | Confident | 127 Ų | 127 | 100.9 Ų | 100.9 | 63% | 0.626 | 59% | 0.587 | S | S | * | * | trans | -81.3 | -6.1 | 178.8 | -66.5 | -59.5 | -67.4 | 0 | 0 | 112.9 | G154 L159 A160 | G154-M156 PolarHBondContact O-N 3.29Å; G154-M156 VanDerWaalsContact O-N 3.07Å; M156-L159 HydrophobicContact CE-CD1 3.45Å; M156-L159 VanDerWaalsContact CE-CD1 3.45Å; M156-L159 WeakPolarHBondContact O-CB 3.48Å; M156-L159 PolarHBondContact O-N 3.1Å; M156-L159 HydrophobicContact SD-CD1 3.91Å; M156-A160 PolarHBondContact O-N 2.82Å | ||
| 157 | R | 83.9 | Confident | 82.5 | Confident | 121 Ų | 121 | 97.8 Ų | 97.8 | 46% | 0.457 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -68.5 | -37.9 | -173.7 | -167.5 | 66.6 | -162.7 | -174.7 | 8.2 | 114.7 | R147 D155 L159 A160 D161 | R147-R157 VanDerWaalsContact CZ-CG 3.49Å; D155-R157 VanDerWaalsContact C-N 3.27Å; D155-R157 WeakPolarHBondContact OD1-CB 3.43Å; D155-R157 PolarHBondContact OD1-N 2.83Å; R157-L159 PolarHBondContact O-N 3.39Å; R157-A160 PolarHBondContact O-N 3.13Å; R157-A160 VanDerWaalsContact O-N 3.09Å; R157-D161 IonicContact CZ-OD1 3.2Å; R157-D161 IonicContact NE-OD1 2.82Å; R157-D161 PolarHBondContact NE-OD1 3.4Å; R157-D161 IonicContact NE-OD2 3.67Å; R157-D161 IonicContact NH2-OD1 2.82Å; R157-D161 PolarHBondContact NH2-OD1 2.86Å; R157-D161 PolarHBondContact O-N 3.3Å |
| 158 | P | 85.9 | Confident | 82.3 | Confident | 78 Ų | 78 | 100.8 Ų | 100.8 | 51% | 0.506 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -56.5 | -36.2 | 172.3 | -26 | 36 | 0 | 0 | 0 | 112.9 | D155 D161 A162 | D155-P158 WeakPolarHBondContact O-CD 3.4Å; P158-D161 PolarHBondContact O-N 3.38Å; P158-A162 VanDerWaalsContact O-CB 3.32Å; P158-A162 WeakPolarHBondContact O-CB 3.43Å; P158-A162 PolarHBondContact O-N 2.82Å |
| 159 | L | 85.9 | Confident | 82.1 | Confident | 107 Ų | 107 | 101.9 Ų | 101.9 | 56% | 0.56 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -67.5 | -41 | 176 | -62.4 | 174.5 | 0 | 0 | 0 | 111.5 | M156 R157 L163 | M156-L159 HydrophobicContact CE-CD1 3.45Å; M156-L159 VanDerWaalsContact CE-CD1 3.45Å; M156-L159 WeakPolarHBondContact O-CB 3.48Å; M156-L159 PolarHBondContact O-N 3.1Å; M156-L159 HydrophobicContact SD-CD1 3.91Å; R157-L159 PolarHBondContact O-N 3.39Å; L159-L163 WeakPolarHBondContact O-CG 3.27Å |
| 160 | A | 85.5 | Confident | 81.9 | Confident | 47 Ų | 47 | 100.3 Ų | 100.3 | 39% | 0.388 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -67.5 | -38.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | M156 R157 A162 L163 | M156-A160 PolarHBondContact O-N 2.82Å; R157-A160 PolarHBondContact O-N 3.13Å; R157-A160 VanDerWaalsContact O-N 3.09Å; A160-A162 VanDerWaalsContact C-N 3.33Å; A160-L163 PolarHBondContact O-N 3.03Å |
| 161 | D | 85.8 | Confident | 81.8 | Confident | 89 Ų | 89 | 97.8 Ų | 97.8 | 48% | 0.476 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -74.6 | -24.2 | -179.8 | -67 | -17.8 | 0 | 0 | 0 | 112 | R157 P158 L163 | R157-D161 IonicContact CZ-OD1 3.2Å; R157-D161 IonicContact NE-OD1 2.82Å; R157-D161 PolarHBondContact NE-OD1 3.4Å; R157-D161 IonicContact NE-OD2 3.67Å; R157-D161 IonicContact NH2-OD1 2.82Å; R157-D161 PolarHBondContact NH2-OD1 2.86Å; R157-D161 PolarHBondContact O-N 3.3Å; P158-D161 PolarHBondContact O-N 3.38Å; D161-L163 VanDerWaalsContact C-N 3.27Å; D161-L163 PolarHBondContact O-N 3.02Å |
| 162 | A | 88.7 | Confident | 81.3 | Confident | 81 Ų | 81 | 95.3 Ų | 95.3 | 67% | 0.669 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.3 | -13.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.7 | P158 A160 | P158-A162 VanDerWaalsContact O-CB 3.32Å; P158-A162 WeakPolarHBondContact O-CB 3.43Å; P158-A162 PolarHBondContact O-N 2.82Å; A160-A162 VanDerWaalsContact C-N 3.33Å |
| 163 | L | 90.8 | Very high | 80.7 | Confident | 122 Ų | 122 | 96 Ų | 96 | 64% | 0.639 | 56% | 0.561 | S | S | * | * | S | Bend | trans | -84.3 | 140.1 | 177.6 | -66 | 176 | 0 | 0 | 0 | 111 | L159 A160 D161 E165 | L159-L163 WeakPolarHBondContact O-CG 3.27Å; A160-L163 PolarHBondContact O-N 3.03Å; D161-L163 VanDerWaalsContact C-N 3.27Å; D161-L163 PolarHBondContact O-N 3.02Å; L163-E165 PolarHBondContact O-N 3.07Å |
| 164 | P | 87 | Confident | 80 | Confident | 76 Ų | 76 | 92 Ų | 92 | 49% | 0.494 | 54% | 0.536 | S | S | . | . | P | Polyproline II helix | trans | -57.7 | 134.3 | 173.5 | -23.7 | 32.9 | 0 | 0 | 0 | 111.7 | L169 | P164-L169 HydrophobicContact CB-CD1 4.29Å; P164-L169 HydrophobicContact CB-CD2 4.03Å; P164-L169 HydrophobicContact CB-CG 4.08Å |
| 165 | E | 84.1 | Confident | 79 | Confident | 127 Ų | 127 | 98.3 Ų | 98.3 | 59% | 0.593 | 54% | 0.541 | S | S | * | . | P | Polyproline II helix | trans | -68.2 | 142.9 | 171.2 | -66.8 | -170.7 | 175.5 | 0 | 0 | 110.2 | L163 C167 Q168 | L163-E165 PolarHBondContact O-N 3.07Å; E165-C167 PolarHBondContact O-N 2.96Å; E165-C167 PolarHBondContact OE2-SG 3.22Å; E165-C167 VanDerWaalsContact OE2-SG 3.36Å; E165-Q168 HydrophobicContact CB-CG 4.35Å; E165-Q168 WeakPolarHBondContact O-CB 3.21Å; E165-Q168 PolarHBondContact O-N 3.39Å |
| 166 | L | 80.7 | Confident | 77.7 | Confident | 130 Ų | 130 | 101.2 Ų | 101.2 | 68% | 0.681 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -55.1 | -26.6 | -179 | -161.3 | 70 | 0 | 0 | 0 | 112.9 | Q168 L169 I170 | L166-Q168 VanDerWaalsContact C-N 3.27Å; L166-Q168 PolarHBondContact O-N 3.37Å; L166-L169 PolarHBondContact O-N 3.23Å; L166-I170 HydrophobicContact CD2-CD1 4.42Å; L166-I170 HydrophobicContact CG-CD1 4.04Å; L166-I170 WeakPolarHBondContact O-CD1 3.41Å; L166-I170 WeakPolarHBondContact O-CG1 3.46Å; L166-I170 PolarHBondContact O-N 3.09Å |
| 167 | C | 79 | Confident | 75.8 | Confident | 74 Ų | 74 | 99.5 Ų | 99.5 | 50% | 0.5 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.9 | -25.7 | 176.3 | 68.1 | 0 | 0 | 0 | 0 | 113.8 | E165 | E165-C167 PolarHBondContact O-N 2.96Å; E165-C167 PolarHBondContact OE2-SG 3.22Å; E165-C167 VanDerWaalsContact OE2-SG 3.36Å |
| 168 | Q | 82.4 | Confident | 74 | Confident | 136 Ų | 136 | 103.6 Ų | 103.6 | 64% | 0.636 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -83.2 | -31.2 | 178.4 | -56.2 | 175.5 | 24.6 | 0 | 0 | 111.1 | E165 L166 | E165-Q168 HydrophobicContact CB-CG 4.35Å; E165-Q168 WeakPolarHBondContact O-CB 3.21Å; E165-Q168 PolarHBondContact O-N 3.39Å; L166-Q168 VanDerWaalsContact C-N 3.27Å; L166-Q168 PolarHBondContact O-N 3.37Å |
| 169 | L | 81.7 | Confident | 72.1 | Confident | 112 Ų | 112 | 109.9 Ų | 109.9 | 59% | 0.586 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -81.7 | -21.5 | -179.7 | -62.1 | 178.4 | 0 | 0 | 0 | 113.5 | P164 L166 P171 | P164-L169 HydrophobicContact CB-CD1 4.29Å; P164-L169 HydrophobicContact CB-CD2 4.03Å; P164-L169 HydrophobicContact CB-CG 4.08Å; L166-L169 PolarHBondContact O-N 3.23Å; L169-P171 VanDerWaalsContact O-CD 3.27Å; L169-P171 WeakPolarHBondContact O-CD 3.09Å |
| 170 | I | 82.4 | Confident | 70.6 | Confident | 51 Ų | 51 | 109.1 Ų | 109.1 | 26% | 0.262 | 61% | 0.606 | S | S | . | * | S | Bend | trans | -83 | 113.6 | 179 | -67.8 | 167.5 | 0 | 0 | 0 | 108.7 | L166 A172 T174 R175 | L166-I170 HydrophobicContact CD2-CD1 4.42Å; L166-I170 HydrophobicContact CG-CD1 4.04Å; L166-I170 WeakPolarHBondContact O-CD1 3.41Å; L166-I170 WeakPolarHBondContact O-CG1 3.46Å; L166-I170 PolarHBondContact O-N 3.09Å; I170-A172 PolarHBondContact O-N 3.47Å; I170-T174 WeakPolarHBondContact CG2-OG1 3.36Å; I170-R175 HydrophobicContact CG2-CG 4.46Å |
| 171 | P | 77.7 | Confident | 68.6 | Low | 78 Ų | 78 | 111.8 Ų | 111.8 | 51% | 0.506 | 62% | 0.621 | S | S | . | * | trans | -58.1 | 134.7 | 176.5 | -22.6 | 34.4 | 0 | 0 | 0 | 110 | L169 T173 T174 | L169-P171 VanDerWaalsContact O-CD 3.27Å; L169-P171 WeakPolarHBondContact O-CD 3.09Å; P171-T173 HydrophobicContact CB-CG2 3.67Å; P171-T173 PolarHBondContact O-N 3.24Å; P171-T174 PolarHBondContact O-N 2.81Å; P171-T174 PolarHBondContact O-OG1 3.28Å | ||
| 172 | A | 63.4 | Low | 66.7 | Low | 78 Ų | 78 | 118.1 Ų | 118.1 | 65% | 0.645 | 64% | 0.638 | S | S | * | * | G | 310 helix | trans | -53.5 | -26.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | I170 T174 R175 | I170-A172 PolarHBondContact O-N 3.47Å; A172-T174 VanDerWaalsContact C-N 3.32Å; A172-T174 PolarHBondContact O-N 2.95Å; A172-R175 WeakPolarHBondContact O-CB 3.09Å; A172-R175 PolarHBondContact O-N 2.92Å |
| 173 | T | 58.6 | Low | 65 | Low | 109 Ų | 109 | 124.3 Ų | 124.3 | 67% | 0.669 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -63.1 | -28.6 | 173.8 | 179.3 | 0 | 0 | 0 | 0 | 114.2 | P171 R175 T176 | P171-T173 HydrophobicContact CB-CG2 3.67Å; P171-T173 PolarHBondContact O-N 3.24Å; T173-R175 VanDerWaalsContact C-N 3.32Å; T173-R175 PolarHBondContact O-N 3.31Å; T173-T176 PolarHBondContact O-OG1 2.85Å |
| 174 | T | 57.4 | Low | 62.7 | Low | 66 Ų | 66 | 125.5 Ų | 125.5 | 41% | 0.405 | 66% | 0.657 | S | S | . | * | G | 310 helix | trans | -87 | -0.5 | 177.8 | 62 | 0 | 0 | 0 | 0 | 113.5 | I170 P171 A172 T176 | I170-T174 WeakPolarHBondContact CG2-OG1 3.36Å; P171-T174 PolarHBondContact O-N 2.81Å; P171-T174 PolarHBondContact O-OG1 3.28Å; A172-T174 VanDerWaalsContact C-N 3.32Å; A172-T174 PolarHBondContact O-N 2.95Å; T174-T176 PolarHBondContact O-N 3.42Å |
| 175 | R | 54.8 | Low | 61.1 | Low | 195 Ų | 195 | 133.8 Ų | 133.8 | 74% | 0.736 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -73.9 | -8.7 | 176.6 | -60.8 | -179 | 74.4 | 152.5 | 1.1 | 112.6 | I170 A172 T173 | I170-R175 HydrophobicContact CG2-CG 4.46Å; A172-R175 WeakPolarHBondContact O-CB 3.09Å; A172-R175 PolarHBondContact O-N 2.92Å; T173-R175 VanDerWaalsContact C-N 3.32Å; T173-R175 PolarHBondContact O-N 3.31Å |
| 176 | T | 51 | Low | 59.2 | Low | 122 Ų | 122 | 132.7 Ų | 132.7 | 75% | 0.748 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -112.1 | 49.9 | -177.6 | 59.7 | 0 | 0 | 0 | 0 | 113.5 | T173 T174 | T173-T176 PolarHBondContact O-OG1 2.85Å; T174-T176 PolarHBondContact O-N 3.42Å |
| 177 | S | 45.6 | Very low | 57.7 | Low | 90 Ų | 90 | 131.9 Ų | 131.9 | 63% | 0.629 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -159 | 10.9 | 167.6 | 65.3 | 0 | 0 | 0 | 0 | 117.4 | ||
| 178 | R | 44.7 | Very low | 56.2 | Low | 207 Ų | 207 | 134.2 Ų | 134.2 | 78% | 0.781 | 69% | 0.694 | S | S | * | * | S | Bend | trans | -96 | 24 | 174.5 | -76.1 | -170.2 | -80.7 | 159.5 | -8.7 | 114.8 | ||
| 179 | K | 47.5 | Very low | 54.9 | Low | 210 Ų | 210 | 137 Ų | 137 | 91% | 0.913 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -120.6 | 39.8 | 170.9 | -67.2 | -152.8 | -174.1 | -174.3 | 0 | 113.6 | ||
| 180 | A | 53.4 | Low | 53.9 | Low | 92 Ų | 92 | 141 Ų | 141 | 76% | 0.76 | 72% | 0.717 | S | S | * | * | trans | -168.6 | 86.5 | 159.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 181 | S | 44.6 | Very low | 52.8 | Low | 102 Ų | 102 | 147.3 Ų | 147.3 | 71% | 0.713 | 74% | 0.743 | S | S | * | * | trans | -152.7 | 106 | 155.2 | -167.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 182 | R | 45.1 | Very low | 52 | Low | 223 Ų | 223 | 149 Ų | 149 | 84% | 0.842 | 75% | 0.753 | S | S | * | * | trans | 63.1 | 95.9 | 142.7 | -63.9 | 177.3 | -176 | 166.7 | 1.6 | 117.8 | N184 | R182-N184 PolarHBondContact O-N 3.2Š| ||
| 183 | K | 52.3 | Low | 52 | Low | 211 Ų | 211 | 150.4 Ų | 150.4 | 92% | 0.917 | 75% | 0.747 | S | S | * | * | -5.4 | 92.7 | 124.7 | -60.1 | 173.1 | -174.6 | 176.5 | 0 | 113.2 | |||||
| 184 | N | 43.6 | Very low | 52.2 | Low | 147 Ų | 147 | 148 Ų | 148 | 79% | 0.786 | 73% | 0.733 | S | S | * | * | trans | -109.5 | 110.6 | 143.9 | -104.5 | -41.2 | 0 | 0 | 0 | 105.5 | R182 V186 | R182-N184 PolarHBondContact O-N 3.2Å; N184-V186 PolarHBondContact O-N 2.77Å | ||
| 185 | R | 53.5 | Low | 52.7 | Low | 249 Ų | 249 | 151.4 Ų | 151.4 | 94% | 0.94 | 75% | 0.754 | S | S | * | * | trans | -70 | 75 | 170 | -79 | -167.4 | 179.6 | -149.7 | 4.4 | 108.1 | ||||
| 186 | V | 43.3 | Very low | 54.1 | Low | 104 Ų | 104 | 146.1 Ų | 146.1 | 63% | 0.63 | 74% | 0.74 | S | S | * | * | trans | -79.7 | 132.1 | 151.5 | 179.2 | 0 | 0 | 0 | 0 | 104.9 | N184 V188 | N184-V186 PolarHBondContact O-N 2.77Å; V186-V188 PolarHBondContact O-N 3.11Å | ||
| 187 | P | 49.9 | Very low | 55.8 | Low | 113 Ų | 113 | 144.8 Ų | 144.8 | 73% | 0.734 | 72% | 0.724 | S | S | * | * | trans | -55.3 | 109.3 | 172.9 | 22.5 | -30.5 | 0 | 0 | 0 | 106.8 | K189 | P187-K189 PolarHBondContact O-N 2.91Š| ||
| 188 | V | 46.8 | Very low | 57.8 | Low | 123 Ų | 123 | 144.2 Ų | 144.2 | 75% | 0.745 | 72% | 0.72 | S | S | * | * | trans | -52.8 | 106.4 | 177 | 173.8 | 0 | 0 | 0 | 0 | 105.2 | V186 K190 | V186-V188 PolarHBondContact O-N 3.11Å; V188-K190 PolarHBondContact O-N 3.01Å | ||
| 189 | K | 55.3 | Low | 59.9 | Low | 196 Ų | 196 | 140.5 Ų | 140.5 | 85% | 0.852 | 72% | 0.715 | S | S | * | * | trans | -45.9 | 111.5 | 166.3 | -71.3 | -89.3 | -175.4 | 174.2 | 0 | 104.4 | P187 K191 | P187-K189 PolarHBondContact O-N 2.91Å; K189-K191 PolarHBondContact O-N 3.04Å; K189-K191 VanDerWaalsContact O-N 3.12Å | ||
| 190 | K | 61.8 | Low | 61.8 | Low | 196 Ų | 196 | 131 Ų | 131 | 85% | 0.852 | 67% | 0.674 | S | S | * | * | trans | -47 | 127.1 | -177.3 | -65.8 | -179.8 | -178 | 176 | 0 | 105.7 | V188 | V188-K190 PolarHBondContact O-N 3.01Š| ||
| 191 | K | 58.7 | Low | 63.7 | Low | 183 Ų | 183 | 133.7 Ų | 133.7 | 80% | 0.796 | 67% | 0.669 | S | S | * | * | trans | -45.2 | 131.4 | 173.4 | -73.1 | -71.7 | -178.2 | 179.5 | 0 | 106.8 | K189 E193 | K189-K191 PolarHBondContact O-N 3.04Å; K189-K191 VanDerWaalsContact O-N 3.12Å; K191-E193 PolarHBondContact O-N 3.27Å | ||
| 192 | P | 61.1 | Low | 66.1 | Low | 112 Ų | 112 | 133.1 Ų | 133.1 | 73% | 0.727 | 66% | 0.663 | S | S | * | * | trans | -50.3 | 132.2 | -179.9 | 21.1 | -31.4 | 0 | 0 | 0 | 107.2 | ||||
| 193 | E | 63.5 | Low | 68.4 | Low | 109 Ų | 109 | 126 Ų | 126 | 51% | 0.509 | 65% | 0.651 | S | S | . | * | trans | -47 | 127.4 | -178.4 | -177.7 | 158.9 | -173.1 | 0 | 0 | 108.3 | K191 T195 M200 | K191-E193 PolarHBondContact O-N 3.27Å; E193-T195 PolarHBondContact O-N 3.14Å; E193-T195 PolarHBondContact O-OG1 2.78Å; E193-T195 VanDerWaalsContact O-OG1 3.14Å; E193-M200 HydrophobicContact CG-CE 4.27Å; E193-M200 WeakPolarHBondContact OE1-CE 3.38Å | ||
| 194 | P | 62.2 | Low | 70.3 | Confident | 58 Ų | 58 | 119.4 Ų | 119.4 | 38% | 0.377 | 62% | 0.624 | S | S | . | * | trans | -51.8 | 105.6 | 180 | -27.1 | 34.6 | 0 | 0 | 0 | 108.9 | D196 M200 | P194-D196 PolarHBondContact O-N 2.74Å; P194-M200 HydrophobicContact CB-CG 4.24Å; P194-M200 WeakPolarHBondContact O-CG 3.39Å | ||
| 195 | T | 67.3 | Low | 72.6 | Confident | 138 Ų | 138 | 114.8 Ų | 114.8 | 85% | 0.847 | 60% | 0.597 | S | S | * | * | trans | -72.3 | -16.8 | -170.4 | -43.8 | 0 | 0 | 0 | 0 | 111.2 | E193 | E193-T195 PolarHBondContact O-N 3.14Å; E193-T195 PolarHBondContact O-OG1 2.78Å; E193-T195 VanDerWaalsContact O-OG1 3.14Å | ||
| 196 | D | 85.7 | Confident | 74.5 | Confident | 83 Ų | 83 | 110.6 Ų | 110.6 | 44% | 0.444 | 58% | 0.581 | S | S | . | * | trans | -87 | 113.2 | 177 | -173.8 | -16.2 | 0 | 0 | 0 | 111.3 | P194 S198 L199 | P194-D196 PolarHBondContact O-N 2.74Å; D196-S198 VanDerWaalsContact CG-OG 3.22Å; D196-S198 PolarHBondContact O-N 2.83Å; D196-S198 VanDerWaalsContact O-N 3.11Å; D196-S198 WeakPolarHBondContact OD1-CB 2.92Å; D196-S198 PolarHBondContact OD1-N 2.81Å; D196-S198 PolarHBondContact OD1-OG 2.86Å; D196-S198 PolarHBondContact OD2-OG 3.12Å; D196-L199 HydrophobicContact CB-CB 4.45Å; D196-L199 HydrophobicContact CB-CD1 3.95Å; D196-L199 HydrophobicContact CB-CG 4.02Å; D196-L199 PolarHBondContact O-N 3Å | ||
| 197 | F | 86.8 | Confident | 77 | Confident | 94 Ų | 94 | 112.6 Ų | 112.6 | 41% | 0.412 | 58% | 0.581 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -54.6 | -28.8 | 178.8 | -169 | -99.9 | 0 | 0 | 0 | 113.2 | L199 K205 L208 L209 | F197-L199 VanDerWaalsContact C-N 3.35Å; F197-K205 HydrophobicContact CD1-CD 4.16Å; F197-K205 HydrophobicContact CD2-CB 4.45Å; F197-K205 HydrophobicContact CD2-CD 4.44Å; F197-K205 HydrophobicContact CD2-CG 4.21Å; F197-K205 HydrophobicContact CE1-CD 3.79Å; F197-K205 HydrophobicContact CE2-CB 3.74Å; F197-K205 HydrophobicContact CE2-CD 4.1Å; F197-K205 HydrophobicContact CE2-CG 3.91Å; F197-K205 HydrophobicContact CG-CD 4.48Å; F197-K205 HydrophobicContact CZ-CB 3.93Å; F197-K205 HydrophobicContact CZ-CD 3.77Å; F197-K205 HydrophobicContact CZ-CG 4.08Å; F197-K205 WeakPolarHBondContact O-CE 2.92Å; F197-K205 PolarHBondContact O-NZ 3.15Å; F197-L208 HydrophobicContact CD2-CD2 4.12Å; F197-L209 HydrophobicContact CE2-CD1 4.37Å; F197-L209 HydrophobicContact CE2-CD2 4.32Å; F197-L209 HydrophobicContact CE2-CG 4.19Å; F197-L209 HydrophobicContact CZ-CD1 4.27Å |
| 198 | S | 87.1 | Confident | 79 | Confident | 78 Ų | 78 | 109.5 Ų | 109.5 | 55% | 0.545 | 56% | 0.558 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.9 | -32.7 | 179.6 | 72.2 | 0 | 0 | 0 | 0 | 112.4 | D196 | D196-S198 VanDerWaalsContact CG-OG 3.22Å; D196-S198 PolarHBondContact O-N 2.83Å; D196-S198 VanDerWaalsContact O-N 3.11Å; D196-S198 WeakPolarHBondContact OD1-CB 2.92Å; D196-S198 PolarHBondContact OD1-N 2.81Å; D196-S198 PolarHBondContact OD1-OG 2.86Å; D196-S198 PolarHBondContact OD2-OG 3.12Å |
| 199 | L | 88.8 | Confident | 81.2 | Confident | 129 Ų | 129 | 108 Ų | 108 | 68% | 0.675 | 55% | 0.545 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.5 | -12.8 | -175 | -56.1 | -178.5 | 0 | 0 | 0 | 113.6 | D196 F197 | D196-L199 HydrophobicContact CB-CB 4.45Å; D196-L199 HydrophobicContact CB-CD1 3.95Å; D196-L199 HydrophobicContact CB-CG 4.02Å; D196-L199 PolarHBondContact O-N 3Å; F197-L199 VanDerWaalsContact C-N 3.35Å |
| 200 | M | 87.7 | Confident | 83.2 | Confident | 10 Ų | 10 | 104.7 Ų | 104.7 | 5% | 0.049 | 53% | 0.533 | C | S | . | . | S | Bend | trans | -75.3 | 147.5 | -177.3 | -67.8 | 176.6 | 83.7 | 0 | 0 | 113 | E193 P194 Q204 K205 L208 | E193-M200 HydrophobicContact CG-CE 4.27Å; E193-M200 WeakPolarHBondContact OE1-CE 3.38Å; P194-M200 HydrophobicContact CB-CG 4.24Å; P194-M200 WeakPolarHBondContact O-CG 3.39Å; M200-Q204 HydrophobicContact CB-CB 4.26Å; M200-Q204 HydrophobicContact CE-CB 3.66Å; M200-K205 HydrophobicContact CB-CG 3.69Å; M200-K205 WeakPolarHBondContact O-CE 3.42Å; M200-L208 HydrophobicContact CE-CB 4.09Å; M200-L208 HydrophobicContact CE-CD2 4.11Å; M200-L208 HydrophobicContact SD-CD2 3.83Å |
| 201 | K | 92.8 | Very high | 84.7 | Confident | 150 Ų | 150 | 98.2 Ų | 98.2 | 65% | 0.652 | 51% | 0.512 | S | S | * | . | trans | -66.9 | 151.4 | 169.4 | -67 | -177.6 | 178.5 | 178.7 | 0 | 110.4 | A203 Q204 K205 | K201-A203 VanDerWaalsContact C-N 3.29Å; K201-A203 PolarHBondContact O-N 3.19Å; K201-A203 VanDerWaalsContact O-N 3.15Å; K201-Q204 HydrophobicContact CB-CG 4.25Å; K201-Q204 WeakPolarHBondContact O-CA 3.47Å; K201-Q204 WeakPolarHBondContact O-CB 3.4Å; K201-Q204 PolarHBondContact O-N 2.9Å; K201-K205 PolarHBondContact O-N 3.36Å | ||
| 202 | P | 94.4 | Very high | 86.4 | Confident | 90 Ų | 90 | 94.3 Ų | 94.3 | 58% | 0.584 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -54 | -38 | -178.2 | -28.2 | 35 | 0 | 0 | 0 | 115.1 | K205 R206 | P202-K205 PolarHBondContact O-N 2.92Å; P202-R206 PolarHBondContact O-N 2.98Å; P202-R206 VanDerWaalsContact O-N 3.1Å |
| 203 | A | 93.3 | Very high | 88.1 | Confident | 73 Ų | 73 | 93.4 Ų | 93.4 | 60% | 0.603 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.9 | -36.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | K201 R206 K207 | K201-A203 VanDerWaalsContact C-N 3.29Å; K201-A203 PolarHBondContact O-N 3.19Å; K201-A203 VanDerWaalsContact O-N 3.15Å; A203-R206 PolarHBondContact O-N 3.18Å; A203-K207 PolarHBondContact O-N 3.37Å; A203-K207 VanDerWaalsContact O-N 3.1Å |
| 204 | Q | 92 | Very high | 89.6 | Confident | 72 Ų | 72 | 91.5 Ų | 91.5 | 34% | 0.336 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.4 | -40.3 | 175.8 | -63.1 | 174.3 | -42.2 | 0 | 0 | 110.5 | M200 K201 R206 K207 L208 | M200-Q204 HydrophobicContact CB-CB 4.26Å; M200-Q204 HydrophobicContact CE-CB 3.66Å; K201-Q204 HydrophobicContact CB-CG 4.25Å; K201-Q204 WeakPolarHBondContact O-CA 3.47Å; K201-Q204 WeakPolarHBondContact O-CB 3.4Å; K201-Q204 PolarHBondContact O-N 2.9Å; Q204-R206 PolarHBondContact O-N 3.31Å; Q204-K207 PolarHBondContact O-N 3.47Å; Q204-L208 WeakPolarHBondContact O-CB 3.47Å; Q204-L208 PolarHBondContact O-N 3.4Å |
| 205 | K | 92.9 | Very high | 91.2 | Very high | 51 Ų | 51 | 97.1 Ų | 97.1 | 22% | 0.222 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -59.1 | -45.7 | 174.9 | -62.5 | -172 | -163.4 | -150.5 | 0 | 112.1 | F197 M200 K201 P202 L208 L209 | F197-K205 HydrophobicContact CD1-CD 4.16Å; F197-K205 HydrophobicContact CD2-CB 4.45Å; F197-K205 HydrophobicContact CD2-CD 4.44Å; F197-K205 HydrophobicContact CD2-CG 4.21Å; F197-K205 HydrophobicContact CE1-CD 3.79Å; F197-K205 HydrophobicContact CE2-CB 3.74Å; F197-K205 HydrophobicContact CE2-CD 4.1Å; F197-K205 HydrophobicContact CE2-CG 3.91Å; F197-K205 HydrophobicContact CG-CD 4.48Å; F197-K205 HydrophobicContact CZ-CB 3.93Å; F197-K205 HydrophobicContact CZ-CD 3.77Å; F197-K205 HydrophobicContact CZ-CG 4.08Å; F197-K205 WeakPolarHBondContact O-CE 2.92Å; F197-K205 PolarHBondContact O-NZ 3.15Å; M200-K205 HydrophobicContact CB-CG 3.69Å; M200-K205 WeakPolarHBondContact O-CE 3.42Å; K201-K205 PolarHBondContact O-N 3.36Å; P202-K205 PolarHBondContact O-N 2.92Å; K205-L208 PolarHBondContact O-N 3.1Å; K205-L209 WeakPolarHBondContact O-CG 3.33Å; K205-L209 PolarHBondContact O-N 2.96Å |
| 206 | R | 94.1 | Very high | 92.6 | Very high | 160 Ų | 160 | 97.4 Ų | 97.4 | 60% | 0.604 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -59.4 | -49.1 | 176 | -73.2 | -170.9 | 179.7 | 98.5 | -0.8 | 111.7 | P202 A203 Q204 L208 L209 E210 | P202-R206 PolarHBondContact O-N 2.98Å; P202-R206 VanDerWaalsContact O-N 3.1Å; A203-R206 PolarHBondContact O-N 3.18Å; Q204-R206 PolarHBondContact O-N 3.31Å; R206-L208 VanDerWaalsContact C-N 3.32Å; R206-L208 PolarHBondContact O-N 2.81Å; R206-L209 PolarHBondContact O-N 3.45Å; R206-E210 WeakPolarHBondContact O-CG 3.42Å; R206-E210 PolarHBondContact O-N 2.7Å |
| 207 | K | 93.9 | Very high | 93 | Very high | 147 Ų | 147 | 95.7 Ų | 95.7 | 64% | 0.639 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -59.2 | -42 | 178.1 | -171.6 | -179 | 178.4 | -175.2 | 0 | 112.5 | A203 Q204 E210 S211 | A203-K207 PolarHBondContact O-N 3.37Å; A203-K207 VanDerWaalsContact O-N 3.1Å; Q204-K207 PolarHBondContact O-N 3.47Å; K207-E210 PolarHBondContact O-N 3.49Å; K207-S211 WeakPolarHBondContact O-CB 3.39Å; K207-S211 PolarHBondContact O-N 3.1Å; K207-S211 PolarHBondContact O-OG 3.34Å |
| 208 | L | 92.8 | Very high | 93.3 | Very high | 47 Ų | 47 | 96.5 Ų | 96.5 | 25% | 0.246 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -61.2 | -49.7 | 175.8 | -178.8 | 68.3 | 0 | 0 | 0 | 110.6 | F197 M200 Q204 K205 R206 E210 S211 E212 | F197-L208 HydrophobicContact CD2-CD2 4.12Å; M200-L208 HydrophobicContact CE-CB 4.09Å; M200-L208 HydrophobicContact CE-CD2 4.11Å; M200-L208 HydrophobicContact SD-CD2 3.83Å; Q204-L208 WeakPolarHBondContact O-CB 3.47Å; Q204-L208 PolarHBondContact O-N 3.4Å; K205-L208 PolarHBondContact O-N 3.1Å; R206-L208 VanDerWaalsContact C-N 3.32Å; R206-L208 PolarHBondContact O-N 2.81Å; L208-E210 VanDerWaalsContact C-N 3.34Å; L208-E210 PolarHBondContact O-N 2.97Å; L208-S211 PolarHBondContact O-N 3.45Å; L208-S211 VanDerWaalsContact O-N 3.16Å; L208-S211 PolarHBondContact O-OG 3.43Å; L208-E212 HydrophobicContact CD1-CG 4.44Å; L208-E212 HydrophobicContact CG-CG 4.5Å; L208-E212 WeakPolarHBondContact O-CG 3.31Å; L208-E212 PolarHBondContact O-N 2.83Å |
| 209 | L | 93.6 | Very high | 93.5 | Very high | 92 Ų | 92 | 95.4 Ų | 95.4 | 48% | 0.482 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.8 | -41.1 | 178.4 | -69.8 | 174.6 | 0 | 0 | 0 | 112.5 | F197 K205 R206 E212 T213 | F197-L209 HydrophobicContact CE2-CD1 4.37Å; F197-L209 HydrophobicContact CE2-CD2 4.32Å; F197-L209 HydrophobicContact CE2-CG 4.19Å; F197-L209 HydrophobicContact CZ-CD1 4.27Å; K205-L209 WeakPolarHBondContact O-CG 3.33Å; K205-L209 PolarHBondContact O-N 2.96Å; R206-L209 PolarHBondContact O-N 3.45Å; L209-E212 PolarHBondContact O-N 3.43Å; L209-T213 VanDerWaalsContact O-CB 3.31Å; L209-T213 WeakPolarHBondContact O-CB 3.31Å; L209-T213 PolarHBondContact O-N 2.87Å; L209-T213 PolarHBondContact O-OG1 3.38Å |
| 210 | E | 95.8 | Very high | 93.6 | Very high | 127 Ų | 127 | 92.7 Ų | 92.7 | 59% | 0.593 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.6 | -43.6 | 174.9 | -73.4 | 164.5 | -161.4 | 0 | 0 | 111.3 | R206 K207 L208 T213 S214 | R206-E210 WeakPolarHBondContact O-CG 3.42Å; R206-E210 PolarHBondContact O-N 2.7Å; K207-E210 PolarHBondContact O-N 3.49Å; L208-E210 VanDerWaalsContact C-N 3.34Å; L208-E210 PolarHBondContact O-N 2.97Å; E210-T213 PolarHBondContact O-N 2.69Å; E210-S214 WeakPolarHBondContact O-CB 3.35Å; E210-S214 PolarHBondContact O-N 3.48Å |
| 211 | S | 94.8 | Very high | 93.6 | Very high | 59 Ų | 59 | 98.3 Ų | 98.3 | 41% | 0.413 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.1 | -40.6 | 177.7 | 71.1 | 0 | 0 | 0 | 0 | 113.1 | K207 L208 S214 R215 | K207-S211 WeakPolarHBondContact O-CB 3.39Å; K207-S211 PolarHBondContact O-N 3.1Å; K207-S211 PolarHBondContact O-OG 3.34Å; L208-S211 PolarHBondContact O-N 3.45Å; L208-S211 VanDerWaalsContact O-N 3.16Å; L208-S211 PolarHBondContact O-OG 3.43Å; S211-S214 PolarHBondContact O-N 3.45Å; S211-R215 WeakPolarHBondContact O-CB 3.47Å; S211-R215 PolarHBondContact O-N 2.85Å |
| 212 | E | 94.4 | Very high | 93.2 | Very high | 101 Ų | 101 | 95.4 Ų | 95.4 | 47% | 0.472 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -68.3 | -41.6 | 176.4 | -72.9 | -60.9 | 151.1 | 0 | 0 | 111.3 | L208 L209 S214 R215 F216 | L208-E212 HydrophobicContact CD1-CG 4.44Å; L208-E212 HydrophobicContact CG-CG 4.5Å; L208-E212 WeakPolarHBondContact O-CG 3.31Å; L208-E212 PolarHBondContact O-N 2.83Å; L209-E212 PolarHBondContact O-N 3.43Å; E212-S214 VanDerWaalsContact C-N 3.31Å; E212-S214 PolarHBondContact O-N 2.89Å; E212-R215 PolarHBondContact O-N 3.16Å; E212-F216 VanDerWaalsContact O-CB 3.31Å; E212-F216 WeakPolarHBondContact O-CB 3.45Å; E212-F216 PolarHBondContact O-N 3.41Å |
| 213 | T | 96.3 | Very high | 92.7 | Very high | 94 Ų | 94 | 96.4 Ų | 96.4 | 58% | 0.577 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -62.1 | -42.3 | 176.1 | -55.1 | 0 | 0 | 0 | 0 | 110.8 | L209 E210 S217 | L209-T213 VanDerWaalsContact O-CB 3.31Å; L209-T213 WeakPolarHBondContact O-CB 3.31Å; L209-T213 PolarHBondContact O-N 2.87Å; L209-T213 PolarHBondContact O-OG1 3.38Å; E210-T213 PolarHBondContact O-N 2.69Å; T213-S217 WeakPolarHBondContact O-CB 3.32Å; T213-S217 PolarHBondContact O-N 3.16Å; T213-S217 PolarHBondContact O-OG 3.34Å |
| 214 | S | 96.1 | Very high | 92.2 | Very high | 68 Ų | 68 | 95.5 Ų | 95.5 | 48% | 0.476 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -61.5 | -52.5 | 175.5 | -174.3 | 0 | 0 | 0 | 0 | 111.3 | E210 S211 E212 F216 S217 E218 | E210-S214 WeakPolarHBondContact O-CB 3.35Å; E210-S214 PolarHBondContact O-N 3.48Å; S211-S214 PolarHBondContact O-N 3.45Å; E212-S214 VanDerWaalsContact C-N 3.31Å; E212-S214 PolarHBondContact O-N 2.89Å; S214-F216 VanDerWaalsContact C-N 3.33Å; S214-F216 PolarHBondContact O-N 2.91Å; S214-S217 PolarHBondContact O-N 2.9Å; S214-S217 VanDerWaalsContact O-N 3.16Å; S214-S217 PolarHBondContact O-OG 3.36Å; S214-E218 PolarHBondContact O-N 2.98Å |
| 215 | R | 95 | Very high | 91.4 | Very high | 176 Ų | 176 | 98.7 Ų | 98.7 | 66% | 0.664 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -57.2 | -43.7 | 178.1 | 178 | -179.7 | -82 | -105 | -0.7 | 112.2 | S211 E212 E218 A219 | S211-R215 WeakPolarHBondContact O-CB 3.47Å; S211-R215 PolarHBondContact O-N 2.85Å; E212-R215 PolarHBondContact O-N 3.16Å; R215-E218 PolarHBondContact O-N 3.39Å; R215-A219 WeakPolarHBondContact O-CB 3.4Å; R215-A219 PolarHBondContact O-N 3.5Å |
| 216 | F | 96 | Very high | 90.4 | Very high | 145 Ų | 145 | 97.6 Ų | 97.6 | 64% | 0.636 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.1 | -46.2 | 176.6 | 179.1 | -100.9 | 0 | 0 | 0 | 111.5 | E212 S214 E218 A219 V220 | E212-F216 VanDerWaalsContact O-CB 3.31Å; E212-F216 WeakPolarHBondContact O-CB 3.45Å; E212-F216 PolarHBondContact O-N 3.41Å; S214-F216 VanDerWaalsContact C-N 3.33Å; S214-F216 PolarHBondContact O-N 2.91Å; F216-E218 VanDerWaalsContact C-N 3.27Å; F216-E218 PolarHBondContact O-N 3.17Å; F216-A219 PolarHBondContact O-N 2.76Å; F216-V220 HydrophobicContact CD1-CG2 4.14Å; F216-V220 HydrophobicContact CE1-CG2 3.67Å; F216-V220 HydrophobicContact CE2-CG2 4.08Å; F216-V220 HydrophobicContact CZ-CG2 3.64Å; F216-V220 WeakPolarHBondContact O-CG2 3.37Å; F216-V220 PolarHBondContact O-N 3.42Å |
| 217 | S | 95.1 | Very high | 89.3 | Confident | 47 Ų | 47 | 98.2 Ų | 98.2 | 33% | 0.329 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.2 | -37.4 | 178.6 | 77.8 | 0 | 0 | 0 | 0 | 112.3 | T213 S214 V220 K221 | T213-S217 WeakPolarHBondContact O-CB 3.32Å; T213-S217 PolarHBondContact O-N 3.16Å; T213-S217 PolarHBondContact O-OG 3.34Å; S214-S217 PolarHBondContact O-N 2.9Å; S214-S217 VanDerWaalsContact O-N 3.16Å; S214-S217 PolarHBondContact O-OG 3.36Å; S217-V220 PolarHBondContact O-N 2.93Å; S217-K221 VanDerWaalsContact O-CG 3.3Å; S217-K221 WeakPolarHBondContact O-CG 3.45Å; S217-K221 PolarHBondContact O-N 3.04Å |
| 218 | E | 92.6 | Very high | 88.4 | Confident | 111 Ų | 111 | 97.6 Ų | 97.6 | 52% | 0.519 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.5 | -45.4 | 174.5 | -169.3 | -170.9 | 160.2 | 0 | 0 | 111.2 | S214 R215 F216 V220 K221 N222 | S214-E218 PolarHBondContact O-N 2.98Å; R215-E218 PolarHBondContact O-N 3.39Å; F216-E218 VanDerWaalsContact C-N 3.27Å; F216-E218 PolarHBondContact O-N 3.17Å; E218-V220 VanDerWaalsContact C-N 3.31Å; E218-V220 PolarHBondContact O-N 2.95Å; E218-K221 PolarHBondContact O-N 3.35Å; E218-N222 WeakPolarHBondContact O-CB 3.35Å; E218-N222 VanDerWaalsContact O-CG 3.27Å; E218-N222 PolarHBondContact O-N 3.39Å; E218-N222 PolarHBondContact O-ND2 3.08Å |
| 219 | A | 90.4 | Very high | 88 | Confident | 54 Ų | 54 | 99.2 Ų | 99.2 | 45% | 0.446 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -40.8 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | R215 F216 N222 L223 | R215-A219 WeakPolarHBondContact O-CB 3.4Å; R215-A219 PolarHBondContact O-N 3.5Å; F216-A219 PolarHBondContact O-N 2.76Å; A219-N222 PolarHBondContact O-N 3.38Å; A219-L223 VanDerWaalsContact O-CB 3.28Å; A219-L223 WeakPolarHBondContact O-CB 3.48Å; A219-L223 PolarHBondContact O-N 2.9Å |
| 220 | V | 91.4 | Very high | 87.6 | Confident | 73 Ų | 73 | 98.7 Ų | 98.7 | 44% | 0.442 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.3 | -41.9 | 175.7 | 172 | 0 | 0 | 0 | 0 | 111.5 | F216 S217 E218 L223 A224 | F216-V220 HydrophobicContact CD1-CG2 4.14Å; F216-V220 HydrophobicContact CE1-CG2 3.67Å; F216-V220 HydrophobicContact CE2-CG2 4.08Å; F216-V220 HydrophobicContact CZ-CG2 3.64Å; F216-V220 WeakPolarHBondContact O-CG2 3.37Å; F216-V220 PolarHBondContact O-N 3.42Å; S217-V220 PolarHBondContact O-N 2.93Å; E218-V220 VanDerWaalsContact C-N 3.31Å; E218-V220 PolarHBondContact O-N 2.95Å; V220-L223 PolarHBondContact O-N 3.34Å; V220-A224 WeakPolarHBondContact O-CB 3.37Å; V220-A224 PolarHBondContact O-N 3.42Å |
| 221 | K | 88.8 | Confident | 87.3 | Confident | 127 Ų | 127 | 99.1 Ų | 99.1 | 55% | 0.552 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.5 | -49.9 | 174.5 | -71.5 | 169.3 | -176.1 | 175.9 | 0 | 111.1 | S217 E218 L223 A224 H225 | S217-K221 VanDerWaalsContact O-CG 3.3Å; S217-K221 WeakPolarHBondContact O-CG 3.45Å; S217-K221 PolarHBondContact O-N 3.04Å; E218-K221 PolarHBondContact O-N 3.35Å; K221-L223 VanDerWaalsContact C-N 3.28Å; K221-L223 PolarHBondContact O-N 3.42Å; K221-A224 WeakPolarHBondContact O-CB 3.43Å; K221-A224 PolarHBondContact O-N 2.85Å; K221-A224 VanDerWaalsContact O-N 3.08Å; K221-H225 VanDerWaalsContact C-CD2 3.49Å; K221-H225 PolarHBondContact O-CD2 2.76Å; K221-H225 VanDerWaalsContact O-CG 3.3Å; K221-H225 PolarHBondContact O-N 3.32Å |
| 222 | N | 84.3 | Confident | 86.8 | Confident | 89 Ų | 89 | 98.4 Ų | 98.4 | 48% | 0.476 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.4 | -41.5 | 177.5 | -69.8 | -25.2 | 0 | 0 | 0 | 111.5 | E218 A219 H225 S226 | E218-N222 WeakPolarHBondContact O-CB 3.35Å; E218-N222 VanDerWaalsContact O-CG 3.27Å; E218-N222 PolarHBondContact O-N 3.39Å; E218-N222 PolarHBondContact O-ND2 3.08Å; A219-N222 PolarHBondContact O-N 3.38Å; N222-H225 PolarHBondContact O-N 3.16Å; N222-S226 WeakPolarHBondContact O-CB 3.32Å; N222-S226 PolarHBondContact O-N 3.43Å; N222-S226 PolarHBondContact O-OG 2.9Å |
| 223 | L | 84.3 | Confident | 86.4 | Confident | 112 Ų | 112 | 95.4 Ų | 95.4 | 59% | 0.586 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -63.8 | -43.4 | 175.5 | -175.3 | 61.5 | 0 | 0 | 0 | 111.3 | A219 V220 K221 H225 S226 K227 | A219-L223 VanDerWaalsContact O-CB 3.28Å; A219-L223 WeakPolarHBondContact O-CB 3.48Å; A219-L223 PolarHBondContact O-N 2.9Å; V220-L223 PolarHBondContact O-N 3.34Å; K221-L223 VanDerWaalsContact C-N 3.28Å; K221-L223 PolarHBondContact O-N 3.42Å; L223-H225 VanDerWaalsContact C-N 3.31Å; L223-H225 PolarHBondContact O-N 2.83Å; L223-S226 WeakPolarHBondContact CA-OG 3.33Å; L223-S226 PolarHBondContact O-N 3.3Å; L223-S226 VanDerWaalsContact O-N 3.16Å; L223-S226 PolarHBondContact O-OG 2.91Å; L223-K227 WeakPolarHBondContact O-CG 3.45Å; L223-K227 PolarHBondContact O-N 2.9Å |
| 224 | A | 81.8 | Confident | 86 | Confident | 54 Ų | 54 | 95.6 Ų | 95.6 | 45% | 0.446 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.7 | -39.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V220 K221 | V220-A224 WeakPolarHBondContact O-CB 3.37Å; V220-A224 PolarHBondContact O-N 3.42Å; K221-A224 WeakPolarHBondContact O-CB 3.43Å; K221-A224 PolarHBondContact O-N 2.85Å; K221-A224 VanDerWaalsContact O-N 3.08Å |
| 225 | H | 76.2 | Confident | 85.7 | Confident | 139 Ų | 139 | 93.6 Ų | 93.6 | 64% | 0.644 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -71.7 | -27.7 | 175.2 | -61 | -51.1 | 0 | 0 | 0 | 113.1 | K221 N222 L223 | K221-H225 VanDerWaalsContact C-CD2 3.49Å; K221-H225 PolarHBondContact O-CD2 2.76Å; K221-H225 VanDerWaalsContact O-CG 3.3Å; K221-H225 PolarHBondContact O-N 3.32Å; N222-H225 PolarHBondContact O-N 3.16Å; L223-H225 VanDerWaalsContact C-N 3.31Å; L223-H225 PolarHBondContact O-N 2.83Å |
| 226 | S | 71.3 | Confident | 85.4 | Confident | 27 Ų | 27 | 89.9 Ų | 89.9 | 19% | 0.189 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -81.6 | -7.9 | -178.7 | 72.6 | 0 | 0 | 0 | 0 | 115.3 | N222 L223 T228 N229 | N222-S226 WeakPolarHBondContact O-CB 3.32Å; N222-S226 PolarHBondContact O-N 3.43Å; N222-S226 PolarHBondContact O-OG 2.9Å; L223-S226 WeakPolarHBondContact CA-OG 3.33Å; L223-S226 PolarHBondContact O-N 3.3Å; L223-S226 VanDerWaalsContact O-N 3.16Å; L223-S226 PolarHBondContact O-OG 2.91Å; S226-T228 PolarHBondContact O-N 3.18Å; S226-T228 VanDerWaalsContact O-N 3.1Å; S226-N229 CarbonylContact O-C 3.51Å; S226-N229 PolarHBondContact O-N 3.06Å |
| 227 | K | 70.4 | Confident | 85.1 | Confident | 173 Ų | 173 | 88.3 Ų | 88.3 | 75% | 0.752 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.3 | -20.2 | -176.1 | -71.4 | -174.8 | 178.1 | 179.5 | 0 | 114.3 | L223 | L223-K227 WeakPolarHBondContact O-CG 3.45Å; L223-K227 PolarHBondContact O-N 2.9Å |
| 228 | T | 75.9 | Confident | 85 | Confident | 135 Ų | 135 | 90.7 Ų | 90.7 | 83% | 0.828 | 50% | 0.499 | S | S | * | . | S | Bend | trans | -91.8 | -31.6 | -178.7 | 41.3 | 0 | 0 | 0 | 0 | 113.3 | S226 | S226-T228 PolarHBondContact O-N 3.18Å; S226-T228 VanDerWaalsContact O-N 3.1Å |
| 229 | N | 83.1 | Confident | 85 | Confident | 80 Ų | 80 | 92.5 Ų | 92.5 | 43% | 0.428 | 50% | 0.501 | S | S | . | . | trans | -160.3 | 98.3 | 174.6 | -172.1 | -19.3 | 0 | 0 | 0 | 112 | S226 L231 A232 A233 | S226-N229 CarbonylContact O-C 3.51Å; S226-N229 PolarHBondContact O-N 3.06Å; N229-L231 VanDerWaalsContact C-N 3.34Å; N229-L231 PolarHBondContact O-N 3.31Å; N229-L231 PolarHBondContact OD1-N 3.45Å; N229-L231 VanDerWaalsContact OD1-N 3.1Å; N229-A232 HydrophobicContact CB-CB 3.98Å; N229-A232 PolarHBondContact O-N 3.35Å; N229-A232 PolarHBondContact OD1-N 3.14Å; N229-A233 PolarHBondContact O-N 2.97Å | ||
| 230 | P | 86.2 | Confident | 85.1 | Confident | 81 Ų | 81 | 96.7 Ų | 96.7 | 53% | 0.526 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.2 | -30.6 | -179.2 | 26.9 | -34.3 | 0 | 0 | 0 | 113.1 | A233 I234 | P230-A233 PolarHBondContact O-N 3.18Å; P230-I234 VanDerWaalsContact O-CG1 3.32Å; P230-I234 WeakPolarHBondContact O-CG1 3.49Å; P230-I234 PolarHBondContact O-N 3Å |
| 231 | L | 88 | Confident | 85.1 | Confident | 136 Ų | 136 | 99.8 Ų | 99.8 | 71% | 0.712 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -67.9 | -39.9 | 179.2 | -67.1 | 175.8 | 0 | 0 | 0 | 111.6 | N229 A233 I234 G235 | N229-L231 VanDerWaalsContact C-N 3.34Å; N229-L231 PolarHBondContact O-N 3.31Å; N229-L231 PolarHBondContact OD1-N 3.45Å; N229-L231 VanDerWaalsContact OD1-N 3.1Å; L231-A233 VanDerWaalsContact C-N 3.34Å; L231-I234 PolarHBondContact O-N 3.16Å; L231-G235 PolarHBondContact O-N 3.42Å |
| 232 | A | 86 | Confident | 85.3 | Confident | 45 Ų | 45 | 99 Ų | 99 | 37% | 0.372 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.7 | -41.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | N229 G235 E236 | N229-A232 HydrophobicContact CB-CB 3.98Å; N229-A232 PolarHBondContact O-N 3.35Å; N229-A232 PolarHBondContact OD1-N 3.14Å; A232-G235 PolarHBondContact O-N 2.95Å; A232-E236 PolarHBondContact O-N 3.2Å |
| 233 | A | 84.4 | Confident | 85.7 | Confident | 37 Ų | 37 | 101.2 Ų | 101.2 | 31% | 0.306 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -63.1 | -42.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | N229 P230 L231 E236 H237 | N229-A233 PolarHBondContact O-N 2.97Å; P230-A233 PolarHBondContact O-N 3.18Å; L231-A233 VanDerWaalsContact C-N 3.34Å; A233-E236 PolarHBondContact O-N 3.04Å; A233-H237 PolarHBondContact O-N 3.46Å |
| 234 | I | 88.1 | Confident | 85.9 | Confident | 98 Ų | 98 | 101 Ų | 101 | 50% | 0.503 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62 | -45.7 | 173.9 | -66.5 | 164.2 | 0 | 0 | 0 | 110.2 | P230 L231 E236 H237 L238 | P230-I234 VanDerWaalsContact O-CG1 3.32Å; P230-I234 WeakPolarHBondContact O-CG1 3.49Å; P230-I234 PolarHBondContact O-N 3Å; L231-I234 PolarHBondContact O-N 3.16Å; I234-E236 VanDerWaalsContact C-N 3.35Å; I234-E236 PolarHBondContact O-N 3.25Å; I234-H237 PolarHBondContact O-N 2.92Å; I234-L238 HydrophobicContact CG2-CD1 3.97Å; I234-L238 HydrophobicContact CG2-CG 4.37Å; I234-L238 WeakPolarHBondContact O-CG 3.42Å; I234-L238 PolarHBondContact O-N 3.31Å |
| 235 | G | 91.1 | Very high | 86.1 | Confident | 27 Ų | 27 | 103.9 Ų | 103.9 | 28% | 0.278 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.4 | -36.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | L231 A232 R239 | L231-G235 PolarHBondContact O-N 3.42Å; A232-G235 PolarHBondContact O-N 2.95Å; G235-R239 WeakPolarHBondContact O-CB 3.34Å; G235-R239 WeakPolarHBondContact O-CG 3.28Å; G235-R239 PolarHBondContact O-N 3.48Å; G235-R239 VanDerWaalsContact O-N 3.07Å; G235-R239 PolarHBondContact O-NE 3.48Å |
| 236 | E | 88.9 | Confident | 86.6 | Confident | 97 Ų | 97 | 104.9 Ų | 104.9 | 45% | 0.453 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.8 | -44.2 | 172 | -79.4 | -175.3 | -175 | 0 | 0 | 112.7 | A232 A233 I234 R239 K240 | A232-E236 PolarHBondContact O-N 3.2Å; A233-E236 PolarHBondContact O-N 3.04Å; I234-E236 VanDerWaalsContact C-N 3.35Å; I234-E236 PolarHBondContact O-N 3.25Å; E236-R239 PolarHBondContact O-N 3.07Å; E236-K240 WeakPolarHBondContact O-CG 3.41Å; E236-K240 PolarHBondContact O-N 3.22Å |
| 237 | H | 89.6 | Confident | 87.1 | Confident | 113 Ų | 113 | 111.4 Ų | 111.4 | 52% | 0.523 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.7 | -45.6 | 178.1 | -175.1 | 74.3 | 0 | 0 | 0 | 111.5 | A233 I234 R239 K240 R241 | A233-H237 PolarHBondContact O-N 3.46Å; I234-H237 PolarHBondContact O-N 2.92Å; H237-R239 PolarHBondContact O-N 3.42Å; H237-K240 PolarHBondContact O-N 2.95Å; H237-R241 WeakPolarHBondContact O-CB 3.3Å; H237-R241 PolarHBondContact O-N 3.46Å |
| 238 | L | 92.8 | Very high | 87.4 | Confident | 96 Ų | 96 | 110.1 Ų | 110.1 | 50% | 0.503 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -60.7 | -44.8 | 176.3 | -70.1 | 173.3 | 0 | 0 | 0 | 111.7 | I234 K240 R241 L242 | I234-L238 HydrophobicContact CG2-CD1 3.97Å; I234-L238 HydrophobicContact CG2-CG 4.37Å; I234-L238 WeakPolarHBondContact O-CG 3.42Å; I234-L238 PolarHBondContact O-N 3.31Å; L238-K240 PolarHBondContact O-N 3.46Å; L238-R241 PolarHBondContact O-N 3.15Å; L238-L242 WeakPolarHBondContact O-CG 3.46Å; L238-L242 PolarHBondContact O-N 3.31Å |
| 239 | R | 92.6 | Very high | 86.9 | Confident | 149 Ų | 149 | 105.7 Ų | 105.7 | 56% | 0.562 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.5 | -42.6 | 175.6 | -81.1 | -176.7 | -73.8 | 131.4 | -10.3 | 112.8 | G235 E236 H237 R241 K243 | G235-R239 WeakPolarHBondContact O-CB 3.34Å; G235-R239 WeakPolarHBondContact O-CG 3.28Å; G235-R239 PolarHBondContact O-N 3.48Å; G235-R239 VanDerWaalsContact O-N 3.07Å; G235-R239 PolarHBondContact O-NE 3.48Å; E236-R239 PolarHBondContact O-N 3.07Å; H237-R239 PolarHBondContact O-N 3.42Å; R239-R241 VanDerWaalsContact C-N 3.34Å; R239-K243 WeakPolarHBondContact O-CG 3.39Å; R239-K243 PolarHBondContact O-N 3.29Å; R239-K243 VanDerWaalsContact O-N 3.15Å |
| 240 | K | 91.6 | Very high | 85.8 | Confident | 143 Ų | 143 | 108.5 Ų | 108.5 | 62% | 0.622 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.1 | -42 | 176.4 | -75 | 176.9 | -178.5 | 174.1 | 0 | 111.5 | E236 H237 L238 K243 Q244 | E236-K240 WeakPolarHBondContact O-CG 3.41Å; E236-K240 PolarHBondContact O-N 3.22Å; H237-K240 PolarHBondContact O-N 2.95Å; L238-K240 PolarHBondContact O-N 3.46Å; K240-K243 PolarHBondContact O-N 2.96Å; K240-Q244 PolarHBondContact O-N 3.35Å |
| 241 | R | 92.4 | Very high | 84.1 | Confident | 137 Ų | 137 | 113.6 Ų | 113.6 | 52% | 0.517 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -67.3 | -43.2 | 179.8 | -165.4 | 169.9 | -169.3 | 133.9 | 1 | 112.5 | H237 L238 R239 K243 Q244 E245 | H237-R241 WeakPolarHBondContact O-CB 3.3Å; H237-R241 PolarHBondContact O-N 3.46Å; L238-R241 PolarHBondContact O-N 3.15Å; R239-R241 VanDerWaalsContact C-N 3.34Å; R241-K243 PolarHBondContact O-N 3.5Å; R241-Q244 PolarHBondContact O-N 2.97Å; R241-E245 IonicContact NE-OE1 3.84Å; R241-E245 WeakPolarHBondContact O-CG 3.46Å; R241-E245 PolarHBondContact O-N 3.46Å |
| 242 | L | 92.4 | Very high | 83.9 | Confident | 111 Ų | 111 | 112.5 Ų | 112.5 | 58% | 0.581 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -59.5 | -43.9 | 174.8 | -77.2 | 171.3 | 0 | 0 | 0 | 112 | L238 Q244 E245 E246 | L238-L242 WeakPolarHBondContact O-CG 3.46Å; L238-L242 PolarHBondContact O-N 3.31Å; L242-Q244 PolarHBondContact O-N 3.05Å; L242-E245 PolarHBondContact O-N 2.97Å; L242-E246 PolarHBondContact O-N 3.1Å |
| 243 | K | 92.1 | Very high | 83.8 | Confident | 135 Ų | 135 | 116.1 Ų | 116.1 | 59% | 0.587 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -62.2 | -41.2 | 174.5 | -73.2 | -176.1 | 175.4 | -164.9 | 0 | 112.8 | R239 K240 R241 E245 E246 E247 | R239-K243 WeakPolarHBondContact O-CG 3.39Å; R239-K243 PolarHBondContact O-N 3.29Å; R239-K243 VanDerWaalsContact O-N 3.15Å; K240-K243 PolarHBondContact O-N 2.96Å; R241-K243 PolarHBondContact O-N 3.5Å; K243-E245 VanDerWaalsContact C-N 3.32Å; K243-E245 PolarHBondContact O-N 3.4Å; K243-E246 PolarHBondContact O-N 3.43Å; K243-E247 WeakPolarHBondContact O-CG 3.44Å; K243-E247 PolarHBondContact O-N 3.42Å |
| 244 | Q | 89.9 | Confident | 83.8 | Confident | 109 Ų | 109 | 120.4 Ų | 120.4 | 51% | 0.509 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -65.9 | -35.3 | 177.9 | -174.3 | -180 | 11.5 | 0 | 0 | 112.3 | K240 R241 L242 Q248 | K240-Q244 PolarHBondContact O-N 3.35Å; R241-Q244 PolarHBondContact O-N 2.97Å; L242-Q244 PolarHBondContact O-N 3.05Å; Q244-Q248 WeakPolarHBondContact O-CB 3.43Å; Q244-Q248 WeakPolarHBondContact O-CG 3.43Å; Q244-Q248 PolarHBondContact O-N 2.91Å; Q244-Q248 VanDerWaalsContact O-N 3.14Å |
| 245 | E | 85.9 | Confident | 83.5 | Confident | 113 Ų | 113 | 121.8 Ų | 121.8 | 53% | 0.528 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -69.9 | -37.6 | 174.9 | -73.4 | 172.8 | -172 | 0 | 0 | 111.5 | R241 L242 K243 Q248 G249 | R241-E245 IonicContact NE-OE1 3.84Å; R241-E245 WeakPolarHBondContact O-CG 3.46Å; R241-E245 PolarHBondContact O-N 3.46Å; L242-E245 PolarHBondContact O-N 2.97Å; K243-E245 VanDerWaalsContact C-N 3.32Å; K243-E245 PolarHBondContact O-N 3.4Å; E245-Q248 CarbonylContact O-C 3.59Å; E245-Q248 PolarHBondContact O-N 3.25Å; E245-G249 PolarHBondContact O-N 3.36Å; E245-G249 VanDerWaalsContact O-N 3.16Å |
| 246 | E | 85.8 | Confident | 83.1 | Confident | 161 Ų | 161 | 127.7 Ų | 127.7 | 75% | 0.752 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -64.7 | -43.3 | 174.1 | -171.5 | 174.3 | -164.2 | 0 | 0 | 112.1 | L242 K243 Q248 G249 | L242-E246 PolarHBondContact O-N 3.1Å; K243-E246 PolarHBondContact O-N 3.43Å; E246-Q248 VanDerWaalsContact C-N 3.3Å; E246-Q248 PolarHBondContact O-N 3.04Å; E246-G249 PolarHBondContact O-N 3.3Å |
| 247 | E | 83.1 | Confident | 82.7 | Confident | 164 Ų | 164 | 129.7 Ų | 129.7 | 77% | 0.766 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -71.7 | -19.4 | 176.4 | -71.3 | 175.9 | -175.1 | 0 | 0 | 113.7 | K243 | K243-E247 WeakPolarHBondContact O-CG 3.44Å; K243-E247 PolarHBondContact O-N 3.42Å |
| 248 | Q | 75.1 | Confident | 82.2 | Confident | 145 Ų | 145 | 130.9 Ų | 130.9 | 68% | 0.678 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.5 | 11.2 | 177.4 | -72 | -163.8 | 69.3 | 0 | 0 | 114.1 | Q244 E245 E246 | Q244-Q248 WeakPolarHBondContact O-CB 3.43Å; Q244-Q248 WeakPolarHBondContact O-CG 3.43Å; Q244-Q248 PolarHBondContact O-N 2.91Å; Q244-Q248 VanDerWaalsContact O-N 3.14Å; E245-Q248 CarbonylContact O-C 3.59Å; E245-Q248 PolarHBondContact O-N 3.25Å; E246-Q248 VanDerWaalsContact C-N 3.3Å; E246-Q248 PolarHBondContact O-N 3.04Å |
| 249 | G | 64.9 | Low | 81.4 | Confident | 42 Ų | 42 | 133.6 Ų | 133.6 | 43% | 0.433 | 67% | 0.674 | S | S | . | * | S | Bend | trans | -60.1 | 152.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E245 E246 S251 | E245-G249 PolarHBondContact O-N 3.36Å; E245-G249 VanDerWaalsContact O-N 3.16Å; E246-G249 PolarHBondContact O-N 3.3Å; G249-S251 PolarHBondContact O-N 3.1Å |
| 250 | P | 61 | Low | 80.4 | Confident | 140 Ų | 140 | 132.3 Ų | 132.3 | 91% | 0.909 | 68% | 0.683 | S | S | * | * | trans | -68.9 | 116.3 | -173.1 | 29.9 | -32.8 | 0 | 0 | 0 | 110.3 | ||||
| 251 | S | 50.9 | Low | 79.4 | Confident | 188 Ų | 188 | 131.4 Ų | 131.4 | 100% | 1.315 | 69% | 0.689 | S | S | * | * | trans | -87.8 | 0 | 155.4 | 179.7 | 0 | 0 | 0 | 0 | 110.6 | G249 | G249-S251 PolarHBondContact O-N 3.1Š|
Retrieved 251 of 251 residues in 1204.4 ms
(Link to these results)