| 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 | 33.2 | Very low | 29.6 | Very low | 234 Ų | 234 | 156.4 Ų | 156.4 | 100% | 1.153 | 83% | 0.825 | S | S | * | * | 0 | 136.2 | 0 | -75.6 | 126.1 | 167.9 | 0 | 0 | 107.4 | |||||
| 2 | T | 32.1 | Very low | 30.2 | Very low | 120 Ų | 120 | 151.3 Ų | 151.3 | 74% | 0.736 | 81% | 0.808 | S | S | * | * | cis | -155.3 | 118.2 | 8.5 | 8.4 | 0 | 0 | 0 | 0 | 107 | ||||
| 3 | M | 29.6 | Very low | 30 | Very low | 150 Ų | 150 | 153.6 Ų | 153.6 | 74% | 0.739 | 81% | 0.811 | S | S | * | * | 94.4 | 118.3 | 94.6 | -76.3 | -69.4 | -101.9 | 0 | 0 | 115 | |||||
| 4 | L | 30.1 | Very low | 30.2 | Very low | 140 Ų | 140 | 151.2 Ų | 151.2 | 73% | 0.733 | 81% | 0.809 | S | S | * | * | trans | 67.3 | 153.3 | 141 | -55.7 | 175 | 0 | 0 | 0 | 119.8 | ||||
| 5 | S | 28.2 | Very low | 29.7 | Very low | 78 Ų | 78 | 149.5 Ų | 149.5 | 55% | 0.545 | 81% | 0.812 | S | S | . | * | cis | -149.5 | 162.4 | -6 | -126.4 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 6 | E | 30.1 | Very low | 29.5 | Very low | 183 Ų | 183 | 153.4 Ų | 153.4 | 86% | 0.855 | 82% | 0.818 | S | S | * | * | trans | 22.7 | 144.1 | 147.5 | -66.7 | 153.1 | 112.7 | 0 | 0 | 123.2 | ||||
| 7 | D | 28 | Very low | 29.4 | Very low | 164 Ų | 164 | 153.5 Ų | 153.5 | 88% | 0.877 | 82% | 0.818 | S | S | * | * | trans | -138.5 | 142.4 | 164.8 | -170.3 | 4.3 | 0 | 0 | 0 | 109.2 | ||||
| 8 | Q | 27.6 | Very low | 29.3 | Very low | 177 Ų | 177 | 151.8 Ų | 151.8 | 83% | 0.827 | 82% | 0.817 | S | S | * | * | trans | -151 | 126.2 | -172.8 | -165.3 | 175.4 | 44.5 | 0 | 0 | 112.8 | ||||
| 9 | P | 34.5 | Very low | 29.1 | Very low | 129 Ų | 129 | 152.7 Ų | 152.7 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | trans | -87.4 | 155.4 | -169.7 | 34.1 | -36.9 | 0 | 0 | 0 | 115.4 | ||||
| 10 | A | 28.4 | Very low | 29.4 | Very low | 105 Ų | 105 | 150.9 Ų | 150.9 | 87% | 0.868 | 81% | 0.813 | S | S | * | * | trans | -101.2 | 168.4 | -168.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 11 | R | 24.3 | Very low | 29.2 | Very low | 240 Ų | 240 | 147 Ų | 147 | 91% | 0.906 | 81% | 0.807 | S | S | * | * | trans | -157.9 | 172.1 | 174.9 | -119.3 | -169.1 | 178.8 | -164.5 | 2.1 | 107.4 | ||||
| 12 | P | 36.4 | Very low | 28.8 | Very low | 95 Ų | 95 | 145.5 Ų | 145.5 | 62% | 0.617 | 80% | 0.795 | S | S | * | * | cis | -141.1 | 174.4 | 0.6 | 41.2 | -23 | 0 | 0 | 0 | 117.9 | ||||
| 13 | Q | 27.3 | Very low | 28.5 | Very low | 182 Ų | 182 | 148.4 Ų | 148.4 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | trans | 67.7 | 168.3 | 146 | -84.5 | -176.9 | 36.3 | 0 | 0 | 120.2 | ||||
| 14 | P | 33.1 | Very low | 28.3 | Very low | 120 Ų | 120 | 147.8 Ų | 147.8 | 78% | 0.779 | 80% | 0.804 | S | S | * | * | cis | -119.6 | -173.3 | -5.7 | 37.6 | -21.6 | 0 | 0 | 0 | 114.5 | ||||
| 15 | C | 23.5 | Very low | 27.9 | Very low | 126 Ų | 126 | 146.8 Ų | 146.8 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | trans | -143.1 | 147.9 | 179.4 | -173.9 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 16 | K | 25.8 | Very low | 27.6 | Very low | 211 Ų | 211 | 148.4 Ų | 148.4 | 92% | 0.917 | 81% | 0.811 | S | S | * | * | trans | -161.5 | 161.4 | 169.1 | -115.1 | 166.2 | -172.8 | 178.7 | 0 | 114.6 | ||||
| 17 | L | 28 | Very low | 27.3 | Very low | 155 Ų | 155 | 144.7 Ų | 144.7 | 81% | 0.812 | 80% | 0.804 | S | S | * | * | trans | -65.6 | 164.8 | -164.9 | -124.3 | 75.1 | 0 | 0 | 0 | 116.8 | ||||
| 18 | P | 26.8 | Very low | 27.2 | Very low | 124 Ų | 124 | 144.8 Ų | 144.8 | 81% | 0.805 | 80% | 0.804 | S | S | * | * | -147 | 171 | 83.8 | 40.6 | -23.6 | 0 | 0 | 0 | 118.4 | |||||
| 19 | E | 27 | Very low | 27 | Very low | 168 Ų | 168 | 143.5 Ų | 143.5 | 79% | 0.785 | 80% | 0.798 | S | S | * | * | trans | -131.6 | 177.1 | 164.1 | -120.8 | -153.9 | -120.2 | 0 | 0 | 107.5 | ||||
| 20 | P | 33.7 | Very low | 26.5 | Very low | 117 Ų | 117 | 143.4 Ų | 143.4 | 76% | 0.76 | 79% | 0.786 | S | S | * | * | cis | -137.2 | -178.8 | 24.3 | 41.3 | -20.7 | 0 | 0 | 0 | 116.9 | ||||
| 21 | G | 25.9 | Very low | 26.2 | Very low | 68 Ų | 68 | 147.6 Ų | 147.6 | 70% | 0.701 | 78% | 0.781 | S | S | * | * | trans | -93.8 | -166.7 | -168.6 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 22 | K | 25.7 | Very low | 26.1 | Very low | 204 Ų | 204 | 141.7 Ų | 141.7 | 89% | 0.887 | 77% | 0.772 | S | S | * | * | trans | -162.3 | 126.1 | 170.5 | -115.3 | 171.6 | -173.9 | 175.8 | 0 | 115.3 | ||||
| 23 | H | 24.3 | Very low | 25.5 | Very low | 181 Ų | 181 | 142.7 Ų | 142.7 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | 11 | 148.5 | 151.7 | -75.7 | -89.5 | 0 | 0 | 0 | 125.1 | ||||
| 24 | V | 24.9 | Very low | 25.2 | Very low | 136 Ų | 136 | 140.6 Ų | 140.6 | 82% | 0.824 | 77% | 0.771 | S | S | * | * | trans | 134.5 | 132.6 | 132.2 | 179.4 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 25 | T | 22.3 | Very low | 24.7 | Very low | 119 Ų | 119 | 144.9 Ų | 144.9 | 73% | 0.73 | 77% | 0.773 | S | S | * | * | trans | -91.7 | 169.2 | -179.8 | 45.9 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 26 | T | 23.2 | Very low | 25.1 | Very low | 113 Ų | 113 | 144.7 Ų | 144.7 | 69% | 0.693 | 77% | 0.77 | S | S | * | * | 140.7 | 130.7 | 114.2 | -47.1 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 27 | S | 23.1 | Very low | 25 | Very low | 104 Ų | 104 | 137.8 Ų | 137.8 | 73% | 0.727 | 76% | 0.76 | S | S | * | * | trans | 63.5 | 163 | 161 | 64.4 | 0 | 0 | 0 | 0 | 117.6 | ||||
| 28 | L | 26.3 | Very low | 24.7 | Very low | 167 Ų | 167 | 136 Ų | 136 | 87% | 0.874 | 76% | 0.759 | S | S | * | * | cis | -137.6 | 177 | 12.3 | -140.3 | 131.3 | 0 | 0 | 0 | 111.8 | ||||
| 29 | Q | 23.1 | Very low | 24.6 | Very low | 150 Ų | 150 | 138.1 Ų | 138.1 | 70% | 0.701 | 76% | 0.756 | S | S | * | * | trans | -132.3 | 149.4 | -160 | -167.6 | 177.4 | -71.3 | 0 | 0 | 113.4 | ||||
| 30 | Q | 23.1 | Very low | 24.5 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 59% | 0.589 | 75% | 0.749 | S | S | * | * | trans | 66.6 | 154.4 | 171.7 | -79 | 152.2 | -66.9 | 0 | 0 | 116.3 | ||||
| 31 | Y | 22.8 | Very low | 24.2 | Very low | 194 Ų | 194 | 138.1 Ų | 138.1 | 76% | 0.761 | 75% | 0.751 | S | S | * | * | cis | -139.8 | -153.4 | 4.7 | -125.6 | -39.3 | 0 | 0 | 0 | 109.8 | ||||
| 32 | T | 22.1 | Very low | 24.2 | Very low | 115 Ų | 115 | 146.2 Ų | 146.2 | 71% | 0.706 | 76% | 0.762 | S | S | * | * | cis | -159.1 | 176.7 | 15 | -18.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 33 | T | 23 | Very low | 24.2 | Very low | 117 Ų | 117 | 145.1 Ų | 145.1 | 72% | 0.718 | 76% | 0.762 | S | S | * | * | trans | -32.3 | 160.8 | 156.6 | 47.3 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 34 | D | 21.1 | Very low | 24.2 | Very low | 137 Ų | 137 | 143 Ų | 143 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | cis | -176.8 | -168.4 | -17.7 | -149.9 | -34.8 | 0 | 0 | 0 | 109.1 | ||||
| 35 | Y | 24.3 | Very low | 24.3 | Very low | 210 Ų | 210 | 142.8 Ų | 142.8 | 82% | 0.824 | 77% | 0.766 | S | S | * | * | trans | 83.4 | 153.1 | 166.5 | -73.2 | -69.2 | 0 | 0 | 0 | 118.3 | ||||
| 36 | P | 30.5 | Very low | 24.6 | Very low | 122 Ų | 122 | 140.8 Ų | 140.8 | 79% | 0.792 | 77% | 0.769 | S | S | * | * | -134.4 | 174 | -127.3 | 42.3 | -24.6 | 0 | 0 | 0 | 116.3 | |||||
| 37 | G | 23.2 | Very low | 24.8 | Very low | 67 Ų | 67 | 144.5 Ų | 144.5 | 69% | 0.691 | 78% | 0.779 | S | S | * | * | trans | 178.7 | 91.5 | 169.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 38 | S | 22.6 | Very low | 25 | Very low | 116 Ų | 116 | 145.5 Ų | 145.5 | 81% | 0.811 | 79% | 0.786 | S | S | * | * | trans | 36.8 | 120.5 | 151.4 | 61.7 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 39 | K | 24.1 | Very low | 25.2 | Very low | 169 Ų | 169 | 142.2 Ų | 142.2 | 74% | 0.735 | 78% | 0.783 | S | S | * | * | trans | 142.3 | 143.6 | 140.9 | -81.6 | -179.5 | 165.9 | -78.2 | 0 | 109.3 | ||||
| 40 | E | 25.4 | Very low | 25.9 | Very low | 138 Ų | 138 | 141.2 Ų | 141.2 | 65% | 0.645 | 79% | 0.787 | S | S | * | * | cis | -160.9 | 154.6 | -16.6 | -113.3 | 153 | -174.5 | 0 | 0 | 104.4 | ||||
| 41 | D | 26.4 | Very low | 26.4 | Very low | 147 Ų | 147 | 145.1 Ų | 145.1 | 79% | 0.786 | 80% | 0.802 | S | S | * | * | trans | 37.9 | 110.7 | 170.8 | -59.1 | -19.3 | 0 | 0 | 0 | 120.8 | ||||
| 42 | Y | 26.5 | Very low | 26.8 | Very low | 239 Ų | 239 | 138.9 Ų | 138.9 | 94% | 0.937 | 80% | 0.797 | S | S | * | * | trans | -173.4 | 99.9 | 133 | -102.9 | -63.5 | 0 | 0 | 0 | 111.9 | ||||
| 43 | M | 26.3 | Very low | 27.5 | Very low | 181 Ų | 181 | 141 Ų | 141 | 89% | 0.892 | 80% | 0.802 | S | S | * | * | trans | -160.8 | 165.1 | 153.8 | -119.3 | -174 | -169.8 | 0 | 0 | 112.9 | ||||
| 44 | T | 24.4 | Very low | 28.4 | Very low | 135 Ų | 135 | 141.3 Ų | 141.3 | 83% | 0.828 | 80% | 0.804 | S | S | * | * | trans | 54.9 | 87.2 | 172.7 | 55.4 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 45 | S | 25.6 | Very low | 29.7 | Very low | 132 Ų | 132 | 140.2 Ų | 140.2 | 92% | 0.923 | 79% | 0.794 | S | S | * | * | -135.5 | 100.3 | 127.6 | -171 | 0 | 0 | 0 | 0 | 108.4 | |||||
| 46 | G | 29.4 | Very low | 31.3 | Very low | 77 Ų | 77 | 132.1 Ų | 132.1 | 79% | 0.794 | 77% | 0.768 | S | S | * | * | trans | -135 | 65.8 | -173 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 47 | E | 28.2 | Very low | 32.7 | Very low | 191 Ų | 191 | 130.1 Ų | 130.1 | 89% | 0.893 | 76% | 0.755 | S | S | * | * | trans | -162.4 | 106.7 | 167.4 | -118.3 | 174.4 | -171.8 | 0 | 0 | 111.2 | ||||
| 48 | S | 27 | Very low | 34.6 | Very low | 125 Ų | 125 | 136.3 Ų | 136.3 | 87% | 0.874 | 76% | 0.757 | S | S | * | * | trans | 161.2 | 93.2 | 145.9 | -173.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 49 | A | 29.9 | Very low | 36.8 | Very low | 99 Ų | 99 | 134.1 Ų | 134.1 | 82% | 0.818 | 73% | 0.731 | S | S | * | * | trans | -152.2 | 43.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 50 | V | 36.9 | Very low | 39.5 | Very low | 128 Ų | 128 | 130 Ų | 130 | 78% | 0.776 | 72% | 0.724 | S | S | * | * | trans | -106.5 | 132.5 | 178.2 | -171.2 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 51 | F | 34.8 | Very low | 42.1 | Very low | 209 Ų | 209 | 131 Ų | 131 | 92% | 0.917 | 72% | 0.722 | S | S | * | * | trans | 64 | 47.2 | -171.2 | -71.6 | -75.9 | 0 | 0 | 0 | 116.7 | ||||
| 52 | G | 29.9 | Very low | 44.8 | Very low | 62 Ų | 62 | 126.1 Ų | 126.1 | 64% | 0.639 | 71% | 0.705 | S | S | * | * | trans | -76 | 130.8 | 143.5 | 0 | 0 | 0 | 0 | 0 | 110 | V54 | G52-V54 PolarHBondContact O-N 3.26Š| ||
| 53 | I | 37.6 | Very low | 47.5 | Very low | 159 Ų | 159 | 119.3 Ų | 119.3 | 82% | 0.815 | 68% | 0.678 | S | S | * | * | trans | -65.2 | 119.1 | 164.7 | -64 | 177 | 0 | 0 | 0 | 106.7 | E55 | I53-E55 PolarHBondContact O-N 3.29Å; I53-E55 VanDerWaalsContact O-N 3.14Å | ||
| 54 | V | 41.8 | Very low | 50.3 | Low | 125 Ų | 125 | 110.7 Ų | 110.7 | 76% | 0.758 | 64% | 0.635 | S | S | * | * | trans | -67.1 | 113.2 | -178.4 | 179 | 0 | 0 | 0 | 0 | 108.9 | G52 | G52-V54 PolarHBondContact O-N 3.26Š| ||
| 55 | E | 48.1 | Very low | 53.4 | Low | 113 Ų | 113 | 107 Ų | 107 | 53% | 0.528 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -58 | 127 | 176.1 | -163.6 | -170.7 | 177.3 | 0 | 0 | 109.1 | I53 S201 H202 | I53-E55 PolarHBondContact O-N 3.29Å; I53-E55 VanDerWaalsContact O-N 3.14Å; E55-S201 WeakPolarHBondContact OE1-CB 3.44Å; E55-H202 IonicContact OE1-CD2 2.74Å |
| 56 | P | 58.8 | Low | 56.4 | Low | 41 Ų | 41 | 104 Ų | 104 | 27% | 0.266 | 58% | 0.583 | S | S | . | * | P | Polyproline II helix | trans | -60.3 | 127.1 | -172.8 | 20.3 | -32.1 | 0 | 0 | 0 | 110.8 | R58 S201 | P56-R58 PolarHBondContact O-N 2.84Å; P56-S201 WeakPolarHBondContact O-CB 3.43Å |
| 57 | P | 60 | Low | 59.3 | Low | 80 Ų | 80 | 100.4 Ų | 100.4 | 52% | 0.519 | 55% | 0.546 | S | S | . | . | P | Polyproline II helix | trans | -63.4 | 131.4 | -166.6 | 22.6 | -33.5 | 0 | 0 | 0 | 111.8 | R59 | P57-R59 WeakPolarHBondContact O-CD 3.09Å; P57-R59 PolarHBondContact O-N 3.02Å; P57-R59 PolarHBondContact O-NE 3.09Å |
| 58 | R | 62.8 | Low | 62.3 | Low | 196 Ų | 196 | 91.3 Ų | 91.3 | 74% | 0.74 | 50% | 0.503 | S | S | * | . | trans | -42.6 | 132.4 | -179.7 | -76.1 | 179.3 | 176.9 | 170 | 2.4 | 112 | P56 S201 | P56-R58 PolarHBondContact O-N 2.84Å; R58-S201 WeakPolarHBondContact CG-OG 3.41Å | ||
| 59 | R | 69.6 | Low | 65.4 | Low | 70 Ų | 70 | 86.8 Ų | 86.8 | 26% | 0.264 | 47% | 0.469 | S | S | . | . | trans | -98.9 | 141.5 | -170.6 | -56.7 | -59.6 | -176.3 | -174.8 | 1.6 | 110.4 | P57 R61 L64 V199 D204 | P57-R59 WeakPolarHBondContact O-CD 3.09Å; P57-R59 PolarHBondContact O-N 3.02Å; P57-R59 PolarHBondContact O-NE 3.09Å; R59-R61 PolarHBondContact O-N 3.12Å; R59-L64 HydrophobicContact CB-CD2 4.2Å; R59-L64 HydrophobicContact CB-CG 4.31Å; R59-V199 PolarHBondContact NE-O 2.78Å; R59-V199 PolarHBondContact NH2-O 3.43Å; R59-V199 VanDerWaalsContact NH2-O 3.14Å; R59-D204 PolarHBondContact N-OD2 2.92Å | ||
| 60 | S | 79.1 | Confident | 68.5 | Low | 84 Ų | 84 | 82 Ų | 82 | 59% | 0.587 | 43% | 0.43 | S | S | * | . | trans | -59.2 | 136.7 | 172 | 175.1 | 0 | 0 | 0 | 0 | 110.1 | G62 R63 L64 | S60-G62 PolarHBondContact O-N 2.95Å; S60-G62 VanDerWaalsContact O-N 3.08Å; S60-R63 WeakPolarHBondContact O-CB 3.46Å; S60-R63 PolarHBondContact O-N 3.27Å; S60-L64 PolarHBondContact O-N 3.43Å | ||
| 61 | R | 81 | Confident | 71.2 | Confident | 159 Ų | 159 | 76 Ų | 76 | 60% | 0.6 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -51.1 | -37.2 | -177.5 | -61.1 | -179 | -173.7 | 172.4 | 3.1 | 112.4 | R59 R63 L64 I65 | R59-R61 PolarHBondContact O-N 3.12Å; R61-R63 VanDerWaalsContact C-N 3.28Å; R61-R63 PolarHBondContact O-N 3.17Å; R61-L64 PolarHBondContact O-N 2.8Å; R61-I65 WeakPolarHBondContact O-CG1 2.97Å; R61-I65 PolarHBondContact O-N 2.94Å |
| 62 | G | 82.8 | Confident | 74.1 | Confident | 43 Ų | 43 | 67.8 Ų | 67.8 | 44% | 0.443 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.4 | -35.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | S60 L66 | S60-G62 PolarHBondContact O-N 2.95Å; S60-G62 VanDerWaalsContact O-N 3.08Å; G62-L66 WeakPolarHBondContact O-CB 3.35Å; G62-L66 PolarHBondContact O-N 3.17Å |
| 63 | R | 84.4 | Confident | 77.1 | Confident | 96 Ų | 96 | 64.8 Ų | 64.8 | 36% | 0.362 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -75.9 | -33.7 | 178.3 | -54.1 | -170.2 | 82.6 | 151 | 14.3 | 112.7 | S60 R61 L66 H67 S265 I266 | S60-R63 WeakPolarHBondContact O-CB 3.46Å; S60-R63 PolarHBondContact O-N 3.27Å; R61-R63 VanDerWaalsContact C-N 3.28Å; R61-R63 PolarHBondContact O-N 3.17Å; R63-L66 PolarHBondContact O-N 3.06Å; R63-H67 VanDerWaalsContact O-CB 3.31Å; R63-H67 WeakPolarHBondContact O-CB 3.02Å; R63-H67 PolarHBondContact O-N 3.37Å; R63-S265 PolarHBondContact NE-O 2.98Å; R63-S265 PolarHBondContact NH2-O 3.41Å; R63-S265 PolarHBondContact O-OG 3.34Å; R63-I266 HydrophobicContact CB-CD1 4.47Å; R63-I266 HydrophobicContact CB-CG1 4.2Å |
| 64 | L | 84.9 | Confident | 79.8 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.2 | -47.1 | 171.9 | -63.3 | 173.8 | 0 | 0 | 0 | 110.1 | R59 S60 R61 H67 S68 L196 C200 D204 R207 Y211 | R59-L64 HydrophobicContact CB-CD2 4.2Å; R59-L64 HydrophobicContact CB-CG 4.31Å; S60-L64 PolarHBondContact O-N 3.43Å; R61-L64 PolarHBondContact O-N 2.8Å; L64-H67 WeakPolarHBondContact O-CB 3.07Å; L64-H67 PolarHBondContact O-N 3.25Å; L64-S68 WeakPolarHBondContact O-CB 3.19Å; L64-S68 PolarHBondContact O-N 3Å; L64-S68 PolarHBondContact O-OG 3.48Å; L64-L196 HydrophobicContact CD2-CD1 4.2Å; L64-C200 VanDerWaalsContact CD2-SG 3.58Å; L64-D204 HydrophobicContact CD1-CB 4Å; L64-D204 HydrophobicContact CD2-CB 4.37Å; L64-R207 HydrophobicContact CD1-CB 4.35Å; L64-Y211 HydrophobicContact CB-CD2 4.15Å; L64-Y211 HydrophobicContact CB-CE2 4.36Å |
| 65 | I | 88.9 | Confident | 82.3 | Confident | 57 Ų | 57 | 53.2 Ų | 53.2 | 29% | 0.292 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -57.9 | -50.9 | 173.8 | -70.6 | 165.2 | 0 | 0 | 0 | 110.8 | R61 H67 S68 L69 Y211 F215 | R61-I65 WeakPolarHBondContact O-CG1 2.97Å; R61-I65 PolarHBondContact O-N 2.94Å; I65-H67 VanDerWaalsContact C-N 3.28Å; I65-H67 PolarHBondContact O-N 3.11Å; I65-S68 PolarHBondContact O-N 3.35Å; I65-L69 WeakPolarHBondContact O-CG 3.34Å; I65-L69 PolarHBondContact O-N 3.21Å; I65-Y211 HydrophobicContact CD1-CE1 4.16Å; I65-Y211 HydrophobicContact CG1-CD1 4Å; I65-Y211 HydrophobicContact CG1-CD2 4.25Å; I65-Y211 HydrophobicContact CG1-CE1 3.83Å; I65-Y211 HydrophobicContact CG1-CE2 4.1Å; I65-Y211 HydrophobicContact CG1-CG 4.23Å; I65-F215 HydrophobicContact CG2-CE2 4Å; I65-F215 HydrophobicContact CG2-CZ 3.92Å |
| 66 | L | 89.1 | Confident | 84.5 | Confident | 69 Ų | 69 | 48.3 Ų | 48.3 | 36% | 0.361 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.3 | -29.3 | -178.3 | -162.8 | 76 | 0 | 0 | 0 | 113.1 | G62 R63 L69 V261 S265 | G62-L66 WeakPolarHBondContact O-CB 3.35Å; G62-L66 PolarHBondContact O-N 3.17Å; R63-L66 PolarHBondContact O-N 3.06Å; L66-L69 HydrophobicContact CD1-CD1 4.32Å; L66-V261 HydrophobicContact CD1-CG1 3.36Å; L66-V261 HydrophobicContact CG-CG1 3.69Å; L66-S265 WeakPolarHBondContact CB-OG 3.36Å |
| 67 | H | 89.7 | Confident | 86.2 | Confident | 2 Ų | 2 | 46.4 Ų | 46.4 | 1% | 0.009 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -68.6 | -49.5 | 167.8 | 178 | 86.3 | 0 | 0 | 0 | 111.1 | R63 L64 I65 L69 V70 I192 Y195 H212 H262 S265 I266 | R63-H67 VanDerWaalsContact O-CB 3.31Å; R63-H67 WeakPolarHBondContact O-CB 3.02Å; R63-H67 PolarHBondContact O-N 3.37Å; L64-H67 WeakPolarHBondContact O-CB 3.07Å; L64-H67 PolarHBondContact O-N 3.25Å; I65-H67 VanDerWaalsContact C-N 3.28Å; I65-H67 PolarHBondContact O-N 3.11Å; H67-L69 VanDerWaalsContact C-N 3.33Å; H67-L69 PolarHBondContact O-N 2.94Å; H67-V70 WeakPolarHBondContact O-CG1 3.33Å; H67-I192 PolarHBondContact NE2-O 3.09Å; H67-Y195 AromaticContact CE1-CD1 3.2Å; H67-Y195 WeakPolarHBondContact CE1-CD1 3.31Å; H67-Y195 AromaticContact CE1-CE1 3.92Å; H67-Y195 AromaticContact CE1-CG 3.73Å; H67-Y195 AromaticContact ND1-CD1 3.57Å; H67-Y195 AromaticContact ND1-CE1 3.83Å; H67-H212 AromaticContact CD2-NE2 3.42Å; H67-H212 PolarHBondContact CD2-NE2 3.26Å; H67-H212 AromaticContact NE2-CE1 3.96Å; H67-H212 AromaticContact NE2-NE2 3.61Å; H67-H262 AromaticContact CE1-CE1 3.24Å; H67-H262 PolarHBondContact CE1-CE1 3.1Å; H67-H262 AromaticContact CE1-ND1 3.97Å; H67-H262 AromaticContact ND1-CE1 3.48Å; H67-H262 PolarHBondContact ND1-CE1 3.45Å; H67-H262 AromaticContact ND1-ND1 3.81Å; H67-H262 AromaticContact NE2-CE1 3.82Å; H67-H262 PolarHBondContact O-ND1 3.17Å; H67-S265 PolarHBondContact N-OG 3.19Å; H67-I266 HydrophobicContact CB-CD1 4.36Å |
| 68 | S | 90.7 | Very high | 87.7 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -72 | -19.6 | -172.9 | -60 | 0 | 0 | 0 | 0 | 115 | L64 I65 V70 M71 G208 Y211 H212 | L64-S68 WeakPolarHBondContact O-CB 3.19Å; L64-S68 PolarHBondContact O-N 3Å; L64-S68 PolarHBondContact O-OG 3.48Å; I65-S68 PolarHBondContact O-N 3.35Å; S68-V70 PolarHBondContact O-N 3.35Å; S68-V70 VanDerWaalsContact O-N 3.09Å; S68-M71 WeakPolarHBondContact O-CB 3.39Å; S68-M71 PolarHBondContact O-N 3.09Å; S68-G208 PolarHBondContact OG-O 3.39Å; S68-Y211 WeakPolarHBondContact OG-CB 3.34Å; S68-H212 VanDerWaalsContact CB-CD2 3.48Å; S68-H212 WeakPolarHBondContact CB-CD2 3.17Å; S68-H212 PolarHBondContact OG-CD2 3.4Å |
| 69 | L | 93.3 | Very high | 88.9 | Confident | 30 Ų | 30 | 35.8 Ų | 35.8 | 16% | 0.157 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.8 | -23.7 | 177.2 | -81.3 | 175 | 0 | 0 | 0 | 114.1 | I65 L66 H67 M71 F72 G73 F215 F258 V261 | I65-L69 WeakPolarHBondContact O-CG 3.34Å; I65-L69 PolarHBondContact O-N 3.21Å; L66-L69 HydrophobicContact CD1-CD1 4.32Å; H67-L69 VanDerWaalsContact C-N 3.33Å; H67-L69 PolarHBondContact O-N 2.94Å; L69-M71 PolarHBondContact O-N 3.19Å; L69-F72 WeakPolarHBondContact O-CB 3.43Å; L69-F72 PolarHBondContact O-N 3.43Å; L69-F72 VanDerWaalsContact O-N 3.09Å; L69-G73 PolarHBondContact O-N 2.87Å; L69-F215 HydrophobicContact CD2-CD1 3.83Å; L69-F215 HydrophobicContact CD2-CD2 4.41Å; L69-F215 HydrophobicContact CD2-CE1 3.49Å; L69-F215 VanDerWaalsContact CD2-CE1 3.49Å; L69-F215 HydrophobicContact CD2-CE2 4.12Å; L69-F215 HydrophobicContact CD2-CG 4.31Å; L69-F215 HydrophobicContact CD2-CZ 3.66Å; L69-F215 HydrophobicContact CG-CE2 4.39Å; L69-F215 HydrophobicContact CG-CZ 4.31Å; L69-F258 HydrophobicContact CB-CD1 3.75Å; L69-F258 HydrophobicContact CB-CE1 4.14Å; L69-F258 HydrophobicContact CD1-CD1 4.28Å; L69-F258 HydrophobicContact CD1-CE1 4.12Å; L69-F258 HydrophobicContact CD2-CD1 4.32Å; L69-F258 HydrophobicContact CD2-CE1 3.83Å; L69-F258 HydrophobicContact CG-CD1 4.34Å; L69-F258 HydrophobicContact CG-CE1 4.26Å; L69-V261 HydrophobicContact CD1-CG1 4.18Å |
| 70 | V | 94.3 | Very high | 89.9 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -56.2 | -33.4 | 172.6 | 69.7 | 0 | 0 | 0 | 0 | 112.3 | H67 S68 F72 G73 R74 I192 W255 H262 | H67-V70 WeakPolarHBondContact O-CG1 3.33Å; S68-V70 PolarHBondContact O-N 3.35Å; S68-V70 VanDerWaalsContact O-N 3.09Å; V70-F72 VanDerWaalsContact C-N 3.3Å; V70-F72 PolarHBondContact O-N 3.43Å; V70-G73 PolarHBondContact O-N 3.23Å; V70-R74 PolarHBondContact O-N 3.24Å; V70-I192 HydrophobicContact CB-CD1 4.36Å; V70-I192 HydrophobicContact CG1-CD1 3.65Å; V70-I192 HydrophobicContact CG1-CG1 4.07Å; V70-I192 HydrophobicContact CG1-CG2 3.66Å; V70-I192 HydrophobicContact CG2-CD1 3.75Å; V70-W255 HydrophobicContact CG2-CH2 3.69Å; V70-W255 HydrophobicContact CG2-CZ3 3.66Å; V70-W255 WeakPolarHBondContact O-CZ3 3.2Å; V70-H262 HydrophobicContact CB-CB 3.95Å; V70-H262 WeakPolarHBondContact CG1-ND1 3.48Å; V70-H262 HydrophobicContact CG2-CB 4.34Å |
| 71 | M | 93.3 | Very high | 90.3 | Very high | 1 Ų | 1 | 28.8 Ų | 28.8 | 1% | 0.005 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -71 | -26 | 179.9 | -61.3 | -53 | -150.6 | 0 | 0 | 112.8 | S68 L69 E75 D189 I192 K193 H212 F215 | S68-M71 WeakPolarHBondContact O-CB 3.39Å; S68-M71 PolarHBondContact O-N 3.09Å; L69-M71 PolarHBondContact O-N 3.19Å; M71-E75 WeakPolarHBondContact O-CB 3.27Å; M71-E75 PolarHBondContact O-N 3.11Å; M71-D189 VanDerWaalsContact CE-OD1 3.22Å; M71-D189 WeakPolarHBondContact CE-OD1 3.17Å; M71-I192 HydrophobicContact CE-CB 4.04Å; M71-I192 HydrophobicContact CE-CG2 3.55Å; M71-I192 HydrophobicContact SD-CD1 4.16Å; M71-I192 HydrophobicContact SD-CG2 4.06Å; M71-K193 HydrophobicContact CE-CG 4.25Å; M71-H212 HydrophobicContact CG-CB 3.98Å; M71-H212 VanDerWaalsContact CG-CD2 3.41Å; M71-H212 WeakPolarHBondContact CG-CD2 3.06Å; M71-F215 HydrophobicContact CB-CB 4.46Å |
| 72 | F | 95.1 | Very high | 90.5 | Very high | 36 Ų | 36 | 23.1 Ų | 23.1 | 16% | 0.158 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -65 | -50.4 | 169.3 | -176.6 | -75.9 | 0 | 0 | 0 | 110.1 | L69 V70 R74 E75 F76 F215 L218 G219 C222 T254 F258 | L69-F72 WeakPolarHBondContact O-CB 3.43Å; L69-F72 PolarHBondContact O-N 3.43Å; L69-F72 VanDerWaalsContact O-N 3.09Å; V70-F72 VanDerWaalsContact C-N 3.3Å; V70-F72 PolarHBondContact O-N 3.43Å; F72-R74 VanDerWaalsContact C-N 3.32Å; F72-R74 PolarHBondContact O-N 3.14Å; F72-E75 PolarHBondContact O-N 3.2Å; F72-F76 HydrophobicContact CD1-CB 4.46Å; F72-F76 HydrophobicContact CE1-CB 4.37Å; F72-F76 HydrophobicContact CE1-CD2 4.3Å; F72-F76 WeakPolarHBondContact O-CB 3.43Å; F72-F76 PolarHBondContact O-N 3.16Å; F72-F215 VanDerWaalsContact CA-O 3.28Å; F72-F215 WeakPolarHBondContact CA-O 3.31Å; F72-F215 HydrophobicContact CB-CB 4.06Å; F72-F215 HydrophobicContact CB-CD1 4.34Å; F72-F215 HydrophobicContact CD2-CD1 4.44Å; F72-L218 HydrophobicContact CD2-CB 3.9Å; F72-L218 HydrophobicContact CE2-CB 3.91Å; F72-G219 VanDerWaalsContact CD2-CA 3.48Å; F72-G219 VanDerWaalsContact CD2-N 3.32Å; F72-C222 HydrophobicContact CE2-CB 4.46Å; F72-C222 HydrophobicContact CZ-CB 3.85Å; F72-T254 HydrophobicContact CD1-CG2 4.31Å; F72-T254 HydrophobicContact CE1-CG2 4.1Å; F72-F258 HydrophobicContact CB-CE2 4.49Å; F72-F258 AromaticContact CD1-CD2 3.87Å; F72-F258 HydrophobicContact CD1-CD2 3.87Å; F72-F258 AromaticContact CD1-CE2 3.27Å; F72-F258 HydrophobicContact CD1-CE2 3.27Å; F72-F258 AromaticContact CD1-CZ 3.94Å; F72-F258 HydrophobicContact CD1-CZ 3.94Å; F72-F258 AromaticContact CE1-CE2 3.74Å; F72-F258 HydrophobicContact CE1-CE2 3.74Å; F72-F258 HydrophobicContact CE1-CZ 4.35Å; F72-F258 HydrophobicContact CG-CE2 4.13Å; F72-F258 HydrophobicContact CG-CZ 4.47Å |
| 73 | G | 94.5 | Very high | 90.3 | Very high | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.6 | -37.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L69 V70 C77 W255 | L69-G73 PolarHBondContact O-N 2.87Å; V70-G73 PolarHBondContact O-N 3.23Å; G73-C77 PolarHBondContact O-N 3.3Å; G73-C77 PolarHBondContact O-SG 3.33Å; G73-W255 VanDerWaalsContact C-CE3 3.44Å |
| 74 | R | 94.4 | Very high | 90.2 | Very high | 13 Ų | 13 | 18.8 Ų | 18.8 | 5% | 0.049 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -59.4 | -62.6 | 172.3 | -177.5 | -154 | -176.9 | -107 | -2.4 | 110.7 | V70 F72 F76 C77 Y78 A185 D186 W255 | V70-R74 PolarHBondContact O-N 3.24Å; F72-R74 VanDerWaalsContact C-N 3.32Å; F72-R74 PolarHBondContact O-N 3.14Å; R74-F76 VanDerWaalsContact C-N 3.29Å; R74-F76 PolarHBondContact O-N 3Å; R74-C77 PolarHBondContact O-N 3.25Å; R74-Y78 PolarHBondContact O-N 3.21Å; R74-A185 VanDerWaalsContact CZ-O 3.3Å; R74-A185 PolarHBondContact NE-O 2.88Å; R74-A185 PolarHBondContact NH2-O 3.16Å; R74-D186 IonicContact NH2-OD1 2.78Å; R74-D186 PolarHBondContact NH2-OD1 2.89Å; R74-W255 HydrophobicContact CB-CZ3 4.22Å |
| 75 | E | 93.5 | Very high | 90.2 | Very high | 27 Ų | 27 | 19 Ų | 19 | 13% | 0.126 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -69.5 | -29.1 | -170.7 | -148.5 | 80.4 | 160.6 | 0 | 0 | 112.3 | M71 F72 Y78 A79 T216 Y483 | M71-E75 WeakPolarHBondContact O-CB 3.27Å; M71-E75 PolarHBondContact O-N 3.11Å; F72-E75 PolarHBondContact O-N 3.2Å; E75-Y78 PolarHBondContact O-N 3.31Å; E75-A79 VanDerWaalsContact O-CB 3.24Å; E75-A79 WeakPolarHBondContact O-CB 3.32Å; E75-A79 PolarHBondContact O-N 2.84Å; E75-T216 HydrophobicContact CB-CG2 4.07Å; E75-T216 WeakPolarHBondContact CB-O 3.13Å; E75-T216 HydrophobicContact CG-CG2 3.66Å; E75-T216 WeakPolarHBondContact CG-O 3.23Å; E75-T216 WeakPolarHBondContact OE1-CG2 2.99Å; E75-Y483 PolarHBondContact OE1-OH 2.78Å; E75-Y483 VanDerWaalsContact OE1-OH 3.09Å |
| 76 | F | 94.2 | Very high | 89.6 | Confident | 10 Ų | 10 | 18.9 Ų | 18.9 | 4% | 0.044 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -57.1 | -51.3 | 171 | 178.6 | -86.1 | 0 | 0 | 0 | 111.3 | F72 R74 A79 V80 G219 C222 V226 T254 | F72-F76 HydrophobicContact CD1-CB 4.46Å; F72-F76 HydrophobicContact CE1-CB 4.37Å; F72-F76 HydrophobicContact CE1-CD2 4.3Å; F72-F76 WeakPolarHBondContact O-CB 3.43Å; F72-F76 PolarHBondContact O-N 3.16Å; R74-F76 VanDerWaalsContact C-N 3.29Å; R74-F76 PolarHBondContact O-N 3Å; F76-A79 PolarHBondContact O-N 2.94Å; F76-V80 HydrophobicContact CD1-CG2 4.37Å; F76-V80 HydrophobicContact CE1-CG2 4Å; F76-V80 HydrophobicContact CZ-CG2 4.28Å; F76-V80 WeakPolarHBondContact O-CG2 3.4Å; F76-V80 PolarHBondContact O-N 3.11Å; F76-G219 VanDerWaalsContact CA-O 3.29Å; F76-G219 WeakPolarHBondContact CA-O 3.46Å; F76-C222 HydrophobicContact CD2-CB 3.79Å; F76-C222 HydrophobicContact CE2-CB 4.04Å; F76-V226 HydrophobicContact CE2-CB 4.42Å; F76-V226 HydrophobicContact CE2-CG2 3.91Å; F76-V226 HydrophobicContact CZ-CB 4.24Å; F76-V226 HydrophobicContact CZ-CG1 4.34Å; F76-V226 HydrophobicContact CZ-CG2 3.88Å; F76-T254 HydrophobicContact CB-CG2 4.39Å; F76-T254 HydrophobicContact CD1-CG2 3.95Å; F76-T254 HydrophobicContact CE1-CG2 4.41Å; F76-T254 HydrophobicContact CG-CG2 4.02Å |
| 77 | C | 94.4 | Very high | 88.9 | Confident | 1 Ų | 1 | 18.2 Ų | 18.2 | 1% | 0.007 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -70.8 | -35.9 | -178.6 | -58.9 | 0 | 0 | 0 | 0 | 111.7 | G73 R74 V80 E81 M142 I146 F181 | G73-C77 PolarHBondContact O-N 3.3Å; G73-C77 PolarHBondContact O-SG 3.33Å; R74-C77 PolarHBondContact O-N 3.25Å; C77-V80 PolarHBondContact O-N 3.19Å; C77-E81 PolarHBondContact O-N 3.08Å; C77-M142 HydrophobicContact CB-CE 3.56Å; C77-I146 HydrophobicContact CB-CD1 4.26Å; C77-F181 HydrophobicContact CB-CE2 3.89Å; C77-F181 HydrophobicContact CB-CZ 3.54Å |
| 78 | Y | 91.4 | Very high | 88.5 | Confident | 52 Ų | 52 | 18.5 Ų | 18.5 | 20% | 0.204 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -67.7 | -36.9 | 177.7 | -160.8 | -110.5 | 0 | 0 | 0 | 112 | R74 E75 A82 F181 A185 | R74-Y78 PolarHBondContact O-N 3.21Å; E75-Y78 PolarHBondContact O-N 3.31Å; Y78-A82 WeakPolarHBondContact O-CB 3.33Å; Y78-A82 PolarHBondContact O-N 3.49Å; Y78-F181 HydrophobicContact CD2-CE1 4.04Å; Y78-A185 HydrophobicContact CD2-CB 3.85Å; Y78-A185 HydrophobicContact CE2-CB 4.3Å |
| 79 | A | 89.1 | Confident | 88 | Confident | 2 Ų | 2 | 18.6 Ų | 18.6 | 2% | 0.017 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -71.5 | -34.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | E75 F76 A83 Y224 | E75-A79 VanDerWaalsContact O-CB 3.24Å; E75-A79 WeakPolarHBondContact O-CB 3.32Å; E75-A79 PolarHBondContact O-N 2.84Å; F76-A79 PolarHBondContact O-N 2.94Å; A79-A83 PolarHBondContact O-N 3.42Å; A79-A83 VanDerWaalsContact O-N 3.13Å; A79-Y224 HydrophobicContact CB-CD1 3.91Å; A79-Y224 HydrophobicContact CB-CD2 3.97Å; A79-Y224 HydrophobicContact CB-CE1 3.79Å; A79-Y224 HydrophobicContact CB-CE2 3.84Å; A79-Y224 HydrophobicContact CB-CG 3.98Å |
| 80 | V | 89.1 | Confident | 87.1 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -64.8 | -44.7 | 171.2 | 164 | 0 | 0 | 0 | 0 | 111.1 | F76 C77 A83 F84 V226 I247 | F76-V80 HydrophobicContact CD1-CG2 4.37Å; F76-V80 HydrophobicContact CE1-CG2 4Å; F76-V80 HydrophobicContact CZ-CG2 4.28Å; F76-V80 WeakPolarHBondContact O-CG2 3.4Å; F76-V80 PolarHBondContact O-N 3.11Å; C77-V80 PolarHBondContact O-N 3.19Å; V80-A83 PolarHBondContact O-N 3.24Å; V80-F84 HydrophobicContact CG1-CD2 4.14Å; V80-F84 VanDerWaalsContact O-CD2 3.31Å; V80-F84 WeakPolarHBondContact O-CD2 3.37Å; V80-F84 PolarHBondContact O-N 3.41Å; V80-F84 VanDerWaalsContact O-N 3.14Å; V80-V226 HydrophobicContact CG2-CB 4.44Å; V80-V226 HydrophobicContact CG2-CG1 4.16Å; V80-I247 HydrophobicContact CG1-CG2 3.3Å |
| 81 | E | 89.3 | Confident | 86.1 | Confident | 7 Ų | 7 | 23.9 Ų | 23.9 | 3% | 0.033 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -60.1 | -51.4 | 173.2 | 179.3 | 179.8 | -124.4 | 0 | 0 | 111 | C77 A83 F84 V85 F149 F181 | C77-E81 PolarHBondContact O-N 3.08Å; E81-A83 PolarHBondContact O-N 2.95Å; E81-A83 VanDerWaalsContact O-N 3.07Å; E81-F84 PolarHBondContact O-N 3.34Å; E81-V85 HydrophobicContact CG-CB 3.95Å; E81-V85 HydrophobicContact CG-CG1 4.47Å; E81-V85 HydrophobicContact CG-CG2 4.41Å; E81-V85 VanDerWaalsContact O-CB 3.23Å; E81-V85 WeakPolarHBondContact O-CB 3.43Å; E81-V85 VanDerWaalsContact O-CG1 3.26Å; E81-V85 WeakPolarHBondContact O-CG1 3.34Å; E81-V85 PolarHBondContact O-N 3.08Å; E81-F149 HydrophobicContact CB-CE1 4.42Å; E81-F149 HydrophobicContact CG-CE1 4.24Å; E81-F181 HydrophobicContact CB-CD1 4.43Å; E81-F181 HydrophobicContact CB-CE1 4.02Å; E81-F181 HydrophobicContact CG-CD1 4.42Å; E81-F181 HydrophobicContact CG-CE1 4.47Å; E81-F181 WeakPolarHBondContact OE1-CD1 3.19Å; E81-F181 WeakPolarHBondContact OE2-CD1 3.48Å; E81-F181 WeakPolarHBondContact OE2-CE1 3.37Å |
| 82 | A | 83.9 | Confident | 85.3 | Confident | 39 Ų | 39 | 25.5 Ų | 25.5 | 32% | 0.322 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -55.7 | -29.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y78 Y224 | Y78-A82 WeakPolarHBondContact O-CB 3.33Å; Y78-A82 PolarHBondContact O-N 3.49Å; A82-Y224 HydrophobicContact CB-CE1 4.25Å |
| 83 | A | 79.4 | Confident | 84.2 | Confident | 29 Ų | 29 | 26.1 Ų | 26.1 | 24% | 0.24 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -75.1 | -43.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A79 V80 E81 | A79-A83 PolarHBondContact O-N 3.42Å; A79-A83 VanDerWaalsContact O-N 3.13Å; V80-A83 PolarHBondContact O-N 3.24Å; E81-A83 PolarHBondContact O-N 2.95Å; E81-A83 VanDerWaalsContact O-N 3.07Å |
| 84 | F | 81.4 | Confident | 83.2 | Confident | 20 Ų | 20 | 26.4 Ų | 26.4 | 9% | 0.088 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -104.6 | -13.8 | -169.2 | -67.3 | -68 | 0 | 0 | 0 | 115.8 | V80 E81 T86 P87 V88 F149 Y244 I247 | V80-F84 HydrophobicContact CG1-CD2 4.14Å; V80-F84 VanDerWaalsContact O-CD2 3.31Å; V80-F84 WeakPolarHBondContact O-CD2 3.37Å; V80-F84 PolarHBondContact O-N 3.41Å; V80-F84 VanDerWaalsContact O-N 3.14Å; E81-F84 PolarHBondContact O-N 3.34Å; F84-T86 PolarHBondContact O-N 3.43Å; F84-P87 WeakPolarHBondContact O-CD 3.21Å; F84-V88 HydrophobicContact CB-CG2 4.43Å; F84-V88 WeakPolarHBondContact O-CB 3.44Å; F84-V88 VanDerWaalsContact O-CG2 3.29Å; F84-V88 WeakPolarHBondContact O-CG2 3.34Å; F84-V88 PolarHBondContact O-N 3.46Å; F84-F149 HydrophobicContact CB-CZ 4.29Å; F84-Y244 HydrophobicContact CD1-CE1 4.27Å; F84-I247 HydrophobicContact CD1-CD1 4.33Å; F84-I247 HydrophobicContact CD2-CD1 3.99Å; F84-I247 HydrophobicContact CD2-CG2 4.06Å; F84-I247 HydrophobicContact CE1-CD1 3.82Å; F84-I247 HydrophobicContact CE2-CD1 3.42Å; F84-I247 VanDerWaalsContact CE2-CD1 3.42Å; F84-I247 HydrophobicContact CE2-CG1 4Å; F84-I247 HydrophobicContact CE2-CG2 4Å; F84-I247 HydrophobicContact CG-CD1 4.42Å; F84-I247 HydrophobicContact CZ-CD1 3.33Å; F84-I247 HydrophobicContact CZ-CG1 4.23Å |
| 85 | V | 84.3 | Confident | 82.3 | Confident | 3 Ų | 3 | 29.2 Ų | 29.2 | 2% | 0.018 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.3 | -43.1 | -174.1 | 65.2 | 0 | 0 | 0 | 0 | 112.5 | E81 L89 W103 F149 V178 | E81-V85 HydrophobicContact CG-CB 3.95Å; E81-V85 HydrophobicContact CG-CG1 4.47Å; E81-V85 HydrophobicContact CG-CG2 4.41Å; E81-V85 VanDerWaalsContact O-CB 3.23Å; E81-V85 WeakPolarHBondContact O-CB 3.43Å; E81-V85 VanDerWaalsContact O-CG1 3.26Å; E81-V85 WeakPolarHBondContact O-CG1 3.34Å; E81-V85 PolarHBondContact O-N 3.08Å; V85-L89 HydrophobicContact CG2-CD1 3.9Å; V85-L89 HydrophobicContact CG2-CG 4.38Å; V85-L89 WeakPolarHBondContact O-CB 3.09Å; V85-L89 VanDerWaalsContact O-CG 3.24Å; V85-L89 WeakPolarHBondContact O-CG 3.46Å; V85-L89 PolarHBondContact O-N 3.27Å; V85-W103 HydrophobicContact CG1-CH2 3.91Å; V85-W103 HydrophobicContact CG1-CZ2 3.38Å; V85-F149 HydrophobicContact CB-CE2 4.26Å; V85-F149 HydrophobicContact CB-CZ 4.1Å; V85-F149 HydrophobicContact CG2-CE2 4.3Å; V85-V178 HydrophobicContact CG2-CB 4.47Å; V85-V178 HydrophobicContact CG2-CG1 3.78Å; V85-V178 HydrophobicContact CG2-CG2 3.77Å |
| 86 | T | 77.1 | Confident | 81 | Confident | 55 Ų | 55 | 34 Ų | 34 | 34% | 0.337 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -69 | -50.6 | 178 | -62.4 | 0 | 0 | 0 | 0 | 112 | F84 V88 L89 L90 | F84-T86 PolarHBondContact O-N 3.43Å; T86-V88 VanDerWaalsContact C-N 3.33Å; T86-V88 PolarHBondContact O-N 3.13Å; T86-L89 PolarHBondContact O-N 2.87Å; T86-L90 HydrophobicContact CG2-CD1 3.92Å; T86-L90 WeakPolarHBondContact O-CB 3.31Å; T86-L90 WeakPolarHBondContact O-CD1 3.39Å; T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 2.71Å |
| 87 | P | 75.3 | Confident | 79.7 | Confident | 56 Ų | 56 | 38 Ų | 38 | 36% | 0.364 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -52.4 | -43.2 | 170.5 | -30.1 | 34.8 | 0 | 0 | 0 | 114.9 | F84 L90 S91 | F84-P87 WeakPolarHBondContact O-CD 3.21Å; P87-L90 WeakPolarHBondContact O-CB 3.41Å; P87-L90 PolarHBondContact O-N 2.96Å; P87-S91 WeakPolarHBondContact O-CB 3.34Å; P87-S91 PolarHBondContact O-N 2.72Å; P87-S91 PolarHBondContact O-OG 2.93Å |
| 88 | V | 80.7 | Confident | 78.8 | Confident | 7 Ų | 7 | 41.3 Ų | 41.3 | 4% | 0.042 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -70.5 | -45.7 | -178.9 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | F84 T86 L90 S91 V92 F149 V174 Y244 | F84-V88 HydrophobicContact CB-CG2 4.43Å; F84-V88 WeakPolarHBondContact O-CB 3.44Å; F84-V88 VanDerWaalsContact O-CG2 3.29Å; F84-V88 WeakPolarHBondContact O-CG2 3.34Å; F84-V88 PolarHBondContact O-N 3.46Å; T86-V88 VanDerWaalsContact C-N 3.33Å; T86-V88 PolarHBondContact O-N 3.13Å; V88-L90 VanDerWaalsContact C-N 3.28Å; V88-L90 PolarHBondContact O-N 3.2Å; V88-S91 PolarHBondContact O-N 3.21Å; V88-S91 PolarHBondContact O-OG 2.85Å; V88-V92 HydrophobicContact CG1-CG2 4.5Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.27Å; V88-V92 PolarHBondContact O-N 3.04Å; V88-F149 HydrophobicContact CB-CE2 3.68Å; V88-F149 HydrophobicContact CB-CZ 4.29Å; V88-F149 HydrophobicContact CG1-CD2 3.97Å; V88-F149 HydrophobicContact CG1-CE2 3.63Å; V88-F149 HydrophobicContact CG2-CE2 4.08Å; V88-F149 HydrophobicContact CG2-CZ 4.26Å; V88-V174 HydrophobicContact CG1-CG1 3.81Å; V88-Y244 HydrophobicContact CG2-CD1 4.03Å; V88-Y244 HydrophobicContact CG2-CE1 3.6Å |
| 89 | L | 79.8 | Confident | 77.9 | Confident | 3 Ų | 3 | 40.4 Ų | 40.4 | 2% | 0.016 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -62.8 | -33.2 | 174.8 | -69.6 | 174.2 | 0 | 0 | 0 | 112.8 | V85 T86 G93 L94 Y99 V174 M175 | V85-L89 HydrophobicContact CG2-CD1 3.9Å; V85-L89 HydrophobicContact CG2-CG 4.38Å; V85-L89 WeakPolarHBondContact O-CB 3.09Å; V85-L89 VanDerWaalsContact O-CG 3.24Å; V85-L89 WeakPolarHBondContact O-CG 3.46Å; V85-L89 PolarHBondContact O-N 3.27Å; T86-L89 PolarHBondContact O-N 2.87Å; L89-G93 PolarHBondContact O-N 3.15Å; L89-L94 HydrophobicContact CB-CD2 4.37Å; L89-L94 HydrophobicContact CD1-CD2 4.44Å; L89-L94 HydrophobicContact CD2-CD2 4.01Å; L89-L94 WeakPolarHBondContact O-CB 3.48Å; L89-L94 PolarHBondContact O-N 3.08Å; L89-Y99 HydrophobicContact CB-CE1 4.38Å; L89-V174 HydrophobicContact CD2-CG1 4.02Å; L89-M175 HydrophobicContact CD2-CG 4Å |
| 90 | L | 74.1 | Confident | 77.1 | Confident | 61 Ų | 61 | 44.6 Ų | 44.6 | 32% | 0.319 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -64.3 | -52 | 171 | -85.1 | 159.9 | 0 | 0 | 0 | 111.8 | T86 P87 V88 V92 G93 Y99 | T86-L90 HydrophobicContact CG2-CD1 3.92Å; T86-L90 WeakPolarHBondContact O-CB 3.31Å; T86-L90 WeakPolarHBondContact O-CD1 3.39Å; T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 2.71Å; P87-L90 WeakPolarHBondContact O-CB 3.41Å; P87-L90 PolarHBondContact O-N 2.96Å; V88-L90 VanDerWaalsContact C-N 3.28Å; V88-L90 PolarHBondContact O-N 3.2Å; L90-V92 VanDerWaalsContact C-N 3.29Å; L90-V92 PolarHBondContact O-N 2.91Å; L90-G93 WeakPolarHBondContact O-CA 3.47Å; L90-G93 PolarHBondContact O-N 2.89Å; L90-Y99 HydrophobicContact CD2-CE2 4.13Å; L90-Y99 WeakPolarHBondContact CD2-OH 3.35Å; L90-Y99 HydrophobicContact CG-CE2 4.13Å; L90-Y99 WeakPolarHBondContact CG-OH 3.18Å |
| 91 | S | 73.3 | Confident | 76.5 | Confident | 80 Ų | 80 | 49.2 Ų | 49.2 | 56% | 0.559 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -64.6 | -30.1 | -177 | 64.2 | 0 | 0 | 0 | 0 | 113.8 | P87 V88 G93 | P87-S91 WeakPolarHBondContact O-CB 3.34Å; P87-S91 PolarHBondContact O-N 2.72Å; P87-S91 PolarHBondContact O-OG 2.93Å; V88-S91 PolarHBondContact O-N 3.21Å; V88-S91 PolarHBondContact O-OG 2.85Å; S91-G93 VanDerWaalsContact C-N 3.25Å; S91-G93 PolarHBondContact O-N 2.72Å |
| 92 | V | 76.9 | Confident | 75.9 | Confident | 34 Ų | 34 | 49 Ų | 49 | 21% | 0.206 | 30% | 0.301 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | -7.3 | 175.3 | -179.3 | 0 | 0 | 0 | 0 | 112 | V88 L90 A170 I171 V174 | V88-V92 HydrophobicContact CG1-CG2 4.5Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.27Å; V88-V92 PolarHBondContact O-N 3.04Å; L90-V92 VanDerWaalsContact C-N 3.29Å; L90-V92 PolarHBondContact O-N 2.91Å; V92-A170 HydrophobicContact CG1-CB 4.04Å; V92-I171 HydrophobicContact CG1-CB 4.32Å; V92-I171 HydrophobicContact CG1-CG1 3.77Å; V92-I171 VanDerWaalsContact O-CG1 3.32Å; V92-I171 WeakPolarHBondContact O-CG1 3.48Å; V92-V174 HydrophobicContact CG2-CG2 4.25Å |
| 93 | G | 73 | Confident | 75.6 | Confident | 49 Ų | 49 | 52 Ų | 52 | 51% | 0.505 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 90.2 | 17.6 | 168.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | L89 L90 S91 | L89-G93 PolarHBondContact O-N 3.15Å; L90-G93 WeakPolarHBondContact O-CA 3.47Å; L90-G93 PolarHBondContact O-N 2.89Å; S91-G93 VanDerWaalsContact C-N 3.25Å; S91-G93 PolarHBondContact O-N 2.72Å |
| 94 | L | 73.5 | Confident | 75.6 | Confident | 7 Ų | 7 | 52.7 Ų | 52.7 | 4% | 0.037 | 30% | 0.303 | C | S | . | . | trans | -66.5 | 133.4 | 175.9 | 179 | 69 | 0 | 0 | 0 | 110.3 | L89 L98 Y99 V102 I171 M175 | L89-L94 HydrophobicContact CB-CD2 4.37Å; L89-L94 HydrophobicContact CD1-CD2 4.44Å; L89-L94 HydrophobicContact CD2-CD2 4.01Å; L89-L94 WeakPolarHBondContact O-CB 3.48Å; L89-L94 PolarHBondContact O-N 3.08Å; L94-L98 HydrophobicContact CD1-CB 4.08Å; L94-L98 HydrophobicContact CD1-CD1 3.91Å; L94-L98 HydrophobicContact CG-CB 4.34Å; L94-Y99 HydrophobicContact CB-CE1 3.92Å; L94-Y99 HydrophobicContact CD2-CD1 3.75Å; L94-Y99 HydrophobicContact CD2-CE1 3.9Å; L94-Y99 HydrophobicContact CG-CD1 4.06Å; L94-Y99 HydrophobicContact CG-CE1 3.81Å; L94-Y99 WeakPolarHBondContact O-CE1 3.47Å; L94-Y99 PolarHBondContact O-OH 2.78Å; L94-V102 HydrophobicContact CD2-CG2 4.17Å; L94-I171 HydrophobicContact CB-CG2 4.4Å; L94-I171 HydrophobicContact CD1-CG2 3.84Å; L94-M175 HydrophobicContact CD1-CE 3.9Å; L94-M175 HydrophobicContact CD1-SD 3.63Å; L94-M175 HydrophobicContact CD2-CE 3.94Å; L94-M175 HydrophobicContact CD2-CG 4.07Å; L94-M175 HydrophobicContact CD2-SD 3.97Å; L94-M175 HydrophobicContact CG-SD 4.43Å | ||
| 95 | P | 75.1 | Confident | 75.8 | Confident | 72 Ų | 72 | 54.8 Ų | 54.8 | 47% | 0.468 | 32% | 0.315 | S | S | . | . | trans | -64.2 | 139.7 | 178.1 | -26.6 | 36.4 | 0 | 0 | 0 | 114 | S97 L98 | P95-S97 PolarHBondContact O-N 2.71Å; P95-L98 PolarHBondContact O-N 2.94Å | ||
| 96 | R | 65.7 | Low | 75.9 | Confident | 126 Ų | 126 | 54.9 Ų | 54.9 | 48% | 0.475 | 32% | 0.315 | S | S | . | . | G | 310 helix | trans | -55.5 | -29.9 | -176 | -53.3 | -171.3 | -167.8 | -168 | 5.1 | 114.4 | L98 Y99 P395 | R96-L98 PolarHBondContact O-N 3.42Å; R96-Y99 HydrophobicContact CB-CD2 4.36Å; R96-Y99 HydrophobicContact CB-CE2 3.96Å; R96-Y99 HydrophobicContact CG-CE2 3.92Å; R96-Y99 PolarHBondContact O-N 3.19Å; R96-P395 PolarHBondContact NH1-O 3.09Å; R96-P395 VanDerWaalsContact NH1-O 3.15Å |
| 97 | S | 67.5 | Low | 76.3 | Confident | 96 Ų | 96 | 52.9 Ų | 52.9 | 67% | 0.671 | 30% | 0.303 | S | S | * | . | G | 310 helix | trans | -69.1 | -13.6 | 177.2 | 50.4 | 0 | 0 | 0 | 0 | 114.6 | P95 | P95-S97 PolarHBondContact O-N 2.71Š|
| 98 | L | 74.4 | Confident | 76.8 | Confident | 70 Ų | 70 | 53.5 Ų | 53.5 | 37% | 0.366 | 30% | 0.303 | S | S | . | . | G | 310 helix | trans | -99.6 | -9.9 | 178.6 | -62.8 | -179.7 | 0 | 0 | 0 | 113.4 | L94 P95 R96 L101 V102 | L94-L98 HydrophobicContact CD1-CB 4.08Å; L94-L98 HydrophobicContact CD1-CD1 3.91Å; L94-L98 HydrophobicContact CG-CB 4.34Å; P95-L98 PolarHBondContact O-N 2.94Å; R96-L98 PolarHBondContact O-N 3.42Å; L98-L101 HydrophobicContact CD2-CD2 4.37Å; L98-L101 WeakPolarHBondContact O-CB 3.28Å; L98-L101 PolarHBondContact O-N 2.88Å; L98-V102 PolarHBondContact O-N 2.88Å |
| 99 | Y | 72.6 | Confident | 77.1 | Confident | 33 Ų | 33 | 55.9 Ų | 55.9 | 13% | 0.129 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.4 | -51.9 | -178.4 | -59 | -16.2 | 0 | 0 | 0 | 111.4 | L89 L90 L94 R96 L101 V102 W103 | L89-Y99 HydrophobicContact CB-CE1 4.38Å; L90-Y99 HydrophobicContact CD2-CE2 4.13Å; L90-Y99 WeakPolarHBondContact CD2-OH 3.35Å; L90-Y99 HydrophobicContact CG-CE2 4.13Å; L90-Y99 WeakPolarHBondContact CG-OH 3.18Å; L94-Y99 HydrophobicContact CB-CE1 3.92Å; L94-Y99 HydrophobicContact CD2-CD1 3.75Å; L94-Y99 HydrophobicContact CD2-CE1 3.9Å; L94-Y99 HydrophobicContact CG-CD1 4.06Å; L94-Y99 HydrophobicContact CG-CE1 3.81Å; L94-Y99 WeakPolarHBondContact O-CE1 3.47Å; L94-Y99 PolarHBondContact O-OH 2.78Å; R96-Y99 HydrophobicContact CB-CD2 4.36Å; R96-Y99 HydrophobicContact CB-CE2 3.96Å; R96-Y99 HydrophobicContact CG-CE2 3.92Å; R96-Y99 PolarHBondContact O-N 3.19Å; Y99-L101 PolarHBondContact O-N 3.16Å; Y99-L101 VanDerWaalsContact O-N 3.09Å; Y99-V102 WeakPolarHBondContact O-CB 3.37Å; Y99-V102 PolarHBondContact O-N 2.91Å; Y99-W103 VanDerWaalsContact O-CD1 3.29Å; Y99-W103 PolarHBondContact O-N 2.93Å |
| 100 | S | 72.1 | Confident | 77.2 | Confident | 89 Ų | 89 | 55.8 Ų | 55.8 | 62% | 0.622 | 31% | 0.314 | S | S | * | . | H | α-helix | trans | -60.1 | -21.5 | 178.1 | 51.1 | 0 | 0 | 0 | 0 | 113.8 | L104 | S100-L104 WeakPolarHBondContact O-CB 3.26Å; S100-L104 PolarHBondContact O-N 3.07Å |
| 101 | L | 76.3 | Confident | 77.6 | Confident | 97 Ų | 97 | 54.8 Ų | 54.8 | 51% | 0.508 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -74.9 | -42.5 | 171.5 | -175.9 | 63.6 | 0 | 0 | 0 | 111.7 | L98 Y99 L104 I105 | L98-L101 HydrophobicContact CD2-CD2 4.37Å; L98-L101 WeakPolarHBondContact O-CB 3.28Å; L98-L101 PolarHBondContact O-N 2.88Å; Y99-L101 PolarHBondContact O-N 3.16Å; Y99-L101 VanDerWaalsContact O-N 3.09Å; L101-L104 PolarHBondContact O-N 3.41Å; L101-I105 WeakPolarHBondContact O-CG1 3.27Å; L101-I105 PolarHBondContact O-N 3.36Å; L101-I105 VanDerWaalsContact O-N 3.13Å |
| 102 | V | 77.8 | Confident | 78 | Confident | 3 Ų | 3 | 54.8 Ų | 54.8 | 2% | 0.018 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -58 | -54 | 176.1 | -179.7 | 0 | 0 | 0 | 0 | 110.5 | L94 L98 Y99 L104 I105 M175 V178 V179 | L94-V102 HydrophobicContact CD2-CG2 4.17Å; L98-V102 PolarHBondContact O-N 2.88Å; Y99-V102 WeakPolarHBondContact O-CB 3.37Å; Y99-V102 PolarHBondContact O-N 2.91Å; V102-L104 PolarHBondContact O-N 3.19Å; V102-I105 PolarHBondContact O-N 2.89Å; V102-M175 HydrophobicContact CG2-CE 3.44Å; V102-M175 VanDerWaalsContact CG2-CE 3.44Å; V102-V178 HydrophobicContact CG1-CG1 4.22Å; V102-V179 HydrophobicContact CG1-CG2 4.08Å |
| 103 | W | 76.4 | Confident | 78.2 | Confident | 102 Ų | 102 | 56.3 Ų | 56.3 | 39% | 0.386 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.8 | -16.9 | 179.4 | -74.6 | 86.2 | 0 | 0 | 0 | 114 | V85 Y99 P107 | V85-W103 HydrophobicContact CG1-CH2 3.91Å; V85-W103 HydrophobicContact CG1-CZ2 3.38Å; Y99-W103 VanDerWaalsContact O-CD1 3.29Å; Y99-W103 PolarHBondContact O-N 2.93Å; W103-P107 WeakPolarHBondContact O-CD 3.36Å |
| 104 | L | 81.1 | Confident | 78.4 | Confident | 43 Ų | 43 | 54.2 Ų | 54.2 | 23% | 0.225 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -95.5 | -22.2 | 177 | -170.2 | 63.8 | 0 | 0 | 0 | 113.2 | S100 L101 V102 I108 I529 | S100-L104 WeakPolarHBondContact O-CB 3.26Å; S100-L104 PolarHBondContact O-N 3.07Å; L101-L104 PolarHBondContact O-N 3.41Å; V102-L104 PolarHBondContact O-N 3.19Å; L104-I108 HydrophobicContact CD1-CD1 4.44Å; L104-I108 HydrophobicContact CD2-CD1 4.33Å; L104-I108 HydrophobicContact CG-CD1 3.85Å; L104-I108 HydrophobicContact CG-CG1 4.44Å; L104-I108 WeakPolarHBondContact O-CD1 3.48Å; L104-I108 VanDerWaalsContact O-CG1 3.27Å; L104-I108 WeakPolarHBondContact O-CG1 3.45Å; L104-I108 PolarHBondContact O-N 2.88Å; L104-I529 HydrophobicContact CD1-CG1 4.4Å; L104-I529 HydrophobicContact CD1-CG2 4.49Å |
| 105 | I | 85.9 | Confident | 78.2 | Confident | 65 Ų | 65 | 54 Ų | 54 | 33% | 0.333 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -62.3 | -47.1 | 177.8 | -73.3 | 164.1 | 0 | 0 | 0 | 110.4 | L101 V102 I108 L109 V179 | L101-I105 WeakPolarHBondContact O-CG1 3.27Å; L101-I105 PolarHBondContact O-N 3.36Å; L101-I105 VanDerWaalsContact O-N 3.13Å; V102-I105 PolarHBondContact O-N 2.89Å; I105-I108 PolarHBondContact O-N 2.93Å; I105-L109 HydrophobicContact CG2-CD1 3.7Å; I105-L109 HydrophobicContact CG2-CG 4.13Å; I105-L109 WeakPolarHBondContact O-CG 3.38Å; I105-L109 PolarHBondContact O-N 2.67Å; I105-V179 HydrophobicContact CB-CG2 4.4Å; I105-V179 HydrophobicContact CG2-CG1 3.66Å; I105-V179 HydrophobicContact CG2-CG2 4.14Å |
| 106 | S | 85.7 | Confident | 78.2 | Confident | 4 Ų | 4 | 53.4 Ų | 53.4 | 3% | 0.028 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.8 | -45.8 | -172.6 | -41.3 | 0 | 0 | 0 | 0 | 113.3 | I108 L109 G110 D182 | S106-I108 VanDerWaalsContact C-N 3.32Å; S106-I108 PolarHBondContact O-N 2.67Å; S106-L109 PolarHBondContact O-N 3.22Å; S106-G110 PolarHBondContact O-N 2.91Å; S106-D182 VanDerWaalsContact CB-OD2 3.27Å; S106-D182 WeakPolarHBondContact CB-OD2 3.43Å; S106-D182 WeakPolarHBondContact OG-CB 3.34Å; S106-D182 PolarHBondContact OG-OD2 3.37Å |
| 107 | P | 85 | Confident | 78.6 | Confident | 13 Ų | 13 | 49.1 Ų | 49.1 | 8% | 0.084 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -59.7 | -35.6 | 170.4 | -27.9 | 37.4 | 0 | 0 | 0 | 114.4 | W103 G110 F111 Q528 I529 | W103-P107 WeakPolarHBondContact O-CD 3.36Å; P107-G110 WeakPolarHBondContact O-CA 3.22Å; P107-G110 PolarHBondContact O-N 3.48Å; P107-F111 PolarHBondContact O-N 2.92Å; P107-Q528 HydrophobicContact CB-CB 3.84Å; P107-Q528 HydrophobicContact CG-CB 3.9Å; P107-Q528 HydrophobicContact CG-CG 4.48Å; P107-I529 HydrophobicContact CB-CD1 4.49Å; P107-I529 HydrophobicContact CB-CG1 3.83Å |
| 108 | I | 86.8 | Confident | 78.5 | Confident | 69 Ų | 69 | 45.1 Ų | 45.1 | 35% | 0.354 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -67.9 | -45.2 | 176.6 | -71.5 | 173.9 | 0 | 0 | 0 | 111 | L104 I105 S106 G110 F111 L112 I529 | L104-I108 HydrophobicContact CD1-CD1 4.44Å; L104-I108 HydrophobicContact CD2-CD1 4.33Å; L104-I108 HydrophobicContact CG-CD1 3.85Å; L104-I108 HydrophobicContact CG-CG1 4.44Å; L104-I108 WeakPolarHBondContact O-CD1 3.48Å; L104-I108 VanDerWaalsContact O-CG1 3.27Å; L104-I108 WeakPolarHBondContact O-CG1 3.45Å; L104-I108 PolarHBondContact O-N 2.88Å; I105-I108 PolarHBondContact O-N 2.93Å; S106-I108 VanDerWaalsContact C-N 3.32Å; S106-I108 PolarHBondContact O-N 2.67Å; I108-G110 VanDerWaalsContact C-N 3.28Å; I108-G110 PolarHBondContact O-N 3.49Å; I108-F111 PolarHBondContact O-N 2.73Å; I108-L112 HydrophobicContact CG2-CD1 3.92Å; I108-L112 WeakPolarHBondContact O-CB 3.5Å; I108-L112 VanDerWaalsContact O-CG 3.3Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.46Å; I108-L112 VanDerWaalsContact O-N 3.17Å; I108-I529 HydrophobicContact CG1-CD1 3.97Å; I108-I529 HydrophobicContact CG1-CG1 4.05Å |
| 109 | L | 85.9 | Confident | 78.2 | Confident | 58 Ų | 58 | 42.2 Ų | 42.2 | 30% | 0.304 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -61.1 | -40.8 | 173.5 | -68.9 | 176.3 | 0 | 0 | 0 | 110.9 | I105 S106 L113 V179 F183 | I105-L109 HydrophobicContact CG2-CD1 3.7Å; I105-L109 HydrophobicContact CG2-CG 4.13Å; I105-L109 WeakPolarHBondContact O-CG 3.38Å; I105-L109 PolarHBondContact O-N 2.67Å; S106-L109 PolarHBondContact O-N 3.22Å; L109-L113 HydrophobicContact CB-CD1 4.47Å; L109-L113 HydrophobicContact CD2-CD1 4.26Å; L109-L113 VanDerWaalsContact O-CB 3.28Å; L109-L113 WeakPolarHBondContact O-CB 3.42Å; L109-L113 WeakPolarHBondContact O-CG 3.33Å; L109-L113 PolarHBondContact O-N 2.93Å; L109-V179 HydrophobicContact CD1-CG1 3.79Å; L109-F183 HydrophobicContact CB-CD2 3.92Å; L109-F183 HydrophobicContact CB-CE2 4.26Å |
| 110 | G | 81.4 | Confident | 78 | Confident | 0 Ų | 0 | 42.2 Ų | 42.2 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -40.2 | -76.3 | 163.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S106 P107 I108 L112 L113 Q114 F187 Q525 | S106-G110 PolarHBondContact O-N 2.91Å; P107-G110 WeakPolarHBondContact O-CA 3.22Å; P107-G110 PolarHBondContact O-N 3.48Å; I108-G110 VanDerWaalsContact C-N 3.28Å; I108-G110 PolarHBondContact O-N 3.49Å; G110-L112 PolarHBondContact O-N 3.48Å; G110-L113 PolarHBondContact O-N 3.32Å; G110-L113 VanDerWaalsContact O-N 3.16Å; G110-Q114 WeakPolarHBondContact O-CB 3.35Å; G110-Q114 PolarHBondContact O-N 3.45Å; G110-F187 VanDerWaalsContact CA-CE2 3.46Å; G110-Q525 PolarHBondContact O-OE1 3.31Å |
| 111 | F | 82.5 | Confident | 77.9 | Confident | 41 Ų | 41 | 38.1 Ų | 38.1 | 18% | 0.18 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -55.5 | -30.7 | -173.4 | -175.7 | -111.9 | 0 | 0 | 0 | 113.7 | P107 I108 F346 C522 Q525 L526 I529 | P107-F111 PolarHBondContact O-N 2.92Å; I108-F111 PolarHBondContact O-N 2.73Å; F111-F346 HydrophobicContact CD1-CE2 4.03Å; F111-F346 AromaticContact CE1-CE2 3.53Å; F111-F346 HydrophobicContact CE1-CE2 3.53Å; F111-F346 AromaticContact CE1-CZ 3.77Å; F111-F346 HydrophobicContact CE1-CZ 3.77Å; F111-F346 HydrophobicContact CZ-CE2 4.02Å; F111-F346 HydrophobicContact CZ-CZ 4.29Å; F111-C522 HydrophobicContact CD2-CB 4.4Å; F111-Q525 HydrophobicContact CB-CB 4.21Å; F111-L526 HydrophobicContact CD2-CB 4.19Å; F111-L526 HydrophobicContact CE2-CB 4.03Å; F111-L526 HydrophobicContact CE2-CD1 4.19Å; F111-L526 HydrophobicContact CE2-CD2 4.32Å; F111-L526 HydrophobicContact CE2-CG 4.41Å; F111-L526 HydrophobicContact CZ-CD1 4.18Å; F111-I529 HydrophobicContact CB-CD1 3.9Å; F111-I529 HydrophobicContact CG-CD1 4.3Å |
| 112 | L | 82.3 | Confident | 77.4 | Confident | 79 Ų | 79 | 34.6 Ų | 34.6 | 41% | 0.414 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -82.9 | -41.1 | 179.3 | -67.5 | 174.6 | 0 | 0 | 0 | 113.9 | I108 G110 F346 | I108-L112 HydrophobicContact CG2-CD1 3.92Å; I108-L112 WeakPolarHBondContact O-CB 3.5Å; I108-L112 VanDerWaalsContact O-CG 3.3Å; I108-L112 WeakPolarHBondContact O-CG 3.36Å; I108-L112 PolarHBondContact O-N 3.46Å; I108-L112 VanDerWaalsContact O-N 3.17Å; G110-L112 PolarHBondContact O-N 3.48Å; L112-F346 HydrophobicContact CD2-CD2 4.15Å; L112-F346 HydrophobicContact CD2-CE2 4.27Å |
| 113 | L | 80.8 | Confident | 76.7 | Confident | 66 Ų | 66 | 42.5 Ų | 42.5 | 35% | 0.346 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -101.6 | -23.1 | -169.3 | -61.6 | 168.8 | 0 | 0 | 0 | 113.4 | L109 G110 P115 V116 I117 F183 F187 | L109-L113 HydrophobicContact CB-CD1 4.47Å; L109-L113 HydrophobicContact CD2-CD1 4.26Å; L109-L113 VanDerWaalsContact O-CB 3.28Å; L109-L113 WeakPolarHBondContact O-CB 3.42Å; L109-L113 WeakPolarHBondContact O-CG 3.33Å; L109-L113 PolarHBondContact O-N 2.93Å; G110-L113 PolarHBondContact O-N 3.32Å; G110-L113 VanDerWaalsContact O-N 3.16Å; L113-P115 VanDerWaalsContact C-CD 3.42Å; L113-V116 WeakPolarHBondContact O-CA 3.39Å; L113-V116 WeakPolarHBondContact O-CB 3.27Å; L113-V116 PolarHBondContact O-N 3.34Å; L113-I117 PolarHBondContact O-N 3.28Å; L113-F183 HydrophobicContact CB-CE2 4.15Å; L113-F183 HydrophobicContact CB-CZ 4.5Å; L113-F183 HydrophobicContact CD1-CE2 3.6Å; L113-F183 HydrophobicContact CD1-CZ 3.85Å; L113-F187 VanDerWaalsContact C-CE1 3.44Å; L113-F187 HydrophobicContact CB-CE1 3.75Å; L113-F187 HydrophobicContact CB-CZ 3.77Å |
| 114 | Q | 77.4 | Confident | 76.2 | Confident | 6 Ų | 6 | 38.6 Ų | 38.6 | 3% | 0.028 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59 | -36.6 | -178.7 | -173.9 | 142.8 | 0.2 | 0 | 0 | 114 | G110 V116 G118 F187 T521 | G110-Q114 WeakPolarHBondContact O-CB 3.35Å; G110-Q114 PolarHBondContact O-N 3.45Å; Q114-V116 VanDerWaalsContact C-N 3.3Å; Q114-V116 PolarHBondContact O-N 2.88Å; Q114-G118 PolarHBondContact O-N 3.13Å; Q114-F187 VanDerWaalsContact CA-CE1 3.41Å; Q114-F187 HydrophobicContact CB-CD1 4.49Å; Q114-F187 HydrophobicContact CB-CE1 3.87Å; Q114-F187 HydrophobicContact CB-CZ 3.95Å; Q114-T521 VanDerWaalsContact NE2-CG2 3.26Å |
| 115 | P | 70.3 | Confident | 75.1 | Confident | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.019 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.7 | -35 | 171 | -20.8 | 32.9 | 0 | 0 | 0 | 113.1 | L113 S119 L349 | L113-P115 VanDerWaalsContact C-CD 3.42Å; P115-S119 WeakPolarHBondContact O-CB 3.42Å; P115-S119 PolarHBondContact O-N 2.9Å; P115-S119 VanDerWaalsContact O-N 3.15Å; P115-S119 PolarHBondContact O-OG 3.36Å; P115-L349 HydrophobicContact CB-CB 4.1Å; P115-L349 HydrophobicContact CB-CD1 4.04Å; P115-L349 HydrophobicContact CB-CG 4.41Å; P115-L349 HydrophobicContact CG-CB 4.09Å; P115-L349 HydrophobicContact CG-CD1 3.89Å; P115-L349 HydrophobicContact CG-CD2 3.65Å; P115-L349 HydrophobicContact CG-CG 4.04Å |
| 116 | V | 74.3 | Confident | 74.2 | Confident | 59 Ų | 59 | 44.6 Ų | 44.6 | 36% | 0.358 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -72.2 | -49.4 | -178.4 | -172.7 | 0 | 0 | 0 | 0 | 109.6 | L113 Q114 S119 A120 | L113-V116 WeakPolarHBondContact O-CA 3.39Å; L113-V116 WeakPolarHBondContact O-CB 3.27Å; L113-V116 PolarHBondContact O-N 3.34Å; Q114-V116 VanDerWaalsContact C-N 3.3Å; Q114-V116 PolarHBondContact O-N 2.88Å; V116-S119 PolarHBondContact O-OG 2.97Å; V116-S119 VanDerWaalsContact O-OG 3.09Å; V116-A120 WeakPolarHBondContact O-CB 3.31Å; V116-A120 PolarHBondContact O-N 3.16Å |
| 117 | I | 73.2 | Confident | 73 | Confident | 36 Ų | 36 | 50.4 Ų | 50.4 | 19% | 0.185 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -71.4 | -38.7 | -179 | -72.2 | 172.9 | 0 | 0 | 0 | 111.5 | L113 A120 S121 Y134 F183 F187 | L113-I117 PolarHBondContact O-N 3.28Å; I117-A120 PolarHBondContact O-N 3.26Å; I117-S121 PolarHBondContact O-N 2.72Å; I117-Y134 HydrophobicContact CG2-CD1 4.37Å; I117-F183 HydrophobicContact CD1-CZ 3.97Å; I117-F187 HydrophobicContact CB-CD1 4.04Å; I117-F187 HydrophobicContact CB-CE1 4.31Å; I117-F187 HydrophobicContact CD1-CD1 3.59Å; I117-F187 HydrophobicContact CD1-CE1 3.72Å; I117-F187 HydrophobicContact CG1-CD1 4.35Å; I117-F187 HydrophobicContact CG1-CE1 4.42Å; I117-F187 HydrophobicContact CG2-CD1 4.16Å |
| 118 | G | 67.3 | Low | 71.9 | Confident | 11 Ų | 11 | 56.6 Ų | 56.6 | 11% | 0.113 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -55.1 | -56 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q114 A120 S121 D122 | Q114-G118 PolarHBondContact O-N 3.13Å; G118-A120 PolarHBondContact O-N 2.77Å; G118-S121 WeakPolarHBondContact O-CB 3.4Å; G118-S121 PolarHBondContact O-N 2.73Å; G118-S121 PolarHBondContact O-OG 3.48Å; G118-D122 PolarHBondContact O-N 2.71Å |
| 119 | S | 67.1 | Low | 70.9 | Confident | 10 Ų | 10 | 53.3 Ų | 53.3 | 7% | 0.07 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -65.4 | -34.9 | 178.2 | 64.9 | 0 | 0 | 0 | 0 | 113.7 | P115 V116 S121 D122 Y123 | P115-S119 WeakPolarHBondContact O-CB 3.42Å; P115-S119 PolarHBondContact O-N 2.9Å; P115-S119 VanDerWaalsContact O-N 3.15Å; P115-S119 PolarHBondContact O-OG 3.36Å; V116-S119 PolarHBondContact O-OG 2.97Å; V116-S119 VanDerWaalsContact O-OG 3.09Å; S119-S121 VanDerWaalsContact C-N 3.29Å; S119-S121 PolarHBondContact O-N 3.22Å; S119-D122 PolarHBondContact O-N 3.45Å; S119-Y123 WeakPolarHBondContact O-CD2 3.42Å |
| 120 | A | 69.4 | Low | 70.3 | Confident | 33 Ų | 33 | 53.2 Ų | 53.2 | 27% | 0.273 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -65.9 | -31.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | V116 I117 G118 Y123 Y134 | V116-A120 WeakPolarHBondContact O-CB 3.31Å; V116-A120 PolarHBondContact O-N 3.16Å; I117-A120 PolarHBondContact O-N 3.26Å; G118-A120 PolarHBondContact O-N 2.77Å; A120-Y123 PolarHBondContact O-N 2.79Å; A120-Y134 VanDerWaalsContact C-OH 3.31Å; A120-Y134 HydrophobicContact CB-CE1 4.19Å; A120-Y134 WeakPolarHBondContact CB-OH 3.31Å; A120-Y134 PolarHBondContact O-OH 3.4Å |
| 121 | S | 69.3 | Low | 70.2 | Confident | 2 Ų | 2 | 53.3 Ų | 53.3 | 1% | 0.014 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66.9 | -37.4 | 172.5 | 83.9 | 0 | 0 | 0 | 0 | 112.5 | I117 G118 S119 Y123 C124 R130 R131 | I117-S121 PolarHBondContact O-N 2.72Å; G118-S121 WeakPolarHBondContact O-CB 3.4Å; G118-S121 PolarHBondContact O-N 2.73Å; G118-S121 PolarHBondContact O-OG 3.48Å; S119-S121 VanDerWaalsContact C-N 3.29Å; S119-S121 PolarHBondContact O-N 3.22Å; S121-Y123 PolarHBondContact O-N 2.95Å; S121-C124 PolarHBondContact O-N 3.46Å; S121-R130 WeakPolarHBondContact O-CG 3.27Å; S121-R131 PolarHBondContact OG-NH1 3.14Å; S121-R131 VanDerWaalsContact OG-NH1 3.08Å |
| 122 | D | 64.9 | Low | 70.2 | Confident | 23 Ų | 23 | 52.5 Ų | 52.5 | 12% | 0.123 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -66.8 | -17.6 | 179.3 | -72.1 | -36.1 | 0 | 0 | 0 | 113.9 | G118 S119 R130 R131 | G118-D122 PolarHBondContact O-N 2.71Å; S119-D122 PolarHBondContact O-N 3.45Å; D122-R130 WeakPolarHBondContact O-CD 3.48Å; D122-R131 IonicContact OD1-CZ 3.81Å; D122-R131 IonicContact OD1-NH1 2.72Å; D122-R131 PolarHBondContact OD1-NH1 2.98Å; D122-R131 IonicContact OD1-NH2 2.81Å; D122-R131 PolarHBondContact OD1-NH2 2.93Å |
| 123 | Y | 63.8 | Low | 70.3 | Confident | 170 Ų | 170 | 50 Ų | 50 | 67% | 0.667 | 25% | 0.246 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -111.6 | 9.8 | -179.1 | -61.8 | -60.8 | 0 | 0 | 0 | 114.8 | S119 A120 S121 | S119-Y123 WeakPolarHBondContact O-CD2 3.42Å; A120-Y123 PolarHBondContact O-N 2.79Å; S121-Y123 PolarHBondContact O-N 2.95Å |
| 124 | C | 64.9 | Low | 70.5 | Confident | 20 Ų | 20 | 49.9 Ų | 49.9 | 14% | 0.135 | 24% | 0.241 | C | C | . | . | trans | -64.7 | 139.4 | 178.7 | -163.8 | 0 | 0 | 0 | 0 | 112.5 | S121 R130 Y134 | S121-C124 PolarHBondContact O-N 3.46Å; C124-R130 HydrophobicContact CB-CG 4.17Å; C124-R130 WeakPolarHBondContact CB-O 3.18Å; C124-Y134 HydrophobicContact CB-CD2 4.38Å; C124-Y134 HydrophobicContact CB-CE2 3.84Å | ||
| 125 | R | 59.5 | Low | 71 | Confident | 199 Ų | 199 | 49.6 Ų | 49.6 | 75% | 0.751 | 24% | 0.24 | S | C | * | . | trans | -122.6 | 32.1 | 178.4 | -65.5 | -173.9 | 172.7 | -171.8 | -4.3 | 112.9 | ||||
| 126 | S | 66.9 | Low | 72 | Confident | 35 Ų | 35 | 51.6 Ų | 51.6 | 25% | 0.245 | 25% | 0.25 | C | S | . | . | trans | -69.7 | 142.3 | 176.4 | -179.7 | 0 | 0 | 0 | 0 | 111.1 | W128 G129 | S126-W128 PolarHBondContact O-N 2.83Å; S126-W128 VanDerWaalsContact O-N 3.11Å; S126-W128 PolarHBondContact OG-N 3.15Å; S126-G129 PolarHBondContact O-N 3.31Å | ||
| 127 | P | 60.4 | Low | 72.8 | Confident | 126 Ų | 126 | 53.3 Ų | 53.3 | 82% | 0.818 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -12.9 | 171.3 | 28.6 | -36.7 | 0 | 0 | 0 | 113 | ||
| 128 | W | 61.3 | Low | 73.7 | Confident | 143 Ų | 143 | 52 Ų | 52 | 54% | 0.542 | 25% | 0.254 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.4 | 8.6 | -179.8 | -128.6 | 31.6 | 0 | 0 | 0 | 114 | S126 R132 L136 | S126-W128 PolarHBondContact O-N 2.83Å; S126-W128 VanDerWaalsContact O-N 3.11Å; S126-W128 PolarHBondContact OG-N 3.15Å; W128-R132 WeakPolarHBondContact O-CB 3.28Å; W128-R132 WeakPolarHBondContact O-CD 3.2Å; W128-L136 HydrophobicContact CH2-CD2 4.13Å; W128-L136 HydrophobicContact CZ3-CD2 3.62Å |
| 129 | G | 66.8 | Low | 75 | Confident | 0 Ų | 0 | 51.4 Ų | 51.4 | 0% | 0 | 25% | 0.248 | C | C | . | . | trans | 108.5 | 166.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | S126 P133 E268 | S126-G129 PolarHBondContact O-N 3.31Å; G129-P133 WeakPolarHBondContact O-CD 3.31Å; G129-E268 WeakPolarHBondContact CA-OE2 3.28Å | ||
| 130 | R | 72.8 | Confident | 76.3 | Confident | 55 Ų | 55 | 54.7 Ų | 54.7 | 21% | 0.208 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -76.8 | -49.5 | -179.1 | 173.4 | 171.8 | 71.4 | 165.8 | -0.5 | 111.1 | S121 D122 C124 D198 E268 | S121-R130 WeakPolarHBondContact O-CG 3.27Å; D122-R130 WeakPolarHBondContact O-CD 3.48Å; C124-R130 HydrophobicContact CB-CG 4.17Å; C124-R130 WeakPolarHBondContact CB-O 3.18Å; R130-D198 IonicContact CZ-OD2 3.64Å; R130-D198 IonicContact NE-OD2 3.8Å; R130-D198 IonicContact NH2-OD1 2.71Å; R130-D198 PolarHBondContact NH2-OD1 3.49Å; R130-D198 IonicContact NH2-OD2 2.73Å; R130-D198 PolarHBondContact NH2-OD2 3.33Å; R130-E268 WeakPolarHBondContact CA-OE1 3.34Å; R130-E268 VanDerWaalsContact CB-OE1 3.27Å; R130-E268 WeakPolarHBondContact CB-OE1 3.4Å; R130-E268 PolarHBondContact N-OE1 3.27Å; R130-E268 PolarHBondContact N-OE2 3.17Å |
| 131 | R | 78.2 | Confident | 77.5 | Confident | 2 Ų | 2 | 54.7 Ų | 54.7 | 1% | 0.008 | 26% | 0.259 | C | S | . | . | S | Bend | trans | -97 | -32.7 | -173.9 | -67.3 | -166.7 | -160.4 | -69.4 | -5.6 | 114.2 | S121 D122 Y134 I135 A194 Y195 D198 E268 | S121-R131 PolarHBondContact OG-NH1 3.14Å; S121-R131 VanDerWaalsContact OG-NH1 3.08Å; D122-R131 IonicContact OD1-CZ 3.81Å; D122-R131 IonicContact OD1-NH1 2.72Å; D122-R131 PolarHBondContact OD1-NH1 2.98Å; D122-R131 IonicContact OD1-NH2 2.81Å; D122-R131 PolarHBondContact OD1-NH2 2.93Å; R131-Y134 PolarHBondContact O-N 3.14Å; R131-Y134 VanDerWaalsContact O-N 3.08Å; R131-I135 HydrophobicContact CB-CD1 4.49Å; R131-I135 PolarHBondContact O-N 3.33Å; R131-A194 VanDerWaalsContact CZ-CB 3.5Å; R131-Y195 HydrophobicContact CB-CD2 3.82Å; R131-D198 IonicContact CZ-OD2 3.68Å; R131-D198 IonicContact NE-OD2 2.67Å; R131-D198 PolarHBondContact NE-OD2 3.42Å; R131-D198 IonicContact NH2-OD1 3.67Å; R131-D198 PolarHBondContact NH2-OD1 3.46Å; R131-D198 IonicContact NH2-OD2 3.48Å; R131-D198 PolarHBondContact NH2-OD2 3.38Å; R131-E268 PolarHBondContact N-OE1 3Å; R131-E268 PolarHBondContact N-OE2 2.91Å |
| 132 | R | 83 | Confident | 78.7 | Confident | 24 Ų | 24 | 54.6 Ų | 54.6 | 9% | 0.091 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -45.8 | -44.4 | 178.9 | -79.9 | 154.9 | 163.4 | -88.3 | -16.9 | 115.7 | W128 Y134 I135 L136 Y195 L263 I266 E268 | W128-R132 WeakPolarHBondContact O-CB 3.28Å; W128-R132 WeakPolarHBondContact O-CD 3.2Å; R132-Y134 PolarHBondContact O-N 3.33Å; R132-I135 PolarHBondContact O-N 3.17Å; R132-L136 PolarHBondContact O-N 3.31Å; R132-Y195 HydrophobicContact CG-CE2 4Å; R132-Y195 PolarHBondContact NE-OH 3.25Å; R132-L263 HydrophobicContact CB-CD2 4.38Å; R132-L263 HydrophobicContact CG-CD2 4.39Å; R132-L263 PolarHBondContact NH1-O 3.35Å; R132-L263 PolarHBondContact NH2-O 3Å; R132-I266 PolarHBondContact NE-O 3.42Å; R132-I266 PolarHBondContact NH2-O 3.09Å; R132-E268 VanDerWaalsContact CD-OE2 3.27Å; R132-E268 WeakPolarHBondContact CD-OE2 3.46Å; R132-E268 WeakPolarHBondContact CG-OE2 3.33Å; R132-E268 PolarHBondContact N-OE2 3.24Å; R132-E268 VanDerWaalsContact N-OE2 3.13Å |
| 133 | P | 84.4 | Confident | 80.1 | Confident | 26 Ų | 26 | 55.9 Ų | 55.9 | 17% | 0.169 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.9 | -37.3 | -179 | -20.2 | 32.4 | 0 | 0 | 0 | 113.1 | G129 L136 V137 | G129-P133 WeakPolarHBondContact O-CD 3.31Å; P133-L136 PolarHBondContact O-N 2.86Å; P133-V137 VanDerWaalsContact O-CG2 3.31Å; P133-V137 WeakPolarHBondContact O-CG2 2.91Å; P133-V137 PolarHBondContact O-N 3.2Å |
| 134 | Y | 85.3 | Confident | 81.6 | Confident | 65 Ų | 65 | 51.7 Ų | 51.7 | 26% | 0.255 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -68 | -41.5 | 177.1 | -78.3 | -90.9 | 0 | 0 | 0 | 111.2 | I117 A120 C124 R131 R132 L136 V137 L138 | I117-Y134 HydrophobicContact CG2-CD1 4.37Å; A120-Y134 VanDerWaalsContact C-OH 3.31Å; A120-Y134 HydrophobicContact CB-CE1 4.19Å; A120-Y134 WeakPolarHBondContact CB-OH 3.31Å; A120-Y134 PolarHBondContact O-OH 3.4Å; C124-Y134 HydrophobicContact CB-CD2 4.38Å; C124-Y134 HydrophobicContact CB-CE2 3.84Å; R131-Y134 PolarHBondContact O-N 3.14Å; R131-Y134 VanDerWaalsContact O-N 3.08Å; R132-Y134 PolarHBondContact O-N 3.33Å; Y134-L136 PolarHBondContact O-N 3.44Å; Y134-V137 PolarHBondContact O-N 3.33Å; Y134-L138 WeakPolarHBondContact O-CB 3.47Å; Y134-L138 VanDerWaalsContact O-CG 3.27Å; Y134-L138 WeakPolarHBondContact O-CG 2.94Å; Y134-L138 PolarHBondContact O-N 3.37Å |
| 135 | I | 88.2 | Confident | 83 | Confident | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -63.2 | -41.1 | 176.8 | -62.2 | 173.4 | 0 | 0 | 0 | 110.6 | R131 R132 G139 I188 P191 I192 Y195 L259 | R131-I135 HydrophobicContact CB-CD1 4.49Å; R131-I135 PolarHBondContact O-N 3.33Å; R132-I135 PolarHBondContact O-N 3.17Å; I135-G139 PolarHBondContact O-N 3.37Å; I135-I188 HydrophobicContact CG2-CD1 4.01Å; I135-I188 HydrophobicContact CG2-CG1 4.15Å; I135-I188 WeakPolarHBondContact O-CD1 3.25Å; I135-P191 HydrophobicContact CD1-CB 4.27Å; I135-P191 HydrophobicContact CG1-CB 3.84Å; I135-I192 HydrophobicContact CD1-CG1 4.12Å; I135-I192 HydrophobicContact CG1-CG1 4.45Å; I135-I192 HydrophobicContact CG2-CG1 4.43Å; I135-Y195 HydrophobicContact CD1-CD2 4.3Å; I135-L259 HydrophobicContact CG2-CD1 4.13Å |
| 136 | L | 91.3 | Very high | 84.5 | Confident | 45 Ų | 45 | 41.5 Ų | 41.5 | 24% | 0.236 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.4 | -46.7 | 173.2 | 178.8 | 64.3 | 0 | 0 | 0 | 112.3 | W128 R132 P133 Y134 L138 G139 I140 L259 L263 | W128-L136 HydrophobicContact CH2-CD2 4.13Å; W128-L136 HydrophobicContact CZ3-CD2 3.62Å; R132-L136 PolarHBondContact O-N 3.31Å; P133-L136 PolarHBondContact O-N 2.86Å; Y134-L136 PolarHBondContact O-N 3.44Å; L136-L138 PolarHBondContact O-N 3.08Å; L136-G139 PolarHBondContact O-N 3.35Å; L136-G139 VanDerWaalsContact O-N 3.15Å; L136-I140 HydrophobicContact CD1-CD1 3.76Å; L136-I140 HydrophobicContact CD1-CG1 3.84Å; L136-I140 HydrophobicContact CD2-CD1 4.16Å; L136-I140 HydrophobicContact CG-CD1 3.71Å; L136-I140 HydrophobicContact CG-CG1 4.19Å; L136-I140 WeakPolarHBondContact O-CG1 3.3Å; L136-I140 PolarHBondContact O-N 3.44Å; L136-L259 HydrophobicContact CD1-CD2 4.35Å; L136-L263 HydrophobicContact CB-CD1 4.17Å; L136-L263 HydrophobicContact CB-CD2 4.45Å; L136-L263 HydrophobicContact CD1-CD1 3.78Å; L136-L263 HydrophobicContact CG-CD1 4.47Å |
| 137 | V | 91.7 | Very high | 85.7 | Confident | 94 Ų | 94 | 41.4 Ų | 41.4 | 57% | 0.57 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -60.9 | -45.1 | -178.4 | 167.4 | 0 | 0 | 0 | 0 | 111 | P133 Y134 I140 M141 | P133-V137 VanDerWaalsContact O-CG2 3.31Å; P133-V137 WeakPolarHBondContact O-CG2 2.91Å; P133-V137 PolarHBondContact O-N 3.2Å; Y134-V137 PolarHBondContact O-N 3.33Å; V137-I140 PolarHBondContact O-N 2.85Å; V137-M141 VanDerWaalsContact O-CB 3.31Å; V137-M141 WeakPolarHBondContact O-CB 3.42Å; V137-M141 PolarHBondContact O-N 2.98Å |
| 138 | L | 91.7 | Very high | 87.2 | Confident | 8 Ų | 8 | 36.2 Ų | 36.2 | 4% | 0.042 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -64.2 | -40.6 | 174.3 | -65.4 | 171.2 | 0 | 0 | 0 | 111.2 | Y134 L136 I140 M141 M142 F187 I188 P191 | Y134-L138 WeakPolarHBondContact O-CB 3.47Å; Y134-L138 VanDerWaalsContact O-CG 3.27Å; Y134-L138 WeakPolarHBondContact O-CG 2.94Å; Y134-L138 PolarHBondContact O-N 3.37Å; L136-L138 PolarHBondContact O-N 3.08Å; L138-I140 PolarHBondContact O-N 2.86Å; L138-M141 HydrophobicContact CD2-CE 3.51Å; L138-M141 WeakPolarHBondContact O-CB 3.22Å; L138-M141 PolarHBondContact O-N 2.9Å; L138-M142 WeakPolarHBondContact O-CB 3.45Å; L138-M142 PolarHBondContact O-N 3.17Å; L138-F187 HydrophobicContact CD1-CB 4.01Å; L138-F187 HydrophobicContact CD2-CB 3.92Å; L138-I188 HydrophobicContact CB-CB 4.1Å; L138-I188 HydrophobicContact CB-CD1 3.94Å; L138-I188 HydrophobicContact CB-CG1 3.95Å; L138-I188 HydrophobicContact CD1-CB 4.15Å; L138-I188 HydrophobicContact CD1-CG1 4.23Å; L138-P191 HydrophobicContact CD1-CG 4.39Å |
| 139 | G | 93.4 | Very high | 88.5 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -67.2 | -34.4 | 178 | 0 | 0 | 0 | 0 | 0 | 114.7 | I135 L136 L143 W255 | I135-G139 PolarHBondContact O-N 3.37Å; L136-G139 PolarHBondContact O-N 3.35Å; L136-G139 VanDerWaalsContact O-N 3.15Å; G139-L143 PolarHBondContact O-N 3.45Å; G139-L143 VanDerWaalsContact O-N 3.14Å; G139-W255 PolarHBondContact O-NE1 3.47Å |
| 140 | I | 95.1 | Very high | 89.5 | Confident | 78 Ų | 78 | 30.1 Ų | 30.1 | 40% | 0.4 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -68.9 | -42.9 | 170.3 | -69.3 | 171.5 | 0 | 0 | 0 | 110.3 | L136 V137 L138 M142 L143 I144 | L136-I140 HydrophobicContact CD1-CD1 3.76Å; L136-I140 HydrophobicContact CD1-CG1 3.84Å; L136-I140 HydrophobicContact CD2-CD1 4.16Å; L136-I140 HydrophobicContact CG-CD1 3.71Å; L136-I140 HydrophobicContact CG-CG1 4.19Å; L136-I140 WeakPolarHBondContact O-CG1 3.3Å; L136-I140 PolarHBondContact O-N 3.44Å; V137-I140 PolarHBondContact O-N 2.85Å; L138-I140 PolarHBondContact O-N 2.86Å; I140-M142 VanDerWaalsContact C-N 3.26Å; I140-M142 PolarHBondContact O-N 3.4Å; I140-L143 WeakPolarHBondContact O-CB 3.15Å; I140-L143 PolarHBondContact O-N 3.31Å; I140-L143 VanDerWaalsContact O-N 3.11Å; I140-I144 HydrophobicContact CG2-CD1 3.88Å; I140-I144 HydrophobicContact CG2-CG1 4.44Å; I140-I144 WeakPolarHBondContact O-CG1 3.41Å; I140-I144 PolarHBondContact O-N 2.91Å |
| 141 | M | 94.6 | Very high | 90.1 | Very high | 33 Ų | 33 | 28.9 Ų | 28.9 | 16% | 0.163 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.5 | -38.5 | 176.6 | -170.6 | 173.4 | 74.6 | 0 | 0 | 111.7 | V137 L138 I144 G145 L180 F183 A184 | V137-M141 VanDerWaalsContact O-CB 3.31Å; V137-M141 WeakPolarHBondContact O-CB 3.42Å; V137-M141 PolarHBondContact O-N 2.98Å; L138-M141 HydrophobicContact CD2-CE 3.51Å; L138-M141 WeakPolarHBondContact O-CB 3.22Å; L138-M141 PolarHBondContact O-N 2.9Å; M141-I144 PolarHBondContact O-N 3.06Å; M141-G145 PolarHBondContact O-N 3.48Å; M141-L180 HydrophobicContact CG-CD1 3.47Å; M141-L180 VanDerWaalsContact CG-CD1 3.47Å; M141-L180 HydrophobicContact CG-CD2 4.22Å; M141-L180 HydrophobicContact CG-CG 3.69Å; M141-L180 HydrophobicContact SD-CD1 3.75Å; M141-F183 HydrophobicContact CE-CD1 3.33Å; M141-F183 HydrophobicContact CE-CE1 3.63Å; M141-F183 HydrophobicContact CE-CG 4.41Å; M141-F183 HydrophobicContact SD-CD1 3.98Å; M141-F183 HydrophobicContact SD-CE1 4.06Å; M141-A184 HydrophobicContact CB-CB 4.24Å; M141-A184 VanDerWaalsContact CE-CA 3.48Å; M141-A184 HydrophobicContact CE-CB 3.53Å; M141-A184 HydrophobicContact CG-CB 4.28Å |
| 142 | M | 94.7 | Very high | 90.1 | Very high | 1 Ų | 1 | 29 Ų | 29 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -64.2 | -42.4 | 172.6 | -164 | 177.2 | 140.2 | 0 | 0 | 112.3 | C77 L138 I140 I144 G145 I146 F181 A184 W255 | C77-M142 HydrophobicContact CB-CE 3.56Å; L138-M142 WeakPolarHBondContact O-CB 3.45Å; L138-M142 PolarHBondContact O-N 3.17Å; I140-M142 VanDerWaalsContact C-N 3.26Å; I140-M142 PolarHBondContact O-N 3.4Å; M142-I144 VanDerWaalsContact C-N 3.33Å; M142-I144 PolarHBondContact O-N 3.27Å; M142-G145 PolarHBondContact O-N 3.05Å; M142-I146 WeakPolarHBondContact O-CG2 3.42Å; M142-I146 PolarHBondContact O-N 2.93Å; M142-F181 HydrophobicContact CE-CE2 3.69Å; M142-F181 HydrophobicContact CE-CZ 3.89Å; M142-F181 HydrophobicContact CG-CD2 3.54Å; M142-F181 HydrophobicContact CG-CE2 3.37Å; M142-F181 HydrophobicContact CG-CG 4.48Å; M142-F181 HydrophobicContact CG-CZ 4.19Å; M142-F181 WeakPolarHBondContact O-CD2 3.21Å; M142-F181 HydrophobicContact SD-CE2 4.26Å; M142-A184 HydrophobicContact CB-CB 3.58Å; M142-A184 HydrophobicContact CG-CB 4.15Å; M142-W255 HydrophobicContact CE-CD2 3.6Å; M142-W255 HydrophobicContact CE-CE3 3.98Å; M142-W255 HydrophobicContact CE-CG 3.84Å; M142-W255 HydrophobicContact CE-CZ2 4.22Å; M142-W255 HydrophobicContact CE-CZ3 4.44Å; M142-W255 HydrophobicContact SD-CD2 3.99Å; M142-W255 HydrophobicContact SD-CE3 4.5Å; M142-W255 HydrophobicContact SD-CH2 4.09Å; M142-W255 HydrophobicContact SD-CZ2 3.51Å; M142-W255 VanDerWaalsContact SD-CZ2 3.51Å |
| 143 | L | 94.9 | Very high | 89.7 | Confident | 50 Ų | 50 | 32.9 Ų | 32.9 | 26% | 0.262 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -61.9 | -39.3 | 172.7 | -75.1 | 172.2 | 0 | 0 | 0 | 112.3 | G139 I140 I146 S147 A252 | G139-L143 PolarHBondContact O-N 3.45Å; G139-L143 VanDerWaalsContact O-N 3.14Å; I140-L143 WeakPolarHBondContact O-CB 3.15Å; I140-L143 PolarHBondContact O-N 3.31Å; I140-L143 VanDerWaalsContact O-N 3.11Å; L143-I146 WeakPolarHBondContact O-CG2 3.49Å; L143-S147 WeakPolarHBondContact O-CB 3.48Å; L143-S147 PolarHBondContact O-N 3.46Å; L143-S147 VanDerWaalsContact O-N 3.11Å; L143-A252 HydrophobicContact CD2-CB 4.17Å |
| 144 | I | 94.6 | Very high | 89.3 | Confident | 82 Ų | 82 | 34.1 Ų | 34.1 | 42% | 0.421 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -67.3 | -46.2 | 177.1 | -66.4 | 166.5 | 0 | 0 | 0 | 110.3 | I140 M141 M142 S147 M148 L180 | I140-I144 HydrophobicContact CG2-CD1 3.88Å; I140-I144 HydrophobicContact CG2-CG1 4.44Å; I140-I144 WeakPolarHBondContact O-CG1 3.41Å; I140-I144 PolarHBondContact O-N 2.91Å; M141-I144 PolarHBondContact O-N 3.06Å; M142-I144 VanDerWaalsContact C-N 3.33Å; M142-I144 PolarHBondContact O-N 3.27Å; I144-S147 WeakPolarHBondContact O-CB 3.5Å; I144-S147 PolarHBondContact O-N 3.01Å; I144-M148 HydrophobicContact CG2-CG 4.36Å; I144-M148 HydrophobicContact CG2-SD 3.86Å; I144-M148 WeakPolarHBondContact O-CG 3.19Å; I144-M148 PolarHBondContact O-N 3.33Å; I144-L180 HydrophobicContact CB-CD2 4.33Å; I144-L180 HydrophobicContact CG2-CD2 3.85Å |
| 145 | G | 93.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -56.7 | -55.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | M141 M142 S147 M148 F149 G177 | M141-G145 PolarHBondContact O-N 3.48Å; M142-G145 PolarHBondContact O-N 3.05Å; G145-S147 PolarHBondContact O-N 3.01Å; G145-M148 PolarHBondContact O-N 2.94Å; G145-F149 VanDerWaalsContact O-CB 3.27Å; G145-F149 WeakPolarHBondContact O-CB 3.33Å; G145-F149 PolarHBondContact O-N 3.34Å; G145-G177 CarbonylContact C-O 3.55Å; G145-G177 WeakPolarHBondContact CA-O 3.3Å; G145-G177 CarbonylContact O-C 3.59Å |
| 146 | I | 92.7 | Very high | 88.3 | Confident | 4 Ų | 4 | 35.5 Ų | 35.5 | 2% | 0.021 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -64.9 | -27.9 | 178.7 | -161.6 | 165.1 | 0 | 0 | 0 | 112.8 | C77 M142 L143 F149 L150 F181 Y248 S251 | C77-I146 HydrophobicContact CB-CD1 4.26Å; M142-I146 WeakPolarHBondContact O-CG2 3.42Å; M142-I146 PolarHBondContact O-N 2.93Å; L143-I146 WeakPolarHBondContact O-CG2 3.49Å; I146-F149 HydrophobicContact CG1-CD1 4.35Å; I146-L150 HydrophobicContact CD1-CD1 4.36Å; I146-L150 HydrophobicContact CG1-CD1 3.88Å; I146-L150 HydrophobicContact CG1-CG 4.33Å; I146-L150 WeakPolarHBondContact O-CB 3.21Å; I146-L150 PolarHBondContact O-N 3.39Å; I146-F181 HydrophobicContact CB-CD2 3.71Å; I146-F181 HydrophobicContact CB-CE2 3.94Å; I146-F181 HydrophobicContact CD1-CE2 4.07Å; I146-F181 HydrophobicContact CG1-CE2 4.44Å; I146-Y248 HydrophobicContact CG2-CD2 4.42Å; I146-Y248 HydrophobicContact CG2-CE2 4.24Å; I146-S251 VanDerWaalsContact CD1-CB 3.49Å |
| 147 | S | 91.9 | Very high | 87.5 | Confident | 33 Ų | 33 | 37 Ų | 37 | 23% | 0.231 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -69.7 | -47.3 | 174 | -161.7 | 0 | 0 | 0 | 0 | 111.9 | L143 I144 G145 F149 N151 Y248 | L143-S147 WeakPolarHBondContact O-CB 3.48Å; L143-S147 PolarHBondContact O-N 3.46Å; L143-S147 VanDerWaalsContact O-N 3.11Å; I144-S147 WeakPolarHBondContact O-CB 3.5Å; I144-S147 PolarHBondContact O-N 3.01Å; G145-S147 PolarHBondContact O-N 3.01Å; S147-F149 VanDerWaalsContact C-N 3.34Å; S147-N151 WeakPolarHBondContact O-CA 3.29Å; S147-N151 VanDerWaalsContact O-CB 3.25Å; S147-N151 WeakPolarHBondContact O-CB 3.43Å; S147-N151 PolarHBondContact O-N 3.4Å; S147-N151 PolarHBondContact O-ND2 3.01Å; S147-N151 VanDerWaalsContact O-ND2 3.15Å; S147-Y248 VanDerWaalsContact CA-CE2 3.45Å; S147-Y248 PolarHBondContact OG-OH 3.41Å |
| 148 | M | 91 | Very high | 86.8 | Confident | 18 Ų | 18 | 37 Ų | 37 | 9% | 0.089 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -66.8 | -35.1 | 176.6 | -69 | -179.9 | 72.1 | 0 | 0 | 112.4 | I144 G145 G152 F155 V173 F176 | I144-M148 HydrophobicContact CG2-CG 4.36Å; I144-M148 HydrophobicContact CG2-SD 3.86Å; I144-M148 WeakPolarHBondContact O-CG 3.19Å; I144-M148 PolarHBondContact O-N 3.33Å; G145-M148 PolarHBondContact O-N 2.94Å; M148-G152 VanDerWaalsContact O-CA 3.24Å; M148-G152 WeakPolarHBondContact O-CA 3.47Å; M148-G152 PolarHBondContact O-N 3.17Å; M148-F155 HydrophobicContact CE-CE1 4.24Å; M148-F155 HydrophobicContact CG-CD2 4.44Å; M148-F155 HydrophobicContact CG-CE2 4.4Å; M148-V173 HydrophobicContact CB-CG1 4.29Å; M148-V173 HydrophobicContact CE-CB 4.33Å; M148-V173 HydrophobicContact CE-CG1 3.85Å; M148-V173 HydrophobicContact CE-CG2 4.09Å; M148-F176 HydrophobicContact CE-CD1 3.64Å; M148-F176 HydrophobicContact CE-CE1 4.25Å; M148-F176 HydrophobicContact SD-CD1 4.04Å; M148-F176 HydrophobicContact SD-CE1 4.27Å |
| 149 | F | 89.6 | Confident | 86.1 | Confident | 2 Ų | 2 | 42.3 Ų | 42.3 | 1% | 0.009 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -64.7 | -57.6 | 174.9 | 166.3 | -130.6 | 0 | 0 | 0 | 112.1 | E81 F84 V85 V88 G145 I146 S147 V174 V178 | E81-F149 HydrophobicContact CB-CE1 4.42Å; E81-F149 HydrophobicContact CG-CE1 4.24Å; F84-F149 HydrophobicContact CB-CZ 4.29Å; V85-F149 HydrophobicContact CB-CE2 4.26Å; V85-F149 HydrophobicContact CB-CZ 4.1Å; V85-F149 HydrophobicContact CG2-CE2 4.3Å; V88-F149 HydrophobicContact CB-CE2 3.68Å; V88-F149 HydrophobicContact CB-CZ 4.29Å; V88-F149 HydrophobicContact CG1-CD2 3.97Å; V88-F149 HydrophobicContact CG1-CE2 3.63Å; V88-F149 HydrophobicContact CG2-CE2 4.08Å; V88-F149 HydrophobicContact CG2-CZ 4.26Å; G145-F149 VanDerWaalsContact O-CB 3.27Å; G145-F149 WeakPolarHBondContact O-CB 3.33Å; G145-F149 PolarHBondContact O-N 3.34Å; I146-F149 HydrophobicContact CG1-CD1 4.35Å; S147-F149 VanDerWaalsContact C-N 3.34Å; F149-V174 HydrophobicContact CD2-CG1 4.19Å; F149-V178 HydrophobicContact CB-CG2 4.35Å; F149-V178 HydrophobicContact CD2-CG2 3.44Å; F149-V178 VanDerWaalsContact CD2-CG2 3.44Å; F149-V178 HydrophobicContact CE2-CG2 3.93Å; F149-V178 HydrophobicContact CG-CG2 4Å |
| 150 | L | 86.8 | Confident | 85.3 | Confident | 13 Ų | 13 | 43.5 Ų | 43.5 | 7% | 0.068 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -85.6 | -15.5 | -174.1 | -64.9 | 177.7 | 0 | 0 | 0 | 114.7 | I146 Y244 I247 Y248 | I146-L150 HydrophobicContact CD1-CD1 4.36Å; I146-L150 HydrophobicContact CG1-CD1 3.88Å; I146-L150 HydrophobicContact CG1-CG 4.33Å; I146-L150 WeakPolarHBondContact O-CB 3.21Å; I146-L150 PolarHBondContact O-N 3.39Å; L150-Y244 HydrophobicContact CD2-CD1 4.36Å; L150-I247 HydrophobicContact CD1-CG2 4.07Å; L150-Y248 HydrophobicContact CB-CD2 4.47Å; L150-Y248 HydrophobicContact CD1-CD2 4.44Å |
| 151 | N | 85.2 | Confident | 84.3 | Confident | 29 Ų | 29 | 45.8 Ų | 45.8 | 16% | 0.155 | 28% | 0.278 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -124 | 23.7 | -178.8 | -49.9 | -97.9 | 0 | 0 | 0 | 112.8 | S147 D153 A154 F155 Y248 | S147-N151 WeakPolarHBondContact O-CA 3.29Å; S147-N151 VanDerWaalsContact O-CB 3.25Å; S147-N151 WeakPolarHBondContact O-CB 3.43Å; S147-N151 PolarHBondContact O-N 3.4Å; S147-N151 PolarHBondContact O-ND2 3.01Å; S147-N151 VanDerWaalsContact O-ND2 3.15Å; N151-D153 PolarHBondContact O-N 3.44Å; N151-D153 VanDerWaalsContact O-N 3.15Å; N151-A154 HydrophobicContact CB-CB 4.44Å; N151-A154 WeakPolarHBondContact O-CB 3.45Å; N151-A154 PolarHBondContact O-N 2.92Å; N151-F155 PolarHBondContact O-N 3.42Å; N151-Y248 WeakPolarHBondContact ND2-CD1 3.23Å; N151-Y248 WeakPolarHBondContact ND2-CD2 3.24Å; N151-Y248 VanDerWaalsContact ND2-CG 3.3Å |
| 152 | G | 78.3 | Confident | 83.5 | Confident | 3 Ų | 3 | 49 Ų | 49 | 3% | 0.031 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -52.5 | -38.7 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | M148 A154 F155 I156 | M148-G152 VanDerWaalsContact O-CA 3.24Å; M148-G152 WeakPolarHBondContact O-CA 3.47Å; M148-G152 PolarHBondContact O-N 3.17Å; G152-A154 VanDerWaalsContact C-N 3.35Å; G152-A154 PolarHBondContact O-N 3.3Å; G152-F155 PolarHBondContact O-N 3.31Å; G152-I156 WeakPolarHBondContact O-CB 3.19Å; G152-I156 WeakPolarHBondContact O-CG1 3.38Å; G152-I156 PolarHBondContact O-N 3.07Å |
| 153 | D | 74.6 | Confident | 82.5 | Confident | 106 Ų | 106 | 60.1 Ų | 60.1 | 57% | 0.567 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -63.9 | -36.8 | 177.9 | -121.5 | -35.2 | 0 | 0 | 0 | 113.4 | N151 S157 K166 | N151-D153 PolarHBondContact O-N 3.44Å; N151-D153 VanDerWaalsContact O-N 3.15Å; D153-S157 VanDerWaalsContact O-CB 3.31Å; D153-S157 WeakPolarHBondContact O-CB 3.48Å; D153-S157 PolarHBondContact O-N 3.48Å; D153-K166 IonicContact OD1-NZ 3.19Å; D153-K166 PolarHBondContact OD1-NZ 3.25Å |
| 154 | A | 77.1 | Confident | 81.4 | Confident | 52 Ų | 52 | 62.2 Ų | 62.2 | 43% | 0.43 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -71.1 | -46 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | N151 G152 I156 S157 A158 | N151-A154 HydrophobicContact CB-CB 4.44Å; N151-A154 WeakPolarHBondContact O-CB 3.45Å; N151-A154 PolarHBondContact O-N 2.92Å; G152-A154 VanDerWaalsContact C-N 3.35Å; G152-A154 PolarHBondContact O-N 3.3Å; A154-I156 VanDerWaalsContact C-N 3.33Å; A154-I156 PolarHBondContact O-N 2.98Å; A154-S157 PolarHBondContact O-N 2.98Å; A154-S157 VanDerWaalsContact O-N 3.16Å; A154-S157 PolarHBondContact O-OG 2.81Å; A154-A158 PolarHBondContact O-N 2.79Å |
| 155 | F | 76.2 | Confident | 80.5 | Confident | 94 Ų | 94 | 62 Ų | 62 | 41% | 0.412 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58.3 | -44.6 | 177.1 | -159.6 | -88.2 | 0 | 0 | 0 | 111.7 | M148 N151 G152 A158 L159 V173 | M148-F155 HydrophobicContact CE-CE1 4.24Å; M148-F155 HydrophobicContact CG-CD2 4.44Å; M148-F155 HydrophobicContact CG-CE2 4.4Å; N151-F155 PolarHBondContact O-N 3.42Å; G152-F155 PolarHBondContact O-N 3.31Å; F155-A158 PolarHBondContact O-N 3.16Å; F155-L159 HydrophobicContact CE1-CD2 4.29Å; F155-L159 WeakPolarHBondContact O-CB 3.45Å; F155-L159 PolarHBondContact O-N 2.95Å; F155-V173 HydrophobicContact CB-CG1 4.4Å; F155-V173 HydrophobicContact CD1-CG1 4.11Å; F155-V173 HydrophobicContact CD1-CG2 4.34Å; F155-V173 HydrophobicContact CG-CG1 4.49Å |
| 156 | I | 76.4 | Confident | 79.8 | Confident | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -69.5 | -36.9 | 175.4 | -68.4 | -53.6 | 0 | 0 | 0 | 112.6 | G152 A154 A158 L159 V160 K166 W169 A170 V173 | G152-I156 WeakPolarHBondContact O-CB 3.19Å; G152-I156 WeakPolarHBondContact O-CG1 3.38Å; G152-I156 PolarHBondContact O-N 3.07Å; A154-I156 VanDerWaalsContact C-N 3.33Å; A154-I156 PolarHBondContact O-N 2.98Å; I156-A158 PolarHBondContact O-N 3.41Å; I156-L159 PolarHBondContact O-N 3.49Å; I156-V160 HydrophobicContact CG2-CB 4.29Å; I156-V160 PolarHBondContact O-N 3.24Å; I156-K166 HydrophobicContact CG2-CB 4.45Å; I156-K166 HydrophobicContact CG2-CD 4.32Å; I156-K166 HydrophobicContact CG2-CG 3.39Å; I156-W169 HydrophobicContact CD1-CB 3.69Å; I156-W169 HydrophobicContact CG1-CB 4.41Å; I156-A170 HydrophobicContact CG1-CB 4.39Å; I156-V173 HydrophobicContact CD1-CB 3.94Å; I156-V173 HydrophobicContact CD1-CG1 4.46Å; I156-V173 HydrophobicContact CD1-CG2 3.5Å; I156-V173 HydrophobicContact CG1-CB 4.22Å; I156-V173 HydrophobicContact CG1-CG1 4.45Å; I156-V173 HydrophobicContact CG1-CG2 4.31Å |
| 157 | S | 73.8 | Confident | 79 | Confident | 78 Ų | 78 | 68.2 Ų | 68.2 | 55% | 0.545 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.4 | -26.4 | 176.9 | 74.1 | 0 | 0 | 0 | 0 | 113.7 | D153 A154 | D153-S157 VanDerWaalsContact O-CB 3.31Å; D153-S157 WeakPolarHBondContact O-CB 3.48Å; D153-S157 PolarHBondContact O-N 3.48Å; A154-S157 PolarHBondContact O-N 2.98Å; A154-S157 VanDerWaalsContact O-N 3.16Å; A154-S157 PolarHBondContact O-OG 2.81Å |
| 158 | A | 77.4 | Confident | 78.5 | Confident | 92 Ų | 92 | 71.7 Ų | 71.7 | 76% | 0.76 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -85.1 | -19.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | A154 F155 I156 | A154-A158 PolarHBondContact O-N 2.79Å; F155-A158 PolarHBondContact O-N 3.16Å; I156-A158 PolarHBondContact O-N 3.41Å |
| 159 | L | 76.8 | Confident | 78.2 | Confident | 120 Ų | 120 | 76.5 Ų | 76.5 | 63% | 0.628 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -111 | -27.5 | -168.9 | -158.9 | 72.7 | 0 | 0 | 0 | 114.2 | F155 I156 | F155-L159 HydrophobicContact CE1-CD2 4.29Å; F155-L159 WeakPolarHBondContact O-CB 3.45Å; F155-L159 PolarHBondContact O-N 2.95Å; I156-L159 PolarHBondContact O-N 3.49Å |
| 160 | V | 76.9 | Confident | 77.9 | Confident | 25 Ų | 25 | 77 Ų | 77 | 15% | 0.152 | 43% | 0.428 | C | S | . | . | trans | -134.9 | 112.4 | -175 | -178.2 | 0 | 0 | 0 | 0 | 110.9 | I156 D162 L165 W169 | I156-V160 HydrophobicContact CG2-CB 4.29Å; I156-V160 PolarHBondContact O-N 3.24Å; V160-D162 HydrophobicContact CG1-CB 4.35Å; V160-L165 HydrophobicContact CG1-CB 4.19Å; V160-W169 HydrophobicContact CG2-CB 4.35Å; V160-W169 HydrophobicContact CG2-CG 4.08Å | ||
| 161 | S | 74.5 | Confident | 77.8 | Confident | 127 Ų | 127 | 78 Ų | 78 | 89% | 0.888 | 43% | 0.434 | S | S | * | . | trans | -79.9 | -22.5 | 175.7 | -48.9 | 0 | 0 | 0 | 0 | 113.8 | R163 | S161-R163 PolarHBondContact O-N 3.02Š| ||
| 162 | D | 77.9 | Confident | 77.9 | Confident | 101 Ų | 101 | 80 Ų | 80 | 54% | 0.54 | 45% | 0.447 | S | S | . | . | trans | -76 | 115.5 | -175.2 | -84.6 | -47.6 | 0 | 0 | 0 | 113.3 | V160 S164 L165 K166 | V160-D162 HydrophobicContact CG1-CB 4.35Å; D162-S164 VanDerWaalsContact C-N 3.31Å; D162-S164 PolarHBondContact O-N 3.35Å; D162-L165 HydrophobicContact CB-CB 4.19Å; D162-L165 HydrophobicContact CB-CD1 4.11Å; D162-L165 HydrophobicContact CB-CG 4.22Å; D162-L165 PolarHBondContact O-N 2.93Å; D162-K166 PolarHBondContact O-N 3.42Å | ||
| 163 | R | 72.2 | Confident | 78.4 | Confident | 234 Ų | 234 | 80.5 Ų | 80.5 | 88% | 0.883 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -30.1 | -171.4 | -162 | 176.8 | -172.6 | -176.5 | 2.9 | 114.4 | S161 | S161-R163 PolarHBondContact O-N 3.02Š|
| 164 | S | 71.7 | Confident | 79.1 | Confident | 94 Ų | 94 | 75.6 Ų | 75.6 | 66% | 0.657 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.4 | -42.1 | 177.3 | 50 | 0 | 0 | 0 | 0 | 112.3 | D162 K166 | D162-S164 VanDerWaalsContact C-N 3.31Å; D162-S164 PolarHBondContact O-N 3.35Å; S164-K166 VanDerWaalsContact C-N 3.32Å |
| 165 | L | 76.1 | Confident | 79.7 | Confident | 77 Ų | 77 | 75.3 Ų | 75.3 | 40% | 0.403 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -72.4 | -27.3 | 178.1 | -61.6 | 179.9 | 0 | 0 | 0 | 111.9 | V160 D162 S167 I168 W169 | V160-L165 HydrophobicContact CG1-CB 4.19Å; D162-L165 HydrophobicContact CB-CB 4.19Å; D162-L165 HydrophobicContact CB-CD1 4.11Å; D162-L165 HydrophobicContact CB-CG 4.22Å; D162-L165 PolarHBondContact O-N 2.93Å; L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 3.03Å; L165-I168 PolarHBondContact O-N 3.17Å; L165-I168 VanDerWaalsContact O-N 3.11Å; L165-W169 VanDerWaalsContact O-CD1 3.26Å; L165-W169 PolarHBondContact O-N 2.67Å |
| 166 | K | 78.3 | Confident | 80.3 | Confident | 63 Ų | 63 | 76.1 Ų | 76.1 | 27% | 0.274 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -48.5 | -45.5 | -176.8 | -154.9 | -161.2 | -177.4 | -142.1 | 0 | 113.6 | D153 I156 D162 S164 A170 | D153-K166 IonicContact OD1-NZ 3.19Å; D153-K166 PolarHBondContact OD1-NZ 3.25Å; I156-K166 HydrophobicContact CG2-CB 4.45Å; I156-K166 HydrophobicContact CG2-CD 4.32Å; I156-K166 HydrophobicContact CG2-CG 3.39Å; D162-K166 PolarHBondContact O-N 3.42Å; S164-K166 VanDerWaalsContact C-N 3.32Å; K166-A170 WeakPolarHBondContact O-CB 3.41Å; K166-A170 PolarHBondContact O-N 2.95Å |
| 167 | S | 76.1 | Confident | 81.1 | Confident | 72 Ų | 72 | 76.1 Ų | 76.1 | 50% | 0.503 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -67.7 | -42 | -178.4 | 171.5 | 0 | 0 | 0 | 0 | 112.7 | L165 A170 I171 | L165-S167 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 3.03Å; S167-A170 PolarHBondContact O-N 3Å; S167-I171 WeakPolarHBondContact O-CG1 3.4Å; S167-I171 PolarHBondContact O-N 3.39Å |
| 168 | I | 82.1 | Confident | 81.9 | Confident | 106 Ų | 106 | 72.6 Ų | 72.6 | 54% | 0.544 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -66.3 | -44 | 178.4 | -59.8 | 175.1 | 0 | 0 | 0 | 110.2 | L165 A170 I171 V172 | L165-I168 PolarHBondContact O-N 3.17Å; L165-I168 VanDerWaalsContact O-N 3.11Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 3.41Å; I168-I171 PolarHBondContact O-N 2.96Å; I168-V172 WeakPolarHBondContact O-CG2 3.48Å; I168-V172 PolarHBondContact O-N 3.09Å; I168-V172 VanDerWaalsContact O-N 3.1Å |
| 169 | W | 83.7 | Confident | 82.6 | Confident | 118 Ų | 118 | 69.3 Ų | 69.3 | 45% | 0.447 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.8 | -31.3 | 177 | -71.9 | 110.2 | 0 | 0 | 0 | 113.1 | I156 V160 L165 V172 V173 | I156-W169 HydrophobicContact CD1-CB 3.69Å; I156-W169 HydrophobicContact CG1-CB 4.41Å; V160-W169 HydrophobicContact CG2-CB 4.35Å; V160-W169 HydrophobicContact CG2-CG 4.08Å; L165-W169 VanDerWaalsContact O-CD1 3.26Å; L165-W169 PolarHBondContact O-N 2.67Å; W169-V172 HydrophobicContact CE3-CG1 4.43Å; W169-V172 PolarHBondContact O-N 2.9Å; W169-V173 WeakPolarHBondContact O-CB 3.21Å; W169-V173 PolarHBondContact O-N 3.23Å |
| 170 | A | 83.4 | Confident | 83.3 | Confident | 12 Ų | 12 | 65 Ų | 65 | 10% | 0.099 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62 | -46.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | V92 I156 K166 S167 I168 V172 V173 V174 | V92-A170 HydrophobicContact CG1-CB 4.04Å; I156-A170 HydrophobicContact CG1-CB 4.39Å; K166-A170 WeakPolarHBondContact O-CB 3.41Å; K166-A170 PolarHBondContact O-N 2.95Å; S167-A170 PolarHBondContact O-N 3Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 3.41Å; A170-V172 VanDerWaalsContact C-N 3.35Å; A170-V172 PolarHBondContact O-N 3.08Å; A170-V173 PolarHBondContact O-N 3.06Å; A170-V174 WeakPolarHBondContact O-CB 3.46Å; A170-V174 WeakPolarHBondContact O-CG2 3.25Å; A170-V174 PolarHBondContact O-N 3.4Å |
| 171 | I | 84.8 | Confident | 84.1 | Confident | 36 Ų | 36 | 63.9 Ų | 63.9 | 19% | 0.185 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -55.3 | -51.2 | 172.8 | -65.1 | 165.1 | 0 | 0 | 0 | 110.1 | V92 L94 S167 I168 V173 V174 M175 | V92-I171 HydrophobicContact CG1-CB 4.32Å; V92-I171 HydrophobicContact CG1-CG1 3.77Å; V92-I171 VanDerWaalsContact O-CG1 3.32Å; V92-I171 WeakPolarHBondContact O-CG1 3.48Å; L94-I171 HydrophobicContact CB-CG2 4.4Å; L94-I171 HydrophobicContact CD1-CG2 3.84Å; S167-I171 WeakPolarHBondContact O-CG1 3.4Å; S167-I171 PolarHBondContact O-N 3.39Å; I168-I171 PolarHBondContact O-N 2.96Å; I171-V173 PolarHBondContact O-N 3.16Å; I171-V174 PolarHBondContact O-N 3.16Å; I171-M175 HydrophobicContact CG2-CG 4.29Å; I171-M175 HydrophobicContact CG2-SD 3.5Å; I171-M175 VanDerWaalsContact CG2-SD 3.5Å; I171-M175 WeakPolarHBondContact O-CB 3.41Å; I171-M175 WeakPolarHBondContact O-CG 3.31Å; I171-M175 PolarHBondContact O-N 3.26Å |
| 172 | V | 87.4 | Confident | 84.9 | Confident | 71 Ų | 71 | 58.6 Ų | 58.6 | 43% | 0.43 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | -177.6 | 172.9 | 0 | 0 | 0 | 0 | 112.6 | I168 W169 A170 F176 | I168-V172 WeakPolarHBondContact O-CG2 3.48Å; I168-V172 PolarHBondContact O-N 3.09Å; I168-V172 VanDerWaalsContact O-N 3.1Å; W169-V172 HydrophobicContact CE3-CG1 4.43Å; W169-V172 PolarHBondContact O-N 2.9Å; A170-V172 VanDerWaalsContact C-N 3.35Å; A170-V172 PolarHBondContact O-N 3.08Å; V172-F176 VanDerWaalsContact O-CB 3.25Å; V172-F176 WeakPolarHBondContact O-CB 3.42Å; V172-F176 PolarHBondContact O-N 3.06Å |
| 173 | V | 89.8 | Confident | 85.5 | Confident | 12 Ų | 12 | 55.1 Ų | 55.1 | 7% | 0.073 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -69.4 | -39.7 | -179.4 | 154.4 | 0 | 0 | 0 | 0 | 112.3 | M148 F155 I156 W169 A170 I171 G177 | M148-V173 HydrophobicContact CB-CG1 4.29Å; M148-V173 HydrophobicContact CE-CB 4.33Å; M148-V173 HydrophobicContact CE-CG1 3.85Å; M148-V173 HydrophobicContact CE-CG2 4.09Å; F155-V173 HydrophobicContact CB-CG1 4.4Å; F155-V173 HydrophobicContact CD1-CG1 4.11Å; F155-V173 HydrophobicContact CD1-CG2 4.34Å; F155-V173 HydrophobicContact CG-CG1 4.49Å; I156-V173 HydrophobicContact CD1-CB 3.94Å; I156-V173 HydrophobicContact CD1-CG1 4.46Å; I156-V173 HydrophobicContact CD1-CG2 3.5Å; I156-V173 HydrophobicContact CG1-CB 4.22Å; I156-V173 HydrophobicContact CG1-CG1 4.45Å; I156-V173 HydrophobicContact CG1-CG2 4.31Å; W169-V173 WeakPolarHBondContact O-CB 3.21Å; W169-V173 PolarHBondContact O-N 3.23Å; A170-V173 PolarHBondContact O-N 3.06Å; I171-V173 PolarHBondContact O-N 3.16Å; V173-G177 PolarHBondContact O-N 2.85Å |
| 174 | V | 89.1 | Confident | 86.4 | Confident | 3 Ų | 3 | 44 Ų | 44 | 2% | 0.018 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -70.4 | -44.7 | 178 | 172.6 | 0 | 0 | 0 | 0 | 110.7 | V88 L89 V92 F149 A170 I171 F176 G177 V178 | V88-V174 HydrophobicContact CG1-CG1 3.81Å; L89-V174 HydrophobicContact CD2-CG1 4.02Å; V92-V174 HydrophobicContact CG2-CG2 4.25Å; F149-V174 HydrophobicContact CD2-CG1 4.19Å; A170-V174 WeakPolarHBondContact O-CB 3.46Å; A170-V174 WeakPolarHBondContact O-CG2 3.25Å; A170-V174 PolarHBondContact O-N 3.4Å; I171-V174 PolarHBondContact O-N 3.16Å; V174-F176 VanDerWaalsContact C-N 3.33Å; V174-F176 PolarHBondContact O-N 3.33Å; V174-G177 PolarHBondContact O-N 2.91Å; V174-G177 VanDerWaalsContact O-N 3.15Å; V174-V178 WeakPolarHBondContact O-CG2 3.42Å; V174-V178 PolarHBondContact O-N 3.24Å |
| 175 | M | 88.4 | Confident | 87.4 | Confident | 46 Ų | 46 | 39.5 Ų | 39.5 | 23% | 0.227 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59.7 | -42 | 173.9 | -71 | 173.2 | 84.7 | 0 | 0 | 112.3 | L89 L94 V102 I171 V179 | L89-M175 HydrophobicContact CD2-CG 4Å; L94-M175 HydrophobicContact CD1-CE 3.9Å; L94-M175 HydrophobicContact CD1-SD 3.63Å; L94-M175 HydrophobicContact CD2-CE 3.94Å; L94-M175 HydrophobicContact CD2-CG 4.07Å; L94-M175 HydrophobicContact CD2-SD 3.97Å; L94-M175 HydrophobicContact CG-SD 4.43Å; V102-M175 HydrophobicContact CG2-CE 3.44Å; V102-M175 VanDerWaalsContact CG2-CE 3.44Å; I171-M175 HydrophobicContact CG2-CG 4.29Å; I171-M175 HydrophobicContact CG2-SD 3.5Å; I171-M175 VanDerWaalsContact CG2-SD 3.5Å; I171-M175 WeakPolarHBondContact O-CB 3.41Å; I171-M175 WeakPolarHBondContact O-CG 3.31Å; I171-M175 PolarHBondContact O-N 3.26Å; M175-V179 WeakPolarHBondContact O-CG2 3.1Å; M175-V179 PolarHBondContact O-N 2.79Å; M175-V179 VanDerWaalsContact O-N 3.09Å |
| 176 | F | 90.5 | Very high | 87.9 | Confident | 112 Ų | 112 | 36.9 Ų | 36.9 | 49% | 0.491 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -66.5 | -38 | 175.2 | -178.1 | -95.2 | 0 | 0 | 0 | 111.7 | M148 V172 V174 L180 | M148-F176 HydrophobicContact CE-CD1 3.64Å; M148-F176 HydrophobicContact CE-CE1 4.25Å; M148-F176 HydrophobicContact SD-CD1 4.04Å; M148-F176 HydrophobicContact SD-CE1 4.27Å; V172-F176 VanDerWaalsContact O-CB 3.25Å; V172-F176 WeakPolarHBondContact O-CB 3.42Å; V172-F176 PolarHBondContact O-N 3.06Å; V174-F176 VanDerWaalsContact C-N 3.33Å; V174-F176 PolarHBondContact O-N 3.33Å; F176-L180 HydrophobicContact CE1-CB 4.47Å; F176-L180 HydrophobicContact CE1-CD2 3.91Å; F176-L180 HydrophobicContact CZ-CD1 4.42Å; F176-L180 HydrophobicContact CZ-CD2 4.49Å; F176-L180 WeakPolarHBondContact O-CB 3.41Å; F176-L180 PolarHBondContact O-N 2.87Å |
| 177 | G | 91.9 | Very high | 88.2 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.4 | -47.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G145 V173 V174 L180 F181 | G145-G177 CarbonylContact C-O 3.55Å; G145-G177 WeakPolarHBondContact CA-O 3.3Å; G145-G177 CarbonylContact O-C 3.59Å; V173-G177 PolarHBondContact O-N 2.85Å; V174-G177 PolarHBondContact O-N 2.91Å; V174-G177 VanDerWaalsContact O-N 3.15Å; G177-L180 PolarHBondContact O-N 3.4Å; G177-F181 WeakPolarHBondContact O-CB 3.46Å; G177-F181 PolarHBondContact O-N 3.47Å |
| 178 | V | 91.1 | Very high | 88.7 | Confident | 4 Ų | 4 | 30.6 Ų | 30.6 | 2% | 0.024 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -59.8 | -57.3 | 174.6 | 172.3 | 0 | 0 | 0 | 0 | 110.8 | V85 V102 F149 V174 L180 F181 D182 | V85-V178 HydrophobicContact CG2-CB 4.47Å; V85-V178 HydrophobicContact CG2-CG1 3.78Å; V85-V178 HydrophobicContact CG2-CG2 3.77Å; V102-V178 HydrophobicContact CG1-CG1 4.22Å; F149-V178 HydrophobicContact CB-CG2 4.35Å; F149-V178 HydrophobicContact CD2-CG2 3.44Å; F149-V178 VanDerWaalsContact CD2-CG2 3.44Å; F149-V178 HydrophobicContact CE2-CG2 3.93Å; F149-V178 HydrophobicContact CG-CG2 4Å; V174-V178 WeakPolarHBondContact O-CG2 3.42Å; V174-V178 PolarHBondContact O-N 3.24Å; V178-L180 PolarHBondContact O-N 3.3Å; V178-F181 WeakPolarHBondContact O-CA 3.46Å; V178-F181 WeakPolarHBondContact O-CB 3.37Å; V178-F181 PolarHBondContact O-N 3.11Å; V178-D182 PolarHBondContact O-N 3.23Å |
| 179 | V | 91.2 | Very high | 88.9 | Confident | 22 Ų | 22 | 26 Ų | 26 | 13% | 0.133 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -60.1 | -34.4 | -178.5 | 171.9 | 0 | 0 | 0 | 0 | 112.1 | V102 I105 L109 M175 F183 | V102-V179 HydrophobicContact CG1-CG2 4.08Å; I105-V179 HydrophobicContact CB-CG2 4.4Å; I105-V179 HydrophobicContact CG2-CG1 3.66Å; I105-V179 HydrophobicContact CG2-CG2 4.14Å; L109-V179 HydrophobicContact CD1-CG1 3.79Å; M175-V179 WeakPolarHBondContact O-CG2 3.1Å; M175-V179 PolarHBondContact O-N 2.79Å; M175-V179 VanDerWaalsContact O-N 3.09Å; V179-F183 WeakPolarHBondContact O-CB 3.06Å; V179-F183 PolarHBondContact O-N 3.23Å; V179-F183 VanDerWaalsContact O-N 3.14Å |
| 180 | L | 92.6 | Very high | 88.8 | Confident | 30 Ų | 30 | 20.8 Ų | 20.8 | 16% | 0.157 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -71.2 | -35 | 175.1 | -171.8 | 70.3 | 0 | 0 | 0 | 112.4 | M141 I144 F176 G177 V178 A184 | M141-L180 HydrophobicContact CG-CD1 3.47Å; M141-L180 VanDerWaalsContact CG-CD1 3.47Å; M141-L180 HydrophobicContact CG-CD2 4.22Å; M141-L180 HydrophobicContact CG-CG 3.69Å; M141-L180 HydrophobicContact SD-CD1 3.75Å; I144-L180 HydrophobicContact CB-CD2 4.33Å; I144-L180 HydrophobicContact CG2-CD2 3.85Å; F176-L180 HydrophobicContact CE1-CB 4.47Å; F176-L180 HydrophobicContact CE1-CD2 3.91Å; F176-L180 HydrophobicContact CZ-CD1 4.42Å; F176-L180 HydrophobicContact CZ-CD2 4.49Å; F176-L180 WeakPolarHBondContact O-CB 3.41Å; F176-L180 PolarHBondContact O-N 2.87Å; G177-L180 PolarHBondContact O-N 3.4Å; V178-L180 PolarHBondContact O-N 3.3Å; L180-A184 WeakPolarHBondContact O-CB 3.46Å; L180-A184 PolarHBondContact O-N 2.92Å |
| 181 | F | 94.1 | Very high | 88.8 | Confident | 1 Ų | 1 | 20.5 Ų | 20.5 | 0% | 0.004 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -71.4 | -52.1 | 176.6 | 177.8 | -86 | 0 | 0 | 0 | 111.6 | C77 Y78 E81 M142 I146 G177 V178 F183 A184 A185 | C77-F181 HydrophobicContact CB-CE2 3.89Å; C77-F181 HydrophobicContact CB-CZ 3.54Å; Y78-F181 HydrophobicContact CD2-CE1 4.04Å; E81-F181 HydrophobicContact CB-CD1 4.43Å; E81-F181 HydrophobicContact CB-CE1 4.02Å; E81-F181 HydrophobicContact CG-CD1 4.42Å; E81-F181 HydrophobicContact CG-CE1 4.47Å; E81-F181 WeakPolarHBondContact OE1-CD1 3.19Å; E81-F181 WeakPolarHBondContact OE2-CD1 3.48Å; E81-F181 WeakPolarHBondContact OE2-CE1 3.37Å; M142-F181 HydrophobicContact CE-CE2 3.69Å; M142-F181 HydrophobicContact CE-CZ 3.89Å; M142-F181 HydrophobicContact CG-CD2 3.54Å; M142-F181 HydrophobicContact CG-CE2 3.37Å; M142-F181 HydrophobicContact CG-CG 4.48Å; M142-F181 HydrophobicContact CG-CZ 4.19Å; M142-F181 WeakPolarHBondContact O-CD2 3.21Å; M142-F181 HydrophobicContact SD-CE2 4.26Å; I146-F181 HydrophobicContact CB-CD2 3.71Å; I146-F181 HydrophobicContact CB-CE2 3.94Å; I146-F181 HydrophobicContact CD1-CE2 4.07Å; I146-F181 HydrophobicContact CG1-CE2 4.44Å; G177-F181 WeakPolarHBondContact O-CB 3.46Å; G177-F181 PolarHBondContact O-N 3.47Å; V178-F181 WeakPolarHBondContact O-CA 3.46Å; V178-F181 WeakPolarHBondContact O-CB 3.37Å; V178-F181 PolarHBondContact O-N 3.11Å; F181-F183 VanDerWaalsContact C-N 3.28Å; F181-F183 PolarHBondContact O-N 3.37Å; F181-A184 CarbonylContact O-C 3.6Å; F181-A184 WeakPolarHBondContact O-CA 3.43Å; F181-A184 WeakPolarHBondContact O-CB 3.42Å; F181-A184 PolarHBondContact O-N 3.14Å; F181-A185 HydrophobicContact CE1-CB 4.28Å; F181-A185 WeakPolarHBondContact O-CB 3.28Å; F181-A185 PolarHBondContact O-N 2.88Å |
| 182 | D | 91.3 | Very high | 88.9 | Confident | 16 Ų | 16 | 18.8 Ų | 18.8 | 9% | 0.086 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -48.6 | -53.7 | 172.8 | -81.3 | -49.6 | 0 | 0 | 0 | 110.1 | S106 V178 A184 A185 D186 | S106-D182 VanDerWaalsContact CB-OD2 3.27Å; S106-D182 WeakPolarHBondContact CB-OD2 3.43Å; S106-D182 WeakPolarHBondContact OG-CB 3.34Å; S106-D182 PolarHBondContact OG-OD2 3.37Å; V178-D182 PolarHBondContact O-N 3.23Å; D182-A184 PolarHBondContact O-N 3.48Å; D182-A185 PolarHBondContact O-N 3.48Å; D182-A185 VanDerWaalsContact O-N 3.11Å; D182-D186 PolarHBondContact O-N 3.22Å |
| 183 | F | 89.6 | Confident | 88.7 | Confident | 29 Ų | 29 | 15.8 Ų | 15.8 | 13% | 0.127 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -62.3 | -27.4 | -179.2 | 178.5 | -102.6 | 0 | 0 | 0 | 112.4 | L109 L113 I117 M141 V179 F181 F187 | L109-F183 HydrophobicContact CB-CD2 3.92Å; L109-F183 HydrophobicContact CB-CE2 4.26Å; L113-F183 HydrophobicContact CB-CE2 4.15Å; L113-F183 HydrophobicContact CB-CZ 4.5Å; L113-F183 HydrophobicContact CD1-CE2 3.6Å; L113-F183 HydrophobicContact CD1-CZ 3.85Å; I117-F183 HydrophobicContact CD1-CZ 3.97Å; M141-F183 HydrophobicContact CE-CD1 3.33Å; M141-F183 HydrophobicContact CE-CE1 3.63Å; M141-F183 HydrophobicContact CE-CG 4.41Å; M141-F183 HydrophobicContact SD-CD1 3.98Å; M141-F183 HydrophobicContact SD-CE1 4.06Å; V179-F183 WeakPolarHBondContact O-CB 3.06Å; V179-F183 PolarHBondContact O-N 3.23Å; V179-F183 VanDerWaalsContact O-N 3.14Å; F181-F183 VanDerWaalsContact C-N 3.28Å; F181-F183 PolarHBondContact O-N 3.37Å; F183-F187 AromaticContact CD2-CD2 3.7Å; F183-F187 HydrophobicContact CD2-CD2 3.7Å; F183-F187 HydrophobicContact CD2-CE1 4.45Å; F183-F187 AromaticContact CD2-CE2 3.26Å; F183-F187 HydrophobicContact CD2-CE2 3.26Å; F183-F187 HydrophobicContact CD2-CG 4.45Å; F183-F187 AromaticContact CD2-CZ 3.73Å; F183-F187 HydrophobicContact CD2-CZ 3.73Å; F183-F187 HydrophobicContact CE2-CD1 4.16Å; F183-F187 AromaticContact CE2-CD2 3.84Å; F183-F187 HydrophobicContact CE2-CD2 3.84Å; F183-F187 AromaticContact CE2-CE1 3.65Å; F183-F187 HydrophobicContact CE2-CE1 3.65Å; F183-F187 AromaticContact CE2-CE2 3.28Å; F183-F187 HydrophobicContact CE2-CE2 3.28Å; F183-F187 HydrophobicContact CE2-CG 4.24Å; F183-F187 AromaticContact CE2-CZ 3.22Å; F183-F187 HydrophobicContact CE2-CZ 3.22Å; F183-F187 HydrophobicContact CG-CD2 4.26Å; F183-F187 HydrophobicContact CG-CE2 4.22Å; F183-F187 HydrophobicContact CZ-CD1 4.27Å; F183-F187 HydrophobicContact CZ-CD2 4.49Å; F183-F187 HydrophobicContact CZ-CE1 4.03Å; F183-F187 HydrophobicContact CZ-CE2 4.25Å; F183-F187 HydrophobicContact CZ-CG 4.49Å; F183-F187 HydrophobicContact CZ-CZ 4.06Å; F183-F187 VanDerWaalsContact O-CB 3.25Å; F183-F187 WeakPolarHBondContact O-CB 3.49Å; F183-F187 WeakPolarHBondContact O-CD2 3.22Å; F183-F187 VanDerWaalsContact O-CG 3.31Å; F183-F187 WeakPolarHBondContact O-CG 3.46Å |
| 184 | A | 91.8 | Very high | 88.3 | Confident | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -77.7 | -44.3 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | M141 M142 L180 F181 D182 F187 I188 | M141-A184 HydrophobicContact CB-CB 4.24Å; M141-A184 VanDerWaalsContact CE-CA 3.48Å; M141-A184 HydrophobicContact CE-CB 3.53Å; M141-A184 HydrophobicContact CG-CB 4.28Å; M142-A184 HydrophobicContact CB-CB 3.58Å; M142-A184 HydrophobicContact CG-CB 4.15Å; L180-A184 WeakPolarHBondContact O-CB 3.46Å; L180-A184 PolarHBondContact O-N 2.92Å; F181-A184 CarbonylContact O-C 3.6Å; F181-A184 WeakPolarHBondContact O-CA 3.43Å; F181-A184 WeakPolarHBondContact O-CB 3.42Å; F181-A184 PolarHBondContact O-N 3.14Å; D182-A184 PolarHBondContact O-N 3.48Å; A184-F187 PolarHBondContact O-N 2.99Å; A184-I188 WeakPolarHBondContact O-CB 3.33Å; A184-I188 PolarHBondContact O-N 3.24Å |
| 185 | A | 91.1 | Very high | 88 | Confident | 0 Ų | 0 | 15.3 Ų | 15.3 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -66.9 | -40.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | R74 Y78 F181 D182 | R74-A185 VanDerWaalsContact CZ-O 3.3Å; R74-A185 PolarHBondContact NE-O 2.88Å; R74-A185 PolarHBondContact NH2-O 3.16Å; Y78-A185 HydrophobicContact CD2-CB 3.85Å; Y78-A185 HydrophobicContact CE2-CB 4.3Å; F181-A185 HydrophobicContact CE1-CB 4.28Å; F181-A185 WeakPolarHBondContact O-CB 3.28Å; F181-A185 PolarHBondContact O-N 2.88Å; D182-A185 PolarHBondContact O-N 3.48Å; D182-A185 VanDerWaalsContact O-N 3.11Å |
| 186 | D | 87.5 | Confident | 87.7 | Confident | 22 Ų | 22 | 13.2 Ų | 13.2 | 12% | 0.118 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -70.1 | -42.2 | 175.2 | -102.7 | 12.3 | 0 | 0 | 0 | 112.5 | R74 D182 I188 Q525 | R74-D186 IonicContact NH2-OD1 2.78Å; R74-D186 PolarHBondContact NH2-OD1 2.89Å; D182-D186 PolarHBondContact O-N 3.22Å; D186-I188 VanDerWaalsContact C-N 3.33Å; D186-I188 PolarHBondContact O-N 3.42Å; D186-Q525 PolarHBondContact OD2-NE2 3.38Å |
| 187 | F | 84.6 | Confident | 87.2 | Confident | 2 Ų | 2 | 8.2 Ų | 8.2 | 1% | 0.009 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -74.8 | -23.9 | -172.2 | -81.9 | -112.9 | 0 | 0 | 0 | 113.7 | G110 L113 Q114 I117 L138 F183 A184 P191 | G110-F187 VanDerWaalsContact CA-CE2 3.46Å; L113-F187 VanDerWaalsContact C-CE1 3.44Å; L113-F187 HydrophobicContact CB-CE1 3.75Å; L113-F187 HydrophobicContact CB-CZ 3.77Å; Q114-F187 VanDerWaalsContact CA-CE1 3.41Å; Q114-F187 HydrophobicContact CB-CD1 4.49Å; Q114-F187 HydrophobicContact CB-CE1 3.87Å; Q114-F187 HydrophobicContact CB-CZ 3.95Å; I117-F187 HydrophobicContact CB-CD1 4.04Å; I117-F187 HydrophobicContact CB-CE1 4.31Å; I117-F187 HydrophobicContact CD1-CD1 3.59Å; I117-F187 HydrophobicContact CD1-CE1 3.72Å; I117-F187 HydrophobicContact CG1-CD1 4.35Å; I117-F187 HydrophobicContact CG1-CE1 4.42Å; I117-F187 HydrophobicContact CG2-CD1 4.16Å; L138-F187 HydrophobicContact CD1-CB 4.01Å; L138-F187 HydrophobicContact CD2-CB 3.92Å; F183-F187 AromaticContact CD2-CD2 3.7Å; F183-F187 HydrophobicContact CD2-CD2 3.7Å; F183-F187 HydrophobicContact CD2-CE1 4.45Å; F183-F187 AromaticContact CD2-CE2 3.26Å; F183-F187 HydrophobicContact CD2-CE2 3.26Å; F183-F187 HydrophobicContact CD2-CG 4.45Å; F183-F187 AromaticContact CD2-CZ 3.73Å; F183-F187 HydrophobicContact CD2-CZ 3.73Å; F183-F187 HydrophobicContact CE2-CD1 4.16Å; F183-F187 AromaticContact CE2-CD2 3.84Å; F183-F187 HydrophobicContact CE2-CD2 3.84Å; F183-F187 AromaticContact CE2-CE1 3.65Å; F183-F187 HydrophobicContact CE2-CE1 3.65Å; F183-F187 AromaticContact CE2-CE2 3.28Å; F183-F187 HydrophobicContact CE2-CE2 3.28Å; F183-F187 HydrophobicContact CE2-CG 4.24Å; F183-F187 AromaticContact CE2-CZ 3.22Å; F183-F187 HydrophobicContact CE2-CZ 3.22Å; F183-F187 HydrophobicContact CG-CD2 4.26Å; F183-F187 HydrophobicContact CG-CE2 4.22Å; F183-F187 HydrophobicContact CZ-CD1 4.27Å; F183-F187 HydrophobicContact CZ-CD2 4.49Å; F183-F187 HydrophobicContact CZ-CE1 4.03Å; F183-F187 HydrophobicContact CZ-CE2 4.25Å; F183-F187 HydrophobicContact CZ-CG 4.49Å; F183-F187 HydrophobicContact CZ-CZ 4.06Å; F183-F187 VanDerWaalsContact O-CB 3.25Å; F183-F187 WeakPolarHBondContact O-CB 3.49Å; F183-F187 WeakPolarHBondContact O-CD2 3.22Å; F183-F187 VanDerWaalsContact O-CG 3.31Å; F183-F187 WeakPolarHBondContact O-CG 3.46Å; A184-F187 PolarHBondContact O-N 2.99Å; F187-P191 WeakPolarHBondContact O-CD 3.24Å |
| 188 | I | 87.4 | Confident | 86.5 | Confident | 0 Ų | 0 | 10.6 Ų | 10.6 | 0% | 0 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -77.8 | -25.1 | -176.6 | -152.6 | 171.3 | 0 | 0 | 0 | 112.6 | I135 L138 A184 D186 G190 P191 I192 W255 | I135-I188 HydrophobicContact CG2-CD1 4.01Å; I135-I188 HydrophobicContact CG2-CG1 4.15Å; I135-I188 WeakPolarHBondContact O-CD1 3.25Å; L138-I188 HydrophobicContact CB-CB 4.1Å; L138-I188 HydrophobicContact CB-CD1 3.94Å; L138-I188 HydrophobicContact CB-CG1 3.95Å; L138-I188 HydrophobicContact CD1-CB 4.15Å; L138-I188 HydrophobicContact CD1-CG1 4.23Å; A184-I188 WeakPolarHBondContact O-CB 3.33Å; A184-I188 PolarHBondContact O-N 3.24Å; D186-I188 VanDerWaalsContact C-N 3.33Å; D186-I188 PolarHBondContact O-N 3.42Å; I188-G190 PolarHBondContact O-N 2.95Å; I188-P191 WeakPolarHBondContact O-CD 2.95Å; I188-I192 HydrophobicContact CB-CD1 4.33Å; I188-I192 HydrophobicContact CD1-CD1 4.44Å; I188-I192 HydrophobicContact CG1-CD1 3.82Å; I188-I192 HydrophobicContact CG1-CG1 4.35Å; I188-I192 HydrophobicContact CG2-CD1 4.05Å; I188-I192 WeakPolarHBondContact O-CB 3.49Å; I188-I192 VanDerWaalsContact O-CD1 3.28Å; I188-I192 WeakPolarHBondContact O-CD1 3.37Å; I188-I192 WeakPolarHBondContact O-CG1 3.43Å; I188-I192 PolarHBondContact O-N 3.18Å; I188-I192 VanDerWaalsContact O-N 3.09Å; I188-W255 HydrophobicContact CD1-CH2 3.85Å; I188-W255 HydrophobicContact CD1-CZ2 3.74Å |
| 189 | D | 85.3 | Confident | 85.8 | Confident | 11 Ų | 11 | 11.1 Ų | 11.1 | 6% | 0.059 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -57.2 | -48.2 | 177.8 | 174.2 | 70.7 | 0 | 0 | 0 | 112.7 | M71 I192 K193 | M71-D189 VanDerWaalsContact CE-OD1 3.22Å; M71-D189 WeakPolarHBondContact CE-OD1 3.17Å; D189-I192 PolarHBondContact O-N 3.15Å; D189-K193 PolarHBondContact O-N 3.33Å; D189-K193 WeakPolarHBondContact OD1-CE 3.5Å; D189-K193 IonicContact OD1-NZ 3.26Å; D189-K193 PolarHBondContact OD1-NZ 3.43Å; D189-K193 WeakPolarHBondContact OD2-CD 3.47Å; D189-K193 WeakPolarHBondContact OD2-CE 3.49Å; D189-K193 IonicContact OD2-NZ 2.71Å; D189-K193 PolarHBondContact OD2-NZ 3.48Å |
| 190 | G | 82.1 | Confident | 85.2 | Confident | 8 Ų | 8 | 10.1 Ų | 10.1 | 8% | 0.082 | 6% | 0.055 | C | C | . | . | H | α-helix | trans | -58.1 | -55.9 | -179.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I188 I192 K193 A194 | I188-G190 PolarHBondContact O-N 2.95Å; G190-I192 VanDerWaalsContact C-N 3.35Å; G190-I192 PolarHBondContact O-N 2.87Å; G190-K193 PolarHBondContact O-N 3.43Å; G190-A194 VanDerWaalsContact O-CB 3.3Å; G190-A194 WeakPolarHBondContact O-CB 3.27Å; G190-A194 PolarHBondContact O-N 2.88Å |
| 191 | P | 82.8 | Confident | 84.4 | Confident | 5 Ų | 5 | 8.8 Ų | 8.8 | 3% | 0.032 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -57.4 | -38 | 172.9 | -28 | 37 | 0 | 0 | 0 | 114.3 | I135 L138 F187 I188 Y195 | I135-P191 HydrophobicContact CD1-CB 4.27Å; I135-P191 HydrophobicContact CG1-CB 3.84Å; L138-P191 HydrophobicContact CD1-CG 4.39Å; F187-P191 WeakPolarHBondContact O-CD 3.24Å; I188-P191 WeakPolarHBondContact O-CD 2.95Å; P191-Y195 VanDerWaalsContact O-CB 3.28Å; P191-Y195 WeakPolarHBondContact O-CB 3.49Å; P191-Y195 PolarHBondContact O-N 3.48Å |
| 192 | I | 86.7 | Confident | 83.4 | Confident | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -66.2 | -42.2 | 177.3 | -69.9 | 161.5 | 0 | 0 | 0 | 111.5 | H67 V70 M71 I135 I188 D189 G190 Y195 L196 | H67-I192 PolarHBondContact NE2-O 3.09Å; V70-I192 HydrophobicContact CB-CD1 4.36Å; V70-I192 HydrophobicContact CG1-CD1 3.65Å; V70-I192 HydrophobicContact CG1-CG1 4.07Å; V70-I192 HydrophobicContact CG1-CG2 3.66Å; V70-I192 HydrophobicContact CG2-CD1 3.75Å; M71-I192 HydrophobicContact CE-CB 4.04Å; M71-I192 HydrophobicContact CE-CG2 3.55Å; M71-I192 HydrophobicContact SD-CD1 4.16Å; M71-I192 HydrophobicContact SD-CG2 4.06Å; I135-I192 HydrophobicContact CD1-CG1 4.12Å; I135-I192 HydrophobicContact CG1-CG1 4.45Å; I135-I192 HydrophobicContact CG2-CG1 4.43Å; I188-I192 HydrophobicContact CB-CD1 4.33Å; I188-I192 HydrophobicContact CD1-CD1 4.44Å; I188-I192 HydrophobicContact CG1-CD1 3.82Å; I188-I192 HydrophobicContact CG1-CG1 4.35Å; I188-I192 HydrophobicContact CG2-CD1 4.05Å; I188-I192 WeakPolarHBondContact O-CB 3.49Å; I188-I192 VanDerWaalsContact O-CD1 3.28Å; I188-I192 WeakPolarHBondContact O-CD1 3.37Å; I188-I192 WeakPolarHBondContact O-CG1 3.43Å; I188-I192 PolarHBondContact O-N 3.18Å; I188-I192 VanDerWaalsContact O-N 3.09Å; D189-I192 PolarHBondContact O-N 3.15Å; G190-I192 VanDerWaalsContact C-N 3.35Å; G190-I192 PolarHBondContact O-N 2.87Å; I192-Y195 WeakPolarHBondContact O-CB 3.28Å; I192-L196 PolarHBondContact O-N 3.19Å |
| 193 | K | 84.5 | Confident | 82.6 | Confident | 8 Ų | 8 | 12.6 Ų | 12.6 | 4% | 0.035 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -69 | -44.6 | 175.3 | -74.7 | 172.8 | 177.9 | 156.9 | 0 | 111.8 | M71 D189 G190 Y195 L196 F197 F487 | M71-K193 HydrophobicContact CE-CG 4.25Å; D189-K193 PolarHBondContact O-N 3.33Å; D189-K193 WeakPolarHBondContact OD1-CE 3.5Å; D189-K193 IonicContact OD1-NZ 3.26Å; D189-K193 PolarHBondContact OD1-NZ 3.43Å; D189-K193 WeakPolarHBondContact OD2-CD 3.47Å; D189-K193 WeakPolarHBondContact OD2-CE 3.49Å; D189-K193 IonicContact OD2-NZ 2.71Å; D189-K193 PolarHBondContact OD2-NZ 3.48Å; G190-K193 PolarHBondContact O-N 3.43Å; K193-Y195 VanDerWaalsContact C-N 3.28Å; K193-Y195 PolarHBondContact O-N 2.92Å; K193-L196 WeakPolarHBondContact O-CB 3.44Å; K193-L196 PolarHBondContact O-N 3.24Å; K193-L196 VanDerWaalsContact O-N 3.14Å; K193-F197 VanDerWaalsContact O-CD2 3.22Å; K193-F197 WeakPolarHBondContact O-CD2 3.38Å; K193-F197 PolarHBondContact O-N 2.83Å; K193-F197 VanDerWaalsContact O-N 3.08Å; K193-F487 HydrophobicContact CD-CD1 4.02Å; K193-F487 HydrophobicContact CD-CE1 3.74Å; K193-F487 HydrophobicContact CD-CE2 4.42Å; K193-F487 HydrophobicContact CD-CG 4.48Å; K193-F487 HydrophobicContact CD-CZ 3.97Å |
| 194 | A | 80.6 | Confident | 82.2 | Confident | 2 Ų | 2 | 11.4 Ų | 11.4 | 2% | 0.017 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -62.9 | -33.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | R131 G190 F197 D198 | R131-A194 VanDerWaalsContact CZ-CB 3.5Å; G190-A194 VanDerWaalsContact O-CB 3.3Å; G190-A194 WeakPolarHBondContact O-CB 3.27Å; G190-A194 PolarHBondContact O-N 2.88Å; A194-F197 PolarHBondContact O-N 2.96Å; A194-D198 VanDerWaalsContact O-CG 3.26Å; A194-D198 PolarHBondContact O-N 2.95Å |
| 195 | Y | 81.9 | Confident | 81.8 | Confident | 4 Ų | 4 | 12.1 Ų | 12.1 | 2% | 0.016 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -61.7 | -45.9 | 171.3 | -166.3 | -74.4 | 0 | 0 | 0 | 111.9 | H67 R131 R132 I135 P191 I192 K193 F197 D198 V199 I266 E268 | H67-Y195 AromaticContact CE1-CD1 3.2Å; H67-Y195 WeakPolarHBondContact CE1-CD1 3.31Å; H67-Y195 AromaticContact CE1-CE1 3.92Å; H67-Y195 AromaticContact CE1-CG 3.73Å; H67-Y195 AromaticContact ND1-CD1 3.57Å; H67-Y195 AromaticContact ND1-CE1 3.83Å; R131-Y195 HydrophobicContact CB-CD2 3.82Å; R132-Y195 HydrophobicContact CG-CE2 4Å; R132-Y195 PolarHBondContact NE-OH 3.25Å; I135-Y195 HydrophobicContact CD1-CD2 4.3Å; P191-Y195 VanDerWaalsContact O-CB 3.28Å; P191-Y195 WeakPolarHBondContact O-CB 3.49Å; P191-Y195 PolarHBondContact O-N 3.48Å; I192-Y195 WeakPolarHBondContact O-CB 3.28Å; K193-Y195 VanDerWaalsContact C-N 3.28Å; K193-Y195 PolarHBondContact O-N 2.92Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.05Å; Y195-D198 PolarHBondContact O-N 3.11Å; Y195-V199 HydrophobicContact CD1-CB 4.34Å; Y195-V199 HydrophobicContact CD1-CG2 3.88Å; Y195-V199 HydrophobicContact CE1-CB 4.3Å; Y195-V199 HydrophobicContact CE1-CG1 4.34Å; Y195-V199 HydrophobicContact CE1-CG2 3.75Å; Y195-V199 WeakPolarHBondContact O-CB 3.32Å; Y195-V199 VanDerWaalsContact O-CG2 3.31Å; Y195-V199 WeakPolarHBondContact O-CG2 3.35Å; Y195-V199 PolarHBondContact O-N 3.47Å; Y195-I266 HydrophobicContact CE1-CB 4.48Å; Y195-I266 PolarHBondContact OH-O 3Å; Y195-E268 HydrophobicContact CE2-CB 4.31Å; Y195-E268 HydrophobicContact CE2-CG 4.18Å |
| 196 | L | 83.8 | Confident | 81.4 | Confident | 2 Ų | 2 | 15 Ų | 15 | 1% | 0.01 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -59 | -43.2 | 177.4 | -178.6 | 73 | 0 | 0 | 0 | 110.9 | L64 I192 K193 V199 C200 G208 L209 | L64-L196 HydrophobicContact CD2-CD1 4.2Å; I192-L196 PolarHBondContact O-N 3.19Å; K193-L196 WeakPolarHBondContact O-CB 3.44Å; K193-L196 PolarHBondContact O-N 3.24Å; K193-L196 VanDerWaalsContact O-N 3.14Å; L196-V199 PolarHBondContact O-N 2.9Å; L196-C200 WeakPolarHBondContact O-CB 3.44Å; L196-C200 PolarHBondContact O-N 3.04Å; L196-C200 PolarHBondContact O-SG 3.14Å; L196-C200 VanDerWaalsContact O-SG 3.38Å; L196-G208 VanDerWaalsContact CD2-C 3.47Å; L196-L209 HydrophobicContact CD2-CB 4.4Å |
| 197 | F | 79 | Confident | 81.3 | Confident | 7 Ų | 7 | 17.3 Ų | 17.3 | 3% | 0.031 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -69.9 | -32.4 | 179.4 | -66.2 | -47.5 | 0 | 0 | 0 | 114.5 | K193 A194 Y195 K205 F487 A491 T513 | K193-F197 VanDerWaalsContact O-CD2 3.22Å; K193-F197 WeakPolarHBondContact O-CD2 3.38Å; K193-F197 PolarHBondContact O-N 2.83Å; K193-F197 VanDerWaalsContact O-N 3.08Å; A194-F197 PolarHBondContact O-N 2.96Å; Y195-F197 VanDerWaalsContact C-N 3.28Å; Y195-F197 PolarHBondContact O-N 3.05Å; F197-K205 HydrophobicContact CD1-CB 4.05Å; F197-K205 HydrophobicContact CD1-CD 3.89Å; F197-K205 HydrophobicContact CD1-CG 3.96Å; F197-K205 HydrophobicContact CE1-CB 4.2Å; F197-K205 WeakPolarHBondContact O-CE 3.22Å; F197-F487 HydrophobicContact CZ-CB 4.11Å; F197-A491 HydrophobicContact CE1-CB 3.94Å; F197-T513 HydrophobicContact CB-CG2 3.72Å; F197-T513 HydrophobicContact CD2-CG2 4.17Å; F197-T513 HydrophobicContact CG-CG2 4.18Å |
| 198 | D | 77.4 | Confident | 81.4 | Confident | 49 Ų | 49 | 17.2 Ų | 17.2 | 26% | 0.262 | 9% | 0.088 | S | C | . | . | H | α-helix | trans | -69.7 | -33.3 | 174.2 | -72.8 | -17.1 | 0 | 0 | 0 | 112.7 | R130 R131 A194 Y195 | R130-D198 IonicContact CZ-OD2 3.64Å; R130-D198 IonicContact NE-OD2 3.8Å; R130-D198 IonicContact NH2-OD1 2.71Å; R130-D198 PolarHBondContact NH2-OD1 3.49Å; R130-D198 IonicContact NH2-OD2 2.73Å; R130-D198 PolarHBondContact NH2-OD2 3.33Å; R131-D198 IonicContact CZ-OD2 3.68Å; R131-D198 IonicContact NE-OD2 2.67Å; R131-D198 PolarHBondContact NE-OD2 3.42Å; R131-D198 IonicContact NH2-OD1 3.67Å; R131-D198 PolarHBondContact NH2-OD1 3.46Å; R131-D198 IonicContact NH2-OD2 3.48Å; R131-D198 PolarHBondContact NH2-OD2 3.38Å; A194-D198 VanDerWaalsContact O-CG 3.26Å; A194-D198 PolarHBondContact O-N 2.95Å; Y195-D198 PolarHBondContact O-N 3.11Å |
| 199 | V | 76.4 | Confident | 81.4 | Confident | 16 Ų | 16 | 17.3 Ų | 17.3 | 10% | 0.097 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -104.6 | -12.2 | -160.3 | 173.3 | 0 | 0 | 0 | 0 | 114.2 | R59 Y195 L196 I266 | R59-V199 PolarHBondContact NE-O 2.78Å; R59-V199 PolarHBondContact NH2-O 3.43Å; R59-V199 VanDerWaalsContact NH2-O 3.14Å; Y195-V199 HydrophobicContact CD1-CB 4.34Å; Y195-V199 HydrophobicContact CD1-CG2 3.88Å; Y195-V199 HydrophobicContact CE1-CB 4.3Å; Y195-V199 HydrophobicContact CE1-CG1 4.34Å; Y195-V199 HydrophobicContact CE1-CG2 3.75Å; Y195-V199 WeakPolarHBondContact O-CB 3.32Å; Y195-V199 VanDerWaalsContact O-CG2 3.31Å; Y195-V199 WeakPolarHBondContact O-CG2 3.35Å; Y195-V199 PolarHBondContact O-N 3.47Å; L196-V199 PolarHBondContact O-N 2.9Å; V199-I266 HydrophobicContact CG1-CB 4.42Å; V199-I266 HydrophobicContact CG1-CD1 3.91Å; V199-I266 HydrophobicContact CG1-CG2 3.72Å |
| 200 | C | 77.8 | Confident | 81.6 | Confident | 1 Ų | 1 | 17.2 Ų | 17.2 | 1% | 0.007 | 9% | 0.087 | C | C | . | . | S | Bend | trans | -122.2 | 141.1 | -171.3 | -55.5 | 0 | 0 | 0 | 0 | 113.4 | L64 L196 D204 K205 | L64-C200 VanDerWaalsContact CD2-SG 3.58Å; L196-C200 WeakPolarHBondContact O-CB 3.44Å; L196-C200 PolarHBondContact O-N 3.04Å; L196-C200 PolarHBondContact O-SG 3.14Å; L196-C200 VanDerWaalsContact O-SG 3.38Å; C200-D204 HydrophobicContact CB-CB 3.97Å; C200-K205 HydrophobicContact CB-CG 4.23Å; C200-K205 WeakPolarHBondContact O-CE 3.33Å; C200-K205 WeakPolarHBondContact O-CG 3.39Å |
| 201 | S | 77.2 | Confident | 82 | Confident | 1 Ų | 1 | 18.7 Ų | 18.7 | 1% | 0.007 | 9% | 0.091 | C | C | . | . | trans | -62.6 | 160.1 | 168 | 53.2 | 0 | 0 | 0 | 0 | 111.8 | E55 P56 R58 S203 D204 K205 | E55-S201 WeakPolarHBondContact OE1-CB 3.44Å; P56-S201 WeakPolarHBondContact O-CB 3.43Å; R58-S201 WeakPolarHBondContact CG-OG 3.41Å; S201-S203 PolarHBondContact O-N 2.6Å; S201-S203 VanDerWaalsContact O-N 3.17Å; S201-D204 WeakPolarHBondContact O-CA 3.26Å; S201-D204 PolarHBondContact O-N 2.9Å; S201-K205 PolarHBondContact O-N 2.74Å | ||
| 202 | H | 72.3 | Confident | 82.4 | Confident | 55 Ų | 55 | 18.6 Ų | 18.6 | 26% | 0.255 | 9% | 0.09 | S | C | . | . | H | α-helix | trans | -50.9 | -46.6 | -171.8 | -65.6 | -96.8 | 0 | 0 | 0 | 114.3 | E55 D204 K205 | E55-H202 IonicContact OE1-CD2 2.74Å; H202-D204 PolarHBondContact O-N 3.39Å; H202-D204 VanDerWaalsContact O-N 3.17Å; H202-K205 WeakPolarHBondContact O-CB 3.47Å; H202-K205 PolarHBondContact O-N 2.79Å |
| 203 | S | 73.9 | Confident | 82.5 | Confident | 43 Ų | 43 | 18.7 Ų | 18.7 | 30% | 0.301 | 9% | 0.091 | S | C | . | . | H | α-helix | trans | -65.8 | -16.7 | 177.8 | 66.2 | 0 | 0 | 0 | 0 | 115.2 | S201 R207 | S201-S203 PolarHBondContact O-N 2.6Å; S201-S203 VanDerWaalsContact O-N 3.17Å; S203-R207 VanDerWaalsContact O-CD 3.28Å; S203-R207 WeakPolarHBondContact O-CD 3.33Å; S203-R207 WeakPolarHBondContact O-CG 3.49Å |
| 204 | D | 82.2 | Confident | 82.9 | Confident | 3 Ų | 3 | 20.2 Ų | 20.2 | 2% | 0.016 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -102.1 | -21.7 | -179.3 | -71.1 | -8.9 | 0 | 0 | 0 | 111.6 | R59 L64 C200 S201 H202 R207 G208 | R59-D204 PolarHBondContact N-OD2 2.92Å; L64-D204 HydrophobicContact CD1-CB 4Å; L64-D204 HydrophobicContact CD2-CB 4.37Å; C200-D204 HydrophobicContact CB-CB 3.97Å; S201-D204 WeakPolarHBondContact O-CA 3.26Å; S201-D204 PolarHBondContact O-N 2.9Å; H202-D204 PolarHBondContact O-N 3.39Å; H202-D204 VanDerWaalsContact O-N 3.17Å; D204-R207 IonicContact OD1-NH1 3.27Å; D204-R207 PolarHBondContact OD1-NH1 2.78Å; D204-G208 PolarHBondContact O-N 2.95Å |
| 205 | K | 83.1 | Confident | 83.5 | Confident | 16 Ų | 16 | 21.5 Ų | 21.5 | 7% | 0.07 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -57.8 | -54.7 | 166.9 | -65.4 | 177.2 | 177.1 | 179.9 | 0 | 110.4 | F197 C200 S201 H202 R207 G208 L209 A491 | F197-K205 HydrophobicContact CD1-CB 4.05Å; F197-K205 HydrophobicContact CD1-CD 3.89Å; F197-K205 HydrophobicContact CD1-CG 3.96Å; F197-K205 HydrophobicContact CE1-CB 4.2Å; F197-K205 WeakPolarHBondContact O-CE 3.22Å; C200-K205 HydrophobicContact CB-CG 4.23Å; C200-K205 WeakPolarHBondContact O-CE 3.33Å; C200-K205 WeakPolarHBondContact O-CG 3.39Å; S201-K205 PolarHBondContact O-N 2.74Å; H202-K205 WeakPolarHBondContact O-CB 3.47Å; H202-K205 PolarHBondContact O-N 2.79Å; K205-R207 PolarHBondContact O-N 3.09Å; K205-G208 PolarHBondContact O-N 3.31Å; K205-L209 PolarHBondContact O-N 3.44Å; K205-L209 VanDerWaalsContact O-N 3.09Å; K205-A491 HydrophobicContact CD-CB 4.43Å |
| 206 | E | 83.7 | Confident | 84 | Confident | 60 Ų | 60 | 21.8 Ų | 21.8 | 28% | 0.28 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -55.2 | -50.5 | 177.5 | -177.9 | -137.3 | 102 | 0 | 0 | 111.8 | G208 L209 H210 L436 N488 | E206-G208 PolarHBondContact O-N 2.92Å; E206-L209 PolarHBondContact O-N 3.17Å; E206-H210 PolarHBondContact O-CD2 3.02Å; E206-H210 VanDerWaalsContact O-CD2 3.26Å; E206-H210 PolarHBondContact O-N 3.05Å; E206-L436 HydrophobicContact CG-CD2 4.34Å; E206-N488 WeakPolarHBondContact CA-OD1 3.41Å |
| 207 | R | 84.8 | Confident | 84.3 | Confident | 71 Ų | 71 | 21.9 Ų | 21.9 | 27% | 0.268 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -61.2 | -45.1 | 178.8 | -72.2 | 172.8 | 173.9 | 160.1 | -1.2 | 113.1 | L64 S203 D204 K205 L209 H210 Y211 | L64-R207 HydrophobicContact CD1-CB 4.35Å; S203-R207 VanDerWaalsContact O-CD 3.28Å; S203-R207 WeakPolarHBondContact O-CD 3.33Å; S203-R207 WeakPolarHBondContact O-CG 3.49Å; D204-R207 IonicContact OD1-NH1 3.27Å; D204-R207 PolarHBondContact OD1-NH1 2.78Å; K205-R207 PolarHBondContact O-N 3.09Å; R207-L209 PolarHBondContact O-N 3.17Å; R207-H210 PolarHBondContact O-N 3.2Å; R207-Y211 HydrophobicContact CB-CE2 4.4Å; R207-Y211 WeakPolarHBondContact O-CD2 3.48Å; R207-Y211 PolarHBondContact O-N 3.27Å |
| 208 | G | 86.7 | Confident | 85 | Confident | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.3 | -32.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S68 L196 D204 K205 E206 Y211 H212 | S68-G208 PolarHBondContact OG-O 3.39Å; L196-G208 VanDerWaalsContact CD2-C 3.47Å; D204-G208 PolarHBondContact O-N 2.95Å; K205-G208 PolarHBondContact O-N 3.31Å; E206-G208 PolarHBondContact O-N 2.92Å; G208-Y211 PolarHBondContact O-N 2.83Å; G208-H212 PolarHBondContact O-N 3.04Å |
| 209 | L | 87.3 | Confident | 85.7 | Confident | 1 Ų | 1 | 22.4 Ų | 22.4 | 1% | 0.005 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -74.2 | -39.3 | 176.1 | -170.7 | 71.9 | 0 | 0 | 0 | 112.7 | L196 K205 E206 R207 Y211 H212 A213 T484 F487 N488 | L196-L209 HydrophobicContact CD2-CB 4.4Å; K205-L209 PolarHBondContact O-N 3.44Å; K205-L209 VanDerWaalsContact O-N 3.09Å; E206-L209 PolarHBondContact O-N 3.17Å; R207-L209 PolarHBondContact O-N 3.17Å; L209-Y211 VanDerWaalsContact C-N 3.29Å; L209-Y211 PolarHBondContact O-N 3.2Å; L209-H212 WeakPolarHBondContact O-CB 3.48Å; L209-H212 PolarHBondContact O-N 3.18Å; L209-H212 VanDerWaalsContact O-N 3.17Å; L209-A213 PolarHBondContact O-N 3.13Å; L209-T484 WeakPolarHBondContact CD2-O 3.36Å; L209-F487 HydrophobicContact CD1-CB 4.16Å; L209-F487 HydrophobicContact CD2-CB 3.6Å; L209-N488 VanDerWaalsContact CD2-OD1 3.31Å; L209-N488 WeakPolarHBondContact CD2-OD1 3.38Å |
| 210 | H | 88.5 | Confident | 86.4 | Confident | 10 Ų | 10 | 21.8 Ų | 21.8 | 5% | 0.046 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -60.8 | -38.8 | 168.9 | -78 | -69.4 | 0 | 0 | 0 | 111.8 | E206 R207 L214 S429 Q432 | E206-H210 PolarHBondContact O-CD2 3.02Å; E206-H210 VanDerWaalsContact O-CD2 3.26Å; E206-H210 PolarHBondContact O-N 3.05Å; R207-H210 PolarHBondContact O-N 3.2Å; H210-L214 VanDerWaalsContact O-CB 3.29Å; H210-L214 WeakPolarHBondContact O-CB 3.46Å; H210-L214 PolarHBondContact O-N 3.29Å; H210-S429 PolarHBondContact ND1-O 3.37Å; H210-S429 PolarHBondContact O-OG 3.42Å; H210-Q432 PolarHBondContact CE1-OE1 3.34Å |
| 211 | Y | 91.1 | Very high | 86.9 | Confident | 38 Ų | 38 | 22.1 Ų | 22.1 | 15% | 0.149 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -65.5 | -38.5 | 171.8 | -70.5 | -53.6 | 0 | 0 | 0 | 112.6 | L64 I65 S68 R207 G208 L209 L214 F215 | L64-Y211 HydrophobicContact CB-CD2 4.15Å; L64-Y211 HydrophobicContact CB-CE2 4.36Å; I65-Y211 HydrophobicContact CD1-CE1 4.16Å; I65-Y211 HydrophobicContact CG1-CD1 4Å; I65-Y211 HydrophobicContact CG1-CD2 4.25Å; I65-Y211 HydrophobicContact CG1-CE1 3.83Å; I65-Y211 HydrophobicContact CG1-CE2 4.1Å; I65-Y211 HydrophobicContact CG1-CG 4.23Å; S68-Y211 WeakPolarHBondContact OG-CB 3.34Å; R207-Y211 HydrophobicContact CB-CE2 4.4Å; R207-Y211 WeakPolarHBondContact O-CD2 3.48Å; R207-Y211 PolarHBondContact O-N 3.27Å; G208-Y211 PolarHBondContact O-N 2.83Å; L209-Y211 VanDerWaalsContact C-N 3.29Å; L209-Y211 PolarHBondContact O-N 3.2Å; Y211-L214 HydrophobicContact CD1-CD2 4.33Å; Y211-L214 PolarHBondContact O-N 3.33Å; Y211-F215 WeakPolarHBondContact O-CB 3.41Å; Y211-F215 WeakPolarHBondContact O-CD2 3.45Å; Y211-F215 PolarHBondContact O-N 2.9Å |
| 212 | H | 92.1 | Very high | 87.6 | Confident | 4 Ų | 4 | 24.5 Ų | 24.5 | 2% | 0.019 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -56.2 | -57.8 | 171.1 | -72 | 152.5 | 0 | 0 | 0 | 111 | H67 S68 M71 G208 L209 L214 F215 T216 | H67-H212 AromaticContact CD2-NE2 3.42Å; H67-H212 PolarHBondContact CD2-NE2 3.26Å; H67-H212 AromaticContact NE2-CE1 3.96Å; H67-H212 AromaticContact NE2-NE2 3.61Å; S68-H212 VanDerWaalsContact CB-CD2 3.48Å; S68-H212 WeakPolarHBondContact CB-CD2 3.17Å; S68-H212 PolarHBondContact OG-CD2 3.4Å; M71-H212 HydrophobicContact CG-CB 3.98Å; M71-H212 VanDerWaalsContact CG-CD2 3.41Å; M71-H212 WeakPolarHBondContact CG-CD2 3.06Å; G208-H212 PolarHBondContact O-N 3.04Å; L209-H212 WeakPolarHBondContact O-CB 3.48Å; L209-H212 PolarHBondContact O-N 3.18Å; L209-H212 VanDerWaalsContact O-N 3.17Å; H212-L214 VanDerWaalsContact C-N 3.3Å; H212-L214 PolarHBondContact O-N 3.45Å; H212-F215 PolarHBondContact O-N 3.19Å; H212-F215 VanDerWaalsContact O-N 3.08Å; H212-T216 PolarHBondContact O-N 3.17Å; H212-T216 PolarHBondContact O-OG1 3.04Å |
| 213 | A | 89.4 | Confident | 88.4 | Confident | 2 Ų | 2 | 21.9 Ų | 21.9 | 2% | 0.017 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.3 | -34.5 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | L209 G217 T484 | L209-A213 PolarHBondContact O-N 3.13Å; A213-G217 PolarHBondContact O-N 2.92Å; A213-T484 HydrophobicContact CB-CG2 3.45Å; A213-T484 VanDerWaalsContact CB-CG2 3.45Å |
| 214 | L | 92.3 | Very high | 89 | Confident | 40 Ų | 40 | 22.1 Ų | 22.1 | 21% | 0.209 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.9 | -49.3 | 171.9 | 174.8 | 65.8 | 0 | 0 | 0 | 111.2 | H210 Y211 H212 G217 L218 A426 | H210-L214 VanDerWaalsContact O-CB 3.29Å; H210-L214 WeakPolarHBondContact O-CB 3.46Å; H210-L214 PolarHBondContact O-N 3.29Å; Y211-L214 HydrophobicContact CD1-CD2 4.33Å; Y211-L214 PolarHBondContact O-N 3.33Å; H212-L214 VanDerWaalsContact C-N 3.3Å; H212-L214 PolarHBondContact O-N 3.45Å; L214-G217 PolarHBondContact O-N 3.07Å; L214-L218 HydrophobicContact CD1-CD1 4.05Å; L214-L218 HydrophobicContact CD1-CG 4.42Å; L214-L218 HydrophobicContact CG-CD1 4.15Å; L214-L218 WeakPolarHBondContact O-CG 3.38Å; L214-L218 PolarHBondContact O-N 3.49Å; L214-A426 HydrophobicContact CD1-CB 4.08Å; L214-A426 VanDerWaalsContact CD1-O 3.27Å; L214-A426 WeakPolarHBondContact CD1-O 3.32Å |
| 215 | F | 93.9 | Very high | 89.1 | Confident | 29 Ų | 29 | 25.7 Ų | 25.7 | 13% | 0.127 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -72.1 | -32.6 | -179.1 | -76.5 | -53.8 | 0 | 0 | 0 | 113.1 | I65 L69 M71 F72 Y211 H212 L218 G219 | I65-F215 HydrophobicContact CG2-CE2 4Å; I65-F215 HydrophobicContact CG2-CZ 3.92Å; L69-F215 HydrophobicContact CD2-CD1 3.83Å; L69-F215 HydrophobicContact CD2-CD2 4.41Å; L69-F215 HydrophobicContact CD2-CE1 3.49Å; L69-F215 VanDerWaalsContact CD2-CE1 3.49Å; L69-F215 HydrophobicContact CD2-CE2 4.12Å; L69-F215 HydrophobicContact CD2-CG 4.31Å; L69-F215 HydrophobicContact CD2-CZ 3.66Å; L69-F215 HydrophobicContact CG-CE2 4.39Å; L69-F215 HydrophobicContact CG-CZ 4.31Å; M71-F215 HydrophobicContact CB-CB 4.46Å; F72-F215 VanDerWaalsContact CA-O 3.28Å; F72-F215 WeakPolarHBondContact CA-O 3.31Å; F72-F215 HydrophobicContact CB-CB 4.06Å; F72-F215 HydrophobicContact CB-CD1 4.34Å; F72-F215 HydrophobicContact CD2-CD1 4.44Å; Y211-F215 WeakPolarHBondContact O-CB 3.41Å; Y211-F215 WeakPolarHBondContact O-CD2 3.45Å; Y211-F215 PolarHBondContact O-N 2.9Å; H212-F215 PolarHBondContact O-N 3.19Å; H212-F215 VanDerWaalsContact O-N 3.08Å; F215-L218 HydrophobicContact CD1-CD1 4.45Å; F215-G219 PolarHBondContact O-N 2.96Å |
| 216 | T | 91.3 | Very high | 89.2 | Confident | 10 Ų | 10 | 25.7 Ų | 25.7 | 6% | 0.061 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -56.6 | -55.7 | 168.3 | -58.6 | 0 | 0 | 0 | 0 | 110.7 | E75 H212 L218 G219 G220 Y483 | E75-T216 HydrophobicContact CB-CG2 4.07Å; E75-T216 WeakPolarHBondContact CB-O 3.13Å; E75-T216 HydrophobicContact CG-CG2 3.66Å; E75-T216 WeakPolarHBondContact CG-O 3.23Å; E75-T216 WeakPolarHBondContact OE1-CG2 2.99Å; H212-T216 PolarHBondContact O-N 3.17Å; H212-T216 PolarHBondContact O-OG1 3.04Å; T216-L218 PolarHBondContact O-N 3.05Å; T216-G219 PolarHBondContact O-N 3.48Å; T216-G220 PolarHBondContact O-N 3.34Å; T216-Y483 HydrophobicContact CG2-CD2 4.25Å; T216-Y483 HydrophobicContact CG2-CE2 3.66Å |
| 217 | G | 89.8 | Confident | 88.7 | Confident | 4 Ų | 4 | 23.9 Ų | 23.9 | 4% | 0.041 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -61.1 | -40.6 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | A213 L214 A221 A422 | A213-G217 PolarHBondContact O-N 2.92Å; L214-G217 PolarHBondContact O-N 3.07Å; G217-A221 WeakPolarHBondContact O-CB 3.42Å; G217-A221 PolarHBondContact O-N 2.73Å; G217-A422 CarbonylContact C-O 3.46Å; G217-A422 WeakPolarHBondContact CA-O 3.35Å; G217-A422 CarbonylContact O-C 3.53Å |
| 218 | L | 93.1 | Very high | 88.2 | Confident | 67 Ų | 67 | 23 Ų | 23 | 35% | 0.351 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -68.5 | -40.4 | 175.4 | -68.4 | 174.4 | 0 | 0 | 0 | 112.5 | F72 L214 F215 T216 A221 C222 A426 | F72-L218 HydrophobicContact CD2-CB 3.9Å; F72-L218 HydrophobicContact CE2-CB 3.91Å; L214-L218 HydrophobicContact CD1-CD1 4.05Å; L214-L218 HydrophobicContact CD1-CG 4.42Å; L214-L218 HydrophobicContact CG-CD1 4.15Å; L214-L218 WeakPolarHBondContact O-CG 3.38Å; L214-L218 PolarHBondContact O-N 3.49Å; F215-L218 HydrophobicContact CD1-CD1 4.45Å; T216-L218 PolarHBondContact O-N 3.05Å; L218-A221 PolarHBondContact O-N 3.3Å; L218-C222 PolarHBondContact O-N 3.35Å; L218-C222 PolarHBondContact O-SG 2.94Å; L218-C222 VanDerWaalsContact O-SG 3.41Å; L218-A426 HydrophobicContact CD2-CB 3.93Å; L218-A426 HydrophobicContact CG-CB 3.86Å |
| 219 | G | 92.5 | Very high | 87.8 | Confident | 0 Ų | 0 | 26.8 Ų | 26.8 | 0% | 0 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.2 | -50.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | F72 F76 F215 T216 A221 C222 G223 | F72-G219 VanDerWaalsContact CD2-CA 3.48Å; F72-G219 VanDerWaalsContact CD2-N 3.32Å; F76-G219 VanDerWaalsContact CA-O 3.29Å; F76-G219 WeakPolarHBondContact CA-O 3.46Å; F215-G219 PolarHBondContact O-N 2.96Å; T216-G219 PolarHBondContact O-N 3.48Å; G219-A221 PolarHBondContact O-N 3.02Å; G219-C222 PolarHBondContact O-N 2.89Å; G219-G223 PolarHBondContact O-N 3.35Å |
| 220 | G | 90.6 | Very high | 87.3 | Confident | 2 Ų | 2 | 31.4 Ų | 31.4 | 2% | 0.021 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -59.9 | -43.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | T216 C222 G223 Y224 | T216-G220 PolarHBondContact O-N 3.34Å; G220-C222 PolarHBondContact O-N 3.29Å; G220-G223 PolarHBondContact O-N 3.44Å; G220-Y224 WeakPolarHBondContact O-CD2 3.25Å; G220-Y224 PolarHBondContact O-N 3.34Å |
| 221 | A | 89.8 | Confident | 86.8 | Confident | 9 Ų | 9 | 32.4 Ų | 32.4 | 7% | 0.074 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -59.9 | -43.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | G217 L218 G219 L225 A422 V423 | G217-A221 WeakPolarHBondContact O-CB 3.42Å; G217-A221 PolarHBondContact O-N 2.73Å; L218-A221 PolarHBondContact O-N 3.3Å; G219-A221 PolarHBondContact O-N 3.02Å; A221-L225 VanDerWaalsContact O-CB 3.3Å; A221-L225 WeakPolarHBondContact O-CB 3.2Å; A221-L225 PolarHBondContact O-N 2.89Å; A221-A422 HydrophobicContact CB-CB 3.92Å; A221-V423 HydrophobicContact CB-CG2 3.66Å |
| 222 | C | 91.3 | Very high | 85.8 | Confident | 50 Ų | 50 | 32.4 Ų | 32.4 | 34% | 0.338 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -68 | -36.5 | 175 | -71.5 | 0 | 0 | 0 | 0 | 112.8 | F72 F76 L218 G219 G220 L225 V226 | F72-C222 HydrophobicContact CE2-CB 4.46Å; F72-C222 HydrophobicContact CZ-CB 3.85Å; F76-C222 HydrophobicContact CD2-CB 3.79Å; F76-C222 HydrophobicContact CE2-CB 4.04Å; L218-C222 PolarHBondContact O-N 3.35Å; L218-C222 PolarHBondContact O-SG 2.94Å; L218-C222 VanDerWaalsContact O-SG 3.41Å; G219-C222 PolarHBondContact O-N 2.89Å; G220-C222 PolarHBondContact O-N 3.29Å; C222-L225 PolarHBondContact O-N 3.45Å; C222-V226 WeakPolarHBondContact O-CG2 3.5Å; C222-V226 PolarHBondContact O-N 3.08Å |
| 223 | G | 89.4 | Confident | 84.7 | Confident | 0 Ų | 0 | 39.6 Ų | 39.6 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -67.7 | -46.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | G219 G220 L225 V226 G227 | G219-G223 PolarHBondContact O-N 3.35Å; G220-G223 PolarHBondContact O-N 3.44Å; G223-L225 VanDerWaalsContact C-N 3.31Å; G223-L225 PolarHBondContact O-N 2.94Å; G223-V226 PolarHBondContact O-N 3.37Å; G223-G227 PolarHBondContact O-N 3.44Å |
| 224 | Y | 85.8 | Confident | 84.3 | Confident | 49 Ų | 49 | 40.9 Ų | 40.9 | 19% | 0.192 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.4 | -35.7 | 173.4 | -67.8 | -54.2 | 0 | 0 | 0 | 112.3 | A79 A82 G220 G227 A228 L418 | A79-Y224 HydrophobicContact CB-CD1 3.91Å; A79-Y224 HydrophobicContact CB-CD2 3.97Å; A79-Y224 HydrophobicContact CB-CE1 3.79Å; A79-Y224 HydrophobicContact CB-CE2 3.84Å; A79-Y224 HydrophobicContact CB-CG 3.98Å; A82-Y224 HydrophobicContact CB-CE1 4.25Å; G220-Y224 WeakPolarHBondContact O-CD2 3.25Å; G220-Y224 PolarHBondContact O-N 3.34Å; Y224-G227 CarbonylContact O-C 3.52Å; Y224-G227 PolarHBondContact O-N 3.3Å; Y224-A228 WeakPolarHBondContact O-CB 3.48Å; Y224-A228 PolarHBondContact O-N 2.62Å; Y224-L418 HydrophobicContact CD2-CB 4.4Å; Y224-L418 HydrophobicContact CE1-CD1 4.35Å; Y224-L418 HydrophobicContact CE2-CB 4.28Å |
| 225 | L | 85.3 | Confident | 83.4 | Confident | 78 Ų | 78 | 44.2 Ų | 44.2 | 41% | 0.408 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -65.2 | -38.9 | 173.4 | -177.7 | 63 | 0 | 0 | 0 | 112.1 | A221 C222 G223 G227 A228 M229 | A221-L225 VanDerWaalsContact O-CB 3.3Å; A221-L225 WeakPolarHBondContact O-CB 3.2Å; A221-L225 PolarHBondContact O-N 2.89Å; C222-L225 PolarHBondContact O-N 3.45Å; G223-L225 VanDerWaalsContact C-N 3.31Å; G223-L225 PolarHBondContact O-N 2.94Å; L225-G227 VanDerWaalsContact C-N 3.29Å; L225-A228 PolarHBondContact O-N 3.14Å; L225-M229 HydrophobicContact CG-CE 4.3Å; L225-M229 WeakPolarHBondContact O-CE 3.3Å; L225-M229 WeakPolarHBondContact O-CG 3.49Å; L225-M229 PolarHBondContact O-N 2.93Å |
| 226 | V | 83.8 | Confident | 82.5 | Confident | 16 Ų | 16 | 45.6 Ų | 45.6 | 10% | 0.097 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.8 | -31 | 172.9 | 165.2 | 0 | 0 | 0 | 0 | 111.9 | F76 V80 C222 G223 M229 W231 | F76-V226 HydrophobicContact CE2-CB 4.42Å; F76-V226 HydrophobicContact CE2-CG2 3.91Å; F76-V226 HydrophobicContact CZ-CB 4.24Å; F76-V226 HydrophobicContact CZ-CG1 4.34Å; F76-V226 HydrophobicContact CZ-CG2 3.88Å; V80-V226 HydrophobicContact CG2-CB 4.44Å; V80-V226 HydrophobicContact CG2-CG1 4.16Å; C222-V226 WeakPolarHBondContact O-CG2 3.5Å; C222-V226 PolarHBondContact O-N 3.08Å; G223-V226 PolarHBondContact O-N 3.37Å; V226-M229 HydrophobicContact CG2-CE 4.12Å; V226-W231 HydrophobicContact CB-CZ2 4.45Å; V226-W231 HydrophobicContact CG1-CZ2 4.02Å; V226-W231 HydrophobicContact CG2-CZ2 4.24Å; V226-W231 PolarHBondContact O-NE1 3.21Å |
| 227 | G | 74.6 | Confident | 81.7 | Confident | 22 Ų | 22 | 45.4 Ų | 45.4 | 23% | 0.227 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -74 | -22.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | G223 Y224 L225 | G223-G227 PolarHBondContact O-N 3.44Å; Y224-G227 CarbonylContact O-C 3.52Å; Y224-G227 PolarHBondContact O-N 3.3Å; L225-G227 VanDerWaalsContact C-N 3.29Å |
| 228 | A | 73.6 | Confident | 81.1 | Confident | 53 Ų | 53 | 54.1 Ų | 54.1 | 44% | 0.438 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.4 | 0.5 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | Y224 L225 | Y224-A228 WeakPolarHBondContact O-CB 3.48Å; Y224-A228 PolarHBondContact O-N 2.62Å; L225-A228 PolarHBondContact O-N 3.14Å |
| 229 | M | 78.4 | Confident | 80.4 | Confident | 79 Ų | 79 | 57.7 Ų | 57.7 | 39% | 0.389 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -103.8 | 127.7 | 176.2 | -71.9 | -175.3 | -68.3 | 0 | 0 | 110.6 | L225 V226 W231 | L225-M229 HydrophobicContact CG-CE 4.3Å; L225-M229 WeakPolarHBondContact O-CE 3.3Å; L225-M229 WeakPolarHBondContact O-CG 3.49Å; L225-M229 PolarHBondContact O-N 2.93Å; V226-M229 HydrophobicContact CG2-CE 4.12Å; M229-W231 HydrophobicContact CB-CZ2 4.4Å; M229-W231 HydrophobicContact CE-CH2 3.96Å; M229-W231 HydrophobicContact CE-CZ2 3.61Å; M229-W231 PolarHBondContact O-N 2.98Å; M229-W231 PolarHBondContact O-NE1 3.43Å |
| 230 | D | 76.2 | Confident | 79.6 | Confident | 98 Ų | 98 | 60.9 Ų | 60.9 | 52% | 0.524 | 33% | 0.332 | S | S | . | . | trans | -65.7 | 113.4 | 167.7 | 166.7 | -0.4 | 0 | 0 | 0 | 109.9 | G232 H233 | D230-G232 WeakPolarHBondContact OD1-CA 3.42Å; D230-G232 PolarHBondContact OD1-N 3.22Å; D230-H233 PolarHBondContact OD1-N 2.71Å; D230-H233 IonicContact OD2-CD2 3.37Å; D230-H233 PolarHBondContact OD2-CD2 3.4Å; D230-H233 VanDerWaalsContact OD2-CD2 3.26Å; D230-H233 IonicContact OD2-CG 3.13Å | ||
| 231 | W | 79.4 | Confident | 78.6 | Confident | 31 Ų | 31 | 63.9 Ų | 63.9 | 12% | 0.117 | 36% | 0.362 | C | S | . | . | trans | -93.1 | -18 | 175 | -60.4 | 96.5 | 0 | 0 | 0 | 112.8 | V226 M229 H233 S234 G237 E243 V246 F250 | V226-W231 HydrophobicContact CB-CZ2 4.45Å; V226-W231 HydrophobicContact CG1-CZ2 4.02Å; V226-W231 HydrophobicContact CG2-CZ2 4.24Å; V226-W231 PolarHBondContact O-NE1 3.21Å; M229-W231 HydrophobicContact CB-CZ2 4.4Å; M229-W231 HydrophobicContact CE-CH2 3.96Å; M229-W231 HydrophobicContact CE-CZ2 3.61Å; M229-W231 PolarHBondContact O-N 2.98Å; M229-W231 PolarHBondContact O-NE1 3.43Å; W231-H233 PolarHBondContact O-N 3.16Å; W231-S234 VanDerWaalsContact O-CB 3.3Å; W231-S234 WeakPolarHBondContact O-CB 3.32Å; W231-S234 PolarHBondContact O-N 3.44Å; W231-S234 VanDerWaalsContact O-N 3.16Å; W231-S234 PolarHBondContact O-OG 3.37Å; W231-G237 WeakPolarHBondContact O-CA 3.15Å; W231-E243 HydrophobicContact CB-CB 4.29Å; W231-E243 HydrophobicContact CB-CG 4Å; W231-E243 PolarHBondContact N-OE1 2.9Å; W231-V246 HydrophobicContact CB-CB 4.28Å; W231-V246 HydrophobicContact CB-CG1 4.21Å; W231-V246 HydrophobicContact CD2-CG1 3.67Å; W231-V246 HydrophobicContact CE3-CG1 3.51Å; W231-V246 HydrophobicContact CG-CB 4.42Å; W231-V246 HydrophobicContact CG-CG1 3.99Å; W231-V246 HydrophobicContact CZ3-CG1 4.12Å; W231-F250 HydrophobicContact CE3-CE2 4.28Å; W231-F250 HydrophobicContact CH2-CD2 4.1Å; W231-F250 AromaticContact CH2-CE2 3.51Å; W231-F250 HydrophobicContact CH2-CE2 3.51Å; W231-F250 HydrophobicContact CH2-CZ 4.15Å; W231-F250 HydrophobicContact CZ2-CD2 4.32Å; W231-F250 HydrophobicContact CZ2-CE2 4.17Å; W231-F250 HydrophobicContact CZ3-CD2 4.46Å; W231-F250 AromaticContact CZ3-CE2 3.59Å; W231-F250 HydrophobicContact CZ3-CE2 3.59Å; W231-F250 HydrophobicContact CZ3-CZ 4.24Å | ||
| 232 | G | 68.4 | Low | 78.1 | Confident | 37 Ų | 37 | 65.3 Ų | 65.3 | 38% | 0.381 | 37% | 0.372 | S | S | . | . | S | Bend | trans | -60 | -44 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | D230 | D230-G232 WeakPolarHBondContact OD1-CA 3.42Å; D230-G232 PolarHBondContact OD1-N 3.22Å |
| 233 | H | 70.6 | Confident | 77.7 | Confident | 155 Ų | 155 | 65.7 Ų | 65.7 | 72% | 0.718 | 37% | 0.369 | S | S | * | . | S | Bend | trans | -82.2 | -12.1 | 176.2 | -73 | -49.1 | 0 | 0 | 0 | 114.3 | D230 W231 | D230-H233 PolarHBondContact OD1-N 2.71Å; D230-H233 IonicContact OD2-CD2 3.37Å; D230-H233 PolarHBondContact OD2-CD2 3.4Å; D230-H233 VanDerWaalsContact OD2-CD2 3.26Å; D230-H233 IonicContact OD2-CG 3.13Å; W231-H233 PolarHBondContact O-N 3.16Å |
| 234 | S | 79.6 | Confident | 77.4 | Confident | 30 Ų | 30 | 69.2 Ų | 69.2 | 21% | 0.21 | 38% | 0.382 | C | S | . | . | S | Bend | trans | -64.6 | 164.5 | -178.5 | 82.5 | 0 | 0 | 0 | 0 | 113.3 | W231 L236 G237 R238 | W231-S234 VanDerWaalsContact O-CB 3.3Å; W231-S234 WeakPolarHBondContact O-CB 3.32Å; W231-S234 PolarHBondContact O-N 3.44Å; W231-S234 VanDerWaalsContact O-N 3.16Å; W231-S234 PolarHBondContact O-OG 3.37Å; S234-L236 VanDerWaalsContact C-N 3.28Å; S234-L236 PolarHBondContact OG-N 3.25Å; S234-G237 PolarHBondContact OG-N 2.95Å; S234-R238 PolarHBondContact O-N 2.95Å; S234-R238 PolarHBondContact O-NE 2.89Å |
| 235 | V | 74.6 | Confident | 77.4 | Confident | 110 Ų | 110 | 70.2 Ų | 70.2 | 67% | 0.667 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -68.1 | -31.4 | 172.4 | -179.2 | 0 | 0 | 0 | 0 | 111 | L239 | V235-L239 WeakPolarHBondContact O-CB 3.47Å; V235-L239 PolarHBondContact O-N 3.33Å; V235-L239 VanDerWaalsContact O-N 3.09Å |
| 236 | L | 74.4 | Confident | 77.5 | Confident | 58 Ų | 58 | 66.5 Ų | 66.5 | 30% | 0.304 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -70.6 | -40.9 | 177 | -107.1 | 71.2 | 0 | 0 | 0 | 112.3 | S234 R238 L239 L240 V246 F250 | S234-L236 VanDerWaalsContact C-N 3.28Å; S234-L236 PolarHBondContact OG-N 3.25Å; L236-R238 VanDerWaalsContact C-N 3.31Å; L236-R238 PolarHBondContact O-N 3.25Å; L236-L239 PolarHBondContact O-N 3.06Å; L236-L240 HydrophobicContact CG-CD1 4.47Å; L236-L240 WeakPolarHBondContact O-CB 3.38Å; L236-L240 PolarHBondContact O-N 2.98Å; L236-V246 HydrophobicContact CB-CG1 4.13Å; L236-V246 HydrophobicContact CB-CG2 4.07Å; L236-V246 HydrophobicContact CD2-CG1 4.08Å; L236-F250 HydrophobicContact CD2-CE2 3.64Å; L236-F250 HydrophobicContact CD2-CZ 3.58Å |
| 237 | G | 75 | Confident | 77.8 | Confident | 5 Ų | 5 | 65.7 Ų | 65.7 | 5% | 0.052 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -58.8 | -43.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | W231 S234 L239 G241 | W231-G237 WeakPolarHBondContact O-CA 3.15Å; S234-G237 PolarHBondContact OG-N 2.95Å; G237-L239 VanDerWaalsContact C-N 3.33Å; G237-L239 PolarHBondContact O-N 3.43Å; G237-G241 WeakPolarHBondContact O-CA 3.33Å; G237-G241 PolarHBondContact O-N 3.15Å |
| 238 | R | 76.6 | Confident | 78.6 | Confident | 187 Ų | 187 | 67.6 Ų | 67.6 | 71% | 0.706 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -70.5 | -21.9 | 174.2 | -73.9 | -177.2 | -76.1 | 158.1 | -9.3 | 114.7 | S234 L236 | S234-R238 PolarHBondContact O-N 2.95Å; S234-R238 PolarHBondContact O-NE 2.89Å; L236-R238 VanDerWaalsContact C-N 3.31Å; L236-R238 PolarHBondContact O-N 3.25Å |
| 239 | L | 78.4 | Confident | 79.4 | Confident | 143 Ų | 143 | 69.9 Ų | 69.9 | 75% | 0.749 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -84 | -41.2 | 176.5 | -172.1 | 75 | 0 | 0 | 0 | 112.2 | V235 L236 G237 | V235-L239 WeakPolarHBondContact O-CB 3.47Å; V235-L239 PolarHBondContact O-N 3.33Å; V235-L239 VanDerWaalsContact O-N 3.09Å; L236-L239 PolarHBondContact O-N 3.06Å; G237-L239 VanDerWaalsContact C-N 3.33Å; G237-L239 PolarHBondContact O-N 3.43Å |
| 240 | L | 76.3 | Confident | 80 | Confident | 67 Ų | 67 | 68.9 Ų | 68.9 | 35% | 0.351 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -91.8 | -20.5 | -174.7 | -77.5 | 158.1 | 0 | 0 | 0 | 113.4 | L236 Q245 V246 | L236-L240 HydrophobicContact CG-CD1 4.47Å; L236-L240 WeakPolarHBondContact O-CB 3.38Å; L236-L240 PolarHBondContact O-N 2.98Å; L240-Q245 HydrophobicContact CB-CB 4.42Å; L240-Q245 PolarHBondContact O-OE1 2.86Å; L240-V246 HydrophobicContact CB-CG2 4.14Å; L240-V246 HydrophobicContact CD1-CB 4.43Å; L240-V246 HydrophobicContact CD1-CG2 3.86Å |
| 241 | G | 70.1 | Confident | 80.8 | Confident | 65 Ų | 65 | 64.2 Ų | 64.2 | 67% | 0.67 | 33% | 0.334 | S | S | * | . | S | Bend | trans | 100.9 | -21.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | G237 | G237-G241 WeakPolarHBondContact O-CA 3.33Å; G237-G241 PolarHBondContact O-N 3.15Å |
| 242 | S | 79.3 | Confident | 81.5 | Confident | 39 Ų | 39 | 63.8 Ų | 63.8 | 27% | 0.273 | 34% | 0.337 | S | S | . | . | S | Bend | trans | -153 | 156.6 | 171.4 | 68.7 | 0 | 0 | 0 | 0 | 112.5 | Q245 V246 | S242-Q245 PolarHBondContact O-N 2.89Å; S242-Q245 WeakPolarHBondContact OG-CB 3.42Å; S242-Q245 VanDerWaalsContact OG-CG 3.27Å; S242-Q245 WeakPolarHBondContact OG-CG 3.48Å; S242-Q245 PolarHBondContact OG-N 3.35Å; S242-Q245 PolarHBondContact OG-OE1 3.28Å; S242-V246 PolarHBondContact O-N 2.9Å |
| 243 | E | 81.9 | Confident | 82.7 | Confident | 58 Ų | 58 | 66.8 Ų | 66.8 | 27% | 0.271 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -57.7 | -48.2 | 173.6 | 167.7 | 153.3 | -111 | 0 | 0 | 112.4 | W231 Q245 V246 I247 | W231-E243 HydrophobicContact CB-CB 4.29Å; W231-E243 HydrophobicContact CB-CG 4Å; W231-E243 PolarHBondContact N-OE1 2.9Å; E243-Q245 PolarHBondContact O-N 2.94Å; E243-V246 WeakPolarHBondContact O-CA 3.24Å; E243-V246 WeakPolarHBondContact O-CB 3.27Å; E243-V246 PolarHBondContact O-N 2.97Å; E243-I247 HydrophobicContact CG-CD1 3.49Å; E243-I247 VanDerWaalsContact CG-CD1 3.49Å; E243-I247 HydrophobicContact CG-CG1 4.46Å; E243-I247 WeakPolarHBondContact O-CD1 3.4Å; E243-I247 WeakPolarHBondContact O-CG1 3.49Å; E243-I247 PolarHBondContact O-N 3.15Å |
| 244 | Y | 83.8 | Confident | 83.9 | Confident | 73 Ų | 73 | 60.6 Ų | 60.6 | 29% | 0.286 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -59.4 | -32.3 | 179.3 | -56.3 | -53.1 | 0 | 0 | 0 | 113.1 | F84 V88 L150 I247 Y248 | F84-Y244 HydrophobicContact CD1-CE1 4.27Å; V88-Y244 HydrophobicContact CG2-CD1 4.03Å; V88-Y244 HydrophobicContact CG2-CE1 3.6Å; L150-Y244 HydrophobicContact CD2-CD1 4.36Å; Y244-I247 HydrophobicContact CD1-CD1 4.44Å; Y244-Y248 WeakPolarHBondContact O-CB 3.44Å; Y244-Y248 PolarHBondContact O-N 3.11Å |
| 245 | Q | 85.9 | Confident | 84.6 | Confident | 70 Ų | 70 | 59.3 Ų | 59.3 | 33% | 0.327 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -72.6 | -32.8 | 174.4 | -73.9 | 164.7 | -44.3 | 0 | 0 | 113 | L240 S242 E243 F249 | L240-Q245 HydrophobicContact CB-CB 4.42Å; L240-Q245 PolarHBondContact O-OE1 2.86Å; S242-Q245 PolarHBondContact O-N 2.89Å; S242-Q245 WeakPolarHBondContact OG-CB 3.42Å; S242-Q245 VanDerWaalsContact OG-CG 3.27Å; S242-Q245 WeakPolarHBondContact OG-CG 3.48Å; S242-Q245 PolarHBondContact OG-N 3.35Å; S242-Q245 PolarHBondContact OG-OE1 3.28Å; E243-Q245 PolarHBondContact O-N 2.94Å; Q245-F249 WeakPolarHBondContact O-CB 3.49Å; Q245-F249 PolarHBondContact O-N 3.34Å |
| 246 | V | 87.6 | Confident | 85.6 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -64.8 | -49.2 | 171.3 | 178.2 | 0 | 0 | 0 | 0 | 110.4 | W231 L236 L240 S242 E243 Y248 F249 F250 | W231-V246 HydrophobicContact CB-CB 4.28Å; W231-V246 HydrophobicContact CB-CG1 4.21Å; W231-V246 HydrophobicContact CD2-CG1 3.67Å; W231-V246 HydrophobicContact CE3-CG1 3.51Å; W231-V246 HydrophobicContact CG-CB 4.42Å; W231-V246 HydrophobicContact CG-CG1 3.99Å; W231-V246 HydrophobicContact CZ3-CG1 4.12Å; L236-V246 HydrophobicContact CB-CG1 4.13Å; L236-V246 HydrophobicContact CB-CG2 4.07Å; L236-V246 HydrophobicContact CD2-CG1 4.08Å; L240-V246 HydrophobicContact CB-CG2 4.14Å; L240-V246 HydrophobicContact CD1-CB 4.43Å; L240-V246 HydrophobicContact CD1-CG2 3.86Å; S242-V246 PolarHBondContact O-N 2.9Å; E243-V246 WeakPolarHBondContact O-CA 3.24Å; E243-V246 WeakPolarHBondContact O-CB 3.27Å; E243-V246 PolarHBondContact O-N 2.97Å; V246-Y248 PolarHBondContact O-N 3.18Å; V246-F249 PolarHBondContact O-N 3.21Å; V246-F250 HydrophobicContact CG1-CD2 3.8Å; V246-F250 HydrophobicContact CG1-CE2 3.6Å; V246-F250 VanDerWaalsContact O-CD2 3.28Å; V246-F250 WeakPolarHBondContact O-CD2 3.37Å; V246-F250 PolarHBondContact O-N 3.48Å |
| 247 | I | 88.6 | Confident | 86.6 | Confident | 0 Ų | 0 | 58 Ų | 58 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.3 | -43.9 | 179.4 | -64.9 | 155.6 | 0 | 0 | 0 | 110.9 | V80 F84 L150 E243 Y244 F250 S251 | V80-I247 HydrophobicContact CG1-CG2 3.3Å; F84-I247 HydrophobicContact CD1-CD1 4.33Å; F84-I247 HydrophobicContact CD2-CD1 3.99Å; F84-I247 HydrophobicContact CD2-CG2 4.06Å; F84-I247 HydrophobicContact CE1-CD1 3.82Å; F84-I247 HydrophobicContact CE2-CD1 3.42Å; F84-I247 VanDerWaalsContact CE2-CD1 3.42Å; F84-I247 HydrophobicContact CE2-CG1 4Å; F84-I247 HydrophobicContact CE2-CG2 4Å; F84-I247 HydrophobicContact CG-CD1 4.42Å; F84-I247 HydrophobicContact CZ-CD1 3.33Å; F84-I247 HydrophobicContact CZ-CG1 4.23Å; L150-I247 HydrophobicContact CD1-CG2 4.07Å; E243-I247 HydrophobicContact CG-CD1 3.49Å; E243-I247 VanDerWaalsContact CG-CD1 3.49Å; E243-I247 HydrophobicContact CG-CG1 4.46Å; E243-I247 WeakPolarHBondContact O-CD1 3.4Å; E243-I247 WeakPolarHBondContact O-CG1 3.49Å; E243-I247 PolarHBondContact O-N 3.15Å; Y244-I247 HydrophobicContact CD1-CD1 4.44Å; I247-F250 PolarHBondContact O-N 3.1Å; I247-S251 WeakPolarHBondContact O-CB 3.39Å; I247-S251 PolarHBondContact O-N 3.03Å; I247-S251 PolarHBondContact O-OG 3.02Å |
| 248 | Y | 91.3 | Very high | 87.5 | Confident | 62 Ų | 62 | 59.1 Ų | 59.1 | 24% | 0.243 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -60.2 | -45.9 | 174.1 | 171.7 | -110.5 | 0 | 0 | 0 | 111.9 | I146 S147 L150 N151 Y244 V246 F250 S251 A252 | I146-Y248 HydrophobicContact CG2-CD2 4.42Å; I146-Y248 HydrophobicContact CG2-CE2 4.24Å; S147-Y248 VanDerWaalsContact CA-CE2 3.45Å; S147-Y248 PolarHBondContact OG-OH 3.41Å; L150-Y248 HydrophobicContact CB-CD2 4.47Å; L150-Y248 HydrophobicContact CD1-CD2 4.44Å; N151-Y248 WeakPolarHBondContact ND2-CD1 3.23Å; N151-Y248 WeakPolarHBondContact ND2-CD2 3.24Å; N151-Y248 VanDerWaalsContact ND2-CG 3.3Å; Y244-Y248 WeakPolarHBondContact O-CB 3.44Å; Y244-Y248 PolarHBondContact O-N 3.11Å; V246-Y248 PolarHBondContact O-N 3.18Å; Y248-F250 PolarHBondContact O-N 2.95Å; Y248-S251 PolarHBondContact O-N 3.11Å; Y248-A252 HydrophobicContact CE2-CB 4.16Å; Y248-A252 VanDerWaalsContact O-CB 3.24Å; Y248-A252 WeakPolarHBondContact O-CB 3.42Å; Y248-A252 PolarHBondContact O-N 3.47Å |
| 249 | F | 90.6 | Very high | 88.3 | Confident | 101 Ų | 101 | 50.6 Ų | 50.6 | 44% | 0.443 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -59.1 | -48.5 | 178 | 175.3 | -98.1 | 0 | 0 | 0 | 111.6 | Q245 V246 S251 L253 | Q245-F249 WeakPolarHBondContact O-CB 3.49Å; Q245-F249 PolarHBondContact O-N 3.34Å; V246-F249 PolarHBondContact O-N 3.21Å; F249-S251 PolarHBondContact O-N 3.27Å; F249-L253 HydrophobicContact CE1-CD2 4.09Å; F249-L253 HydrophobicContact CZ-CD2 4.15Å; F249-L253 WeakPolarHBondContact O-CB 3.41Å; F249-L253 PolarHBondContact O-N 3.09Å |
| 250 | F | 91.3 | Very high | 89 | Confident | 58 Ų | 58 | 47.2 Ų | 47.2 | 25% | 0.254 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 176.9 | -78 | -61.8 | 0 | 0 | 0 | 112.5 | W231 L236 V246 I247 Y248 T254 | W231-F250 HydrophobicContact CE3-CE2 4.28Å; W231-F250 HydrophobicContact CH2-CD2 4.1Å; W231-F250 AromaticContact CH2-CE2 3.51Å; W231-F250 HydrophobicContact CH2-CE2 3.51Å; W231-F250 HydrophobicContact CH2-CZ 4.15Å; W231-F250 HydrophobicContact CZ2-CD2 4.32Å; W231-F250 HydrophobicContact CZ2-CE2 4.17Å; W231-F250 HydrophobicContact CZ3-CD2 4.46Å; W231-F250 AromaticContact CZ3-CE2 3.59Å; W231-F250 HydrophobicContact CZ3-CE2 3.59Å; W231-F250 HydrophobicContact CZ3-CZ 4.24Å; L236-F250 HydrophobicContact CD2-CE2 3.64Å; L236-F250 HydrophobicContact CD2-CZ 3.58Å; V246-F250 HydrophobicContact CG1-CD2 3.8Å; V246-F250 HydrophobicContact CG1-CE2 3.6Å; V246-F250 VanDerWaalsContact O-CD2 3.28Å; V246-F250 WeakPolarHBondContact O-CD2 3.37Å; V246-F250 PolarHBondContact O-N 3.48Å; I247-F250 PolarHBondContact O-N 3.1Å; Y248-F250 PolarHBondContact O-N 2.95Å; F250-T254 WeakPolarHBondContact O-CB 3.32Å; F250-T254 PolarHBondContact O-N 2.87Å; F250-T254 PolarHBondContact O-OG1 3.22Å |
| 251 | S | 92.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -68.5 | -46.4 | -178.8 | -55.1 | 0 | 0 | 0 | 0 | 112.4 | I146 I247 Y248 F249 L253 T254 W255 | I146-S251 VanDerWaalsContact CD1-CB 3.49Å; I247-S251 WeakPolarHBondContact O-CB 3.39Å; I247-S251 PolarHBondContact O-N 3.03Å; I247-S251 PolarHBondContact O-OG 3.02Å; Y248-S251 PolarHBondContact O-N 3.11Å; F249-S251 PolarHBondContact O-N 3.27Å; S251-L253 PolarHBondContact O-N 3.23Å; S251-T254 PolarHBondContact O-N 3.06Å; S251-W255 VanDerWaalsContact O-CB 3.3Å; S251-W255 WeakPolarHBondContact O-CB 3.2Å; S251-W255 PolarHBondContact O-N 3.09Å |
| 252 | A | 94.4 | Very high | 90.6 | Very high | 22 Ų | 22 | 42.4 Ų | 42.4 | 18% | 0.182 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -64.4 | -40 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L143 Y248 G256 | L143-A252 HydrophobicContact CD2-CB 4.17Å; Y248-A252 HydrophobicContact CE2-CB 4.16Å; Y248-A252 VanDerWaalsContact O-CB 3.24Å; Y248-A252 WeakPolarHBondContact O-CB 3.42Å; Y248-A252 PolarHBondContact O-N 3.47Å; A252-G256 WeakPolarHBondContact O-CA 3.35Å; A252-G256 PolarHBondContact O-N 3.42Å |
| 253 | L | 94.6 | Very high | 90.9 | Very high | 99 Ų | 99 | 41.3 Ų | 41.3 | 52% | 0.518 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.6 | -48.1 | 174.8 | 179.5 | 63.4 | 0 | 0 | 0 | 111.6 | F249 S251 F257 | F249-L253 HydrophobicContact CE1-CD2 4.09Å; F249-L253 HydrophobicContact CZ-CD2 4.15Å; F249-L253 WeakPolarHBondContact O-CB 3.41Å; F249-L253 PolarHBondContact O-N 3.09Å; S251-L253 PolarHBondContact O-N 3.23Å; L253-F257 VanDerWaalsContact O-CB 3.28Å; L253-F257 WeakPolarHBondContact O-CB 3.43Å; L253-F257 PolarHBondContact O-N 3.32Å |
| 254 | T | 94.3 | Very high | 90.9 | Very high | 26 Ų | 26 | 46.1 Ų | 46.1 | 16% | 0.16 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -63.5 | -48.2 | -178.6 | -60.6 | 0 | 0 | 0 | 0 | 111 | F72 F76 F250 S251 F258 | F72-T254 HydrophobicContact CD1-CG2 4.31Å; F72-T254 HydrophobicContact CE1-CG2 4.1Å; F76-T254 HydrophobicContact CB-CG2 4.39Å; F76-T254 HydrophobicContact CD1-CG2 3.95Å; F76-T254 HydrophobicContact CE1-CG2 4.41Å; F76-T254 HydrophobicContact CG-CG2 4.02Å; F250-T254 WeakPolarHBondContact O-CB 3.32Å; F250-T254 PolarHBondContact O-N 2.87Å; F250-T254 PolarHBondContact O-OG1 3.22Å; S251-T254 PolarHBondContact O-N 3.06Å; T254-F258 HydrophobicContact CG2-CD2 3.81Å; T254-F258 HydrophobicContact CG2-CE2 3.72Å; T254-F258 WeakPolarHBondContact O-CD2 3.32Å; T254-F258 PolarHBondContact O-N 2.88Å; T254-F258 VanDerWaalsContact O-N 3.1Å |
| 255 | W | 95.8 | Very high | 90.5 | Very high | 2 Ų | 2 | 42.8 Ų | 42.8 | 1% | 0.008 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -66.7 | -47.2 | 177.6 | -179 | -130.7 | 0 | 0 | 0 | 112.4 | V70 G73 R74 G139 M142 I188 S251 F257 F258 L259 | V70-W255 HydrophobicContact CG2-CH2 3.69Å; V70-W255 HydrophobicContact CG2-CZ3 3.66Å; V70-W255 WeakPolarHBondContact O-CZ3 3.2Å; G73-W255 VanDerWaalsContact C-CE3 3.44Å; R74-W255 HydrophobicContact CB-CZ3 4.22Å; G139-W255 PolarHBondContact O-NE1 3.47Å; M142-W255 HydrophobicContact CE-CD2 3.6Å; M142-W255 HydrophobicContact CE-CE3 3.98Å; M142-W255 HydrophobicContact CE-CG 3.84Å; M142-W255 HydrophobicContact CE-CZ2 4.22Å; M142-W255 HydrophobicContact CE-CZ3 4.44Å; M142-W255 HydrophobicContact SD-CD2 3.99Å; M142-W255 HydrophobicContact SD-CE3 4.5Å; M142-W255 HydrophobicContact SD-CH2 4.09Å; M142-W255 HydrophobicContact SD-CZ2 3.51Å; M142-W255 VanDerWaalsContact SD-CZ2 3.51Å; I188-W255 HydrophobicContact CD1-CH2 3.85Å; I188-W255 HydrophobicContact CD1-CZ2 3.74Å; S251-W255 VanDerWaalsContact O-CB 3.3Å; S251-W255 WeakPolarHBondContact O-CB 3.2Å; S251-W255 PolarHBondContact O-N 3.09Å; W255-F257 VanDerWaalsContact C-N 3.3Å; W255-F257 PolarHBondContact O-N 3.33Å; W255-F258 PolarHBondContact O-N 3.38Å; W255-L259 HydrophobicContact CD2-CB 4.46Å; W255-L259 HydrophobicContact CH2-CD1 4.39Å; W255-L259 HydrophobicContact CZ2-CB 4.46Å; W255-L259 HydrophobicContact CZ2-CD1 4.11Å; W255-L259 HydrophobicContact CZ2-CD2 4.4Å; W255-L259 WeakPolarHBondContact O-CB 3.13Å; W255-L259 PolarHBondContact O-N 2.98Å |
| 256 | G | 95.1 | Very high | 89.7 | Confident | 21 Ų | 21 | 39.6 Ų | 39.6 | 22% | 0.216 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58 | -41.5 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | A252 T260 | A252-G256 WeakPolarHBondContact O-CA 3.35Å; A252-G256 PolarHBondContact O-N 3.42Å; G256-T260 VanDerWaalsContact O-CB 3.24Å; G256-T260 WeakPolarHBondContact O-CB 3.41Å; G256-T260 PolarHBondContact O-N 3.5Å; G256-T260 VanDerWaalsContact O-N 3.09Å; G256-T260 PolarHBondContact O-OG1 3.26Å |
| 257 | F | 95.1 | Very high | 88.6 | Confident | 119 Ų | 119 | 44 Ų | 44 | 52% | 0.522 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -62.5 | -55.3 | 174.3 | 177.2 | -106.5 | 0 | 0 | 0 | 112 | L253 W255 L259 T260 V261 | L253-F257 VanDerWaalsContact O-CB 3.28Å; L253-F257 WeakPolarHBondContact O-CB 3.43Å; L253-F257 PolarHBondContact O-N 3.32Å; W255-F257 VanDerWaalsContact C-N 3.3Å; W255-F257 PolarHBondContact O-N 3.33Å; F257-L259 PolarHBondContact O-N 3.04Å; F257-T260 PolarHBondContact O-N 2.89Å; F257-V261 HydrophobicContact CD1-CG2 4.42Å; F257-V261 HydrophobicContact CD2-CG2 4.25Å; F257-V261 HydrophobicContact CE1-CG2 4.09Å; F257-V261 HydrophobicContact CE2-CG2 3.9Å; F257-V261 HydrophobicContact CG-CG2 4.5Å; F257-V261 HydrophobicContact CZ-CG2 3.82Å; F257-V261 WeakPolarHBondContact O-CB 3.01Å; F257-V261 VanDerWaalsContact O-CG2 3.3Å; F257-V261 WeakPolarHBondContact O-CG2 3.49Å; F257-V261 PolarHBondContact O-N 3.42Å |
| 258 | F | 94.8 | Very high | 87.5 | Confident | 30 Ų | 30 | 45.4 Ų | 45.4 | 13% | 0.132 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -70.1 | -33.3 | -174.8 | -69.7 | -54 | 0 | 0 | 0 | 113.8 | L69 F72 T254 W255 H262 | L69-F258 HydrophobicContact CB-CD1 3.75Å; L69-F258 HydrophobicContact CB-CE1 4.14Å; L69-F258 HydrophobicContact CD1-CD1 4.28Å; L69-F258 HydrophobicContact CD1-CE1 4.12Å; L69-F258 HydrophobicContact CD2-CD1 4.32Å; L69-F258 HydrophobicContact CD2-CE1 3.83Å; L69-F258 HydrophobicContact CG-CD1 4.34Å; L69-F258 HydrophobicContact CG-CE1 4.26Å; F72-F258 HydrophobicContact CB-CE2 4.49Å; F72-F258 AromaticContact CD1-CD2 3.87Å; F72-F258 HydrophobicContact CD1-CD2 3.87Å; F72-F258 AromaticContact CD1-CE2 3.27Å; F72-F258 HydrophobicContact CD1-CE2 3.27Å; F72-F258 AromaticContact CD1-CZ 3.94Å; F72-F258 HydrophobicContact CD1-CZ 3.94Å; F72-F258 AromaticContact CE1-CE2 3.74Å; F72-F258 HydrophobicContact CE1-CE2 3.74Å; F72-F258 HydrophobicContact CE1-CZ 4.35Å; F72-F258 HydrophobicContact CG-CE2 4.13Å; F72-F258 HydrophobicContact CG-CZ 4.47Å; T254-F258 HydrophobicContact CG2-CD2 3.81Å; T254-F258 HydrophobicContact CG2-CE2 3.72Å; T254-F258 WeakPolarHBondContact O-CD2 3.32Å; T254-F258 PolarHBondContact O-N 2.88Å; T254-F258 VanDerWaalsContact O-N 3.1Å; W255-F258 PolarHBondContact O-N 3.38Å; F258-H262 VanDerWaalsContact O-CB 3.32Å; F258-H262 WeakPolarHBondContact O-CB 3.48Å; F258-H262 PolarHBondContact O-N 3.34Å |
| 259 | L | 93.4 | Very high | 85.8 | Confident | 7 Ų | 7 | 51 Ų | 51 | 4% | 0.037 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 170.9 | -178.8 | 64.5 | 0 | 0 | 0 | 111.2 | I135 L136 W255 F257 H262 L263 | I135-L259 HydrophobicContact CG2-CD1 4.13Å; L136-L259 HydrophobicContact CD1-CD2 4.35Å; W255-L259 HydrophobicContact CD2-CB 4.46Å; W255-L259 HydrophobicContact CH2-CD1 4.39Å; W255-L259 HydrophobicContact CZ2-CB 4.46Å; W255-L259 HydrophobicContact CZ2-CD1 4.11Å; W255-L259 HydrophobicContact CZ2-CD2 4.4Å; W255-L259 WeakPolarHBondContact O-CB 3.13Å; W255-L259 PolarHBondContact O-N 2.98Å; F257-L259 PolarHBondContact O-N 3.04Å; L259-H262 PolarHBondContact O-N 2.84Å; L259-L263 HydrophobicContact CD1-CD1 4.26Å; L259-L263 HydrophobicContact CG-CD1 4.08Å; L259-L263 WeakPolarHBondContact O-CB 3.44Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.43Å; L259-L263 PolarHBondContact O-N 2.96Å |
| 260 | T | 91.5 | Very high | 83.9 | Confident | 73 Ų | 73 | 49.6 Ų | 49.6 | 45% | 0.448 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.5 | -47.9 | 176.4 | -60.6 | 0 | 0 | 0 | 0 | 111.2 | G256 F257 H262 L263 F264 | G256-T260 VanDerWaalsContact O-CB 3.24Å; G256-T260 WeakPolarHBondContact O-CB 3.41Å; G256-T260 PolarHBondContact O-N 3.5Å; G256-T260 VanDerWaalsContact O-N 3.09Å; G256-T260 PolarHBondContact O-OG1 3.26Å; F257-T260 PolarHBondContact O-N 2.89Å; T260-H262 VanDerWaalsContact C-N 3.34Å; T260-H262 PolarHBondContact O-N 3.08Å; T260-L263 PolarHBondContact O-N 3.48Å; T260-F264 HydrophobicContact CG2-CD2 3.89Å; T260-F264 HydrophobicContact CG2-CE2 3.81Å; T260-F264 VanDerWaalsContact O-CD2 3.23Å; T260-F264 WeakPolarHBondContact O-CD2 3.08Å; T260-F264 PolarHBondContact O-N 3.02Å; T260-F264 VanDerWaalsContact O-N 3.16Å |
| 261 | V | 90.9 | Very high | 81.8 | Confident | 25 Ų | 25 | 51.8 Ų | 51.8 | 15% | 0.152 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -56.3 | -46.5 | 177 | 162.3 | 0 | 0 | 0 | 0 | 111.7 | L66 L69 F257 F264 S265 | L66-V261 HydrophobicContact CD1-CG1 3.36Å; L66-V261 HydrophobicContact CG-CG1 3.69Å; L69-V261 HydrophobicContact CD1-CG1 4.18Å; F257-V261 HydrophobicContact CD1-CG2 4.42Å; F257-V261 HydrophobicContact CD2-CG2 4.25Å; F257-V261 HydrophobicContact CE1-CG2 4.09Å; F257-V261 HydrophobicContact CE2-CG2 3.9Å; F257-V261 HydrophobicContact CG-CG2 4.5Å; F257-V261 HydrophobicContact CZ-CG2 3.82Å; F257-V261 WeakPolarHBondContact O-CB 3.01Å; F257-V261 VanDerWaalsContact O-CG2 3.3Å; F257-V261 WeakPolarHBondContact O-CG2 3.49Å; F257-V261 PolarHBondContact O-N 3.42Å; V261-F264 PolarHBondContact O-N 3Å; V261-S265 PolarHBondContact O-N 3.4Å |
| 262 | H | 89.7 | Confident | 79.3 | Confident | 5 Ų | 5 | 57 Ų | 57 | 2% | 0.023 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -61 | -47 | 176.8 | 178.4 | 95 | 0 | 0 | 0 | 112 | H67 V70 F258 L259 T260 F264 S265 | H67-H262 AromaticContact CE1-CE1 3.24Å; H67-H262 PolarHBondContact CE1-CE1 3.1Å; H67-H262 AromaticContact CE1-ND1 3.97Å; H67-H262 AromaticContact ND1-CE1 3.48Å; H67-H262 PolarHBondContact ND1-CE1 3.45Å; H67-H262 AromaticContact ND1-ND1 3.81Å; H67-H262 AromaticContact NE2-CE1 3.82Å; H67-H262 PolarHBondContact O-ND1 3.17Å; V70-H262 HydrophobicContact CB-CB 3.95Å; V70-H262 WeakPolarHBondContact CG1-ND1 3.48Å; V70-H262 HydrophobicContact CG2-CB 4.34Å; F258-H262 VanDerWaalsContact O-CB 3.32Å; F258-H262 WeakPolarHBondContact O-CB 3.48Å; F258-H262 PolarHBondContact O-N 3.34Å; L259-H262 PolarHBondContact O-N 2.84Å; T260-H262 VanDerWaalsContact C-N 3.34Å; T260-H262 PolarHBondContact O-N 3.08Å; H262-F264 PolarHBondContact O-N 2.87Å; H262-F264 VanDerWaalsContact O-N 3.16Å; H262-S265 WeakPolarHBondContact O-CB 3.27Å; H262-S265 PolarHBondContact O-N 2.94Å; H262-S265 VanDerWaalsContact O-N 3.08Å |
| 263 | L | 85.6 | Confident | 76.4 | Confident | 16 Ų | 16 | 64.3 Ų | 64.3 | 8% | 0.084 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -63.9 | -16.9 | 178.3 | -69.8 | 168.5 | 0 | 0 | 0 | 113.7 | R132 L136 L259 T260 | R132-L263 HydrophobicContact CB-CD2 4.38Å; R132-L263 HydrophobicContact CG-CD2 4.39Å; R132-L263 PolarHBondContact NH1-O 3.35Å; R132-L263 PolarHBondContact NH2-O 3Å; L136-L263 HydrophobicContact CB-CD1 4.17Å; L136-L263 HydrophobicContact CB-CD2 4.45Å; L136-L263 HydrophobicContact CD1-CD1 3.78Å; L136-L263 HydrophobicContact CG-CD1 4.47Å; L259-L263 HydrophobicContact CD1-CD1 4.26Å; L259-L263 HydrophobicContact CG-CD1 4.08Å; L259-L263 WeakPolarHBondContact O-CB 3.44Å; L259-L263 VanDerWaalsContact O-CG 3.27Å; L259-L263 WeakPolarHBondContact O-CG 3.43Å; L259-L263 PolarHBondContact O-N 2.96Å; T260-L263 PolarHBondContact O-N 3.48Å |
| 264 | F | 81.6 | Confident | 73.4 | Confident | 159 Ų | 159 | 66.1 Ų | 66.1 | 70% | 0.697 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -104 | -8.2 | 171.9 | -68.8 | -65.3 | 0 | 0 | 0 | 114.7 | T260 V261 H262 | T260-F264 HydrophobicContact CG2-CD2 3.89Å; T260-F264 HydrophobicContact CG2-CE2 3.81Å; T260-F264 VanDerWaalsContact O-CD2 3.23Å; T260-F264 WeakPolarHBondContact O-CD2 3.08Å; T260-F264 PolarHBondContact O-N 3.02Å; T260-F264 VanDerWaalsContact O-N 3.16Å; V261-F264 PolarHBondContact O-N 3Å; H262-F264 PolarHBondContact O-N 2.87Å; H262-F264 VanDerWaalsContact O-N 3.16Å |
| 265 | S | 75 | Confident | 70.6 | Confident | 3 Ų | 3 | 71.3 Ų | 71.3 | 2% | 0.021 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.1 | -52.2 | -169.3 | 177.4 | 0 | 0 | 0 | 0 | 115.5 | R63 L66 H67 V261 H262 | R63-S265 PolarHBondContact NE-O 2.98Å; R63-S265 PolarHBondContact NH2-O 3.41Å; R63-S265 PolarHBondContact O-OG 3.34Å; L66-S265 WeakPolarHBondContact CB-OG 3.36Å; H67-S265 PolarHBondContact N-OG 3.19Å; V261-S265 PolarHBondContact O-N 3.4Å; H262-S265 WeakPolarHBondContact O-CB 3.27Å; H262-S265 PolarHBondContact O-N 2.94Å; H262-S265 VanDerWaalsContact O-N 3.08Å |
| 266 | I | 70.7 | Confident | 67.8 | Low | 3 Ų | 3 | 75.7 Ų | 75.7 | 2% | 0.015 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -134.5 | 118.3 | -178.1 | -47.8 | 173.7 | 0 | 0 | 0 | 108.7 | R63 H67 R132 Y195 V199 E268 | R63-I266 HydrophobicContact CB-CD1 4.47Å; R63-I266 HydrophobicContact CB-CG1 4.2Å; H67-I266 HydrophobicContact CB-CD1 4.36Å; R132-I266 PolarHBondContact NE-O 3.42Å; R132-I266 PolarHBondContact NH2-O 3.09Å; Y195-I266 HydrophobicContact CE1-CB 4.48Å; Y195-I266 PolarHBondContact OH-O 3Å; V199-I266 HydrophobicContact CG1-CB 4.42Å; V199-I266 HydrophobicContact CG1-CD1 3.91Å; V199-I266 HydrophobicContact CG1-CG2 3.72Å; I266-E268 PolarHBondContact O-N 2.93Å |
| 267 | P | 63.3 | Low | 65.2 | Low | 93 Ų | 93 | 81.6 Ų | 81.6 | 60% | 0.604 | 45% | 0.446 | S | S | * | . | P | Polyproline II helix | trans | -66.4 | 126.2 | 177.2 | 27.9 | -33.6 | 0 | 0 | 0 | 110 | ||
| 268 | E | 64.9 | Low | 62.1 | Low | 30 Ų | 30 | 81.1 Ų | 81.1 | 14% | 0.14 | 46% | 0.457 | C | S | . | . | P | Polyproline II helix | trans | -83.7 | 131.2 | 176.3 | -162.3 | 177.3 | 175 | 0 | 0 | 108.6 | G129 R130 R131 R132 Y195 I266 | G129-E268 WeakPolarHBondContact CA-OE2 3.28Å; R130-E268 WeakPolarHBondContact CA-OE1 3.34Å; R130-E268 VanDerWaalsContact CB-OE1 3.27Å; R130-E268 WeakPolarHBondContact CB-OE1 3.4Å; R130-E268 PolarHBondContact N-OE1 3.27Å; R130-E268 PolarHBondContact N-OE2 3.17Å; R131-E268 PolarHBondContact N-OE1 3Å; R131-E268 PolarHBondContact N-OE2 2.91Å; R132-E268 VanDerWaalsContact CD-OE2 3.27Å; R132-E268 WeakPolarHBondContact CD-OE2 3.46Å; R132-E268 WeakPolarHBondContact CG-OE2 3.33Å; R132-E268 PolarHBondContact N-OE2 3.24Å; R132-E268 VanDerWaalsContact N-OE2 3.13Å; Y195-E268 HydrophobicContact CE2-CB 4.31Å; Y195-E268 HydrophobicContact CE2-CG 4.18Å; I266-E268 PolarHBondContact O-N 2.93Å |
| 269 | Q | 55.7 | Low | 58.8 | Low | 180 Ų | 180 | 87.1 Ų | 87.1 | 84% | 0.841 | 49% | 0.491 | S | S | * | . | P | Polyproline II helix | trans | -78.9 | 133.7 | 171.8 | -72.4 | -177 | -16.5 | 0 | 0 | 109.1 | ||
| 270 | P | 52.4 | Low | 55.7 | Low | 70 Ų | 70 | 93.3 Ų | 93.3 | 46% | 0.455 | 53% | 0.533 | S | S | . | . | P | Polyproline II helix | trans | -66.8 | 146 | 176.9 | 28.9 | -34.6 | 0 | 0 | 0 | 110.4 | C272 | P270-C272 PolarHBondContact O-N 2.86Š|
| 271 | L | 46.9 | Very low | 52.6 | Low | 105 Ų | 105 | 94.7 Ų | 94.7 | 55% | 0.55 | 55% | 0.546 | S | S | . | . | trans | -68.7 | 98.1 | 179.8 | -165.4 | 82.5 | 0 | 0 | 0 | 110.3 | ||||
| 272 | C | 39.2 | Very low | 49.5 | Very low | 108 Ų | 108 | 99.7 Ų | 99.7 | 73% | 0.73 | 58% | 0.582 | S | S | * | * | P | Polyproline II helix | trans | -58 | 147.3 | 172 | -72.6 | 0 | 0 | 0 | 0 | 110.9 | P270 | P270-C272 PolarHBondContact O-N 2.86Š|
| 273 | K | 33.9 | Very low | 46.7 | Very low | 176 Ų | 176 | 104.8 Ų | 104.8 | 77% | 0.765 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 140.5 | 167.2 | -65.6 | 177.7 | -179.3 | 175.6 | 0 | 108.8 | P275 | K273-P275 WeakPolarHBondContact O-CD 3.4Š|
| 274 | D | 32 | Very low | 44 | Very low | 138 Ų | 138 | 108.6 Ų | 108.6 | 74% | 0.738 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 123.7 | 162.7 | -59.1 | -71.2 | 0 | 0 | 0 | 109.5 | S276 | D274-S276 PolarHBondContact O-N 2.98Š|
| 275 | P | 35.6 | Very low | 41.7 | Very low | 135 Ų | 135 | 106.5 Ų | 106.5 | 88% | 0.877 | 66% | 0.656 | S | S | * | * | trans | -78.6 | 62.4 | 177.6 | 33.3 | -35.2 | 0 | 0 | 0 | 110.4 | K273 | K273-P275 WeakPolarHBondContact O-CD 3.4Š| ||
| 276 | S | 36.1 | Very low | 39.8 | Very low | 93 Ų | 93 | 113.1 Ų | 113.1 | 65% | 0.65 | 69% | 0.69 | S | S | * | * | trans | -103.2 | 120.8 | 169 | 56.7 | 0 | 0 | 0 | 0 | 109.4 | D274 | D274-S276 PolarHBondContact O-N 2.98Š| ||
| 277 | V | 41.9 | Very low | 37.7 | Very low | 145 Ų | 145 | 124.3 Ų | 124.3 | 88% | 0.879 | 73% | 0.732 | S | S | * | * | S | Bend | trans | 63.7 | 71.4 | -176.8 | -162.2 | 0 | 0 | 0 | 0 | 114.3 | ||
| 278 | S | 29.6 | Very low | 36.2 | Very low | 110 Ų | 110 | 128.1 Ų | 128.1 | 77% | 0.769 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -150.9 | 94.4 | 153.6 | -67.4 | 0 | 0 | 0 | 0 | 108.7 | ||
| 279 | D | 25.7 | Very low | 34.5 | Very low | 155 Ų | 155 | 134.8 Ų | 134.8 | 83% | 0.829 | 78% | 0.782 | S | S | * | * | trans | 33.8 | 118.3 | 166.3 | -53.8 | -30.5 | 0 | 0 | 0 | 120.7 | S281 | D279-S281 PolarHBondContact O-N 3.45Š| ||
| 280 | C | 28.3 | Very low | 33.1 | Very low | 138 Ų | 138 | 129.5 Ų | 129.5 | 93% | 0.932 | 78% | 0.776 | S | S | * | * | trans | -81.2 | 101.1 | 174.7 | -170.6 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 281 | S | 24.9 | Very low | 31.7 | Very low | 102 Ų | 102 | 131.6 Ų | 131.6 | 71% | 0.713 | 79% | 0.792 | S | S | * | * | trans | -165.9 | 84.8 | 158 | 43.5 | 0 | 0 | 0 | 0 | 113.4 | D279 P283 | D279-S281 PolarHBondContact O-N 3.45Å; S281-P283 WeakPolarHBondContact O-CD 3.05Å | ||
| 282 | S | 25.9 | Very low | 30.7 | Very low | 130 Ų | 130 | 135.1 Ų | 135.1 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | trans | -72.8 | 136.5 | 162.3 | -62.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 283 | P | 31.3 | Very low | 30 | Very low | 112 Ų | 112 | 134.9 Ų | 134.9 | 73% | 0.727 | 81% | 0.806 | S | S | * | * | trans | -136.5 | 155.6 | 136.1 | 37.5 | -27.3 | 0 | 0 | 0 | 115 | S281 | S281-P283 WeakPolarHBondContact O-CD 3.05Š| ||
| 284 | S | 30 | Very low | 29.7 | Very low | 95 Ų | 95 | 134 Ų | 134 | 66% | 0.664 | 81% | 0.809 | S | S | * | * | trans | 72.9 | 51.5 | 152.1 | -57.3 | 0 | 0 | 0 | 0 | 120.2 | L286 | S284-L286 PolarHBondContact O-N 3.32Š| ||
| 285 | A | 32.7 | Very low | 29.3 | Very low | 116 Ų | 116 | 130.2 Ų | 130.2 | 96% | 0.959 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -73.7 | 47.9 | 143.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 286 | L | 34.2 | Very low | 28.8 | Very low | 141 Ų | 141 | 135.8 Ų | 135.8 | 74% | 0.738 | 81% | 0.808 | S | S | * | * | trans | -157.2 | 71.2 | -172.8 | -142.7 | 176.1 | 0 | 0 | 0 | 112.9 | S284 | S284-L286 PolarHBondContact O-N 3.32Š| ||
| 287 | R | 27.9 | Very low | 28.5 | Very low | 239 Ų | 239 | 134.9 Ų | 134.9 | 90% | 0.902 | 81% | 0.814 | S | S | * | * | trans | -141.8 | 71.7 | 163.4 | -77.2 | -163 | 173.3 | 178 | -1 | 111.3 | ||||
| 288 | L | 30.7 | Very low | 27.7 | Very low | 173 Ų | 173 | 132.8 Ų | 132.8 | 91% | 0.906 | 81% | 0.812 | S | S | * | * | trans | -131.6 | 56.3 | 166.7 | -144.7 | 171.6 | 0 | 0 | 0 | 110.1 | ||||
| 289 | L | 30.1 | Very low | 27.6 | Very low | 169 Ų | 169 | 136 Ų | 136 | 89% | 0.885 | 82% | 0.819 | S | S | * | * | trans | -142.2 | 126.7 | 165.7 | -103.1 | 165.9 | 0 | 0 | 0 | 106.2 | ||||
| 290 | G | 25.1 | Very low | 27.8 | Very low | 70 Ų | 70 | 133.5 Ų | 133.5 | 72% | 0.722 | 81% | 0.814 | S | S | * | * | trans | -103.3 | -173.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 291 | S | 24.5 | Very low | 27.7 | Very low | 113 Ų | 113 | 136.6 Ų | 136.6 | 79% | 0.79 | 81% | 0.811 | S | S | * | * | trans | 94.2 | 140 | 175.9 | -152.9 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 292 | Q | 25.6 | Very low | 27.8 | Very low | 180 Ų | 180 | 139.7 Ų | 139.7 | 84% | 0.841 | 81% | 0.814 | S | S | * | * | trans | 61.8 | 102.7 | 173.6 | -47.7 | -164.9 | 1.6 | 0 | 0 | 115.5 | ||||
| 293 | S | 24.9 | Very low | 28 | Very low | 103 Ų | 103 | 139.2 Ų | 139.2 | 72% | 0.72 | 81% | 0.808 | S | S | * | * | 80.8 | 136.7 | 54.3 | -161.3 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 294 | N | 25.8 | Very low | 27.7 | Very low | 158 Ų | 158 | 138.4 Ų | 138.4 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | trans | 72 | 143.9 | 178.8 | -46.3 | -7 | 0 | 0 | 0 | 114 | ||||
| 295 | G | 23.8 | Very low | 27.5 | Very low | 58 Ų | 58 | 138.9 Ų | 138.9 | 60% | 0.598 | 81% | 0.809 | S | S | * | * | cis | 165.8 | 156.5 | -5.9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 296 | Y | 26.9 | Very low | 27 | Very low | 251 Ų | 251 | 139.9 Ų | 139.9 | 98% | 0.984 | 80% | 0.803 | S | S | * | * | trans | 65.2 | 149.9 | -174.3 | -52.9 | -86.3 | 0 | 0 | 0 | 115.1 | ||||
| 297 | G | 28 | Very low | 26.6 | Very low | 75 Ų | 75 | 138 Ų | 138 | 77% | 0.773 | 81% | 0.808 | S | S | * | * | cis | 176.2 | 127.4 | -8.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 298 | A | 26.9 | Very low | 26.4 | Very low | 101 Ų | 101 | 131.1 Ų | 131.1 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | trans | -97.2 | 144.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 299 | L | 27 | Very low | 26.8 | Very low | 176 Ų | 176 | 128 Ų | 128 | 92% | 0.921 | 79% | 0.793 | S | S | * | * | trans | -160.5 | 152.3 | 149.6 | -114.3 | 164.8 | 0 | 0 | 0 | 111 | ||||
| 300 | S | 29.3 | Very low | 26.4 | Very low | 103 Ų | 103 | 126.2 Ų | 126.2 | 72% | 0.72 | 79% | 0.789 | S | S | * | * | trans | -110.7 | 150.1 | -172.9 | 50.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 301 | K | 26 | Very low | 26.4 | Very low | 204 Ų | 204 | 127.8 Ų | 127.8 | 89% | 0.887 | 79% | 0.789 | S | S | * | * | trans | -165.6 | 129.8 | 144.3 | -118.4 | 178.6 | 178.6 | 179 | 0 | 112.8 | ||||
| 302 | E | 27.1 | Very low | 26.5 | Very low | 166 Ų | 166 | 128.8 Ų | 128.8 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | trans | -87.8 | 159.4 | 148.8 | -136 | -177.4 | -122.6 | 0 | 0 | 107.6 | ||||
| 303 | P | 31.2 | Very low | 26.4 | Very low | 120 Ų | 120 | 125.4 Ų | 125.4 | 78% | 0.779 | 79% | 0.786 | S | S | * | * | -146 | 174.2 | 82.5 | 39.7 | -22.8 | 0 | 0 | 0 | 115 | |||||
| 304 | S | 25.2 | Very low | 26.4 | Very low | 96 Ų | 96 | 126 Ų | 126 | 67% | 0.671 | 78% | 0.781 | S | S | * | * | trans | -78.7 | 155.7 | 174.9 | 54.8 | 0 | 0 | 0 | 0 | 114 | ||||
| 305 | S | 23.8 | Very low | 26.5 | Very low | 104 Ų | 104 | 124.2 Ų | 124.2 | 73% | 0.727 | 78% | 0.775 | S | S | * | * | 165.5 | 147.4 | 112 | 59.9 | 0 | 0 | 0 | 0 | 115.1 | |||||
| 306 | T | 23.4 | Very low | 26.6 | Very low | 137 Ų | 137 | 131 Ų | 131 | 84% | 0.84 | 78% | 0.783 | S | S | * | * | trans | 69.1 | 139.5 | 152.1 | -26.8 | 0 | 0 | 0 | 0 | 122 | ||||
| 307 | A | 25.7 | Very low | 27 | Very low | 102 Ų | 102 | 124.2 Ų | 124.2 | 84% | 0.843 | 77% | 0.769 | S | S | * | * | trans | 107.8 | 146.2 | 153.4 | 0 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 308 | A | 22.8 | Very low | 26.8 | Very low | 94 Ų | 94 | 132.1 Ų | 132.1 | 78% | 0.777 | 78% | 0.776 | S | S | * | * | trans | -158.9 | 179.6 | -179.9 | 0 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 309 | P | 39 | Very low | 26.5 | Very low | 109 Ų | 109 | 131.3 Ų | 131.3 | 71% | 0.708 | 76% | 0.764 | S | S | * | * | cis | -127.8 | -144.5 | -10 | 39.3 | -19.3 | 0 | 0 | 0 | 111.7 | ||||
| 310 | T | 22.8 | Very low | 26.4 | Very low | 131 Ų | 131 | 133 Ų | 133 | 80% | 0.804 | 76% | 0.76 | S | S | * | * | trans | 68.8 | 148.6 | 166.5 | 39.3 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 311 | S | 24.9 | Very low | 26.1 | Very low | 103 Ų | 103 | 133.8 Ų | 133.8 | 72% | 0.72 | 77% | 0.765 | S | S | * | * | cis | -164.3 | 149 | -7.2 | 47.1 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 312 | V | 26 | Very low | 25.9 | Very low | 134 Ų | 134 | 128.6 Ų | 128.6 | 81% | 0.812 | 76% | 0.761 | S | S | * | * | trans | 5.8 | 141.6 | 134.8 | 171.8 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 313 | S | 24.7 | Very low | 25.8 | Very low | 108 Ų | 108 | 129.6 Ų | 129.6 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | cis | -160.5 | -156.7 | -8.8 | 50.5 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 314 | D | 24.9 | Very low | 25.4 | Very low | 117 Ų | 117 | 126.9 Ų | 126.9 | 63% | 0.626 | 76% | 0.764 | S | S | * | * | cis | -158.2 | -165.4 | 10.2 | 175 | -136.8 | 0 | 0 | 0 | 108.2 | ||||
| 315 | V | 26.9 | Very low | 25.3 | Very low | 120 Ų | 120 | 131.8 Ų | 131.8 | 73% | 0.727 | 78% | 0.776 | S | S | * | * | trans | 96.3 | 121.3 | 152.5 | -174.4 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 316 | R | 25.9 | Very low | 25.1 | Very low | 201 Ų | 201 | 130.8 Ų | 130.8 | 76% | 0.758 | 77% | 0.774 | S | S | * | * | cis | 178.7 | -169.9 | -18.7 | -119.4 | -177.8 | -168.6 | -170.2 | 2.8 | 107.6 | ||||
| 317 | P | 34.7 | Very low | 25.1 | Very low | 107 Ų | 107 | 132.1 Ų | 132.1 | 70% | 0.695 | 78% | 0.776 | S | S | * | * | -103.9 | -151.2 | -64 | 33.7 | -13.3 | 0 | 0 | 0 | 108.7 | |||||
| 318 | R | 23.9 | Very low | 25 | Very low | 242 Ų | 242 | 131.8 Ų | 131.8 | 91% | 0.913 | 77% | 0.773 | S | S | * | * | cis | -157.2 | 175.3 | 11.3 | -148.1 | 170.4 | -166 | 160.9 | 2.5 | 109.1 | ||||
| 319 | S | 21.3 | Very low | 25 | Very low | 84 Ų | 84 | 133.6 Ų | 133.6 | 59% | 0.587 | 77% | 0.774 | S | S | * | * | trans | -143.3 | 166.4 | -166.8 | -164.7 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 320 | Y | 24.1 | Very low | 24.2 | Very low | 211 Ų | 211 | 134.7 Ų | 134.7 | 83% | 0.827 | 78% | 0.78 | S | S | * | * | trans | 78.8 | 153.8 | 159 | -64.5 | -62.9 | 0 | 0 | 0 | 122 | ||||
| 321 | S | 22.7 | Very low | 24.3 | Very low | 120 Ų | 120 | 134 Ų | 134 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | 80.3 | 146.9 | 162 | -55.6 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 322 | A | 22.8 | Very low | 24.2 | Very low | 95 Ų | 95 | 134.3 Ų | 134.3 | 79% | 0.785 | 78% | 0.782 | S | S | * | * | cis | -164.9 | 180 | -19.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 323 | L | 24.4 | Very low | 24.1 | Very low | 186 Ų | 186 | 132.6 Ų | 132.6 | 97% | 0.974 | 78% | 0.776 | S | S | * | * | trans | -64.6 | 155.6 | -176 | -78.3 | 90.8 | 0 | 0 | 0 | 116.3 | ||||
| 324 | G | 23.6 | Very low | 24 | Very low | 63 Ų | 63 | 137.5 Ų | 137.5 | 65% | 0.649 | 78% | 0.784 | S | S | * | * | trans | 159.8 | 101.1 | 164.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 325 | E | 23.1 | Very low | 23.8 | Very low | 199 Ų | 199 | 140 Ų | 140 | 93% | 0.93 | 79% | 0.792 | S | S | * | * | 58.6 | 130.1 | 89.7 | -66.5 | -168.7 | 134 | 0 | 0 | 114.9 | |||||
| 326 | A | 20.3 | Very low | 23.8 | Very low | 83 Ų | 83 | 140.7 Ų | 140.7 | 69% | 0.686 | 80% | 0.799 | S | S | * | * | cis | -162.3 | 159.1 | -16 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 327 | N | 22.6 | Very low | 23.7 | Very low | 165 Ų | 165 | 137.2 Ų | 137.2 | 88% | 0.882 | 80% | 0.795 | S | S | * | * | trans | 42.8 | 99.4 | 160 | -66.1 | -19.9 | 0 | 0 | 0 | 120.7 | ||||
| 328 | A | 22.5 | Very low | 23.2 | Very low | 95 Ų | 95 | 140.7 Ų | 140.7 | 79% | 0.785 | 80% | 0.8 | S | S | * | * | trans | -154.9 | 103.9 | 151.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 329 | V | 23.4 | Very low | 23.3 | Very low | 132 Ų | 132 | 138.9 Ų | 138.9 | 80% | 0.8 | 80% | 0.801 | S | S | * | * | trans | 70.1 | 147.7 | 145.2 | -173.6 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 330 | T | 22.6 | Very low | 23.8 | Very low | 133 Ų | 133 | 143 Ų | 143 | 82% | 0.816 | 81% | 0.811 | S | S | * | * | trans | 69.9 | 113.5 | 167.7 | 30.7 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 331 | S | 24.4 | Very low | 24.6 | Very low | 116 Ų | 116 | 142.3 Ų | 142.3 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | -71.7 | 146.1 | 164.4 | 52 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 332 | S | 22.4 | Very low | 25.4 | Very low | 110 Ų | 110 | 144.3 Ų | 144.3 | 77% | 0.769 | 81% | 0.809 | S | S | * | * | trans | -168.2 | 166.6 | 130.5 | -157 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 333 | S | 24 | Very low | 26.4 | Very low | 98 Ų | 98 | 148.6 Ų | 148.6 | 69% | 0.685 | 81% | 0.81 | S | S | * | * | trans | 48.2 | 90.2 | 153.3 | 63.7 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 334 | K | 22.6 | Very low | 27.8 | Very low | 210 Ų | 210 | 141.3 Ų | 141.3 | 91% | 0.913 | 77% | 0.771 | S | S | * | * | trans | -79.5 | 121.8 | 142 | -99 | -176.2 | 175.3 | 178.7 | 0 | 108.4 | ||||
| 335 | Q | 22.3 | Very low | 29.5 | Very low | 171 Ų | 171 | 142.3 Ų | 142.3 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | trans | -67.3 | 130.9 | 173 | -69 | 178 | -21.1 | 0 | 0 | 110.8 | N337 | Q335-N337 PolarHBondContact O-N 3.03Š| ||
| 336 | P | 25.9 | Very low | 31.2 | Very low | 134 Ų | 134 | 136.6 Ų | 136.6 | 87% | 0.87 | 74% | 0.737 | S | S | * | * | trans | -80.6 | 97.7 | 168.2 | 31.7 | -30.9 | 0 | 0 | 0 | 109.6 | ||||
| 337 | N | 23.4 | Very low | 33.2 | Very low | 128 Ų | 128 | 142.5 Ų | 142.5 | 68% | 0.684 | 74% | 0.742 | S | S | * | * | trans | -90.7 | 143.9 | -179.7 | -159.6 | -10.7 | 0 | 0 | 0 | 111.5 | Q335 | Q335-N337 PolarHBondContact O-N 3.03Š| ||
| 338 | K | 25.1 | Very low | 35 | Very low | 180 Ų | 180 | 136.2 Ų | 136.2 | 78% | 0.783 | 71% | 0.711 | S | S | * | * | trans | 52.6 | 91.4 | 178 | -63.2 | -178.5 | -177.3 | 177.9 | 0 | 115.8 | E340 | K338-E340 PolarHBondContact O-N 3.38Å; K338-E340 VanDerWaalsContact O-N 3.12Å | ||
| 339 | Q | 26.4 | Very low | 37 | Very low | 203 Ų | 203 | 132.1 Ų | 132.1 | 95% | 0.949 | 68% | 0.676 | S | S | * | * | trans | -71.8 | 100.3 | 164.3 | -173.4 | 163.4 | -19.4 | 0 | 0 | 109.9 | ||||
| 340 | E | 31.8 | Very low | 38.8 | Very low | 171 Ų | 171 | 130.6 Ų | 130.6 | 80% | 0.799 | 66% | 0.661 | S | S | * | * | trans | -61.3 | 152.1 | -176.2 | -70.1 | -168.4 | 134.4 | 0 | 0 | 113.9 | K338 K342 | K338-E340 PolarHBondContact O-N 3.38Å; K338-E340 VanDerWaalsContact O-N 3.12Å; E340-K342 VanDerWaalsContact C-N 3.26Å; E340-K342 PolarHBondContact O-N 3.42Å | ||
| 341 | Q | 39.5 | Very low | 40.8 | Very low | 197 Ų | 197 | 130.3 Ų | 130.3 | 92% | 0.921 | 65% | 0.648 | S | S | * | * | trans | -70.4 | 70.1 | -172.1 | -169.4 | 175.5 | -6.8 | 0 | 0 | 112.8 | K343 | Q341-K343 PolarHBondContact O-N 3.22Å; Q341-K343 VanDerWaalsContact O-N 3.09Å | ||
| 342 | K | 39.5 | Very low | 42.6 | Very low | 161 Ų | 161 | 125.8 Ų | 125.8 | 70% | 0.7 | 62% | 0.618 | S | S | * | * | trans | -78.9 | 93.7 | -168.2 | -165 | 172.2 | -169.6 | 169.4 | 0 | 113 | E340 M344 | E340-K342 VanDerWaalsContact C-N 3.26Å; E340-K342 PolarHBondContact O-N 3.42Å; K342-M344 PolarHBondContact O-N 2.95Å | ||
| 343 | K | 43.9 | Very low | 44.7 | Very low | 186 Ų | 186 | 122.6 Ų | 122.6 | 81% | 0.809 | 59% | 0.592 | S | S | * | * | trans | -48 | 126.7 | 162.5 | -73.2 | -175.3 | 175.1 | -177.5 | 0 | 109.6 | Q341 T345 | Q341-K343 PolarHBondContact O-N 3.22Å; Q341-K343 VanDerWaalsContact O-N 3.09Å; K343-T345 PolarHBondContact O-N 3.47Å; K343-T345 VanDerWaalsContact O-N 3.17Å | ||
| 344 | M | 54.5 | Low | 46.7 | Very low | 32 Ų | 32 | 122.8 Ų | 122.8 | 16% | 0.158 | 58% | 0.584 | C | S | . | * | trans | -74.9 | 109 | 179.3 | -68.6 | -142.7 | -71.9 | 0 | 0 | 110.6 | K342 M515 | K342-M344 PolarHBondContact O-N 2.95Å; M344-M515 HydrophobicContact CE-CB 4.25Å; M344-M515 HydrophobicContact CE-CG 3.97Å; M344-M515 HydrophobicContact CE-SD 3.64Å; M344-M515 HydrophobicContact SD-SD 3.81Å | ||
| 345 | T | 60 | Low | 48.6 | Very low | 85 Ų | 85 | 118.7 Ų | 118.7 | 52% | 0.521 | 57% | 0.568 | S | S | . | * | trans | -81.8 | 164.4 | 169.9 | 57.9 | 0 | 0 | 0 | 0 | 110.8 | K343 R347 S348 L349 | K343-T345 PolarHBondContact O-N 3.47Å; K343-T345 VanDerWaalsContact O-N 3.17Å; T345-R347 PolarHBondContact O-N 3.09Å; T345-R347 VanDerWaalsContact O-N 3.16Å; T345-S348 VanDerWaalsContact O-CA 3.32Å; T345-S348 WeakPolarHBondContact O-CA 3.49Å; T345-S348 WeakPolarHBondContact O-CB 3.31Å; T345-S348 PolarHBondContact O-N 3.19Å; T345-L349 PolarHBondContact O-N 3.26Å | ||
| 346 | F | 58.6 | Low | 50.6 | Low | 78 Ų | 78 | 111 Ų | 111 | 34% | 0.342 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -49.4 | -40.1 | 174.1 | 180 | -102.9 | 0 | 0 | 0 | 113.4 | F111 L112 S348 L349 M350 | F111-F346 HydrophobicContact CD1-CE2 4.03Å; F111-F346 AromaticContact CE1-CE2 3.53Å; F111-F346 HydrophobicContact CE1-CE2 3.53Å; F111-F346 AromaticContact CE1-CZ 3.77Å; F111-F346 HydrophobicContact CE1-CZ 3.77Å; F111-F346 HydrophobicContact CZ-CE2 4.02Å; F111-F346 HydrophobicContact CZ-CZ 4.29Å; L112-F346 HydrophobicContact CD2-CD2 4.15Å; L112-F346 HydrophobicContact CD2-CE2 4.27Å; F346-S348 PolarHBondContact O-N 3.05Å; F346-L349 PolarHBondContact O-N 2.95Å; F346-L349 VanDerWaalsContact O-N 3.11Å; F346-M350 PolarHBondContact O-N 3.21Å |
| 347 | R | 62 | Low | 52.9 | Low | 208 Ų | 208 | 106.5 Ų | 106.5 | 79% | 0.785 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62 | -24 | 175 | -164.4 | 176.8 | -173.6 | -174.9 | 3.6 | 113.1 | T345 K351 | T345-R347 PolarHBondContact O-N 3.09Å; T345-R347 VanDerWaalsContact O-N 3.16Å; R347-K351 WeakPolarHBondContact O-CB 3.43Å; R347-K351 PolarHBondContact O-N 3.17Å |
| 348 | S | 61 | Low | 55.4 | Low | 33 Ų | 33 | 105.6 Ų | 105.6 | 23% | 0.231 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -79.3 | -40.7 | 173.2 | -153.3 | 0 | 0 | 0 | 0 | 112 | T345 F346 K351 A352 | T345-S348 VanDerWaalsContact O-CA 3.32Å; T345-S348 WeakPolarHBondContact O-CA 3.49Å; T345-S348 WeakPolarHBondContact O-CB 3.31Å; T345-S348 PolarHBondContact O-N 3.19Å; F346-S348 PolarHBondContact O-N 3.05Å; S348-K351 PolarHBondContact O-N 3.46Å; S348-A352 WeakPolarHBondContact O-CB 3.38Å; S348-A352 PolarHBondContact O-N 3.41Å |
| 349 | L | 63.1 | Low | 58 | Low | 8 Ų | 8 | 100.3 Ų | 100.3 | 4% | 0.042 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -59.4 | -53.5 | 172.2 | -179.7 | 85.3 | 0 | 0 | 0 | 110.4 | P115 T345 F346 K351 A352 I353 A519 | P115-L349 HydrophobicContact CB-CB 4.1Å; P115-L349 HydrophobicContact CB-CD1 4.04Å; P115-L349 HydrophobicContact CB-CG 4.41Å; P115-L349 HydrophobicContact CG-CB 4.09Å; P115-L349 HydrophobicContact CG-CD1 3.89Å; P115-L349 HydrophobicContact CG-CD2 3.65Å; P115-L349 HydrophobicContact CG-CG 4.04Å; T345-L349 PolarHBondContact O-N 3.26Å; F346-L349 PolarHBondContact O-N 2.95Å; F346-L349 VanDerWaalsContact O-N 3.11Å; L349-K351 PolarHBondContact O-N 3.05Å; L349-A352 WeakPolarHBondContact O-CA 3.4Å; L349-A352 WeakPolarHBondContact O-CB 3.26Å; L349-A352 PolarHBondContact O-N 3.08Å; L349-I353 HydrophobicContact CD1-CD1 4.31Å; L349-I353 HydrophobicContact CD2-CD1 3.88Å; L349-I353 HydrophobicContact CG-CD1 3.75Å; L349-I353 HydrophobicContact CG-CG1 4.37Å; L349-I353 WeakPolarHBondContact O-CG1 3.06Å; L349-I353 PolarHBondContact O-N 3.45Å; L349-A519 HydrophobicContact CD1-CB 4.22Å |
| 350 | M | 62.3 | Low | 60.6 | Low | 100 Ų | 100 | 90.9 Ų | 90.9 | 49% | 0.493 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -59.8 | -36.9 | -177.6 | -166.4 | 170.4 | 71.8 | 0 | 0 | 111.4 | F346 I354 | F346-M350 PolarHBondContact O-N 3.21Å; M350-I354 HydrophobicContact CG-CD1 4.16Å; M350-I354 WeakPolarHBondContact O-CB 3.38Å; M350-I354 WeakPolarHBondContact O-CD1 3.47Å; M350-I354 WeakPolarHBondContact O-CG1 3.5Å; M350-I354 PolarHBondContact O-N 3Å; M350-I354 VanDerWaalsContact O-N 3.08Å |
| 351 | K | 64.1 | Low | 63 | Low | 127 Ų | 127 | 87.5 Ų | 87.5 | 55% | 0.552 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -70.4 | -34.2 | 172.8 | -169.9 | 167.8 | -175.9 | 175.7 | 0 | 113.2 | R347 S348 L349 I354 H355 | R347-K351 WeakPolarHBondContact O-CB 3.43Å; R347-K351 PolarHBondContact O-N 3.17Å; S348-K351 PolarHBondContact O-N 3.46Å; L349-K351 PolarHBondContact O-N 3.05Å; K351-I354 PolarHBondContact O-N 3.11Å; K351-H355 VanDerWaalsContact CE-CD2 3.46Å; K351-H355 WeakPolarHBondContact CE-CD2 3.27Å; K351-H355 WeakPolarHBondContact CE-NE2 3.33Å; K351-H355 WeakPolarHBondContact O-CB 3.32Å; K351-H355 PolarHBondContact O-N 2.83Å |
| 352 | A | 63.3 | Low | 65.2 | Low | 21 Ų | 21 | 79.2 Ų | 79.2 | 17% | 0.174 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -67.5 | -42.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | S348 L349 H355 M356 M515 | S348-A352 WeakPolarHBondContact O-CB 3.38Å; S348-A352 PolarHBondContact O-N 3.41Å; L349-A352 WeakPolarHBondContact O-CA 3.4Å; L349-A352 WeakPolarHBondContact O-CB 3.26Å; L349-A352 PolarHBondContact O-N 3.08Å; A352-H355 CarbonylContact O-C 3.43Å; A352-H355 PolarHBondContact O-N 3.02Å; A352-M356 WeakPolarHBondContact O-CG 3.37Å; A352-M356 PolarHBondContact O-N 3.34Å; A352-M515 HydrophobicContact CB-SD 4.38Å |
| 353 | I | 65.9 | Low | 67.5 | Low | 43 Ų | 43 | 71.6 Ų | 71.6 | 22% | 0.221 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -61.5 | -44.9 | 173.6 | -65.2 | 164.2 | 0 | 0 | 0 | 110.4 | L349 H355 M356 R361 M523 | L349-I353 HydrophobicContact CD1-CD1 4.31Å; L349-I353 HydrophobicContact CD2-CD1 3.88Å; L349-I353 HydrophobicContact CG-CD1 3.75Å; L349-I353 HydrophobicContact CG-CG1 4.37Å; L349-I353 WeakPolarHBondContact O-CG1 3.06Å; L349-I353 PolarHBondContact O-N 3.45Å; I353-H355 VanDerWaalsContact C-N 3.31Å; I353-H355 PolarHBondContact O-N 3.01Å; I353-M356 HydrophobicContact CG1-CE 4.46Å; I353-M356 PolarHBondContact O-N 2.88Å; I353-R361 WeakPolarHBondContact O-CD 3.29Å; I353-M523 HydrophobicContact CD1-CE 3.72Å; I353-M523 HydrophobicContact CG1-CE 4.14Å; I353-M523 HydrophobicContact CG2-CE 4.19Å |
| 354 | I | 64.9 | Low | 69.6 | Low | 102 Ų | 102 | 63.2 Ų | 63.2 | 52% | 0.523 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.3 | -31 | 177.9 | -70.4 | 166.8 | 0 | 0 | 0 | 112.4 | M350 K351 | M350-I354 HydrophobicContact CG-CD1 4.16Å; M350-I354 WeakPolarHBondContact O-CB 3.38Å; M350-I354 WeakPolarHBondContact O-CD1 3.47Å; M350-I354 WeakPolarHBondContact O-CG1 3.5Å; M350-I354 PolarHBondContact O-N 3Å; M350-I354 VanDerWaalsContact O-N 3.08Å; K351-I354 PolarHBondContact O-N 3.11Å |
| 355 | H | 63.8 | Low | 71.3 | Confident | 125 Ų | 125 | 65.5 Ų | 65.5 | 58% | 0.579 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99 | 13.3 | 178.1 | -66.2 | -22 | 0 | 0 | 0 | 114.4 | K351 A352 I353 | K351-H355 VanDerWaalsContact CE-CD2 3.46Å; K351-H355 WeakPolarHBondContact CE-CD2 3.27Å; K351-H355 WeakPolarHBondContact CE-NE2 3.33Å; K351-H355 WeakPolarHBondContact O-CB 3.32Å; K351-H355 PolarHBondContact O-N 2.83Å; A352-H355 CarbonylContact O-C 3.43Å; A352-H355 PolarHBondContact O-N 3.02Å; I353-H355 VanDerWaalsContact C-N 3.31Å; I353-H355 PolarHBondContact O-N 3.01Å |
| 356 | M | 64.7 | Low | 72.7 | Confident | 9 Ų | 9 | 61.4 Ų | 61.4 | 4% | 0.044 | 29% | 0.294 | C | S | . | . | S | Bend | trans | -69.6 | 145.3 | 172.7 | -92.6 | 167.2 | -166.4 | 0 | 0 | 111.7 | A352 I353 R361 R511 A519 | A352-M356 WeakPolarHBondContact O-CG 3.37Å; A352-M356 PolarHBondContact O-N 3.34Å; I353-M356 HydrophobicContact CG1-CE 4.46Å; I353-M356 PolarHBondContact O-N 2.88Å; M356-R361 HydrophobicContact CB-CG 3.46Å; M356-R361 VanDerWaalsContact CB-CG 3.46Å; M356-R361 WeakPolarHBondContact O-CD 3.5Å; M356-R361 PolarHBondContact O-NE 3.09Å; M356-R511 VanDerWaalsContact CE-NH2 3.28Å; M356-R511 VanDerWaalsContact CG-NH2 3.27Å; M356-A519 HydrophobicContact CE-CB 3.59Å |
| 357 | P | 73 | Confident | 74.2 | Confident | 39 Ų | 39 | 57.7 Ų | 57.7 | 25% | 0.253 | 28% | 0.278 | S | S | . | . | trans | -52.9 | 153.1 | 166 | -23.6 | 31.8 | 0 | 0 | 0 | 112.2 | H359 Y360 R361 | P357-H359 VanDerWaalsContact C-N 3.33Å; P357-H359 WeakPolarHBondContact CB-NE2 3.3Å; P357-H359 PolarHBondContact O-N 3.35Å; P357-Y360 HydrophobicContact CB-CD2 3.99Å; P357-Y360 HydrophobicContact CG-CD2 3.86Å; P357-Y360 HydrophobicContact CG-CE2 4.19Å; P357-Y360 PolarHBondContact O-N 3.44Å; P357-R361 PolarHBondContact O-N 2.9Å; P357-R361 VanDerWaalsContact O-N 3.16Å | ||
| 358 | N | 76.4 | Confident | 75.7 | Confident | 109 Ų | 109 | 49.5 Ų | 49.5 | 58% | 0.583 | 25% | 0.249 | S | C | * | . | H | α-helix | trans | -56.8 | -43.2 | -170.8 | -65.9 | -2.1 | 0 | 0 | 0 | 112.9 | Y360 R361 C362 | N358-Y360 PolarHBondContact O-N 2.96Å; N358-R361 PolarHBondContact O-N 3.37Å; N358-R361 VanDerWaalsContact O-N 3.17Å; N358-R361 PolarHBondContact OD1-NH2 2.98Å; N358-C362 PolarHBondContact O-N 3.35Å; N358-C362 PolarHBondContact O-SG 3Å |
| 359 | H | 79.1 | Confident | 77.1 | Confident | 69 Ų | 69 | 49.5 Ų | 49.5 | 32% | 0.319 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.5 | -45.5 | 179.8 | 45.6 | -103.3 | 0 | 0 | 0 | 112.9 | P357 R361 C362 L363 Y493 | P357-H359 VanDerWaalsContact C-N 3.33Å; P357-H359 WeakPolarHBondContact CB-NE2 3.3Å; P357-H359 PolarHBondContact O-N 3.35Å; H359-R361 VanDerWaalsContact C-N 3.32Å; H359-R361 PolarHBondContact O-N 2.89Å; H359-C362 PolarHBondContact O-N 2.93Å; H359-L363 WeakPolarHBondContact O-CB 3.46Å; H359-L363 PolarHBondContact O-N 2.93Å; H359-Y493 HydrophobicContact CB-CE2 4.28Å |
| 360 | Y | 80.3 | Confident | 78.5 | Confident | 6 Ų | 6 | 49.1 Ų | 49.1 | 2% | 0.024 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -65.2 | -35 | 175.7 | -66.3 | -72.8 | 0 | 0 | 0 | 112.2 | P357 N358 L363 C364 Y493 Q494 E497 | P357-Y360 HydrophobicContact CB-CD2 3.99Å; P357-Y360 HydrophobicContact CG-CD2 3.86Å; P357-Y360 HydrophobicContact CG-CE2 4.19Å; P357-Y360 PolarHBondContact O-N 3.44Å; N358-Y360 PolarHBondContact O-N 2.96Å; Y360-L363 PolarHBondContact O-N 3.42Å; Y360-C364 PolarHBondContact O-N 3.49Å; Y360-C364 PolarHBondContact O-SG 3.33Å; Y360-Y493 HydrophobicContact CD1-CD2 4.09Å; Y360-Y493 AromaticContact CE1-CD2 3.98Å; Y360-Y493 HydrophobicContact CE1-CD2 3.98Å; Y360-Y493 HydrophobicContact CE1-CG 4.38Å; Y360-Q494 PolarHBondContact OH-N 2.9Å; Y360-E497 VanDerWaalsContact CE2-OE2 3.22Å; Y360-E497 WeakPolarHBondContact CE2-OE2 3.3Å; Y360-E497 PolarHBondContact OH-OE2 2.87Å |
| 361 | R | 82.8 | Confident | 79.9 | Confident | 100 Ų | 100 | 44.9 Ų | 44.9 | 38% | 0.377 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -67.1 | -43.3 | 176.1 | -67.3 | -167.8 | -71.6 | 150.7 | 0.1 | 111.8 | I353 M356 P357 N358 H359 L363 C364 I365 | I353-R361 WeakPolarHBondContact O-CD 3.29Å; M356-R361 HydrophobicContact CB-CG 3.46Å; M356-R361 VanDerWaalsContact CB-CG 3.46Å; M356-R361 WeakPolarHBondContact O-CD 3.5Å; M356-R361 PolarHBondContact O-NE 3.09Å; P357-R361 PolarHBondContact O-N 2.9Å; P357-R361 VanDerWaalsContact O-N 3.16Å; N358-R361 PolarHBondContact O-N 3.37Å; N358-R361 VanDerWaalsContact O-N 3.17Å; N358-R361 PolarHBondContact OD1-NH2 2.98Å; H359-R361 VanDerWaalsContact C-N 3.32Å; H359-R361 PolarHBondContact O-N 2.89Å; R361-L363 VanDerWaalsContact C-N 3.34Å; R361-C364 PolarHBondContact O-N 3.26Å; R361-I365 WeakPolarHBondContact O-CG1 3.22Å; R361-I365 PolarHBondContact O-N 3.44Å |
| 362 | C | 86.2 | Confident | 81.2 | Confident | 22 Ų | 22 | 39 Ų | 39 | 15% | 0.149 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -59.4 | -45.4 | 172.7 | -63.6 | 0 | 0 | 0 | 0 | 111.3 | N358 H359 C364 I365 S366 F562 F566 I567 | N358-C362 PolarHBondContact O-N 3.35Å; N358-C362 PolarHBondContact O-SG 3Å; H359-C362 PolarHBondContact O-N 2.93Å; C362-C364 PolarHBondContact O-N 3.41Å; C362-I365 PolarHBondContact O-N 3.1Å; C362-S366 WeakPolarHBondContact O-CB 3.41Å; C362-S366 PolarHBondContact O-N 3.26Å; C362-F562 HydrophobicContact CB-CE1 3.96Å; C362-F562 HydrophobicContact CB-CZ 4.23Å; C362-F562 WeakPolarHBondContact O-CE1 3.36Å; C362-F566 HydrophobicContact CB-CB 4.17Å; C362-F566 WeakPolarHBondContact CB-O 3.06Å; C362-I567 HydrophobicContact CB-CG1 4.18Å |
| 363 | L | 87.6 | Confident | 82.5 | Confident | 1 Ų | 1 | 38 Ų | 38 | 1% | 0.005 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.8 | -44.6 | 177.2 | -174.1 | 62.1 | 0 | 0 | 0 | 112.2 | H359 Y360 R361 S366 H367 Y445 P486 L489 I490 Y493 I567 | H359-L363 WeakPolarHBondContact O-CB 3.46Å; H359-L363 PolarHBondContact O-N 2.93Å; Y360-L363 PolarHBondContact O-N 3.42Å; R361-L363 VanDerWaalsContact C-N 3.34Å; L363-S366 PolarHBondContact O-N 3.34Å; L363-H367 WeakPolarHBondContact O-CB 3.35Å; L363-H367 PolarHBondContact O-N 2.87Å; L363-Y445 HydrophobicContact CD1-CE1 4.29Å; L363-P486 HydrophobicContact CD1-CB 4.25Å; L363-L489 HydrophobicContact CD1-CB 4.33Å; L363-L489 HydrophobicContact CD1-CD1 3.77Å; L363-L489 HydrophobicContact CD2-CB 3.97Å; L363-I490 HydrophobicContact CD2-CG1 3.77Å; L363-Y493 HydrophobicContact CD2-CD2 4.48Å; L363-Y493 HydrophobicContact CD2-CE2 4.1Å; L363-I567 HydrophobicContact CD1-CD1 4.32Å |
| 364 | C | 87.6 | Confident | 83.7 | Confident | 11 Ų | 11 | 36.7 Ų | 36.7 | 7% | 0.074 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -62.8 | -43.1 | 176.8 | -68.1 | 0 | 0 | 0 | 0 | 112.8 | Y360 R361 C362 H367 L368 M523 | Y360-C364 PolarHBondContact O-N 3.49Å; Y360-C364 PolarHBondContact O-SG 3.33Å; R361-C364 PolarHBondContact O-N 3.26Å; C362-C364 PolarHBondContact O-N 3.41Å; C364-H367 PolarHBondContact O-N 2.89Å; C364-L368 WeakPolarHBondContact O-CB 3.37Å; C364-L368 PolarHBondContact O-N 3.25Å; C364-M523 HydrophobicContact CB-CE 4.04Å; C364-M523 HydrophobicContact CB-CG 4.13Å; C364-M523 HydrophobicContact CB-SD 4.38Å |
| 365 | I | 89.8 | Confident | 84.8 | Confident | 79 Ų | 79 | 32.8 Ų | 32.8 | 41% | 0.405 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.7 | -44.5 | 178.3 | -69.2 | 164.9 | 0 | 0 | 0 | 110.6 | R361 C362 L368 L369 F562 | R361-I365 WeakPolarHBondContact O-CG1 3.22Å; R361-I365 PolarHBondContact O-N 3.44Å; C362-I365 PolarHBondContact O-N 3.1Å; I365-L368 PolarHBondContact O-N 2.96Å; I365-L369 HydrophobicContact CG2-CD1 4.26Å; I365-L369 WeakPolarHBondContact O-CG 3.48Å; I365-L369 PolarHBondContact O-N 3.18Å; I365-L369 VanDerWaalsContact O-N 3.08Å; I365-F562 HydrophobicContact CB-CE1 4.26Å; I365-F562 HydrophobicContact CB-CZ 4Å; I365-F562 HydrophobicContact CD1-CZ 4.38Å; I365-F562 HydrophobicContact CG2-CD2 4.38Å; I365-F562 HydrophobicContact CG2-CE1 4.15Å; I365-F562 HydrophobicContact CG2-CE2 3.86Å; I365-F562 HydrophobicContact CG2-CZ 3.74Å |
| 366 | S | 90.3 | Very high | 85.9 | Confident | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.5 | -48.3 | 174.3 | 172.5 | 0 | 0 | 0 | 0 | 111.1 | C362 L363 L368 L369 G370 Y445 Y449 I563 | C362-S366 WeakPolarHBondContact O-CB 3.41Å; C362-S366 PolarHBondContact O-N 3.26Å; L363-S366 PolarHBondContact O-N 3.34Å; S366-L368 VanDerWaalsContact C-N 3.32Å; S366-L368 PolarHBondContact O-N 3.49Å; S366-L369 WeakPolarHBondContact O-CB 3.24Å; S366-L369 PolarHBondContact O-N 3.16Å; S366-L369 VanDerWaalsContact O-N 3.09Å; S366-G370 PolarHBondContact O-N 2.84Å; S366-Y445 WeakPolarHBondContact OG-CE1 3.31Å; S366-Y445 PolarHBondContact OG-OH 3.14Å; S366-Y449 PolarHBondContact O-OH 3.13Å; S366-Y449 PolarHBondContact OG-OH 3.21Å; S366-I563 WeakPolarHBondContact OG-CG1 3.4Å |
| 367 | H | 91.3 | Very high | 86.8 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -58.6 | -42 | 179.6 | -160.4 | 64.5 | 0 | 0 | 0 | 112.6 | L363 C364 G370 W371 Y445 L482 P486 L520 | L363-H367 WeakPolarHBondContact O-CB 3.35Å; L363-H367 PolarHBondContact O-N 2.87Å; C364-H367 PolarHBondContact O-N 2.89Å; H367-G370 PolarHBondContact O-N 3.31Å; H367-W371 AromaticContact CD2-CD1 3.58Å; H367-W371 AromaticContact CD2-NE1 3.77Å; H367-W371 AromaticContact CE1-CD1 3.54Å; H367-W371 AromaticContact CE1-NE1 3.08Å; H367-W371 PolarHBondContact CE1-NE1 2.87Å; H367-W371 AromaticContact CG-CD1 3.81Å; H367-W371 AromaticContact ND1-CD1 3.75Å; H367-W371 AromaticContact ND1-NE1 3.73Å; H367-W371 AromaticContact NE2-CD1 3.4Å; H367-W371 AromaticContact NE2-NE1 3.07Å; H367-W371 PolarHBondContact NE2-NE1 2.71Å; H367-W371 WeakPolarHBondContact O-CB 3.43Å; H367-W371 PolarHBondContact O-N 2.98Å; H367-Y445 PolarHBondContact N-OH 3.48Å; H367-L482 PolarHBondContact CE1-O 2.95Å; H367-P486 VanDerWaalsContact ND1-CG 3.32Å; H367-P486 WeakPolarHBondContact ND1-CG 3.34Å; H367-L520 HydrophobicContact CB-CD1 3.69Å; H367-L520 WeakPolarHBondContact CD2-CD1 3.41Å |
| 368 | L | 91.8 | Very high | 87.3 | Confident | 36 Ų | 36 | 26 Ų | 26 | 19% | 0.188 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -58.3 | -47 | 173.6 | -179.8 | 68.7 | 0 | 0 | 0 | 111.6 | C364 I365 S366 A372 M523 L526 A527 I530 | C364-L368 WeakPolarHBondContact O-CB 3.37Å; C364-L368 PolarHBondContact O-N 3.25Å; I365-L368 PolarHBondContact O-N 2.96Å; S366-L368 VanDerWaalsContact C-N 3.32Å; S366-L368 PolarHBondContact O-N 3.49Å; L368-A372 WeakPolarHBondContact O-CB 3.15Å; L368-A372 PolarHBondContact O-N 3.38Å; L368-M523 HydrophobicContact CB-CB 4.29Å; L368-M523 HydrophobicContact CD1-CB 4.45Å; L368-M523 VanDerWaalsContact CD1-O 3.26Å; L368-M523 WeakPolarHBondContact CD1-O 3.46Å; L368-L526 HydrophobicContact CD1-CB 3.84Å; L368-L526 HydrophobicContact CD1-CD2 3.98Å; L368-L526 HydrophobicContact CD1-CG 3.81Å; L368-L526 HydrophobicContact CD2-CD2 4.22Å; L368-A527 HydrophobicContact CD1-CB 4.06Å; L368-I530 HydrophobicContact CD1-CD1 4.46Å |
| 369 | L | 91.4 | Very high | 87.3 | Confident | 32 Ų | 32 | 24.5 Ų | 24.5 | 17% | 0.168 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -65.3 | -42.1 | 178.6 | -70.5 | 170 | 0 | 0 | 0 | 112.4 | I365 S366 A372 A373 M555 I558 | I365-L369 HydrophobicContact CG2-CD1 4.26Å; I365-L369 WeakPolarHBondContact O-CG 3.48Å; I365-L369 PolarHBondContact O-N 3.18Å; I365-L369 VanDerWaalsContact O-N 3.08Å; S366-L369 WeakPolarHBondContact O-CB 3.24Å; S366-L369 PolarHBondContact O-N 3.16Å; S366-L369 VanDerWaalsContact O-N 3.09Å; L369-A372 PolarHBondContact O-N 3.49Å; L369-A373 WeakPolarHBondContact O-CB 3.44Å; L369-A373 PolarHBondContact O-N 2.67Å; L369-M555 HydrophobicContact CD2-CE 3.8Å; L369-I558 HydrophobicContact CD1-CG2 4.24Å |
| 370 | G | 91.8 | Very high | 87.1 | Confident | 0 Ų | 0 | 23.6 Ų | 23.6 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -67.3 | -44.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.2 | S366 H367 A373 F374 Y449 | S366-G370 PolarHBondContact O-N 2.84Å; H367-G370 PolarHBondContact O-N 3.31Å; G370-A373 PolarHBondContact O-N 2.92Å; G370-F374 WeakPolarHBondContact O-CB 3.18Å; G370-F374 PolarHBondContact O-N 3.41Å; G370-Y449 VanDerWaalsContact CA-CE1 3.46Å; G370-Y449 VanDerWaalsContact CA-OH 3.29Å; G370-Y449 WeakPolarHBondContact CA-OH 3.48Å; G370-Y449 PolarHBondContact N-OH 3.49Å |
| 371 | W | 92.1 | Very high | 87.1 | Confident | 12 Ų | 12 | 23.4 Ų | 23.4 | 5% | 0.045 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -65.8 | -38.6 | 173.2 | -82.4 | 108.4 | 0 | 0 | 0 | 112.2 | H367 F374 L375 L482 Y483 V524 A527 | H367-W371 AromaticContact CD2-CD1 3.58Å; H367-W371 AromaticContact CD2-NE1 3.77Å; H367-W371 AromaticContact CE1-CD1 3.54Å; H367-W371 AromaticContact CE1-NE1 3.08Å; H367-W371 PolarHBondContact CE1-NE1 2.87Å; H367-W371 AromaticContact CG-CD1 3.81Å; H367-W371 AromaticContact ND1-CD1 3.75Å; H367-W371 AromaticContact ND1-NE1 3.73Å; H367-W371 AromaticContact NE2-CD1 3.4Å; H367-W371 AromaticContact NE2-NE1 3.07Å; H367-W371 PolarHBondContact NE2-NE1 2.71Å; H367-W371 WeakPolarHBondContact O-CB 3.43Å; H367-W371 PolarHBondContact O-N 2.98Å; W371-F374 AromaticContact CE3-CD1 3.85Å; W371-F374 HydrophobicContact CE3-CD1 3.85Å; W371-F374 AromaticContact CZ3-CD1 3.62Å; W371-F374 HydrophobicContact CZ3-CD1 3.62Å; W371-F374 AromaticContact CZ3-CE1 3.9Å; W371-F374 HydrophobicContact CZ3-CE1 3.9Å; W371-F374 PolarHBondContact O-N 3.21Å; W371-L375 HydrophobicContact CB-CD1 4.3Å; W371-L375 HydrophobicContact CE3-CD1 4.3Å; W371-L375 HydrophobicContact CE3-CD2 4.47Å; W371-L375 HydrophobicContact CE3-CG 4.14Å; W371-L375 WeakPolarHBondContact O-CB 3.17Å; W371-L375 WeakPolarHBondContact O-CD1 3.28Å; W371-L375 WeakPolarHBondContact O-CG 3.14Å; W371-L375 PolarHBondContact O-N 2.99Å; W371-L482 HydrophobicContact CD2-CB 4.48Å; W371-L482 HydrophobicContact CD2-CD1 3.95Å; W371-L482 HydrophobicContact CE3-CD1 4.24Å; W371-L482 HydrophobicContact CG-CD1 4.22Å; W371-L482 HydrophobicContact CZ2-CB 3.83Å; W371-Y483 HydrophobicContact CH2-CD1 4.17Å; W371-Y483 AromaticContact CH2-CE1 3.67Å; W371-Y483 HydrophobicContact CH2-CE1 3.67Å; W371-Y483 HydrophobicContact CH2-CE2 4.21Å; W371-Y483 AromaticContact CH2-CZ 3.73Å; W371-Y483 AromaticContact CZ2-CD1 3.93Å; W371-Y483 HydrophobicContact CZ2-CD1 3.93Å; W371-Y483 AromaticContact CZ2-CE1 3.81Å; W371-Y483 HydrophobicContact CZ2-CE1 3.81Å; W371-V524 HydrophobicContact CD2-CG1 3.81Å; W371-V524 HydrophobicContact CD2-CG2 4.29Å; W371-V524 HydrophobicContact CE3-CG1 4.05Å; W371-V524 HydrophobicContact CG-CB 4.44Å; W371-V524 HydrophobicContact CG-CG1 4.06Å; W371-V524 HydrophobicContact CG-CG2 4.12Å; W371-A527 HydrophobicContact CB-CB 3.8Å |
| 372 | A | 90.7 | Very high | 87 | Confident | 3 Ų | 3 | 20.2 Ų | 20.2 | 3% | 0.025 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -61.8 | -45.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | L368 L369 F374 C376 A527 V531 M555 | L368-A372 WeakPolarHBondContact O-CB 3.15Å; L368-A372 PolarHBondContact O-N 3.38Å; L369-A372 PolarHBondContact O-N 3.49Å; A372-F374 PolarHBondContact O-N 2.96Å; A372-C376 WeakPolarHBondContact O-CB 3.18Å; A372-C376 PolarHBondContact O-N 3.42Å; A372-A527 HydrophobicContact CB-CB 4.08Å; A372-V531 HydrophobicContact CB-CG2 4.06Å; A372-M555 HydrophobicContact CB-CE 3.47Å; A372-M555 VanDerWaalsContact CB-CE 3.47Å; A372-M555 HydrophobicContact CB-SD 4Å |
| 373 | A | 91.8 | Very high | 86.5 | Confident | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -60.8 | -44.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L369 G370 N377 F452 A552 M555 | L369-A373 WeakPolarHBondContact O-CB 3.44Å; L369-A373 PolarHBondContact O-N 2.67Å; G370-A373 PolarHBondContact O-N 2.92Å; A373-N377 PolarHBondContact O-N 3.21Å; A373-F452 HydrophobicContact CB-CE1 4.16Å; A373-A552 WeakPolarHBondContact CB-O 3.41Å; A373-A552 WeakPolarHBondContact O-CB 3.24Å; A373-M555 HydrophobicContact CB-CB 3.83Å |
| 374 | F | 91.5 | Very high | 86.1 | Confident | 15 Ų | 15 | 20.7 Ų | 20.7 | 7% | 0.066 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -67.5 | -49 | -179.8 | -178.2 | -102.9 | 0 | 0 | 0 | 112.4 | G370 W371 A372 N377 M378 F452 F475 M478 L482 | G370-F374 WeakPolarHBondContact O-CB 3.18Å; G370-F374 PolarHBondContact O-N 3.41Å; W371-F374 AromaticContact CE3-CD1 3.85Å; W371-F374 HydrophobicContact CE3-CD1 3.85Å; W371-F374 AromaticContact CZ3-CD1 3.62Å; W371-F374 HydrophobicContact CZ3-CD1 3.62Å; W371-F374 AromaticContact CZ3-CE1 3.9Å; W371-F374 HydrophobicContact CZ3-CE1 3.9Å; W371-F374 PolarHBondContact O-N 3.21Å; A372-F374 PolarHBondContact O-N 2.96Å; F374-N377 PolarHBondContact O-N 3.48Å; F374-M378 HydrophobicContact CD1-CG 4.12Å; F374-M378 HydrophobicContact CD2-CG 4.34Å; F374-M378 HydrophobicContact CE1-CG 3.77Å; F374-M378 HydrophobicContact CE2-CE 3.72Å; F374-M378 HydrophobicContact CE2-CG 3.99Å; F374-M378 HydrophobicContact CG-CG 4.4Å; F374-M378 HydrophobicContact CZ-CE 3.84Å; F374-M378 HydrophobicContact CZ-CG 3.69Å; F374-M378 HydrophobicContact CZ-SD 4.16Å; F374-M378 WeakPolarHBondContact O-CB 3.36Å; F374-M378 VanDerWaalsContact O-CG 3.29Å; F374-M378 WeakPolarHBondContact O-CG 3.33Å; F374-M378 PolarHBondContact O-N 3.24Å; F374-F452 HydrophobicContact CD2-CE2 4.07Å; F374-F452 HydrophobicContact CD2-CZ 4.39Å; F374-F475 HydrophobicContact CE2-CB 4.36Å; F374-F475 WeakPolarHBondContact CE2-O 3.3Å; F374-M478 HydrophobicContact CB-CG 4.35Å; F374-M478 HydrophobicContact CD2-CB 4.14Å; F374-M478 HydrophobicContact CD2-CG 3.96Å; F374-L482 HydrophobicContact CB-CD1 3.84Å; F374-L482 HydrophobicContact CG-CD1 4.19Å |
| 375 | L | 87.7 | Confident | 85.7 | Confident | 20 Ų | 20 | 20.1 Ų | 20.1 | 11% | 0.105 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -67.3 | -37.9 | 179.8 | -68.3 | 165 | 0 | 0 | 0 | 112.2 | W371 N377 M378 L379 A527 Q528 | W371-L375 HydrophobicContact CB-CD1 4.3Å; W371-L375 HydrophobicContact CE3-CD1 4.3Å; W371-L375 HydrophobicContact CE3-CD2 4.47Å; W371-L375 HydrophobicContact CE3-CG 4.14Å; W371-L375 WeakPolarHBondContact O-CB 3.17Å; W371-L375 WeakPolarHBondContact O-CD1 3.28Å; W371-L375 WeakPolarHBondContact O-CG 3.14Å; W371-L375 PolarHBondContact O-N 2.99Å; L375-N377 VanDerWaalsContact C-N 3.33Å; L375-N377 PolarHBondContact O-N 3.45Å; L375-M378 PolarHBondContact O-N 3.34Å; L375-L379 HydrophobicContact CB-CD1 4.4Å; L375-L379 WeakPolarHBondContact O-CB 3.29Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.24Å; L375-L379 PolarHBondContact O-N 3.05Å; L375-A527 HydrophobicContact CD1-CB 4.03Å; L375-Q528 HydrophobicContact CD1-CB 4.37Å; L375-Q528 HydrophobicContact CD1-CG 3.56Å; L375-Q528 HydrophobicContact CD2-CG 4.39Å |
| 376 | C | 85.8 | Confident | 84.8 | Confident | 4 Ų | 4 | 16.4 Ų | 16.4 | 3% | 0.027 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -51.8 | -53.3 | 174 | 177.1 | 0 | 0 | 0 | 0 | 110.7 | A372 V531 L535 V548 S551 A552 | A372-C376 WeakPolarHBondContact O-CB 3.18Å; A372-C376 PolarHBondContact O-N 3.42Å; C376-V531 HydrophobicContact CB-CG1 4.27Å; C376-V531 HydrophobicContact CB-CG2 4.35Å; C376-L535 HydrophobicContact CB-CD2 4.11Å; C376-L535 VanDerWaalsContact SG-CD2 3.56Å; C376-V548 WeakPolarHBondContact O-CG1 3.35Å; C376-V548 PolarHBondContact SG-O 2.94Å; C376-V548 VanDerWaalsContact SG-O 3.39Å; C376-S551 PolarHBondContact SG-OG 2.91Å; C376-A552 HydrophobicContact CB-CB 4.25Å |
| 377 | N | 84.4 | Confident | 83.7 | Confident | 1 Ų | 1 | 19.2 Ų | 19.2 | 1% | 0.005 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -68.1 | -46.7 | 177 | -173.9 | 72.7 | 0 | 0 | 0 | 112.4 | A373 F374 L375 F381 F452 F475 A552 | A373-N377 PolarHBondContact O-N 3.21Å; F374-N377 PolarHBondContact O-N 3.48Å; L375-N377 VanDerWaalsContact C-N 3.33Å; L375-N377 PolarHBondContact O-N 3.45Å; N377-F381 WeakPolarHBondContact O-CB 3.48Å; N377-F381 PolarHBondContact O-N 3.35Å; N377-F452 HydrophobicContact CB-CZ 4.11Å; N377-F475 WeakPolarHBondContact ND2-CE1 3.31Å; N377-F475 VanDerWaalsContact ND2-CE2 3.28Å; N377-F475 WeakPolarHBondContact ND2-CE2 3.27Å; N377-F475 WeakPolarHBondContact ND2-CZ 3.29Å; N377-A552 HydrophobicContact CB-CB 3.86Å |
| 378 | M | 82.3 | Confident | 82.4 | Confident | 26 Ų | 26 | 22.1 Ų | 22.1 | 13% | 0.128 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -62.9 | -45.6 | -174.4 | -79.9 | -73.2 | 154.3 | 0 | 0 | 114.2 | F374 L375 F380 F381 L418 N421 F475 | F374-M378 HydrophobicContact CD1-CG 4.12Å; F374-M378 HydrophobicContact CD2-CG 4.34Å; F374-M378 HydrophobicContact CE1-CG 3.77Å; F374-M378 HydrophobicContact CE2-CE 3.72Å; F374-M378 HydrophobicContact CE2-CG 3.99Å; F374-M378 HydrophobicContact CG-CG 4.4Å; F374-M378 HydrophobicContact CZ-CE 3.84Å; F374-M378 HydrophobicContact CZ-CG 3.69Å; F374-M378 HydrophobicContact CZ-SD 4.16Å; F374-M378 WeakPolarHBondContact O-CB 3.36Å; F374-M378 VanDerWaalsContact O-CG 3.29Å; F374-M378 WeakPolarHBondContact O-CG 3.33Å; F374-M378 PolarHBondContact O-N 3.24Å; L375-M378 PolarHBondContact O-N 3.34Å; M378-F380 PolarHBondContact O-N 3.49Å; M378-F381 PolarHBondContact O-N 2.87Å; M378-L418 HydrophobicContact CE-CD2 4.29Å; M378-L418 HydrophobicContact SD-CD2 3.47Å; M378-L418 WeakPolarHBondContact SD-CD2 3.5Å; M378-N421 HydrophobicContact CE-CB 4.19Å; M378-N421 VanDerWaalsContact CE-CG 3.47Å; M378-N421 WeakPolarHBondContact CE-OD1 3.38Å; M378-F475 HydrophobicContact CE-CB 3.42Å; M378-F475 VanDerWaalsContact CE-CB 3.42Å; M378-F475 HydrophobicContact CE-CD2 3.56Å; M378-F475 HydrophobicContact CE-CG 3.82Å |
| 379 | L | 76.9 | Confident | 80.9 | Confident | 77 Ų | 77 | 21.2 Ų | 21.2 | 40% | 0.403 | 11% | 0.106 | S | C | . | . | H | α-helix | trans | -65.4 | -24.4 | -173.8 | -71.6 | 169.7 | 0 | 0 | 0 | 113.6 | L375 V531 | L375-L379 HydrophobicContact CB-CD1 4.4Å; L375-L379 WeakPolarHBondContact O-CB 3.29Å; L375-L379 VanDerWaalsContact O-CG 3.31Å; L375-L379 WeakPolarHBondContact O-CG 3.24Å; L375-L379 PolarHBondContact O-N 3.05Å; L379-V531 HydrophobicContact CD1-CG1 3.92Å |
| 380 | F | 75.9 | Confident | 79.1 | Confident | 51 Ų | 51 | 20 Ų | 20 | 22% | 0.224 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -115.2 | 6.4 | -179.9 | -67.1 | -96.2 | 0 | 0 | 0 | 112.7 | M378 T382 D383 F384 L535 V545 V548 | M378-F380 PolarHBondContact O-N 3.49Å; F380-T382 PolarHBondContact O-N 3.45Å; F380-D383 PolarHBondContact O-N 3.19Å; F380-F384 VanDerWaalsContact O-CB 3.24Å; F380-F384 WeakPolarHBondContact O-CB 3.42Å; F380-F384 PolarHBondContact O-N 3.07Å; F380-L535 HydrophobicContact CD2-CD2 3.5Å; F380-L535 HydrophobicContact CD2-CG 4.19Å; F380-L535 HydrophobicContact CE2-CB 4.27Å; F380-L535 HydrophobicContact CE2-CD2 3.47Å; F380-L535 VanDerWaalsContact CE2-CD2 3.47Å; F380-L535 HydrophobicContact CE2-CG 3.85Å; F380-L535 HydrophobicContact CZ-CD2 4.48Å; F380-L535 HydrophobicContact CZ-CG 4.43Å; F380-V545 HydrophobicContact CB-CG1 4.39Å; F380-V548 HydrophobicContact CB-CG1 4.15Å; F380-V548 HydrophobicContact CB-CG2 4.31Å; F380-V548 HydrophobicContact CG-CG2 4.32Å |
| 381 | F | 80.4 | Confident | 77.5 | Confident | 2 Ų | 2 | 29.4 Ų | 29.4 | 1% | 0.009 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -63.4 | -43 | -174.3 | 178.1 | -106.1 | 0 | 0 | 0 | 112.9 | N377 M378 M385 G414 L418 T468 C472 F475 | N377-F381 WeakPolarHBondContact O-CB 3.48Å; N377-F381 PolarHBondContact O-N 3.35Å; M378-F381 PolarHBondContact O-N 2.87Å; F381-M385 HydrophobicContact CE1-CE 4.24Å; F381-M385 HydrophobicContact CE2-CE 4.22Å; F381-M385 HydrophobicContact CZ-CE 3.55Å; F381-M385 WeakPolarHBondContact O-CB 3.49Å; F381-M385 PolarHBondContact O-N 2.87Å; F381-G414 WeakPolarHBondContact CE1-O 3.36Å; F381-L418 HydrophobicContact CD1-CD2 3.95Å; F381-L418 HydrophobicContact CD1-CG 4.2Å; F381-T468 HydrophobicContact CE2-CG2 3.75Å; F381-T468 HydrophobicContact CZ-CG2 4Å; F381-C472 WeakPolarHBondContact CZ-SG 3.28Å; F381-F475 AromaticContact CD2-CE2 3.81Å; F381-F475 HydrophobicContact CD2-CE2 3.81Å; F381-F475 HydrophobicContact CD2-CZ 4.36Å; F381-F475 AromaticContact CE2-CE2 3.77Å; F381-F475 HydrophobicContact CE2-CE2 3.77Å; F381-F475 HydrophobicContact CE2-CZ 4.29Å; F381-F475 HydrophobicContact CG-CE2 4.44Å; F381-F475 HydrophobicContact CZ-CE2 4.35Å |
| 382 | T | 79.6 | Confident | 76.4 | Confident | 33 Ų | 33 | 37.3 Ų | 37.3 | 20% | 0.202 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -67 | -40 | 177.2 | 44.8 | 0 | 0 | 0 | 0 | 112 | F380 M385 G386 L418 | F380-T382 PolarHBondContact O-N 3.45Å; T382-M385 PolarHBondContact O-N 3.01Å; T382-G386 PolarHBondContact O-N 3.33Å; T382-L418 HydrophobicContact CG2-CD1 3.94Å |
| 383 | D | 75.8 | Confident | 75.2 | Confident | 29 Ų | 29 | 37.5 Ų | 37.5 | 16% | 0.155 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -67.5 | -41.9 | 176.3 | -172.9 | 45.6 | 0 | 0 | 0 | 111.7 | F380 G386 Q387 Y407 | F380-D383 PolarHBondContact O-N 3.19Å; D383-G386 PolarHBondContact O-N 3.02Å; D383-Q387 WeakPolarHBondContact O-CB 3.11Å; D383-Q387 WeakPolarHBondContact O-CG 3.46Å; D383-Q387 PolarHBondContact O-N 3.35Å; D383-Q387 PolarHBondContact OD1-NE2 2.9Å; D383-Q387 PolarHBondContact OD2-NE2 3.41Å; D383-Y407 WeakPolarHBondContact OD1-CE2 3.21Å; D383-Y407 PolarHBondContact OD1-OH 3.32Å |
| 384 | F | 78.6 | Confident | 74.1 | Confident | 3 Ų | 3 | 40.9 Ų | 40.9 | 1% | 0.013 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.8 | -43.3 | 171.9 | 174 | -111.1 | 0 | 0 | 0 | 112.1 | F380 Q388 I389 I459 V545 I546 V549 | F380-F384 VanDerWaalsContact O-CB 3.24Å; F380-F384 WeakPolarHBondContact O-CB 3.42Å; F380-F384 PolarHBondContact O-N 3.07Å; F384-Q388 HydrophobicContact CD2-CB 3.95Å; F384-Q388 HydrophobicContact CD2-CG 4.34Å; F384-Q388 HydrophobicContact CE2-CB 4.06Å; F384-Q388 HydrophobicContact CE2-CG 4.04Å; F384-Q388 WeakPolarHBondContact O-CA 3.36Å; F384-Q388 WeakPolarHBondContact O-CB 3.26Å; F384-Q388 PolarHBondContact O-N 2.71Å; F384-I389 HydrophobicContact CD1-CD1 3.84Å; F384-I389 HydrophobicContact CE1-CD1 3.34Å; F384-I389 HydrophobicContact CE1-CG1 4.19Å; F384-I389 HydrophobicContact CZ-CD1 3.93Å; F384-I389 HydrophobicContact CZ-CG1 4.34Å; F384-I389 PolarHBondContact O-N 2.83Å; F384-I459 HydrophobicContact CE1-CG2 3.47Å; F384-I459 VanDerWaalsContact CE1-CG2 3.47Å; F384-I459 HydrophobicContact CZ-CG2 3.92Å; F384-V545 HydrophobicContact CB-CG1 3.82Å; F384-V545 HydrophobicContact CD2-CB 4.21Å; F384-V545 HydrophobicContact CD2-CG1 4.17Å; F384-V545 HydrophobicContact CG-CG1 4.45Å; F384-I546 HydrophobicContact CE2-CG1 4.33Å; F384-V549 HydrophobicContact CD1-CG2 4.17Å; F384-V549 HydrophobicContact CD2-CG2 4.27Å; F384-V549 HydrophobicContact CE1-CG2 4Å; F384-V549 HydrophobicContact CE2-CG2 4.11Å; F384-V549 HydrophobicContact CG-CG2 4.3Å; F384-V549 HydrophobicContact CZ-CG2 3.97Å |
| 385 | M | 79.3 | Confident | 72.9 | Confident | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 20% | 0.195 | C | C | . | . | I | π-helix | trans | -61.4 | -45.8 | 173.9 | -170.1 | 67.4 | 71.3 | 0 | 0 | 111.3 | F381 T382 I389 V390 G410 V413 T468 L469 | F381-M385 HydrophobicContact CE1-CE 4.24Å; F381-M385 HydrophobicContact CE2-CE 4.22Å; F381-M385 HydrophobicContact CZ-CE 3.55Å; F381-M385 WeakPolarHBondContact O-CB 3.49Å; F381-M385 PolarHBondContact O-N 2.87Å; T382-M385 PolarHBondContact O-N 3.01Å; M385-I389 HydrophobicContact CE-CD1 4.21Å; M385-I389 PolarHBondContact O-N 2.99Å; M385-I389 HydrophobicContact SD-CB 3.78Å; M385-I389 HydrophobicContact SD-CD1 3.93Å; M385-I389 HydrophobicContact SD-CG1 4.48Å; M385-I389 HydrophobicContact SD-CG2 3.6Å; M385-I389 VanDerWaalsContact SD-CG2 3.6Å; M385-V390 HydrophobicContact CG-CG2 3.96Å; M385-V390 WeakPolarHBondContact O-CB 3.17Å; M385-V390 PolarHBondContact O-N 3.08Å; M385-V390 HydrophobicContact SD-CG2 3.93Å; M385-G410 WeakPolarHBondContact CG-O 3.41Å; M385-V413 HydrophobicContact CE-CG1 4.28Å; M385-V413 HydrophobicContact CG-CB 4.21Å; M385-V413 HydrophobicContact CG-CG1 4Å; M385-V413 HydrophobicContact SD-CG1 3.89Å; M385-T468 HydrophobicContact CE-CG2 3.63Å; M385-L469 HydrophobicContact CE-CD2 4.5Å |
| 386 | G | 71.1 | Confident | 72.2 | Confident | 0 Ų | 0 | 49 Ų | 49 | 0% | 0 | 22% | 0.224 | C | C | . | . | I | π-helix | trans | -70 | -38.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | T382 D383 G393 | T382-G386 PolarHBondContact O-N 3.33Å; D383-G386 PolarHBondContact O-N 3.02Å; G386-G393 WeakPolarHBondContact O-CA 3.47Å; G386-G393 PolarHBondContact O-N 3.5Å; G386-G393 VanDerWaalsContact O-N 3.17Å |
| 387 | Q | 67.5 | Low | 71.4 | Confident | 59 Ų | 59 | 49.6 Ų | 49.6 | 28% | 0.276 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -87.9 | -30.5 | -178.7 | -68.6 | -171.4 | 31.1 | 0 | 0 | 113.8 | D383 K392 P395 Y407 | D383-Q387 WeakPolarHBondContact O-CB 3.11Å; D383-Q387 WeakPolarHBondContact O-CG 3.46Å; D383-Q387 PolarHBondContact O-N 3.35Å; D383-Q387 PolarHBondContact OD1-NE2 2.9Å; D383-Q387 PolarHBondContact OD2-NE2 3.41Å; Q387-K392 WeakPolarHBondContact O-CA 3.24Å; Q387-P395 HydrophobicContact CG-CG 4.44Å; Q387-Y407 HydrophobicContact CG-CD2 4.31Å; Q387-Y407 HydrophobicContact CG-CE2 4.21Å |
| 388 | Q | 64.9 | Low | 71 | Confident | 61 Ų | 61 | 57.3 Ų | 57.3 | 29% | 0.285 | 27% | 0.266 | S | S | . | . | I | π-helix | trans | -122.4 | -38.9 | -159.5 | -156 | 133.5 | 52.8 | 0 | 0 | 114.2 | F384 S544 I546 | F384-Q388 HydrophobicContact CD2-CB 3.95Å; F384-Q388 HydrophobicContact CD2-CG 4.34Å; F384-Q388 HydrophobicContact CE2-CB 4.06Å; F384-Q388 HydrophobicContact CE2-CG 4.04Å; F384-Q388 WeakPolarHBondContact O-CA 3.36Å; F384-Q388 WeakPolarHBondContact O-CB 3.26Å; F384-Q388 PolarHBondContact O-N 2.71Å; Q388-S544 PolarHBondContact NE2-OG 3.16Å; Q388-S544 VanDerWaalsContact NE2-OG 3.1Å; Q388-I546 VanDerWaalsContact CD-CG1 3.42Å; Q388-I546 HydrophobicContact CG-CG1 4.37Å; Q388-I546 VanDerWaalsContact OE1-N 3.14Å |
| 389 | I | 59.4 | Low | 70.3 | Confident | 18 Ų | 18 | 60.9 Ų | 60.9 | 9% | 0.092 | 28% | 0.282 | C | S | . | . | I | π-helix | trans | -93.6 | -45.4 | -179.1 | -67.5 | 164 | 0 | 0 | 0 | 111.1 | F384 M385 Y391 P463 V465 T468 | F384-I389 HydrophobicContact CD1-CD1 3.84Å; F384-I389 HydrophobicContact CE1-CD1 3.34Å; F384-I389 HydrophobicContact CE1-CG1 4.19Å; F384-I389 HydrophobicContact CZ-CD1 3.93Å; F384-I389 HydrophobicContact CZ-CG1 4.34Å; F384-I389 PolarHBondContact O-N 2.83Å; M385-I389 HydrophobicContact CE-CD1 4.21Å; M385-I389 PolarHBondContact O-N 2.99Å; M385-I389 HydrophobicContact SD-CB 3.78Å; M385-I389 HydrophobicContact SD-CD1 3.93Å; M385-I389 HydrophobicContact SD-CG1 4.48Å; M385-I389 HydrophobicContact SD-CG2 3.6Å; M385-I389 VanDerWaalsContact SD-CG2 3.6Å; I389-Y391 PolarHBondContact O-N 2.93Å; I389-P463 HydrophobicContact CG1-CB 3.88Å; I389-V465 HydrophobicContact CG2-CB 4.06Å; I389-V465 HydrophobicContact CG2-CG1 4.49Å; I389-V465 HydrophobicContact CG2-CG2 3.66Å; I389-T468 HydrophobicContact CD1-CG2 3.74Å; I389-T468 WeakPolarHBondContact CD1-OG1 3.5Å |
| 390 | V | 53.8 | Low | 70.3 | Confident | 6 Ų | 6 | 65.1 Ų | 65.1 | 4% | 0.036 | 31% | 0.305 | C | S | . | . | S | Bend | trans | -94.4 | 87.3 | -176.6 | -177.9 | 0 | 0 | 0 | 0 | 110.2 | M385 K392 V465 | M385-V390 HydrophobicContact CG-CG2 3.96Å; M385-V390 WeakPolarHBondContact O-CB 3.17Å; M385-V390 PolarHBondContact O-N 3.08Å; M385-V390 HydrophobicContact SD-CG2 3.93Å; V390-K392 VanDerWaalsContact C-N 3.28Å; V390-K392 PolarHBondContact O-N 3.19Å; V390-V465 HydrophobicContact CG2-CG1 4.49Å |
| 391 | Y | 57.3 | Low | 70.4 | Confident | 198 Ų | 198 | 64.4 Ų | 64.4 | 78% | 0.776 | 31% | 0.306 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.7 | 14.6 | 165 | -51.6 | -70.6 | 0 | 0 | 0 | 118.8 | I389 T406 | I389-Y391 PolarHBondContact O-N 2.93Å; Y391-T406 HydrophobicContact CD2-CG2 4.34Å; Y391-T406 HydrophobicContact CG-CG2 4.45Å |
| 392 | K | 69.3 | Low | 70.5 | Confident | 178 Ų | 178 | 70.1 Ų | 70.1 | 77% | 0.774 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.6 | 47.7 | -178.4 | -51.5 | 178.3 | -179.6 | 178.5 | 0 | 113.9 | Q387 V390 | Q387-K392 WeakPolarHBondContact O-CA 3.24Å; V390-K392 VanDerWaalsContact C-N 3.28Å; V390-K392 PolarHBondContact O-N 3.19Å |
| 393 | G | 65.3 | Low | 70.3 | Confident | 7 Ų | 7 | 70.2 Ų | 70.2 | 7% | 0.072 | 35% | 0.345 | C | S | . | . | trans | -60.1 | 155.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | G386 A403 | G386-G393 WeakPolarHBondContact O-CA 3.47Å; G386-G393 PolarHBondContact O-N 3.5Å; G386-G393 VanDerWaalsContact O-N 3.17Å; G393-A403 WeakPolarHBondContact CA-O 3.48Å | ||
| 394 | N | 69.6 | Low | 70.3 | Confident | 71 Ų | 71 | 70.8 Ų | 70.8 | 38% | 0.38 | 35% | 0.346 | S | S | . | . | trans | -126.7 | 111.8 | -179 | -179.4 | 0.2 | 0 | 0 | 0 | 111.6 | Y396 A397 A403 | N394-Y396 PolarHBondContact O-N 2.97Å; N394-Y396 WeakPolarHBondContact OD1-CB 3.23Å; N394-Y396 PolarHBondContact OD1-N 2.82Å; N394-A397 HydrophobicContact CB-CB 4.15Å; N394-A397 WeakPolarHBondContact O-CB 3.35Å; N394-A397 PolarHBondContact O-N 2.85Å; N394-A397 VanDerWaalsContact O-N 3.16Å; N394-A403 HydrophobicContact CB-CB 4.39Å; N394-A403 PolarHBondContact N-O 3.07Å; N394-A403 VanDerWaalsContact N-O 3.09Å | ||
| 395 | P | 66.9 | Low | 70.1 | Confident | 19 Ų | 19 | 73 Ų | 73 | 12% | 0.123 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -68 | -12.5 | 179.6 | 26.6 | -33.8 | 0 | 0 | 0 | 114.4 | R96 Q387 Y407 | R96-P395 PolarHBondContact NH1-O 3.09Å; R96-P395 VanDerWaalsContact NH1-O 3.15Å; Q387-P395 HydrophobicContact CG-CG 4.44Å; P395-Y407 HydrophobicContact CB-CD1 4.14Å; P395-Y407 HydrophobicContact CB-CD2 4.16Å; P395-Y407 HydrophobicContact CB-CE1 3.87Å; P395-Y407 HydrophobicContact CB-CE2 3.89Å; P395-Y407 HydrophobicContact CB-CG 4.29Å; P395-Y407 HydrophobicContact CG-CD2 4.33Å; P395-Y407 HydrophobicContact CG-CE2 4.06Å |
| 396 | Y | 71.4 | Confident | 70 | Confident | 186 Ų | 186 | 75 Ų | 75 | 73% | 0.729 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | -1.5 | 177 | -55.6 | -76.7 | 0 | 0 | 0 | 113.5 | N394 | N394-Y396 PolarHBondContact O-N 2.97Å; N394-Y396 WeakPolarHBondContact OD1-CB 3.23Å; N394-Y396 PolarHBondContact OD1-N 2.82Å |
| 397 | A | 70.5 | Confident | 70.4 | Confident | 17 Ų | 17 | 76.8 Ų | 76.8 | 14% | 0.14 | 38% | 0.384 | C | S | . | . | S | Bend | trans | -74.4 | 159.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | N394 S401 A403 | N394-A397 HydrophobicContact CB-CB 4.15Å; N394-A397 WeakPolarHBondContact O-CB 3.35Å; N394-A397 PolarHBondContact O-N 2.85Å; N394-A397 VanDerWaalsContact O-N 3.16Å; A397-S401 WeakPolarHBondContact CB-OG 3.29Å; A397-A403 HydrophobicContact CB-CB 4.03Å |
| 398 | E | 75.6 | Confident | 70.7 | Confident | 162 Ų | 162 | 79.1 Ų | 79.1 | 76% | 0.757 | 39% | 0.394 | S | S | * | . | trans | -62 | 142.9 | 175 | -63.8 | -172.4 | 156.9 | 0 | 0 | 111 | N400 S401 Y404 | E398-N400 PolarHBondContact O-N 3.31Å; E398-S401 WeakPolarHBondContact O-CB 3.33Å; E398-S401 PolarHBondContact O-N 3.29Å; E398-S401 PolarHBondContact O-OG 2.96Å; E398-Y404 VanDerWaalsContact O-CB 3.24Å; E398-Y404 WeakPolarHBondContact O-CB 3.39Å | ||
| 399 | H | 67.6 | Low | 71.3 | Confident | 101 Ų | 101 | 83.2 Ų | 83.2 | 47% | 0.468 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63.1 | -27 | -173.1 | -60.4 | -20.6 | 0 | 0 | 0 | 113.9 | S401 Y404 | H399-S401 VanDerWaalsContact C-N 3.26Å; H399-S401 PolarHBondContact O-N 3.05Å; H399-Y404 HydrophobicContact CB-CD1 4.16Å; H399-Y404 HydrophobicContact CB-CE1 4.24Å; H399-Y404 AromaticContact CE1-CE2 3.5Å; H399-Y404 AromaticContact CE1-CZ 3.71Å; H399-Y404 AromaticContact ND1-CD1 4Å; H399-Y404 AromaticContact ND1-CD2 3.47Å; H399-Y404 WeakPolarHBondContact ND1-CD2 3.45Å; H399-Y404 AromaticContact ND1-CE1 3.77Å; H399-Y404 AromaticContact ND1-CE2 3.19Å; H399-Y404 WeakPolarHBondContact ND1-CE2 3.29Å; H399-Y404 AromaticContact ND1-CG 3.87Å; H399-Y404 AromaticContact ND1-CZ 3.37Å |
| 400 | N | 75.7 | Confident | 72.3 | Confident | 167 Ų | 167 | 82.4 Ų | 82.4 | 89% | 0.893 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82 | 0.9 | 174.7 | -64.9 | -12.4 | 0 | 0 | 0 | 113.5 | E398 | E398-N400 PolarHBondContact O-N 3.31Š|
| 401 | S | 79.4 | Confident | 73.5 | Confident | 35 Ų | 35 | 83.9 Ų | 83.9 | 25% | 0.245 | 41% | 0.412 | C | S | . | . | S | Bend | trans | -87.6 | 148.4 | -179.1 | 76.1 | 0 | 0 | 0 | 0 | 112.4 | A397 E398 H399 A403 Y404 A405 | A397-S401 WeakPolarHBondContact CB-OG 3.29Å; E398-S401 WeakPolarHBondContact O-CB 3.33Å; E398-S401 PolarHBondContact O-N 3.29Å; E398-S401 PolarHBondContact O-OG 2.96Å; H399-S401 VanDerWaalsContact C-N 3.26Å; H399-S401 PolarHBondContact O-N 3.05Å; S401-A403 PolarHBondContact O-N 2.95Å; S401-Y404 PolarHBondContact O-N 2.93Å; S401-Y404 VanDerWaalsContact O-N 3.11Å; S401-Y404 PolarHBondContact OG-N 3.06Å; S401-A405 PolarHBondContact O-N 3.42Å |
| 402 | T | 81.8 | Confident | 74.4 | Confident | 122 Ų | 122 | 78.8 Ų | 78.8 | 75% | 0.748 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -59 | -32.8 | 175.1 | 49.9 | 0 | 0 | 0 | 0 | 112.8 | T406 | T402-T406 WeakPolarHBondContact O-CB 3.31Å; T402-T406 PolarHBondContact O-N 3.29Å; T402-T406 PolarHBondContact O-OG1 3.37Å |
| 403 | A | 75.1 | Confident | 75 | Confident | 35 Ų | 35 | 71.8 Ų | 71.8 | 29% | 0.289 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -68 | -30.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | G393 N394 A397 S401 Y407 | G393-A403 WeakPolarHBondContact CA-O 3.48Å; N394-A403 HydrophobicContact CB-CB 4.39Å; N394-A403 PolarHBondContact N-O 3.07Å; N394-A403 VanDerWaalsContact N-O 3.09Å; A397-A403 HydrophobicContact CB-CB 4.03Å; S401-A403 PolarHBondContact O-N 2.95Å; A403-Y407 PolarHBondContact O-N 2.9Å |
| 404 | Y | 75.6 | Confident | 75.9 | Confident | 42 Ų | 42 | 71.4 Ų | 71.4 | 17% | 0.165 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -76.6 | -49.3 | 173.9 | -175.7 | -90 | 0 | 0 | 0 | 111.3 | E398 H399 S401 T406 Y407 E408 | E398-Y404 VanDerWaalsContact O-CB 3.24Å; E398-Y404 WeakPolarHBondContact O-CB 3.39Å; H399-Y404 HydrophobicContact CB-CD1 4.16Å; H399-Y404 HydrophobicContact CB-CE1 4.24Å; H399-Y404 AromaticContact CE1-CE2 3.5Å; H399-Y404 AromaticContact CE1-CZ 3.71Å; H399-Y404 AromaticContact ND1-CD1 4Å; H399-Y404 AromaticContact ND1-CD2 3.47Å; H399-Y404 WeakPolarHBondContact ND1-CD2 3.45Å; H399-Y404 AromaticContact ND1-CE1 3.77Å; H399-Y404 AromaticContact ND1-CE2 3.19Å; H399-Y404 WeakPolarHBondContact ND1-CE2 3.29Å; H399-Y404 AromaticContact ND1-CG 3.87Å; H399-Y404 AromaticContact ND1-CZ 3.37Å; S401-Y404 PolarHBondContact O-N 2.93Å; S401-Y404 VanDerWaalsContact O-N 3.11Å; S401-Y404 PolarHBondContact OG-N 3.06Å; Y404-T406 PolarHBondContact O-N 3.24Å; Y404-Y407 WeakPolarHBondContact O-CA 3.48Å; Y404-Y407 WeakPolarHBondContact O-CB 3.38Å; Y404-Y407 PolarHBondContact O-N 3.44Å; Y404-E408 PolarHBondContact O-N 3.23Å |
| 405 | A | 75.4 | Confident | 76.3 | Confident | 49 Ų | 49 | 69.8 Ų | 69.8 | 41% | 0.405 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -59.7 | -29.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | S401 R409 | S401-A405 PolarHBondContact O-N 3.42Å; A405-R409 WeakPolarHBondContact O-CB 3.32Å; A405-R409 PolarHBondContact O-N 3.21Å; A405-R409 VanDerWaalsContact O-N 3.1Å |
| 406 | T | 77.9 | Confident | 77.2 | Confident | 41 Ų | 41 | 74.7 Ų | 74.7 | 25% | 0.252 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -71.3 | -41.2 | 173.2 | -67.9 | 0 | 0 | 0 | 0 | 112.4 | Y391 T402 Y404 G410 | Y391-T406 HydrophobicContact CD2-CG2 4.34Å; Y391-T406 HydrophobicContact CG-CG2 4.45Å; T402-T406 WeakPolarHBondContact O-CB 3.31Å; T402-T406 PolarHBondContact O-N 3.29Å; T402-T406 PolarHBondContact O-OG1 3.37Å; Y404-T406 PolarHBondContact O-N 3.24Å; T406-G410 PolarHBondContact O-N 2.94Å; T406-G410 VanDerWaalsContact O-N 3.12Å |
| 407 | Y | 78.3 | Confident | 77.9 | Confident | 39 Ų | 39 | 65.9 Ų | 65.9 | 15% | 0.153 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.4 | -47 | 172.8 | 170.4 | -96.2 | 0 | 0 | 0 | 111.2 | D383 Q387 P395 A403 Y404 R409 G410 V411 | D383-Y407 WeakPolarHBondContact OD1-CE2 3.21Å; D383-Y407 PolarHBondContact OD1-OH 3.32Å; Q387-Y407 HydrophobicContact CG-CD2 4.31Å; Q387-Y407 HydrophobicContact CG-CE2 4.21Å; P395-Y407 HydrophobicContact CB-CD1 4.14Å; P395-Y407 HydrophobicContact CB-CD2 4.16Å; P395-Y407 HydrophobicContact CB-CE1 3.87Å; P395-Y407 HydrophobicContact CB-CE2 3.89Å; P395-Y407 HydrophobicContact CB-CG 4.29Å; P395-Y407 HydrophobicContact CG-CD2 4.33Å; P395-Y407 HydrophobicContact CG-CE2 4.06Å; A403-Y407 PolarHBondContact O-N 2.9Å; Y404-Y407 WeakPolarHBondContact O-CA 3.48Å; Y404-Y407 WeakPolarHBondContact O-CB 3.38Å; Y404-Y407 PolarHBondContact O-N 3.44Å; Y407-R409 VanDerWaalsContact C-N 3.34Å; Y407-R409 PolarHBondContact O-N 3.13Å; Y407-G410 CarbonylContact O-C 3.56Å; Y407-G410 WeakPolarHBondContact O-CA 3.17Å; Y407-G410 PolarHBondContact O-N 2.71Å; Y407-V411 HydrophobicContact CD1-CG2 4.2Å; Y407-V411 HydrophobicContact CE1-CG2 3.62Å; Y407-V411 HydrophobicContact CE2-CG2 4.07Å; Y407-V411 PolarHBondContact O-N 3.25Å |
| 408 | E | 73.3 | Confident | 78.6 | Confident | 107 Ų | 107 | 65.9 Ų | 65.9 | 50% | 0.5 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -55.9 | -45.3 | 177.4 | -177.2 | 170.5 | -115.4 | 0 | 0 | 112.1 | Y404 G410 V411 E412 | Y404-E408 PolarHBondContact O-N 3.23Å; E408-G410 VanDerWaalsContact C-N 3.29Å; E408-G410 PolarHBondContact O-N 3.27Å; E408-V411 WeakPolarHBondContact O-CB 3.4Å; E408-V411 PolarHBondContact O-N 3.28Å; E408-V411 VanDerWaalsContact O-N 3.14Å; E408-E412 PolarHBondContact O-N 3.37Å |
| 409 | R | 79.3 | Confident | 79.2 | Confident | 148 Ų | 148 | 59.1 Ų | 59.1 | 56% | 0.558 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -64.8 | -29.1 | 173.6 | -172.7 | 163.1 | -169 | 71.7 | -5.2 | 113.8 | A405 Y407 E412 V413 | A405-R409 WeakPolarHBondContact O-CB 3.32Å; A405-R409 PolarHBondContact O-N 3.21Å; A405-R409 VanDerWaalsContact O-N 3.1Å; Y407-R409 VanDerWaalsContact C-N 3.34Å; Y407-R409 PolarHBondContact O-N 3.13Å; R409-E412 IonicContact NH1-OE2 3Å; R409-E412 PolarHBondContact NH1-OE2 3.08Å; R409-E412 WeakPolarHBondContact O-CB 3.28Å; R409-V413 WeakPolarHBondContact O-CG2 3.28Å; R409-V413 PolarHBondContact O-N 2.67Å |
| 410 | G | 80.2 | Confident | 80.3 | Confident | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -75 | -33 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | M385 T406 Y407 E408 V413 G414 | M385-G410 WeakPolarHBondContact CG-O 3.41Å; T406-G410 PolarHBondContact O-N 2.94Å; T406-G410 VanDerWaalsContact O-N 3.12Å; Y407-G410 CarbonylContact O-C 3.56Å; Y407-G410 WeakPolarHBondContact O-CA 3.17Å; Y407-G410 PolarHBondContact O-N 2.71Å; E408-G410 VanDerWaalsContact C-N 3.29Å; E408-G410 PolarHBondContact O-N 3.27Å; G410-V413 PolarHBondContact O-N 3.08Å; G410-G414 PolarHBondContact O-N 3.42Å |
| 411 | V | 77.3 | Confident | 81 | Confident | 38 Ų | 38 | 50 Ų | 50 | 23% | 0.23 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -66.1 | -42.1 | 170.1 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | Y407 E408 V413 G414 C415 | Y407-V411 HydrophobicContact CD1-CG2 4.2Å; Y407-V411 HydrophobicContact CE1-CG2 3.62Å; Y407-V411 HydrophobicContact CE2-CG2 4.07Å; Y407-V411 PolarHBondContact O-N 3.25Å; E408-V411 WeakPolarHBondContact O-CB 3.4Å; E408-V411 PolarHBondContact O-N 3.28Å; E408-V411 VanDerWaalsContact O-N 3.14Å; V411-V413 PolarHBondContact O-N 2.96Å; V411-G414 CarbonylContact O-C 3.56Å; V411-G414 WeakPolarHBondContact O-CA 3.48Å; V411-G414 PolarHBondContact O-N 2.82Å; V411-C415 PolarHBondContact O-N 3.3Å; V411-C415 PolarHBondContact O-SG 3.39Å |
| 412 | E | 77.8 | Confident | 81.5 | Confident | 91 Ų | 91 | 48.6 Ų | 48.6 | 43% | 0.425 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -52.6 | -51.5 | 171.9 | -173.5 | -158.5 | 161.2 | 0 | 0 | 111 | E408 R409 G414 C415 W416 | E408-E412 PolarHBondContact O-N 3.37Å; R409-E412 IonicContact NH1-OE2 3Å; R409-E412 PolarHBondContact NH1-OE2 3.08Å; R409-E412 WeakPolarHBondContact O-CB 3.28Å; E412-G414 VanDerWaalsContact C-N 3.29Å; E412-G414 PolarHBondContact O-N 3.43Å; E412-C415 WeakPolarHBondContact O-CB 2.99Å; E412-C415 PolarHBondContact O-N 2.83Å; E412-W416 VanDerWaalsContact O-CD1 3.29Å; E412-W416 PolarHBondContact O-N 2.87Å; E412-W416 VanDerWaalsContact O-N 3.16Å |
| 413 | V | 82.3 | Confident | 82 | Confident | 30 Ų | 30 | 45.7 Ų | 45.7 | 18% | 0.182 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.1 | -35 | 175.4 | 172.6 | 0 | 0 | 0 | 0 | 111.8 | M385 R409 G410 V411 W416 G417 V465 L469 | M385-V413 HydrophobicContact CE-CG1 4.28Å; M385-V413 HydrophobicContact CG-CB 4.21Å; M385-V413 HydrophobicContact CG-CG1 4Å; M385-V413 HydrophobicContact SD-CG1 3.89Å; R409-V413 WeakPolarHBondContact O-CG2 3.28Å; R409-V413 PolarHBondContact O-N 2.67Å; G410-V413 PolarHBondContact O-N 3.08Å; V411-V413 PolarHBondContact O-N 2.96Å; V413-W416 PolarHBondContact O-N 2.92Å; V413-G417 PolarHBondContact O-N 3.36Å; V413-V465 HydrophobicContact CG1-CG1 3.95Å; V413-L469 HydrophobicContact CG1-CD1 4.07Å; V413-L469 HydrophobicContact CG1-CD2 4.08Å; V413-L469 HydrophobicContact CG1-CG 4.32Å |
| 414 | G | 82.6 | Confident | 82.9 | Confident | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -60.6 | -43.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | F381 G410 V411 E412 W416 G417 L418 | F381-G414 WeakPolarHBondContact CE1-O 3.36Å; G410-G414 PolarHBondContact O-N 3.42Å; V411-G414 CarbonylContact O-C 3.56Å; V411-G414 WeakPolarHBondContact O-CA 3.48Å; V411-G414 PolarHBondContact O-N 2.82Å; E412-G414 VanDerWaalsContact C-N 3.29Å; E412-G414 PolarHBondContact O-N 3.43Å; G414-W416 VanDerWaalsContact C-N 3.34Å; G414-W416 PolarHBondContact O-N 3.5Å; G414-G417 CarbonylContact O-C 3.56Å; G414-G417 WeakPolarHBondContact O-CA 3.4Å; G414-G417 PolarHBondContact O-N 3.11Å; G414-L418 PolarHBondContact O-N 2.91Å |
| 415 | C | 79.3 | Confident | 83.7 | Confident | 36 Ų | 36 | 43.1 Ų | 43.1 | 24% | 0.243 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.1 | -37.7 | 175.6 | -67.5 | 0 | 0 | 0 | 0 | 112.4 | V411 E412 G417 L418 C419 | V411-C415 PolarHBondContact O-N 3.3Å; V411-C415 PolarHBondContact O-SG 3.39Å; E412-C415 WeakPolarHBondContact O-CB 2.99Å; E412-C415 PolarHBondContact O-N 2.83Å; C415-G417 VanDerWaalsContact C-N 3.33Å; C415-G417 PolarHBondContact O-N 3Å; C415-L418 PolarHBondContact O-N 3.5Å; C415-C419 PolarHBondContact O-N 3.22Å |
| 416 | W | 84.3 | Confident | 84.5 | Confident | 123 Ų | 123 | 40.9 Ų | 40.9 | 47% | 0.466 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -61.1 | -40.1 | 169.6 | -77.7 | 103.2 | 0 | 0 | 0 | 112.3 | E412 V413 G414 C419 I420 | E412-W416 VanDerWaalsContact O-CD1 3.29Å; E412-W416 PolarHBondContact O-N 2.87Å; E412-W416 VanDerWaalsContact O-N 3.16Å; V413-W416 PolarHBondContact O-N 2.92Å; G414-W416 VanDerWaalsContact C-N 3.34Å; G414-W416 PolarHBondContact O-N 3.5Å; W416-C419 WeakPolarHBondContact O-CB 3.39Å; W416-C419 PolarHBondContact O-N 3.41Å; W416-I420 WeakPolarHBondContact O-CG1 3.26Å; W416-I420 PolarHBondContact O-N 3.45Å |
| 417 | G | 87.4 | Confident | 85.2 | Confident | 1 Ų | 1 | 44.3 Ų | 44.3 | 1% | 0.01 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -61.9 | -41.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | V413 G414 C415 C419 I420 N421 C472 | V413-G417 PolarHBondContact O-N 3.36Å; G414-G417 CarbonylContact O-C 3.56Å; G414-G417 WeakPolarHBondContact O-CA 3.4Å; G414-G417 PolarHBondContact O-N 3.11Å; C415-G417 VanDerWaalsContact C-N 3.33Å; C415-G417 PolarHBondContact O-N 3Å; G417-C419 VanDerWaalsContact C-N 3.33Å; G417-C419 PolarHBondContact O-N 3.39Å; G417-I420 PolarHBondContact O-N 3.28Å; G417-N421 PolarHBondContact O-N 3.18Å; G417-C472 WeakPolarHBondContact O-CB 3.34Å |
| 418 | L | 85.2 | Confident | 85.9 | Confident | 17 Ų | 17 | 44 Ų | 44 | 9% | 0.089 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.8 | -37.2 | 174.7 | -66.3 | -179.5 | 0 | 0 | 0 | 112.3 | Y224 M378 F381 T382 G414 C415 N421 A422 | Y224-L418 HydrophobicContact CD2-CB 4.4Å; Y224-L418 HydrophobicContact CE1-CD1 4.35Å; Y224-L418 HydrophobicContact CE2-CB 4.28Å; M378-L418 HydrophobicContact CE-CD2 4.29Å; M378-L418 HydrophobicContact SD-CD2 3.47Å; M378-L418 WeakPolarHBondContact SD-CD2 3.5Å; F381-L418 HydrophobicContact CD1-CD2 3.95Å; F381-L418 HydrophobicContact CD1-CG 4.2Å; T382-L418 HydrophobicContact CG2-CD1 3.94Å; G414-L418 PolarHBondContact O-N 2.91Å; C415-L418 PolarHBondContact O-N 3.5Å; L418-N421 WeakPolarHBondContact O-CB 3.27Å; L418-N421 PolarHBondContact O-N 3.47Å; L418-N421 PolarHBondContact O-ND2 3.05Å; L418-A422 PolarHBondContact O-N 3.13Å |
| 419 | C | 86.9 | Confident | 86.6 | Confident | 20 Ų | 20 | 39 Ų | 39 | 14% | 0.135 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -65 | -44.2 | 172.7 | -172.7 | 0 | 0 | 0 | 0 | 111.9 | C415 W416 G417 N421 A422 V423 | C415-C419 PolarHBondContact O-N 3.22Å; W416-C419 WeakPolarHBondContact O-CB 3.39Å; W416-C419 PolarHBondContact O-N 3.41Å; G417-C419 VanDerWaalsContact C-N 3.33Å; G417-C419 PolarHBondContact O-N 3.39Å; C419-N421 VanDerWaalsContact C-N 3.31Å; C419-N421 PolarHBondContact O-N 2.91Å; C419-A422 PolarHBondContact O-N 3.39Å; C419-A422 VanDerWaalsContact O-N 3.14Å; C419-V423 WeakPolarHBondContact O-CG2 3.29Å; C419-V423 PolarHBondContact O-N 3.31Å |
| 420 | I | 90.8 | Very high | 87.1 | Confident | 64 Ų | 64 | 38.8 Ų | 38.8 | 33% | 0.328 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -58.4 | -43.2 | 173.3 | -69.5 | 164.6 | 0 | 0 | 0 | 111 | W416 G417 S424 L469 C472 | W416-I420 WeakPolarHBondContact O-CG1 3.26Å; W416-I420 PolarHBondContact O-N 3.45Å; G417-I420 PolarHBondContact O-N 3.28Å; I420-S424 WeakPolarHBondContact O-CB 3.46Å; I420-S424 PolarHBondContact O-N 3.41Å; I420-L469 HydrophobicContact CD1-CB 4.3Å; I420-L469 HydrophobicContact CD1-CD2 4.28Å; I420-C472 HydrophobicContact CB-CB 4.3Å; I420-C472 HydrophobicContact CG2-CB 4.07Å |
| 421 | N | 91.3 | Very high | 87.5 | Confident | 11 Ų | 11 | 41.7 Ų | 41.7 | 6% | 0.059 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -58.4 | -46.7 | 173 | 151.5 | 78.2 | 0 | 0 | 0 | 112.1 | M378 G417 L418 C419 S424 S425 F475 G476 | M378-N421 HydrophobicContact CE-CB 4.19Å; M378-N421 VanDerWaalsContact CE-CG 3.47Å; M378-N421 WeakPolarHBondContact CE-OD1 3.38Å; G417-N421 PolarHBondContact O-N 3.18Å; L418-N421 WeakPolarHBondContact O-CB 3.27Å; L418-N421 PolarHBondContact O-N 3.47Å; L418-N421 PolarHBondContact O-ND2 3.05Å; C419-N421 VanDerWaalsContact C-N 3.31Å; C419-N421 PolarHBondContact O-N 2.91Å; N421-S424 PolarHBondContact O-N 3.26Å; N421-S425 WeakPolarHBondContact O-CB 3.36Å; N421-S425 PolarHBondContact O-N 3.07Å; N421-F475 HydrophobicContact CB-CB 4.2Å; N421-F475 WeakPolarHBondContact OD1-CB 3.48Å; N421-F475 PolarHBondContact OD1-O 2.9Å; N421-G476 VanDerWaalsContact O-CA 3.23Å; N421-G476 WeakPolarHBondContact O-CA 3.35Å; N421-G476 WeakPolarHBondContact OD1-CA 3.45Å; N421-G476 PolarHBondContact OD1-N 3.45Å; N421-G476 VanDerWaalsContact OD1-N 3.11Å |
| 422 | A | 89.2 | Confident | 88.1 | Confident | 7 Ų | 7 | 39.9 Ų | 39.9 | 6% | 0.058 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -66.1 | -44.8 | -179.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | G217 A221 L418 C419 S424 S425 A426 | G217-A422 CarbonylContact C-O 3.46Å; G217-A422 WeakPolarHBondContact CA-O 3.35Å; G217-A422 CarbonylContact O-C 3.53Å; A221-A422 HydrophobicContact CB-CB 3.92Å; L418-A422 PolarHBondContact O-N 3.13Å; C419-A422 PolarHBondContact O-N 3.39Å; C419-A422 VanDerWaalsContact O-N 3.14Å; A422-S424 PolarHBondContact O-N 3.14Å; A422-S425 WeakPolarHBondContact O-CB 3.29Å; A422-S425 PolarHBondContact O-N 3.46Å; A422-A426 PolarHBondContact O-N 2.96Å |
| 423 | V | 92.6 | Very high | 88.4 | Confident | 60 Ų | 60 | 39.4 Ų | 39.4 | 36% | 0.364 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.4 | -41.8 | 173.2 | 174.2 | 0 | 0 | 0 | 0 | 111.2 | A221 C419 A426 L427 | A221-V423 HydrophobicContact CB-CG2 3.66Å; C419-V423 WeakPolarHBondContact O-CG2 3.29Å; C419-V423 PolarHBondContact O-N 3.31Å; V423-A426 WeakPolarHBondContact O-CB 3.3Å; V423-A426 PolarHBondContact O-N 2.94Å; V423-L427 HydrophobicContact CG1-CD1 4.05Å; V423-L427 HydrophobicContact CG1-CG 4.49Å; V423-L427 WeakPolarHBondContact O-CG 3.39Å; V423-L427 PolarHBondContact O-N 3.3Å |
| 424 | S | 94 | Very high | 88.6 | Confident | 22 Ų | 22 | 43.3 Ų | 43.3 | 15% | 0.154 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67 | -36.7 | 177.9 | -171 | 0 | 0 | 0 | 0 | 112.2 | I420 N421 A422 L427 Y428 S473 | I420-S424 WeakPolarHBondContact O-CB 3.46Å; I420-S424 PolarHBondContact O-N 3.41Å; N421-S424 PolarHBondContact O-N 3.26Å; A422-S424 PolarHBondContact O-N 3.14Å; S424-L427 PolarHBondContact O-N 2.87Å; S424-Y428 VanDerWaalsContact O-CB 3.23Å; S424-Y428 WeakPolarHBondContact O-CB 3.47Å; S424-Y428 PolarHBondContact O-N 3.15Å; S424-S473 PolarHBondContact OG-O 3.45Å |
| 425 | S | 92.4 | Very high | 88.8 | Confident | 1 Ų | 1 | 45.8 Ų | 45.8 | 1% | 0.007 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -61.1 | -45.2 | 172 | -170.2 | 0 | 0 | 0 | 0 | 111.7 | N421 A422 Y428 S429 G476 S479 S480 | N421-S425 WeakPolarHBondContact O-CB 3.36Å; N421-S425 PolarHBondContact O-N 3.07Å; A422-S425 WeakPolarHBondContact O-CB 3.29Å; A422-S425 PolarHBondContact O-N 3.46Å; S425-Y428 PolarHBondContact O-N 2.96Å; S425-S429 PolarHBondContact O-N 2.9Å; S425-G476 WeakPolarHBondContact CA-O 3.34Å; S425-G476 WeakPolarHBondContact CB-O 3.46Å; S425-S479 PolarHBondContact OG-OG 3.31Å; S425-S480 WeakPolarHBondContact O-CB 3Å; S425-S480 WeakPolarHBondContact OG-CB 3.48Å; S425-S480 PolarHBondContact OG-N 3.03Å |
| 426 | A | 91.3 | Very high | 89.1 | Confident | 2 Ų | 2 | 45.4 Ų | 45.4 | 2% | 0.017 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -59.9 | -48.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L214 L218 A422 V423 | L214-A426 HydrophobicContact CD1-CB 4.08Å; L214-A426 VanDerWaalsContact CD1-O 3.27Å; L214-A426 WeakPolarHBondContact CD1-O 3.32Å; L218-A426 HydrophobicContact CD2-CB 3.93Å; L218-A426 HydrophobicContact CG-CB 3.86Å; A422-A426 PolarHBondContact O-N 2.96Å; V423-A426 WeakPolarHBondContact O-CB 3.3Å; V423-A426 PolarHBondContact O-N 2.94Å |
| 427 | L | 93 | Very high | 89.3 | Confident | 114 Ų | 114 | 44.6 Ų | 44.6 | 60% | 0.597 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -64.5 | -41.9 | 177.2 | -68.9 | 172.2 | 0 | 0 | 0 | 111.9 | V423 S424 S429 Y430 V431 | V423-L427 HydrophobicContact CG1-CD1 4.05Å; V423-L427 HydrophobicContact CG1-CG 4.49Å; V423-L427 WeakPolarHBondContact O-CG 3.39Å; V423-L427 PolarHBondContact O-N 3.3Å; S424-L427 PolarHBondContact O-N 2.87Å; L427-S429 PolarHBondContact O-N 3.5Å; L427-Y430 WeakPolarHBondContact O-CB 3.45Å; L427-Y430 PolarHBondContact O-N 3.49Å; L427-V431 WeakPolarHBondContact O-CG2 3.48Å; L427-V431 PolarHBondContact O-N 3.25Å; L427-V431 VanDerWaalsContact O-N 3.13Å |
| 428 | Y | 93 | Very high | 89.3 | Confident | 31 Ų | 31 | 54.6 Ų | 54.6 | 12% | 0.122 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.9 | -36.8 | -179.1 | -168.2 | -112.5 | 0 | 0 | 0 | 112 | S424 S425 Y430 V431 Q432 L444 V477 | S424-Y428 VanDerWaalsContact O-CB 3.23Å; S424-Y428 WeakPolarHBondContact O-CB 3.47Å; S424-Y428 PolarHBondContact O-N 3.15Å; S425-Y428 PolarHBondContact O-N 2.96Å; Y428-Y430 PolarHBondContact O-N 2.8Å; Y428-V431 HydrophobicContact CD2-CB 4.35Å; Y428-V431 HydrophobicContact CD2-CG1 4.4Å; Y428-V431 HydrophobicContact CE2-CG1 4.47Å; Y428-V431 CarbonylContact O-C 3.54Å; Y428-V431 PolarHBondContact O-N 3.47Å; Y428-Q432 HydrophobicContact CD1-CG 3.61Å; Y428-Q432 HydrophobicContact CE1-CG 3.41Å; Y428-Q432 VanDerWaalsContact CE1-CG 3.41Å; Y428-Q432 HydrophobicContact CG-CG 4.29Å; Y428-Q432 WeakPolarHBondContact O-CB 3.32Å; Y428-Q432 WeakPolarHBondContact O-CG 3.24Å; Y428-Q432 PolarHBondContact O-N 2.98Å; Y428-L444 VanDerWaalsContact OH-CD1 3.28Å; Y428-L444 WeakPolarHBondContact OH-CD1 3.48Å; Y428-V477 HydrophobicContact CD1-CB 4.34Å; Y428-V477 HydrophobicContact CD1-CG1 4.2Å; Y428-V477 HydrophobicContact CD1-CG2 4.47Å; Y428-V477 HydrophobicContact CD2-CG2 3.97Å; Y428-V477 HydrophobicContact CE1-CB 4.42Å; Y428-V477 HydrophobicContact CE1-CG1 3.79Å; Y428-V477 HydrophobicContact CE2-CG1 4.16Å; Y428-V477 HydrophobicContact CE2-CG2 4.27Å; Y428-V477 HydrophobicContact CG-CB 4.43Å; Y428-V477 HydrophobicContact CG-CG2 4.08Å |
| 429 | S | 89.1 | Confident | 89.5 | Confident | 2 Ų | 2 | 57.1 Ų | 57.1 | 1% | 0.014 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -56.6 | -35.3 | 174 | -175.3 | 0 | 0 | 0 | 0 | 112.7 | H210 S425 L427 S480 | H210-S429 PolarHBondContact ND1-O 3.37Å; H210-S429 PolarHBondContact O-OG 3.42Å; S425-S429 PolarHBondContact O-N 2.9Å; L427-S429 PolarHBondContact O-N 3.5Å; S429-S480 WeakPolarHBondContact CA-OG 3.22Å; S429-S480 PolarHBondContact N-OG 2.76Å |
| 430 | Y | 88.3 | Confident | 89.6 | Confident | 145 Ų | 145 | 57.6 Ų | 57.6 | 57% | 0.569 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -71.9 | -43.6 | 173.4 | -172.1 | -111.1 | 0 | 0 | 0 | 111.9 | L427 Y428 R433 F434 | L427-Y430 WeakPolarHBondContact O-CB 3.45Å; L427-Y430 PolarHBondContact O-N 3.49Å; Y428-Y430 PolarHBondContact O-N 2.8Å; Y430-R433 PolarHBondContact O-N 2.98Å; Y430-F434 AromaticContact CD1-CE2 3.95Å; Y430-F434 HydrophobicContact CD1-CE2 3.95Å; Y430-F434 HydrophobicContact CD2-CE2 4.43Å; Y430-F434 AromaticContact CE1-CE2 3.54Å; Y430-F434 HydrophobicContact CE1-CE2 3.54Å; Y430-F434 HydrophobicContact CE1-CZ 4.13Å; Y430-F434 HydrophobicContact CE2-CE2 4.05Å; Y430-F434 HydrophobicContact CE2-CZ 4.49Å; Y430-F434 HydrophobicContact CG-CE2 4.38Å; Y430-F434 AromaticContact CZ-CE2 3.58Å; Y430-F434 AromaticContact CZ-CZ 3.88Å; Y430-F434 VanDerWaalsContact O-CD2 3.27Å; Y430-F434 WeakPolarHBondContact O-CD2 3.27Å |
| 431 | V | 90.3 | Very high | 89.4 | Confident | 60 Ų | 60 | 56.2 Ų | 56.2 | 36% | 0.364 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -64.2 | -41.1 | 178.1 | 172.8 | 0 | 0 | 0 | 0 | 112.4 | L427 Y428 R433 F434 L435 | L427-V431 WeakPolarHBondContact O-CG2 3.48Å; L427-V431 PolarHBondContact O-N 3.25Å; L427-V431 VanDerWaalsContact O-N 3.13Å; Y428-V431 HydrophobicContact CD2-CB 4.35Å; Y428-V431 HydrophobicContact CD2-CG1 4.4Å; Y428-V431 HydrophobicContact CE2-CG1 4.47Å; Y428-V431 CarbonylContact O-C 3.54Å; Y428-V431 PolarHBondContact O-N 3.47Å; V431-R433 PolarHBondContact O-N 3.15Å; V431-R433 VanDerWaalsContact O-N 3.15Å; V431-F434 PolarHBondContact O-N 2.67Å; V431-L435 HydrophobicContact CG1-CD1 3.74Å; V431-L435 HydrophobicContact CG1-CD2 4.27Å; V431-L435 PolarHBondContact O-N 3.32Å; V431-L435 VanDerWaalsContact O-N 3.08Å |
| 432 | Q | 88.4 | Confident | 89.2 | Confident | 0 Ų | 0 | 60.7 Ų | 60.7 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -48.7 | -42.6 | 176.5 | -80.9 | -178.1 | -21.9 | 0 | 0 | 111.8 | H210 Y428 F434 L435 L436 L444 S480 T484 | H210-Q432 PolarHBondContact CE1-OE1 3.34Å; Y428-Q432 HydrophobicContact CD1-CG 3.61Å; Y428-Q432 HydrophobicContact CE1-CG 3.41Å; Y428-Q432 VanDerWaalsContact CE1-CG 3.41Å; Y428-Q432 HydrophobicContact CG-CG 4.29Å; Y428-Q432 WeakPolarHBondContact O-CB 3.32Å; Y428-Q432 WeakPolarHBondContact O-CG 3.24Å; Y428-Q432 PolarHBondContact O-N 2.98Å; Q432-F434 VanDerWaalsContact C-N 3.25Å; Q432-F434 PolarHBondContact O-N 3.19Å; Q432-L435 PolarHBondContact O-N 2.93Å; Q432-L435 VanDerWaalsContact O-N 3.11Å; Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 PolarHBondContact O-N 3.33Å; Q432-L444 HydrophobicContact CB-CD2 4.02Å; Q432-L444 HydrophobicContact CG-CD1 4.38Å; Q432-L444 HydrophobicContact CG-CD2 4.07Å; Q432-L444 HydrophobicContact CG-CG 4.47Å; Q432-S480 VanDerWaalsContact CD-OG 3.32Å; Q432-S480 PolarHBondContact NE2-O 3.44Å; Q432-S480 PolarHBondContact NE2-OG 3.37Å; Q432-S480 PolarHBondContact OE1-OG 2.94Å; Q432-T484 VanDerWaalsContact CD-OG1 3.29Å; Q432-T484 PolarHBondContact NE2-OG1 3.06Å; Q432-T484 VanDerWaalsContact NE2-OG1 3.13Å; Q432-T484 PolarHBondContact OE1-OG1 2.92Å |
| 433 | R | 84.3 | Confident | 89.3 | Confident | 81 Ų | 81 | 61.4 Ų | 61.4 | 31% | 0.306 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -67 | -22.2 | -179.5 | -177.2 | 172.6 | 160 | -160.3 | -12.7 | 113.9 | Y430 V431 | Y430-R433 PolarHBondContact O-N 2.98Å; V431-R433 PolarHBondContact O-N 3.15Å; V431-R433 VanDerWaalsContact O-N 3.15Å |
| 434 | F | 86.5 | Confident | 89.2 | Confident | 113 Ų | 113 | 58.6 Ų | 58.6 | 50% | 0.496 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -87.9 | -28 | 170.5 | -64.5 | -86.8 | 0 | 0 | 0 | 112.7 | Y430 V431 Q432 P437 Y438 | Y430-F434 AromaticContact CD1-CE2 3.95Å; Y430-F434 HydrophobicContact CD1-CE2 3.95Å; Y430-F434 HydrophobicContact CD2-CE2 4.43Å; Y430-F434 AromaticContact CE1-CE2 3.54Å; Y430-F434 HydrophobicContact CE1-CE2 3.54Å; Y430-F434 HydrophobicContact CE1-CZ 4.13Å; Y430-F434 HydrophobicContact CE2-CE2 4.05Å; Y430-F434 HydrophobicContact CE2-CZ 4.49Å; Y430-F434 HydrophobicContact CG-CE2 4.38Å; Y430-F434 AromaticContact CZ-CE2 3.58Å; Y430-F434 AromaticContact CZ-CZ 3.88Å; Y430-F434 VanDerWaalsContact O-CD2 3.27Å; Y430-F434 WeakPolarHBondContact O-CD2 3.27Å; V431-F434 PolarHBondContact O-N 2.67Å; Q432-F434 VanDerWaalsContact C-N 3.25Å; Q432-F434 PolarHBondContact O-N 3.19Å; F434-P437 WeakPolarHBondContact O-CD 3.46Å; F434-Y438 WeakPolarHBondContact O-CD2 3.42Å; F434-Y438 WeakPolarHBondContact O-CE2 3.49Å |
| 435 | L | 87.1 | Confident | 89.1 | Confident | 51 Ų | 51 | 57.5 Ų | 57.5 | 27% | 0.267 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -78.1 | -29.9 | 175.8 | -90.9 | 55.5 | 0 | 0 | 0 | 112.7 | V431 Q432 Y438 I439 L444 | V431-L435 HydrophobicContact CG1-CD1 3.74Å; V431-L435 HydrophobicContact CG1-CD2 4.27Å; V431-L435 PolarHBondContact O-N 3.32Å; V431-L435 VanDerWaalsContact O-N 3.08Å; Q432-L435 PolarHBondContact O-N 2.93Å; Q432-L435 VanDerWaalsContact O-N 3.11Å; L435-Y438 PolarHBondContact O-N 2.98Å; L435-I439 HydrophobicContact CB-CD1 4.15Å; L435-I439 HydrophobicContact CD2-CD1 4.09Å; L435-I439 HydrophobicContact CG-CD1 3.92Å; L435-I439 PolarHBondContact O-N 3.36Å; L435-L444 HydrophobicContact CB-CD1 4.22Å; L435-L444 HydrophobicContact CD2-CD1 4.18Å |
| 436 | L | 86.6 | Confident | 89.2 | Confident | 28 Ų | 28 | 60.9 Ų | 60.9 | 15% | 0.147 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -51.4 | -43.3 | -175.7 | -175.7 | 64.3 | 0 | 0 | 0 | 114.1 | E206 Q432 Y438 G440 L441 L444 | E206-L436 HydrophobicContact CG-CD2 4.34Å; Q432-L436 WeakPolarHBondContact O-CB 3.46Å; Q432-L436 PolarHBondContact O-N 3.33Å; L436-Y438 VanDerWaalsContact C-N 3.32Å; L436-Y438 PolarHBondContact O-N 2.86Å; L436-G440 VanDerWaalsContact O-CA 3.28Å; L436-G440 WeakPolarHBondContact O-CA 3.36Å; L436-G440 PolarHBondContact O-N 2.99Å; L436-L441 HydrophobicContact CD1-CD2 3.56Å; L436-L441 HydrophobicContact CD1-CG 3.82Å; L436-L444 HydrophobicContact CD1-CD2 4.46Å |
| 437 | P | 86.8 | Confident | 89.3 | Confident | 107 Ų | 107 | 64.8 Ų | 64.8 | 70% | 0.695 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -72.8 | -18.6 | 178.4 | -17.9 | 33.9 | 0 | 0 | 0 | 114.9 | F434 | F434-P437 WeakPolarHBondContact O-CD 3.46Å |
| 438 | Y | 89.1 | Confident | 89.3 | Confident | 210 Ų | 210 | 59.3 Ų | 59.3 | 82% | 0.824 | 29% | 0.289 | S | S | * | . | H | α-helix | trans | -97.4 | -33.9 | -178.7 | -61 | -81.9 | 0 | 0 | 0 | 113 | F434 L435 L436 | F434-Y438 WeakPolarHBondContact O-CD2 3.42Å; F434-Y438 WeakPolarHBondContact O-CE2 3.49Å; L435-Y438 PolarHBondContact O-N 2.98Å; L436-Y438 VanDerWaalsContact C-N 3.32Å; L436-Y438 PolarHBondContact O-N 2.86Å |
| 439 | I | 88.4 | Confident | 89.3 | Confident | 70 Ų | 70 | 57.9 Ų | 57.9 | 36% | 0.359 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -111.3 | -23.7 | -170.7 | -57.3 | 178.9 | 0 | 0 | 0 | 111.7 | L435 | L435-I439 HydrophobicContact CB-CD1 4.15Å; L435-I439 HydrophobicContact CD2-CD1 4.09Å; L435-I439 HydrophobicContact CG-CD1 3.92Å; L435-I439 PolarHBondContact O-N 3.36Å |
| 440 | G | 88.3 | Confident | 89.6 | Confident | 31 Ų | 31 | 62.8 Ų | 62.8 | 32% | 0.32 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | 70.3 | 165.8 | -174.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | L436 K442 L444 | L436-G440 VanDerWaalsContact O-CA 3.28Å; L436-G440 WeakPolarHBondContact O-CA 3.36Å; L436-G440 PolarHBondContact O-N 2.99Å; G440-K442 VanDerWaalsContact C-N 3.34Å; G440-K442 PolarHBondContact O-N 3.45Å; G440-L444 VanDerWaalsContact O-CB 3.26Å; G440-L444 WeakPolarHBondContact O-CB 3.49Å; G440-L444 PolarHBondContact O-N 2.92Å |
| 441 | L | 86.9 | Confident | 89.9 | Confident | 34 Ų | 34 | 57.7 Ų | 57.7 | 18% | 0.178 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -55.2 | -47.2 | -179.2 | -71.1 | 170.3 | 0 | 0 | 0 | 112.1 | L436 L444 Y445 I485 N488 L489 | L436-L441 HydrophobicContact CD1-CD2 3.56Å; L436-L441 HydrophobicContact CD1-CG 3.82Å; L441-L444 PolarHBondContact O-N 3.49Å; L441-Y445 WeakPolarHBondContact O-CB 3.29Å; L441-Y445 PolarHBondContact O-N 2.86Å; L441-I485 HydrophobicContact CB-CG2 4.2Å; L441-I485 HydrophobicContact CD2-CD1 4.24Å; L441-I485 HydrophobicContact CD2-CG2 4.12Å; L441-I485 WeakPolarHBondContact O-CG2 3.46Å; L441-N488 HydrophobicContact CD1-CB 4.37Å; L441-N488 HydrophobicContact CD2-CB 3.71Å; L441-L489 HydrophobicContact CB-CD2 3.82Å; L441-L489 HydrophobicContact CB-CG 4.19Å; L441-L489 HydrophobicContact CD1-CD2 3.87Å; L441-L489 HydrophobicContact CD1-CG 4.2Å; L441-L489 HydrophobicContact CG-CD2 4.47Å |
| 442 | K | 88.6 | Confident | 90.1 | Very high | 105 Ų | 105 | 54.9 Ų | 54.9 | 46% | 0.457 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -63.8 | -48.1 | -175.5 | -58.3 | 179.6 | 173.3 | -160.9 | 0 | 112.7 | G440 L444 Y445 F446 I567 | G440-K442 VanDerWaalsContact C-N 3.34Å; G440-K442 PolarHBondContact O-N 3.45Å; K442-L444 VanDerWaalsContact C-N 3.32Å; K442-L444 PolarHBondContact O-N 3.28Å; K442-Y445 WeakPolarHBondContact O-CB 3.35Å; K442-Y445 PolarHBondContact O-N 2.9Å; K442-F446 PolarHBondContact O-N 3Å; K442-I567 WeakPolarHBondContact CD-OXT 3.48Å; K442-I567 WeakPolarHBondContact CE-O 3.32Å; K442-I567 HydrophobicContact CG-CG2 4.34Å; K442-I567 PolarHBondContact NZ-O 2.83Å |
| 443 | G | 89.4 | Confident | 90.3 | Very high | 23 Ų | 23 | 55.2 Ų | 55.2 | 24% | 0.237 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -67.2 | -33.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F446 M447 | G443-F446 PolarHBondContact O-N 3.03Å; G443-M447 WeakPolarHBondContact O-CB 3.4Å; G443-M447 VanDerWaalsContact O-CG 3.27Å; G443-M447 WeakPolarHBondContact O-CG 3.28Å; G443-M447 PolarHBondContact O-N 3.28Å |
| 444 | L | 91.5 | Very high | 90.8 | Very high | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -69.2 | -35.6 | 175.7 | -169.5 | 55.2 | 0 | 0 | 0 | 111.3 | Y428 Q432 L435 L436 G440 L441 K442 G448 I485 | Y428-L444 VanDerWaalsContact OH-CD1 3.28Å; Y428-L444 WeakPolarHBondContact OH-CD1 3.48Å; Q432-L444 HydrophobicContact CB-CD2 4.02Å; Q432-L444 HydrophobicContact CG-CD1 4.38Å; Q432-L444 HydrophobicContact CG-CD2 4.07Å; Q432-L444 HydrophobicContact CG-CG 4.47Å; L435-L444 HydrophobicContact CB-CD1 4.22Å; L435-L444 HydrophobicContact CD2-CD1 4.18Å; L436-L444 HydrophobicContact CD1-CD2 4.46Å; G440-L444 VanDerWaalsContact O-CB 3.26Å; G440-L444 WeakPolarHBondContact O-CB 3.49Å; G440-L444 PolarHBondContact O-N 2.92Å; L441-L444 PolarHBondContact O-N 3.49Å; K442-L444 VanDerWaalsContact C-N 3.32Å; K442-L444 PolarHBondContact O-N 3.28Å; L444-G448 PolarHBondContact O-N 3.37Å; L444-I485 HydrophobicContact CB-CD1 4.47Å; L444-I485 HydrophobicContact CD2-CD1 3.63Å; L444-I485 HydrophobicContact CG-CD1 3.96Å; L444-I485 HydrophobicContact CG-CG1 4.38Å |
| 445 | Y | 92.3 | Very high | 91 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.8 | -48.8 | 172.1 | -157 | -143 | 0 | 0 | 0 | 111.7 | L363 S366 H367 L441 K442 M447 G448 Y449 T481 I485 P486 I563 I567 | L363-Y445 HydrophobicContact CD1-CE1 4.29Å; S366-Y445 WeakPolarHBondContact OG-CE1 3.31Å; S366-Y445 PolarHBondContact OG-OH 3.14Å; H367-Y445 PolarHBondContact N-OH 3.48Å; L441-Y445 WeakPolarHBondContact O-CB 3.29Å; L441-Y445 PolarHBondContact O-N 2.86Å; K442-Y445 WeakPolarHBondContact O-CB 3.35Å; K442-Y445 PolarHBondContact O-N 2.9Å; Y445-M447 PolarHBondContact O-N 3.45Å; Y445-G448 PolarHBondContact O-N 2.77Å; Y445-Y449 AromaticContact CD2-CE2 3.93Å; Y445-Y449 HydrophobicContact CD2-CE2 3.93Å; Y445-Y449 HydrophobicContact CE1-CE2 4.46Å; Y445-Y449 HydrophobicContact CE2-CD2 4.5Å; Y445-Y449 AromaticContact CE2-CE2 3.52Å; Y445-Y449 HydrophobicContact CE2-CE2 3.52Å; Y445-Y449 AromaticContact CZ-CE2 3.78Å; Y445-Y449 AromaticContact CZ-CZ 3.99Å; Y445-Y449 VanDerWaalsContact O-CD2 3.29Å; Y445-Y449 WeakPolarHBondContact O-CD2 3.14Å; Y445-Y449 PolarHBondContact O-N 3.35Å; Y445-Y449 PolarHBondContact OH-OH 2.86Å; Y445-T481 HydrophobicContact CD2-CG2 3.72Å; Y445-T481 HydrophobicContact CE2-CG2 4.36Å; Y445-I485 HydrophobicContact CD2-CB 3.96Å; Y445-I485 HydrophobicContact CD2-CG2 4.05Å; Y445-I485 HydrophobicContact CG-CB 4.5Å; Y445-I485 HydrophobicContact CG-CG2 4.09Å; Y445-P486 HydrophobicContact CD2-CG 4.41Å; Y445-P486 HydrophobicContact CE2-CG 3.55Å; Y445-I563 HydrophobicContact CD1-CD1 3.52Å; Y445-I563 HydrophobicContact CD1-CG1 3.65Å; Y445-I563 HydrophobicContact CD1-CG2 4.11Å; Y445-I563 HydrophobicContact CE1-CD1 3.73Å; Y445-I563 HydrophobicContact CE1-CG1 3.77Å; Y445-I563 HydrophobicContact CG-CD1 3.98Å; Y445-I567 HydrophobicContact CD1-CD1 4.34Å; Y445-I567 HydrophobicContact CE1-CD1 3.95Å |
| 446 | F | 93.9 | Very high | 91.2 | Very high | 71 Ų | 71 | 48.2 Ų | 48.2 | 31% | 0.311 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -56.6 | -47 | 174.4 | 176.4 | -85.8 | 0 | 0 | 0 | 112 | K442 G443 G448 Y449 F450 C560 I563 A564 | K442-F446 PolarHBondContact O-N 3Å; G443-F446 PolarHBondContact O-N 3.03Å; F446-G448 VanDerWaalsContact C-N 3.34Å; F446-G448 PolarHBondContact O-N 2.93Å; F446-Y449 PolarHBondContact O-N 3.18Å; F446-F450 HydrophobicContact CE1-CB 4.28Å; F446-F450 WeakPolarHBondContact O-CB 3.48Å; F446-F450 PolarHBondContact O-N 3.46Å; F446-C560 VanDerWaalsContact CD2-SG 3.52Å; F446-C560 WeakPolarHBondContact CE2-SG 3.49Å; F446-I563 HydrophobicContact CB-CG2 4.1Å; F446-A564 HydrophobicContact CD2-CB 4.08Å; F446-A564 HydrophobicContact CE2-CB 3.98Å |
| 447 | M | 93.1 | Very high | 91.4 | Very high | 84 Ų | 84 | 48.5 Ų | 48.5 | 41% | 0.414 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60 | -40 | 179.7 | -79.3 | -70.2 | 174.1 | 0 | 0 | 112.7 | G443 Y445 Y449 F450 V451 | G443-M447 WeakPolarHBondContact O-CB 3.4Å; G443-M447 VanDerWaalsContact O-CG 3.27Å; G443-M447 WeakPolarHBondContact O-CG 3.28Å; G443-M447 PolarHBondContact O-N 3.28Å; Y445-M447 PolarHBondContact O-N 3.45Å; M447-Y449 PolarHBondContact O-N 3.43Å; M447-F450 PolarHBondContact O-N 3.35Å; M447-V451 VanDerWaalsContact O-CB 3.32Å; M447-V451 WeakPolarHBondContact O-CB 3.07Å; M447-V451 VanDerWaalsContact O-CG2 3.24Å; M447-V451 WeakPolarHBondContact O-CG2 3.33Å; M447-V451 PolarHBondContact O-N 2.89Å |
| 448 | G | 92.7 | Very high | 91.6 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -59.1 | -46.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L444 Y445 F446 F452 | L444-G448 PolarHBondContact O-N 3.37Å; Y445-G448 PolarHBondContact O-N 2.77Å; F446-G448 VanDerWaalsContact C-N 3.34Å; F446-G448 PolarHBondContact O-N 2.93Å; G448-F452 WeakPolarHBondContact O-CB 3.35Å; G448-F452 PolarHBondContact O-N 2.93Å |
| 449 | Y | 94.4 | Very high | 91.5 | Very high | 0 Ų | 0 | 36.6 Ų | 36.6 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -70.7 | -38.9 | 179.9 | -78 | -119.6 | 0 | 0 | 0 | 112.4 | S366 G370 Y445 F446 M447 G453 M478 L482 S556 I563 | S366-Y449 PolarHBondContact O-OH 3.13Å; S366-Y449 PolarHBondContact OG-OH 3.21Å; G370-Y449 VanDerWaalsContact CA-CE1 3.46Å; G370-Y449 VanDerWaalsContact CA-OH 3.29Å; G370-Y449 WeakPolarHBondContact CA-OH 3.48Å; G370-Y449 PolarHBondContact N-OH 3.49Å; Y445-Y449 AromaticContact CD2-CE2 3.93Å; Y445-Y449 HydrophobicContact CD2-CE2 3.93Å; Y445-Y449 HydrophobicContact CE1-CE2 4.46Å; Y445-Y449 HydrophobicContact CE2-CD2 4.5Å; Y445-Y449 AromaticContact CE2-CE2 3.52Å; Y445-Y449 HydrophobicContact CE2-CE2 3.52Å; Y445-Y449 AromaticContact CZ-CE2 3.78Å; Y445-Y449 AromaticContact CZ-CZ 3.99Å; Y445-Y449 VanDerWaalsContact O-CD2 3.29Å; Y445-Y449 WeakPolarHBondContact O-CD2 3.14Å; Y445-Y449 PolarHBondContact O-N 3.35Å; Y445-Y449 PolarHBondContact OH-OH 2.86Å; F446-Y449 PolarHBondContact O-N 3.18Å; M447-Y449 PolarHBondContact O-N 3.43Å; Y449-G453 PolarHBondContact O-N 3.06Å; Y449-M478 HydrophobicContact CD1-CE 3.89Å; Y449-M478 HydrophobicContact CD2-CE 3.91Å; Y449-M478 HydrophobicContact CD2-SD 3.97Å; Y449-M478 HydrophobicContact CE1-CE 4.14Å; Y449-M478 HydrophobicContact CE2-CE 4.14Å; Y449-M478 HydrophobicContact CE2-SD 4.21Å; Y449-M478 HydrophobicContact CG-CE 3.8Å; Y449-M478 HydrophobicContact CG-SD 4.39Å; Y449-L482 HydrophobicContact CE2-CD2 4.12Å; Y449-S556 PolarHBondContact O-OG 3Å; Y449-I563 HydrophobicContact CD1-CD1 4.01Å; Y449-I563 HydrophobicContact CD2-CD1 3.58Å; Y449-I563 HydrophobicContact CE1-CD1 4.1Å; Y449-I563 HydrophobicContact CE2-CD1 3.69Å; Y449-I563 HydrophobicContact CG-CD1 3.73Å |
| 450 | F | 94.7 | Very high | 91.3 | Very high | 105 Ų | 105 | 33.9 Ų | 33.9 | 46% | 0.461 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -64.6 | -50.9 | 177.6 | -178.6 | -100.6 | 0 | 0 | 0 | 111.3 | F446 M447 F452 G453 M454 | F446-F450 HydrophobicContact CE1-CB 4.28Å; F446-F450 WeakPolarHBondContact O-CB 3.48Å; F446-F450 PolarHBondContact O-N 3.46Å; M447-F450 PolarHBondContact O-N 3.35Å; F450-F452 VanDerWaalsContact C-N 3.34Å; F450-F452 PolarHBondContact O-N 3.23Å; F450-G453 PolarHBondContact O-N 2.95Å; F450-M454 HydrophobicContact CE1-SD 4.39Å; F450-M454 WeakPolarHBondContact O-CB 3.42Å; F450-M454 PolarHBondContact O-N 3.05Å |
| 451 | V | 94.5 | Very high | 91.2 | Very high | 39 Ų | 39 | 37.9 Ų | 37.9 | 24% | 0.236 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -63.7 | -41.5 | 179.7 | 175.5 | 0 | 0 | 0 | 0 | 110.2 | M447 M454 G455 V474 V477 | M447-V451 VanDerWaalsContact O-CB 3.32Å; M447-V451 WeakPolarHBondContact O-CB 3.07Å; M447-V451 VanDerWaalsContact O-CG2 3.24Å; M447-V451 WeakPolarHBondContact O-CG2 3.33Å; M447-V451 PolarHBondContact O-N 2.89Å; V451-M454 PolarHBondContact O-N 3.45Å; V451-G455 PolarHBondContact O-N 3.43Å; V451-V474 HydrophobicContact CG1-CB 4.41Å; V451-V474 HydrophobicContact CG1-CG1 3.96Å; V451-V474 HydrophobicContact CG1-CG2 3.88Å; V451-V474 WeakPolarHBondContact O-CG1 3.23Å; V451-V477 HydrophobicContact CG1-CG1 4.47Å |
| 452 | F | 94.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.6 | -47.2 | 175 | -172.5 | -99.2 | 0 | 0 | 0 | 113.7 | A373 F374 N377 G448 F450 M454 G455 T456 V474 F475 M478 A552 | A373-F452 HydrophobicContact CB-CE1 4.16Å; F374-F452 HydrophobicContact CD2-CE2 4.07Å; F374-F452 HydrophobicContact CD2-CZ 4.39Å; N377-F452 HydrophobicContact CB-CZ 4.11Å; G448-F452 WeakPolarHBondContact O-CB 3.35Å; G448-F452 PolarHBondContact O-N 2.93Å; F450-F452 VanDerWaalsContact C-N 3.34Å; F450-F452 PolarHBondContact O-N 3.23Å; F452-M454 VanDerWaalsContact C-N 3.32Å; F452-M454 PolarHBondContact O-N 3.22Å; F452-G455 PolarHBondContact O-N 3.01Å; F452-T456 HydrophobicContact CD1-CG2 4.24Å; F452-T456 HydrophobicContact CD2-CG2 4.48Å; F452-T456 HydrophobicContact CE1-CG2 3.82Å; F452-T456 HydrophobicContact CE2-CG2 4.09Å; F452-T456 HydrophobicContact CZ-CG2 3.74Å; F452-T456 WeakPolarHBondContact O-CB 3.38Å; F452-T456 PolarHBondContact O-N 3.21Å; F452-T456 PolarHBondContact O-OG1 3.38Å; F452-V474 HydrophobicContact CB-CG1 4.48Å; F452-F475 AromaticContact CD2-CD1 3.96Å; F452-F475 HydrophobicContact CD2-CD1 3.96Å; F452-F475 HydrophobicContact CE2-CB 4.23Å; F452-F475 AromaticContact CE2-CD1 3.52Å; F452-F475 HydrophobicContact CE2-CD1 3.52Å; F452-F475 HydrophobicContact CE2-CE1 4.26Å; F452-F475 HydrophobicContact CE2-CG 4.16Å; F452-F475 HydrophobicContact CZ-CD1 4.46Å; F452-M478 HydrophobicContact CB-CB 3.93Å; F452-M478 HydrophobicContact CB-CE 4.1Å; F452-M478 HydrophobicContact CB-CG 4.07Å; F452-M478 HydrophobicContact CB-SD 4.16Å; F452-M478 HydrophobicContact CD1-CE 3.89Å; F452-M478 HydrophobicContact CD1-CG 4.29Å; F452-M478 HydrophobicContact CD2-CB 3.38Å; F452-M478 HydrophobicContact CD2-CG 3.72Å; F452-M478 HydrophobicContact CE2-CB 4.06Å; F452-M478 HydrophobicContact CE2-CG 4.2Å; F452-M478 HydrophobicContact CG-CB 3.78Å; F452-M478 HydrophobicContact CG-CE 4.05Å; F452-M478 HydrophobicContact CG-CG 3.76Å; F452-M478 HydrophobicContact CG-SD 4.36Å; F452-A552 HydrophobicContact CE1-CB 4.49Å |
| 453 | G | 93.3 | Very high | 90.5 | Very high | 8 Ų | 8 | 40.9 Ų | 40.9 | 8% | 0.082 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -62.1 | -39.8 | 177 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y449 F450 T456 S457 S553 | Y449-G453 PolarHBondContact O-N 3.06Å; F450-G453 PolarHBondContact O-N 2.95Å; G453-T456 PolarHBondContact O-OG1 3.34Å; G453-S457 VanDerWaalsContact O-CB 3.31Å; G453-S457 WeakPolarHBondContact O-CB 3.27Å; G453-S457 PolarHBondContact O-N 3.36Å; G453-S457 PolarHBondContact O-OG 3.5Å; G453-S553 PolarHBondContact O-OG 3.33Å |
| 454 | M | 93.7 | Very high | 90.3 | Very high | 95 Ų | 95 | 43.4 Ų | 43.4 | 47% | 0.468 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -66.3 | -47.5 | 175.5 | -173.8 | 174.7 | 65.4 | 0 | 0 | 112.2 | F450 V451 F452 S457 L458 | F450-M454 HydrophobicContact CE1-SD 4.39Å; F450-M454 WeakPolarHBondContact O-CB 3.42Å; F450-M454 PolarHBondContact O-N 3.05Å; V451-M454 PolarHBondContact O-N 3.45Å; F452-M454 VanDerWaalsContact C-N 3.32Å; F452-M454 PolarHBondContact O-N 3.22Å; M454-S457 PolarHBondContact O-N 3.43Å; M454-L458 HydrophobicContact CG-CD1 4.29Å; M454-L458 WeakPolarHBondContact O-CG 3.47Å; M454-L458 PolarHBondContact O-N 3.04Å |
| 455 | G | 92 | Very high | 89.9 | Confident | 2 Ų | 2 | 45.7 Ų | 45.7 | 2% | 0.021 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.4 | -43.1 | -179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | V451 F452 L458 I459 | V451-G455 PolarHBondContact O-N 3.43Å; F452-G455 PolarHBondContact O-N 3.01Å; G455-L458 PolarHBondContact O-N 3.45Å; G455-I459 WeakPolarHBondContact O-CG1 3.38Å; G455-I459 PolarHBondContact O-N 3.32Å; G455-I459 VanDerWaalsContact O-N 3.08Å |
| 456 | T | 90.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 172.9 | 47.1 | 0 | 0 | 0 | 0 | 111.4 | F452 G453 L458 I459 G460 F475 V549 S553 | F452-T456 HydrophobicContact CD1-CG2 4.24Å; F452-T456 HydrophobicContact CD2-CG2 4.48Å; F452-T456 HydrophobicContact CE1-CG2 3.82Å; F452-T456 HydrophobicContact CE2-CG2 4.09Å; F452-T456 HydrophobicContact CZ-CG2 3.74Å; F452-T456 WeakPolarHBondContact O-CB 3.38Å; F452-T456 PolarHBondContact O-N 3.21Å; F452-T456 PolarHBondContact O-OG1 3.38Å; G453-T456 PolarHBondContact O-OG1 3.34Å; T456-L458 VanDerWaalsContact C-N 3.32Å; T456-L458 PolarHBondContact O-N 3.2Å; T456-I459 PolarHBondContact O-N 3.11Å; T456-G460 PolarHBondContact O-N 3.46Å; T456-F475 HydrophobicContact CG2-CD1 4.42Å; T456-F475 HydrophobicContact CG2-CE1 3.76Å; T456-V549 WeakPolarHBondContact O-CG1 3.36Å; T456-S553 WeakPolarHBondContact OG1-CA 3.28Å; T456-S553 WeakPolarHBondContact OG1-CB 3.34Å |
| 457 | S | 91 | Very high | 89.2 | Confident | 34 Ų | 34 | 49.5 Ų | 49.5 | 24% | 0.238 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -57.8 | -42.6 | 174.6 | -57.8 | 0 | 0 | 0 | 0 | 112.8 | G453 M454 G460 L461 S553 | G453-S457 VanDerWaalsContact O-CB 3.31Å; G453-S457 WeakPolarHBondContact O-CB 3.27Å; G453-S457 PolarHBondContact O-N 3.36Å; G453-S457 PolarHBondContact O-OG 3.5Å; M454-S457 PolarHBondContact O-N 3.43Å; S457-G460 PolarHBondContact O-N 2.98Å; S457-L461 WeakPolarHBondContact O-CB 3.49Å; S457-L461 VanDerWaalsContact O-CG 3.29Å; S457-L461 WeakPolarHBondContact O-CG 3.49Å; S457-L461 PolarHBondContact O-N 3.49Å; S457-S553 WeakPolarHBondContact OG-CB 3.4Å; S457-S553 PolarHBondContact OG-OG 3.08Å |
| 458 | L | 90.8 | Very high | 88.9 | Confident | 68 Ų | 68 | 45.5 Ų | 45.5 | 36% | 0.356 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -65.4 | -40.1 | 178.7 | -73 | 169 | 0 | 0 | 0 | 112.2 | M454 G455 T456 L461 F462 L471 | M454-L458 HydrophobicContact CG-CD1 4.29Å; M454-L458 WeakPolarHBondContact O-CG 3.47Å; M454-L458 PolarHBondContact O-N 3.04Å; G455-L458 PolarHBondContact O-N 3.45Å; T456-L458 VanDerWaalsContact C-N 3.32Å; T456-L458 PolarHBondContact O-N 3.2Å; L458-L461 PolarHBondContact O-N 3.37Å; L458-F462 HydrophobicContact CD2-CD2 4.34Å; L458-F462 HydrophobicContact CD2-CE2 4.39Å; L458-F462 PolarHBondContact O-N 2.85Å; L458-L471 HydrophobicContact CB-CD1 3.87Å |
| 459 | I | 88.4 | Confident | 88.7 | Confident | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.9 | -43.3 | 173.5 | -68 | 169.2 | 0 | 0 | 0 | 111.1 | F384 G455 T456 L461 F462 T468 L471 F475 V549 | F384-I459 HydrophobicContact CE1-CG2 3.47Å; F384-I459 VanDerWaalsContact CE1-CG2 3.47Å; F384-I459 HydrophobicContact CZ-CG2 3.92Å; G455-I459 WeakPolarHBondContact O-CG1 3.38Å; G455-I459 PolarHBondContact O-N 3.32Å; G455-I459 VanDerWaalsContact O-N 3.08Å; T456-I459 PolarHBondContact O-N 3.11Å; I459-L461 VanDerWaalsContact C-N 3.3Å; I459-L461 PolarHBondContact O-N 2.79Å; I459-F462 CarbonylContact O-C 3.58Å; I459-T468 HydrophobicContact CD1-CG2 4.12Å; I459-T468 HydrophobicContact CG1-CG2 4.21Å; I459-T468 HydrophobicContact CG2-CG2 3.95Å; I459-L471 HydrophobicContact CD1-CB 3.68Å; I459-L471 HydrophobicContact CG1-CB 3.76Å; I459-L471 HydrophobicContact CG1-CD1 3.69Å; I459-L471 HydrophobicContact CG1-CG 4.37Å; I459-F475 HydrophobicContact CD1-CE1 3.75Å; I459-F475 HydrophobicContact CD1-CE2 4.38Å; I459-F475 HydrophobicContact CD1-CZ 3.35Å; I459-V549 HydrophobicContact CB-CG1 4.34Å; I459-V549 HydrophobicContact CG2-CG1 4.25Å |
| 460 | G | 84.2 | Confident | 88.5 | Confident | 12 Ų | 12 | 52.6 Ų | 52.6 | 12% | 0.124 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -67.7 | -26 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.3 | T456 S457 | T456-G460 PolarHBondContact O-N 3.46Å; S457-G460 PolarHBondContact O-N 2.98Å |
| 461 | L | 85.8 | Confident | 88.3 | Confident | 116 Ų | 116 | 49.3 Ų | 49.3 | 61% | 0.607 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -89.7 | -34.1 | 177.5 | -70.7 | 169.1 | 0 | 0 | 0 | 113.2 | S457 L458 I459 | S457-L461 WeakPolarHBondContact O-CB 3.49Å; S457-L461 VanDerWaalsContact O-CG 3.29Å; S457-L461 WeakPolarHBondContact O-CG 3.49Å; S457-L461 PolarHBondContact O-N 3.49Å; L458-L461 PolarHBondContact O-N 3.37Å; I459-L461 VanDerWaalsContact C-N 3.3Å; I459-L461 PolarHBondContact O-N 2.79Å |
| 462 | F | 83.9 | Confident | 88 | Confident | 136 Ų | 136 | 47.4 Ų | 47.4 | 60% | 0.596 | 26% | 0.26 | S | S | * | . | trans | -130.8 | 77.5 | -174.3 | -57.7 | -72.8 | 0 | 0 | 0 | 110.9 | L458 I459 D464 | L458-F462 HydrophobicContact CD2-CD2 4.34Å; L458-F462 HydrophobicContact CD2-CE2 4.39Å; L458-F462 PolarHBondContact O-N 2.85Å; I459-F462 CarbonylContact O-C 3.58Å; F462-D464 PolarHBondContact O-N 2.75Å | ||
| 463 | P | 76.1 | Confident | 87.9 | Confident | 65 Ų | 65 | 49.4 Ų | 49.4 | 42% | 0.422 | 27% | 0.273 | S | S | . | . | trans | -75.3 | 68.9 | -178.7 | 32.1 | -36.8 | 0 | 0 | 0 | 112.1 | I389 | I389-P463 HydrophobicContact CG1-CB 3.88Š| ||
| 464 | D | 84.6 | Confident | 87.9 | Confident | 76 Ų | 76 | 49.9 Ų | 49.9 | 41% | 0.406 | 28% | 0.275 | S | S | . | . | trans | -99.4 | 147.6 | 168 | 170.1 | 68.3 | 0 | 0 | 0 | 111.1 | F462 I466 A467 T468 | F462-D464 PolarHBondContact O-N 2.75Å; D464-I466 WeakPolarHBondContact OD2-CA 3.39Å; D464-I466 PolarHBondContact OD2-N 3.13Å; D464-A467 HydrophobicContact CB-CB 3.96Å; D464-A467 PolarHBondContact OD2-N 3.3Å; D464-T468 WeakPolarHBondContact O-CB 3.5Å; D464-T468 PolarHBondContact O-N 3.02Å; D464-T468 PolarHBondContact O-OG1 3.08Å | ||
| 465 | V | 83.6 | Confident | 87.8 | Confident | 49 Ų | 49 | 45.4 Ų | 45.4 | 30% | 0.297 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64 | -48.4 | -176.3 | -166.9 | 0 | 0 | 0 | 0 | 111.3 | I389 V390 V413 L469 | I389-V465 HydrophobicContact CG2-CB 4.06Å; I389-V465 HydrophobicContact CG2-CG1 4.49Å; I389-V465 HydrophobicContact CG2-CG2 3.66Å; V390-V465 HydrophobicContact CG2-CG1 4.49Å; V413-V465 HydrophobicContact CG1-CG1 3.95Å; V465-L469 HydrophobicContact CG1-CD1 4.28Å; V465-L469 VanDerWaalsContact O-CG 3.29Å; V465-L469 WeakPolarHBondContact O-CG 3.37Å; V465-L469 PolarHBondContact O-N 3.22Å |
| 466 | I | 85.5 | Confident | 87.7 | Confident | 116 Ų | 116 | 45.3 Ų | 45.3 | 60% | 0.595 | 25% | 0.252 | S | S | * | . | H | α-helix | trans | -75.3 | -43 | -173.5 | -58.5 | 177.4 | 0 | 0 | 0 | 109.6 | D464 T468 L469 I470 | D464-I466 WeakPolarHBondContact OD2-CA 3.39Å; D464-I466 PolarHBondContact OD2-N 3.13Å; I466-T468 VanDerWaalsContact C-N 3.34Å; I466-T468 PolarHBondContact O-N 2.9Å; I466-L469 PolarHBondContact O-N 3.28Å; I466-I470 HydrophobicContact CG2-CD1 3.95Å; I466-I470 WeakPolarHBondContact O-CG1 3.46Å; I466-I470 PolarHBondContact O-N 2.91Å |
| 467 | A | 86.2 | Confident | 87.8 | Confident | 35 Ų | 35 | 46.3 Ų | 46.3 | 29% | 0.289 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -58.2 | -45.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.6 | D464 I470 L471 | D464-A467 HydrophobicContact CB-CB 3.96Å; D464-A467 PolarHBondContact OD2-N 3.3Å; A467-I470 PolarHBondContact O-N 3.05Å; A467-L471 WeakPolarHBondContact O-CB 3.46Å; A467-L471 VanDerWaalsContact O-CG 3.24Å; A467-L471 WeakPolarHBondContact O-CG 3.42Å; A467-L471 PolarHBondContact O-N 3.42Å |
| 468 | T | 87 | Confident | 87.9 | Confident | 0 Ų | 0 | 44.7 Ų | 44.7 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.4 | -43.8 | 179.1 | -57.4 | 0 | 0 | 0 | 0 | 111.8 | F381 M385 I389 I459 D464 I466 I470 L471 C472 | F381-T468 HydrophobicContact CE2-CG2 3.75Å; F381-T468 HydrophobicContact CZ-CG2 4Å; M385-T468 HydrophobicContact CE-CG2 3.63Å; I389-T468 HydrophobicContact CD1-CG2 3.74Å; I389-T468 WeakPolarHBondContact CD1-OG1 3.5Å; I459-T468 HydrophobicContact CD1-CG2 4.12Å; I459-T468 HydrophobicContact CG1-CG2 4.21Å; I459-T468 HydrophobicContact CG2-CG2 3.95Å; D464-T468 WeakPolarHBondContact O-CB 3.5Å; D464-T468 PolarHBondContact O-N 3.02Å; D464-T468 PolarHBondContact O-OG1 3.08Å; I466-T468 VanDerWaalsContact C-N 3.34Å; I466-T468 PolarHBondContact O-N 2.9Å; T468-I470 PolarHBondContact O-N 3.15Å; T468-L471 CarbonylContact O-C 3.56Å; T468-L471 PolarHBondContact O-N 3.41Å; T468-C472 PolarHBondContact O-N 2.86Å; T468-C472 PolarHBondContact O-SG 3.45Å |
| 469 | L | 88 | Confident | 88 | Confident | 37 Ų | 37 | 42 Ų | 42 | 19% | 0.194 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.5 | -40.5 | 176.3 | -73.8 | 171.8 | 0 | 0 | 0 | 112.5 | M385 V413 I420 V465 I466 C472 | M385-L469 HydrophobicContact CE-CD2 4.5Å; V413-L469 HydrophobicContact CG1-CD1 4.07Å; V413-L469 HydrophobicContact CG1-CD2 4.08Å; V413-L469 HydrophobicContact CG1-CG 4.32Å; I420-L469 HydrophobicContact CD1-CB 4.3Å; I420-L469 HydrophobicContact CD1-CD2 4.28Å; V465-L469 HydrophobicContact CG1-CD1 4.28Å; V465-L469 VanDerWaalsContact O-CG 3.29Å; V465-L469 WeakPolarHBondContact O-CG 3.37Å; V465-L469 PolarHBondContact O-N 3.22Å; I466-L469 PolarHBondContact O-N 3.28Å; L469-C472 WeakPolarHBondContact O-CB 3.4Å; L469-C472 PolarHBondContact O-N 3.14Å |
| 470 | I | 89.9 | Confident | 88.1 | Confident | 111 Ų | 111 | 42 Ų | 42 | 57% | 0.569 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -64.6 | -44.3 | 174.2 | -68.6 | 168 | 0 | 0 | 0 | 110.4 | I466 A467 T468 C472 S473 | I466-I470 HydrophobicContact CG2-CD1 3.95Å; I466-I470 WeakPolarHBondContact O-CG1 3.46Å; I466-I470 PolarHBondContact O-N 2.91Å; A467-I470 PolarHBondContact O-N 3.05Å; T468-I470 PolarHBondContact O-N 3.15Å; I470-C472 PolarHBondContact O-N 3.3Å; I470-S473 WeakPolarHBondContact O-CB 3.4Å; I470-S473 PolarHBondContact O-N 3.46Å; I470-S473 PolarHBondContact O-OG 3.04Å |
| 471 | L | 90.3 | Very high | 88.4 | Confident | 36 Ų | 36 | 41.4 Ų | 41.4 | 19% | 0.188 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -70.4 | -12 | 179.1 | -68.7 | 168.2 | 0 | 0 | 0 | 113.4 | L458 I459 A467 T468 S473 V474 | L458-L471 HydrophobicContact CB-CD1 3.87Å; I459-L471 HydrophobicContact CD1-CB 3.68Å; I459-L471 HydrophobicContact CG1-CB 3.76Å; I459-L471 HydrophobicContact CG1-CD1 3.69Å; I459-L471 HydrophobicContact CG1-CG 4.37Å; A467-L471 WeakPolarHBondContact O-CB 3.46Å; A467-L471 VanDerWaalsContact O-CG 3.24Å; A467-L471 WeakPolarHBondContact O-CG 3.42Å; A467-L471 PolarHBondContact O-N 3.42Å; T468-L471 CarbonylContact O-C 3.56Å; T468-L471 PolarHBondContact O-N 3.41Å; L471-S473 PolarHBondContact O-N 3.19Å; L471-V474 HydrophobicContact CD2-CG2 4.49Å; L471-V474 VanDerWaalsContact O-CB 3.31Å; L471-V474 WeakPolarHBondContact O-CB 3.23Å; L471-V474 PolarHBondContact O-N 3.47Å |
| 472 | C | 89.6 | Confident | 88.7 | Confident | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.8 | -25 | 168.2 | -66.8 | 0 | 0 | 0 | 0 | 112.9 | F381 G417 I420 T468 L469 I470 V474 F475 G476 | F381-C472 WeakPolarHBondContact CZ-SG 3.28Å; G417-C472 WeakPolarHBondContact O-CB 3.34Å; I420-C472 HydrophobicContact CB-CB 4.3Å; I420-C472 HydrophobicContact CG2-CB 4.07Å; T468-C472 PolarHBondContact O-N 2.86Å; T468-C472 PolarHBondContact O-SG 3.45Å; L469-C472 WeakPolarHBondContact O-CB 3.4Å; L469-C472 PolarHBondContact O-N 3.14Å; I470-C472 PolarHBondContact O-N 3.3Å; C472-V474 PolarHBondContact O-N 2.96Å; C472-F475 HydrophobicContact CB-CD2 4.23Å; C472-F475 HydrophobicContact CB-CE2 4.4Å; C472-F475 WeakPolarHBondContact O-CB 3.33Å; C472-F475 PolarHBondContact O-N 3.46Å; C472-G476 PolarHBondContact O-N 3.48Å |
| 473 | S | 92.2 | Very high | 88.8 | Confident | 41 Ų | 41 | 31 Ų | 31 | 29% | 0.287 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -59.9 | -34.4 | 173 | 62.1 | 0 | 0 | 0 | 0 | 112.7 | S424 I470 L471 F475 G476 V477 | S424-S473 PolarHBondContact OG-O 3.45Å; I470-S473 WeakPolarHBondContact O-CB 3.4Å; I470-S473 PolarHBondContact O-N 3.46Å; I470-S473 PolarHBondContact O-OG 3.04Å; L471-S473 PolarHBondContact O-N 3.19Å; S473-F475 PolarHBondContact O-N 3Å; S473-G476 PolarHBondContact O-N 3.23Å; S473-V477 PolarHBondContact O-N 3.46Å |
| 474 | V | 92.9 | Very high | 89.3 | Confident | 19 Ų | 19 | 27.9 Ų | 27.9 | 12% | 0.115 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64.5 | -28.1 | 175.5 | 163.1 | 0 | 0 | 0 | 0 | 112 | V451 F452 L471 C472 V477 M478 | V451-V474 HydrophobicContact CG1-CB 4.41Å; V451-V474 HydrophobicContact CG1-CG1 3.96Å; V451-V474 HydrophobicContact CG1-CG2 3.88Å; V451-V474 WeakPolarHBondContact O-CG1 3.23Å; F452-V474 HydrophobicContact CB-CG1 4.48Å; L471-V474 HydrophobicContact CD2-CG2 4.49Å; L471-V474 VanDerWaalsContact O-CB 3.31Å; L471-V474 WeakPolarHBondContact O-CB 3.23Å; L471-V474 PolarHBondContact O-N 3.47Å; C472-V474 PolarHBondContact O-N 2.96Å; V474-V477 WeakPolarHBondContact O-CB 3.48Å; V474-V477 PolarHBondContact O-N 2.88Å; V474-M478 PolarHBondContact O-N 3.13Å |
| 475 | F | 91.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -69.7 | -36.3 | 173.2 | -48.5 | -22.9 | 0 | 0 | 0 | 111.3 | F374 N377 M378 F381 N421 F452 T456 I459 C472 S473 V477 M478 S479 | F374-F475 HydrophobicContact CE2-CB 4.36Å; F374-F475 WeakPolarHBondContact CE2-O 3.3Å; N377-F475 WeakPolarHBondContact ND2-CE1 3.31Å; N377-F475 VanDerWaalsContact ND2-CE2 3.28Å; N377-F475 WeakPolarHBondContact ND2-CE2 3.27Å; N377-F475 WeakPolarHBondContact ND2-CZ 3.29Å; M378-F475 HydrophobicContact CE-CB 3.42Å; M378-F475 VanDerWaalsContact CE-CB 3.42Å; M378-F475 HydrophobicContact CE-CD2 3.56Å; M378-F475 HydrophobicContact CE-CG 3.82Å; F381-F475 AromaticContact CD2-CE2 3.81Å; F381-F475 HydrophobicContact CD2-CE2 3.81Å; F381-F475 HydrophobicContact CD2-CZ 4.36Å; F381-F475 AromaticContact CE2-CE2 3.77Å; F381-F475 HydrophobicContact CE2-CE2 3.77Å; F381-F475 HydrophobicContact CE2-CZ 4.29Å; F381-F475 HydrophobicContact CG-CE2 4.44Å; F381-F475 HydrophobicContact CZ-CE2 4.35Å; N421-F475 HydrophobicContact CB-CB 4.2Å; N421-F475 WeakPolarHBondContact OD1-CB 3.48Å; N421-F475 PolarHBondContact OD1-O 2.9Å; F452-F475 AromaticContact CD2-CD1 3.96Å; F452-F475 HydrophobicContact CD2-CD1 3.96Å; F452-F475 HydrophobicContact CE2-CB 4.23Å; F452-F475 AromaticContact CE2-CD1 3.52Å; F452-F475 HydrophobicContact CE2-CD1 3.52Å; F452-F475 HydrophobicContact CE2-CE1 4.26Å; F452-F475 HydrophobicContact CE2-CG 4.16Å; F452-F475 HydrophobicContact CZ-CD1 4.46Å; T456-F475 HydrophobicContact CG2-CD1 4.42Å; T456-F475 HydrophobicContact CG2-CE1 3.76Å; I459-F475 HydrophobicContact CD1-CE1 3.75Å; I459-F475 HydrophobicContact CD1-CE2 4.38Å; I459-F475 HydrophobicContact CD1-CZ 3.35Å; C472-F475 HydrophobicContact CB-CD2 4.23Å; C472-F475 HydrophobicContact CB-CE2 4.4Å; C472-F475 WeakPolarHBondContact O-CB 3.33Å; C472-F475 PolarHBondContact O-N 3.46Å; S473-F475 PolarHBondContact O-N 3Å; F475-V477 VanDerWaalsContact C-N 3.33Å; F475-V477 PolarHBondContact O-N 3.39Å; F475-M478 WeakPolarHBondContact O-CB 3.28Å; F475-M478 PolarHBondContact O-N 2.92Å; F475-M478 VanDerWaalsContact O-N 3.14Å; F475-S479 WeakPolarHBondContact O-CB 3.34Å; F475-S479 PolarHBondContact O-N 2.94Å |
| 476 | G | 90.1 | Very high | 89.9 | Confident | 0 Ų | 0 | 22 Ų | 22 | 0% | 0 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -62.4 | -39.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | N421 S425 C472 S473 M478 S479 S480 | N421-G476 VanDerWaalsContact O-CA 3.23Å; N421-G476 WeakPolarHBondContact O-CA 3.35Å; N421-G476 WeakPolarHBondContact OD1-CA 3.45Å; N421-G476 PolarHBondContact OD1-N 3.45Å; N421-G476 VanDerWaalsContact OD1-N 3.11Å; S425-G476 WeakPolarHBondContact CA-O 3.34Å; S425-G476 WeakPolarHBondContact CB-O 3.46Å; C472-G476 PolarHBondContact O-N 3.48Å; S473-G476 PolarHBondContact O-N 3.23Å; G476-M478 VanDerWaalsContact C-N 3.32Å; G476-M478 PolarHBondContact O-N 3.38Å; G476-S479 PolarHBondContact O-N 2.93Å; G476-S480 WeakPolarHBondContact O-CB 3.47Å; G476-S480 PolarHBondContact O-N 3.46Å |
| 477 | V | 92.9 | Very high | 89.9 | Confident | 21 Ų | 21 | 16.6 Ų | 16.6 | 13% | 0.127 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -56.5 | -44.6 | 171.8 | 171.5 | 0 | 0 | 0 | 0 | 111.4 | Y428 V451 S473 V474 F475 T481 | Y428-V477 HydrophobicContact CD1-CB 4.34Å; Y428-V477 HydrophobicContact CD1-CG1 4.2Å; Y428-V477 HydrophobicContact CD1-CG2 4.47Å; Y428-V477 HydrophobicContact CD2-CG2 3.97Å; Y428-V477 HydrophobicContact CE1-CB 4.42Å; Y428-V477 HydrophobicContact CE1-CG1 3.79Å; Y428-V477 HydrophobicContact CE2-CG1 4.16Å; Y428-V477 HydrophobicContact CE2-CG2 4.27Å; Y428-V477 HydrophobicContact CG-CB 4.43Å; Y428-V477 HydrophobicContact CG-CG2 4.08Å; V451-V477 HydrophobicContact CG1-CG1 4.47Å; S473-V477 PolarHBondContact O-N 3.46Å; V474-V477 WeakPolarHBondContact O-CB 3.48Å; V474-V477 PolarHBondContact O-N 2.88Å; F475-V477 VanDerWaalsContact C-N 3.33Å; F475-V477 PolarHBondContact O-N 3.39Å; V477-T481 VanDerWaalsContact O-CB 3.28Å; V477-T481 WeakPolarHBondContact O-CB 3.38Å; V477-T481 PolarHBondContact O-N 2.97Å; V477-T481 VanDerWaalsContact O-N 3.08Å; V477-T481 PolarHBondContact O-OG1 2.92Å |
| 478 | M | 93.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -68.4 | -47.8 | 176.7 | -172.3 | 57.5 | 138.5 | 0 | 0 | 112.4 | F374 Y449 F452 V474 F475 G476 S480 T481 L482 | F374-M478 HydrophobicContact CB-CG 4.35Å; F374-M478 HydrophobicContact CD2-CB 4.14Å; F374-M478 HydrophobicContact CD2-CG 3.96Å; Y449-M478 HydrophobicContact CD1-CE 3.89Å; Y449-M478 HydrophobicContact CD2-CE 3.91Å; Y449-M478 HydrophobicContact CD2-SD 3.97Å; Y449-M478 HydrophobicContact CE1-CE 4.14Å; Y449-M478 HydrophobicContact CE2-CE 4.14Å; Y449-M478 HydrophobicContact CE2-SD 4.21Å; Y449-M478 HydrophobicContact CG-CE 3.8Å; Y449-M478 HydrophobicContact CG-SD 4.39Å; F452-M478 HydrophobicContact CB-CB 3.93Å; F452-M478 HydrophobicContact CB-CE 4.1Å; F452-M478 HydrophobicContact CB-CG 4.07Å; F452-M478 HydrophobicContact CB-SD 4.16Å; F452-M478 HydrophobicContact CD1-CE 3.89Å; F452-M478 HydrophobicContact CD1-CG 4.29Å; F452-M478 HydrophobicContact CD2-CB 3.38Å; F452-M478 HydrophobicContact CD2-CG 3.72Å; F452-M478 HydrophobicContact CE2-CB 4.06Å; F452-M478 HydrophobicContact CE2-CG 4.2Å; F452-M478 HydrophobicContact CG-CB 3.78Å; F452-M478 HydrophobicContact CG-CE 4.05Å; F452-M478 HydrophobicContact CG-CG 3.76Å; F452-M478 HydrophobicContact CG-SD 4.36Å; V474-M478 PolarHBondContact O-N 3.13Å; F475-M478 WeakPolarHBondContact O-CB 3.28Å; F475-M478 PolarHBondContact O-N 2.92Å; F475-M478 VanDerWaalsContact O-N 3.14Å; G476-M478 VanDerWaalsContact C-N 3.32Å; G476-M478 PolarHBondContact O-N 3.38Å; M478-S480 PolarHBondContact O-N 2.85Å; M478-T481 WeakPolarHBondContact O-CA 3.36Å; M478-T481 WeakPolarHBondContact O-CB 3.18Å; M478-T481 PolarHBondContact O-N 3.1Å; M478-T481 VanDerWaalsContact O-N 3.08Å; M478-L482 HydrophobicContact CG-CD1 3.98Å; M478-L482 HydrophobicContact CG-CG 4.38Å; M478-L482 WeakPolarHBondContact O-CG 3.24Å; M478-L482 PolarHBondContact O-N 3.36Å; M478-L482 HydrophobicContact SD-CD1 4.27Å; M478-L482 HydrophobicContact SD-CG 4.19Å |
| 479 | S | 91 | Very high | 89.9 | Confident | 11 Ų | 11 | 15.5 Ų | 15.5 | 8% | 0.077 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -53.2 | -54.1 | 178 | 175.1 | 0 | 0 | 0 | 0 | 111.6 | S425 F475 G476 T481 L482 Y483 | S425-S479 PolarHBondContact OG-OG 3.31Å; F475-S479 WeakPolarHBondContact O-CB 3.34Å; F475-S479 PolarHBondContact O-N 2.94Å; G476-S479 PolarHBondContact O-N 2.93Å; S479-T481 VanDerWaalsContact C-N 3.29Å; S479-T481 PolarHBondContact O-N 2.91Å; S479-L482 PolarHBondContact O-N 3.04Å; S479-Y483 VanDerWaalsContact O-CD2 3.29Å; S479-Y483 WeakPolarHBondContact O-CD2 3.32Å; S479-Y483 PolarHBondContact O-N 2.96Å |
| 480 | S | 90.9 | Very high | 89.7 | Confident | 0 Ų | 0 | 14 Ų | 14 | 0% | 0 | 8% | 0.077 | C | C | . | . | H | α-helix | trans | -64.7 | -32.5 | 177.8 | 163.1 | 0 | 0 | 0 | 0 | 112.1 | S425 S429 Q432 G476 M478 T484 | S425-S480 WeakPolarHBondContact O-CB 3Å; S425-S480 WeakPolarHBondContact OG-CB 3.48Å; S425-S480 PolarHBondContact OG-N 3.03Å; S429-S480 WeakPolarHBondContact CA-OG 3.22Å; S429-S480 PolarHBondContact N-OG 2.76Å; Q432-S480 VanDerWaalsContact CD-OG 3.32Å; Q432-S480 PolarHBondContact NE2-O 3.44Å; Q432-S480 PolarHBondContact NE2-OG 3.37Å; Q432-S480 PolarHBondContact OE1-OG 2.94Å; G476-S480 WeakPolarHBondContact O-CB 3.47Å; G476-S480 PolarHBondContact O-N 3.46Å; M478-S480 PolarHBondContact O-N 2.85Å; S480-T484 WeakPolarHBondContact O-CG2 3.38Å; S480-T484 PolarHBondContact O-N 2.7Å; S480-T484 VanDerWaalsContact O-N 3.11Å; S480-T484 PolarHBondContact O-OG1 2.87Å |
| 481 | T | 92 | Very high | 89.3 | Confident | 0 Ų | 0 | 9.2 Ų | 9.2 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -65.5 | -45.2 | 174.1 | -62.6 | 0 | 0 | 0 | 0 | 112.4 | Y445 V477 M478 S479 I485 P486 | Y445-T481 HydrophobicContact CD2-CG2 3.72Å; Y445-T481 HydrophobicContact CE2-CG2 4.36Å; V477-T481 VanDerWaalsContact O-CB 3.28Å; V477-T481 WeakPolarHBondContact O-CB 3.38Å; V477-T481 PolarHBondContact O-N 2.97Å; V477-T481 VanDerWaalsContact O-N 3.08Å; V477-T481 PolarHBondContact O-OG1 2.92Å; M478-T481 WeakPolarHBondContact O-CA 3.36Å; M478-T481 WeakPolarHBondContact O-CB 3.18Å; M478-T481 PolarHBondContact O-N 3.1Å; M478-T481 VanDerWaalsContact O-N 3.08Å; S479-T481 VanDerWaalsContact C-N 3.29Å; S479-T481 PolarHBondContact O-N 2.91Å; T481-I485 HydrophobicContact CG2-CG1 4.04Å; T481-I485 PolarHBondContact O-N 2.97Å; T481-P486 VanDerWaalsContact O-CD 3.27Å; T481-P486 WeakPolarHBondContact O-CD 3.49Å |
| 482 | L | 90.3 | Very high | 89 | Confident | 0 Ų | 0 | 10.7 Ų | 10.7 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -68.5 | -35.2 | 178.7 | -66.6 | 172 | 0 | 0 | 0 | 112.1 | H367 W371 F374 Y449 M478 S479 P486 | H367-L482 PolarHBondContact CE1-O 2.95Å; W371-L482 HydrophobicContact CD2-CB 4.48Å; W371-L482 HydrophobicContact CD2-CD1 3.95Å; W371-L482 HydrophobicContact CE3-CD1 4.24Å; W371-L482 HydrophobicContact CG-CD1 4.22Å; W371-L482 HydrophobicContact CZ2-CB 3.83Å; F374-L482 HydrophobicContact CB-CD1 3.84Å; F374-L482 HydrophobicContact CG-CD1 4.19Å; Y449-L482 HydrophobicContact CE2-CD2 4.12Å; M478-L482 HydrophobicContact CG-CD1 3.98Å; M478-L482 HydrophobicContact CG-CG 4.38Å; M478-L482 WeakPolarHBondContact O-CG 3.24Å; M478-L482 PolarHBondContact O-N 3.36Å; M478-L482 HydrophobicContact SD-CD1 4.27Å; M478-L482 HydrophobicContact SD-CG 4.19Å; S479-L482 PolarHBondContact O-N 3.04Å; L482-P486 WeakPolarHBondContact O-CD 3.22Å |
| 483 | Y | 87.3 | Confident | 88.6 | Confident | 34 Ų | 34 | 11.5 Ų | 11.5 | 13% | 0.133 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -74.8 | -28.3 | 177.3 | -76.8 | -50.3 | 0 | 0 | 0 | 114.4 | E75 T216 W371 S479 F487 | E75-Y483 PolarHBondContact OE1-OH 2.78Å; E75-Y483 VanDerWaalsContact OE1-OH 3.09Å; T216-Y483 HydrophobicContact CG2-CD2 4.25Å; T216-Y483 HydrophobicContact CG2-CE2 3.66Å; W371-Y483 HydrophobicContact CH2-CD1 4.17Å; W371-Y483 AromaticContact CH2-CE1 3.67Å; W371-Y483 HydrophobicContact CH2-CE1 3.67Å; W371-Y483 HydrophobicContact CH2-CE2 4.21Å; W371-Y483 AromaticContact CH2-CZ 3.73Å; W371-Y483 AromaticContact CZ2-CD1 3.93Å; W371-Y483 HydrophobicContact CZ2-CD1 3.93Å; W371-Y483 AromaticContact CZ2-CE1 3.81Å; W371-Y483 HydrophobicContact CZ2-CE1 3.81Å; S479-Y483 VanDerWaalsContact O-CD2 3.29Å; S479-Y483 WeakPolarHBondContact O-CD2 3.32Å; S479-Y483 PolarHBondContact O-N 2.96Å; Y483-F487 WeakPolarHBondContact O-CD2 3.49Å |
| 484 | T | 87.3 | Confident | 87.9 | Confident | 0 Ų | 0 | 10.1 Ų | 10.1 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -103.9 | -54.2 | -177.2 | 62.7 | 0 | 0 | 0 | 0 | 114.6 | L209 A213 Q432 S480 F487 N488 | L209-T484 WeakPolarHBondContact CD2-O 3.36Å; A213-T484 HydrophobicContact CB-CG2 3.45Å; A213-T484 VanDerWaalsContact CB-CG2 3.45Å; Q432-T484 VanDerWaalsContact CD-OG1 3.29Å; Q432-T484 PolarHBondContact NE2-OG1 3.06Å; Q432-T484 VanDerWaalsContact NE2-OG1 3.13Å; Q432-T484 PolarHBondContact OE1-OG1 2.92Å; S480-T484 WeakPolarHBondContact O-CG2 3.38Å; S480-T484 PolarHBondContact O-N 2.7Å; S480-T484 VanDerWaalsContact O-N 3.11Å; S480-T484 PolarHBondContact O-OG1 2.87Å; T484-F487 PolarHBondContact O-N 3.45Å; T484-N488 WeakPolarHBondContact O-CB 3.27Å; T484-N488 PolarHBondContact O-N 3.09Å |
| 485 | I | 89.9 | Confident | 87.2 | Confident | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -68.9 | -41.6 | -162.1 | -49.9 | -55.9 | 0 | 0 | 0 | 113.5 | L441 L444 Y445 T481 F487 N488 L489 | L441-I485 HydrophobicContact CB-CG2 4.2Å; L441-I485 HydrophobicContact CD2-CD1 4.24Å; L441-I485 HydrophobicContact CD2-CG2 4.12Å; L441-I485 WeakPolarHBondContact O-CG2 3.46Å; L444-I485 HydrophobicContact CB-CD1 4.47Å; L444-I485 HydrophobicContact CD2-CD1 3.63Å; L444-I485 HydrophobicContact CG-CD1 3.96Å; L444-I485 HydrophobicContact CG-CG1 4.38Å; Y445-I485 HydrophobicContact CD2-CB 3.96Å; Y445-I485 HydrophobicContact CD2-CG2 4.05Å; Y445-I485 HydrophobicContact CG-CB 4.5Å; Y445-I485 HydrophobicContact CG-CG2 4.09Å; T481-I485 HydrophobicContact CG2-CG1 4.04Å; T481-I485 PolarHBondContact O-N 2.97Å; I485-F487 PolarHBondContact O-N 2.91Å; I485-N488 PolarHBondContact O-N 3.41Å; I485-L489 HydrophobicContact CG2-CD1 4.06Å; I485-L489 HydrophobicContact CG2-CG 4.4Å; I485-L489 WeakPolarHBondContact O-CG 3.47Å; I485-L489 PolarHBondContact O-N 3.23Å |
| 486 | P | 88.9 | Confident | 86.5 | Confident | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -63 | -41.6 | 178 | -28 | 39.1 | 0 | 0 | 0 | 114.1 | L363 H367 Y445 T481 L482 L489 I490 L520 | L363-P486 HydrophobicContact CD1-CB 4.25Å; H367-P486 VanDerWaalsContact ND1-CG 3.32Å; H367-P486 WeakPolarHBondContact ND1-CG 3.34Å; Y445-P486 HydrophobicContact CD2-CG 4.41Å; Y445-P486 HydrophobicContact CE2-CG 3.55Å; T481-P486 VanDerWaalsContact O-CD 3.27Å; T481-P486 WeakPolarHBondContact O-CD 3.49Å; L482-P486 WeakPolarHBondContact O-CD 3.22Å; P486-L489 PolarHBondContact O-N 3.41Å; P486-I490 PolarHBondContact O-N 2.84Å; P486-L520 HydrophobicContact CB-CD2 3.79Å |
| 487 | F | 86.8 | Confident | 85.7 | Confident | 3 Ų | 3 | 20.2 Ų | 20.2 | 1% | 0.013 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -74.5 | -29.9 | 178.7 | -62.8 | -88.5 | 0 | 0 | 0 | 111.6 | K193 F197 L209 Y483 T484 I485 A491 L520 | K193-F487 HydrophobicContact CD-CD1 4.02Å; K193-F487 HydrophobicContact CD-CE1 3.74Å; K193-F487 HydrophobicContact CD-CE2 4.42Å; K193-F487 HydrophobicContact CD-CG 4.48Å; K193-F487 HydrophobicContact CD-CZ 3.97Å; F197-F487 HydrophobicContact CZ-CB 4.11Å; L209-F487 HydrophobicContact CD1-CB 4.16Å; L209-F487 HydrophobicContact CD2-CB 3.6Å; Y483-F487 WeakPolarHBondContact O-CD2 3.49Å; T484-F487 PolarHBondContact O-N 3.45Å; I485-F487 PolarHBondContact O-N 2.91Å; F487-A491 PolarHBondContact O-N 3.27Å; F487-L520 HydrophobicContact CD1-CD2 3.72Å; F487-L520 HydrophobicContact CD2-CD2 4.07Å; F487-L520 HydrophobicContact CE1-CB 4.41Å; F487-L520 HydrophobicContact CE1-CD2 3.63Å; F487-L520 HydrophobicContact CE1-CG 4.31Å; F487-L520 HydrophobicContact CE2-CD2 3.98Å; F487-L520 HydrophobicContact CG-CD2 3.93Å; F487-L520 HydrophobicContact CZ-CD2 3.76Å; F487-L520 HydrophobicContact CZ-CG 4.28Å |
| 488 | N | 86.1 | Confident | 84.7 | Confident | 7 Ų | 7 | 22.9 Ų | 22.9 | 4% | 0.037 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -65.8 | -41.7 | 167.8 | -81.3 | -15 | 0 | 0 | 0 | 112.1 | E206 L209 L441 T484 I485 I490 A491 E492 | E206-N488 WeakPolarHBondContact CA-OD1 3.41Å; L209-N488 VanDerWaalsContact CD2-OD1 3.31Å; L209-N488 WeakPolarHBondContact CD2-OD1 3.38Å; L441-N488 HydrophobicContact CD1-CB 4.37Å; L441-N488 HydrophobicContact CD2-CB 3.71Å; T484-N488 WeakPolarHBondContact O-CB 3.27Å; T484-N488 PolarHBondContact O-N 3.09Å; I485-N488 PolarHBondContact O-N 3.41Å; N488-I490 VanDerWaalsContact C-N 3.34Å; N488-I490 PolarHBondContact O-N 2.94Å; N488-A491 PolarHBondContact O-N 2.99Å; N488-A491 VanDerWaalsContact O-N 3.17Å; N488-E492 PolarHBondContact O-N 3.37Å; N488-E492 VanDerWaalsContact O-N 3.07Å |
| 489 | L | 86.8 | Confident | 83.5 | Confident | 6 Ų | 6 | 26.9 Ų | 26.9 | 3% | 0.031 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -62.4 | -38.7 | 175.4 | -76.8 | 166.1 | 0 | 0 | 0 | 112.1 | L363 L441 I485 P486 E492 Y493 I567 | L363-L489 HydrophobicContact CD1-CB 4.33Å; L363-L489 HydrophobicContact CD1-CD1 3.77Å; L363-L489 HydrophobicContact CD2-CB 3.97Å; L441-L489 HydrophobicContact CB-CD2 3.82Å; L441-L489 HydrophobicContact CB-CG 4.19Å; L441-L489 HydrophobicContact CD1-CD2 3.87Å; L441-L489 HydrophobicContact CD1-CG 4.2Å; L441-L489 HydrophobicContact CG-CD2 4.47Å; I485-L489 HydrophobicContact CG2-CD1 4.06Å; I485-L489 HydrophobicContact CG2-CG 4.4Å; I485-L489 WeakPolarHBondContact O-CG 3.47Å; I485-L489 PolarHBondContact O-N 3.23Å; P486-L489 PolarHBondContact O-N 3.41Å; L489-E492 PolarHBondContact O-N 3.46Å; L489-Y493 HydrophobicContact CB-CE2 4.27Å; L489-Y493 VanDerWaalsContact O-CD2 3.31Å; L489-Y493 WeakPolarHBondContact O-CD2 3.41Å; L489-Y493 VanDerWaalsContact O-CG 3.3Å; L489-Y493 PolarHBondContact O-N 3.44Å; L489-I567 HydrophobicContact CD1-CG2 4.41Å |
| 490 | I | 84.3 | Confident | 82.2 | Confident | 6 Ų | 6 | 32.3 Ų | 32.3 | 3% | 0.031 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -59.8 | -45.7 | 171.2 | -71.3 | 176.8 | 0 | 0 | 0 | 111.2 | L363 P486 N488 E492 Y493 Q494 D516 L520 | L363-I490 HydrophobicContact CD2-CG1 3.77Å; P486-I490 PolarHBondContact O-N 2.84Å; N488-I490 VanDerWaalsContact C-N 3.34Å; N488-I490 PolarHBondContact O-N 2.94Å; I490-E492 PolarHBondContact O-N 3.22Å; I490-Y493 PolarHBondContact O-N 3.48Å; I490-Q494 HydrophobicContact CG2-CG 4.31Å; I490-Q494 WeakPolarHBondContact O-CB 3.44Å; I490-Q494 VanDerWaalsContact O-CG 3.27Å; I490-Q494 WeakPolarHBondContact O-CG 3.34Å; I490-Q494 PolarHBondContact O-N 2.96Å; I490-D516 HydrophobicContact CG2-CB 4.17Å; I490-L520 HydrophobicContact CD1-CB 3.97Å; I490-L520 HydrophobicContact CD1-CD2 3.55Å; I490-L520 HydrophobicContact CD1-CG 4.24Å |
| 491 | A | 80.1 | Confident | 80.7 | Confident | 10 Ų | 10 | 34.1 Ų | 34.1 | 8% | 0.083 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -65.5 | -25.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | F197 K205 F487 N488 R495 | F197-A491 HydrophobicContact CE1-CB 3.94Å; K205-A491 HydrophobicContact CD-CB 4.43Å; F487-A491 PolarHBondContact O-N 3.27Å; N488-A491 PolarHBondContact O-N 2.99Å; N488-A491 VanDerWaalsContact O-N 3.17Å; A491-R495 PolarHBondContact O-N 3.14Å |
| 492 | E | 84.2 | Confident | 79 | Confident | 66 Ų | 66 | 41.2 Ų | 41.2 | 31% | 0.308 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -84 | -44.9 | 175.3 | -170.7 | 71 | 157.2 | 0 | 0 | 112.1 | N488 L489 I490 Q494 R495 E496 | N488-E492 PolarHBondContact O-N 3.37Å; N488-E492 VanDerWaalsContact O-N 3.07Å; L489-E492 PolarHBondContact O-N 3.46Å; I490-E492 PolarHBondContact O-N 3.22Å; E492-Q494 VanDerWaalsContact C-N 3.28Å; E492-Q494 PolarHBondContact O-N 3.27Å; E492-R495 VanDerWaalsContact CD-NH2 3.31Å; E492-R495 WeakPolarHBondContact O-CA 3.45Å; E492-R495 VanDerWaalsContact O-CB 3.29Å; E492-R495 WeakPolarHBondContact O-CB 3.42Å; E492-R495 PolarHBondContact O-N 3.41Å; E492-R495 IonicContact OE1-CZ 3.2Å; E492-R495 IonicContact OE1-NE 3.04Å; E492-R495 IonicContact OE1-NH2 3.19Å; E492-R495 PolarHBondContact OE1-NH2 3.47Å; E492-R495 IonicContact OE2-CZ 2.93Å; E492-R495 IonicContact OE2-NE 2.72Å; E492-R495 PolarHBondContact OE2-NE 3.32Å; E492-R495 IonicContact OE2-NH2 3.93Å; E492-R495 PolarHBondContact OE2-NH2 3.03Å; E492-E496 PolarHBondContact O-N 2.98Å |
| 493 | Y | 82.2 | Confident | 77.4 | Confident | 18 Ų | 18 | 48.6 Ų | 48.6 | 7% | 0.071 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.7 | -37.3 | 173.4 | -63.1 | -33.4 | 0 | 0 | 0 | 112.1 | H359 Y360 L363 L489 I490 R495 E496 E497 | H359-Y493 HydrophobicContact CB-CE2 4.28Å; Y360-Y493 HydrophobicContact CD1-CD2 4.09Å; Y360-Y493 AromaticContact CE1-CD2 3.98Å; Y360-Y493 HydrophobicContact CE1-CD2 3.98Å; Y360-Y493 HydrophobicContact CE1-CG 4.38Å; L363-Y493 HydrophobicContact CD2-CD2 4.48Å; L363-Y493 HydrophobicContact CD2-CE2 4.1Å; L489-Y493 HydrophobicContact CB-CE2 4.27Å; L489-Y493 VanDerWaalsContact O-CD2 3.31Å; L489-Y493 WeakPolarHBondContact O-CD2 3.41Å; L489-Y493 VanDerWaalsContact O-CG 3.3Å; L489-Y493 PolarHBondContact O-N 3.44Å; I490-Y493 PolarHBondContact O-N 3.48Å; Y493-R495 VanDerWaalsContact C-N 3.3Å; Y493-R495 PolarHBondContact O-N 3.26Å; Y493-E496 PolarHBondContact O-N 2.95Å; Y493-E497 PolarHBondContact O-N 3.15Å |
| 494 | Q | 76.9 | Confident | 75.8 | Confident | 12 Ų | 12 | 54.9 Ų | 54.9 | 6% | 0.056 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -64.7 | -33.7 | 172.6 | -74.9 | 172.9 | -10.3 | 0 | 0 | 112.1 | Y360 I490 E492 E497 E498 D516 | Y360-Q494 PolarHBondContact OH-N 2.9Å; I490-Q494 HydrophobicContact CG2-CG 4.31Å; I490-Q494 WeakPolarHBondContact O-CB 3.44Å; I490-Q494 VanDerWaalsContact O-CG 3.27Å; I490-Q494 WeakPolarHBondContact O-CG 3.34Å; I490-Q494 PolarHBondContact O-N 2.96Å; E492-Q494 VanDerWaalsContact C-N 3.28Å; E492-Q494 PolarHBondContact O-N 3.27Å; Q494-E497 PolarHBondContact O-N 3.38Å; Q494-E498 WeakPolarHBondContact O-CB 3.33Å; Q494-E498 WeakPolarHBondContact O-CG 3.46Å; Q494-E498 PolarHBondContact O-N 3.06Å; Q494-D516 PolarHBondContact NE2-OD2 2.73Å |
| 495 | R | 77.3 | Confident | 73.9 | Confident | 74 Ų | 74 | 58.5 Ų | 58.5 | 28% | 0.279 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -66.1 | -45.2 | 173.6 | -172.8 | 173.7 | 70.8 | 84.9 | -4 | 111.2 | A491 E492 Y493 E497 E498 E499 | A491-R495 PolarHBondContact O-N 3.14Å; E492-R495 VanDerWaalsContact CD-NH2 3.31Å; E492-R495 WeakPolarHBondContact O-CA 3.45Å; E492-R495 VanDerWaalsContact O-CB 3.29Å; E492-R495 WeakPolarHBondContact O-CB 3.42Å; E492-R495 PolarHBondContact O-N 3.41Å; E492-R495 IonicContact OE1-CZ 3.2Å; E492-R495 IonicContact OE1-NE 3.04Å; E492-R495 IonicContact OE1-NH2 3.19Å; E492-R495 PolarHBondContact OE1-NH2 3.47Å; E492-R495 IonicContact OE2-CZ 2.93Å; E492-R495 IonicContact OE2-NE 2.72Å; E492-R495 PolarHBondContact OE2-NE 3.32Å; E492-R495 IonicContact OE2-NH2 3.93Å; E492-R495 PolarHBondContact OE2-NH2 3.03Å; Y493-R495 VanDerWaalsContact C-N 3.3Å; Y493-R495 PolarHBondContact O-N 3.26Å; R495-E497 PolarHBondContact O-N 2.91Å; R495-E498 PolarHBondContact O-N 2.95Å; R495-E499 WeakPolarHBondContact CG-OE1 3.48Å; R495-E499 IonicContact CZ-OE1 3.29Å; R495-E499 IonicContact NH1-OE1 2.73Å; R495-E499 PolarHBondContact NH1-OE1 2.99Å; R495-E499 IonicContact NH1-OE2 2.79Å; R495-E499 PolarHBondContact NH1-OE2 3.34Å; R495-E499 WeakPolarHBondContact O-CB 3.48Å; R495-E499 WeakPolarHBondContact O-CG 3.37Å; R495-E499 PolarHBondContact O-N 2.91Å |
| 496 | E | 78.1 | Confident | 71.8 | Confident | 87 Ų | 87 | 60.2 Ų | 60.2 | 41% | 0.407 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.1 | -43.7 | 174.3 | -65.7 | 178.7 | 173.3 | 0 | 0 | 112 | E492 Y493 E498 E499 Q500 | E492-E496 PolarHBondContact O-N 2.98Å; Y493-E496 PolarHBondContact O-N 2.95Å; E496-E498 VanDerWaalsContact C-N 3.34Å; E496-E498 PolarHBondContact O-N 3.38Å; E496-E499 PolarHBondContact O-N 2.94Å; E496-Q500 WeakPolarHBondContact O-CG 3.38Å; E496-Q500 PolarHBondContact O-N 3.41Å; E496-Q500 VanDerWaalsContact O-N 3.13Å |
| 497 | E | 73.8 | Confident | 69.5 | Low | 69 Ų | 69 | 68.5 Ų | 68.5 | 32% | 0.322 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -70.2 | -23.4 | 176.1 | -74.7 | -168.5 | 124 | 0 | 0 | 113.9 | Y360 Y493 Q494 R495 P501 | Y360-E497 VanDerWaalsContact CE2-OE2 3.22Å; Y360-E497 WeakPolarHBondContact CE2-OE2 3.3Å; Y360-E497 PolarHBondContact OH-OE2 2.87Å; Y493-E497 PolarHBondContact O-N 3.15Å; Q494-E497 PolarHBondContact O-N 3.38Å; R495-E497 PolarHBondContact O-N 2.91Å; E497-P501 WeakPolarHBondContact O-CD 3.4Å; E497-P501 VanDerWaalsContact O-CG 3.23Å; E497-P501 WeakPolarHBondContact O-CG 3.37Å |
| 498 | E | 70.5 | Confident | 67.7 | Low | 78 Ų | 78 | 76.7 Ų | 76.7 | 36% | 0.364 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -84.8 | -23.7 | 171.7 | -81.1 | -174.3 | -145 | 0 | 0 | 113.5 | Q494 R495 E496 K502 | Q494-E498 WeakPolarHBondContact O-CB 3.33Å; Q494-E498 WeakPolarHBondContact O-CG 3.46Å; Q494-E498 PolarHBondContact O-N 3.06Å; R495-E498 PolarHBondContact O-N 2.95Å; E496-E498 VanDerWaalsContact C-N 3.34Å; E496-E498 PolarHBondContact O-N 3.38Å; E498-K502 VanDerWaalsContact O-CD 3.27Å; E498-K502 WeakPolarHBondContact O-CD 3.4Å; E498-K502 WeakPolarHBondContact O-CE 3.4Å; E498-K502 WeakPolarHBondContact O-CG 3.5Å; E498-K502 PolarHBondContact O-NZ 2.8Å |
| 499 | E | 69 | Low | 66 | Low | 84 Ų | 84 | 81.4 Ų | 81.4 | 39% | 0.393 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -83.9 | -41.5 | 179.2 | -75.5 | 175.3 | -160.8 | 0 | 0 | 111.9 | R495 E496 K502 L503 | R495-E499 WeakPolarHBondContact CG-OE1 3.48Å; R495-E499 IonicContact CZ-OE1 3.29Å; R495-E499 IonicContact NH1-OE1 2.73Å; R495-E499 PolarHBondContact NH1-OE1 2.99Å; R495-E499 IonicContact NH1-OE2 2.79Å; R495-E499 PolarHBondContact NH1-OE2 3.34Å; R495-E499 WeakPolarHBondContact O-CB 3.48Å; R495-E499 WeakPolarHBondContact O-CG 3.37Å; R495-E499 PolarHBondContact O-N 2.91Å; E496-E499 PolarHBondContact O-N 2.94Å; E499-K502 WeakPolarHBondContact O-CB 3.47Å; E499-K502 PolarHBondContact O-N 2.98Å; E499-L503 WeakPolarHBondContact O-CD1 3.42Å |
| 500 | Q | 64 | Low | 64.3 | Low | 124 Ų | 124 | 86.3 Ų | 86.3 | 58% | 0.579 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -56.9 | -43.4 | -179.5 | -71.4 | 177 | 30.7 | 0 | 0 | 115.2 | E496 K502 L503 Q504 | E496-Q500 WeakPolarHBondContact O-CG 3.38Å; E496-Q500 PolarHBondContact O-N 3.41Å; E496-Q500 VanDerWaalsContact O-N 3.13Å; Q500-K502 VanDerWaalsContact C-N 3.27Å; Q500-K502 PolarHBondContact O-N 2.72Å; Q500-L503 PolarHBondContact O-N 3.27Å; Q500-Q504 PolarHBondContact O-N 2.83Å |
| 501 | P | 59.8 | Low | 63.2 | Low | 39 Ų | 39 | 89.6 Ų | 89.6 | 25% | 0.253 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -64.8 | -29.9 | 179.7 | -22.5 | 34.7 | 0 | 0 | 0 | 113.2 | E497 L503 Q504 G505 | E497-P501 WeakPolarHBondContact O-CD 3.4Å; E497-P501 VanDerWaalsContact O-CG 3.23Å; E497-P501 WeakPolarHBondContact O-CG 3.37Å; P501-L503 PolarHBondContact O-N 2.86Å; P501-Q504 PolarHBondContact O-N 2.93Å; P501-Q504 VanDerWaalsContact O-N 3.17Å; P501-G505 PolarHBondContact O-N 3.17Å |
| 502 | K | 56.5 | Low | 62.3 | Low | 149 Ų | 149 | 90.9 Ų | 90.9 | 65% | 0.648 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.6 | -27.2 | 178.5 | -62.1 | 168.3 | -175.3 | 138 | 0 | 111.8 | E498 E499 Q500 | E498-K502 VanDerWaalsContact O-CD 3.27Å; E498-K502 WeakPolarHBondContact O-CD 3.4Å; E498-K502 WeakPolarHBondContact O-CE 3.4Å; E498-K502 WeakPolarHBondContact O-CG 3.5Å; E498-K502 PolarHBondContact O-NZ 2.8Å; E499-K502 WeakPolarHBondContact O-CB 3.47Å; E499-K502 PolarHBondContact O-N 2.98Å; Q500-K502 VanDerWaalsContact C-N 3.27Å; Q500-K502 PolarHBondContact O-N 2.72Å |
| 503 | L | 55.7 | Low | 61.4 | Low | 154 Ų | 154 | 89.1 Ų | 89.1 | 81% | 0.806 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -87.1 | -21 | 174.2 | -79.3 | 79.5 | 0 | 0 | 0 | 113.7 | E499 Q500 P501 | E499-L503 WeakPolarHBondContact O-CD1 3.42Å; Q500-L503 PolarHBondContact O-N 3.27Å; P501-L503 PolarHBondContact O-N 2.86Å |
| 504 | Q | 53.9 | Low | 60.5 | Low | 167 Ų | 167 | 88.5 Ų | 88.5 | 78% | 0.78 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -113.5 | 0.6 | -172.8 | -67.9 | -170.4 | -10.3 | 0 | 0 | 115 | Q500 P501 G506 | Q500-Q504 PolarHBondContact O-N 2.83Å; P501-Q504 PolarHBondContact O-N 2.93Å; P501-Q504 VanDerWaalsContact O-N 3.17Å; Q504-G506 PolarHBondContact O-N 3.33Å |
| 505 | G | 47.6 | Very low | 60.2 | Low | 75 Ų | 75 | 90.2 Ų | 90.2 | 77% | 0.773 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.9 | 12.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | P501 N507 | P501-G505 PolarHBondContact O-N 3.17Å; G505-N507 PolarHBondContact O-N 2.94Å |
| 506 | G | 44.4 | Very low | 60 | Low | 36 Ų | 36 | 86.9 Ų | 86.9 | 37% | 0.371 | 48% | 0.476 | S | S | . | . | trans | -85.2 | 108.7 | -171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q504 K508 | Q504-G506 PolarHBondContact O-N 3.33Å; G506-K508 PolarHBondContact O-N 3.39Å | ||
| 507 | N | 42.4 | Very low | 59.8 | Low | 174 Ų | 174 | 82.8 Ų | 82.8 | 93% | 0.93 | 46% | 0.457 | S | S | * | . | trans | -75.9 | 67.2 | -176.9 | -144.6 | 5.4 | 0 | 0 | 0 | 112.4 | G505 | G505-N507 PolarHBondContact O-N 2.94Š| ||
| 508 | K | 48.3 | Very low | 59.8 | Low | 176 Ų | 176 | 80 Ų | 80 | 77% | 0.765 | 45% | 0.445 | S | S | * | . | P | Polyproline II helix | trans | -82.2 | 127.2 | 168.4 | -72.7 | 179.6 | -179.1 | 171.5 | 0 | 109 | G506 | G506-K508 PolarHBondContact O-N 3.39Š|
| 509 | S | 49.7 | Very low | 60.1 | Low | 106 Ų | 106 | 76.3 Ų | 76.3 | 74% | 0.741 | 43% | 0.428 | S | S | * | . | P | Polyproline II helix | trans | -58.7 | 129.5 | 172.1 | 55.2 | 0 | 0 | 0 | 0 | 110.4 | R511 | S509-R511 PolarHBondContact O-N 3.44Š|
| 510 | P | 52.1 | Low | 60.7 | Low | 109 Ų | 109 | 72.3 Ų | 72.3 | 71% | 0.708 | 41% | 0.409 | S | S | * | . | P | Polyproline II helix | trans | -59.8 | 136.7 | 179.4 | 24.1 | -33.3 | 0 | 0 | 0 | 110.8 | ||
| 511 | R | 60.4 | Low | 61.5 | Low | 75 Ų | 75 | 66.8 Ų | 66.8 | 28% | 0.283 | 38% | 0.384 | S | S | . | . | P | Polyproline II helix | trans | -72.9 | 129.8 | -178.9 | -179.7 | 175.9 | 165.9 | 125.4 | 4.1 | 109.2 | M356 S509 T513 D516 | M356-R511 VanDerWaalsContact CE-NH2 3.28Å; M356-R511 VanDerWaalsContact CG-NH2 3.27Å; S509-R511 PolarHBondContact O-N 3.44Å; R511-T513 PolarHBondContact O-N 2.96Å; R511-T513 VanDerWaalsContact O-N 3.11Å; R511-D516 IonicContact CZ-OD1 3.78Å; R511-D516 IonicContact NE-OD1 3.04Å; R511-D516 PolarHBondContact NE-OD1 3.39Å; R511-D516 IonicContact NE-OD2 3.46Å; R511-D516 PolarHBondContact NE-OD2 2.9Å; R511-D516 IonicContact NH2-OD1 2.79Å; R511-D516 PolarHBondContact NH2-OD1 3.45Å |
| 512 | G | 61.9 | Low | 62.6 | Low | 36 Ų | 36 | 65 Ų | 65 | 37% | 0.371 | 37% | 0.372 | S | S | . | . | trans | -66.6 | 110.3 | -172.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | G514 M515 | G512-G514 PolarHBondContact O-N 3.35Å; G512-G514 VanDerWaalsContact O-N 3.07Å; G512-M515 WeakPolarHBondContact O-CB 3.38Å; G512-M515 PolarHBondContact O-N 3.21Å | ||
| 513 | T | 64.3 | Low | 64 | Low | 29 Ų | 29 | 58.5 Ų | 58.5 | 18% | 0.178 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -51.7 | -33.5 | -176.7 | -49.5 | 0 | 0 | 0 | 0 | 114.3 | F197 R511 M515 D516 C517 | F197-T513 HydrophobicContact CB-CG2 3.72Å; F197-T513 HydrophobicContact CD2-CG2 4.17Å; F197-T513 HydrophobicContact CG-CG2 4.18Å; R511-T513 PolarHBondContact O-N 2.96Å; R511-T513 VanDerWaalsContact O-N 3.11Å; T513-M515 VanDerWaalsContact C-N 3.31Å; T513-M515 PolarHBondContact O-N 3.19Å; T513-D516 PolarHBondContact O-N 3.31Å; T513-C517 PolarHBondContact O-N 3.07Å |
| 514 | G | 64.8 | Low | 65.6 | Low | 5 Ų | 5 | 52.1 Ų | 52.1 | 5% | 0.052 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62.1 | -32.8 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | G512 A518 | G512-G514 PolarHBondContact O-N 3.35Å; G512-G514 VanDerWaalsContact O-N 3.07Å; G514-A518 WeakPolarHBondContact O-CB 3.16Å; G514-A518 PolarHBondContact O-N 3.06Å |
| 515 | M | 69.6 | Low | 67.2 | Low | 48 Ų | 48 | 44.2 Ų | 44.2 | 24% | 0.236 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -72.5 | -35.2 | 178.2 | 173 | 167.2 | 42.2 | 0 | 0 | 112.5 | M344 A352 G512 T513 A519 | M344-M515 HydrophobicContact CE-CB 4.25Å; M344-M515 HydrophobicContact CE-CG 3.97Å; M344-M515 HydrophobicContact CE-SD 3.64Å; M344-M515 HydrophobicContact SD-SD 3.81Å; A352-M515 HydrophobicContact CB-SD 4.38Å; G512-M515 WeakPolarHBondContact O-CB 3.38Å; G512-M515 PolarHBondContact O-N 3.21Å; T513-M515 VanDerWaalsContact C-N 3.31Å; T513-M515 PolarHBondContact O-N 3.19Å; M515-A519 VanDerWaalsContact O-CB 3.26Å; M515-A519 WeakPolarHBondContact O-CB 3.49Å; M515-A519 PolarHBondContact O-N 2.94Å |
| 516 | D | 74 | Confident | 69.1 | Low | 5 Ų | 5 | 42.8 Ų | 42.8 | 3% | 0.027 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -71.8 | -44 | 177.6 | -62.7 | -31.1 | 0 | 0 | 0 | 111.1 | I490 Q494 R511 T513 A519 L520 | I490-D516 HydrophobicContact CG2-CB 4.17Å; Q494-D516 PolarHBondContact NE2-OD2 2.73Å; R511-D516 IonicContact CZ-OD1 3.78Å; R511-D516 IonicContact NE-OD1 3.04Å; R511-D516 PolarHBondContact NE-OD1 3.39Å; R511-D516 IonicContact NE-OD2 3.46Å; R511-D516 PolarHBondContact NE-OD2 2.9Å; R511-D516 IonicContact NH2-OD1 2.79Å; R511-D516 PolarHBondContact NH2-OD1 3.45Å; T513-D516 PolarHBondContact O-N 3.31Å; D516-A519 PolarHBondContact O-N 3.03Å; D516-L520 WeakPolarHBondContact O-CB 3.44Å; D516-L520 PolarHBondContact O-N 3.04Å |
| 517 | C | 73.3 | Confident | 71.2 | Confident | 1 Ų | 1 | 41.1 Ų | 41.1 | 1% | 0.007 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.8 | -46.7 | 172.9 | -173.7 | 0 | 0 | 0 | 0 | 111.4 | T513 A519 L520 T521 | T513-C517 PolarHBondContact O-N 3.07Å; C517-A519 PolarHBondContact O-N 3.39Å; C517-L520 PolarHBondContact O-N 3.1Å; C517-T521 PolarHBondContact O-N 3.43Å; C517-T521 PolarHBondContact O-OG1 3.35Å |
| 518 | A | 72.8 | Confident | 73.4 | Confident | 9 Ų | 9 | 34 Ų | 34 | 7% | 0.074 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -62.7 | -42.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | G514 T521 C522 | G514-A518 WeakPolarHBondContact O-CB 3.16Å; G514-A518 PolarHBondContact O-N 3.06Å; A518-T521 PolarHBondContact O-N 3.23Å; A518-C522 PolarHBondContact O-N 3.09Å; A518-C522 PolarHBondContact O-SG 3.17Å |
| 519 | A | 78.2 | Confident | 75.3 | Confident | 1 Ų | 1 | 27.3 Ų | 27.3 | 1% | 0.008 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.3 | -36 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | L349 M356 M515 D516 C517 | L349-A519 HydrophobicContact CD1-CB 4.22Å; M356-A519 HydrophobicContact CE-CB 3.59Å; M515-A519 VanDerWaalsContact O-CB 3.26Å; M515-A519 WeakPolarHBondContact O-CB 3.49Å; M515-A519 PolarHBondContact O-N 2.94Å; D516-A519 PolarHBondContact O-N 3.03Å; C517-A519 PolarHBondContact O-N 3.39Å |
| 520 | L | 81.5 | Confident | 77.1 | Confident | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.005 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -66.4 | -46.7 | 173.9 | -171.4 | 67.9 | 0 | 0 | 0 | 111.2 | H367 P486 F487 I490 D516 C517 C522 M523 | H367-L520 HydrophobicContact CB-CD1 3.69Å; H367-L520 WeakPolarHBondContact CD2-CD1 3.41Å; P486-L520 HydrophobicContact CB-CD2 3.79Å; F487-L520 HydrophobicContact CD1-CD2 3.72Å; F487-L520 HydrophobicContact CD2-CD2 4.07Å; F487-L520 HydrophobicContact CE1-CB 4.41Å; F487-L520 HydrophobicContact CE1-CD2 3.63Å; F487-L520 HydrophobicContact CE1-CG 4.31Å; F487-L520 HydrophobicContact CE2-CD2 3.98Å; F487-L520 HydrophobicContact CG-CD2 3.93Å; F487-L520 HydrophobicContact CZ-CD2 3.76Å; F487-L520 HydrophobicContact CZ-CG 4.28Å; I490-L520 HydrophobicContact CD1-CB 3.97Å; I490-L520 HydrophobicContact CD1-CD2 3.55Å; I490-L520 HydrophobicContact CD1-CG 4.24Å; D516-L520 WeakPolarHBondContact O-CB 3.44Å; D516-L520 PolarHBondContact O-N 3.04Å; C517-L520 PolarHBondContact O-N 3.1Å; L520-C522 VanDerWaalsContact C-N 3.31Å; L520-C522 PolarHBondContact O-N 3.35Å; L520-M523 WeakPolarHBondContact O-CB 3.41Å; L520-M523 PolarHBondContact O-N 3.24Å |
| 521 | T | 81.1 | Confident | 78.7 | Confident | 8 Ų | 8 | 21.7 Ų | 21.7 | 5% | 0.049 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -65.7 | -31.7 | 177.4 | -51.9 | 0 | 0 | 0 | 0 | 112.5 | Q114 C517 A518 M523 V524 | Q114-T521 VanDerWaalsContact NE2-CG2 3.26Å; C517-T521 PolarHBondContact O-N 3.43Å; C517-T521 PolarHBondContact O-OG1 3.35Å; A518-T521 PolarHBondContact O-N 3.23Å; T521-M523 PolarHBondContact O-N 3.36Å; T521-V524 VanDerWaalsContact O-CB 3.28Å; T521-V524 WeakPolarHBondContact O-CB 3.09Å; T521-V524 WeakPolarHBondContact O-CG2 3.31Å; T521-V524 PolarHBondContact O-N 2.99Å |
| 522 | C | 82.3 | Confident | 79.7 | Confident | 0 Ų | 0 | 20.3 Ų | 20.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.8 | -25.1 | 171.5 | -68.9 | 0 | 0 | 0 | 0 | 113.2 | F111 A518 L520 V524 L526 | F111-C522 HydrophobicContact CD2-CB 4.4Å; A518-C522 PolarHBondContact O-N 3.09Å; A518-C522 PolarHBondContact O-SG 3.17Å; L520-C522 VanDerWaalsContact C-N 3.31Å; L520-C522 PolarHBondContact O-N 3.35Å; C522-V524 VanDerWaalsContact C-N 3.31Å; C522-L526 WeakPolarHBondContact O-CB 3.35Å; C522-L526 PolarHBondContact O-N 3.05Å |
| 523 | M | 86.6 | Confident | 80.6 | Confident | 14 Ų | 14 | 21.9 Ų | 21.9 | 7% | 0.069 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -71.6 | -26.2 | 174.3 | -59 | -64.3 | 159.3 | 0 | 0 | 112.2 | I353 C364 L368 L520 T521 L526 A527 | I353-M523 HydrophobicContact CD1-CE 3.72Å; I353-M523 HydrophobicContact CG1-CE 4.14Å; I353-M523 HydrophobicContact CG2-CE 4.19Å; C364-M523 HydrophobicContact CB-CE 4.04Å; C364-M523 HydrophobicContact CB-CG 4.13Å; C364-M523 HydrophobicContact CB-SD 4.38Å; L368-M523 HydrophobicContact CB-CB 4.29Å; L368-M523 HydrophobicContact CD1-CB 4.45Å; L368-M523 VanDerWaalsContact CD1-O 3.26Å; L368-M523 WeakPolarHBondContact CD1-O 3.46Å; L520-M523 WeakPolarHBondContact O-CB 3.41Å; L520-M523 PolarHBondContact O-N 3.24Å; T521-M523 PolarHBondContact O-N 3.36Å; M523-L526 HydrophobicContact SD-CD2 4.3Å; M523-A527 WeakPolarHBondContact O-CB 3.24Å; M523-A527 PolarHBondContact O-N 3.48Å |
| 524 | V | 87.4 | Confident | 81.4 | Confident | 19 Ų | 19 | 22.6 Ų | 22.6 | 12% | 0.115 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -66.8 | -45.8 | 174.4 | -170.3 | 0 | 0 | 0 | 0 | 109.9 | W371 T521 C522 A527 Q528 | W371-V524 HydrophobicContact CD2-CG1 3.81Å; W371-V524 HydrophobicContact CD2-CG2 4.29Å; W371-V524 HydrophobicContact CE3-CG1 4.05Å; W371-V524 HydrophobicContact CG-CB 4.44Å; W371-V524 HydrophobicContact CG-CG1 4.06Å; W371-V524 HydrophobicContact CG-CG2 4.12Å; T521-V524 VanDerWaalsContact O-CB 3.28Å; T521-V524 WeakPolarHBondContact O-CB 3.09Å; T521-V524 WeakPolarHBondContact O-CG2 3.31Å; T521-V524 PolarHBondContact O-N 2.99Å; C522-V524 VanDerWaalsContact C-N 3.31Å; V524-A527 WeakPolarHBondContact O-CB 3.28Å; V524-A527 PolarHBondContact O-N 3Å; V524-Q528 WeakPolarHBondContact O-CG 3.35Å; V524-Q528 PolarHBondContact O-N 2.63Å |
| 525 | Q | 87.6 | Confident | 82.2 | Confident | 1 Ų | 1 | 22.9 Ų | 22.9 | 1% | 0.005 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.7 | -37 | 176.1 | -73.9 | 152.2 | -8.8 | 0 | 0 | 112.5 | G110 F111 D186 A527 Q528 I529 | G110-Q525 PolarHBondContact O-OE1 3.31Å; F111-Q525 HydrophobicContact CB-CB 4.21Å; D186-Q525 PolarHBondContact OD2-NE2 3.38Å; Q525-A527 VanDerWaalsContact C-N 3.31Å; Q525-A527 PolarHBondContact O-N 3.34Å; Q525-Q528 PolarHBondContact O-N 3.45Å; Q525-I529 WeakPolarHBondContact O-CD1 3.1Å; Q525-I529 VanDerWaalsContact O-CG1 3.24Å; Q525-I529 WeakPolarHBondContact O-CG1 3.49Å; Q525-I529 PolarHBondContact O-N 2.82Å |
| 526 | L | 88.1 | Confident | 82.4 | Confident | 46 Ų | 46 | 22 Ų | 22 | 24% | 0.241 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -63 | -37.8 | 171.6 | -174 | 59.5 | 0 | 0 | 0 | 111.8 | F111 L368 C522 M523 I530 | F111-L526 HydrophobicContact CD2-CB 4.19Å; F111-L526 HydrophobicContact CE2-CB 4.03Å; F111-L526 HydrophobicContact CE2-CD1 4.19Å; F111-L526 HydrophobicContact CE2-CD2 4.32Å; F111-L526 HydrophobicContact CE2-CG 4.41Å; F111-L526 HydrophobicContact CZ-CD1 4.18Å; L368-L526 HydrophobicContact CD1-CB 3.84Å; L368-L526 HydrophobicContact CD1-CD2 3.98Å; L368-L526 HydrophobicContact CD1-CG 3.81Å; L368-L526 HydrophobicContact CD2-CD2 4.22Å; C522-L526 WeakPolarHBondContact O-CB 3.35Å; C522-L526 PolarHBondContact O-N 3.05Å; M523-L526 HydrophobicContact SD-CD2 4.3Å; L526-I530 HydrophobicContact CD1-CD1 4.13Å; L526-I530 HydrophobicContact CD1-CG1 4.44Å; L526-I530 HydrophobicContact CG-CD1 3.94Å; L526-I530 WeakPolarHBondContact O-CB 3.18Å; L526-I530 WeakPolarHBondContact O-CD1 3.48Å; L526-I530 VanDerWaalsContact O-CG1 3.22Å; L526-I530 WeakPolarHBondContact O-CG1 3.31Å; L526-I530 PolarHBondContact O-N 3.16Å |
| 527 | A | 89 | Confident | 82.7 | Confident | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -64.3 | -46.8 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L368 W371 A372 L375 M523 V524 Q525 I529 I530 V531 | L368-A527 HydrophobicContact CD1-CB 4.06Å; W371-A527 HydrophobicContact CB-CB 3.8Å; A372-A527 HydrophobicContact CB-CB 4.08Å; L375-A527 HydrophobicContact CD1-CB 4.03Å; M523-A527 WeakPolarHBondContact O-CB 3.24Å; M523-A527 PolarHBondContact O-N 3.48Å; V524-A527 WeakPolarHBondContact O-CB 3.28Å; V524-A527 PolarHBondContact O-N 3Å; Q525-A527 VanDerWaalsContact C-N 3.31Å; Q525-A527 PolarHBondContact O-N 3.34Å; A527-I529 VanDerWaalsContact C-N 3.33Å; A527-I529 PolarHBondContact O-N 2.64Å; A527-I530 PolarHBondContact O-N 3.28Å; A527-V531 WeakPolarHBondContact O-CB 3.37Å; A527-V531 VanDerWaalsContact O-CG2 3.3Å; A527-V531 WeakPolarHBondContact O-CG2 3.3Å; A527-V531 PolarHBondContact O-N 3.18Å |
| 528 | Q | 87.8 | Confident | 83.1 | Confident | 25 Ų | 25 | 27 Ų | 27 | 12% | 0.117 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -54.8 | -46.3 | 174.9 | -71.8 | 168.5 | -27.7 | 0 | 0 | 111.6 | P107 L375 V524 Q525 G532 | P107-Q528 HydrophobicContact CB-CB 3.84Å; P107-Q528 HydrophobicContact CG-CB 3.9Å; P107-Q528 HydrophobicContact CG-CG 4.48Å; L375-Q528 HydrophobicContact CD1-CB 4.37Å; L375-Q528 HydrophobicContact CD1-CG 3.56Å; L375-Q528 HydrophobicContact CD2-CG 4.39Å; V524-Q528 WeakPolarHBondContact O-CG 3.35Å; V524-Q528 PolarHBondContact O-N 2.63Å; Q525-Q528 PolarHBondContact O-N 3.45Å; Q528-G532 PolarHBondContact O-N 3.05Å |
| 529 | I | 87.8 | Confident | 83.5 | Confident | 35 Ų | 35 | 28 Ų | 28 | 18% | 0.179 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.5 | -46.7 | 179.1 | -66.2 | 163.1 | 0 | 0 | 0 | 111.3 | L104 P107 I108 F111 Q525 A527 A533 | L104-I529 HydrophobicContact CD1-CG1 4.4Å; L104-I529 HydrophobicContact CD1-CG2 4.49Å; P107-I529 HydrophobicContact CB-CD1 4.49Å; P107-I529 HydrophobicContact CB-CG1 3.83Å; I108-I529 HydrophobicContact CG1-CD1 3.97Å; I108-I529 HydrophobicContact CG1-CG1 4.05Å; F111-I529 HydrophobicContact CB-CD1 3.9Å; F111-I529 HydrophobicContact CG-CD1 4.3Å; Q525-I529 WeakPolarHBondContact O-CD1 3.1Å; Q525-I529 VanDerWaalsContact O-CG1 3.24Å; Q525-I529 WeakPolarHBondContact O-CG1 3.49Å; Q525-I529 PolarHBondContact O-N 2.82Å; A527-I529 VanDerWaalsContact C-N 3.33Å; A527-I529 PolarHBondContact O-N 2.64Å; I529-A533 VanDerWaalsContact O-CB 3.26Å; I529-A533 WeakPolarHBondContact O-CB 3.48Å; I529-A533 PolarHBondContact O-N 3.46Å |
| 530 | I | 88.1 | Confident | 83.6 | Confident | 88 Ų | 88 | 34.9 Ų | 34.9 | 45% | 0.451 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.9 | -46 | -179.9 | -71.3 | 166.8 | 0 | 0 | 0 | 110.8 | L368 L526 A527 G534 | L368-I530 HydrophobicContact CD1-CD1 4.46Å; L526-I530 HydrophobicContact CD1-CD1 4.13Å; L526-I530 HydrophobicContact CD1-CG1 4.44Å; L526-I530 HydrophobicContact CG-CD1 3.94Å; L526-I530 WeakPolarHBondContact O-CB 3.18Å; L526-I530 WeakPolarHBondContact O-CD1 3.48Å; L526-I530 VanDerWaalsContact O-CG1 3.22Å; L526-I530 WeakPolarHBondContact O-CG1 3.31Å; L526-I530 PolarHBondContact O-N 3.16Å; A527-I530 PolarHBondContact O-N 3.28Å; I530-G534 PolarHBondContact O-N 3.41Å |
| 531 | V | 86.6 | Confident | 83.7 | Confident | 9 Ų | 9 | 39 Ų | 39 | 6% | 0.055 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.2 | -51.7 | 178.6 | 172 | 0 | 0 | 0 | 0 | 110.5 | A372 C376 L379 A527 A533 G534 L535 | A372-V531 HydrophobicContact CB-CG2 4.06Å; C376-V531 HydrophobicContact CB-CG1 4.27Å; C376-V531 HydrophobicContact CB-CG2 4.35Å; L379-V531 HydrophobicContact CD1-CG1 3.92Å; A527-V531 WeakPolarHBondContact O-CB 3.37Å; A527-V531 VanDerWaalsContact O-CG2 3.3Å; A527-V531 WeakPolarHBondContact O-CG2 3.3Å; A527-V531 PolarHBondContact O-N 3.18Å; V531-A533 VanDerWaalsContact C-N 3.33Å; V531-A533 PolarHBondContact O-N 2.66Å; V531-G534 PolarHBondContact O-N 3.16Å; V531-L535 HydrophobicContact CG1-CB 4.25Å; V531-L535 HydrophobicContact CG1-CD2 3.71Å; V531-L535 WeakPolarHBondContact O-CB 3.41Å; V531-L535 PolarHBondContact O-N 3.33Å |
| 532 | G | 80.4 | Confident | 83.9 | Confident | 46 Ų | 46 | 41.2 Ų | 41.2 | 47% | 0.474 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -60.6 | -38.3 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q528 | Q528-G532 PolarHBondContact O-N 3.05Å |
| 533 | A | 81.9 | Confident | 83.6 | Confident | 70 Ų | 70 | 44.7 Ų | 44.7 | 58% | 0.579 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -79.2 | -38.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | I529 V531 | I529-A533 VanDerWaalsContact O-CB 3.26Å; I529-A533 WeakPolarHBondContact O-CB 3.48Å; I529-A533 PolarHBondContact O-N 3.46Å; V531-A533 VanDerWaalsContact C-N 3.33Å; V531-A533 PolarHBondContact O-N 2.66Å |
| 534 | G | 81.3 | Confident | 83.4 | Confident | 44 Ų | 44 | 45.7 Ų | 45.7 | 45% | 0.454 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -88.3 | -38.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 115 | I530 V531 G536 G537 L538 | I530-G534 PolarHBondContact O-N 3.41Å; V531-G534 PolarHBondContact O-N 3.16Å; G534-G536 PolarHBondContact O-N 3.18Å; G534-G537 PolarHBondContact O-N 3.37Å; G534-L538 PolarHBondContact O-N 3.39Å; G534-L538 VanDerWaalsContact O-N 3.14Å |
| 535 | L | 79.8 | Confident | 82.9 | Confident | 10 Ų | 10 | 45 Ų | 45 | 5% | 0.052 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -72.4 | -36.1 | -164.7 | -171.4 | 56.3 | 0 | 0 | 0 | 113.3 | C376 F380 V531 G537 L538 V539 V548 | C376-L535 HydrophobicContact CB-CD2 4.11Å; C376-L535 VanDerWaalsContact SG-CD2 3.56Å; F380-L535 HydrophobicContact CD2-CD2 3.5Å; F380-L535 HydrophobicContact CD2-CG 4.19Å; F380-L535 HydrophobicContact CE2-CB 4.27Å; F380-L535 HydrophobicContact CE2-CD2 3.47Å; F380-L535 VanDerWaalsContact CE2-CD2 3.47Å; F380-L535 HydrophobicContact CE2-CG 3.85Å; F380-L535 HydrophobicContact CZ-CD2 4.48Å; F380-L535 HydrophobicContact CZ-CG 4.43Å; V531-L535 HydrophobicContact CG1-CB 4.25Å; V531-L535 HydrophobicContact CG1-CD2 3.71Å; V531-L535 WeakPolarHBondContact O-CB 3.41Å; V531-L535 PolarHBondContact O-N 3.33Å; L535-G537 VanDerWaalsContact C-N 3.3Å; L535-G537 PolarHBondContact O-N 2.9Å; L535-L538 HydrophobicContact CD1-CB 4.45Å; L535-L538 HydrophobicContact CD1-CD2 4.04Å; L535-L538 WeakPolarHBondContact O-CB 3.48Å; L535-L538 PolarHBondContact O-N 2.89Å; L535-L538 VanDerWaalsContact O-N 3.13Å; L535-V539 WeakPolarHBondContact O-CG2 3.46Å; L535-V539 PolarHBondContact O-N 2.89Å; L535-V548 HydrophobicContact CD1-CB 4.41Å; L535-V548 HydrophobicContact CD1-CG1 4.37Å; L535-V548 HydrophobicContact CD1-CG2 3.94Å; L535-V548 HydrophobicContact CD2-CG1 3.92Å; L535-V548 HydrophobicContact CD2-CG2 4.36Å; L535-V548 HydrophobicContact CG-CG2 4.18Å |
| 536 | G | 74.8 | Confident | 82.6 | Confident | 29 Ų | 29 | 47.4 Ų | 47.4 | 30% | 0.299 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -60.3 | -39.8 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | G534 V539 I540 | G534-G536 PolarHBondContact O-N 3.18Å; G536-V539 PolarHBondContact O-N 3Å; G536-I540 WeakPolarHBondContact O-CD1 3.24Å; G536-I540 VanDerWaalsContact O-CG1 3.29Å; G536-I540 WeakPolarHBondContact O-CG1 3.19Å; G536-I540 PolarHBondContact O-N 2.9Å; G536-I540 VanDerWaalsContact O-N 3.07Å |
| 537 | G | 79.3 | Confident | 82.5 | Confident | 43 Ų | 43 | 46.7 Ų | 46.7 | 44% | 0.443 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -65.1 | -37.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | G534 L535 I540 A541 | G534-G537 PolarHBondContact O-N 3.37Å; L535-G537 VanDerWaalsContact C-N 3.3Å; L535-G537 PolarHBondContact O-N 2.9Å; G537-I540 PolarHBondContact O-N 3.14Å; G537-A541 WeakPolarHBondContact O-CB 3.47Å; G537-A541 PolarHBondContact O-N 2.97Å |
| 538 | L | 82.5 | Confident | 82.3 | Confident | 70 Ų | 70 | 46.8 Ų | 46.8 | 37% | 0.366 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -66 | -42.2 | 176.2 | -174.5 | 64.3 | 0 | 0 | 0 | 112.2 | G534 L535 A541 A542 V547 | G534-L538 PolarHBondContact O-N 3.39Å; G534-L538 VanDerWaalsContact O-N 3.14Å; L535-L538 HydrophobicContact CD1-CB 4.45Å; L535-L538 HydrophobicContact CD1-CD2 4.04Å; L535-L538 WeakPolarHBondContact O-CB 3.48Å; L535-L538 PolarHBondContact O-N 2.89Å; L535-L538 VanDerWaalsContact O-N 3.13Å; L538-A541 PolarHBondContact O-N 3.44Å; L538-A542 WeakPolarHBondContact O-CB 3.2Å; L538-A542 PolarHBondContact O-N 3.45Å; L538-V547 HydrophobicContact CD1-CG2 4.07Å; L538-V547 HydrophobicContact CD2-CG1 4.36Å; L538-V547 HydrophobicContact CD2-CG2 4Å; L538-V547 HydrophobicContact CG-CG1 3.95Å; L538-V547 HydrophobicContact CG-CG2 3.8Å |
| 539 | V | 80.8 | Confident | 82.3 | Confident | 28 Ų | 28 | 45.7 Ų | 45.7 | 17% | 0.17 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63.3 | -43.5 | 175.4 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | L535 G536 A542 G543 V545 V547 V548 | L535-V539 WeakPolarHBondContact O-CG2 3.46Å; L535-V539 PolarHBondContact O-N 2.89Å; G536-V539 PolarHBondContact O-N 3Å; V539-A542 PolarHBondContact O-N 3.03Å; V539-G543 PolarHBondContact O-N 2.89Å; V539-V545 HydrophobicContact CG1-CG2 4.39Å; V539-V547 HydrophobicContact CG2-CG1 4.02Å; V539-V548 HydrophobicContact CG2-CG2 3.46Å; V539-V548 VanDerWaalsContact CG2-CG2 3.46Å |
| 540 | I | 80.6 | Confident | 82.3 | Confident | 146 Ų | 146 | 48.1 Ų | 48.1 | 75% | 0.749 | 34% | 0.344 | S | S | * | . | H | α-helix | trans | -62.5 | -43 | 176 | -68.1 | 165 | 0 | 0 | 0 | 111.1 | G536 G537 | G536-I540 WeakPolarHBondContact O-CD1 3.24Å; G536-I540 VanDerWaalsContact O-CG1 3.29Å; G536-I540 WeakPolarHBondContact O-CG1 3.19Å; G536-I540 PolarHBondContact O-N 2.9Å; G536-I540 VanDerWaalsContact O-N 3.07Å; G537-I540 PolarHBondContact O-N 3.14Å |
| 541 | A | 84.8 | Confident | 82.4 | Confident | 89 Ų | 89 | 45.1 Ų | 45.1 | 74% | 0.736 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -69.3 | -31.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | G537 L538 | G537-A541 WeakPolarHBondContact O-CB 3.47Å; G537-A541 PolarHBondContact O-N 2.97Å; L538-A541 PolarHBondContact O-N 3.44Å |
| 542 | A | 83.7 | Confident | 82.6 | Confident | 54 Ų | 54 | 44.7 Ų | 44.7 | 45% | 0.446 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -88.7 | -18.4 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114 | L538 V539 S544 V547 | L538-A542 WeakPolarHBondContact O-CB 3.2Å; L538-A542 PolarHBondContact O-N 3.45Å; V539-A542 PolarHBondContact O-N 3.03Å; A542-S544 PolarHBondContact O-N 3.2Å; A542-V547 HydrophobicContact CB-CB 3.71Å; A542-V547 HydrophobicContact CB-CG1 3.8Å; A542-V547 HydrophobicContact CB-CG2 3.86Å |
| 543 | G | 77.4 | Confident | 83.3 | Confident | 72 Ų | 72 | 43.1 Ų | 43.1 | 74% | 0.742 | 31% | 0.31 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65 | 15.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | V539 | V539-G543 PolarHBondContact O-N 2.89Š|
| 544 | S | 81.1 | Confident | 83.8 | Confident | 36 Ų | 36 | 42 Ų | 42 | 25% | 0.252 | 30% | 0.301 | S | S | . | . | S | Bend | trans | -158.5 | 138.4 | -174.3 | -176.5 | 0 | 0 | 0 | 0 | 112 | Q388 A542 I546 V547 | Q388-S544 PolarHBondContact NE2-OG 3.16Å; Q388-S544 VanDerWaalsContact NE2-OG 3.1Å; A542-S544 PolarHBondContact O-N 3.2Å; S544-I546 VanDerWaalsContact C-N 3.26Å; S544-I546 PolarHBondContact O-N 2.88Å; S544-V547 WeakPolarHBondContact O-CG1 3.47Å; S544-V547 PolarHBondContact O-N 3.06Å |
| 545 | V | 77.9 | Confident | 84.3 | Confident | 3 Ų | 3 | 42.5 Ų | 42.5 | 2% | 0.018 | 29% | 0.292 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.8 | -18 | -178 | -167.1 | 0 | 0 | 0 | 0 | 112.4 | F380 F384 V539 V547 V548 | F380-V545 HydrophobicContact CB-CG1 4.39Å; F384-V545 HydrophobicContact CB-CG1 3.82Å; F384-V545 HydrophobicContact CD2-CB 4.21Å; F384-V545 HydrophobicContact CD2-CG1 4.17Å; F384-V545 HydrophobicContact CG-CG1 4.45Å; V539-V545 HydrophobicContact CG1-CG2 4.39Å; V545-V547 PolarHBondContact O-N 2.89Å; V545-V548 HydrophobicContact CG1-CB 4.47Å; V545-V548 HydrophobicContact CG1-CG2 3.95Å; V545-V548 VanDerWaalsContact O-CB 3.22Å; V545-V548 WeakPolarHBondContact O-CB 3.4Å; V545-V548 WeakPolarHBondContact O-CG2 3.1Å; V545-V548 PolarHBondContact O-N 3.34Å |
| 546 | I | 81.8 | Confident | 85 | Confident | 52 Ų | 52 | 42 Ų | 42 | 27% | 0.267 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -50.8 | -33.1 | 172.7 | -52.7 | -178.9 | 0 | 0 | 0 | 112.1 | F384 Q388 S544 V548 V549 L550 | F384-I546 HydrophobicContact CE2-CG1 4.33Å; Q388-I546 VanDerWaalsContact CD-CG1 3.42Å; Q388-I546 HydrophobicContact CG-CG1 4.37Å; Q388-I546 VanDerWaalsContact OE1-N 3.14Å; S544-I546 VanDerWaalsContact C-N 3.26Å; S544-I546 PolarHBondContact O-N 2.88Å; I546-V548 PolarHBondContact O-N 2.94Å; I546-V548 VanDerWaalsContact O-N 3.13Å; I546-V549 PolarHBondContact O-N 3.09Å; I546-V549 VanDerWaalsContact O-N 3.09Å; I546-L550 HydrophobicContact CG2-CD1 3.85Å; I546-L550 HydrophobicContact CG2-CG 4.01Å; I546-L550 WeakPolarHBondContact O-CG 3.39Å; I546-L550 PolarHBondContact O-N 3.17Å |
| 547 | V | 86 | Confident | 85.9 | Confident | 32 Ų | 32 | 45.4 Ų | 45.4 | 19% | 0.194 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.8 | -27.6 | 179.1 | 80.6 | 0 | 0 | 0 | 0 | 112.8 | L538 V539 A542 S544 V545 S551 | L538-V547 HydrophobicContact CD1-CG2 4.07Å; L538-V547 HydrophobicContact CD2-CG1 4.36Å; L538-V547 HydrophobicContact CD2-CG2 4Å; L538-V547 HydrophobicContact CG-CG1 3.95Å; L538-V547 HydrophobicContact CG-CG2 3.8Å; V539-V547 HydrophobicContact CG2-CG1 4.02Å; A542-V547 HydrophobicContact CB-CB 3.71Å; A542-V547 HydrophobicContact CB-CG1 3.8Å; A542-V547 HydrophobicContact CB-CG2 3.86Å; S544-V547 WeakPolarHBondContact O-CG1 3.47Å; S544-V547 PolarHBondContact O-N 3.06Å; V545-V547 PolarHBondContact O-N 2.89Å; V547-S551 VanDerWaalsContact O-CB 3.27Å; V547-S551 WeakPolarHBondContact O-CB 3.49Å; V547-S551 PolarHBondContact O-N 3.46Å; V547-S551 PolarHBondContact O-OG 3.15Å; V547-S551 VanDerWaalsContact O-OG 3.1Å |
| 548 | V | 84.8 | Confident | 86.5 | Confident | 2 Ų | 2 | 47.9 Ų | 47.9 | 1% | 0.012 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -65.9 | -51.1 | 175.1 | 179.6 | 0 | 0 | 0 | 0 | 110.8 | C376 F380 L535 V539 V545 I546 L550 S551 A552 | C376-V548 WeakPolarHBondContact O-CG1 3.35Å; C376-V548 PolarHBondContact SG-O 2.94Å; C376-V548 VanDerWaalsContact SG-O 3.39Å; F380-V548 HydrophobicContact CB-CG1 4.15Å; F380-V548 HydrophobicContact CB-CG2 4.31Å; F380-V548 HydrophobicContact CG-CG2 4.32Å; L535-V548 HydrophobicContact CD1-CB 4.41Å; L535-V548 HydrophobicContact CD1-CG1 4.37Å; L535-V548 HydrophobicContact CD1-CG2 3.94Å; L535-V548 HydrophobicContact CD2-CG1 3.92Å; L535-V548 HydrophobicContact CD2-CG2 4.36Å; L535-V548 HydrophobicContact CG-CG2 4.18Å; V539-V548 HydrophobicContact CG2-CG2 3.46Å; V539-V548 VanDerWaalsContact CG2-CG2 3.46Å; V545-V548 HydrophobicContact CG1-CB 4.47Å; V545-V548 HydrophobicContact CG1-CG2 3.95Å; V545-V548 VanDerWaalsContact O-CB 3.22Å; V545-V548 WeakPolarHBondContact O-CB 3.4Å; V545-V548 WeakPolarHBondContact O-CG2 3.1Å; V545-V548 PolarHBondContact O-N 3.34Å; I546-V548 PolarHBondContact O-N 2.94Å; I546-V548 VanDerWaalsContact O-N 3.13Å; V548-L550 VanDerWaalsContact C-N 3.32Å; V548-L550 PolarHBondContact O-N 3.28Å; V548-S551 PolarHBondContact O-N 3.45Å; V548-S551 PolarHBondContact O-OG 2.92Å; V548-A552 WeakPolarHBondContact O-CB 3.38Å; V548-A552 PolarHBondContact O-N 2.98Å |
| 549 | V | 87 | Confident | 86.9 | Confident | 2 Ų | 2 | 44.6 Ų | 44.6 | 1% | 0.012 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -67.1 | -38.2 | -176.9 | -172.9 | 0 | 0 | 0 | 0 | 110.4 | F384 T456 I459 I546 S553 | F384-V549 HydrophobicContact CD1-CG2 4.17Å; F384-V549 HydrophobicContact CD2-CG2 4.27Å; F384-V549 HydrophobicContact CE1-CG2 4Å; F384-V549 HydrophobicContact CE2-CG2 4.11Å; F384-V549 HydrophobicContact CG-CG2 4.3Å; F384-V549 HydrophobicContact CZ-CG2 3.97Å; T456-V549 WeakPolarHBondContact O-CG1 3.36Å; I459-V549 HydrophobicContact CB-CG1 4.34Å; I459-V549 HydrophobicContact CG2-CG1 4.25Å; I546-V549 PolarHBondContact O-N 3.09Å; I546-V549 VanDerWaalsContact O-N 3.09Å; V549-S553 PolarHBondContact O-N 3.38Å |
| 550 | L | 88.4 | Confident | 87.5 | Confident | 85 Ų | 85 | 43.6 Ų | 43.6 | 45% | 0.445 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -67.7 | -40 | 174.7 | -66.3 | 176.2 | 0 | 0 | 0 | 112.8 | I546 V548 S553 A554 | I546-L550 HydrophobicContact CG2-CD1 3.85Å; I546-L550 HydrophobicContact CG2-CG 4.01Å; I546-L550 WeakPolarHBondContact O-CG 3.39Å; I546-L550 PolarHBondContact O-N 3.17Å; V548-L550 VanDerWaalsContact C-N 3.32Å; V548-L550 PolarHBondContact O-N 3.28Å; L550-S553 PolarHBondContact O-N 3.45Å; L550-A554 WeakPolarHBondContact O-CB 3.42Å; L550-A554 PolarHBondContact O-N 3.04Å |
| 551 | S | 90.1 | Very high | 88 | Confident | 26 Ų | 26 | 41 Ų | 41 | 18% | 0.182 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -71.4 | -36.2 | 177.2 | 70.1 | 0 | 0 | 0 | 0 | 112.1 | C376 V547 V548 A554 M555 | C376-S551 PolarHBondContact SG-OG 2.91Å; V547-S551 VanDerWaalsContact O-CB 3.27Å; V547-S551 WeakPolarHBondContact O-CB 3.49Å; V547-S551 PolarHBondContact O-N 3.46Å; V547-S551 PolarHBondContact O-OG 3.15Å; V547-S551 VanDerWaalsContact O-OG 3.1Å; V548-S551 PolarHBondContact O-N 3.45Å; V548-S551 PolarHBondContact O-OG 2.92Å; S551-A554 PolarHBondContact O-N 3.21Å; S551-M555 WeakPolarHBondContact O-CB 3.42Å; S551-M555 WeakPolarHBondContact O-CG 3.38Å; S551-M555 PolarHBondContact O-N 2.66Å |
| 552 | A | 91 | Very high | 88.4 | Confident | 0 Ų | 0 | 38.5 Ų | 38.5 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -59.6 | -45.8 | 170.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | A373 C376 N377 F452 V548 M555 S556 | A373-A552 WeakPolarHBondContact CB-O 3.41Å; A373-A552 WeakPolarHBondContact O-CB 3.24Å; C376-A552 HydrophobicContact CB-CB 4.25Å; N377-A552 HydrophobicContact CB-CB 3.86Å; F452-A552 HydrophobicContact CE1-CB 4.49Å; V548-A552 WeakPolarHBondContact O-CB 3.38Å; V548-A552 PolarHBondContact O-N 2.98Å; A552-M555 PolarHBondContact O-N 3.33Å; A552-S556 WeakPolarHBondContact O-CB 3.2Å; A552-S556 PolarHBondContact O-N 3.26Å |
| 553 | S | 93.3 | Very high | 88.7 | Confident | 12 Ų | 12 | 36 Ų | 36 | 8% | 0.084 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.8 | -50.7 | 172.4 | 168.8 | 0 | 0 | 0 | 0 | 111.7 | G453 T456 S457 V549 L550 M555 S556 L557 | G453-S553 PolarHBondContact O-OG 3.33Å; T456-S553 WeakPolarHBondContact OG1-CA 3.28Å; T456-S553 WeakPolarHBondContact OG1-CB 3.34Å; S457-S553 WeakPolarHBondContact OG-CB 3.4Å; S457-S553 PolarHBondContact OG-OG 3.08Å; V549-S553 PolarHBondContact O-N 3.38Å; L550-S553 PolarHBondContact O-N 3.45Å; S553-M555 PolarHBondContact O-N 3.03Å; S553-S556 PolarHBondContact O-N 3.17Å; S553-S556 VanDerWaalsContact O-N 3.15Å; S553-L557 WeakPolarHBondContact O-CB 3.49Å; S553-L557 PolarHBondContact O-N 2.69Å |
| 554 | A | 92.8 | Very high | 89.2 | Confident | 47 Ų | 47 | 35.8 Ų | 35.8 | 39% | 0.388 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -60.4 | -43.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L550 S551 L557 I558 | L550-A554 WeakPolarHBondContact O-CB 3.42Å; L550-A554 PolarHBondContact O-N 3.04Å; S551-A554 PolarHBondContact O-N 3.21Å; A554-L557 PolarHBondContact O-N 3.28Å; A554-I558 WeakPolarHBondContact O-CD1 3.35Å; A554-I558 VanDerWaalsContact O-CG1 3.24Å; A554-I558 WeakPolarHBondContact O-CG1 3.42Å; A554-I558 PolarHBondContact O-N 3.41Å |
| 555 | M | 92.8 | Very high | 89.5 | Confident | 54 Ų | 54 | 39.9 Ų | 39.9 | 27% | 0.266 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -65 | -38 | 175.4 | -70.2 | -164 | 77.7 | 0 | 0 | 112.2 | L369 A372 A373 S551 A552 S553 I558 G559 | L369-M555 HydrophobicContact CD2-CE 3.8Å; A372-M555 HydrophobicContact CB-CE 3.47Å; A372-M555 VanDerWaalsContact CB-CE 3.47Å; A372-M555 HydrophobicContact CB-SD 4Å; A373-M555 HydrophobicContact CB-CB 3.83Å; S551-M555 WeakPolarHBondContact O-CB 3.42Å; S551-M555 WeakPolarHBondContact O-CG 3.38Å; S551-M555 PolarHBondContact O-N 2.66Å; A552-M555 PolarHBondContact O-N 3.33Å; S553-M555 PolarHBondContact O-N 3.03Å; M555-I558 PolarHBondContact O-N 3.31Å; M555-G559 PolarHBondContact O-N 2.87Å |
| 556 | S | 93.4 | Very high | 89.8 | Confident | 0 Ų | 0 | 45.1 Ų | 45.1 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -66.6 | -39.6 | 174.9 | -160.2 | 0 | 0 | 0 | 0 | 112.2 | Y449 A552 S553 G559 C560 | Y449-S556 PolarHBondContact O-OG 3Å; A552-S556 WeakPolarHBondContact O-CB 3.2Å; A552-S556 PolarHBondContact O-N 3.26Å; S553-S556 PolarHBondContact O-N 3.17Å; S553-S556 VanDerWaalsContact O-N 3.15Å; S556-G559 PolarHBondContact O-N 3.43Å; S556-C560 VanDerWaalsContact O-CB 3.3Å; S556-C560 WeakPolarHBondContact O-CB 3.2Å; S556-C560 PolarHBondContact O-N 2.97Å |
| 557 | L | 93.3 | Very high | 89.6 | Confident | 100 Ų | 100 | 44.3 Ų | 44.3 | 52% | 0.524 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67 | -41.9 | 176.6 | -172.5 | 151.3 | 0 | 0 | 0 | 111.5 | S553 A554 G559 C560 I561 | S553-L557 WeakPolarHBondContact O-CB 3.49Å; S553-L557 PolarHBondContact O-N 2.69Å; A554-L557 PolarHBondContact O-N 3.28Å; L557-G559 VanDerWaalsContact C-N 3.35Å; L557-C560 WeakPolarHBondContact O-CB 3.29Å; L557-C560 PolarHBondContact O-N 3.12Å; L557-I561 HydrophobicContact CD2-CD1 3.65Å; L557-I561 HydrophobicContact CD2-CG1 4.42Å; L557-I561 WeakPolarHBondContact O-CG1 3.19Å; L557-I561 PolarHBondContact O-N 3.25Å |
| 558 | I | 93.8 | Very high | 89.8 | Confident | 96 Ų | 96 | 44.9 Ų | 44.9 | 49% | 0.492 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -60.5 | -44.9 | 171.9 | -68.4 | 163.5 | 0 | 0 | 0 | 110.4 | L369 A554 M555 C560 I561 F562 | L369-I558 HydrophobicContact CD1-CG2 4.24Å; A554-I558 WeakPolarHBondContact O-CD1 3.35Å; A554-I558 VanDerWaalsContact O-CG1 3.24Å; A554-I558 WeakPolarHBondContact O-CG1 3.42Å; A554-I558 PolarHBondContact O-N 3.41Å; M555-I558 PolarHBondContact O-N 3.31Å; I558-C560 VanDerWaalsContact C-N 3.34Å; I558-C560 PolarHBondContact O-N 3.1Å; I558-I561 PolarHBondContact O-N 3.29Å; I558-F562 WeakPolarHBondContact O-CB 3.44Å; I558-F562 PolarHBondContact O-N 3.18Å |
| 559 | G | 91 | Very high | 90 | Very high | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | M555 S556 L557 F562 I563 | M555-G559 PolarHBondContact O-N 2.87Å; S556-G559 PolarHBondContact O-N 3.43Å; L557-G559 VanDerWaalsContact C-N 3.35Å; G559-F562 PolarHBondContact O-N 3.11Å; G559-I563 WeakPolarHBondContact O-CD1 3.24Å; G559-I563 VanDerWaalsContact O-CG1 3.24Å; G559-I563 WeakPolarHBondContact O-CG1 3.4Å; G559-I563 PolarHBondContact O-N 2.76Å |
| 560 | C | 91.9 | Very high | 90.2 | Very high | 8 Ų | 8 | 49.7 Ų | 49.7 | 5% | 0.054 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 177.3 | -162.1 | 0 | 0 | 0 | 0 | 112.1 | F446 S556 L557 I558 A564 | F446-C560 VanDerWaalsContact CD2-SG 3.52Å; F446-C560 WeakPolarHBondContact CE2-SG 3.49Å; S556-C560 VanDerWaalsContact O-CB 3.3Å; S556-C560 WeakPolarHBondContact O-CB 3.2Å; S556-C560 PolarHBondContact O-N 2.97Å; L557-C560 WeakPolarHBondContact O-CB 3.29Å; L557-C560 PolarHBondContact O-N 3.12Å; I558-C560 VanDerWaalsContact C-N 3.34Å; I558-C560 PolarHBondContact O-N 3.1Å; C560-A564 PolarHBondContact O-N 3.3Å; C560-A564 VanDerWaalsContact O-N 3.16Å |
| 561 | I | 92.3 | Very high | 90.3 | Very high | 90 Ų | 90 | 47.6 Ų | 47.6 | 46% | 0.462 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -64.6 | -42.6 | 173.5 | -67.9 | 173.1 | 0 | 0 | 0 | 110.5 | L557 I558 I563 A564 L565 | L557-I561 HydrophobicContact CD2-CD1 3.65Å; L557-I561 HydrophobicContact CD2-CG1 4.42Å; L557-I561 WeakPolarHBondContact O-CG1 3.19Å; L557-I561 PolarHBondContact O-N 3.25Å; I558-I561 PolarHBondContact O-N 3.29Å; I561-I563 PolarHBondContact O-N 3.27Å; I561-A564 PolarHBondContact O-N 3.02Å; I561-L565 HydrophobicContact CG2-CD1 3.74Å; I561-L565 HydrophobicContact CG2-CG 4.37Å; I561-L565 WeakPolarHBondContact O-CG 3.34Å; I561-L565 PolarHBondContact O-N 2.92Å; I561-L565 VanDerWaalsContact O-N 3.1Å |
| 562 | F | 92 | Very high | 90.3 | Very high | 37 Ų | 37 | 48.9 Ų | 48.9 | 16% | 0.162 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.4 | -43 | 179.3 | -171.2 | -81.6 | 0 | 0 | 0 | 112 | C362 I365 I558 G559 L565 F566 | C362-F562 HydrophobicContact CB-CE1 3.96Å; C362-F562 HydrophobicContact CB-CZ 4.23Å; C362-F562 WeakPolarHBondContact O-CE1 3.36Å; I365-F562 HydrophobicContact CB-CE1 4.26Å; I365-F562 HydrophobicContact CB-CZ 4Å; I365-F562 HydrophobicContact CD1-CZ 4.38Å; I365-F562 HydrophobicContact CG2-CD2 4.38Å; I365-F562 HydrophobicContact CG2-CE1 4.15Å; I365-F562 HydrophobicContact CG2-CE2 3.86Å; I365-F562 HydrophobicContact CG2-CZ 3.74Å; I558-F562 WeakPolarHBondContact O-CB 3.44Å; I558-F562 PolarHBondContact O-N 3.18Å; G559-F562 PolarHBondContact O-N 3.11Å; F562-L565 PolarHBondContact O-N 2.99Å; F562-F566 HydrophobicContact CD1-CB 4.27Å; F562-F566 HydrophobicContact CD1-CD2 4.21Å; F562-F566 AromaticContact CD2-CD2 3.52Å; F562-F566 HydrophobicContact CD2-CD2 3.52Å; F562-F566 AromaticContact CD2-CE2 3.89Å; F562-F566 HydrophobicContact CD2-CE2 3.89Å; F562-F566 HydrophobicContact CE1-CB 3.87Å; F562-F566 HydrophobicContact CE1-CD2 4.18Å; F562-F566 HydrophobicContact CE1-CG 4.35Å; F562-F566 AromaticContact CE2-CD2 3.51Å; F562-F566 HydrophobicContact CE2-CD2 3.51Å; F562-F566 AromaticContact CE2-CE2 3.9Å; F562-F566 HydrophobicContact CE2-CE2 3.9Å; F562-F566 HydrophobicContact CE2-CG 4.17Å; F562-F566 AromaticContact CG-CD2 3.88Å; F562-F566 HydrophobicContact CG-CD2 3.88Å; F562-F566 HydrophobicContact CZ-CB 4.02Å; F562-F566 AromaticContact CZ-CD2 3.85Å; F562-F566 HydrophobicContact CZ-CD2 3.85Å; F562-F566 HydrophobicContact CZ-CG 4.08Å; F562-F566 WeakPolarHBondContact O-CB 3.29Å; F562-F566 WeakPolarHBondContact O-CD2 3.46Å; F562-F566 PolarHBondContact O-N 2.84Å |
| 563 | I | 89.9 | Confident | 90.3 | Very high | 3 Ų | 3 | 52.2 Ų | 52.2 | 2% | 0.015 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.8 | -50.6 | 173.7 | -68.3 | 160.8 | 0 | 0 | 0 | 110 | S366 Y445 F446 Y449 G559 I561 L565 F566 I567 | S366-I563 WeakPolarHBondContact OG-CG1 3.4Å; Y445-I563 HydrophobicContact CD1-CD1 3.52Å; Y445-I563 HydrophobicContact CD1-CG1 3.65Å; Y445-I563 HydrophobicContact CD1-CG2 4.11Å; Y445-I563 HydrophobicContact CE1-CD1 3.73Å; Y445-I563 HydrophobicContact CE1-CG1 3.77Å; Y445-I563 HydrophobicContact CG-CD1 3.98Å; F446-I563 HydrophobicContact CB-CG2 4.1Å; Y449-I563 HydrophobicContact CD1-CD1 4.01Å; Y449-I563 HydrophobicContact CD2-CD1 3.58Å; Y449-I563 HydrophobicContact CE1-CD1 4.1Å; Y449-I563 HydrophobicContact CE2-CD1 3.69Å; Y449-I563 HydrophobicContact CG-CD1 3.73Å; G559-I563 WeakPolarHBondContact O-CD1 3.24Å; G559-I563 VanDerWaalsContact O-CG1 3.24Å; G559-I563 WeakPolarHBondContact O-CG1 3.4Å; G559-I563 PolarHBondContact O-N 2.76Å; I561-I563 PolarHBondContact O-N 3.27Å; I563-L565 PolarHBondContact O-N 3.38Å; I563-F566 PolarHBondContact O-N 3.45Å; I563-I567 HydrophobicContact CG1-CD1 4.25Å; I563-I567 HydrophobicContact CG2-CB 4.46Å; I563-I567 PolarHBondContact O-N 2.95Å; I563-I567 VanDerWaalsContact O-N 3.14Å |
| 564 | A | 88.8 | Confident | 90 | Very high | 66 Ų | 66 | 55.1 Ų | 55.1 | 55% | 0.545 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.2 | -20.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | F446 C560 I561 | F446-A564 HydrophobicContact CD2-CB 4.08Å; F446-A564 HydrophobicContact CE2-CB 3.98Å; C560-A564 PolarHBondContact O-N 3.3Å; C560-A564 VanDerWaalsContact O-N 3.16Å; I561-A564 PolarHBondContact O-N 3.02Å |
| 565 | L | 87.6 | Confident | 89.8 | Confident | 122 Ų | 122 | 55.7 Ų | 55.7 | 64% | 0.639 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -101.8 | -26.1 | -179.6 | -67.7 | 176.6 | 0 | 0 | 0 | 114.4 | I561 F562 I563 | I561-L565 HydrophobicContact CG2-CD1 3.74Å; I561-L565 HydrophobicContact CG2-CG 4.37Å; I561-L565 WeakPolarHBondContact O-CG 3.34Å; I561-L565 PolarHBondContact O-N 2.92Å; I561-L565 VanDerWaalsContact O-N 3.1Å; F562-L565 PolarHBondContact O-N 2.99Å; I563-L565 PolarHBondContact O-N 3.38Å |
| 566 | F | 83.4 | Confident | 89.6 | Confident | 114 Ų | 114 | 55.8 Ų | 55.8 | 50% | 0.5 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -131.9 | -2.3 | -164.7 | -62.5 | -70.4 | 0 | 0 | 0 | 116.2 | C362 F562 I563 | C362-F566 HydrophobicContact CB-CB 4.17Å; C362-F566 WeakPolarHBondContact CB-O 3.06Å; F562-F566 HydrophobicContact CD1-CB 4.27Å; F562-F566 HydrophobicContact CD1-CD2 4.21Å; F562-F566 AromaticContact CD2-CD2 3.52Å; F562-F566 HydrophobicContact CD2-CD2 3.52Å; F562-F566 AromaticContact CD2-CE2 3.89Å; F562-F566 HydrophobicContact CD2-CE2 3.89Å; F562-F566 HydrophobicContact CE1-CB 3.87Å; F562-F566 HydrophobicContact CE1-CD2 4.18Å; F562-F566 HydrophobicContact CE1-CG 4.35Å; F562-F566 AromaticContact CE2-CD2 3.51Å; F562-F566 HydrophobicContact CE2-CD2 3.51Å; F562-F566 AromaticContact CE2-CE2 3.9Å; F562-F566 HydrophobicContact CE2-CE2 3.9Å; F562-F566 HydrophobicContact CE2-CG 4.17Å; F562-F566 AromaticContact CG-CD2 3.88Å; F562-F566 HydrophobicContact CG-CD2 3.88Å; F562-F566 HydrophobicContact CZ-CB 4.02Å; F562-F566 AromaticContact CZ-CD2 3.85Å; F562-F566 HydrophobicContact CZ-CD2 3.85Å; F562-F566 HydrophobicContact CZ-CG 4.08Å; F562-F566 WeakPolarHBondContact O-CB 3.29Å; F562-F566 WeakPolarHBondContact O-CD2 3.46Å; F562-F566 PolarHBondContact O-N 2.84Å; I563-F566 PolarHBondContact O-N 3.45Å |
| 567 | I | 77.8 | Confident | 89.2 | Confident | 34 Ų | 34 | 60.9 Ų | 60.9 | 17% | 0.174 | 32% | 0.324 | C | S | . | . | trans | -122.4 | 0 | -178.8 | -63.2 | -176.4 | 0 | 0 | 0 | 111.1 | C362 L363 K442 Y445 L489 I563 | C362-I567 HydrophobicContact CB-CG1 4.18Å; L363-I567 HydrophobicContact CD1-CD1 4.32Å; K442-I567 WeakPolarHBondContact CD-OXT 3.48Å; K442-I567 WeakPolarHBondContact CE-O 3.32Å; K442-I567 HydrophobicContact CG-CG2 4.34Å; K442-I567 PolarHBondContact NZ-O 2.83Å; Y445-I567 HydrophobicContact CD1-CD1 4.34Å; Y445-I567 HydrophobicContact CE1-CD1 3.95Å; L489-I567 HydrophobicContact CD1-CG2 4.41Å; I563-I567 HydrophobicContact CG1-CD1 4.25Å; I563-I567 HydrophobicContact CG2-CB 4.46Å; I563-I567 PolarHBondContact O-N 2.95Å; I563-I567 VanDerWaalsContact O-N 3.14Å |
Retrieved 567 of 567 residues in 224.5 ms
(Link to these results)