| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 37.8 | Very low | 34.1 | Very low | 240 Ų | 240 | 114.5 Ų | 114.5 | 100% | 1.182 | 84% | 0.835 | S | S | * | * | 0 | 93.6 | 0 | -80.2 | 171.1 | 164.2 | 0 | 0 | 106.2 | |||||
| 2 | A | 31.1 | Very low | 33.9 | Very low | 81 Ų | 81 | 124.6 Ų | 124.6 | 67% | 0.669 | 84% | 0.839 | S | S | * | * | 73 | 96.4 | 85 | 0 | 0 | 0 | 0 | 0 | 110 | |||||
| 3 | T | 33.2 | Very low | 33.6 | Very low | 128 Ų | 128 | 127.4 Ų | 127.4 | 79% | 0.785 | 84% | 0.841 | S | S | * | * | 78.4 | 126.7 | 104.1 | 56.1 | 0 | 0 | 0 | 0 | 111.5 | |||||
| 4 | T | 34.5 | Very low | 33.3 | Very low | 136 Ų | 136 | 123.8 Ų | 123.8 | 83% | 0.834 | 84% | 0.837 | S | S | * | * | 167.7 | 168 | 71.6 | 36.4 | 0 | 0 | 0 | 0 | 105.4 | |||||
| 5 | A | 33.1 | Very low | 33 | Very low | 94 Ų | 94 | 122.9 Ų | 122.9 | 78% | 0.777 | 84% | 0.843 | S | S | * | * | cis | -178.4 | 158.6 | -16.5 | 0 | 0 | 0 | 0 | 0 | 104.5 | ||||
| 6 | A | 33 | Very low | 33 | Very low | 92 Ų | 92 | 119.5 Ų | 119.5 | 76% | 0.76 | 83% | 0.834 | S | S | * | * | trans | -75.4 | -156.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 7 | P | 53.8 | Low | 33.4 | Very low | 123 Ų | 123 | 119.6 Ų | 119.6 | 80% | 0.799 | 83% | 0.831 | S | S | * | * | cis | -136.4 | -176.2 | -24.8 | 30 | -7.8 | 0 | 0 | 0 | 113.1 | ||||
| 8 | A | 31.3 | Very low | 33.3 | Very low | 99 Ų | 99 | 123.8 Ų | 123.8 | 82% | 0.818 | 84% | 0.835 | S | S | * | * | 140.1 | 128.1 | 130 | 0 | 0 | 0 | 0 | 0 | 116 | |||||
| 9 | G | 27.7 | Very low | 33.3 | Very low | 85 Ų | 85 | 130.3 Ų | 130.3 | 88% | 0.876 | 84% | 0.841 | S | S | * | * | trans | 95.9 | 133 | 130.7 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 10 | G | 28 | Very low | 33.4 | Very low | 85 Ų | 85 | 126.6 Ų | 126.6 | 88% | 0.876 | 83% | 0.828 | S | S | * | * | trans | 129.9 | 99 | 146.7 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 11 | A | 31.6 | Very low | 33 | Very low | 97 Ų | 97 | 124.4 Ų | 124.4 | 80% | 0.802 | 83% | 0.828 | S | S | * | * | trans | -80.9 | 160.6 | 168.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 12 | R | 32 | Very low | 32.5 | Very low | 235 Ų | 235 | 122.7 Ų | 122.7 | 89% | 0.887 | 81% | 0.814 | S | S | * | * | trans | 101 | 119.7 | 150.5 | -70.7 | -179 | 151 | 161.4 | -5.6 | 120.8 | ||||
| 13 | N | 30.1 | Very low | 32.6 | Very low | 161 Ų | 161 | 127.4 Ų | 127.4 | 86% | 0.861 | 82% | 0.822 | S | S | * | * | trans | 80.2 | 134 | 131.4 | -87.7 | 14.7 | 0 | 0 | 0 | 123.5 | ||||
| 14 | G | 28.6 | Very low | 32.7 | Very low | 77 Ų | 77 | 129.5 Ų | 129.5 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | trans | 100.7 | 135.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 15 | A | 29.7 | Very low | 32.5 | Very low | 111 Ų | 111 | 130.9 Ų | 130.9 | 92% | 0.917 | 83% | 0.825 | S | S | * | * | cis | -169.5 | 143.9 | -1.3 | 0 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 16 | G | 32 | Very low | 32.6 | Very low | 68 Ų | 68 | 132.4 Ų | 132.4 | 70% | 0.701 | 82% | 0.819 | S | S | * | * | trans | -175.8 | 131.9 | 168.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 17 | P | 39.8 | Very low | 32.5 | Very low | 121 Ų | 121 | 136.9 Ų | 136.9 | 79% | 0.786 | 82% | 0.824 | S | S | * | * | trans | -94.8 | 135.6 | -146.6 | 1.5 | 19.1 | 0 | 0 | 0 | 113.7 | ||||
| 18 | E | 32.3 | Very low | 31.6 | Very low | 195 Ų | 195 | 138.9 Ų | 138.9 | 91% | 0.911 | 82% | 0.823 | S | S | * | * | trans | -81.4 | 117.4 | 167.7 | -58.7 | 175.6 | 145.4 | 0 | 0 | 108.7 | ||||
| 19 | W | 34.1 | Very low | 32 | Very low | 248 Ų | 248 | 139.1 Ų | 139.1 | 94% | 0.939 | 82% | 0.816 | S | S | * | * | trans | -83 | 108.6 | 164.4 | -70.9 | 92.3 | 0 | 0 | 0 | 106.2 | ||||
| 20 | G | 33.7 | Very low | 32.2 | Very low | 56 Ų | 56 | 142.8 Ų | 142.8 | 58% | 0.577 | 82% | 0.815 | S | S | * | * | 84.9 | 95.1 | 59.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | |||||
| 21 | G | 26.3 | Very low | 32.6 | Very low | 80 Ų | 80 | 143.9 Ų | 143.9 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | cis | 81.6 | 82.2 | 41.4 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 22 | F | 27.2 | Very low | 32.9 | Very low | 204 Ų | 204 | 145.3 Ų | 145.3 | 90% | 0.895 | 81% | 0.813 | S | S | * | * | trans | -123 | 103 | 175.4 | -85.6 | -84.5 | 0 | 0 | 0 | 109.3 | ||||
| 23 | E | 33.1 | Very low | 32.9 | Very low | 181 Ų | 181 | 143.2 Ų | 143.2 | 85% | 0.846 | 81% | 0.813 | S | S | * | * | trans | -134.2 | 138.1 | 153.2 | -79.4 | -173.2 | 137.1 | 0 | 0 | 109.7 | ||||
| 24 | E | 34.9 | Very low | 33.1 | Very low | 171 Ų | 171 | 139 Ų | 139 | 80% | 0.799 | 81% | 0.808 | S | S | * | * | trans | 75.4 | 101.8 | 152.3 | -68.6 | 175.4 | 152.9 | 0 | 0 | 121 | ||||
| 25 | N | 30.9 | Very low | 33.5 | Very low | 166 Ų | 166 | 139.7 Ų | 139.7 | 89% | 0.888 | 82% | 0.815 | S | S | * | * | -128.5 | 136 | 128 | -162.1 | 20 | 0 | 0 | 0 | 109.8 | |||||
| 26 | I | 35.3 | Very low | 33.8 | Very low | 126 Ų | 126 | 137.7 Ų | 137.7 | 65% | 0.646 | 81% | 0.806 | S | S | * | * | trans | -90.6 | 138 | -158.8 | -67 | 156.9 | 0 | 0 | 0 | 111.5 | ||||
| 27 | Q | 29.4 | Very low | 34.2 | Very low | 186 Ų | 186 | 139.7 Ų | 139.7 | 87% | 0.869 | 81% | 0.808 | S | S | * | * | trans | -165.9 | 108.2 | 140.5 | -159.8 | 71.5 | 50.2 | 0 | 0 | 111.3 | ||||
| 28 | E | 35.1 | Very low | 34.3 | Very low | 165 Ų | 165 | 138.3 Ų | 138.3 | 77% | 0.771 | 81% | 0.807 | S | S | * | * | trans | -68.6 | 176.8 | 170.8 | -84.2 | -125.7 | 149 | 0 | 0 | 114.3 | ||||
| 29 | P | 40.1 | Very low | 34.8 | Very low | 103 Ų | 103 | 134.8 Ų | 134.8 | 67% | 0.669 | 80% | 0.799 | S | S | * | * | cis | -132.9 | 143.7 | -7.1 | 29.9 | -10.4 | 0 | 0 | 0 | 114.5 | ||||
| 30 | L | 31.4 | Very low | 35.3 | Very low | 163 Ų | 163 | 129 Ų | 129 | 85% | 0.853 | 79% | 0.785 | S | S | * | * | trans | -165.6 | 99.9 | 139.6 | -156.2 | 60.2 | 0 | 0 | 0 | 111.2 | ||||
| 31 | S | 37 | Very low | 35.7 | Very low | 107 Ų | 107 | 132.8 Ų | 132.8 | 75% | 0.748 | 79% | 0.792 | S | S | * | * | trans | 16.7 | 105.5 | 153.9 | 58.9 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 32 | S | 37 | Very low | 36.7 | Very low | 127 Ų | 127 | 136.5 Ų | 136.5 | 89% | 0.888 | 79% | 0.79 | S | S | * | * | trans | -171.7 | 124.5 | 137.6 | 179.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 33 | Q | 33.5 | Very low | 38 | Very low | 191 Ų | 191 | 135.5 Ų | 135.5 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | trans | -80.7 | 131.8 | -164 | -173.8 | 172.1 | 23.7 | 0 | 0 | 113.4 | ||||
| 34 | G | 33 | Very low | 38.8 | Very low | 73 Ų | 73 | 134.1 Ų | 134.1 | 75% | 0.753 | 79% | 0.786 | S | S | * | * | trans | 71.9 | 109.3 | 134 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 35 | G | 37.6 | Very low | 39.2 | Very low | 91 Ų | 91 | 133.2 Ų | 133.2 | 94% | 0.938 | 78% | 0.784 | S | S | * | * | trans | -69.4 | 132.5 | 152.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 36 | G | 35.4 | Very low | 39.9 | Very low | 70 Ų | 70 | 132 Ų | 132 | 72% | 0.722 | 78% | 0.777 | S | S | * | * | trans | -170 | 129.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 110 | A38 | G36-A38 PolarHBondContact O-N 2.86Š| ||
| 37 | S | 41.7 | Very low | 40.4 | Very low | 109 Ų | 109 | 133.9 Ų | 133.9 | 76% | 0.762 | 79% | 0.789 | S | S | * | * | trans | -38.5 | 119.4 | 167.8 | 152.5 | 0 | 0 | 0 | 0 | 111.6 | V39 | S37-V39 VanDerWaalsContact C-N 3.29Å; S37-V39 PolarHBondContact O-N 3.11Å | ||
| 38 | A | 41.3 | Very low | 41.1 | Very low | 92 Ų | 92 | 130.3 Ų | 130.3 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | trans | -72.5 | 85.5 | 172 | 0 | 0 | 0 | 0 | 0 | 109.8 | G36 I40 | G36-A38 PolarHBondContact O-N 2.86Å; A38-I40 PolarHBondContact O-N 2.79Å | ||
| 39 | V | 42 | Very low | 41.6 | Very low | 121 Ų | 121 | 128.3 Ų | 128.3 | 73% | 0.733 | 78% | 0.784 | S | S | * | * | trans | -73.7 | 108.5 | 156.1 | -179.8 | 0 | 0 | 0 | 0 | 105.3 | S37 D41 | S37-V39 VanDerWaalsContact C-N 3.29Å; S37-V39 PolarHBondContact O-N 3.11Å; V39-D41 PolarHBondContact O-N 3.02Å | ||
| 40 | I | 45.7 | Very low | 42 | Very low | 128 Ų | 128 | 126.4 Ų | 126.4 | 66% | 0.656 | 78% | 0.783 | S | S | * | * | trans | -76.8 | 112.2 | 173.2 | -60.9 | 179.5 | 0 | 0 | 0 | 106.6 | A38 M42 | A38-I40 PolarHBondContact O-N 2.79Å; I40-M42 PolarHBondContact O-N 2.71Å; I40-M42 VanDerWaalsContact O-N 3.15Å | ||
| 41 | D | 40.9 | Very low | 42.8 | Very low | 134 Ų | 134 | 123.3 Ų | 123.3 | 72% | 0.717 | 78% | 0.775 | S | S | * | * | trans | -73.1 | 100.9 | 174.4 | -141.9 | -11.5 | 0 | 0 | 0 | 108.5 | V39 E43 | V39-D41 PolarHBondContact O-N 3.02Å; D41-E43 PolarHBondContact O-N 3.33Å; D41-E43 VanDerWaalsContact O-N 3.13Å | ||
| 42 | M | 49 | Very low | 43.5 | Very low | 159 Ų | 159 | 123.4 Ų | 123.4 | 78% | 0.783 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | 34.7 | -173.2 | -159.9 | 95.5 | 128.8 | 0 | 0 | 112 | I40 | I40-M42 PolarHBondContact O-N 2.71Å; I40-M42 VanDerWaalsContact O-N 3.15Å |
| 43 | E | 54.2 | Low | 43.5 | Very low | 183 Ų | 183 | 126.3 Ų | 126.3 | 86% | 0.855 | 77% | 0.773 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.2 | -5.7 | 175.9 | -136.6 | 175.9 | -162.4 | 0 | 0 | 112.5 | D41 | D41-E43 PolarHBondContact O-N 3.33Å; D41-E43 VanDerWaalsContact O-N 3.13Å |
| 44 | N | 50 | Low | 44.4 | Very low | 151 Ų | 151 | 124.4 Ų | 124.4 | 81% | 0.807 | 76% | 0.764 | S | S | * | * | trans | -137.1 | 32.6 | -178.3 | -154.4 | 87.4 | 0 | 0 | 0 | 114.1 | D46 | N44-D46 PolarHBondContact O-N 3.41Š| ||
| 45 | M | 42 | Very low | 45.1 | Very low | 152 Ų | 152 | 126.2 Ų | 126.2 | 75% | 0.749 | 76% | 0.757 | S | S | * | * | trans | -86.5 | 105.9 | 173.3 | -158 | 157.4 | 147.3 | 0 | 0 | 109.5 | ||||
| 46 | D | 45.3 | Very low | 45.8 | Very low | 141 Ų | 141 | 127.8 Ų | 127.8 | 75% | 0.754 | 74% | 0.741 | S | S | * | * | trans | -58.6 | 133.7 | -176.3 | -155.6 | -0.5 | 0 | 0 | 0 | 112.3 | N44 T48 | N44-D46 PolarHBondContact O-N 3.41Å; D46-T48 PolarHBondContact O-N 3.32Å | ||
| 47 | D | 46.9 | Very low | 46.9 | Very low | 166 Ų | 166 | 126.4 Ų | 126.4 | 89% | 0.888 | 73% | 0.727 | S | S | * | * | trans | -72 | 66 | -176.3 | -84.4 | -40.4 | 0 | 0 | 0 | 111.8 | ||||
| 48 | T | 43.7 | Very low | 47.7 | Very low | 110 Ų | 110 | 125.9 Ų | 125.9 | 68% | 0.675 | 71% | 0.713 | S | S | * | * | trans | -125 | 72 | 174.7 | -43.3 | 0 | 0 | 0 | 0 | 111.4 | D46 | D46-T48 PolarHBondContact O-N 3.32Š| ||
| 49 | S | 45.2 | Very low | 48.4 | Very low | 124 Ų | 124 | 125.8 Ų | 125.8 | 87% | 0.867 | 70% | 0.699 | S | S | * | * | trans | -164.5 | 56.9 | 160.9 | -75.5 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 50 | G | 49.1 | Very low | 49 | Very low | 63 Ų | 63 | 126.5 Ų | 126.5 | 65% | 0.649 | 69% | 0.694 | S | S | * | * | trans | -111.5 | 55.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 51 | S | 48.8 | Very low | 49.8 | Very low | 97 Ų | 97 | 126 Ų | 126 | 68% | 0.678 | 69% | 0.689 | S | S | * | * | trans | -137.8 | 29 | -171.7 | 66.4 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 52 | S | 50.6 | Low | 50.7 | Low | 110 Ų | 110 | 127 Ų | 127 | 77% | 0.769 | 68% | 0.682 | S | S | * | * | S | Bend | trans | -130 | -1.8 | 171.6 | -86.1 | 0 | 0 | 0 | 0 | 116.2 | ||
| 53 | F | 38.1 | Very low | 51.2 | Low | 187 Ų | 187 | 124 Ų | 124 | 82% | 0.82 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -106.9 | -32.5 | 176 | -172.4 | -104 | 0 | 0 | 0 | 113.3 | ||
| 54 | E | 51 | Low | 51.6 | Low | 151 Ų | 151 | 123.6 Ų | 123.6 | 71% | 0.706 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -70.6 | -36 | 175.7 | -76 | 172.7 | 133.8 | 0 | 0 | 112.2 | M56 G57 E58 | E54-M56 VanDerWaalsContact C-N 3.33Å; E54-M56 PolarHBondContact O-N 3.38Å; E54-G57 PolarHBondContact O-N 2.84Å; E54-E58 PolarHBondContact O-N 3.16Å; E54-E58 VanDerWaalsContact O-N 3.08Å |
| 55 | D | 48.2 | Very low | 51.8 | Low | 112 Ų | 112 | 121.1 Ų | 121.1 | 60% | 0.599 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -65.2 | -34.2 | -178.9 | -167.9 | 45 | 0 | 0 | 0 | 112.9 | L59 | D55-L59 PolarHBondContact O-N 2.88Å; D55-L59 VanDerWaalsContact O-N 3.15Å |
| 56 | M | 53.1 | Low | 52.4 | Low | 123 Ų | 123 | 120.7 Ų | 120.7 | 61% | 0.606 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -80.1 | -25.2 | 179 | -150.8 | 59.9 | -163.9 | 0 | 0 | 113 | E54 L59 H60 | E54-M56 VanDerWaalsContact C-N 3.33Å; E54-M56 PolarHBondContact O-N 3.38Å; M56-L59 HydrophobicContact CE-CD2 3.89Å; M56-L59 HydrophobicContact SD-CD2 4.26Å; M56-H60 PolarHBondContact O-N 2.74Å |
| 57 | G | 58 | Low | 52.7 | Low | 42 Ų | 42 | 120.5 Ų | 120.5 | 43% | 0.433 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -71.1 | -40.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | E54 H60 Q61 | E54-G57 PolarHBondContact O-N 2.84Å; G57-H60 PolarHBondContact O-N 3Å; G57-Q61 WeakPolarHBondContact O-CB 3.45Å; G57-Q61 PolarHBondContact O-N 3.3Å |
| 58 | E | 58.3 | Low | 53.1 | Low | 98 Ų | 98 | 116.5 Ų | 116.5 | 46% | 0.458 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.4 | -37.8 | 178.2 | -157.2 | -178.3 | 167.7 | 0 | 0 | 112 | E54 Q61 R62 | E54-E58 PolarHBondContact O-N 3.16Å; E54-E58 VanDerWaalsContact O-N 3.08Å; E58-Q61 PolarHBondContact O-N 3.41Å; E58-R62 WeakPolarHBondContact O-CG 3.13Å; E58-R62 PolarHBondContact O-N 3.27Å; E58-R62 IonicContact OE1-CZ 3.72Å; E58-R62 IonicContact OE1-NE 3.48Å; E58-R62 IonicContact OE1-NH2 3.63Å; E58-R62 PolarHBondContact OE1-NH2 3.28Å |
| 59 | L | 56.1 | Low | 53.5 | Low | 90 Ų | 90 | 116.7 Ų | 116.7 | 47% | 0.471 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -64.4 | -41.1 | 175.2 | -160 | 95.9 | 0 | 0 | 0 | 112.4 | D55 M56 Q61 R62 L63 | D55-L59 PolarHBondContact O-N 2.88Å; D55-L59 VanDerWaalsContact O-N 3.15Å; M56-L59 HydrophobicContact CE-CD2 3.89Å; M56-L59 HydrophobicContact SD-CD2 4.26Å; L59-Q61 VanDerWaalsContact C-N 3.33Å; L59-R62 PolarHBondContact O-N 3.48Å; L59-L63 HydrophobicContact CD2-CD1 4.47Å; L59-L63 WeakPolarHBondContact O-CG 3.15Å; L59-L63 PolarHBondContact O-N 2.91Å; L59-L63 VanDerWaalsContact O-N 3.08Å |
| 60 | H | 55.3 | Low | 53.9 | Low | 136 Ų | 136 | 114 Ų | 114 | 63% | 0.63 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -71.8 | -30.3 | 178.3 | -156.1 | 79 | 0 | 0 | 0 | 112 | M56 G57 R64 | M56-H60 PolarHBondContact O-N 2.74Å; G57-H60 PolarHBondContact O-N 3Å; H60-R64 WeakPolarHBondContact O-CB 3.23Å; H60-R64 PolarHBondContact O-N 2.86Å |
| 61 | Q | 61.3 | Low | 53.8 | Low | 117 Ų | 117 | 116.4 Ų | 116.4 | 55% | 0.547 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -72.7 | -39.5 | 174.8 | -173 | 156.8 | -12.3 | 0 | 0 | 112 | G57 E58 L59 R64 E65 | G57-Q61 WeakPolarHBondContact O-CB 3.45Å; G57-Q61 PolarHBondContact O-N 3.3Å; E58-Q61 PolarHBondContact O-N 3.41Å; L59-Q61 VanDerWaalsContact C-N 3.33Å; Q61-R64 PolarHBondContact O-N 3.44Å; Q61-E65 WeakPolarHBondContact CG-OE1 3.32Å; Q61-E65 PolarHBondContact NE2-OE1 3.25Å; Q61-E65 WeakPolarHBondContact O-CB 3.27Å; Q61-E65 VanDerWaalsContact O-CG 3.32Å; Q61-E65 WeakPolarHBondContact O-CG 3.42Å; Q61-E65 PolarHBondContact O-N 3.19Å |
| 62 | R | 61.1 | Low | 53.8 | Low | 155 Ų | 155 | 114.1 Ų | 114.1 | 59% | 0.585 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -67.3 | -40.8 | 174.6 | -72.3 | -175.9 | -172.3 | 170.1 | 5.7 | 113.3 | E58 L59 R64 E65 E66 | E58-R62 WeakPolarHBondContact O-CG 3.13Å; E58-R62 PolarHBondContact O-N 3.27Å; E58-R62 IonicContact OE1-CZ 3.72Å; E58-R62 IonicContact OE1-NE 3.48Å; E58-R62 IonicContact OE1-NH2 3.63Å; E58-R62 PolarHBondContact OE1-NH2 3.28Å; L59-R62 PolarHBondContact O-N 3.48Å; R62-R64 VanDerWaalsContact C-N 3.28Å; R62-R64 PolarHBondContact O-N 3.11Å; R62-E65 PolarHBondContact O-N 2.83Å; R62-E66 WeakPolarHBondContact O-CB 3.35Å; R62-E66 PolarHBondContact O-N 3.5Å |
| 63 | L | 59 | Low | 53.8 | Low | 96 Ų | 96 | 112.5 Ų | 112.5 | 50% | 0.503 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -63.4 | -36.5 | 174.6 | -78.5 | 165.4 | 0 | 0 | 0 | 111.8 | L59 E67 | L59-L63 HydrophobicContact CD2-CD1 4.47Å; L59-L63 WeakPolarHBondContact O-CG 3.15Å; L59-L63 PolarHBondContact O-N 2.91Å; L59-L63 VanDerWaalsContact O-N 3.08Å; L63-E67 VanDerWaalsContact O-CB 3.31Å; L63-E67 WeakPolarHBondContact O-CB 2.96Å; L63-E67 PolarHBondContact O-N 3.21Å |
| 64 | R | 61.8 | Low | 54 | Low | 175 Ų | 175 | 110 Ų | 110 | 66% | 0.66 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -72.5 | -36.2 | 176.1 | -172.1 | 178.2 | -177 | -178.2 | 1.7 | 112.5 | H60 Q61 R62 V68 | H60-R64 WeakPolarHBondContact O-CB 3.23Å; H60-R64 PolarHBondContact O-N 2.86Å; Q61-R64 PolarHBondContact O-N 3.44Å; R62-R64 VanDerWaalsContact C-N 3.28Å; R62-R64 PolarHBondContact O-N 3.11Å; R64-V68 HydrophobicContact CG-CG2 4.46Å; R64-V68 VanDerWaalsContact O-CB 3.3Å; R64-V68 WeakPolarHBondContact O-CB 3.37Å; R64-V68 WeakPolarHBondContact O-CG2 3.31Å; R64-V68 PolarHBondContact O-N 3.33Å |
| 65 | E | 54.7 | Low | 53.8 | Low | 99 Ų | 99 | 106 Ų | 106 | 46% | 0.463 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.5 | -39.4 | 174.8 | -74.5 | 169 | -172.6 | 0 | 0 | 110.8 | Q61 R62 V68 D69 | Q61-E65 WeakPolarHBondContact CG-OE1 3.32Å; Q61-E65 PolarHBondContact NE2-OE1 3.25Å; Q61-E65 WeakPolarHBondContact O-CB 3.27Å; Q61-E65 VanDerWaalsContact O-CG 3.32Å; Q61-E65 WeakPolarHBondContact O-CG 3.42Å; Q61-E65 PolarHBondContact O-N 3.19Å; R62-E65 PolarHBondContact O-N 2.83Å; E65-V68 PolarHBondContact O-N 2.87Å; E65-D69 PolarHBondContact O-N 3.49Å |
| 66 | E | 54.7 | Low | 53.6 | Low | 142 Ų | 142 | 104.9 Ų | 104.9 | 66% | 0.664 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -69 | -35.1 | 176.2 | -163.7 | 174.3 | -172 | 0 | 0 | 113 | R62 A70 | R62-E66 WeakPolarHBondContact O-CB 3.35Å; R62-E66 PolarHBondContact O-N 3.5Å; E66-A70 PolarHBondContact O-N 2.89Å |
| 67 | E | 53 | Low | 53.3 | Low | 137 Ų | 137 | 103.5 Ų | 103.5 | 64% | 0.64 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -71.9 | -34.6 | 174.2 | -160.1 | 171.9 | -151.2 | 0 | 0 | 111.7 | L63 D71 | L63-E67 VanDerWaalsContact O-CB 3.31Å; L63-E67 WeakPolarHBondContact O-CB 2.96Å; L63-E67 PolarHBondContact O-N 3.21Å; E67-D71 PolarHBondContact O-N 3.14Å |
| 68 | V | 54.3 | Low | 52.7 | Low | 82 Ų | 82 | 105.2 Ų | 105.2 | 50% | 0.497 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -74.2 | -33.9 | 177.2 | 170 | 0 | 0 | 0 | 0 | 112.3 | R64 E65 A72 | R64-V68 HydrophobicContact CG-CG2 4.46Å; R64-V68 VanDerWaalsContact O-CB 3.3Å; R64-V68 WeakPolarHBondContact O-CB 3.37Å; R64-V68 WeakPolarHBondContact O-CG2 3.31Å; R64-V68 PolarHBondContact O-N 3.33Å; E65-V68 PolarHBondContact O-N 2.87Å; V68-A72 WeakPolarHBondContact O-CB 3.31Å; V68-A72 PolarHBondContact O-N 3.23Å |
| 69 | D | 52.2 | Low | 51.9 | Low | 114 Ų | 114 | 109.5 Ų | 109.5 | 61% | 0.61 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -73.7 | -31 | 176 | -74 | -29.5 | 0 | 0 | 0 | 112.3 | E65 A73 | E65-D69 PolarHBondContact O-N 3.49Å; D69-A73 PolarHBondContact O-N 3.35Å |
| 70 | A | 52.8 | Low | 51.3 | Low | 67 Ų | 67 | 114.5 Ų | 114.5 | 55% | 0.554 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70 | -41.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | E66 | E66-A70 PolarHBondContact O-N 2.89Å |
| 71 | D | 47.5 | Very low | 50.6 | Low | 114 Ų | 114 | 116.3 Ų | 116.3 | 61% | 0.61 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -73 | -31.3 | 174.4 | -95.1 | -35 | 0 | 0 | 0 | 112.5 | E67 D74 A75 | E67-D71 PolarHBondContact O-N 3.14Å; D71-D74 PolarHBondContact O-N 3.5Å; D71-A75 VanDerWaalsContact O-CB 3.25Å; D71-A75 WeakPolarHBondContact O-CB 3.2Å; D71-A75 PolarHBondContact O-N 2.7Å |
| 72 | A | 49.2 | Very low | 49.3 | Very low | 50 Ų | 50 | 117.9 Ų | 117.9 | 41% | 0.413 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -71 | -30.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | V68 A76 | V68-A72 WeakPolarHBondContact O-CB 3.31Å; V68-A72 PolarHBondContact O-N 3.23Å; A72-A76 VanDerWaalsContact O-CB 3.3Å; A72-A76 WeakPolarHBondContact O-CB 3.34Å; A72-A76 PolarHBondContact O-N 3.22Å; A72-A76 VanDerWaalsContact O-N 3.08Å |
| 73 | A | 49.8 | Very low | 48.3 | Very low | 76 Ų | 76 | 114.1 Ų | 114.1 | 63% | 0.628 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -70.7 | -32.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | D69 | D69-A73 PolarHBondContact O-N 3.35Å |
| 74 | D | 43.6 | Very low | 47.8 | Very low | 134 Ų | 134 | 119 Ų | 119 | 72% | 0.717 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -82.2 | -30.9 | 176.9 | -147.9 | 22.9 | 0 | 0 | 0 | 111.7 | D71 | D71-D74 PolarHBondContact O-N 3.5Å |
| 75 | A | 46.8 | Very low | 46.8 | Very low | 68 Ų | 68 | 116.5 Ų | 116.5 | 56% | 0.562 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -79.7 | -25.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | D71 A77 A78 | D71-A75 VanDerWaalsContact O-CB 3.25Å; D71-A75 WeakPolarHBondContact O-CB 3.2Å; D71-A75 PolarHBondContact O-N 2.7Å; A75-A77 PolarHBondContact O-N 3.11Å; A75-A78 PolarHBondContact O-N 3.09Å |
| 76 | A | 43.8 | Very low | 46.7 | Very low | 88 Ų | 88 | 120.5 Ų | 120.5 | 73% | 0.727 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.2 | -9.1 | 179.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | A72 | A72-A76 VanDerWaalsContact O-CB 3.3Å; A72-A76 WeakPolarHBondContact O-CB 3.34Å; A72-A76 PolarHBondContact O-N 3.22Å; A72-A76 VanDerWaalsContact O-N 3.08Å |
| 77 | A | 45.6 | Very low | 46.5 | Very low | 94 Ų | 94 | 116.9 Ų | 116.9 | 78% | 0.777 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.2 | -4.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.2 | A75 | A75-A77 PolarHBondContact O-N 3.11Š|
| 78 | A | 46.7 | Very low | 46.3 | Very low | 77 Ų | 77 | 116.9 Ų | 116.9 | 64% | 0.636 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -116.1 | -15.5 | -162.1 | 0 | 0 | 0 | 0 | 0 | 118 | A75 | A75-A78 PolarHBondContact O-N 3.09Š|
| 79 | E | 39.8 | Very low | 46.3 | Very low | 188 Ų | 188 | 120.5 Ų | 120.5 | 88% | 0.879 | 71% | 0.709 | S | S | * | * | trans | -140.4 | 77.5 | -172.8 | -67.5 | -164.8 | 165.8 | 0 | 0 | 113.7 | ||||
| 80 | E | 44.4 | Very low | 46.5 | Very low | 196 Ų | 196 | 117.2 Ų | 117.2 | 92% | 0.916 | 70% | 0.702 | S | S | * | * | trans | -84.2 | 109.8 | 142.9 | -86.5 | -168.8 | 149.8 | 0 | 0 | 107.5 | ||||
| 81 | E | 40 | Very low | 46.6 | Very low | 173 Ų | 173 | 120.9 Ų | 120.9 | 81% | 0.808 | 71% | 0.705 | S | S | * | * | trans | 161.9 | 141.8 | 134 | -89.6 | -173.4 | 157 | 0 | 0 | 112 | ||||
| 82 | D | 35.3 | Very low | 47.1 | Very low | 151 Ų | 151 | 123.4 Ų | 123.4 | 81% | 0.807 | 71% | 0.711 | S | S | * | * | trans | 91.1 | 98.8 | 154.8 | -53.6 | -19.8 | 0 | 0 | 0 | 121.8 | ||||
| 83 | G | 38.4 | Very low | 47.8 | Very low | 75 Ų | 75 | 122.5 Ų | 122.5 | 77% | 0.773 | 71% | 0.706 | S | S | * | * | 91.4 | 93.7 | 107.9 | 0 | 0 | 0 | 0 | 0 | 120.1 | |||||
| 84 | E | 49.1 | Very low | 48.4 | Very low | 199 Ų | 199 | 125.1 Ų | 125.1 | 93% | 0.93 | 71% | 0.706 | S | S | * | * | trans | 44.9 | 78.6 | 136.8 | -153.4 | 178 | 135 | 0 | 0 | 119.7 | ||||
| 85 | F | 40.4 | Very low | 49.5 | Very low | 123 Ų | 123 | 122.7 Ų | 122.7 | 54% | 0.539 | 69% | 0.692 | S | S | . | * | trans | -155.1 | 63.8 | 156.6 | -170.2 | -108 | 0 | 0 | 0 | 112.4 | M88 K89 | F85-M88 HydrophobicContact CE1-CB 4.44Å; F85-M88 HydrophobicContact CE2-CB 4.41Å; F85-M88 HydrophobicContact CE2-CE 4.31Å; F85-M88 HydrophobicContact CZ-CB 3.85Å; F85-M88 HydrophobicContact CZ-CE 4.23Å; F85-K89 HydrophobicContact CD1-CD 4.43Å; F85-K89 HydrophobicContact CE1-CG 4.29Å | ||
| 86 | L | 52.6 | Low | 50.3 | Low | 182 Ų | 182 | 122.6 Ų | 122.6 | 95% | 0.953 | 69% | 0.688 | S | S | * | * | trans | -115.5 | 41.8 | -172.8 | -85.7 | 166.7 | 0 | 0 | 0 | 114.3 | ||||
| 87 | G | 50.8 | Low | 51.4 | Low | 66 Ų | 66 | 127.5 Ų | 127.5 | 68% | 0.68 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -125.9 | -36.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 88 | M | 50 | Low | 52.6 | Low | 137 Ų | 137 | 129.4 Ų | 129.4 | 68% | 0.675 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -103 | -16.3 | -167.1 | -132 | 138.3 | 65.1 | 0 | 0 | 114.3 | F85 | F85-M88 HydrophobicContact CE1-CB 4.44Å; F85-M88 HydrophobicContact CE2-CB 4.41Å; F85-M88 HydrophobicContact CE2-CE 4.31Å; F85-M88 HydrophobicContact CZ-CB 3.85Å; F85-M88 HydrophobicContact CZ-CE 4.23Å |
| 89 | K | 53.2 | Low | 53.8 | Low | 158 Ų | 158 | 128.9 Ų | 128.9 | 69% | 0.687 | 67% | 0.669 | S | S | * | * | H | α-helix | trans | -75.1 | -33.4 | 176.5 | -105.5 | 175.3 | 175.4 | 174.4 | 0 | 113 | F85 G93 | F85-K89 HydrophobicContact CD1-CD 4.43Å; F85-K89 HydrophobicContact CE1-CG 4.29Å; K89-G93 PolarHBondContact O-N 3.46Å |
| 90 | G | 56.9 | Low | 55.2 | Low | 45 Ų | 45 | 122.4 Ų | 122.4 | 46% | 0.464 | 65% | 0.647 | S | S | . | * | H | α-helix | trans | -67.1 | -43.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | G93 Q94 | G90-G93 PolarHBondContact O-N 2.67Å; G90-Q94 WeakPolarHBondContact O-CG 3.27Å; G90-Q94 PolarHBondContact O-N 3.48Å |
| 91 | F | 54.8 | Low | 56.3 | Low | 144 Ų | 144 | 117.6 Ų | 117.6 | 63% | 0.632 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -66.6 | -42 | 178.9 | -170.8 | -104.3 | 0 | 0 | 0 | 112.3 | G93 Q94 L95 | F91-G93 VanDerWaalsContact C-N 3.33Å; F91-G93 PolarHBondContact O-N 3.43Å; F91-Q94 PolarHBondContact O-N 2.92Å; F91-L95 HydrophobicContact CD1-CD1 4.39Å; F91-L95 HydrophobicContact CE1-CD1 3.68Å; F91-L95 HydrophobicContact CZ-CD1 3.84Å; F91-L95 VanDerWaalsContact O-CB 3.27Å; F91-L95 WeakPolarHBondContact O-CB 3.4Å; F91-L95 PolarHBondContact O-N 3.48Å |
| 92 | K | 57.3 | Low | 57.9 | Low | 168 Ų | 168 | 116.3 Ų | 116.3 | 73% | 0.73 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -66.1 | -36.1 | 175 | -166.2 | 176.2 | 179 | -176.6 | 0 | 111.8 | S96 | K92-S96 VanDerWaalsContact O-CB 3.22Å; K92-S96 WeakPolarHBondContact O-CB 3.33Å; K92-S96 PolarHBondContact O-N 3.13Å; K92-S96 PolarHBondContact O-OG 2.89Å |
| 93 | G | 64.3 | Low | 59.4 | Low | 30 Ų | 30 | 115.5 Ų | 115.5 | 31% | 0.309 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -65.6 | -46.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | K89 G90 F91 S96 R97 | K89-G93 PolarHBondContact O-N 3.46Å; G90-G93 PolarHBondContact O-N 2.67Å; F91-G93 VanDerWaalsContact C-N 3.33Å; F91-G93 PolarHBondContact O-N 3.43Å; G93-S96 PolarHBondContact O-N 2.94Å; G93-S96 PolarHBondContact O-OG 3.02Å; G93-R97 WeakPolarHBondContact O-CG 3.34Å; G93-R97 PolarHBondContact O-N 3.11Å |
| 94 | Q | 62.3 | Low | 60.8 | Low | 132 Ų | 132 | 121 Ų | 121 | 62% | 0.617 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.1 | -39.8 | 178.4 | -72.2 | 179.4 | -71.2 | 0 | 0 | 112.7 | G90 F91 R97 Q98 | G90-Q94 WeakPolarHBondContact O-CG 3.27Å; G90-Q94 PolarHBondContact O-N 3.48Å; F91-Q94 PolarHBondContact O-N 2.92Å; Q94-R97 PolarHBondContact O-N 2.95Å; Q94-Q98 PolarHBondContact O-N 2.76Å |
| 95 | L | 67.3 | Low | 61.8 | Low | 82 Ų | 82 | 116.1 Ų | 116.1 | 43% | 0.429 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -69 | -36.4 | 177.5 | -147.5 | 150.4 | 0 | 0 | 0 | 110.9 | F91 Q98 V99 | F91-L95 HydrophobicContact CD1-CD1 4.39Å; F91-L95 HydrophobicContact CE1-CD1 3.68Å; F91-L95 HydrophobicContact CZ-CD1 3.84Å; F91-L95 VanDerWaalsContact O-CB 3.27Å; F91-L95 WeakPolarHBondContact O-CB 3.4Å; F91-L95 PolarHBondContact O-N 3.48Å; L95-Q98 PolarHBondContact O-N 3.28Å; L95-V99 HydrophobicContact CD2-CG2 4.08Å; L95-V99 WeakPolarHBondContact O-CB 3.48Å; L95-V99 VanDerWaalsContact O-CG2 3.25Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 3.42Å |
| 96 | S | 63.2 | Low | 63.2 | Low | 67 Ų | 67 | 112.8 Ų | 112.8 | 47% | 0.469 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -66.3 | -36.6 | 172.6 | 73 | 0 | 0 | 0 | 0 | 113.2 | K92 G93 A100 | K92-S96 VanDerWaalsContact O-CB 3.22Å; K92-S96 WeakPolarHBondContact O-CB 3.33Å; K92-S96 PolarHBondContact O-N 3.13Å; K92-S96 PolarHBondContact O-OG 2.89Å; G93-S96 PolarHBondContact O-N 2.94Å; G93-S96 PolarHBondContact O-OG 3.02Å; S96-A100 WeakPolarHBondContact O-CB 3.36Å; S96-A100 PolarHBondContact O-N 3.44Å |
| 97 | R | 67 | Low | 63.7 | Low | 190 Ų | 190 | 105.9 Ų | 105.9 | 72% | 0.717 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.8 | -44.1 | 174 | -79.4 | 179.5 | 170.8 | -177.9 | -3 | 111.6 | G93 Q94 A100 D101 | G93-R97 WeakPolarHBondContact O-CG 3.34Å; G93-R97 PolarHBondContact O-N 3.11Å; Q94-R97 PolarHBondContact O-N 2.95Å; R97-A100 PolarHBondContact O-N 2.87Å; R97-D101 WeakPolarHBondContact O-CB 3.23Å; R97-D101 PolarHBondContact O-N 3.28Å |
| 98 | Q | 71.4 | Confident | 64.6 | Low | 135 Ų | 135 | 109.9 Ų | 109.9 | 63% | 0.631 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.8 | -39.9 | 176.2 | -77.8 | 179.6 | -40.2 | 0 | 0 | 112.8 | Q94 L95 Q102 | Q94-Q98 PolarHBondContact O-N 2.76Å; L95-Q98 PolarHBondContact O-N 3.28Å; Q98-Q102 VanDerWaalsContact O-CB 3.32Å; Q98-Q102 WeakPolarHBondContact O-CB 3.28Å; Q98-Q102 PolarHBondContact O-N 2.86Å |
| 99 | V | 71.1 | Confident | 65.3 | Low | 65 Ų | 65 | 110.6 Ų | 110.6 | 39% | 0.394 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.3 | -40.2 | 175.1 | 172.3 | 0 | 0 | 0 | 0 | 111 | L95 Q102 M103 | L95-V99 HydrophobicContact CD2-CG2 4.08Å; L95-V99 WeakPolarHBondContact O-CB 3.48Å; L95-V99 VanDerWaalsContact O-CG2 3.25Å; L95-V99 WeakPolarHBondContact O-CG2 3.49Å; L95-V99 PolarHBondContact O-N 3.42Å; V99-Q102 PolarHBondContact O-N 3.1Å; V99-M103 HydrophobicContact CG1-CG 4.35Å; V99-M103 HydrophobicContact CG1-SD 3.89Å; V99-M103 WeakPolarHBondContact O-CB 3.36Å; V99-M103 VanDerWaalsContact O-CG 3.25Å; V99-M103 WeakPolarHBondContact O-CG 3.35Å; V99-M103 PolarHBondContact O-N 3.16Å |
| 100 | A | 68.5 | Low | 65.7 | Low | 52 Ų | 52 | 110.1 Ų | 110.1 | 43% | 0.43 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -43.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S96 R97 M103 W104 | S96-A100 WeakPolarHBondContact O-CB 3.36Å; S96-A100 PolarHBondContact O-N 3.44Å; R97-A100 PolarHBondContact O-N 2.87Å; A100-M103 PolarHBondContact O-N 3.47Å; A100-W104 WeakPolarHBondContact O-CB 3.44Å; A100-W104 PolarHBondContact O-N 2.92Å |
| 101 | D | 69.1 | Low | 65.6 | Low | 96 Ų | 96 | 110.7 Ų | 110.7 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.4 | -39.4 | 176 | -76.7 | -24.5 | 0 | 0 | 0 | 111.8 | R97 W104 Q105 | R97-D101 WeakPolarHBondContact O-CB 3.23Å; R97-D101 PolarHBondContact O-N 3.28Å; D101-W104 PolarHBondContact O-N 3.21Å; D101-Q105 VanDerWaalsContact O-CB 3.31Å; D101-Q105 WeakPolarHBondContact O-CB 3.36Å; D101-Q105 WeakPolarHBondContact O-CG 3.35Å; D101-Q105 PolarHBondContact O-N 3.29Å |
| 102 | Q | 73.4 | Confident | 65.7 | Low | 145 Ų | 145 | 107 Ų | 107 | 68% | 0.678 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -67.8 | -39.8 | 176.4 | -170 | 174.4 | -5.5 | 0 | 0 | 111.8 | Q98 V99 A106 | Q98-Q102 VanDerWaalsContact O-CB 3.32Å; Q98-Q102 WeakPolarHBondContact O-CB 3.28Å; Q98-Q102 PolarHBondContact O-N 2.86Å; V99-Q102 PolarHBondContact O-N 3.1Å; Q102-A106 VanDerWaalsContact O-CB 3.25Å; Q102-A106 WeakPolarHBondContact O-CB 3.33Å; Q102-A106 PolarHBondContact O-N 2.95Å |
| 103 | M | 65.3 | Low | 65.7 | Low | 134 Ų | 134 | 107.3 Ų | 107.3 | 66% | 0.66 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -69.2 | -37.4 | 173.8 | -73 | 178.2 | 70.4 | 0 | 0 | 112 | V99 A100 A106 G107 | V99-M103 HydrophobicContact CG1-CG 4.35Å; V99-M103 HydrophobicContact CG1-SD 3.89Å; V99-M103 WeakPolarHBondContact O-CB 3.36Å; V99-M103 VanDerWaalsContact O-CG 3.25Å; V99-M103 WeakPolarHBondContact O-CG 3.35Å; V99-M103 PolarHBondContact O-N 3.16Å; A100-M103 PolarHBondContact O-N 3.47Å; M103-A106 PolarHBondContact O-N 3.06Å; M103-G107 PolarHBondContact O-N 3.15Å |
| 104 | W | 69.2 | Low | 65.4 | Low | 190 Ų | 190 | 108.3 Ų | 108.3 | 72% | 0.72 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -66.9 | -42.4 | 175.9 | -176.4 | -103.9 | 0 | 0 | 0 | 111.4 | A100 D101 G107 K108 | A100-W104 WeakPolarHBondContact O-CB 3.44Å; A100-W104 PolarHBondContact O-N 2.92Å; D101-W104 PolarHBondContact O-N 3.21Å; W104-G107 PolarHBondContact O-N 3.03Å; W104-K108 VanDerWaalsContact O-CB 3.3Å; W104-K108 WeakPolarHBondContact O-CB 2.91Å; W104-K108 PolarHBondContact O-N 3.21Å |
| 105 | Q | 70.7 | Confident | 65 | Low | 97 Ų | 97 | 109.6 Ų | 109.6 | 45% | 0.453 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -69.1 | -36 | 173.7 | -71.9 | -178.6 | 20.6 | 0 | 0 | 112.1 | D101 K108 R109 | D101-Q105 VanDerWaalsContact O-CB 3.31Å; D101-Q105 WeakPolarHBondContact O-CB 3.36Å; D101-Q105 WeakPolarHBondContact O-CG 3.35Å; D101-Q105 PolarHBondContact O-N 3.29Å; Q105-K108 PolarHBondContact O-N 3.1Å; Q105-R109 WeakPolarHBondContact O-CB 3.02Å; Q105-R109 VanDerWaalsContact O-CG 3.23Å; Q105-R109 WeakPolarHBondContact O-CG 3.45Å; Q105-R109 PolarHBondContact O-N 3.36Å |
| 106 | A | 69.1 | Low | 64.5 | Low | 53 Ų | 53 | 109.3 Ų | 109.3 | 44% | 0.438 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -64.9 | -40.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q102 M103 R109 Q110 | Q102-A106 VanDerWaalsContact O-CB 3.25Å; Q102-A106 WeakPolarHBondContact O-CB 3.33Å; Q102-A106 PolarHBondContact O-N 2.95Å; M103-A106 PolarHBondContact O-N 3.06Å; A106-R109 PolarHBondContact O-N 3.38Å; A106-Q110 WeakPolarHBondContact O-CB 3.39Å; A106-Q110 PolarHBondContact O-N 3.34Å |
| 107 | G | 63.8 | Low | 64 | Low | 37 Ų | 37 | 112.3 Ų | 112.3 | 38% | 0.381 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -64.4 | -44.3 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | M103 W104 R109 Q110 A111 | M103-G107 PolarHBondContact O-N 3.15Å; W104-G107 PolarHBondContact O-N 3.03Å; G107-R109 VanDerWaalsContact C-N 3.31Å; G107-R109 PolarHBondContact O-N 3.48Å; G107-Q110 PolarHBondContact O-N 2.99Å; G107-A111 VanDerWaalsContact O-CB 3.27Å; G107-A111 WeakPolarHBondContact O-CB 3.42Å; G107-A111 PolarHBondContact O-N 2.89Å |
| 108 | K | 67.9 | Low | 63 | Low | 150 Ų | 150 | 112.1 Ų | 112.1 | 65% | 0.652 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.8 | -35.4 | 175.2 | -168.8 | 170.2 | -178.3 | 171.8 | 0 | 111.8 | W104 Q105 S112 | W104-K108 VanDerWaalsContact O-CB 3.3Å; W104-K108 WeakPolarHBondContact O-CB 2.91Å; W104-K108 PolarHBondContact O-N 3.21Å; Q105-K108 PolarHBondContact O-N 3.1Å; K108-S112 VanDerWaalsContact O-CB 3.26Å; K108-S112 WeakPolarHBondContact O-CB 3.46Å; K108-S112 PolarHBondContact O-N 2.75Å; K108-S112 PolarHBondContact O-OG 3.21Å |
| 109 | R | 65.8 | Low | 61.9 | Low | 152 Ų | 152 | 108.7 Ų | 108.7 | 57% | 0.574 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -74.4 | -33.7 | 173.9 | -74.3 | 173.8 | -177.2 | 146.8 | 4 | 113.1 | Q105 A106 G107 S112 R113 | Q105-R109 WeakPolarHBondContact O-CB 3.02Å; Q105-R109 VanDerWaalsContact O-CG 3.23Å; Q105-R109 WeakPolarHBondContact O-CG 3.45Å; Q105-R109 PolarHBondContact O-N 3.36Å; A106-R109 PolarHBondContact O-N 3.38Å; G107-R109 VanDerWaalsContact C-N 3.31Å; G107-R109 PolarHBondContact O-N 3.48Å; R109-S112 WeakPolarHBondContact CA-OG 3.23Å; R109-S112 PolarHBondContact O-OG 2.81Å; R109-R113 WeakPolarHBondContact O-CB 3.07Å; R109-R113 VanDerWaalsContact O-CG 3.29Å; R109-R113 WeakPolarHBondContact O-CG 3.37Å; R109-R113 PolarHBondContact O-N 2.97Å |
| 110 | Q | 61.6 | Low | 61 | Low | 148 Ų | 148 | 109.8 Ų | 109.8 | 69% | 0.692 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -72.2 | -39.3 | 173.9 | -174.3 | 170 | -20.2 | 0 | 0 | 111.1 | A106 G107 R113 A114 | A106-Q110 WeakPolarHBondContact O-CB 3.39Å; A106-Q110 PolarHBondContact O-N 3.34Å; G107-Q110 PolarHBondContact O-N 2.99Å; Q110-R113 PolarHBondContact O-N 3.42Å; Q110-A114 WeakPolarHBondContact O-CB 3.37Å; Q110-A114 PolarHBondContact O-N 3.46Å |
| 111 | A | 55.1 | Low | 60.4 | Low | 58 Ų | 58 | 113.1 Ų | 113.1 | 48% | 0.479 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.8 | -42.8 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | G107 R113 A114 F115 | G107-A111 VanDerWaalsContact O-CB 3.27Å; G107-A111 WeakPolarHBondContact O-CB 3.42Å; G107-A111 PolarHBondContact O-N 2.89Å; A111-R113 VanDerWaalsContact C-N 3.35Å; A111-R113 PolarHBondContact O-N 3.44Å; A111-A114 CarbonylContact O-C 3.59Å; A111-A114 PolarHBondContact O-N 2.9Å; A111-F115 VanDerWaalsContact O-CB 3.27Å; A111-F115 WeakPolarHBondContact O-CB 3.07Å; A111-F115 PolarHBondContact O-N 3.48Å |
| 112 | S | 56.8 | Low | 59.5 | Low | 65 Ų | 65 | 113.2 Ų | 113.2 | 46% | 0.455 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -68.9 | -31 | 176.7 | 74.9 | 0 | 0 | 0 | 0 | 113 | K108 R109 F115 S116 | K108-S112 VanDerWaalsContact O-CB 3.26Å; K108-S112 WeakPolarHBondContact O-CB 3.46Å; K108-S112 PolarHBondContact O-N 2.75Å; K108-S112 PolarHBondContact O-OG 3.21Å; R109-S112 WeakPolarHBondContact CA-OG 3.23Å; R109-S112 PolarHBondContact O-OG 2.81Å; S112-F115 PolarHBondContact O-N 3.12Å; S112-S116 VanDerWaalsContact O-CB 3.3Å; S112-S116 WeakPolarHBondContact O-CB 3.14Å; S112-S116 PolarHBondContact O-N 3.19Å; S112-S116 PolarHBondContact O-OG 3.13Å |
| 113 | R | 57.3 | Low | 58.7 | Low | 176 Ų | 176 | 111.2 Ų | 111.2 | 66% | 0.664 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -70.6 | -38 | 169.4 | -76.6 | -178.2 | -166.3 | 170.7 | 4.2 | 112.7 | R109 Q110 A111 F115 S116 L117 | R109-R113 WeakPolarHBondContact O-CB 3.07Å; R109-R113 VanDerWaalsContact O-CG 3.29Å; R109-R113 WeakPolarHBondContact O-CG 3.37Å; R109-R113 PolarHBondContact O-N 2.97Å; Q110-R113 PolarHBondContact O-N 3.42Å; A111-R113 VanDerWaalsContact C-N 3.35Å; A111-R113 PolarHBondContact O-N 3.44Å; R113-F115 VanDerWaalsContact C-N 3.3Å; R113-S116 WeakPolarHBondContact CA-OG 3.3Å; R113-S116 PolarHBondContact O-OG 3.27Å; R113-L117 VanDerWaalsContact O-CB 3.29Å; R113-L117 WeakPolarHBondContact O-CB 3.17Å; R113-L117 WeakPolarHBondContact O-CG 3.36Å; R113-L117 PolarHBondContact O-N 3.47Å |
| 114 | A | 56.8 | Low | 58.3 | Low | 51 Ų | 51 | 108.1 Ų | 108.1 | 42% | 0.421 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -66.2 | -37.1 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q110 A111 Y118 | Q110-A114 WeakPolarHBondContact O-CB 3.37Å; Q110-A114 PolarHBondContact O-N 3.46Å; A111-A114 CarbonylContact O-C 3.59Å; A111-A114 PolarHBondContact O-N 2.9Å; A114-Y118 WeakPolarHBondContact O-CB 3.49Å; A114-Y118 WeakPolarHBondContact O-CD2 3.33Å; A114-Y118 PolarHBondContact O-N 3.37Å |
| 115 | F | 54.1 | Low | 58.1 | Low | 159 Ų | 159 | 106.8 Ų | 106.8 | 70% | 0.697 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -72.2 | -36.9 | 176 | -147 | -90.4 | 0 | 0 | 0 | 112.1 | A111 S112 R113 Y118 A119 | A111-F115 VanDerWaalsContact O-CB 3.27Å; A111-F115 WeakPolarHBondContact O-CB 3.07Å; A111-F115 PolarHBondContact O-N 3.48Å; S112-F115 PolarHBondContact O-N 3.12Å; R113-F115 VanDerWaalsContact C-N 3.3Å; F115-Y118 CarbonylContact O-C 3.52Å; F115-Y118 PolarHBondContact O-N 3.21Å; F115-A119 VanDerWaalsContact O-CB 3.27Å; F115-A119 WeakPolarHBondContact O-CB 3.39Å; F115-A119 PolarHBondContact O-N 2.75Å |
| 116 | S | 57 | Low | 57.9 | Low | 75 Ų | 75 | 106.3 Ų | 106.3 | 52% | 0.524 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -74.9 | -28.9 | 174.8 | 70.5 | 0 | 0 | 0 | 0 | 112.8 | S112 R113 | S112-S116 VanDerWaalsContact O-CB 3.3Å; S112-S116 WeakPolarHBondContact O-CB 3.14Å; S112-S116 PolarHBondContact O-N 3.19Å; S112-S116 PolarHBondContact O-OG 3.13Å; R113-S116 WeakPolarHBondContact CA-OG 3.3Å; R113-S116 PolarHBondContact O-OG 3.27Å |
| 117 | L | 54.1 | Low | 57.6 | Low | 131 Ų | 131 | 108 Ų | 108 | 69% | 0.686 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -69.4 | -34 | 166 | -86.4 | 159.7 | 0 | 0 | 0 | 112.2 | R113 N120 | R113-L117 VanDerWaalsContact O-CB 3.29Å; R113-L117 WeakPolarHBondContact O-CB 3.17Å; R113-L117 WeakPolarHBondContact O-CG 3.36Å; R113-L117 PolarHBondContact O-N 3.47Å; L117-N120 WeakPolarHBondContact O-CB 3.29Å |
| 118 | Y | 44.7 | Very low | 57.7 | Low | 185 Ų | 185 | 109.6 Ų | 109.6 | 73% | 0.725 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -76.4 | -28.9 | 172.8 | -104.5 | -93.3 | 0 | 0 | 0 | 113.3 | A114 F115 N120 | A114-Y118 WeakPolarHBondContact O-CB 3.49Å; A114-Y118 WeakPolarHBondContact O-CD2 3.33Å; A114-Y118 PolarHBondContact O-N 3.37Å; F115-Y118 CarbonylContact O-C 3.52Å; F115-Y118 PolarHBondContact O-N 3.21Å; Y118-N120 PolarHBondContact O-N 2.92Å |
| 119 | A | 48.8 | Very low | 57.8 | Low | 64 Ų | 64 | 109 Ų | 109 | 53% | 0.529 | 55% | 0.549 | S | S | . | . | S | Bend | trans | -72.6 | -5.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | F115 I121 | F115-A119 VanDerWaalsContact O-CB 3.27Å; F115-A119 WeakPolarHBondContact O-CB 3.39Å; F115-A119 PolarHBondContact O-N 2.75Å; A119-I121 PolarHBondContact O-N 3.33Å |
| 120 | N | 52.7 | Low | 58.1 | Low | 87 Ų | 87 | 102.9 Ų | 102.9 | 47% | 0.465 | 53% | 0.528 | S | S | . | . | trans | -76.1 | 56 | 163.7 | -159.1 | 38.5 | 0 | 0 | 0 | 110.3 | L117 Y118 D122 I123 | L117-N120 WeakPolarHBondContact O-CB 3.29Å; Y118-N120 PolarHBondContact O-N 2.92Å; N120-D122 PolarHBondContact O-N 3.46Å; N120-I123 WeakPolarHBondContact O-CG2 3.46Å; N120-I123 PolarHBondContact O-N 3.12Å | ||
| 121 | I | 54.9 | Low | 58.8 | Low | 123 Ų | 123 | 101.3 Ų | 101.3 | 63% | 0.631 | 52% | 0.521 | S | S | * | . | G | 310 helix | trans | -57.1 | -20.6 | -177.3 | -62.3 | 172 | 0 | 0 | 0 | 111.5 | A119 I123 L124 R125 | A119-I121 PolarHBondContact O-N 3.33Å; I121-I123 VanDerWaalsContact C-N 3.27Å; I121-I123 PolarHBondContact O-N 3.35Å; I121-L124 PolarHBondContact O-N 3.33Å; I121-R125 PolarHBondContact O-N 3.49Å |
| 122 | D | 50.7 | Low | 59.7 | Low | 98 Ų | 98 | 102.7 Ų | 102.7 | 52% | 0.524 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -69 | -14.4 | 172.7 | -88.4 | -25.6 | 0 | 0 | 0 | 114.8 | N120 R125 P126 | N120-D122 PolarHBondContact O-N 3.46Å; D122-R125 WeakPolarHBondContact OD1-CD 3.27Å; D122-R125 IonicContact OD1-CZ 2.69Å; D122-R125 IonicContact OD1-NE 3.96Å; D122-R125 IonicContact OD1-NH1 3.71Å; D122-R125 PolarHBondContact OD1-NH1 3.49Å; D122-P126 VanDerWaalsContact O-CD 3.27Å; D122-P126 WeakPolarHBondContact O-CD 3Å |
| 123 | I | 57.2 | Low | 60.2 | Low | 102 Ų | 102 | 101.7 Ų | 101.7 | 52% | 0.523 | 52% | 0.521 | S | S | . | . | G | 310 helix | trans | -75.1 | -29.4 | 173.4 | -157.3 | 171.3 | 0 | 0 | 0 | 112.4 | N120 I121 Y127 | N120-I123 WeakPolarHBondContact O-CG2 3.46Å; N120-I123 PolarHBondContact O-N 3.12Å; I121-I123 VanDerWaalsContact C-N 3.27Å; I121-I123 PolarHBondContact O-N 3.35Å; I123-Y127 WeakPolarHBondContact O-CD2 3.36Å; I123-Y127 WeakPolarHBondContact O-CE2 3.38Å |
| 124 | L | 56.9 | Low | 60.9 | Low | 69 Ų | 69 | 97.1 Ų | 97.1 | 36% | 0.361 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | -25.6 | -179.7 | -69 | 176 | 0 | 0 | 0 | 111.7 | I121 P126 Y127 F128 | I121-L124 PolarHBondContact O-N 3.33Å; L124-P126 VanDerWaalsContact C-CD 3.47Å; L124-P126 VanDerWaalsContact C-N 3.33Å; L124-Y127 WeakPolarHBondContact O-CA 3.38Å; L124-Y127 WeakPolarHBondContact O-CB 3.42Å; L124-Y127 PolarHBondContact O-N 3.32Å; L124-F128 HydrophobicContact CB-CD2 4Å; L124-F128 HydrophobicContact CB-CE2 3.99Å; L124-F128 VanDerWaalsContact O-CD2 3.29Å; L124-F128 WeakPolarHBondContact O-CD2 3.24Å; L124-F128 PolarHBondContact O-N 3.03Å |
| 125 | R | 63.6 | Low | 61.7 | Low | 162 Ų | 162 | 95.4 Ų | 95.4 | 61% | 0.611 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -47.4 | -45.1 | 179.4 | 178.8 | 177.3 | -96.8 | 174 | -15.5 | 113.3 | I121 D122 Y127 F128 D129 | I121-R125 PolarHBondContact O-N 3.49Å; D122-R125 WeakPolarHBondContact OD1-CD 3.27Å; D122-R125 IonicContact OD1-CZ 2.69Å; D122-R125 IonicContact OD1-NE 3.96Å; D122-R125 IonicContact OD1-NH1 3.71Å; D122-R125 PolarHBondContact OD1-NH1 3.49Å; R125-Y127 VanDerWaalsContact C-N 3.26Å; R125-Y127 PolarHBondContact O-N 2.84Å; R125-F128 PolarHBondContact O-N 3.12Å; R125-F128 VanDerWaalsContact O-N 3.14Å; R125-D129 WeakPolarHBondContact O-CB 3.25Å; R125-D129 PolarHBondContact O-N 3.46Å |
| 126 | P | 66.4 | Low | 62.8 | Low | 88 Ų | 88 | 95.4 Ų | 95.4 | 57% | 0.571 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -65.1 | -23.1 | 177.1 | -22.6 | 34.3 | 0 | 0 | 0 | 115.2 | D122 L124 | D122-P126 VanDerWaalsContact O-CD 3.27Å; D122-P126 WeakPolarHBondContact O-CD 3Å; L124-P126 VanDerWaalsContact C-CD 3.47Å; L124-P126 VanDerWaalsContact C-N 3.33Å |
| 127 | Y | 64 | Low | 63.6 | Low | 88 Ų | 88 | 94.9 Ų | 94.9 | 35% | 0.345 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -90.2 | -10 | 178 | -59.5 | -74.7 | 0 | 0 | 0 | 113 | I123 L124 R125 G157 E158 L159 Y160 L222 | I123-Y127 WeakPolarHBondContact O-CD2 3.36Å; I123-Y127 WeakPolarHBondContact O-CE2 3.38Å; L124-Y127 WeakPolarHBondContact O-CA 3.38Å; L124-Y127 WeakPolarHBondContact O-CB 3.42Å; L124-Y127 PolarHBondContact O-N 3.32Å; R125-Y127 VanDerWaalsContact C-N 3.26Å; R125-Y127 PolarHBondContact O-N 2.84Å; Y127-G157 WeakPolarHBondContact CD1-O 3.47Å; Y127-E158 WeakPolarHBondContact O-CB 3.4Å; Y127-L159 PolarHBondContact O-N 3.17Å; Y127-Y160 PolarHBondContact O-N 3.39Å; Y127-L222 HydrophobicContact CD1-CD1 4.48Å; Y127-L222 HydrophobicContact CE1-CD1 3.79Å; Y127-L222 HydrophobicContact CE2-CD1 4.31Å |
| 128 | F | 66.1 | Low | 64.6 | Low | 71 Ų | 71 | 91.9 Ų | 91.9 | 31% | 0.311 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -109.8 | -15.7 | 175.9 | -72.1 | -72.5 | 0 | 0 | 0 | 113.6 | L124 R125 V130 L159 Y160 L163 | L124-F128 HydrophobicContact CB-CD2 4Å; L124-F128 HydrophobicContact CB-CE2 3.99Å; L124-F128 VanDerWaalsContact O-CD2 3.29Å; L124-F128 WeakPolarHBondContact O-CD2 3.24Å; L124-F128 PolarHBondContact O-N 3.03Å; R125-F128 PolarHBondContact O-N 3.12Å; R125-F128 VanDerWaalsContact O-N 3.14Å; F128-V130 VanDerWaalsContact C-N 3.33Å; F128-V130 PolarHBondContact O-N 3.05Å; F128-L159 HydrophobicContact CE1-CB 3.93Å; F128-L159 HydrophobicContact CE2-CB 4.42Å; F128-L159 HydrophobicContact CZ-CB 3.78Å; F128-Y160 HydrophobicContact CD1-CD2 4.3Å; F128-L163 HydrophobicContact CE1-CD1 4.05Å; F128-L163 HydrophobicContact CZ-CD1 4.2Å |
| 129 | D | 69 | Low | 66.1 | Low | 138 Ų | 138 | 84.4 Ų | 84.4 | 74% | 0.738 | 44% | 0.435 | S | S | * | . | trans | -82.7 | 75.3 | 175.7 | -166.6 | 22.1 | 0 | 0 | 0 | 111 | R125 | R125-D129 WeakPolarHBondContact O-CB 3.25Å; R125-D129 PolarHBondContact O-N 3.46Å | ||
| 130 | V | 72.9 | Confident | 67.3 | Low | 22 Ų | 22 | 86.1 Ų | 86.1 | 13% | 0.133 | 43% | 0.434 | C | S | . | . | trans | -129.2 | 132.6 | 178.3 | -176.3 | 0 | 0 | 0 | 0 | 110 | F128 Q134 V135 E158 | F128-V130 VanDerWaalsContact C-N 3.33Å; F128-V130 PolarHBondContact O-N 3.05Å; V130-Q134 HydrophobicContact CG1-CB 4.2Å; V130-V135 HydrophobicContact CG1-CG2 3.92Å; V130-E158 HydrophobicContact CG2-CB 3.67Å; V130-E158 HydrophobicContact CG2-CG 3.93Å | ||
| 131 | E | 75.2 | Confident | 68.3 | Low | 115 Ų | 115 | 86.5 Ų | 86.5 | 54% | 0.537 | 43% | 0.434 | S | S | . | . | trans | -66.2 | 131 | 178.6 | -168.7 | 178.4 | -169.6 | 0 | 0 | 111.5 | A133 Q134 V135 | E131-A133 HydrophobicContact CG-CB 4.41Å; E131-A133 PolarHBondContact O-N 3.25Å; E131-A133 VanDerWaalsContact O-N 3.08Å; E131-Q134 HydrophobicContact CB-CG 4.1Å; E131-Q134 WeakPolarHBondContact O-CB 3.22Å; E131-Q134 PolarHBondContact O-N 3.37Å; E131-Q134 PolarHBondContact OE2-NE2 3.31Å; E131-Q134 VanDerWaalsContact OE2-NE2 3.15Å; E131-V135 PolarHBondContact O-N 3.46Å | ||
| 132 | P | 74.3 | Confident | 69 | Low | 88 Ų | 88 | 80.7 Ų | 80.7 | 57% | 0.571 | 40% | 0.404 | S | S | * | . | H | α-helix | trans | -56.5 | -30.2 | -177.2 | -28 | 34.9 | 0 | 0 | 0 | 114.6 | Q134 V135 R136 | P132-Q134 VanDerWaalsContact C-N 3.3Å; P132-Q134 PolarHBondContact O-N 3.19Å; P132-V135 WeakPolarHBondContact O-CB 3.42Å; P132-V135 PolarHBondContact O-N 3.14Å; P132-R136 PolarHBondContact O-N 2.82Å |
| 133 | A | 68.4 | Low | 69.8 | Low | 44 Ų | 44 | 78 Ų | 78 | 36% | 0.364 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.4 | -35 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | E131 S137 | E131-A133 HydrophobicContact CG-CB 4.41Å; E131-A133 PolarHBondContact O-N 3.25Å; E131-A133 VanDerWaalsContact O-N 3.08Å; A133-S137 PolarHBondContact O-N 3.32Å; A133-S137 PolarHBondContact O-OG 3.16Å |
| 134 | Q | 71.9 | Confident | 70.5 | Confident | 80 Ų | 80 | 78.2 Ų | 78.2 | 37% | 0.374 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -71.7 | -38.4 | 176 | -60.7 | 178 | 26.8 | 0 | 0 | 110.7 | V130 E131 P132 R136 S137 R138 | V130-Q134 HydrophobicContact CG1-CB 4.2Å; E131-Q134 HydrophobicContact CB-CG 4.1Å; E131-Q134 WeakPolarHBondContact O-CB 3.22Å; E131-Q134 PolarHBondContact O-N 3.37Å; E131-Q134 PolarHBondContact OE2-NE2 3.31Å; E131-Q134 VanDerWaalsContact OE2-NE2 3.15Å; P132-Q134 VanDerWaalsContact C-N 3.3Å; P132-Q134 PolarHBondContact O-N 3.19Å; Q134-R136 PolarHBondContact O-N 3.34Å; Q134-S137 PolarHBondContact O-N 2.91Å; Q134-R138 WeakPolarHBondContact O-CG 3.42Å; Q134-R138 PolarHBondContact O-N 2.79Å |
| 135 | V | 73.4 | Confident | 70.8 | Confident | 14 Ų | 14 | 77 Ų | 77 | 9% | 0.085 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -59.3 | -47.9 | 174.6 | -177 | 0 | 0 | 0 | 0 | 110.7 | V130 E131 P132 S137 R138 L139 Y160 Y230 | V130-V135 HydrophobicContact CG1-CG2 3.92Å; E131-V135 PolarHBondContact O-N 3.46Å; P132-V135 WeakPolarHBondContact O-CB 3.42Å; P132-V135 PolarHBondContact O-N 3.14Å; V135-S137 VanDerWaalsContact C-N 3.32Å; V135-S137 PolarHBondContact O-N 3.36Å; V135-R138 PolarHBondContact O-N 3.01Å; V135-R138 VanDerWaalsContact O-N 3.16Å; V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 HydrophobicContact CG1-CG 4.32Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.39Å; V135-L139 PolarHBondContact O-N 3.39Å; V135-Y160 HydrophobicContact CG2-CD1 3.89Å; V135-Y160 HydrophobicContact CG2-CE1 4.2Å; V135-Y230 HydrophobicContact CG1-CE1 4.41Å |
| 136 | R | 75.6 | Confident | 70.7 | Confident | 159 Ų | 159 | 72.7 Ų | 72.7 | 60% | 0.6 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -56.7 | -45.4 | 176.6 | -177.1 | -169.9 | 66.4 | -163.8 | -2.9 | 112.3 | P132 Q134 R138 L139 L140 | P132-R136 PolarHBondContact O-N 2.82Å; Q134-R136 PolarHBondContact O-N 3.34Å; R136-R138 VanDerWaalsContact C-N 3.28Å; R136-R138 PolarHBondContact O-N 2.86Å; R136-L139 WeakPolarHBondContact O-CB 3.45Å; R136-L139 PolarHBondContact O-N 2.89Å; R136-L140 WeakPolarHBondContact O-CG 3.5Å; R136-L140 PolarHBondContact O-N 3.47Å |
| 137 | S | 73.8 | Confident | 70 | Confident | 64 Ų | 64 | 78.3 Ų | 78.3 | 45% | 0.448 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -61.8 | -40.3 | -179.6 | -52.5 | 0 | 0 | 0 | 0 | 110.9 | A133 Q134 V135 L140 E141 | A133-S137 PolarHBondContact O-N 3.32Å; A133-S137 PolarHBondContact O-OG 3.16Å; Q134-S137 PolarHBondContact O-N 2.91Å; V135-S137 VanDerWaalsContact C-N 3.32Å; V135-S137 PolarHBondContact O-N 3.36Å; S137-L140 PolarHBondContact O-N 3.28Å; S137-E141 WeakPolarHBondContact O-CB 3.46Å; S137-E141 PolarHBondContact O-N 2.93Å |
| 138 | R | 75.6 | Confident | 69.2 | Low | 68 Ų | 68 | 79.3 Ų | 79.3 | 26% | 0.257 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -72.4 | -31.3 | 176.7 | -68.4 | 174.4 | -176.1 | 152.8 | 2 | 113.8 | Q134 V135 R136 E141 S142 E158 Y230 | Q134-R138 WeakPolarHBondContact O-CG 3.42Å; Q134-R138 PolarHBondContact O-N 2.79Å; V135-R138 PolarHBondContact O-N 3.01Å; V135-R138 VanDerWaalsContact O-N 3.16Å; R136-R138 VanDerWaalsContact C-N 3.28Å; R136-R138 PolarHBondContact O-N 2.86Å; R138-E141 CarbonylContact O-C 3.59Å; R138-E141 PolarHBondContact O-N 3.16Å; R138-S142 PolarHBondContact O-N 3.13Å; R138-E158 WeakPolarHBondContact CD-OE1 3.47Å; R138-E158 IonicContact CZ-OE1 3.49Å; R138-E158 IonicContact CZ-OE2 3.41Å; R138-E158 IonicContact NE-OE1 3.57Å; R138-E158 IonicContact NH1-OE1 2.79Å; R138-E158 PolarHBondContact NH1-OE1 3.18Å; R138-E158 IonicContact NH1-OE2 2.67Å; R138-E158 PolarHBondContact NH1-OE2 2.9Å; R138-E158 IonicContact NH2-OE2 2.66Å; R138-Y230 HydrophobicContact CB-CE1 4.32Å |
| 139 | L | 76.2 | Confident | 68.5 | Low | 28 Ų | 28 | 80.6 Ų | 80.6 | 15% | 0.147 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -64.9 | -43.1 | 172.2 | -72.8 | 170.6 | 0 | 0 | 0 | 111.6 | V135 R136 E141 S142 L165 Y230 F233 | V135-L139 HydrophobicContact CG1-CD1 4.12Å; V135-L139 HydrophobicContact CG1-CG 4.32Å; V135-L139 VanDerWaalsContact O-CG 3.3Å; V135-L139 WeakPolarHBondContact O-CG 3.39Å; V135-L139 PolarHBondContact O-N 3.39Å; R136-L139 WeakPolarHBondContact O-CB 3.45Å; R136-L139 PolarHBondContact O-N 2.89Å; L139-E141 VanDerWaalsContact C-N 3.29Å; L139-E141 PolarHBondContact O-N 3.27Å; L139-S142 PolarHBondContact O-N 2.71Å; L139-S142 PolarHBondContact O-OG 3.31Å; L139-L165 HydrophobicContact CD2-CD1 3.59Å; L139-L165 HydrophobicContact CD2-CD2 3.86Å; L139-L165 HydrophobicContact CD2-CG 4Å; L139-Y230 HydrophobicContact CD2-CD1 3.88Å; L139-Y230 HydrophobicContact CD2-CE1 4.19Å; L139-Y230 HydrophobicContact CG-CE1 4.45Å; L139-F233 HydrophobicContact CB-CD1 4.22Å; L139-F233 HydrophobicContact CB-CE1 4.16Å; L139-F233 HydrophobicContact CB-CG 4.49Å; L139-F233 HydrophobicContact CB-CZ 4.4Å; L139-F233 HydrophobicContact CD2-CB 3.91Å; L139-F233 HydrophobicContact CD2-CD1 4.3Å; L139-F233 HydrophobicContact CD2-CD2 3.93Å; L139-F233 HydrophobicContact CD2-CG 3.8Å; L139-F233 WeakPolarHBondContact O-CD1 3.47Å |
| 140 | L | 73.6 | Confident | 67.5 | Low | 100 Ų | 100 | 80.9 Ų | 80.9 | 52% | 0.524 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -66.2 | -37.1 | 175 | -67.1 | 173 | 0 | 0 | 0 | 111.2 | R136 S137 S142 M143 | R136-L140 WeakPolarHBondContact O-CG 3.5Å; R136-L140 PolarHBondContact O-N 3.47Å; S137-L140 PolarHBondContact O-N 3.28Å; L140-S142 VanDerWaalsContact C-N 3.34Å; L140-M143 PolarHBondContact O-N 3.28Å |
| 141 | E | 75.2 | Confident | 66.4 | Low | 96 Ų | 96 | 87 Ų | 87 | 45% | 0.449 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -69.3 | -28.6 | 174.9 | -164.6 | 178.7 | 175.6 | 0 | 0 | 112.8 | S137 R138 L139 M143 I144 I146 | S137-E141 WeakPolarHBondContact O-CB 3.46Å; S137-E141 PolarHBondContact O-N 2.93Å; R138-E141 CarbonylContact O-C 3.59Å; R138-E141 PolarHBondContact O-N 3.16Å; L139-E141 VanDerWaalsContact C-N 3.29Å; L139-E141 PolarHBondContact O-N 3.27Å; E141-M143 PolarHBondContact O-N 3.34Å; E141-I144 PolarHBondContact O-N 3.42Å; E141-I144 VanDerWaalsContact O-N 3.16Å; E141-I146 HydrophobicContact CG-CD1 4.19Å; E141-I146 WeakPolarHBondContact OE1-CD1 3.37Å |
| 142 | S | 69.4 | Low | 65.6 | Low | 1 Ų | 1 | 85.1 Ų | 85.1 | 1% | 0.007 | 44% | 0.437 | C | S | . | . | H | α-helix | trans | -67.6 | -21.2 | 176.3 | 78.9 | 0 | 0 | 0 | 0 | 112.7 | R138 L139 L140 Y230 | R138-S142 PolarHBondContact O-N 3.13Å; L139-S142 PolarHBondContact O-N 2.71Å; L139-S142 PolarHBondContact O-OG 3.31Å; L140-S142 VanDerWaalsContact C-N 3.34Å; S142-Y230 PolarHBondContact OG-O 3.2Å; S142-Y230 VanDerWaalsContact OG-O 3.11Å |
| 143 | M | 67.6 | Low | 64.9 | Low | 40 Ų | 40 | 82.6 Ų | 82.6 | 20% | 0.197 | 42% | 0.417 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | -8.7 | 174.2 | -67 | -171.2 | 73.8 | 0 | 0 | 114.2 | L140 E141 F233 I237 V258 L261 | L140-M143 PolarHBondContact O-N 3.28Å; E141-M143 PolarHBondContact O-N 3.34Å; M143-F233 HydrophobicContact CG-CD1 3.76Å; M143-F233 HydrophobicContact CG-CE1 3.91Å; M143-F233 HydrophobicContact SD-CD1 3.87Å; M143-F233 HydrophobicContact SD-CE1 3.46Å; M143-F233 WeakPolarHBondContact SD-CE1 3.49Å; M143-F233 HydrophobicContact SD-CZ 4.5Å; M143-I237 HydrophobicContact CE-CD1 3.96Å; M143-I237 HydrophobicContact SD-CD1 3.69Å; M143-V258 HydrophobicContact CE-CG1 3.94Å; M143-L261 WeakPolarHBondContact O-CD2 3.45Å; M143-L261 WeakPolarHBondContact O-CG 3.46Å |
| 144 | I | 70.4 | Confident | 64.6 | Low | 108 Ų | 108 | 90.1 Ų | 90.1 | 55% | 0.554 | 44% | 0.442 | S | S | * | . | S | Bend | trans | -124.3 | 112.6 | -174.6 | -57.6 | 175.2 | 0 | 0 | 0 | 110 | E141 I146 | E141-I144 PolarHBondContact O-N 3.42Å; E141-I144 VanDerWaalsContact O-N 3.16Å; I144-I146 PolarHBondContact O-N 2.99Å; I144-I146 VanDerWaalsContact O-N 3.15Å |
| 145 | P | 63.5 | Low | 64.2 | Low | 43 Ų | 43 | 86.9 Ų | 86.9 | 28% | 0.279 | 43% | 0.427 | S | S | . | . | trans | -70.8 | 112.3 | 175.7 | 27.4 | -31.5 | 0 | 0 | 0 | 110.1 | K147 L261 R265 | P145-K147 PolarHBondContact O-N 3.27Å; P145-L261 HydrophobicContact CG-CD1 3.92Å; P145-R265 HydrophobicContact CB-CB 4.43Å | ||
| 146 | I | 61.6 | Low | 63.8 | Low | 72 Ų | 72 | 87.5 Ų | 87.5 | 37% | 0.369 | 43% | 0.433 | S | S | . | . | trans | -78.2 | 123.2 | 173 | -54.4 | 176.8 | 0 | 0 | 0 | 108.4 | E141 I144 M148 Q153 | E141-I146 HydrophobicContact CG-CD1 4.19Å; E141-I146 WeakPolarHBondContact OE1-CD1 3.37Å; I144-I146 PolarHBondContact O-N 2.99Å; I144-I146 VanDerWaalsContact O-N 3.15Å; I146-M148 HydrophobicContact CG2-CE 3.95Å; I146-M148 HydrophobicContact CG2-CG 4.12Å; I146-M148 HydrophobicContact CG2-SD 4.28Å; I146-M148 PolarHBondContact O-N 2.88Å; I146-Q153 PolarHBondContact O-NE2 3.33Å | ||
| 147 | K | 51.9 | Low | 63.5 | Low | 205 Ų | 205 | 81.1 Ų | 81.1 | 89% | 0.891 | 42% | 0.417 | S | S | * | . | trans | -70.1 | 72.7 | 178.1 | -71.2 | -179.7 | 176.1 | 173.6 | 0 | 111.3 | P145 | P145-K147 PolarHBondContact O-N 3.27Š| ||
| 148 | M | 47.3 | Very low | 64 | Low | 109 Ų | 109 | 78.8 Ų | 78.8 | 54% | 0.537 | 40% | 0.399 | S | S | . | . | trans | -133.1 | 86.1 | 169.1 | -66.3 | -179.7 | -164.6 | 0 | 0 | 108.4 | I146 Q153 | I146-M148 HydrophobicContact CG2-CE 3.95Å; I146-M148 HydrophobicContact CG2-CG 4.12Å; I146-M148 HydrophobicContact CG2-SD 4.28Å; I146-M148 PolarHBondContact O-N 2.88Å; M148-Q153 PolarHBondContact O-NE2 3.11Å | ||
| 149 | V | 51.3 | Low | 64.3 | Low | 99 Ų | 99 | 76.4 Ų | 76.4 | 60% | 0.6 | 39% | 0.391 | S | S | * | . | S | Bend | trans | -85 | -12.7 | 175.8 | -78.4 | 0 | 0 | 0 | 0 | 112.8 | ||
| 150 | N | 47.6 | Very low | 64.7 | Low | 143 Ų | 143 | 78.3 Ų | 78.3 | 77% | 0.765 | 40% | 0.397 | S | S | * | . | S | Bend | trans | -95.3 | -15.9 | -175.2 | -64.6 | -18.7 | 0 | 0 | 0 | 113.5 | ||
| 151 | F | 49.9 | Very low | 65.3 | Low | 150 Ų | 150 | 73.6 Ų | 73.6 | 66% | 0.658 | 37% | 0.373 | S | S | * | . | S | Bend | trans | -121.8 | 137.5 | 177.6 | -73.3 | -77.1 | 0 | 0 | 0 | 110.8 | Q153 | F151-Q153 PolarHBondContact O-N 2.85Å; F151-Q153 VanDerWaalsContact O-N 3.11Å |
| 152 | P | 58.9 | Low | 65.9 | Low | 77 Ų | 77 | 69 Ų | 69 | 50% | 0.5 | 35% | 0.351 | S | S | . | . | trans | -62.5 | 115.1 | 177.4 | 22.1 | -29.7 | 0 | 0 | 0 | 110.1 | K154 R273 | P152-K154 PolarHBondContact O-N 3.49Å; P152-R273 VanDerWaalsContact CB-CZ 3.42Å | ||
| 153 | Q | 59.9 | Low | 66.9 | Low | 34 Ų | 34 | 70.8 Ų | 70.8 | 16% | 0.159 | 36% | 0.36 | C | S | . | . | trans | -63.2 | 137.6 | -179.7 | -62.8 | -172.6 | 14.5 | 0 | 0 | 110.4 | I146 M148 F151 I155 V269 R273 | I146-Q153 PolarHBondContact O-NE2 3.33Å; M148-Q153 PolarHBondContact O-NE2 3.11Å; F151-Q153 PolarHBondContact O-N 2.85Å; F151-Q153 VanDerWaalsContact O-N 3.11Å; Q153-I155 PolarHBondContact O-N 3.27Å; Q153-V269 HydrophobicContact CB-CG2 4.3Å; Q153-R273 PolarHBondContact O-NH2 3.15Å | ||
| 154 | K | 62.1 | Low | 67.9 | Low | 203 Ų | 203 | 72.7 Ų | 72.7 | 88% | 0.883 | 37% | 0.37 | S | S | * | . | trans | -79.6 | 108.8 | 178.5 | -169.2 | 177.4 | -179.4 | -177.5 | 0 | 108.6 | P152 | P152-K154 PolarHBondContact O-N 3.49Š| ||
| 155 | I | 63.9 | Low | 68.9 | Low | 12 Ų | 12 | 68.1 Ų | 68.1 | 6% | 0.062 | 35% | 0.346 | C | S | . | . | trans | -89.7 | 126.9 | 173.8 | -51.8 | 167.5 | 0 | 0 | 0 | 107.4 | Q153 I219 Q223 L227 V269 | Q153-I155 PolarHBondContact O-N 3.27Å; I155-I219 HydrophobicContact CD1-CD1 3.58Å; I155-I219 HydrophobicContact CD1-CG1 4.4Å; I155-Q223 HydrophobicContact CB-CB 4.37Å; I155-Q223 HydrophobicContact CB-CG 4.16Å; I155-Q223 HydrophobicContact CD1-CB 4.21Å; I155-Q223 HydrophobicContact CG2-CB 4.18Å; I155-Q223 HydrophobicContact CG2-CG 4.29Å; I155-L227 HydrophobicContact CD1-CD1 4.49Å; I155-L227 HydrophobicContact CG2-CB 4.46Å; I155-V269 HydrophobicContact CD1-CG1 3.34Å; I155-V269 HydrophobicContact CG1-CG1 3.74Å | ||
| 156 | A | 64.9 | Low | 70.4 | Confident | 26 Ų | 26 | 66 Ų | 66 | 22% | 0.215 | 33% | 0.333 | C | S | . | . | trans | -68.5 | 130.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | E158 A226 | A156-E158 VanDerWaalsContact C-N 3.33Å; A156-E158 VanDerWaalsContact CB-OE1 3.24Å; A156-E158 WeakPolarHBondContact CB-OE1 3.34Å; A156-E158 WeakPolarHBondContact CB-OE2 3.3Å; A156-A226 WeakPolarHBondContact O-CB 3.48Å | ||
| 157 | G | 69.2 | Low | 71.8 | Confident | 25 Ų | 25 | 67.4 Ų | 67.4 | 26% | 0.258 | 34% | 0.336 | S | S | . | . | trans | -89.5 | 10.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | Y127 | Y127-G157 WeakPolarHBondContact CD1-O 3.47Š| ||
| 158 | E | 83.1 | Confident | 73.7 | Confident | 15 Ų | 15 | 60.8 Ų | 60.8 | 7% | 0.07 | 31% | 0.313 | C | S | . | . | trans | -77.8 | 153.2 | -179.1 | 68.9 | -95.5 | 170.7 | 0 | 0 | 113.8 | Y127 V130 R138 A156 A226 Y230 | Y127-E158 WeakPolarHBondContact O-CB 3.4Å; V130-E158 HydrophobicContact CG2-CB 3.67Å; V130-E158 HydrophobicContact CG2-CG 3.93Å; R138-E158 WeakPolarHBondContact CD-OE1 3.47Å; R138-E158 IonicContact CZ-OE1 3.49Å; R138-E158 IonicContact CZ-OE2 3.41Å; R138-E158 IonicContact NE-OE1 3.57Å; R138-E158 IonicContact NH1-OE1 2.79Å; R138-E158 PolarHBondContact NH1-OE1 3.18Å; R138-E158 IonicContact NH1-OE2 2.67Å; R138-E158 PolarHBondContact NH1-OE2 2.9Å; R138-E158 IonicContact NH2-OE2 2.66Å; A156-E158 VanDerWaalsContact C-N 3.33Å; A156-E158 VanDerWaalsContact CB-OE1 3.24Å; A156-E158 WeakPolarHBondContact CB-OE1 3.34Å; A156-E158 WeakPolarHBondContact CB-OE2 3.3Å; E158-A226 WeakPolarHBondContact O-CB 3.5Å; E158-Y230 HydrophobicContact CG-CE2 4.45Å; E158-Y230 PolarHBondContact OE1-OH 3.07Å | ||
| 159 | L | 83.4 | Confident | 75.8 | Confident | 18 Ų | 18 | 55.6 Ų | 55.6 | 9% | 0.094 | 29% | 0.288 | C | S | . | . | S | Bend | trans | -107.8 | -15.1 | 179.9 | -91.5 | 63.8 | 0 | 0 | 0 | 113 | Y127 F128 P162 L163 L222 L225 | Y127-L159 PolarHBondContact O-N 3.17Å; F128-L159 HydrophobicContact CE1-CB 3.93Å; F128-L159 HydrophobicContact CE2-CB 4.42Å; F128-L159 HydrophobicContact CZ-CB 3.78Å; L159-P162 WeakPolarHBondContact O-CD 3.5Å; L159-L163 WeakPolarHBondContact O-CB 3.26Å; L159-L163 PolarHBondContact O-N 3.16Å; L159-L222 HydrophobicContact CD1-CD2 3.63Å; L159-L222 HydrophobicContact CD2-CD2 4.24Å; L159-L225 HydrophobicContact CD2-CD2 3.88Å; L159-L225 HydrophobicContact CG-CD2 4.19Å |
| 160 | Y | 84.8 | Confident | 77.7 | Confident | 69 Ų | 69 | 51.3 Ų | 51.3 | 27% | 0.271 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.1 | -57.5 | -178.2 | 177.8 | -102.1 | 0 | 0 | 0 | 113.5 | Y127 F128 V135 L163 M164 | Y127-Y160 PolarHBondContact O-N 3.39Å; F128-Y160 HydrophobicContact CD1-CD2 4.3Å; V135-Y160 HydrophobicContact CG2-CD1 3.89Å; V135-Y160 HydrophobicContact CG2-CE1 4.2Å; Y160-L163 PolarHBondContact O-N 2.77Å; Y160-M164 HydrophobicContact CD2-CE 4.13Å; Y160-M164 HydrophobicContact CD2-CG 4.45Å; Y160-M164 HydrophobicContact CE1-CG 4.22Å; Y160-M164 HydrophobicContact CE2-CE 3.37Å; Y160-M164 HydrophobicContact CE2-CG 4.1Å; Y160-M164 WeakPolarHBondContact O-CG 3.38Å; Y160-M164 PolarHBondContact O-N 3.34Å |
| 161 | G | 84.6 | Confident | 79.7 | Confident | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.01 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58 | -51.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L163 M164 L165 | G161-L163 VanDerWaalsContact C-N 3.32Å; G161-L163 PolarHBondContact O-N 3.12Å; G161-M164 PolarHBondContact O-N 3.15Å; G161-L165 PolarHBondContact O-N 3.3Å |
| 162 | P | 89.1 | Confident | 81.6 | Confident | 0 Ų | 0 | 40.6 Ų | 40.6 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -52 | -46.1 | 174 | -32.6 | 39.7 | 0 | 0 | 0 | 113.7 | L159 L165 V166 W201 A226 Y230 | L159-P162 WeakPolarHBondContact O-CD 3.5Å; P162-L165 WeakPolarHBondContact O-CB 3.48Å; P162-L165 PolarHBondContact O-N 3.38Å; P162-V166 WeakPolarHBondContact O-CG2 3.45Å; P162-V166 PolarHBondContact O-N 3.38Å; P162-W201 HydrophobicContact CB-CZ2 3.8Å; P162-A226 HydrophobicContact CG-CB 4.15Å; P162-Y230 HydrophobicContact CG-CD2 3.72Å; P162-Y230 HydrophobicContact CG-CE2 3.66Å; P162-Y230 HydrophobicContact CG-CG 4.26Å |
| 163 | L | 89 | Confident | 82.9 | Confident | 38 Ų | 38 | 36.9 Ų | 36.9 | 20% | 0.199 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -67 | -39.5 | -179 | -179.6 | 141.3 | 0 | 0 | 0 | 111.8 | F128 L159 Y160 G161 L165 V166 F167 W201 | F128-L163 HydrophobicContact CE1-CD1 4.05Å; F128-L163 HydrophobicContact CZ-CD1 4.2Å; L159-L163 WeakPolarHBondContact O-CB 3.26Å; L159-L163 PolarHBondContact O-N 3.16Å; Y160-L163 PolarHBondContact O-N 2.77Å; G161-L163 VanDerWaalsContact C-N 3.32Å; G161-L163 PolarHBondContact O-N 3.12Å; L163-L165 VanDerWaalsContact C-N 3.33Å; L163-L165 PolarHBondContact O-N 3.13Å; L163-V166 PolarHBondContact O-N 2.76Å; L163-F167 HydrophobicContact CD2-CD2 3.77Å; L163-F167 HydrophobicContact CD2-CE2 3.41Å; L163-F167 VanDerWaalsContact CD2-CE2 3.41Å; L163-F167 HydrophobicContact CG-CD2 4.29Å; L163-F167 HydrophobicContact CG-CE2 3.93Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.11Å; L163-F167 PolarHBondContact O-N 2.92Å; L163-F167 VanDerWaalsContact O-N 3.1Å; L163-W201 HydrophobicContact CB-CH2 4.09Å; L163-W201 HydrophobicContact CB-CZ3 4.48Å |
| 164 | M | 90.5 | Very high | 84.1 | Confident | 80 Ų | 80 | 37.2 Ų | 37.2 | 39% | 0.394 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -63.5 | -37.1 | 173.1 | -71.4 | -61.7 | 168.8 | 0 | 0 | 112.6 | Y160 G161 F167 T168 | Y160-M164 HydrophobicContact CD2-CE 4.13Å; Y160-M164 HydrophobicContact CD2-CG 4.45Å; Y160-M164 HydrophobicContact CE1-CG 4.22Å; Y160-M164 HydrophobicContact CE2-CE 3.37Å; Y160-M164 HydrophobicContact CE2-CG 4.1Å; Y160-M164 WeakPolarHBondContact O-CG 3.38Å; Y160-M164 PolarHBondContact O-N 3.34Å; G161-M164 PolarHBondContact O-N 3.15Å; M164-F167 PolarHBondContact O-N 2.92Å; M164-T168 WeakPolarHBondContact O-CB 3.4Å; M164-T168 PolarHBondContact O-N 3.49Å; M164-T168 PolarHBondContact O-OG1 3.14Å |
| 165 | L | 91.3 | Very high | 85.1 | Confident | 11 Ų | 11 | 31.3 Ų | 31.3 | 6% | 0.058 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -66.2 | -41 | 175.2 | -73.6 | 176.1 | 0 | 0 | 0 | 112.6 | L139 G161 P162 L163 F167 T168 L169 G229 Y230 F233 | L139-L165 HydrophobicContact CD2-CD1 3.59Å; L139-L165 HydrophobicContact CD2-CD2 3.86Å; L139-L165 HydrophobicContact CD2-CG 4Å; G161-L165 PolarHBondContact O-N 3.3Å; P162-L165 WeakPolarHBondContact O-CB 3.48Å; P162-L165 PolarHBondContact O-N 3.38Å; L163-L165 VanDerWaalsContact C-N 3.33Å; L163-L165 PolarHBondContact O-N 3.13Å; L165-F167 VanDerWaalsContact C-N 3.32Å; L165-F167 PolarHBondContact O-N 3.41Å; L165-T168 WeakPolarHBondContact O-CB 3.23Å; L165-T168 PolarHBondContact O-N 2.91Å; L165-L169 WeakPolarHBondContact O-CB 3.38Å; L165-L169 PolarHBondContact O-N 3.27Å; L165-G229 WeakPolarHBondContact CD1-O 3.34Å; L165-Y230 HydrophobicContact CD1-CD1 4.25Å; L165-F233 HydrophobicContact CD1-CB 3.84Å; L165-F233 HydrophobicContact CD2-CB 3.99Å; L165-F233 HydrophobicContact CD2-CD2 3.73Å; L165-F233 HydrophobicContact CD2-CG 4.31Å |
| 166 | V | 93.1 | Very high | 85.7 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -60.7 | -44.6 | 176 | 174.2 | 0 | 0 | 0 | 0 | 110.2 | P162 L163 T168 L169 V170 C197 F198 W201 L232 | P162-V166 WeakPolarHBondContact O-CG2 3.45Å; P162-V166 PolarHBondContact O-N 3.38Å; L163-V166 PolarHBondContact O-N 2.76Å; V166-T168 PolarHBondContact O-N 3.33Å; V166-L169 WeakPolarHBondContact O-CB 3.39Å; V166-L169 PolarHBondContact O-N 2.88Å; V166-V170 WeakPolarHBondContact O-CG2 3.42Å; V166-V170 PolarHBondContact O-N 2.99Å; V166-C197 HydrophobicContact CG1-CB 4Å; V166-F198 HydrophobicContact CG1-CD1 4.19Å; V166-F198 HydrophobicContact CG1-CD2 3.65Å; V166-F198 HydrophobicContact CG1-CE1 4.15Å; V166-F198 HydrophobicContact CG1-CE2 3.6Å; V166-F198 HydrophobicContact CG1-CG 3.96Å; V166-F198 HydrophobicContact CG1-CZ 3.86Å; V166-W201 HydrophobicContact CB-CE3 4.5Å; V166-W201 HydrophobicContact CG2-CB 3.99Å; V166-W201 HydrophobicContact CG2-CD2 3.73Å; V166-W201 HydrophobicContact CG2-CE3 3.77Å; V166-W201 HydrophobicContact CG2-CG 3.85Å; V166-W201 HydrophobicContact CG2-CZ3 4.47Å; V166-L232 HydrophobicContact CG2-CD1 3.72Å |
| 167 | F | 91.4 | Very high | 86 | Confident | 100 Ų | 100 | 30 Ų | 30 | 44% | 0.439 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -64.3 | -39.2 | 174.1 | -73.7 | -51 | 0 | 0 | 0 | 113.2 | L163 M164 L165 L169 V170 A171 F198 | L163-F167 HydrophobicContact CD2-CD2 3.77Å; L163-F167 HydrophobicContact CD2-CE2 3.41Å; L163-F167 VanDerWaalsContact CD2-CE2 3.41Å; L163-F167 HydrophobicContact CG-CD2 4.29Å; L163-F167 HydrophobicContact CG-CE2 3.93Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.11Å; L163-F167 PolarHBondContact O-N 2.92Å; L163-F167 VanDerWaalsContact O-N 3.1Å; M164-F167 PolarHBondContact O-N 2.92Å; L165-F167 VanDerWaalsContact C-N 3.32Å; L165-F167 PolarHBondContact O-N 3.41Å; F167-L169 VanDerWaalsContact C-N 3.29Å; F167-L169 PolarHBondContact O-N 3.49Å; F167-V170 WeakPolarHBondContact O-CB 3.4Å; F167-V170 PolarHBondContact O-N 3.23Å; F167-A171 PolarHBondContact O-N 3.2Å; F167-F198 HydrophobicContact CD1-CE2 4Å; F167-F198 HydrophobicContact CD1-CZ 4.17Å; F167-F198 AromaticContact CE1-CE2 3.62Å; F167-F198 HydrophobicContact CE1-CE2 3.62Å; F167-F198 AromaticContact CE1-CZ 3.61Å; F167-F198 HydrophobicContact CE1-CZ 3.61Å; F167-F198 HydrophobicContact CE2-CZ 4.38Å; F167-F198 HydrophobicContact CZ-CE2 4.23Å; F167-F198 AromaticContact CZ-CZ 3.73Å; F167-F198 HydrophobicContact CZ-CZ 3.73Å |
| 168 | T | 92.3 | Very high | 86 | Confident | 66 Ų | 66 | 35.9 Ų | 35.9 | 41% | 0.405 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -61.6 | -41.4 | 175.3 | -56.5 | 0 | 0 | 0 | 0 | 110.9 | M164 L165 V166 A171 I172 | M164-T168 WeakPolarHBondContact O-CB 3.4Å; M164-T168 PolarHBondContact O-N 3.49Å; M164-T168 PolarHBondContact O-OG1 3.14Å; L165-T168 WeakPolarHBondContact O-CB 3.23Å; L165-T168 PolarHBondContact O-N 2.91Å; V166-T168 PolarHBondContact O-N 3.33Å; T168-A171 WeakPolarHBondContact O-CB 3.41Å; T168-A171 PolarHBondContact O-N 2.84Å; T168-I172 HydrophobicContact CG2-CD1 4.01Å; T168-I172 VanDerWaalsContact O-CG1 3.31Å; T168-I172 WeakPolarHBondContact O-CG1 3.41Å; T168-I172 PolarHBondContact O-N 3.35Å |
| 169 | L | 90.8 | Very high | 85.1 | Confident | 0 Ų | 0 | 38.4 Ų | 38.4 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -63 | -45.3 | 176.6 | -172 | 64.4 | 0 | 0 | 0 | 111.3 | L165 V166 F167 A171 I172 L173 C197 L232 H235 L239 F294 L298 | L165-L169 WeakPolarHBondContact O-CB 3.38Å; L165-L169 PolarHBondContact O-N 3.27Å; V166-L169 WeakPolarHBondContact O-CB 3.39Å; V166-L169 PolarHBondContact O-N 2.88Å; F167-L169 VanDerWaalsContact C-N 3.29Å; F167-L169 PolarHBondContact O-N 3.49Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.12Å; L169-I172 PolarHBondContact O-N 3.38Å; L169-L173 WeakPolarHBondContact O-CG 3.32Å; L169-L173 PolarHBondContact O-N 2.89Å; L169-C197 HydrophobicContact CD2-CB 4.45Å; L169-L232 HydrophobicContact CD2-CD1 4.33Å; L169-L232 HydrophobicContact CD2-CD2 4.06Å; L169-H235 HydrophobicContact CD1-CB 4.37Å; L169-L239 HydrophobicContact CD1-CD1 3.68Å; L169-F294 HydrophobicContact CD2-CE1 4.06Å; L169-F294 HydrophobicContact CD2-CZ 4.39Å; L169-L298 HydrophobicContact CD1-CD1 4.07Å; L169-L298 HydrophobicContact CD2-CD1 4.02Å; L169-L298 HydrophobicContact CG-CD1 4.31Å |
| 170 | V | 90.9 | Very high | 83.7 | Confident | 9 Ų | 9 | 40.1 Ų | 40.1 | 6% | 0.055 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.3 | -45.4 | 172.5 | 172.5 | 0 | 0 | 0 | 0 | 110.9 | V166 F167 I172 L173 L174 A193 I194 C197 | V166-V170 WeakPolarHBondContact O-CG2 3.42Å; V166-V170 PolarHBondContact O-N 2.99Å; F167-V170 WeakPolarHBondContact O-CB 3.4Å; F167-V170 PolarHBondContact O-N 3.23Å; V170-I172 PolarHBondContact O-N 3.41Å; V170-L173 PolarHBondContact O-N 2.92Å; V170-L174 HydrophobicContact CG1-CD1 4.03Å; V170-L174 HydrophobicContact CG1-CG 4.43Å; V170-L174 WeakPolarHBondContact O-CG 3.44Å; V170-L174 PolarHBondContact O-N 2.88Å; V170-A193 HydrophobicContact CG1-CB 4.04Å; V170-I194 HydrophobicContact CG1-CG1 3.8Å; V170-I194 HydrophobicContact CG2-CG1 4.33Å; V170-C197 HydrophobicContact CG2-CB 3.59Å |
| 171 | A | 89.6 | Confident | 82.1 | Confident | 53 Ų | 53 | 44.2 Ų | 44.2 | 44% | 0.438 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.1 | -39.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | F167 T168 L169 L174 H175 | F167-A171 PolarHBondContact O-N 3.2Å; T168-A171 WeakPolarHBondContact O-CB 3.41Å; T168-A171 PolarHBondContact O-N 2.84Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.12Å; A171-L174 PolarHBondContact O-N 3.49Å; A171-H175 WeakPolarHBondContact O-CB 3.12Å; A171-H175 PolarHBondContact O-N 2.61Å |
| 172 | I | 89.7 | Confident | 80.3 | Confident | 15 Ų | 15 | 46.9 Ų | 46.9 | 8% | 0.077 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66 | -41 | 176.1 | -68.1 | 163.3 | 0 | 0 | 0 | 111 | T168 L169 V170 H175 G176 C236 L239 F240 Y243 | T168-I172 HydrophobicContact CG2-CD1 4.01Å; T168-I172 VanDerWaalsContact O-CG1 3.31Å; T168-I172 WeakPolarHBondContact O-CG1 3.41Å; T168-I172 PolarHBondContact O-N 3.35Å; L169-I172 PolarHBondContact O-N 3.38Å; V170-I172 PolarHBondContact O-N 3.41Å; I172-H175 WeakPolarHBondContact O-CB 3.43Å; I172-H175 PolarHBondContact O-N 2.82Å; I172-G176 PolarHBondContact O-N 3.26Å; I172-C236 HydrophobicContact CD1-CB 3.71Å; I172-L239 HydrophobicContact CG2-CB 3.92Å; I172-F240 HydrophobicContact CD1-CB 4.25Å; I172-F240 HydrophobicContact CG1-CD2 4.45Å; I172-Y243 HydrophobicContact CG2-CD2 3.87Å; I172-Y243 HydrophobicContact CG2-CE2 3.99Å |
| 173 | L | 87.1 | Confident | 78.3 | Confident | 0 Ų | 0 | 54.1 Ų | 54.1 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.7 | -49.2 | 174.7 | -67.9 | 179.6 | 0 | 0 | 0 | 111.1 | L169 V170 H175 G176 M177 A193 C197 L239 Y243 L298 Y302 | L169-L173 WeakPolarHBondContact O-CG 3.32Å; L169-L173 PolarHBondContact O-N 2.89Å; V170-L173 PolarHBondContact O-N 2.92Å; L173-H175 PolarHBondContact O-N 3.13Å; L173-G176 PolarHBondContact O-N 3.34Å; L173-M177 WeakPolarHBondContact O-CG 3.18Å; L173-M177 PolarHBondContact O-N 3.42Å; L173-M177 VanDerWaalsContact O-N 3.15Å; L173-A193 HydrophobicContact CB-CB 4.46Å; L173-C197 VanDerWaalsContact CD1-SG 3.53Å; L173-L239 HydrophobicContact CD2-CD1 4.35Å; L173-Y243 HydrophobicContact CD2-CE2 4.29Å; L173-Y243 WeakPolarHBondContact CD2-OH 3.33Å; L173-L298 HydrophobicContact CD1-CD2 3.88Å; L173-L298 HydrophobicContact CD2-CB 4.45Å; L173-L298 HydrophobicContact CD2-CD2 4.24Å; L173-Y302 HydrophobicContact CB-CE1 4.05Å; L173-Y302 HydrophobicContact CD1-CE1 4.48Å; L173-Y302 HydrophobicContact CD1-CE2 4.35Å; L173-Y302 HydrophobicContact CD2-CD1 4.09Å; L173-Y302 HydrophobicContact CD2-CE1 4.17Å; L173-Y302 HydrophobicContact CG-CE1 4.46Å |
| 174 | L | 84.2 | Confident | 76.6 | Confident | 41 Ų | 41 | 54.6 Ų | 54.6 | 22% | 0.215 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -58.5 | -37.8 | 175.5 | -71.7 | 174.3 | 0 | 0 | 0 | 112.4 | V170 A171 M177 K178 L189 M190 A193 | V170-L174 HydrophobicContact CG1-CD1 4.03Å; V170-L174 HydrophobicContact CG1-CG 4.43Å; V170-L174 WeakPolarHBondContact O-CG 3.44Å; V170-L174 PolarHBondContact O-N 2.88Å; A171-L174 PolarHBondContact O-N 3.49Å; L174-M177 HydrophobicContact CD2-SD 4.46Å; L174-M177 PolarHBondContact O-N 2.81Å; L174-K178 WeakPolarHBondContact O-CG 3.21Å; L174-K178 PolarHBondContact O-N 3.31Å; L174-L189 HydrophobicContact CD2-CD2 3.92Å; L174-M190 HydrophobicContact CD1-CG 4.07Å; L174-M190 HydrophobicContact CD2-CB 4.22Å; L174-M190 HydrophobicContact CD2-CG 4.4Å; L174-A193 HydrophobicContact CD2-CB 4.42Å; L174-A193 HydrophobicContact CG-CB 4.47Å |
| 175 | H | 83.3 | Confident | 74.8 | Confident | 78 Ų | 78 | 61.6 Ų | 61.6 | 36% | 0.361 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -64.3 | -48 | 175.9 | 178.4 | 60.5 | 0 | 0 | 0 | 112 | A171 I172 L173 M177 K178 T179 | A171-H175 WeakPolarHBondContact O-CB 3.12Å; A171-H175 PolarHBondContact O-N 2.61Å; I172-H175 WeakPolarHBondContact O-CB 3.43Å; I172-H175 PolarHBondContact O-N 2.82Å; L173-H175 PolarHBondContact O-N 3.13Å; H175-M177 PolarHBondContact O-N 2.89Å; H175-K178 PolarHBondContact O-N 2.98Å; H175-K178 VanDerWaalsContact O-N 3.13Å; H175-T179 PolarHBondContact O-N 3.05Å; H175-T179 PolarHBondContact O-OG1 3.49Å |
| 176 | G | 76.9 | Confident | 73.1 | Confident | 2 Ų | 2 | 67.8 Ų | 67.8 | 2% | 0.021 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -59 | -29.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | I172 L173 T179 S180 | I172-G176 PolarHBondContact O-N 3.26Å; L173-G176 PolarHBondContact O-N 3.34Å; G176-T179 VanDerWaalsContact C-OG1 3.3Å; G176-T179 WeakPolarHBondContact CA-OG1 3.37Å; G176-T179 PolarHBondContact O-OG1 3.46Å; G176-S180 PolarHBondContact O-OG 3.04Å |
| 177 | M | 71.7 | Confident | 71.4 | Confident | 10 Ų | 10 | 70.4 Ų | 70.4 | 5% | 0.049 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -78.5 | -39.7 | 176.7 | -58.9 | 163.5 | 96.3 | 0 | 0 | 112.2 | L173 L174 H175 T179 S180 L189 Y302 V306 | L173-M177 WeakPolarHBondContact O-CG 3.18Å; L173-M177 PolarHBondContact O-N 3.42Å; L173-M177 VanDerWaalsContact O-N 3.15Å; L174-M177 HydrophobicContact CD2-SD 4.46Å; L174-M177 PolarHBondContact O-N 2.81Å; H175-M177 PolarHBondContact O-N 2.89Å; M177-T179 VanDerWaalsContact C-N 3.26Å; M177-T179 PolarHBondContact O-N 3.37Å; M177-S180 WeakPolarHBondContact O-CB 3.3Å; M177-S180 PolarHBondContact O-N 3.07Å; M177-L189 HydrophobicContact CB-CD2 4.36Å; M177-L189 HydrophobicContact CE-CD1 3.7Å; M177-L189 HydrophobicContact CE-CD2 3.07Å; M177-L189 HydrophobicContact CE-CG 3.2Å; M177-L189 HydrophobicContact CG-CD2 4.47Å; M177-L189 HydrophobicContact SD-CD2 3.29Å; M177-L189 WeakPolarHBondContact SD-CD2 3.49Å; M177-L189 HydrophobicContact SD-CG 4.13Å; M177-Y302 HydrophobicContact CE-CE1 3.88Å; M177-Y302 WeakPolarHBondContact CE-OH 3.17Å; M177-Y302 HydrophobicContact CG-CE1 4.04Å; M177-Y302 HydrophobicContact SD-CE1 3.57Å; M177-Y302 VanDerWaalsContact SD-CE1 3.57Å; M177-Y302 PolarHBondContact SD-OH 2.72Å; M177-V306 HydrophobicContact CE-CB 3.87Å; M177-V306 HydrophobicContact CE-CG1 3.26Å; M177-V306 HydrophobicContact CE-CG2 3.28Å |
| 178 | K | 69.1 | Low | 70.3 | Confident | 148 Ų | 148 | 70 Ų | 70 | 64% | 0.643 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -65.2 | -30.8 | 174.8 | -75.3 | -171.9 | 178 | -165.1 | 0 | 112.6 | L174 H175 S180 E186 | L174-K178 WeakPolarHBondContact O-CG 3.21Å; L174-K178 PolarHBondContact O-N 3.31Å; H175-K178 PolarHBondContact O-N 2.98Å; H175-K178 VanDerWaalsContact O-N 3.13Å; K178-S180 PolarHBondContact O-N 3.41Å; K178-E186 IonicContact NZ-OE1 3.44Å |
| 179 | T | 63.4 | Low | 69.2 | Low | 68 Ų | 68 | 68.5 Ų | 68.5 | 42% | 0.417 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.3 | -8 | 173.9 | 48.9 | 0 | 0 | 0 | 0 | 113.6 | H175 G176 M177 | H175-T179 PolarHBondContact O-N 3.05Å; H175-T179 PolarHBondContact O-OG1 3.49Å; G176-T179 VanDerWaalsContact C-OG1 3.3Å; G176-T179 WeakPolarHBondContact CA-OG1 3.37Å; G176-T179 PolarHBondContact O-OG1 3.46Å; M177-T179 VanDerWaalsContact C-N 3.26Å; M177-T179 PolarHBondContact O-N 3.37Å |
| 180 | S | 55.4 | Low | 68.6 | Low | 53 Ų | 53 | 73 Ų | 73 | 37% | 0.371 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.9 | 16 | -177.3 | -57.9 | 0 | 0 | 0 | 0 | 114.2 | G176 M177 K178 T182 | G176-S180 PolarHBondContact O-OG 3.04Å; M177-S180 WeakPolarHBondContact O-CB 3.3Å; M177-S180 PolarHBondContact O-N 3.07Å; K178-S180 PolarHBondContact O-N 3.41Å; S180-T182 VanDerWaalsContact C-N 3.29Å; S180-T182 PolarHBondContact O-N 3.16Å; S180-T182 VanDerWaalsContact O-N 3.17Å |
| 181 | D | 50.7 | Low | 68.1 | Low | 156 Ų | 156 | 74.5 Ų | 74.5 | 83% | 0.834 | 41% | 0.405 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.1 | 26.4 | 173.5 | -83 | -29.3 | 0 | 0 | 0 | 116.8 | ||
| 182 | T | 46.2 | Very low | 67.8 | Low | 56 Ų | 56 | 73.7 Ų | 73.7 | 34% | 0.344 | 40% | 0.395 | S | S | . | . | trans | -99.3 | 111.2 | 175.9 | 56.4 | 0 | 0 | 0 | 0 | 111.1 | S180 I184 L310 | S180-T182 VanDerWaalsContact C-N 3.29Å; S180-T182 PolarHBondContact O-N 3.16Å; S180-T182 VanDerWaalsContact O-N 3.17Å; T182-I184 PolarHBondContact O-N 3.35Å; T182-L310 HydrophobicContact CG2-CD1 3.71Å | ||
| 183 | I | 47.3 | Very low | 67.6 | Low | 153 Ų | 153 | 73 Ų | 73 | 79% | 0.785 | 39% | 0.391 | S | S | * | . | trans | -95.7 | 81.7 | -176 | -53.3 | 169.8 | 0 | 0 | 0 | 109.9 | ||||
| 184 | I | 53.1 | Low | 67.7 | Low | 48 Ų | 48 | 75.9 Ų | 75.9 | 25% | 0.246 | 41% | 0.406 | C | S | . | . | trans | -142.1 | 147.3 | 174.7 | -64 | -170.6 | 0 | 0 | 0 | 113.9 | T182 E186 L310 E314 | T182-I184 PolarHBondContact O-N 3.35Å; I184-E186 PolarHBondContact O-N 2.93Å; I184-L310 HydrophobicContact CB-CD2 3.95Å; I184-L310 HydrophobicContact CD1-CD2 4.13Å; I184-L310 HydrophobicContact CG1-CD2 4.33Å; I184-L310 HydrophobicContact CG2-CD2 4.44Å; I184-E314 HydrophobicContact CD1-CB 4.47Å; I184-E314 VanDerWaalsContact CD1-CD 3.5Å; I184-E314 HydrophobicContact CD1-CG 3.08Å; I184-E314 WeakPolarHBondContact CD1-OE1 3.14Å; I184-E314 HydrophobicContact CG1-CG 4.44Å | ||
| 185 | R | 53.9 | Low | 67.9 | Low | 227 Ų | 227 | 76 Ų | 76 | 86% | 0.857 | 42% | 0.418 | S | S | * | . | trans | -12.3 | 101.8 | 172 | -91.3 | -177.9 | 167.9 | -163.3 | -2.6 | 114.3 | G187 | R185-G187 PolarHBondContact O-N 3.32Š| ||
| 186 | E | 54.3 | Low | 68.3 | Low | 141 Ų | 141 | 73.6 Ų | 73.6 | 66% | 0.659 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63 | -15.5 | -171.4 | -58.6 | 178.2 | 133.7 | 0 | 0 | 114.9 | K178 I184 M190 | K178-E186 IonicContact NZ-OE1 3.44Å; I184-E186 PolarHBondContact O-N 2.93Å; E186-M190 WeakPolarHBondContact O-CB 3.2Å; E186-M190 PolarHBondContact O-N 3.22Å |
| 187 | G | 58.5 | Low | 69 | Low | 54 Ų | 54 | 73.5 Ų | 73.5 | 56% | 0.557 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -69.3 | -58.9 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | R185 L189 M190 G191 | R185-G187 PolarHBondContact O-N 3.32Å; G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 2.99Å; G187-M190 PolarHBondContact O-N 3.43Å; G187-G191 PolarHBondContact O-N 3.08Å |
| 188 | T | 67.4 | Low | 70 | Confident | 92 Ų | 92 | 75.2 Ų | 75.2 | 56% | 0.564 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -66.7 | -31.9 | -176.2 | -53.4 | 0 | 0 | 0 | 0 | 112.2 | G191 T192 | T188-G191 PolarHBondContact O-N 2.7Å; T188-T192 PolarHBondContact O-N 3.38Å; T188-T192 PolarHBondContact O-OG1 3.32Å |
| 189 | L | 68.8 | Low | 71.1 | Confident | 34 Ų | 34 | 70.1 Ų | 70.1 | 18% | 0.178 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -71.5 | -40.6 | -178.2 | -167.7 | 153.1 | 0 | 0 | 0 | 110.8 | L174 M177 G187 T192 A193 L310 | L174-L189 HydrophobicContact CD2-CD2 3.92Å; M177-L189 HydrophobicContact CB-CD2 4.36Å; M177-L189 HydrophobicContact CE-CD1 3.7Å; M177-L189 HydrophobicContact CE-CD2 3.07Å; M177-L189 HydrophobicContact CE-CG 3.2Å; M177-L189 HydrophobicContact CG-CD2 4.47Å; M177-L189 HydrophobicContact SD-CD2 3.29Å; M177-L189 WeakPolarHBondContact SD-CD2 3.49Å; M177-L189 HydrophobicContact SD-CG 4.13Å; G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 2.99Å; L189-T192 PolarHBondContact O-N 3.44Å; L189-A193 PolarHBondContact O-N 3.5Å; L189-L310 HydrophobicContact CD1-CD2 4.41Å |
| 190 | M | 78.5 | Confident | 72.6 | Confident | 94 Ų | 94 | 67.8 Ų | 67.8 | 46% | 0.463 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -65.9 | -42.1 | 170 | -171.1 | 177.3 | 81.2 | 0 | 0 | 112.6 | L174 E186 G187 T192 A193 I194 | L174-M190 HydrophobicContact CD1-CG 4.07Å; L174-M190 HydrophobicContact CD2-CB 4.22Å; L174-M190 HydrophobicContact CD2-CG 4.4Å; E186-M190 WeakPolarHBondContact O-CB 3.2Å; E186-M190 PolarHBondContact O-N 3.22Å; G187-M190 PolarHBondContact O-N 3.43Å; M190-T192 VanDerWaalsContact C-N 3.29Å; M190-T192 PolarHBondContact O-N 3.47Å; M190-A193 PolarHBondContact O-N 2.86Å; M190-I194 HydrophobicContact CE-CD1 4.27Å; M190-I194 HydrophobicContact CG-CD1 3.87Å; M190-I194 HydrophobicContact CG-CG1 4.46Å; M190-I194 WeakPolarHBondContact O-CG1 3.26Å; M190-I194 PolarHBondContact O-N 3.27Å |
| 191 | G | 80.3 | Confident | 74.5 | Confident | 41 Ų | 41 | 65.6 Ų | 65.6 | 42% | 0.423 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -58.9 | -39.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113 | G187 T188 I194 G195 | G187-G191 PolarHBondContact O-N 3.08Å; T188-G191 PolarHBondContact O-N 2.7Å; G191-I194 PolarHBondContact O-N 2.86Å; G191-G195 PolarHBondContact O-N 3.35Å |
| 192 | T | 83.5 | Confident | 76.6 | Confident | 37 Ų | 37 | 61.8 Ų | 61.8 | 23% | 0.227 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -68.1 | -41.8 | 177.8 | -53.7 | 0 | 0 | 0 | 0 | 111.8 | T188 L189 M190 G195 T196 Y302 | T188-T192 PolarHBondContact O-N 3.38Å; T188-T192 PolarHBondContact O-OG1 3.32Å; L189-T192 PolarHBondContact O-N 3.44Å; M190-T192 VanDerWaalsContact C-N 3.29Å; M190-T192 PolarHBondContact O-N 3.47Å; T192-G195 PolarHBondContact O-N 3.16Å; T192-T196 HydrophobicContact CG2-CG2 4.39Å; T192-T196 WeakPolarHBondContact O-CB 3.48Å; T192-T196 VanDerWaalsContact O-CG2 3.26Å; T192-T196 WeakPolarHBondContact O-CG2 3.41Å; T192-T196 PolarHBondContact O-N 3.44Å; T192-T196 PolarHBondContact O-OG1 3.14Å; T192-Y302 HydrophobicContact CG2-CE2 4.43Å |
| 193 | A | 85.6 | Confident | 78.9 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -60.9 | -46.8 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | V170 L173 L174 L189 M190 T196 C197 Y302 | V170-A193 HydrophobicContact CG1-CB 4.04Å; L173-A193 HydrophobicContact CB-CB 4.46Å; L174-A193 HydrophobicContact CD2-CB 4.42Å; L174-A193 HydrophobicContact CG-CB 4.47Å; L189-A193 PolarHBondContact O-N 3.5Å; M190-A193 PolarHBondContact O-N 2.86Å; A193-T196 PolarHBondContact O-OG1 3.32Å; A193-C197 WeakPolarHBondContact O-CB 3.13Å; A193-C197 PolarHBondContact O-N 2.87Å; A193-C197 VanDerWaalsContact O-N 3.08Å; A193-C197 PolarHBondContact O-SG 3.45Å; A193-C197 VanDerWaalsContact O-SG 3.39Å; A193-Y302 WeakPolarHBondContact CB-OH 3.21Å |
| 194 | I | 89.3 | Confident | 81.2 | Confident | 60 Ų | 60 | 54.7 Ų | 54.7 | 31% | 0.308 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.9 | -50.4 | 177.6 | -68.9 | 170.4 | 0 | 0 | 0 | 110.3 | V170 M190 G191 T196 C197 F198 | V170-I194 HydrophobicContact CG1-CG1 3.8Å; V170-I194 HydrophobicContact CG2-CG1 4.33Å; M190-I194 HydrophobicContact CE-CD1 4.27Å; M190-I194 HydrophobicContact CG-CD1 3.87Å; M190-I194 HydrophobicContact CG-CG1 4.46Å; M190-I194 WeakPolarHBondContact O-CG1 3.26Å; M190-I194 PolarHBondContact O-N 3.27Å; G191-I194 PolarHBondContact O-N 2.86Å; I194-T196 VanDerWaalsContact C-N 3.35Å; I194-T196 PolarHBondContact O-N 2.97Å; I194-C197 PolarHBondContact O-N 3.38Å; I194-F198 HydrophobicContact CG2-CD2 3.83Å; I194-F198 HydrophobicContact CG2-CE2 4.28Å; I194-F198 WeakPolarHBondContact O-CB 3.49Å; I194-F198 WeakPolarHBondContact O-CD2 3.32Å; I194-F198 PolarHBondContact O-N 2.96Å |
| 195 | G | 89.3 | Confident | 83.1 | Confident | 45 Ų | 45 | 52.4 Ų | 52.4 | 46% | 0.464 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.5 | -39.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | G191 T192 G199 | G191-G195 PolarHBondContact O-N 3.35Å; T192-G195 PolarHBondContact O-N 3.16Å; G195-G199 WeakPolarHBondContact O-CA 3.49Å; G195-G199 PolarHBondContact O-N 2.94Å |
| 196 | T | 90.7 | Very high | 85 | Confident | 27 Ų | 27 | 44.3 Ų | 44.3 | 17% | 0.166 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -69.3 | -46.3 | 177.7 | 50.5 | 0 | 0 | 0 | 0 | 112.3 | T192 A193 I194 Y200 Y297 | T192-T196 HydrophobicContact CG2-CG2 4.39Å; T192-T196 WeakPolarHBondContact O-CB 3.48Å; T192-T196 VanDerWaalsContact O-CG2 3.26Å; T192-T196 WeakPolarHBondContact O-CG2 3.41Å; T192-T196 PolarHBondContact O-N 3.44Å; T192-T196 PolarHBondContact O-OG1 3.14Å; A193-T196 PolarHBondContact O-OG1 3.32Å; I194-T196 VanDerWaalsContact C-N 3.35Å; I194-T196 PolarHBondContact O-N 2.97Å; T196-Y200 VanDerWaalsContact O-CB 3.26Å; T196-Y200 WeakPolarHBondContact O-CB 3.5Å; T196-Y200 PolarHBondContact O-N 3.4Å; T196-Y297 HydrophobicContact CG2-CE1 4.41Å |
| 197 | C | 91.6 | Very high | 87 | Confident | 0 Ų | 0 | 42.4 Ų | 42.4 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -67.9 | -49 | 179.8 | -69.5 | 0 | 0 | 0 | 0 | 112.7 | V166 L169 V170 L173 A193 I194 W201 | V166-C197 HydrophobicContact CG1-CB 4Å; L169-C197 HydrophobicContact CD2-CB 4.45Å; V170-C197 HydrophobicContact CG2-CB 3.59Å; L173-C197 VanDerWaalsContact CD1-SG 3.53Å; A193-C197 WeakPolarHBondContact O-CB 3.13Å; A193-C197 PolarHBondContact O-N 2.87Å; A193-C197 VanDerWaalsContact O-N 3.08Å; A193-C197 PolarHBondContact O-SG 3.45Å; A193-C197 VanDerWaalsContact O-SG 3.39Å; I194-C197 PolarHBondContact O-N 3.38Å; C197-W201 WeakPolarHBondContact O-CB 3.34Å; C197-W201 PolarHBondContact O-N 3.28Å |
| 198 | F | 92.8 | Very high | 88.7 | Confident | 45 Ų | 45 | 39.9 Ų | 39.9 | 20% | 0.197 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -69.8 | -38 | 176.9 | -84.3 | -88.7 | 0 | 0 | 0 | 112.1 | V166 F167 I194 W201 L202 | V166-F198 HydrophobicContact CG1-CD1 4.19Å; V166-F198 HydrophobicContact CG1-CD2 3.65Å; V166-F198 HydrophobicContact CG1-CE1 4.15Å; V166-F198 HydrophobicContact CG1-CE2 3.6Å; V166-F198 HydrophobicContact CG1-CG 3.96Å; V166-F198 HydrophobicContact CG1-CZ 3.86Å; F167-F198 HydrophobicContact CD1-CE2 4Å; F167-F198 HydrophobicContact CD1-CZ 4.17Å; F167-F198 AromaticContact CE1-CE2 3.62Å; F167-F198 HydrophobicContact CE1-CE2 3.62Å; F167-F198 AromaticContact CE1-CZ 3.61Å; F167-F198 HydrophobicContact CE1-CZ 3.61Å; F167-F198 HydrophobicContact CE2-CZ 4.38Å; F167-F198 HydrophobicContact CZ-CE2 4.23Å; F167-F198 AromaticContact CZ-CZ 3.73Å; F167-F198 HydrophobicContact CZ-CZ 3.73Å; I194-F198 HydrophobicContact CG2-CD2 3.83Å; I194-F198 HydrophobicContact CG2-CE2 4.28Å; I194-F198 WeakPolarHBondContact O-CB 3.49Å; I194-F198 WeakPolarHBondContact O-CD2 3.32Å; I194-F198 PolarHBondContact O-N 2.96Å; F198-W201 AromaticContact CD1-CE3 3.94Å; F198-W201 HydrophobicContact CD1-CE3 3.94Å; F198-W201 HydrophobicContact CD1-CZ3 4.17Å; F198-W201 HydrophobicContact CE1-CE3 4.09Å; F198-W201 AromaticContact CE1-CZ3 3.92Å; F198-W201 HydrophobicContact CE1-CZ3 3.92Å; F198-W201 PolarHBondContact O-N 3.34Å; F198-L202 WeakPolarHBondContact O-CB 3.33Å; F198-L202 WeakPolarHBondContact O-CG 3.24Å; F198-L202 PolarHBondContact O-N 3.35Å |
| 199 | G | 93.7 | Very high | 89.9 | Confident | 42 Ų | 42 | 39.9 Ų | 39.9 | 43% | 0.433 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -62.7 | -42.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | G195 G203 | G195-G199 WeakPolarHBondContact O-CA 3.49Å; G195-G199 PolarHBondContact O-N 2.94Å; G199-G203 WeakPolarHBondContact O-CA 3.34Å; G199-G203 PolarHBondContact O-N 3.02Å |
| 200 | Y | 94.8 | Very high | 91.1 | Very high | 18 Ų | 18 | 43.6 Ų | 43.6 | 7% | 0.071 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -60.8 | -53.7 | 170.6 | 172.3 | -97 | 0 | 0 | 0 | 111.2 | T196 L202 V204 L228 L232 H291 F294 | T196-Y200 VanDerWaalsContact O-CB 3.26Å; T196-Y200 WeakPolarHBondContact O-CB 3.5Å; T196-Y200 PolarHBondContact O-N 3.4Å; Y200-L202 PolarHBondContact O-N 2.83Å; Y200-V204 HydrophobicContact CD2-CB 4.25Å; Y200-V204 HydrophobicContact CD2-CG2 3.51Å; Y200-V204 HydrophobicContact CE2-CB 4.05Å; Y200-V204 HydrophobicContact CE2-CG1 4.23Å; Y200-V204 HydrophobicContact CE2-CG2 3.56Å; Y200-V204 HydrophobicContact CG-CG2 4.33Å; Y200-V204 WeakPolarHBondContact O-CB 3.39Å; Y200-V204 WeakPolarHBondContact O-CG2 3.31Å; Y200-V204 PolarHBondContact O-N 2.91Å; Y200-L228 HydrophobicContact CD1-CD2 4.46Å; Y200-L228 HydrophobicContact CE1-CD2 3.8Å; Y200-L228 HydrophobicContact CE1-CG 4.34Å; Y200-L232 HydrophobicContact CD1-CD1 4.5Å; Y200-L232 HydrophobicContact CD1-CD2 3.95Å; Y200-L232 HydrophobicContact CE1-CD2 3.61Å; Y200-L232 HydrophobicContact CE1-CG 4.35Å; Y200-H291 AromaticContact CZ-ND1 3.78Å; Y200-H291 WeakPolarHBondContact OH-CA 3.25Å; Y200-H291 PolarHBondContact OH-ND1 3.44Å; Y200-F294 VanDerWaalsContact CB-CE2 3.4Å; Y200-F294 VanDerWaalsContact CB-CZ 3.47Å; Y200-F294 AromaticContact CD1-CD1 3.6Å; Y200-F294 HydrophobicContact CD1-CD1 3.6Å; Y200-F294 HydrophobicContact CD1-CD2 4.39Å; Y200-F294 AromaticContact CD1-CE1 3.39Å; Y200-F294 HydrophobicContact CD1-CE1 3.39Å; Y200-F294 HydrophobicContact CD1-CE2 4.23Å; Y200-F294 HydrophobicContact CD1-CG 4.1Å; Y200-F294 AromaticContact CD1-CZ 3.73Å; Y200-F294 HydrophobicContact CD1-CZ 3.73Å; Y200-F294 HydrophobicContact CD2-CB 3.78Å; Y200-F294 AromaticContact CD2-CD1 3.73Å; Y200-F294 HydrophobicContact CD2-CD1 3.73Å; Y200-F294 AromaticContact CD2-CD2 3.31Å; Y200-F294 HydrophobicContact CD2-CD2 3.31Å; Y200-F294 HydrophobicContact CD2-CE1 4.08Å; Y200-F294 AromaticContact CD2-CE2 3.72Å; Y200-F294 HydrophobicContact CD2-CE2 3.72Å; Y200-F294 AromaticContact CD2-CG 3.31Å; Y200-F294 HydrophobicContact CD2-CG 3.31Å; Y200-F294 HydrophobicContact CD2-CZ 4.08Å; Y200-F294 AromaticContact CE1-CD1 3.63Å; Y200-F294 HydrophobicContact CE1-CD1 3.63Å; Y200-F294 AromaticContact CE1-CE1 3.84Å; Y200-F294 HydrophobicContact CE1-CE1 3.84Å; Y200-F294 HydrophobicContact CE1-CG 4.19Å; Y200-F294 HydrophobicContact CE2-CB 3.41Å; Y200-F294 VanDerWaalsContact CE2-CB 3.41Å; Y200-F294 AromaticContact CE2-CD1 3.73Å; Y200-F294 HydrophobicContact CE2-CD1 3.73Å; Y200-F294 AromaticContact CE2-CD2 3.9Å; Y200-F294 HydrophobicContact CE2-CD2 3.9Å; Y200-F294 HydrophobicContact CE2-CE1 4.45Å; Y200-F294 AromaticContact CE2-CG 3.4Å; Y200-F294 HydrophobicContact CE2-CG 3.4Å; Y200-F294 AromaticContact CG-CD1 3.67Å; Y200-F294 HydrophobicContact CG-CD1 3.67Å; Y200-F294 AromaticContact CG-CD2 3.6Å; Y200-F294 HydrophobicContact CG-CD2 3.6Å; Y200-F294 AromaticContact CG-CE1 3.55Å; Y200-F294 HydrophobicContact CG-CE1 3.55Å; Y200-F294 AromaticContact CG-CE2 3.49Å; Y200-F294 HydrophobicContact CG-CE2 3.49Å; Y200-F294 VanDerWaalsContact CG-CE2 3.49Å; Y200-F294 AromaticContact CG-CG 3.69Å; Y200-F294 HydrophobicContact CG-CG 3.69Å; Y200-F294 AromaticContact CG-CZ 3.45Å; Y200-F294 HydrophobicContact CG-CZ 3.45Å; Y200-F294 VanDerWaalsContact CG-CZ 3.45Å; Y200-F294 AromaticContact CZ-CD1 3.69Å; Y200-F294 AromaticContact CZ-CG 3.87Å |
| 201 | W | 95.1 | Very high | 91.8 | Very high | 8 Ų | 8 | 40.2 Ų | 40.2 | 3% | 0.03 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.3 | -52.5 | -174 | 177.1 | 42.4 | 0 | 0 | 0 | 112.3 | P162 L163 V166 C197 F198 S205 L225 | P162-W201 HydrophobicContact CB-CZ2 3.8Å; L163-W201 HydrophobicContact CB-CH2 4.09Å; L163-W201 HydrophobicContact CB-CZ3 4.48Å; V166-W201 HydrophobicContact CB-CE3 4.5Å; V166-W201 HydrophobicContact CG2-CB 3.99Å; V166-W201 HydrophobicContact CG2-CD2 3.73Å; V166-W201 HydrophobicContact CG2-CE3 3.77Å; V166-W201 HydrophobicContact CG2-CG 3.85Å; V166-W201 HydrophobicContact CG2-CZ3 4.47Å; C197-W201 WeakPolarHBondContact O-CB 3.34Å; C197-W201 PolarHBondContact O-N 3.28Å; F198-W201 AromaticContact CD1-CE3 3.94Å; F198-W201 HydrophobicContact CD1-CE3 3.94Å; F198-W201 HydrophobicContact CD1-CZ3 4.17Å; F198-W201 HydrophobicContact CE1-CE3 4.09Å; F198-W201 AromaticContact CE1-CZ3 3.92Å; F198-W201 HydrophobicContact CE1-CZ3 3.92Å; F198-W201 PolarHBondContact O-N 3.34Å; W201-S205 WeakPolarHBondContact O-CB 3.11Å; W201-S205 PolarHBondContact O-N 2.88Å; W201-S205 PolarHBondContact O-OG 3.27Å; W201-L225 HydrophobicContact CH2-CD2 4.39Å; W201-L225 HydrophobicContact CZ2-CD2 3.95Å; W201-L225 HydrophobicContact CZ2-CG 3.75Å; W201-L225 PolarHBondContact NE1-O 3.17Å |
| 202 | L | 94.4 | Very high | 92.3 | Very high | 75 Ų | 75 | 38.3 Ų | 38.3 | 39% | 0.393 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -75.2 | -42.6 | -178.9 | -60.4 | -176.7 | 0 | 0 | 0 | 111.9 | F198 Y200 S206 L225 | F198-L202 WeakPolarHBondContact O-CB 3.33Å; F198-L202 WeakPolarHBondContact O-CG 3.24Å; F198-L202 PolarHBondContact O-N 3.35Å; Y200-L202 PolarHBondContact O-N 2.83Å; L202-S206 VanDerWaalsContact O-CB 3.3Å; L202-S206 WeakPolarHBondContact O-CB 3.16Å; L202-S206 PolarHBondContact O-N 3.41Å; L202-S206 PolarHBondContact O-OG 2.97Å; L202-L225 HydrophobicContact CD2-CD1 3.81Å; L202-L225 HydrophobicContact CD2-CD2 4.22Å; L202-L225 HydrophobicContact CD2-CG 4.41Å |
| 203 | G | 94.9 | Very high | 92.6 | Very high | 40 Ų | 40 | 44.9 Ų | 44.9 | 41% | 0.412 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -67.8 | -50.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G199 S206 F207 | G199-G203 WeakPolarHBondContact O-CA 3.34Å; G199-G203 PolarHBondContact O-N 3.02Å; G203-S206 PolarHBondContact O-N 3.08Å; G203-F207 WeakPolarHBondContact O-CB 3.37Å; G203-F207 PolarHBondContact O-N 2.81Å |
| 204 | V | 94.8 | Very high | 92.9 | Very high | 20 Ų | 20 | 50 Ų | 50 | 12% | 0.121 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -69.1 | -37.7 | 179 | 177.4 | 0 | 0 | 0 | 0 | 111 | Y200 S206 F207 I208 L228 L290 | Y200-V204 HydrophobicContact CD2-CB 4.25Å; Y200-V204 HydrophobicContact CD2-CG2 3.51Å; Y200-V204 HydrophobicContact CE2-CB 4.05Å; Y200-V204 HydrophobicContact CE2-CG1 4.23Å; Y200-V204 HydrophobicContact CE2-CG2 3.56Å; Y200-V204 HydrophobicContact CG-CG2 4.33Å; Y200-V204 WeakPolarHBondContact O-CB 3.39Å; Y200-V204 WeakPolarHBondContact O-CG2 3.31Å; Y200-V204 PolarHBondContact O-N 2.91Å; V204-S206 VanDerWaalsContact C-N 3.31Å; V204-S206 PolarHBondContact O-N 2.84Å; V204-F207 PolarHBondContact O-N 3.43Å; V204-I208 HydrophobicContact CG1-CG1 3.96Å; V204-I208 WeakPolarHBondContact O-CB 3.42Å; V204-I208 VanDerWaalsContact O-CG1 3.25Å; V204-I208 WeakPolarHBondContact O-CG1 3.39Å; V204-I208 PolarHBondContact O-N 3.29Å; V204-L228 HydrophobicContact CB-CD2 3.86Å; V204-L228 HydrophobicContact CG1-CD1 4.19Å; V204-L228 HydrophobicContact CG1-CD2 3.91Å; V204-L290 HydrophobicContact CG1-CB 4.23Å; V204-L290 HydrophobicContact CG1-CD1 4.03Å |
| 205 | S | 93.8 | Very high | 92.8 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -61.4 | -41.7 | 174.2 | -61.9 | 0 | 0 | 0 | 0 | 111.8 | W201 Y209 L225 L228 | W201-S205 WeakPolarHBondContact O-CB 3.11Å; W201-S205 PolarHBondContact O-N 2.88Å; W201-S205 PolarHBondContact O-OG 3.27Å; S205-Y209 WeakPolarHBondContact O-CB 3.31Å; S205-Y209 PolarHBondContact O-N 2.96Å; S205-L225 VanDerWaalsContact CB-CD1 3.44Å; S205-L228 WeakPolarHBondContact OG-CB 3.26Å; S205-L228 WeakPolarHBondContact OG-CD2 3.49Å |
| 206 | S | 93.6 | Very high | 92.8 | Very high | 57 Ų | 57 | 51 Ų | 51 | 40% | 0.399 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -66.6 | -43.3 | 177.1 | -59 | 0 | 0 | 0 | 0 | 111.9 | L202 G203 V204 Y209 F210 | L202-S206 VanDerWaalsContact O-CB 3.3Å; L202-S206 WeakPolarHBondContact O-CB 3.16Å; L202-S206 PolarHBondContact O-N 3.41Å; L202-S206 PolarHBondContact O-OG 2.97Å; G203-S206 PolarHBondContact O-N 3.08Å; V204-S206 VanDerWaalsContact C-N 3.31Å; V204-S206 PolarHBondContact O-N 2.84Å; S206-Y209 PolarHBondContact O-N 3.41Å; S206-F210 WeakPolarHBondContact O-CB 3.24Å; S206-F210 PolarHBondContact O-N 2.94Å |
| 207 | F | 95.3 | Very high | 92.5 | Very high | 102 Ų | 102 | 50.3 Ų | 50.3 | 45% | 0.447 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -64.3 | -46 | 178.2 | 179 | -107.1 | 0 | 0 | 0 | 112.3 | G203 V204 F210 L211 L290 | G203-F207 WeakPolarHBondContact O-CB 3.37Å; G203-F207 PolarHBondContact O-N 2.81Å; V204-F207 PolarHBondContact O-N 3.43Å; F207-F210 WeakPolarHBondContact O-CB 3.33Å; F207-F210 PolarHBondContact O-N 2.91Å; F207-L211 HydrophobicContact CD1-CD1 4.07Å; F207-L211 HydrophobicContact CE1-CD1 3.46Å; F207-L211 VanDerWaalsContact CE1-CD1 3.46Å; F207-L211 HydrophobicContact CE1-CG 4.29Å; F207-L211 HydrophobicContact CZ-CD1 3.74Å; F207-L211 HydrophobicContact CZ-CG 4.24Å; F207-L211 PolarHBondContact O-N 2.85Å; F207-L290 HydrophobicContact CD1-CD1 3.78Å; F207-L290 HydrophobicContact CE1-CD1 3.93Å |
| 208 | I | 94.4 | Very high | 92 | Very high | 0 Ų | 0 | 57.6 Ų | 57.6 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -68.6 | -36.4 | 177.2 | -61.8 | -66.4 | 0 | 0 | 0 | 110.8 | V204 F210 L211 A212 M224 L283 L287 L290 | V204-I208 HydrophobicContact CG1-CG1 3.96Å; V204-I208 WeakPolarHBondContact O-CB 3.42Å; V204-I208 VanDerWaalsContact O-CG1 3.25Å; V204-I208 WeakPolarHBondContact O-CG1 3.39Å; V204-I208 PolarHBondContact O-N 3.29Å; I208-F210 VanDerWaalsContact C-N 3.32Å; I208-F210 PolarHBondContact O-N 3Å; I208-L211 HydrophobicContact CD1-CD1 4.31Å; I208-L211 PolarHBondContact O-N 2.87Å; I208-A212 VanDerWaalsContact O-CB 3.22Å; I208-A212 WeakPolarHBondContact O-CB 3.18Å; I208-A212 PolarHBondContact O-N 3.39Å; I208-M224 HydrophobicContact CB-CE 3.98Å; I208-M224 HydrophobicContact CG2-CE 3.37Å; I208-L283 HydrophobicContact CG2-CD1 4.02Å; I208-L287 HydrophobicContact CD1-CB 4.08Å; I208-L287 HydrophobicContact CD1-CD1 4.2Å; I208-L287 HydrophobicContact CG1-CD1 3.89Å; I208-L287 HydrophobicContact CG2-CD1 4.29Å; I208-L290 HydrophobicContact CD1-CD1 4.08Å |
| 209 | Y | 93.4 | Very high | 91.7 | Very high | 92 Ų | 92 | 56.1 Ų | 56.1 | 36% | 0.361 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -60.9 | -41.5 | 172.8 | 176.2 | -103.6 | 0 | 0 | 0 | 111.8 | S205 S206 A212 Y213 I219 M221 M224 | S205-Y209 WeakPolarHBondContact O-CB 3.31Å; S205-Y209 PolarHBondContact O-N 2.96Å; S206-Y209 PolarHBondContact O-N 3.41Å; Y209-A212 WeakPolarHBondContact O-CB 3.21Å; Y209-A212 PolarHBondContact O-N 3.46Å; Y209-Y213 PolarHBondContact O-N 3.27Å; Y209-I219 WeakPolarHBondContact CE2-O 3.08Å; Y209-M221 HydrophobicContact CD2-CB 4.15Å; Y209-M221 HydrophobicContact CE1-CB 4.49Å; Y209-M221 HydrophobicContact CE2-CB 4.1Å; Y209-M221 HydrophobicContact CG-CB 4.37Å; Y209-M224 HydrophobicContact CD2-CG 4.37Å |
| 210 | F | 93.6 | Very high | 91.4 | Very high | 113 Ų | 113 | 57.4 Ų | 57.4 | 50% | 0.496 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63 | -45 | 173.5 | 176.5 | -102.7 | 0 | 0 | 0 | 112.2 | S206 F207 I208 A212 Y213 L214 | S206-F210 WeakPolarHBondContact O-CB 3.24Å; S206-F210 PolarHBondContact O-N 2.94Å; F207-F210 WeakPolarHBondContact O-CB 3.33Å; F207-F210 PolarHBondContact O-N 2.91Å; I208-F210 VanDerWaalsContact C-N 3.32Å; I208-F210 PolarHBondContact O-N 3Å; F210-A212 VanDerWaalsContact C-N 3.3Å; F210-A212 PolarHBondContact O-N 3.32Å; F210-Y213 WeakPolarHBondContact O-CB 3.41Å; F210-Y213 PolarHBondContact O-N 3.36Å; F210-L214 HydrophobicContact CD1-CD1 4.19Å; F210-L214 HydrophobicContact CE1-CD1 3.58Å; F210-L214 HydrophobicContact CE1-CG 4.24Å; F210-L214 HydrophobicContact CZ-CD1 3.91Å; F210-L214 HydrophobicContact CZ-CD2 4.34Å; F210-L214 HydrophobicContact CZ-CG 4.24Å; F210-L214 PolarHBondContact O-N 2.81Å |
| 211 | L | 92.5 | Very high | 91 | Very high | 23 Ų | 23 | 59.8 Ų | 59.8 | 12% | 0.12 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -62.8 | -36.8 | 173.7 | -75.9 | 176.7 | 0 | 0 | 0 | 112.5 | F207 I208 Y213 L214 C215 L282 L283 T286 | F207-L211 HydrophobicContact CD1-CD1 4.07Å; F207-L211 HydrophobicContact CE1-CD1 3.46Å; F207-L211 VanDerWaalsContact CE1-CD1 3.46Å; F207-L211 HydrophobicContact CE1-CG 4.29Å; F207-L211 HydrophobicContact CZ-CD1 3.74Å; F207-L211 HydrophobicContact CZ-CG 4.24Å; F207-L211 PolarHBondContact O-N 2.85Å; I208-L211 HydrophobicContact CD1-CD1 4.31Å; I208-L211 PolarHBondContact O-N 2.87Å; L211-Y213 VanDerWaalsContact C-N 3.32Å; L211-L214 HydrophobicContact CD2-CD1 4.43Å; L211-L214 PolarHBondContact O-N 3.41Å; L211-C215 VanDerWaalsContact O-CB 3.31Å; L211-C215 WeakPolarHBondContact O-CB 3.31Å; L211-C215 PolarHBondContact O-N 3.38Å; L211-C215 PolarHBondContact O-SG 3.26Å; L211-L282 HydrophobicContact CD2-CD2 4.35Å; L211-L283 HydrophobicContact CB-CD1 3.77Å; L211-T286 HydrophobicContact CD1-CG2 4.3Å |
| 212 | A | 90.9 | Very high | 90.7 | Very high | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.008 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63.5 | -39.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111 | I208 Y209 F210 C215 N216 A217 I219 L283 | I208-A212 VanDerWaalsContact O-CB 3.22Å; I208-A212 WeakPolarHBondContact O-CB 3.18Å; I208-A212 PolarHBondContact O-N 3.39Å; Y209-A212 WeakPolarHBondContact O-CB 3.21Å; Y209-A212 PolarHBondContact O-N 3.46Å; F210-A212 VanDerWaalsContact C-N 3.3Å; F210-A212 PolarHBondContact O-N 3.32Å; A212-C215 CarbonylContact O-C 3.59Å; A212-C215 PolarHBondContact O-N 3.49Å; A212-N216 PolarHBondContact O-N 3.06Å; A212-N216 VanDerWaalsContact O-N 3.1Å; A212-A217 HydrophobicContact CB-CB 4Å; A212-A217 PolarHBondContact O-N 2.91Å; A212-I219 HydrophobicContact CB-CG2 3.97Å; A212-L283 HydrophobicContact CB-CD1 4.14Å; A212-L283 HydrophobicContact CB-CD2 4.22Å |
| 213 | Y | 90.8 | Very high | 90.4 | Very high | 175 Ų | 175 | 60.2 Ų | 60.2 | 69% | 0.686 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -61.1 | -46.9 | 172.2 | -179.8 | -99 | 0 | 0 | 0 | 111.7 | Y209 F210 L211 C215 N216 | Y209-Y213 PolarHBondContact O-N 3.27Å; F210-Y213 WeakPolarHBondContact O-CB 3.41Å; F210-Y213 PolarHBondContact O-N 3.36Å; L211-Y213 VanDerWaalsContact C-N 3.32Å; Y213-C215 VanDerWaalsContact C-N 3.28Å; Y213-C215 PolarHBondContact O-N 3.27Å; Y213-N216 PolarHBondContact O-N 3.49Å; Y213-N216 VanDerWaalsContact O-N 3.16Å |
| 214 | L | 91.3 | Very high | 90.2 | Very high | 106 Ų | 106 | 58.3 Ų | 58.3 | 56% | 0.555 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -63.8 | -33.4 | 175.8 | -64.4 | -179.5 | 0 | 0 | 0 | 113 | F210 L211 N216 | F210-L214 HydrophobicContact CD1-CD1 4.19Å; F210-L214 HydrophobicContact CE1-CD1 3.58Å; F210-L214 HydrophobicContact CE1-CG 4.24Å; F210-L214 HydrophobicContact CZ-CD1 3.91Å; F210-L214 HydrophobicContact CZ-CD2 4.34Å; F210-L214 HydrophobicContact CZ-CG 4.24Å; F210-L214 PolarHBondContact O-N 2.81Å; L211-L214 HydrophobicContact CD2-CD1 4.43Å; L211-L214 PolarHBondContact O-N 3.41Å; L214-N216 VanDerWaalsContact C-N 3.27Å; L214-N216 PolarHBondContact O-N 2.87Å |
| 215 | C | 88.3 | Confident | 90 | Very high | 9 Ų | 9 | 57.8 Ų | 57.8 | 6% | 0.061 | 28% | 0.282 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -85.2 | 5.4 | 178.3 | -66.8 | 0 | 0 | 0 | 0 | 113.6 | L211 A212 Y213 A217 Q279 | L211-C215 VanDerWaalsContact O-CB 3.31Å; L211-C215 WeakPolarHBondContact O-CB 3.31Å; L211-C215 PolarHBondContact O-N 3.38Å; L211-C215 PolarHBondContact O-SG 3.26Å; A212-C215 CarbonylContact O-C 3.59Å; A212-C215 PolarHBondContact O-N 3.49Å; Y213-C215 VanDerWaalsContact C-N 3.28Å; Y213-C215 PolarHBondContact O-N 3.27Å; C215-A217 PolarHBondContact O-N 3.24Å; C215-Q279 HydrophobicContact CB-CB 4.04Å; C215-Q279 HydrophobicContact CB-CG 4.29Å; C215-Q279 PolarHBondContact O-OE1 2.9Å |
| 216 | N | 87.3 | Confident | 89.8 | Confident | 118 Ų | 118 | 57.8 Ų | 57.8 | 63% | 0.631 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.6 | 38.4 | -176.4 | -164.5 | 36.3 | 0 | 0 | 0 | 113.5 | A212 Y213 L214 | A212-N216 PolarHBondContact O-N 3.06Å; A212-N216 VanDerWaalsContact O-N 3.1Å; Y213-N216 PolarHBondContact O-N 3.49Å; Y213-N216 VanDerWaalsContact O-N 3.16Å; L214-N216 VanDerWaalsContact C-N 3.27Å; L214-N216 PolarHBondContact O-N 2.87Å |
| 217 | A | 84.6 | Confident | 89.7 | Confident | 12 Ų | 12 | 55 Ų | 55 | 10% | 0.099 | 26% | 0.263 | C | S | . | . | trans | -86.2 | 132.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | A212 C215 I219 T274 L283 | A212-A217 HydrophobicContact CB-CB 4Å; A212-A217 PolarHBondContact O-N 2.91Å; C215-A217 PolarHBondContact O-N 3.24Å; A217-I219 PolarHBondContact O-N 3.45Å; A217-I219 VanDerWaalsContact O-N 3.16Å; A217-T274 HydrophobicContact CB-CG2 3.52Å; A217-L283 HydrophobicContact CB-CD2 4.11Å | ||
| 218 | Q | 82.4 | Confident | 89.5 | Confident | 153 Ų | 153 | 50.2 Ų | 50.2 | 72% | 0.715 | 24% | 0.241 | S | C | * | . | trans | -88.1 | 83.5 | -179.5 | -65.5 | -173.7 | -13.7 | 0 | 0 | 111 | ||||
| 219 | I | 85.4 | Confident | 89.4 | Confident | 14 Ų | 14 | 50.2 Ų | 50.2 | 7% | 0.072 | 24% | 0.241 | C | C | . | . | trans | -138.9 | 139 | 174.4 | -165.4 | 152.7 | 0 | 0 | 0 | 110.8 | I155 Y209 A212 A217 Q223 M224 L270 | I155-I219 HydrophobicContact CD1-CD1 3.58Å; I155-I219 HydrophobicContact CD1-CG1 4.4Å; Y209-I219 WeakPolarHBondContact CE2-O 3.08Å; A212-I219 HydrophobicContact CB-CG2 3.97Å; A217-I219 PolarHBondContact O-N 3.45Å; A217-I219 VanDerWaalsContact O-N 3.16Å; I219-Q223 HydrophobicContact CD1-CB 4.37Å; I219-Q223 HydrophobicContact CG1-CB 3.84Å; I219-M224 HydrophobicContact CB-SD 4.39Å; I219-M224 HydrophobicContact CD1-CG 4.14Å; I219-M224 HydrophobicContact CD1-SD 3.36Å; I219-M224 WeakPolarHBondContact CD1-SD 3.43Å; I219-M224 HydrophobicContact CG1-CG 3.96Å; I219-M224 HydrophobicContact CG1-SD 3.84Å; I219-M224 HydrophobicContact CG2-CG 3.79Å; I219-M224 HydrophobicContact CG2-SD 3.74Å; I219-L270 HydrophobicContact CD1-CD2 3.97Å | ||
| 220 | T | 88.8 | Confident | 89.3 | Confident | 69 Ų | 69 | 46.2 Ų | 46.2 | 42% | 0.423 | 23% | 0.226 | S | C | . | . | trans | -83.1 | 156.2 | 178 | 72.3 | 0 | 0 | 0 | 0 | 111 | L222 Q223 M224 | T220-L222 VanDerWaalsContact C-N 3.32Å; T220-L222 PolarHBondContact O-N 2.77Å; T220-Q223 PolarHBondContact O-N 3.34Å; T220-Q223 WeakPolarHBondContact OG1-CB 3.26Å; T220-Q223 VanDerWaalsContact OG1-CG 3.23Å; T220-Q223 WeakPolarHBondContact OG1-CG 3.4Å; T220-Q223 PolarHBondContact OG1-N 3.43Å; T220-M224 PolarHBondContact O-N 2.68Å | ||
| 221 | M | 86.3 | Confident | 89.1 | Confident | 69 Ų | 69 | 40.8 Ų | 40.8 | 34% | 0.34 | 20% | 0.202 | S | C | . | . | H | α-helix | trans | -58.2 | -44.5 | 176.9 | -173.4 | -76.1 | -173.1 | 0 | 0 | 111.5 | Y209 Q223 M224 L225 | Y209-M221 HydrophobicContact CD2-CB 4.15Å; Y209-M221 HydrophobicContact CE1-CB 4.49Å; Y209-M221 HydrophobicContact CE2-CB 4.1Å; Y209-M221 HydrophobicContact CG-CB 4.37Å; M221-Q223 VanDerWaalsContact C-N 3.32Å; M221-Q223 PolarHBondContact O-N 2.67Å; M221-M224 WeakPolarHBondContact O-CB 3.43Å; M221-M224 PolarHBondContact O-N 2.66Å; M221-M224 VanDerWaalsContact O-N 3.12Å; M221-L225 HydrophobicContact CE-CD1 3.73Å; M221-L225 HydrophobicContact CE-CD2 4.21Å; M221-L225 HydrophobicContact CE-CG 4.48Å; M221-L225 WeakPolarHBondContact O-CB 3.28Å; M221-L225 PolarHBondContact O-N 2.91Å; M221-L225 HydrophobicContact SD-CB 4.36Å; M221-L225 HydrophobicContact SD-CD1 4.3Å; M221-L225 HydrophobicContact SD-CD2 4.3Å |
| 222 | L | 87.2 | Confident | 89.1 | Confident | 51 Ų | 51 | 39.7 Ų | 39.7 | 27% | 0.267 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.7 | -39.8 | 177.3 | -68.4 | 172.5 | 0 | 0 | 0 | 112.4 | Y127 L159 T220 L225 A226 | Y127-L222 HydrophobicContact CD1-CD1 4.48Å; Y127-L222 HydrophobicContact CE1-CD1 3.79Å; Y127-L222 HydrophobicContact CE2-CD1 4.31Å; L159-L222 HydrophobicContact CD1-CD2 3.63Å; L159-L222 HydrophobicContact CD2-CD2 4.24Å; T220-L222 VanDerWaalsContact C-N 3.32Å; T220-L222 PolarHBondContact O-N 2.77Å; L222-L225 PolarHBondContact O-N 2.86Å; L222-A226 WeakPolarHBondContact O-CB 3.21Å; L222-A226 PolarHBondContact O-N 3.22Å |
| 223 | Q | 88.4 | Confident | 89.2 | Confident | 41 Ų | 41 | 41.7 Ų | 41.7 | 19% | 0.192 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -65.9 | -38.6 | 175.3 | -75.8 | 171.9 | -13.9 | 0 | 0 | 111.9 | I155 I219 T220 M221 L227 | I155-Q223 HydrophobicContact CB-CB 4.37Å; I155-Q223 HydrophobicContact CB-CG 4.16Å; I155-Q223 HydrophobicContact CD1-CB 4.21Å; I155-Q223 HydrophobicContact CG2-CB 4.18Å; I155-Q223 HydrophobicContact CG2-CG 4.29Å; I219-Q223 HydrophobicContact CD1-CB 4.37Å; I219-Q223 HydrophobicContact CG1-CB 3.84Å; T220-Q223 PolarHBondContact O-N 3.34Å; T220-Q223 WeakPolarHBondContact OG1-CB 3.26Å; T220-Q223 VanDerWaalsContact OG1-CG 3.23Å; T220-Q223 WeakPolarHBondContact OG1-CG 3.4Å; T220-Q223 PolarHBondContact OG1-N 3.43Å; M221-Q223 VanDerWaalsContact C-N 3.32Å; M221-Q223 PolarHBondContact O-N 2.67Å; Q223-L227 WeakPolarHBondContact O-CB 3.46Å; Q223-L227 PolarHBondContact O-N 2.82Å |
| 224 | M | 90.4 | Very high | 89.1 | Confident | 0 Ų | 0 | 33.4 Ų | 33.4 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.7 | -44.6 | 173.4 | -75.2 | -54.7 | -50.3 | 0 | 0 | 111.7 | I208 Y209 I219 T220 M221 A226 L227 L228 L270 | I208-M224 HydrophobicContact CB-CE 3.98Å; I208-M224 HydrophobicContact CG2-CE 3.37Å; Y209-M224 HydrophobicContact CD2-CG 4.37Å; I219-M224 HydrophobicContact CB-SD 4.39Å; I219-M224 HydrophobicContact CD1-CG 4.14Å; I219-M224 HydrophobicContact CD1-SD 3.36Å; I219-M224 WeakPolarHBondContact CD1-SD 3.43Å; I219-M224 HydrophobicContact CG1-CG 3.96Å; I219-M224 HydrophobicContact CG1-SD 3.84Å; I219-M224 HydrophobicContact CG2-CG 3.79Å; I219-M224 HydrophobicContact CG2-SD 3.74Å; T220-M224 PolarHBondContact O-N 2.68Å; M221-M224 WeakPolarHBondContact O-CB 3.43Å; M221-M224 PolarHBondContact O-N 2.66Å; M221-M224 VanDerWaalsContact O-N 3.12Å; M224-A226 PolarHBondContact O-N 3.28Å; M224-L227 PolarHBondContact O-N 3.19Å; M224-L228 WeakPolarHBondContact O-CB 3.21Å; M224-L228 PolarHBondContact O-N 3.46Å; M224-L270 HydrophobicContact SD-CD2 4.04Å |
| 225 | L | 91.7 | Very high | 89.2 | Confident | 8 Ų | 8 | 28.4 Ų | 28.4 | 4% | 0.042 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -60.7 | -45.7 | 178.8 | -144.7 | 69.4 | 0 | 0 | 0 | 111 | L159 W201 L202 S205 M221 L222 G229 | L159-L225 HydrophobicContact CD2-CD2 3.88Å; L159-L225 HydrophobicContact CG-CD2 4.19Å; W201-L225 HydrophobicContact CH2-CD2 4.39Å; W201-L225 HydrophobicContact CZ2-CD2 3.95Å; W201-L225 HydrophobicContact CZ2-CG 3.75Å; W201-L225 PolarHBondContact NE1-O 3.17Å; L202-L225 HydrophobicContact CD2-CD1 3.81Å; L202-L225 HydrophobicContact CD2-CD2 4.22Å; L202-L225 HydrophobicContact CD2-CG 4.41Å; S205-L225 VanDerWaalsContact CB-CD1 3.44Å; M221-L225 HydrophobicContact CE-CD1 3.73Å; M221-L225 HydrophobicContact CE-CD2 4.21Å; M221-L225 HydrophobicContact CE-CG 4.48Å; M221-L225 WeakPolarHBondContact O-CB 3.28Å; M221-L225 PolarHBondContact O-N 2.91Å; M221-L225 HydrophobicContact SD-CB 4.36Å; M221-L225 HydrophobicContact SD-CD1 4.3Å; M221-L225 HydrophobicContact SD-CD2 4.3Å; L222-L225 PolarHBondContact O-N 2.86Å; L225-G229 PolarHBondContact O-N 3.24Å |
| 226 | A | 90.1 | Very high | 89.4 | Confident | 0 Ų | 0 | 28.3 Ų | 28.3 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -67 | -45.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A156 E158 P162 L222 M224 L228 G229 Y230 | A156-A226 WeakPolarHBondContact O-CB 3.48Å; E158-A226 WeakPolarHBondContact O-CB 3.5Å; P162-A226 HydrophobicContact CG-CB 4.15Å; L222-A226 WeakPolarHBondContact O-CB 3.21Å; L222-A226 PolarHBondContact O-N 3.22Å; M224-A226 PolarHBondContact O-N 3.28Å; A226-L228 PolarHBondContact O-N 2.91Å; A226-G229 PolarHBondContact O-N 3.48Å; A226-Y230 HydrophobicContact CB-CD2 4.36Å; A226-Y230 HydrophobicContact CB-CE2 4.49Å; A226-Y230 WeakPolarHBondContact O-CB 3.36Å; A226-Y230 WeakPolarHBondContact O-CD2 3.17Å; A226-Y230 PolarHBondContact O-N 3.01Å |
| 227 | L | 90.2 | Very high | 89.6 | Confident | 0 Ų | 0 | 24.9 Ų | 24.9 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -58.4 | -48.1 | 179.7 | -174.7 | 75 | 0 | 0 | 0 | 111.7 | I155 Q223 M224 G231 R265 M266 V269 | I155-L227 HydrophobicContact CD1-CD1 4.49Å; I155-L227 HydrophobicContact CG2-CB 4.46Å; Q223-L227 WeakPolarHBondContact O-CB 3.46Å; Q223-L227 PolarHBondContact O-N 2.82Å; M224-L227 PolarHBondContact O-N 3.19Å; L227-G231 PolarHBondContact O-N 2.74Å; L227-G231 VanDerWaalsContact O-N 3.16Å; L227-R265 VanDerWaalsContact CD1-NH1 3.33Å; L227-M266 HydrophobicContact CD1-CG 4.38Å; L227-M266 HydrophobicContact CD2-CB 4.42Å; L227-M266 HydrophobicContact CG-CB 4.42Å; L227-M266 HydrophobicContact CG-CG 4.13Å; L227-V269 HydrophobicContact CD1-CB 4.19Å; L227-V269 HydrophobicContact CD1-CG1 4.09Å; L227-V269 HydrophobicContact CD1-CG2 4.07Å; L227-V269 HydrophobicContact CD2-CB 4.48Å; L227-V269 HydrophobicContact CD2-CG1 4.18Å |
| 228 | L | 92.6 | Very high | 89.9 | Confident | 0 Ų | 0 | 24.3 Ų | 24.3 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -68.4 | -43.3 | -179.8 | -152.4 | 89.4 | 0 | 0 | 0 | 111.4 | Y200 V204 S205 M224 A226 G231 L232 M266 L287 | Y200-L228 HydrophobicContact CD1-CD2 4.46Å; Y200-L228 HydrophobicContact CE1-CD2 3.8Å; Y200-L228 HydrophobicContact CE1-CG 4.34Å; V204-L228 HydrophobicContact CB-CD2 3.86Å; V204-L228 HydrophobicContact CG1-CD1 4.19Å; V204-L228 HydrophobicContact CG1-CD2 3.91Å; S205-L228 WeakPolarHBondContact OG-CB 3.26Å; S205-L228 WeakPolarHBondContact OG-CD2 3.49Å; M224-L228 WeakPolarHBondContact O-CB 3.21Å; M224-L228 PolarHBondContact O-N 3.46Å; A226-L228 PolarHBondContact O-N 2.91Å; L228-G231 PolarHBondContact O-N 3.43Å; L228-G231 VanDerWaalsContact O-N 3.15Å; L228-L232 PolarHBondContact O-N 2.98Å; L228-M266 HydrophobicContact CD1-CE 3.51Å; L228-M266 HydrophobicContact CG-CE 4.32Å; L228-L287 HydrophobicContact CD1-CD1 3.54Å |
| 229 | G | 91.7 | Very high | 90.3 | Very high | 0 Ų | 0 | 17 Ų | 17 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -67.8 | -40.5 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L165 L225 A226 G231 L232 | L165-G229 WeakPolarHBondContact CD1-O 3.34Å; L225-G229 PolarHBondContact O-N 3.24Å; A226-G229 PolarHBondContact O-N 3.48Å; G229-G231 PolarHBondContact O-N 2.88Å; G229-L232 VanDerWaalsContact O-CB 3.31Å; G229-L232 WeakPolarHBondContact O-CB 3.3Å; G229-L232 PolarHBondContact O-N 3.36Å; G229-L232 VanDerWaalsContact O-N 3.14Å |
| 230 | Y | 90.7 | Very high | 90.5 | Very high | 8 Ų | 8 | 21.4 Ų | 21.4 | 3% | 0.031 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -65.2 | -25.8 | 171.2 | -80.8 | -63.8 | 0 | 0 | 0 | 113.1 | V135 R138 L139 S142 E158 P162 L165 A226 L232 F233 | V135-Y230 HydrophobicContact CG1-CE1 4.41Å; R138-Y230 HydrophobicContact CB-CE1 4.32Å; L139-Y230 HydrophobicContact CD2-CD1 3.88Å; L139-Y230 HydrophobicContact CD2-CE1 4.19Å; L139-Y230 HydrophobicContact CG-CE1 4.45Å; S142-Y230 PolarHBondContact OG-O 3.2Å; S142-Y230 VanDerWaalsContact OG-O 3.11Å; E158-Y230 HydrophobicContact CG-CE2 4.45Å; E158-Y230 PolarHBondContact OE1-OH 3.07Å; P162-Y230 HydrophobicContact CG-CD2 3.72Å; P162-Y230 HydrophobicContact CG-CE2 3.66Å; P162-Y230 HydrophobicContact CG-CG 4.26Å; L165-Y230 HydrophobicContact CD1-CD1 4.25Å; A226-Y230 HydrophobicContact CB-CD2 4.36Å; A226-Y230 HydrophobicContact CB-CE2 4.49Å; A226-Y230 WeakPolarHBondContact O-CB 3.36Å; A226-Y230 WeakPolarHBondContact O-CD2 3.17Å; A226-Y230 PolarHBondContact O-N 3.01Å; Y230-L232 VanDerWaalsContact C-N 3.29Å; Y230-F233 WeakPolarHBondContact O-CB 3.35Å; Y230-F233 PolarHBondContact O-N 3.3Å |
| 231 | G | 90.2 | Very high | 90.5 | Very high | 0 Ų | 0 | 20.4 Ų | 20.4 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -66.1 | -29.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | L227 L228 G229 F233 G234 S262 H291 | L227-G231 PolarHBondContact O-N 2.74Å; L227-G231 VanDerWaalsContact O-N 3.16Å; L228-G231 PolarHBondContact O-N 3.43Å; L228-G231 VanDerWaalsContact O-N 3.15Å; G229-G231 PolarHBondContact O-N 2.88Å; G231-F233 PolarHBondContact O-N 3.23Å; G231-F233 VanDerWaalsContact O-N 3.12Å; G231-G234 PolarHBondContact O-N 3.17Å; G231-S262 VanDerWaalsContact CA-OG 3.26Å; G231-S262 WeakPolarHBondContact CA-OG 3.24Å; G231-S262 PolarHBondContact O-OG 3.4Å; G231-H291 PolarHBondContact O-NE2 2.96Å |
| 232 | L | 92.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 17.3 Ų | 17.3 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -64.6 | -14.9 | 177.3 | -67 | 174.4 | 0 | 0 | 0 | 113.6 | V166 L169 Y200 L228 G229 Y230 G234 H235 C236 F294 | V166-L232 HydrophobicContact CG2-CD1 3.72Å; L169-L232 HydrophobicContact CD2-CD1 4.33Å; L169-L232 HydrophobicContact CD2-CD2 4.06Å; Y200-L232 HydrophobicContact CD1-CD1 4.5Å; Y200-L232 HydrophobicContact CD1-CD2 3.95Å; Y200-L232 HydrophobicContact CE1-CD2 3.61Å; Y200-L232 HydrophobicContact CE1-CG 4.35Å; L228-L232 PolarHBondContact O-N 2.98Å; G229-L232 VanDerWaalsContact O-CB 3.31Å; G229-L232 WeakPolarHBondContact O-CB 3.3Å; G229-L232 PolarHBondContact O-N 3.36Å; G229-L232 VanDerWaalsContact O-N 3.14Å; Y230-L232 VanDerWaalsContact C-N 3.29Å; L232-G234 PolarHBondContact O-N 2.8Å; L232-H235 HydrophobicContact CD2-CB 4.48Å; L232-H235 WeakPolarHBondContact O-CA 3.46Å; L232-H235 WeakPolarHBondContact O-CB 3.42Å; L232-H235 PolarHBondContact O-N 3.2Å; L232-C236 PolarHBondContact O-N 3.3Å; L232-C236 PolarHBondContact O-SG 2.94Å; L232-C236 VanDerWaalsContact O-SG 3.35Å; L232-F294 HydrophobicContact CD2-CD1 4.08Å; L232-F294 HydrophobicContact CD2-CE1 3.74Å |
| 233 | F | 91.9 | Very high | 90.3 | Very high | 43 Ų | 43 | 15.6 Ų | 15.6 | 19% | 0.189 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -57.6 | -39.9 | 174.9 | -178.9 | -125.1 | 0 | 0 | 0 | 112.1 | L139 M143 L165 Y230 G231 H235 C236 I237 | L139-F233 HydrophobicContact CB-CD1 4.22Å; L139-F233 HydrophobicContact CB-CE1 4.16Å; L139-F233 HydrophobicContact CB-CG 4.49Å; L139-F233 HydrophobicContact CB-CZ 4.4Å; L139-F233 HydrophobicContact CD2-CB 3.91Å; L139-F233 HydrophobicContact CD2-CD1 4.3Å; L139-F233 HydrophobicContact CD2-CD2 3.93Å; L139-F233 HydrophobicContact CD2-CG 3.8Å; L139-F233 WeakPolarHBondContact O-CD1 3.47Å; M143-F233 HydrophobicContact CG-CD1 3.76Å; M143-F233 HydrophobicContact CG-CE1 3.91Å; M143-F233 HydrophobicContact SD-CD1 3.87Å; M143-F233 HydrophobicContact SD-CE1 3.46Å; M143-F233 WeakPolarHBondContact SD-CE1 3.49Å; M143-F233 HydrophobicContact SD-CZ 4.5Å; L165-F233 HydrophobicContact CD1-CB 3.84Å; L165-F233 HydrophobicContact CD2-CB 3.99Å; L165-F233 HydrophobicContact CD2-CD2 3.73Å; L165-F233 HydrophobicContact CD2-CG 4.31Å; Y230-F233 WeakPolarHBondContact O-CB 3.35Å; Y230-F233 PolarHBondContact O-N 3.3Å; G231-F233 PolarHBondContact O-N 3.23Å; G231-F233 VanDerWaalsContact O-N 3.12Å; F233-H235 PolarHBondContact O-N 3.47Å; F233-C236 WeakPolarHBondContact O-CB 3.31Å; F233-C236 PolarHBondContact O-N 3.04Å; F233-I237 HydrophobicContact CD1-CD1 4.16Å; F233-I237 HydrophobicContact CE1-CD1 3.73Å; F233-I237 HydrophobicContact CE2-CD1 4.15Å; F233-I237 HydrophobicContact CE2-CG1 4.36Å; F233-I237 HydrophobicContact CZ-CD1 3.72Å; F233-I237 HydrophobicContact CZ-CG1 4.38Å; F233-I237 WeakPolarHBondContact O-CG1 3.4Å; F233-I237 PolarHBondContact O-N 3.44Å; F233-I237 VanDerWaalsContact O-N 3.16Å |
| 234 | G | 90.1 | Very high | 90 | Very high | 1 Ų | 1 | 17.9 Ų | 17.9 | 1% | 0.01 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -60.3 | -45.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | G231 L232 C236 I237 V238 | G231-G234 PolarHBondContact O-N 3.17Å; L232-G234 PolarHBondContact O-N 2.8Å; G234-C236 VanDerWaalsContact C-N 3.34Å; G234-C236 PolarHBondContact O-N 3.42Å; G234-I237 PolarHBondContact O-N 3.07Å; G234-V238 VanDerWaalsContact O-CG2 3.3Å; G234-V238 WeakPolarHBondContact O-CG2 3.48Å; G234-V238 PolarHBondContact O-N 3.15Å |
| 235 | H | 93.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 21.6 Ų | 21.6 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -59.4 | -43.1 | 176.9 | -62.6 | 49.3 | 0 | 0 | 0 | 112 | L169 L232 F233 I237 V238 L239 H291 F294 L295 | L169-H235 HydrophobicContact CD1-CB 4.37Å; L232-H235 HydrophobicContact CD2-CB 4.48Å; L232-H235 WeakPolarHBondContact O-CA 3.46Å; L232-H235 WeakPolarHBondContact O-CB 3.42Å; L232-H235 PolarHBondContact O-N 3.2Å; F233-H235 PolarHBondContact O-N 3.47Å; H235-I237 VanDerWaalsContact C-N 3.35Å; H235-I237 PolarHBondContact O-N 3.29Å; H235-V238 PolarHBondContact O-N 3.46Å; H235-L239 WeakPolarHBondContact O-CB 3.39Å; H235-L239 WeakPolarHBondContact O-CG 3.46Å; H235-L239 PolarHBondContact O-N 3.41Å; H235-H291 AromaticContact CE1-CD2 3.57Å; H235-H291 AromaticContact CE1-CE1 3.15Å; H235-H291 PolarHBondContact CE1-CE1 3.19Å; H235-H291 AromaticContact CE1-CG 3.75Å; H235-H291 AromaticContact CE1-ND1 3.49Å; H235-H291 PolarHBondContact CE1-ND1 3.43Å; H235-H291 AromaticContact CE1-NE2 3.18Å; H235-H291 PolarHBondContact CE1-NE2 2.95Å; H235-H291 AromaticContact ND1-CE1 3.68Å; H235-H291 AromaticContact ND1-NE2 3.72Å; H235-H291 AromaticContact NE2-CE1 3.79Å; H235-H291 AromaticContact NE2-ND1 3.75Å; H235-H291 PolarHBondContact NE2-O 2.94Å; H235-F294 AromaticContact CD2-CD1 3.77Å; H235-L295 HydrophobicContact CB-CD1 4.1Å; H235-L295 HydrophobicContact CB-CG 4.42Å; H235-L295 VanDerWaalsContact CD2-CB 3.48Å; H235-L295 WeakPolarHBondContact CD2-CB 3.5Å |
| 236 | C | 92.1 | Very high | 88.7 | Confident | 7 Ų | 7 | 27.9 Ų | 27.9 | 5% | 0.047 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -57.6 | -46.5 | 175.8 | -66.2 | 0 | 0 | 0 | 0 | 111.6 | I172 L232 F233 G234 F240 | I172-C236 HydrophobicContact CD1-CB 3.71Å; L232-C236 PolarHBondContact O-N 3.3Å; L232-C236 PolarHBondContact O-SG 2.94Å; L232-C236 VanDerWaalsContact O-SG 3.35Å; F233-C236 WeakPolarHBondContact O-CB 3.31Å; F233-C236 PolarHBondContact O-N 3.04Å; G234-C236 VanDerWaalsContact C-N 3.34Å; G234-C236 PolarHBondContact O-N 3.42Å; C236-F240 WeakPolarHBondContact O-CB 3.18Å; C236-F240 PolarHBondContact O-N 2.99Å |
| 237 | I | 90.8 | Very high | 88.3 | Confident | 46 Ų | 46 | 32.9 Ų | 32.9 | 24% | 0.236 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -63.6 | -49.5 | 179 | -65.1 | 168.3 | 0 | 0 | 0 | 110.9 | M143 F233 G234 H235 L239 F240 I241 V258 | M143-I237 HydrophobicContact CE-CD1 3.96Å; M143-I237 HydrophobicContact SD-CD1 3.69Å; F233-I237 HydrophobicContact CD1-CD1 4.16Å; F233-I237 HydrophobicContact CE1-CD1 3.73Å; F233-I237 HydrophobicContact CE2-CD1 4.15Å; F233-I237 HydrophobicContact CE2-CG1 4.36Å; F233-I237 HydrophobicContact CZ-CD1 3.72Å; F233-I237 HydrophobicContact CZ-CG1 4.38Å; F233-I237 WeakPolarHBondContact O-CG1 3.4Å; F233-I237 PolarHBondContact O-N 3.44Å; F233-I237 VanDerWaalsContact O-N 3.16Å; G234-I237 PolarHBondContact O-N 3.07Å; H235-I237 VanDerWaalsContact C-N 3.35Å; H235-I237 PolarHBondContact O-N 3.29Å; I237-L239 PolarHBondContact O-N 2.96Å; I237-F240 PolarHBondContact O-N 3.29Å; I237-I241 HydrophobicContact CG2-CD1 3.73Å; I237-I241 VanDerWaalsContact O-CG1 3.32Å; I237-I241 WeakPolarHBondContact O-CG1 3.39Å; I237-I241 PolarHBondContact O-N 3.29Å; I237-I241 VanDerWaalsContact O-N 3.08Å; I237-V258 HydrophobicContact CB-CG1 4.39Å; I237-V258 HydrophobicContact CG2-CG1 4.45Å |
| 238 | V | 91.9 | Very high | 88 | Confident | 0 Ų | 0 | 38.7 Ų | 38.7 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -60.2 | -48.4 | -177.3 | 177.1 | 0 | 0 | 0 | 0 | 110.9 | G234 H235 T242 F251 F254 V258 L295 | G234-V238 VanDerWaalsContact O-CG2 3.3Å; G234-V238 WeakPolarHBondContact O-CG2 3.48Å; G234-V238 PolarHBondContact O-N 3.15Å; H235-V238 PolarHBondContact O-N 3.46Å; V238-T242 VanDerWaalsContact O-CB 3.26Å; V238-T242 WeakPolarHBondContact O-CB 3.48Å; V238-T242 PolarHBondContact O-N 3.5Å; V238-T242 PolarHBondContact O-OG1 3.22Å; V238-F251 HydrophobicContact CG1-CD2 4.12Å; V238-F251 HydrophobicContact CG1-CE2 4.13Å; V238-F254 HydrophobicContact CB-CB 4.45Å; V238-F254 HydrophobicContact CG1-CB 3.94Å; V238-F254 HydrophobicContact CG2-CB 4.09Å; V238-F254 WeakPolarHBondContact CG2-O 3.11Å; V238-V258 HydrophobicContact CG2-CB 3.72Å; V238-V258 HydrophobicContact CG2-CG1 3.86Å; V238-L295 HydrophobicContact CB-CD1 4.08Å; V238-L295 HydrophobicContact CB-CD2 4.21Å; V238-L295 HydrophobicContact CG1-CD1 4.26Å; V238-L295 HydrophobicContact CG1-CD2 3.61Å; V238-L295 HydrophobicContact CG2-CD1 4.08Å |
| 239 | L | 90.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -68.4 | -42.3 | -178.3 | -68.8 | 174.3 | 0 | 0 | 0 | 111.7 | L169 I172 L173 H235 I237 I241 T242 Y243 L298 H299 | L169-L239 HydrophobicContact CD1-CD1 3.68Å; I172-L239 HydrophobicContact CG2-CB 3.92Å; L173-L239 HydrophobicContact CD2-CD1 4.35Å; H235-L239 WeakPolarHBondContact O-CB 3.39Å; H235-L239 WeakPolarHBondContact O-CG 3.46Å; H235-L239 PolarHBondContact O-N 3.41Å; I237-L239 PolarHBondContact O-N 2.96Å; L239-I241 PolarHBondContact O-N 3.28Å; L239-T242 PolarHBondContact O-N 3.1Å; L239-Y243 HydrophobicContact CB-CE2 4.34Å; L239-Y243 HydrophobicContact CD2-CE1 4.34Å; L239-Y243 WeakPolarHBondContact O-CB 3.36Å; L239-Y243 VanDerWaalsContact O-CG 3.25Å; L239-Y243 PolarHBondContact O-N 3.32Å; L239-L298 HydrophobicContact CD1-CB 3.97Å; L239-L298 HydrophobicContact CD1-CD1 3.69Å; L239-L298 HydrophobicContact CD2-CB 4.38Å; L239-H299 HydrophobicContact CD2-CB 4.23Å |
| 240 | F | 90 | Very high | 87.5 | Confident | 107 Ų | 107 | 44.3 Ų | 44.3 | 47% | 0.469 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59.1 | -47.3 | 178 | -177.3 | -103.2 | 0 | 0 | 0 | 111.7 | I172 C236 I237 N244 | I172-F240 HydrophobicContact CD1-CB 4.25Å; I172-F240 HydrophobicContact CG1-CD2 4.45Å; C236-F240 WeakPolarHBondContact O-CB 3.18Å; C236-F240 PolarHBondContact O-N 2.99Å; I237-F240 PolarHBondContact O-N 3.29Å; F240-N244 PolarHBondContact O-N 3.05Å; F240-N244 PolarHBondContact O-ND2 3.06Å |
| 241 | I | 88.4 | Confident | 87.4 | Confident | 47 Ų | 47 | 44 Ų | 44 | 24% | 0.241 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -66.8 | -43.7 | 179.3 | -62 | 170.5 | 0 | 0 | 0 | 110.7 | I237 L239 N244 I245 L250 F254 | I237-I241 HydrophobicContact CG2-CD1 3.73Å; I237-I241 VanDerWaalsContact O-CG1 3.32Å; I237-I241 WeakPolarHBondContact O-CG1 3.39Å; I237-I241 PolarHBondContact O-N 3.29Å; I237-I241 VanDerWaalsContact O-N 3.08Å; L239-I241 PolarHBondContact O-N 3.28Å; I241-N244 PolarHBondContact O-N 3.44Å; I241-I245 HydrophobicContact CG2-CD1 4.14Å; I241-I245 PolarHBondContact O-N 3.39Å; I241-L250 HydrophobicContact CG2-CD2 4.02Å; I241-F254 HydrophobicContact CD1-CE1 4.34Å; I241-F254 HydrophobicContact CD1-CE2 4.49Å; I241-F254 HydrophobicContact CD1-CZ 4.19Å; I241-F254 HydrophobicContact CG2-CD2 4.31Å; I241-F254 HydrophobicContact CG2-CE2 3.84Å; I241-F254 HydrophobicContact CG2-CZ 4.42Å |
| 242 | T | 86.5 | Confident | 87.4 | Confident | 4 Ų | 4 | 49.4 Ų | 49.4 | 3% | 0.025 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -68.9 | -36.4 | -176.1 | -55.2 | 0 | 0 | 0 | 0 | 112.5 | V238 L239 N244 I245 F251 H299 | V238-T242 VanDerWaalsContact O-CB 3.26Å; V238-T242 WeakPolarHBondContact O-CB 3.48Å; V238-T242 PolarHBondContact O-N 3.5Å; V238-T242 PolarHBondContact O-OG1 3.22Å; L239-T242 PolarHBondContact O-N 3.1Å; T242-N244 VanDerWaalsContact C-N 3.27Å; T242-N244 PolarHBondContact O-N 2.99Å; T242-I245 CarbonylContact O-C 3.56Å; T242-I245 PolarHBondContact O-N 3.41Å; T242-F251 HydrophobicContact CG2-CB 3.62Å; T242-F251 HydrophobicContact CG2-CD2 3.72Å; T242-F251 HydrophobicContact CG2-CG 4.04Å; T242-H299 WeakPolarHBondContact CG2-NE2 3.4Å |
| 243 | Y | 83 | Confident | 87.4 | Confident | 15 Ų | 15 | 54.1 Ų | 54.1 | 6% | 0.059 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -68.9 | -26 | 174.8 | -69 | -15.7 | 0 | 0 | 0 | 112.7 | I172 L173 L239 H246 L298 H303 | I172-Y243 HydrophobicContact CG2-CD2 3.87Å; I172-Y243 HydrophobicContact CG2-CE2 3.99Å; L173-Y243 HydrophobicContact CD2-CE2 4.29Å; L173-Y243 WeakPolarHBondContact CD2-OH 3.33Å; L239-Y243 HydrophobicContact CB-CE2 4.34Å; L239-Y243 HydrophobicContact CD2-CE1 4.34Å; L239-Y243 WeakPolarHBondContact O-CB 3.36Å; L239-Y243 VanDerWaalsContact O-CG 3.25Å; L239-Y243 PolarHBondContact O-N 3.32Å; Y243-H246 PolarHBondContact O-CE1 3.45Å; Y243-H246 PolarHBondContact O-ND1 2.91Å; Y243-L298 PolarHBondContact OH-O 2.94Å; Y243-H303 AromaticContact CE1-NE2 3.31Å; Y243-H303 VanDerWaalsContact CE1-NE2 3.31Å; Y243-H303 WeakPolarHBondContact CE1-NE2 3.45Å; Y243-H303 AromaticContact CZ-NE2 3.62Å |
| 244 | N | 82 | Confident | 87.3 | Confident | 90 Ų | 90 | 54.7 Ų | 54.7 | 48% | 0.481 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -80.5 | -36.8 | 172.7 | -78.5 | -87.1 | 0 | 0 | 0 | 111.9 | F240 I241 T242 | F240-N244 PolarHBondContact O-N 3.05Å; F240-N244 PolarHBondContact O-ND2 3.06Å; I241-N244 PolarHBondContact O-N 3.44Å; T242-N244 VanDerWaalsContact C-N 3.27Å; T242-N244 PolarHBondContact O-N 2.99Å |
| 245 | I | 81 | Confident | 87.5 | Confident | 77 Ų | 77 | 57.1 Ų | 57.1 | 40% | 0.395 | 29% | 0.285 | S | S | . | . | S | Bend | trans | -118.1 | 91.8 | -175.7 | -50.5 | 171.6 | 0 | 0 | 0 | 107.8 | I241 T242 L247 L250 | I241-I245 HydrophobicContact CG2-CD1 4.14Å; I241-I245 PolarHBondContact O-N 3.39Å; T242-I245 CarbonylContact O-C 3.56Å; T242-I245 PolarHBondContact O-N 3.41Å; I245-L247 HydrophobicContact CG2-CB 4.38Å; I245-L247 HydrophobicContact CG2-CD1 3.8Å; I245-L247 HydrophobicContact CG2-CG 3.95Å; I245-L247 PolarHBondContact O-N 2.97Å; I245-L250 HydrophobicContact CB-CD1 4.37Å; I245-L250 HydrophobicContact CD1-CD1 4.29Å; I245-L250 HydrophobicContact CG2-CD1 3.99Å |
| 246 | H | 73.1 | Confident | 87.4 | Confident | 141 Ų | 141 | 62.3 Ų | 62.3 | 65% | 0.653 | 31% | 0.312 | S | S | * | . | trans | -69.9 | 52.6 | -173.8 | -67.9 | 63.8 | 0 | 0 | 0 | 113.2 | Y243 | Y243-H246 PolarHBondContact O-CE1 3.45Å; Y243-H246 PolarHBondContact O-ND1 2.91Å | ||
| 247 | L | 81.1 | Confident | 87.4 | Confident | 105 Ų | 105 | 66.6 Ų | 66.6 | 55% | 0.55 | 33% | 0.334 | S | S | . | . | trans | -112.1 | 109.6 | 178.6 | -67.4 | 178.1 | 0 | 0 | 0 | 109.5 | I245 A249 L250 F251 | I245-L247 HydrophobicContact CG2-CB 4.38Å; I245-L247 HydrophobicContact CG2-CD1 3.8Å; I245-L247 HydrophobicContact CG2-CG 3.95Å; I245-L247 PolarHBondContact O-N 2.97Å; L247-A249 VanDerWaalsContact C-N 3.25Å; L247-A249 PolarHBondContact O-N 3.45Å; L247-L250 HydrophobicContact CB-CB 3.87Å; L247-L250 WeakPolarHBondContact O-CB 3.36Å; L247-L250 PolarHBondContact O-N 3.24Å; L247-F251 PolarHBondContact O-N 3.2Å; L247-F251 VanDerWaalsContact O-N 3.13Å | ||
| 248 | H | 83.9 | Confident | 87.5 | Confident | 122 Ų | 122 | 65.4 Ų | 65.4 | 57% | 0.565 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -59 | -33.8 | -179.2 | -63.3 | -55.1 | 0 | 0 | 0 | 113.5 | L250 F251 Y252 H299 | H248-L250 VanDerWaalsContact C-N 3.34Å; H248-L250 PolarHBondContact O-N 3.27Å; H248-F251 WeakPolarHBondContact O-CB 3.49Å; H248-F251 PolarHBondContact O-N 3.22Å; H248-Y252 WeakPolarHBondContact O-CD2 3.45Å; H248-Y252 PolarHBondContact O-N 2.89Å; H248-Y252 VanDerWaalsContact O-N 3.17Å; H248-H299 AromaticContact ND1-CE1 3.92Å |
| 249 | A | 86.3 | Confident | 87.4 | Confident | 82 Ų | 82 | 65.4 Ų | 65.4 | 68% | 0.678 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -64.9 | -37.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L247 F251 Y252 L253 | L247-A249 VanDerWaalsContact C-N 3.25Å; L247-A249 PolarHBondContact O-N 3.45Å; A249-F251 VanDerWaalsContact C-N 3.33Å; A249-Y252 PolarHBondContact O-N 2.87Å; A249-L253 PolarHBondContact O-N 2.93Å; A249-L253 VanDerWaalsContact O-N 3.1Å |
| 250 | L | 87.6 | Confident | 87.4 | Confident | 36 Ų | 36 | 66 Ų | 66 | 19% | 0.188 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -66.6 | -38.5 | 176.6 | 178.8 | 149.1 | 0 | 0 | 0 | 110.7 | I241 I245 L247 H248 L253 F254 | I241-L250 HydrophobicContact CG2-CD2 4.02Å; I245-L250 HydrophobicContact CB-CD1 4.37Å; I245-L250 HydrophobicContact CD1-CD1 4.29Å; I245-L250 HydrophobicContact CG2-CD1 3.99Å; L247-L250 HydrophobicContact CB-CB 3.87Å; L247-L250 WeakPolarHBondContact O-CB 3.36Å; L247-L250 PolarHBondContact O-N 3.24Å; H248-L250 VanDerWaalsContact C-N 3.34Å; H248-L250 PolarHBondContact O-N 3.27Å; L250-L253 PolarHBondContact O-N 3.48Å; L250-F254 HydrophobicContact CD1-CE2 4.07Å; L250-F254 HydrophobicContact CD2-CD2 3.43Å; L250-F254 VanDerWaalsContact CD2-CD2 3.43Å; L250-F254 HydrophobicContact CD2-CE2 3.65Å; L250-F254 HydrophobicContact CG-CD2 3.66Å; L250-F254 HydrophobicContact CG-CE2 3.63Å; L250-F254 WeakPolarHBondContact O-CD2 3.48Å; L250-F254 PolarHBondContact O-N 3.46Å |
| 251 | F | 88.8 | Confident | 87.4 | Confident | 0 Ų | 0 | 63.9 Ų | 63.9 | 0% | 0 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -57.8 | -52.2 | 173.1 | 174.8 | -104.9 | 0 | 0 | 0 | 112.1 | V238 T242 L247 H248 A249 L253 F254 W255 L295 L296 H299 F300 | V238-F251 HydrophobicContact CG1-CD2 4.12Å; V238-F251 HydrophobicContact CG1-CE2 4.13Å; T242-F251 HydrophobicContact CG2-CB 3.62Å; T242-F251 HydrophobicContact CG2-CD2 3.72Å; T242-F251 HydrophobicContact CG2-CG 4.04Å; L247-F251 PolarHBondContact O-N 3.2Å; L247-F251 VanDerWaalsContact O-N 3.13Å; H248-F251 WeakPolarHBondContact O-CB 3.49Å; H248-F251 PolarHBondContact O-N 3.22Å; A249-F251 VanDerWaalsContact C-N 3.33Å; F251-L253 VanDerWaalsContact C-N 3.28Å; F251-L253 PolarHBondContact O-N 3.37Å; F251-F254 PolarHBondContact O-N 3.01Å; F251-W255 HydrophobicContact CE1-CB 4.47Å; F251-W255 HydrophobicContact CZ-CB 4.43Å; F251-W255 WeakPolarHBondContact O-CB 3.4Å; F251-W255 PolarHBondContact O-N 3.03Å; F251-L295 HydrophobicContact CE2-CD2 3.41Å; F251-L295 VanDerWaalsContact CE2-CD2 3.41Å; F251-L295 HydrophobicContact CZ-CD2 3.66Å; F251-L296 HydrophobicContact CE1-CD2 3.77Å; F251-L296 HydrophobicContact CZ-CD2 4.14Å; F251-H299 AromaticContact CD1-ND1 3.98Å; F251-H299 HydrophobicContact CD2-CB 4.21Å; F251-H299 AromaticContact CD2-CD2 3.4Å; F251-H299 WeakPolarHBondContact CD2-CD2 3.27Å; F251-H299 AromaticContact CD2-CG 3.71Å; F251-H299 AromaticContact CD2-NE2 3.86Å; F251-H299 HydrophobicContact CE1-CB 4.08Å; F251-H299 AromaticContact CE1-CG 3.86Å; F251-H299 AromaticContact CE1-ND1 3.85Å; F251-H299 HydrophobicContact CE2-CB 3.37Å; F251-H299 AromaticContact CE2-CD2 3.5Å; F251-H299 AromaticContact CE2-CG 3.38Å; F251-H299 AromaticContact CG-CD2 3.84Å; F251-H299 AromaticContact CG-NE2 3.83Å; F251-H299 HydrophobicContact CZ-CB 3.29Å; F251-H299 AromaticContact CZ-CG 3.47Å; F251-H299 VanDerWaalsContact CZ-CG 3.47Å; F251-H299 AromaticContact CZ-ND1 3.94Å; F251-F300 HydrophobicContact CD1-CE2 4.29Å; F251-F300 HydrophobicContact CD1-CZ 4.25Å; F251-F300 AromaticContact CE1-CE2 3.68Å; F251-F300 HydrophobicContact CE1-CE2 3.68Å; F251-F300 HydrophobicContact CE1-CZ 4.09Å; F251-F300 HydrophobicContact CZ-CE2 4.47Å |
| 252 | Y | 90.6 | Very high | 87.6 | Confident | 114 Ų | 114 | 61.7 Ų | 61.7 | 45% | 0.447 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -62.9 | -35.6 | -179.8 | -70.6 | -65.8 | 0 | 0 | 0 | 112.6 | H248 A249 L256 L296 F300 | H248-Y252 WeakPolarHBondContact O-CD2 3.45Å; H248-Y252 PolarHBondContact O-N 2.89Å; H248-Y252 VanDerWaalsContact O-N 3.17Å; A249-Y252 PolarHBondContact O-N 2.87Å; Y252-L256 WeakPolarHBondContact O-CB 3.29Å; Y252-L256 PolarHBondContact O-N 2.9Å; Y252-L296 HydrophobicContact CE1-CD2 4.38Å; Y252-F300 HydrophobicContact CE1-CE2 4.38Å; Y252-F300 HydrophobicContact CE1-CZ 4.43Å; Y252-F300 AromaticContact CZ-CZ 3.9Å; Y252-F300 WeakPolarHBondContact OH-CZ 3.31Å |
| 253 | L | 92.4 | Very high | 87.8 | Confident | 100 Ų | 100 | 62.1 Ų | 62.1 | 52% | 0.524 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -62.7 | -50.5 | 174.9 | -178.1 | 68 | 0 | 0 | 0 | 111.4 | A249 L250 F251 L256 L257 | A249-L253 PolarHBondContact O-N 2.93Å; A249-L253 VanDerWaalsContact O-N 3.1Å; L250-L253 PolarHBondContact O-N 3.48Å; F251-L253 VanDerWaalsContact C-N 3.28Å; F251-L253 PolarHBondContact O-N 3.37Å; L253-L256 PolarHBondContact O-N 3.03Å; L253-L257 HydrophobicContact CD1-CD1 3.8Å; L253-L257 HydrophobicContact CD1-CG 4.32Å; L253-L257 HydrophobicContact CG-CD1 4.05Å; L253-L257 WeakPolarHBondContact O-CB 3.44Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.22Å |
| 254 | F | 90.7 | Very high | 88.2 | Confident | 54 Ų | 54 | 66.3 Ų | 66.3 | 24% | 0.237 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -72.3 | -34.1 | 179.8 | -81.7 | -60.9 | 0 | 0 | 0 | 113 | V238 I241 L250 F251 V258 G259 | V238-F254 HydrophobicContact CB-CB 4.45Å; V238-F254 HydrophobicContact CG1-CB 3.94Å; V238-F254 HydrophobicContact CG2-CB 4.09Å; V238-F254 WeakPolarHBondContact CG2-O 3.11Å; I241-F254 HydrophobicContact CD1-CE1 4.34Å; I241-F254 HydrophobicContact CD1-CE2 4.49Å; I241-F254 HydrophobicContact CD1-CZ 4.19Å; I241-F254 HydrophobicContact CG2-CD2 4.31Å; I241-F254 HydrophobicContact CG2-CE2 3.84Å; I241-F254 HydrophobicContact CG2-CZ 4.42Å; L250-F254 HydrophobicContact CD1-CE2 4.07Å; L250-F254 HydrophobicContact CD2-CD2 3.43Å; L250-F254 VanDerWaalsContact CD2-CD2 3.43Å; L250-F254 HydrophobicContact CD2-CE2 3.65Å; L250-F254 HydrophobicContact CG-CD2 3.66Å; L250-F254 HydrophobicContact CG-CE2 3.63Å; L250-F254 WeakPolarHBondContact O-CD2 3.48Å; L250-F254 PolarHBondContact O-N 3.46Å; F251-F254 PolarHBondContact O-N 3.01Å; F254-V258 HydrophobicContact CD1-CG2 3.87Å; F254-V258 WeakPolarHBondContact O-CA 3.42Å; F254-V258 WeakPolarHBondContact O-CB 3.49Å; F254-V258 PolarHBondContact O-N 2.83Å; F254-G259 PolarHBondContact O-N 2.8Å |
| 255 | W | 92.8 | Very high | 88.5 | Confident | 52 Ų | 52 | 63.4 Ų | 63.4 | 20% | 0.197 | 33% | 0.326 | C | S | . | . | I | π-helix | trans | -56.9 | -50.3 | 171 | 171.6 | 79.3 | 0 | 0 | 0 | 110.6 | F251 G259 G260 M292 L295 L296 | F251-W255 HydrophobicContact CE1-CB 4.47Å; F251-W255 HydrophobicContact CZ-CB 4.43Å; F251-W255 WeakPolarHBondContact O-CB 3.4Å; F251-W255 PolarHBondContact O-N 3.03Å; W255-G259 CarbonylContact O-C 3.49Å; W255-G259 WeakPolarHBondContact O-CA 3.47Å; W255-G259 PolarHBondContact O-N 3.11Å; W255-G260 PolarHBondContact O-N 3.06Å; W255-G260 VanDerWaalsContact O-N 3.12Å; W255-M292 HydrophobicContact CD2-CE 3.73Å; W255-M292 HydrophobicContact CE3-CE 4.22Å; W255-M292 HydrophobicContact CG-CE 4.2Å; W255-M292 HydrophobicContact CH2-CE 4.11Å; W255-M292 HydrophobicContact CZ2-CB 4.03Å; W255-M292 HydrophobicContact CZ2-CE 3.6Å; W255-M292 HydrophobicContact CZ3-CE 4.39Å; W255-M292 PolarHBondContact NE1-O 3.25Å; W255-M292 VanDerWaalsContact O-CE 3.3Å; W255-M292 WeakPolarHBondContact O-CE 3.39Å; W255-L295 HydrophobicContact CB-CD2 4.38Å; W255-L295 HydrophobicContact CG-CD2 4.44Å; W255-L296 HydrophobicContact CD2-CD2 4.35Å; W255-L296 HydrophobicContact CG-CD2 4.44Å; W255-L296 HydrophobicContact CZ2-CD1 3.72Å; W255-L296 HydrophobicContact CZ2-CD2 4.44Å; W255-L296 HydrophobicContact CZ2-CG 4.11Å |
| 256 | L | 92.5 | Very high | 88.9 | Confident | 109 Ų | 109 | 59.8 Ų | 59.8 | 57% | 0.571 | 31% | 0.307 | S | S | * | . | I | π-helix | trans | -70.3 | -42.6 | -180 | -168.4 | 115.6 | 0 | 0 | 0 | 112.2 | Y252 L253 G260 | Y252-L256 WeakPolarHBondContact O-CB 3.29Å; Y252-L256 PolarHBondContact O-N 2.9Å; L253-L256 PolarHBondContact O-N 3.03Å; L256-G260 WeakPolarHBondContact O-CA 3.37Å; L256-G260 PolarHBondContact O-N 2.83Å |
| 257 | L | 92.1 | Very high | 89.8 | Confident | 97 Ų | 97 | 54.6 Ų | 54.6 | 51% | 0.508 | 29% | 0.285 | S | S | . | . | I | π-helix | trans | -77.7 | -63 | -177 | -69.5 | 180 | 0 | 0 | 0 | 112.4 | L253 L261 | L253-L257 HydrophobicContact CD1-CD1 3.8Å; L253-L257 HydrophobicContact CD1-CG 4.32Å; L253-L257 HydrophobicContact CG-CD1 4.05Å; L253-L257 WeakPolarHBondContact O-CB 3.44Å; L253-L257 WeakPolarHBondContact O-CG 3.37Å; L253-L257 PolarHBondContact O-N 3.22Å; L257-L261 WeakPolarHBondContact O-CB 3.47Å; L257-L261 PolarHBondContact O-N 3.45Å |
| 258 | V | 92 | Very high | 90.1 | Very high | 21 Ų | 21 | 50.7 Ų | 50.7 | 13% | 0.127 | 27% | 0.268 | C | S | . | . | I | π-helix | trans | -77.9 | -42.4 | -173.9 | 175.6 | 0 | 0 | 0 | 0 | 111.1 | M143 I237 V238 F254 L261 S262 | M143-V258 HydrophobicContact CE-CG1 3.94Å; I237-V258 HydrophobicContact CB-CG1 4.39Å; I237-V258 HydrophobicContact CG2-CG1 4.45Å; V238-V258 HydrophobicContact CG2-CB 3.72Å; V238-V258 HydrophobicContact CG2-CG1 3.86Å; F254-V258 HydrophobicContact CD1-CG2 3.87Å; F254-V258 WeakPolarHBondContact O-CA 3.42Å; F254-V258 WeakPolarHBondContact O-CB 3.49Å; F254-V258 PolarHBondContact O-N 2.83Å; V258-L261 PolarHBondContact O-N 3.32Å; V258-S262 PolarHBondContact O-N 3.39Å; V258-S262 VanDerWaalsContact O-N 3.13Å |
| 259 | G | 89.6 | Confident | 90.3 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -65.6 | -43.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | F254 W255 L261 S262 T263 M292 | F254-G259 PolarHBondContact O-N 2.8Å; W255-G259 CarbonylContact O-C 3.49Å; W255-G259 WeakPolarHBondContact O-CA 3.47Å; W255-G259 PolarHBondContact O-N 3.11Å; G259-L261 PolarHBondContact O-N 3.29Å; G259-S262 PolarHBondContact O-N 3.07Å; G259-T263 PolarHBondContact O-N 2.83Å; G259-T263 PolarHBondContact O-OG1 3.12Å; G259-T263 VanDerWaalsContact O-OG1 3.12Å; G259-M292 VanDerWaalsContact C-SD 3.55Å |
| 260 | G | 91.3 | Very high | 90.4 | Very high | 13 Ų | 13 | 41 Ų | 41 | 13% | 0.134 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -63.5 | -37.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | W255 L256 T263 L264 | W255-G260 PolarHBondContact O-N 3.06Å; W255-G260 VanDerWaalsContact O-N 3.12Å; L256-G260 WeakPolarHBondContact O-CA 3.37Å; L256-G260 PolarHBondContact O-N 2.83Å; G260-T263 VanDerWaalsContact C-OG1 3.27Å; G260-T263 VanDerWaalsContact CA-OG1 3.23Å; G260-T263 WeakPolarHBondContact CA-OG1 3.28Å; G260-T263 PolarHBondContact O-N 3.33Å; G260-T263 PolarHBondContact O-OG1 3.45Å; G260-L264 WeakPolarHBondContact O-CB 3.46Å; G260-L264 VanDerWaalsContact O-CG 3.27Å; G260-L264 WeakPolarHBondContact O-CG 3.35Å; G260-L264 PolarHBondContact O-N 3.22Å |
| 261 | L | 90.3 | Very high | 90.4 | Very high | 62 Ų | 62 | 41.2 Ų | 41.2 | 33% | 0.325 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -70.2 | -40.1 | 179.2 | -169.4 | 65.9 | 0 | 0 | 0 | 112.2 | M143 P145 L257 V258 G259 L264 R265 | M143-L261 WeakPolarHBondContact O-CD2 3.45Å; M143-L261 WeakPolarHBondContact O-CG 3.46Å; P145-L261 HydrophobicContact CG-CD1 3.92Å; L257-L261 WeakPolarHBondContact O-CB 3.47Å; L257-L261 PolarHBondContact O-N 3.45Å; V258-L261 PolarHBondContact O-N 3.32Å; G259-L261 PolarHBondContact O-N 3.29Å; L261-L264 PolarHBondContact O-N 3.08Å; L261-R265 PolarHBondContact O-N 3.15Å |
| 262 | S | 91.1 | Very high | 90.2 | Very high | 2 Ų | 2 | 42.3 Ų | 42.3 | 1% | 0.014 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.1 | -45.9 | 172.7 | -177.3 | 0 | 0 | 0 | 0 | 111.7 | G231 V258 G259 L264 R265 M266 | G231-S262 VanDerWaalsContact CA-OG 3.26Å; G231-S262 WeakPolarHBondContact CA-OG 3.24Å; G231-S262 PolarHBondContact O-OG 3.4Å; V258-S262 PolarHBondContact O-N 3.39Å; V258-S262 VanDerWaalsContact O-N 3.13Å; G259-S262 PolarHBondContact O-N 3.07Å; S262-L264 PolarHBondContact O-N 3.13Å; S262-R265 PolarHBondContact O-N 2.91Å; S262-M266 WeakPolarHBondContact O-CG 3.38Å; S262-M266 PolarHBondContact O-N 2.9Å |
| 263 | T | 92.4 | Very high | 89.9 | Confident | 12 Ų | 12 | 39.9 Ų | 39.9 | 7% | 0.074 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -62 | -42.4 | 175.6 | 45.8 | 0 | 0 | 0 | 0 | 112.8 | G259 G260 R265 M266 V267 H291 M292 | G259-T263 PolarHBondContact O-N 2.83Å; G259-T263 PolarHBondContact O-OG1 3.12Å; G259-T263 VanDerWaalsContact O-OG1 3.12Å; G260-T263 VanDerWaalsContact C-OG1 3.27Å; G260-T263 VanDerWaalsContact CA-OG1 3.23Å; G260-T263 WeakPolarHBondContact CA-OG1 3.28Å; G260-T263 PolarHBondContact O-N 3.33Å; G260-T263 PolarHBondContact O-OG1 3.45Å; T263-R265 VanDerWaalsContact C-N 3.29Å; T263-R265 PolarHBondContact O-N 3.14Å; T263-M266 PolarHBondContact O-N 3.03Å; T263-M266 VanDerWaalsContact O-N 3.14Å; T263-V267 WeakPolarHBondContact O-CB 3.25Å; T263-V267 WeakPolarHBondContact O-CG2 3.37Å; T263-V267 PolarHBondContact O-N 3.25Å; T263-H291 HydrophobicContact CG2-CB 3.79Å; T263-H291 WeakPolarHBondContact CG2-CD2 3.32Å; T263-M292 HydrophobicContact CG2-CG 3.8Å; T263-M292 HydrophobicContact CG2-SD 3.6Å; T263-M292 VanDerWaalsContact CG2-SD 3.6Å |
| 264 | L | 91.1 | Very high | 89.7 | Confident | 103 Ų | 103 | 35.1 Ų | 35.1 | 54% | 0.539 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -57.6 | -41.8 | 178.3 | -82.5 | 167.2 | 0 | 0 | 0 | 112.2 | G260 L261 S262 V267 A268 | G260-L264 WeakPolarHBondContact O-CB 3.46Å; G260-L264 VanDerWaalsContact O-CG 3.27Å; G260-L264 WeakPolarHBondContact O-CG 3.35Å; G260-L264 PolarHBondContact O-N 3.22Å; L261-L264 PolarHBondContact O-N 3.08Å; S262-L264 PolarHBondContact O-N 3.13Å; L264-V267 PolarHBondContact O-N 3.06Å; L264-A268 WeakPolarHBondContact O-CB 3.39Å; L264-A268 PolarHBondContact O-N 2.86Å |
| 265 | R | 88.4 | Confident | 89.3 | Confident | 30 Ų | 30 | 37.9 Ų | 37.9 | 11% | 0.113 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.1 | -45.8 | 175.8 | 178.3 | -92.2 | 177.3 | 162.5 | 0.4 | 111.2 | P145 L227 L261 S262 T263 V267 A268 V269 | P145-R265 HydrophobicContact CB-CB 4.43Å; L227-R265 VanDerWaalsContact CD1-NH1 3.33Å; L261-R265 PolarHBondContact O-N 3.15Å; S262-R265 PolarHBondContact O-N 2.91Å; T263-R265 VanDerWaalsContact C-N 3.29Å; T263-R265 PolarHBondContact O-N 3.14Å; R265-V267 PolarHBondContact O-N 3.23Å; R265-A268 PolarHBondContact O-N 3.24Å; R265-V269 WeakPolarHBondContact O-CG2 3.25Å; R265-V269 PolarHBondContact O-N 2.88Å; R265-V269 VanDerWaalsContact O-N 3.12Å |
| 266 | M | 89.5 | Confident | 89 | Confident | 1 Ų | 1 | 36 Ų | 36 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.8 | -40.6 | 179.4 | -62.9 | 169.6 | 44.7 | 0 | 0 | 112 | L227 L228 S262 T263 V269 L270 L287 H291 | L227-M266 HydrophobicContact CD1-CG 4.38Å; L227-M266 HydrophobicContact CD2-CB 4.42Å; L227-M266 HydrophobicContact CG-CB 4.42Å; L227-M266 HydrophobicContact CG-CG 4.13Å; L228-M266 HydrophobicContact CD1-CE 3.51Å; L228-M266 HydrophobicContact CG-CE 4.32Å; S262-M266 WeakPolarHBondContact O-CG 3.38Å; S262-M266 PolarHBondContact O-N 2.9Å; T263-M266 PolarHBondContact O-N 3.03Å; T263-M266 VanDerWaalsContact O-N 3.14Å; M266-V269 PolarHBondContact O-N 3.34Å; M266-L270 PolarHBondContact O-N 3.39Å; M266-L270 VanDerWaalsContact O-N 3.13Å; M266-L287 HydrophobicContact CB-CD2 3.91Å; M266-L287 HydrophobicContact CE-CD1 3.66Å; M266-L287 HydrophobicContact CE-CD2 3.8Å; M266-L287 HydrophobicContact CE-CG 3.93Å; M266-H291 VanDerWaalsContact SD-CD2 3.6Å |
| 267 | V | 91.2 | Very high | 88.7 | Confident | 32 Ų | 32 | 35.7 Ų | 35.7 | 19% | 0.194 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -62.8 | -45.7 | 174.3 | 167.3 | 0 | 0 | 0 | 0 | 111 | T263 L264 R265 V269 L270 V271 C284 A288 | T263-V267 WeakPolarHBondContact O-CB 3.25Å; T263-V267 WeakPolarHBondContact O-CG2 3.37Å; T263-V267 PolarHBondContact O-N 3.25Å; L264-V267 PolarHBondContact O-N 3.06Å; R265-V267 PolarHBondContact O-N 3.23Å; V267-V269 VanDerWaalsContact C-N 3.28Å; V267-V269 PolarHBondContact O-N 3.45Å; V267-L270 PolarHBondContact O-N 3.32Å; V267-L270 VanDerWaalsContact O-N 3.14Å; V267-V271 HydrophobicContact CG1-CG2 4.16Å; V267-V271 WeakPolarHBondContact O-CG2 3.33Å; V267-V271 PolarHBondContact O-N 2.9Å; V267-C284 HydrophobicContact CB-CB 4.48Å; V267-C284 HydrophobicContact CG1-CB 3.83Å; V267-C284 HydrophobicContact CG2-CB 4.19Å; V267-A288 HydrophobicContact CG2-CB 4.12Å |
| 268 | A | 88.4 | Confident | 88.5 | Confident | 23 Ų | 23 | 36.4 Ų | 36.4 | 19% | 0.19 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -58.2 | -41.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | L264 R265 S272 | L264-A268 WeakPolarHBondContact O-CB 3.39Å; L264-A268 PolarHBondContact O-N 2.86Å; R265-A268 PolarHBondContact O-N 3.24Å; A268-S272 PolarHBondContact O-N 3.47Å |
| 269 | V | 87 | Confident | 88.4 | Confident | 1 Ų | 1 | 38.5 Ų | 38.5 | 1% | 0.006 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.2 | -48.6 | 174.9 | 171.9 | 0 | 0 | 0 | 0 | 111.1 | Q153 I155 L227 R265 M266 V267 V271 S272 R273 | Q153-V269 HydrophobicContact CB-CG2 4.3Å; I155-V269 HydrophobicContact CD1-CG1 3.34Å; I155-V269 HydrophobicContact CG1-CG1 3.74Å; L227-V269 HydrophobicContact CD1-CB 4.19Å; L227-V269 HydrophobicContact CD1-CG1 4.09Å; L227-V269 HydrophobicContact CD1-CG2 4.07Å; L227-V269 HydrophobicContact CD2-CB 4.48Å; L227-V269 HydrophobicContact CD2-CG1 4.18Å; R265-V269 WeakPolarHBondContact O-CG2 3.25Å; R265-V269 PolarHBondContact O-N 2.88Å; R265-V269 VanDerWaalsContact O-N 3.12Å; M266-V269 PolarHBondContact O-N 3.34Å; V267-V269 VanDerWaalsContact C-N 3.28Å; V267-V269 PolarHBondContact O-N 3.45Å; V269-V271 PolarHBondContact O-N 3.28Å; V269-S272 PolarHBondContact O-N 2.76Å; V269-S272 PolarHBondContact O-OG 3.01Å; V269-R273 WeakPolarHBondContact O-CG 3.49Å; V269-R273 PolarHBondContact O-N 3.36Å |
| 270 | L | 87.8 | Confident | 88.5 | Confident | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -66.6 | -37.6 | -179.2 | -73 | -171.1 | 0 | 0 | 0 | 113.4 | I219 M224 M266 V267 S272 R273 T274 L283 L287 | I219-L270 HydrophobicContact CD1-CD2 3.97Å; M224-L270 HydrophobicContact SD-CD2 4.04Å; M266-L270 PolarHBondContact O-N 3.39Å; M266-L270 VanDerWaalsContact O-N 3.13Å; V267-L270 PolarHBondContact O-N 3.32Å; V267-L270 VanDerWaalsContact O-N 3.14Å; L270-S272 PolarHBondContact O-N 2.91Å; L270-R273 PolarHBondContact O-N 3.07Å; L270-R273 VanDerWaalsContact O-N 3.09Å; L270-T274 PolarHBondContact O-N 3.39Å; L270-T274 VanDerWaalsContact O-N 3.11Å; L270-T274 PolarHBondContact O-OG1 3.23Å; L270-L283 HydrophobicContact CD1-CD2 4.02Å; L270-L283 HydrophobicContact CD1-CG 3.97Å; L270-L283 HydrophobicContact CD2-CD2 4.31Å; L270-L287 HydrophobicContact CD1-CB 4.39Å; L270-L287 HydrophobicContact CD1-CD2 3.4Å; L270-L287 VanDerWaalsContact CD1-CD2 3.4Å; L270-L287 HydrophobicContact CD1-CG 4.46Å; L270-L287 HydrophobicContact CG-CD2 4.26Å |
| 271 | V | 88.5 | Confident | 88.5 | Confident | 39 Ų | 39 | 48.8 Ų | 48.8 | 24% | 0.236 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.5 | -38.1 | 174.9 | 170.9 | 0 | 0 | 0 | 0 | 110.9 | V267 V269 R273 T274 R280 C284 | V267-V271 HydrophobicContact CG1-CG2 4.16Å; V267-V271 WeakPolarHBondContact O-CG2 3.33Å; V267-V271 PolarHBondContact O-N 2.9Å; V269-V271 PolarHBondContact O-N 3.28Å; V271-R273 PolarHBondContact O-N 2.93Å; V271-T274 PolarHBondContact O-OG1 3.47Å; V271-R280 PolarHBondContact O-NE 2.98Å; V271-R280 PolarHBondContact O-NH2 2.86Å; V271-C284 VanDerWaalsContact CG2-SG 3.59Å |
| 272 | S | 85.4 | Confident | 88.6 | Confident | 24 Ų | 24 | 50.3 Ų | 50.3 | 17% | 0.168 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -68.4 | -20.2 | 178 | 78.2 | 0 | 0 | 0 | 0 | 114 | A268 V269 L270 | A268-S272 PolarHBondContact O-N 3.47Å; V269-S272 PolarHBondContact O-N 2.76Å; V269-S272 PolarHBondContact O-OG 3.01Å; L270-S272 PolarHBondContact O-N 2.91Å |
| 273 | R | 83.9 | Confident | 88.7 | Confident | 62 Ų | 62 | 50.2 Ų | 50.2 | 23% | 0.234 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -106.6 | -7.8 | -174.4 | -63.6 | -66.3 | -173.7 | 156.8 | -0.2 | 114.3 | P152 Q153 V269 L270 V271 | P152-R273 VanDerWaalsContact CB-CZ 3.42Å; Q153-R273 PolarHBondContact O-NH2 3.15Å; V269-R273 WeakPolarHBondContact O-CG 3.49Å; V269-R273 PolarHBondContact O-N 3.36Å; L270-R273 PolarHBondContact O-N 3.07Å; L270-R273 VanDerWaalsContact O-N 3.09Å; V271-R273 PolarHBondContact O-N 2.93Å |
| 274 | T | 87.7 | Confident | 88.7 | Confident | 1 Ų | 1 | 50.1 Ų | 50.1 | 1% | 0.006 | 28% | 0.275 | C | S | . | . | trans | -107 | 141.4 | 179.1 | 40.9 | 0 | 0 | 0 | 0 | 109.2 | A217 L270 V271 R280 L283 | A217-T274 HydrophobicContact CB-CG2 3.52Å; L270-T274 PolarHBondContact O-N 3.39Å; L270-T274 VanDerWaalsContact O-N 3.11Å; L270-T274 PolarHBondContact O-OG1 3.23Å; V271-T274 PolarHBondContact O-OG1 3.47Å; T274-R280 PolarHBondContact O-NE 3.23Å; T274-R280 PolarHBondContact O-NH2 3.48Å; T274-R280 WeakPolarHBondContact OG1-CG 3.35Å; T274-L283 HydrophobicContact CG2-CD2 3.68Å | ||
| 275 | V | 82.3 | Confident | 88.8 | Confident | 112 Ų | 112 | 47.1 Ų | 47.1 | 68% | 0.679 | 27% | 0.269 | S | S | * | . | trans | -98 | -34.6 | -176.3 | -73.4 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 276 | G | 85.6 | Confident | 89.2 | Confident | 13 Ų | 13 | 47.8 Ų | 47.8 | 13% | 0.134 | 28% | 0.277 | C | S | . | . | trans | -87.7 | 138 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114 | R280 | G276-R280 VanDerWaalsContact O-CB 3.27Å; G276-R280 WeakPolarHBondContact O-CB 3.48Å; G276-R280 WeakPolarHBondContact O-CD 3.33Å; G276-R280 WeakPolarHBondContact O-CG 3.32Å; G276-R280 PolarHBondContact O-N 3.17Å | ||
| 277 | P | 86.6 | Confident | 89.4 | Confident | 102 Ų | 102 | 47.9 Ų | 47.9 | 66% | 0.662 | 28% | 0.277 | S | S | * | . | H | α-helix | trans | -67.5 | -37.9 | 179.8 | 26.2 | -33.6 | 0 | 0 | 0 | 113.4 | R280 L281 | P277-R280 WeakPolarHBondContact O-CB 3.47Å; P277-L281 PolarHBondContact O-N 2.67Å; P277-L281 VanDerWaalsContact O-N 3.11Å |
| 278 | T | 88.9 | Confident | 89.6 | Confident | 112 Ų | 112 | 47.7 Ų | 47.7 | 69% | 0.687 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -70.5 | -42.7 | 176.8 | 50.1 | 0 | 0 | 0 | 0 | 111.6 | L281 L282 | T278-L281 PolarHBondContact O-N 2.77Å; T278-L282 PolarHBondContact O-N 3.24Å |
| 279 | Q | 90 | Very high | 89.9 | Confident | 64 Ų | 64 | 48.7 Ų | 48.7 | 30% | 0.299 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.6 | -41.8 | 174.5 | -69.8 | 170.8 | -22.8 | 0 | 0 | 111.8 | C215 L282 L283 | C215-Q279 HydrophobicContact CB-CB 4.04Å; C215-Q279 HydrophobicContact CB-CG 4.29Å; C215-Q279 PolarHBondContact O-OE1 2.9Å; Q279-L282 PolarHBondContact O-N 3.42Å; Q279-L283 VanDerWaalsContact O-CB 3.31Å; Q279-L283 WeakPolarHBondContact O-CB 3.29Å; Q279-L283 PolarHBondContact O-N 2.78Å |
| 280 | R | 90.7 | Very high | 90.3 | Very high | 92 Ų | 92 | 51.6 Ų | 51.6 | 35% | 0.347 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -54.9 | -51.9 | 172.2 | -84.4 | 165.6 | -179.5 | -171.5 | 4.7 | 111.2 | V271 T274 G276 P277 L282 C284 | V271-R280 PolarHBondContact O-NE 2.98Å; V271-R280 PolarHBondContact O-NH2 2.86Å; T274-R280 PolarHBondContact O-NE 3.23Å; T274-R280 PolarHBondContact O-NH2 3.48Å; T274-R280 WeakPolarHBondContact OG1-CG 3.35Å; G276-R280 VanDerWaalsContact O-CB 3.27Å; G276-R280 WeakPolarHBondContact O-CB 3.48Å; G276-R280 WeakPolarHBondContact O-CD 3.33Å; G276-R280 WeakPolarHBondContact O-CG 3.32Å; G276-R280 PolarHBondContact O-N 3.17Å; P277-R280 WeakPolarHBondContact O-CB 3.47Å; R280-L282 PolarHBondContact O-N 3.48Å; R280-C284 WeakPolarHBondContact O-CB 3.27Å; R280-C284 PolarHBondContact O-N 2.79Å; R280-C284 PolarHBondContact O-SG 3.47Å |
| 281 | L | 91.4 | Very high | 90.7 | Very high | 137 Ų | 137 | 51.6 Ų | 51.6 | 72% | 0.717 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -62.4 | -44.5 | -177.9 | -172.9 | 68.5 | 0 | 0 | 0 | 111.3 | P277 T278 G285 | P277-L281 PolarHBondContact O-N 2.67Å; P277-L281 VanDerWaalsContact O-N 3.11Å; T278-L281 PolarHBondContact O-N 2.77Å; L281-G285 WeakPolarHBondContact O-CA 3.38Å; L281-G285 PolarHBondContact O-N 3.41Å |
| 282 | L | 93.1 | Very high | 90.9 | Very high | 95 Ų | 95 | 51 Ų | 51 | 50% | 0.497 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.3 | -49.9 | -180 | -172.6 | 141.4 | 0 | 0 | 0 | 111.8 | L211 T278 Q279 R280 T286 | L211-L282 HydrophobicContact CD2-CD2 4.35Å; T278-L282 PolarHBondContact O-N 3.24Å; Q279-L282 PolarHBondContact O-N 3.42Å; R280-L282 PolarHBondContact O-N 3.48Å; L282-T286 WeakPolarHBondContact O-CB 3.21Å; L282-T286 VanDerWaalsContact O-CG2 3.23Å; L282-T286 WeakPolarHBondContact O-CG2 3Å; L282-T286 PolarHBondContact O-N 3.36Å; L282-T286 PolarHBondContact O-OG1 3.34Å |
| 283 | L | 92.9 | Very high | 91.3 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -67.7 | -45.2 | -178.2 | -173.5 | 68.6 | 0 | 0 | 0 | 112 | I208 L211 A212 A217 L270 T274 Q279 T286 L287 | I208-L283 HydrophobicContact CG2-CD1 4.02Å; L211-L283 HydrophobicContact CB-CD1 3.77Å; A212-L283 HydrophobicContact CB-CD1 4.14Å; A212-L283 HydrophobicContact CB-CD2 4.22Å; A217-L283 HydrophobicContact CB-CD2 4.11Å; L270-L283 HydrophobicContact CD1-CD2 4.02Å; L270-L283 HydrophobicContact CD1-CG 3.97Å; L270-L283 HydrophobicContact CD2-CD2 4.31Å; T274-L283 HydrophobicContact CG2-CD2 3.68Å; Q279-L283 VanDerWaalsContact O-CB 3.31Å; Q279-L283 WeakPolarHBondContact O-CB 3.29Å; Q279-L283 PolarHBondContact O-N 2.78Å; L283-T286 PolarHBondContact O-OG1 3.37Å; L283-L287 WeakPolarHBondContact O-CB 3.29Å; L283-L287 PolarHBondContact O-N 2.88Å; L283-L287 VanDerWaalsContact O-N 3.11Å |
| 284 | C | 92.6 | Very high | 91.8 | Very high | 10 Ų | 10 | 52.9 Ų | 52.9 | 7% | 0.068 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -72.1 | -38.6 | -179.5 | -62.3 | 0 | 0 | 0 | 0 | 111.8 | V267 V271 R280 A288 | V267-C284 HydrophobicContact CB-CB 4.48Å; V267-C284 HydrophobicContact CG1-CB 3.83Å; V267-C284 HydrophobicContact CG2-CB 4.19Å; V271-C284 VanDerWaalsContact CG2-SG 3.59Å; R280-C284 WeakPolarHBondContact O-CB 3.27Å; R280-C284 PolarHBondContact O-N 2.79Å; R280-C284 PolarHBondContact O-SG 3.47Å; C284-A288 VanDerWaalsContact O-CB 3.23Å; C284-A288 WeakPolarHBondContact O-CB 3.39Å; C284-A288 PolarHBondContact O-N 2.86Å |
| 285 | G | 93.4 | Very high | 92 | Very high | 40 Ų | 40 | 52.8 Ų | 52.8 | 41% | 0.412 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -65.1 | -45.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | L281 A288 A289 | L281-G285 WeakPolarHBondContact O-CA 3.38Å; L281-G285 PolarHBondContact O-N 3.41Å; G285-A288 PolarHBondContact O-N 3.36Å; G285-A289 VanDerWaalsContact O-CB 3.28Å; G285-A289 WeakPolarHBondContact O-CB 3.42Å; G285-A289 PolarHBondContact O-N 2.99Å |
| 286 | T | 95.3 | Very high | 92.4 | Very high | 44 Ų | 44 | 49.6 Ų | 49.6 | 27% | 0.27 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -63.4 | -43.8 | 176 | 50.7 | 0 | 0 | 0 | 0 | 111.9 | L211 L282 L283 L290 | L211-T286 HydrophobicContact CD1-CG2 4.3Å; L282-T286 WeakPolarHBondContact O-CB 3.21Å; L282-T286 VanDerWaalsContact O-CG2 3.23Å; L282-T286 WeakPolarHBondContact O-CG2 3Å; L282-T286 PolarHBondContact O-N 3.36Å; L282-T286 PolarHBondContact O-OG1 3.34Å; L283-T286 PolarHBondContact O-OG1 3.37Å; T286-L290 WeakPolarHBondContact O-CB 3.47Å; T286-L290 WeakPolarHBondContact O-CG 3.47Å; T286-L290 PolarHBondContact O-N 2.75Å |
| 287 | L | 95.2 | Very high | 92.6 | Very high | 2 Ų | 2 | 53.5 Ų | 53.5 | 1% | 0.01 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -60.8 | -49.7 | 175.3 | 178.5 | 71 | 0 | 0 | 0 | 112.2 | I208 L228 M266 L270 L283 A289 L290 H291 | I208-L287 HydrophobicContact CD1-CB 4.08Å; I208-L287 HydrophobicContact CD1-CD1 4.2Å; I208-L287 HydrophobicContact CG1-CD1 3.89Å; I208-L287 HydrophobicContact CG2-CD1 4.29Å; L228-L287 HydrophobicContact CD1-CD1 3.54Å; M266-L287 HydrophobicContact CB-CD2 3.91Å; M266-L287 HydrophobicContact CE-CD1 3.66Å; M266-L287 HydrophobicContact CE-CD2 3.8Å; M266-L287 HydrophobicContact CE-CG 3.93Å; L270-L287 HydrophobicContact CD1-CB 4.39Å; L270-L287 HydrophobicContact CD1-CD2 3.4Å; L270-L287 VanDerWaalsContact CD1-CD2 3.4Å; L270-L287 HydrophobicContact CD1-CG 4.46Å; L270-L287 HydrophobicContact CG-CD2 4.26Å; L283-L287 WeakPolarHBondContact O-CB 3.29Å; L283-L287 PolarHBondContact O-N 2.88Å; L283-L287 VanDerWaalsContact O-N 3.11Å; L287-A289 VanDerWaalsContact C-N 3.34Å; L287-A289 PolarHBondContact O-N 3.3Å; L287-L290 PolarHBondContact O-N 3.36Å; L287-H291 WeakPolarHBondContact O-CB 3.35Å; L287-H291 PolarHBondContact O-N 3.31Å |
| 288 | A | 94.9 | Very high | 92.8 | Very high | 28 Ų | 28 | 48.6 Ų | 48.6 | 23% | 0.231 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61.9 | -44.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111 | V267 C284 G285 H291 M292 | V267-A288 HydrophobicContact CG2-CB 4.12Å; C284-A288 VanDerWaalsContact O-CB 3.23Å; C284-A288 WeakPolarHBondContact O-CB 3.39Å; C284-A288 PolarHBondContact O-N 2.86Å; G285-A288 PolarHBondContact O-N 3.36Å; A288-H291 PolarHBondContact O-N 2.94Å; A288-M292 WeakPolarHBondContact O-CB 3.27Å; A288-M292 VanDerWaalsContact O-CG 3.29Å; A288-M292 WeakPolarHBondContact O-CG 3.2Å; A288-M292 PolarHBondContact O-N 2.85Å |
| 289 | A | 95.3 | Very high | 92.5 | Very high | 45 Ų | 45 | 44.2 Ų | 44.2 | 37% | 0.372 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -58.4 | -55.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | G285 L287 H291 M292 L293 | G285-A289 VanDerWaalsContact O-CB 3.28Å; G285-A289 WeakPolarHBondContact O-CB 3.42Å; G285-A289 PolarHBondContact O-N 2.99Å; L287-A289 VanDerWaalsContact C-N 3.34Å; L287-A289 PolarHBondContact O-N 3.3Å; A289-H291 VanDerWaalsContact C-N 3.33Å; A289-H291 PolarHBondContact O-N 2.87Å; A289-M292 PolarHBondContact O-N 2.75Å; A289-L293 HydrophobicContact CB-CD1 4.16Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.29Å; A289-L293 WeakPolarHBondContact O-CD1 3.4Å; A289-L293 PolarHBondContact O-N 3.49Å |
| 290 | L | 95.6 | Very high | 92.1 | Very high | 61 Ų | 61 | 44.7 Ų | 44.7 | 32% | 0.319 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -59.9 | -40.4 | -178.6 | -72.4 | 174.6 | 0 | 0 | 0 | 112.8 | V204 F207 I208 T286 L287 F294 | V204-L290 HydrophobicContact CG1-CB 4.23Å; V204-L290 HydrophobicContact CG1-CD1 4.03Å; F207-L290 HydrophobicContact CD1-CD1 3.78Å; F207-L290 HydrophobicContact CE1-CD1 3.93Å; I208-L290 HydrophobicContact CD1-CD1 4.08Å; T286-L290 WeakPolarHBondContact O-CB 3.47Å; T286-L290 WeakPolarHBondContact O-CG 3.47Å; T286-L290 PolarHBondContact O-N 2.75Å; L287-L290 PolarHBondContact O-N 3.36Å; L290-F294 VanDerWaalsContact O-CB 3.24Å; L290-F294 WeakPolarHBondContact O-CB 3.39Å; L290-F294 PolarHBondContact O-N 2.95Å |
| 291 | H | 94.9 | Very high | 91 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -71.9 | -40.3 | -179.6 | -162.4 | 53.8 | 0 | 0 | 0 | 112.5 | Y200 G231 H235 T263 M266 L287 A288 A289 | Y200-H291 AromaticContact CZ-ND1 3.78Å; Y200-H291 WeakPolarHBondContact OH-CA 3.25Å; Y200-H291 PolarHBondContact OH-ND1 3.44Å; G231-H291 PolarHBondContact O-NE2 2.96Å; H235-H291 AromaticContact CE1-CD2 3.57Å; H235-H291 AromaticContact CE1-CE1 3.15Å; H235-H291 PolarHBondContact CE1-CE1 3.19Å; H235-H291 AromaticContact CE1-CG 3.75Å; H235-H291 AromaticContact CE1-ND1 3.49Å; H235-H291 PolarHBondContact CE1-ND1 3.43Å; H235-H291 AromaticContact CE1-NE2 3.18Å; H235-H291 PolarHBondContact CE1-NE2 2.95Å; H235-H291 AromaticContact ND1-CE1 3.68Å; H235-H291 AromaticContact ND1-NE2 3.72Å; H235-H291 AromaticContact NE2-CE1 3.79Å; H235-H291 AromaticContact NE2-ND1 3.75Å; H235-H291 PolarHBondContact NE2-O 2.94Å; T263-H291 HydrophobicContact CG2-CB 3.79Å; T263-H291 WeakPolarHBondContact CG2-CD2 3.32Å; M266-H291 VanDerWaalsContact SD-CD2 3.6Å; L287-H291 WeakPolarHBondContact O-CB 3.35Å; L287-H291 PolarHBondContact O-N 3.31Å; A288-H291 PolarHBondContact O-N 2.94Å; A289-H291 VanDerWaalsContact C-N 3.33Å; A289-H291 PolarHBondContact O-N 2.87Å |
| 292 | M | 94 | Very high | 89.9 | Confident | 26 Ų | 26 | 35.4 Ų | 35.4 | 13% | 0.128 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -71.1 | -42.1 | 175.9 | -69.1 | -53.9 | -78.7 | 0 | 0 | 112.6 | W255 G259 T263 A288 A289 F294 L295 L296 | W255-M292 HydrophobicContact CD2-CE 3.73Å; W255-M292 HydrophobicContact CE3-CE 4.22Å; W255-M292 HydrophobicContact CG-CE 4.2Å; W255-M292 HydrophobicContact CH2-CE 4.11Å; W255-M292 HydrophobicContact CZ2-CB 4.03Å; W255-M292 HydrophobicContact CZ2-CE 3.6Å; W255-M292 HydrophobicContact CZ3-CE 4.39Å; W255-M292 PolarHBondContact NE1-O 3.25Å; W255-M292 VanDerWaalsContact O-CE 3.3Å; W255-M292 WeakPolarHBondContact O-CE 3.39Å; G259-M292 VanDerWaalsContact C-SD 3.55Å; T263-M292 HydrophobicContact CG2-CG 3.8Å; T263-M292 HydrophobicContact CG2-SD 3.6Å; T263-M292 VanDerWaalsContact CG2-SD 3.6Å; A288-M292 WeakPolarHBondContact O-CB 3.27Å; A288-M292 VanDerWaalsContact O-CG 3.29Å; A288-M292 WeakPolarHBondContact O-CG 3.2Å; A288-M292 PolarHBondContact O-N 2.85Å; A289-M292 PolarHBondContact O-N 2.75Å; M292-F294 VanDerWaalsContact C-N 3.28Å; M292-F294 PolarHBondContact O-N 3.2Å; M292-L295 PolarHBondContact O-N 2.95Å; M292-L296 PolarHBondContact O-N 3.38Å |
| 293 | L | 93.5 | Very high | 88.8 | Confident | 110 Ų | 110 | 33 Ų | 33 | 58% | 0.576 | 19% | 0.188 | S | C | * | . | H | α-helix | trans | -64.9 | -34.7 | 176.7 | -89.6 | 94.3 | 0 | 0 | 0 | 111.3 | A289 L295 L296 Y297 | A289-L293 HydrophobicContact CB-CD1 4.16Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.29Å; A289-L293 WeakPolarHBondContact O-CD1 3.4Å; A289-L293 PolarHBondContact O-N 3.49Å; L293-L295 VanDerWaalsContact C-N 3.29Å; L293-L295 PolarHBondContact O-N 3.03Å; L293-L296 WeakPolarHBondContact O-CB 3.4Å; L293-L296 PolarHBondContact O-N 3.26Å; L293-Y297 WeakPolarHBondContact O-CB 3.44Å; L293-Y297 PolarHBondContact O-N 3.43Å |
| 294 | F | 94.1 | Very high | 87.6 | Confident | 16 Ų | 16 | 39.5 Ų | 39.5 | 7% | 0.07 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -60.7 | -38.9 | 176.9 | -179.4 | -118.5 | 0 | 0 | 0 | 112.4 | L169 Y200 L232 H235 L290 M292 Y297 L298 | L169-F294 HydrophobicContact CD2-CE1 4.06Å; L169-F294 HydrophobicContact CD2-CZ 4.39Å; Y200-F294 VanDerWaalsContact CB-CE2 3.4Å; Y200-F294 VanDerWaalsContact CB-CZ 3.47Å; Y200-F294 AromaticContact CD1-CD1 3.6Å; Y200-F294 HydrophobicContact CD1-CD1 3.6Å; Y200-F294 HydrophobicContact CD1-CD2 4.39Å; Y200-F294 AromaticContact CD1-CE1 3.39Å; Y200-F294 HydrophobicContact CD1-CE1 3.39Å; Y200-F294 HydrophobicContact CD1-CE2 4.23Å; Y200-F294 HydrophobicContact CD1-CG 4.1Å; Y200-F294 AromaticContact CD1-CZ 3.73Å; Y200-F294 HydrophobicContact CD1-CZ 3.73Å; Y200-F294 HydrophobicContact CD2-CB 3.78Å; Y200-F294 AromaticContact CD2-CD1 3.73Å; Y200-F294 HydrophobicContact CD2-CD1 3.73Å; Y200-F294 AromaticContact CD2-CD2 3.31Å; Y200-F294 HydrophobicContact CD2-CD2 3.31Å; Y200-F294 HydrophobicContact CD2-CE1 4.08Å; Y200-F294 AromaticContact CD2-CE2 3.72Å; Y200-F294 HydrophobicContact CD2-CE2 3.72Å; Y200-F294 AromaticContact CD2-CG 3.31Å; Y200-F294 HydrophobicContact CD2-CG 3.31Å; Y200-F294 HydrophobicContact CD2-CZ 4.08Å; Y200-F294 AromaticContact CE1-CD1 3.63Å; Y200-F294 HydrophobicContact CE1-CD1 3.63Å; Y200-F294 AromaticContact CE1-CE1 3.84Å; Y200-F294 HydrophobicContact CE1-CE1 3.84Å; Y200-F294 HydrophobicContact CE1-CG 4.19Å; Y200-F294 HydrophobicContact CE2-CB 3.41Å; Y200-F294 VanDerWaalsContact CE2-CB 3.41Å; Y200-F294 AromaticContact CE2-CD1 3.73Å; Y200-F294 HydrophobicContact CE2-CD1 3.73Å; Y200-F294 AromaticContact CE2-CD2 3.9Å; Y200-F294 HydrophobicContact CE2-CD2 3.9Å; Y200-F294 HydrophobicContact CE2-CE1 4.45Å; Y200-F294 AromaticContact CE2-CG 3.4Å; Y200-F294 HydrophobicContact CE2-CG 3.4Å; Y200-F294 AromaticContact CG-CD1 3.67Å; Y200-F294 HydrophobicContact CG-CD1 3.67Å; Y200-F294 AromaticContact CG-CD2 3.6Å; Y200-F294 HydrophobicContact CG-CD2 3.6Å; Y200-F294 AromaticContact CG-CE1 3.55Å; Y200-F294 HydrophobicContact CG-CE1 3.55Å; Y200-F294 AromaticContact CG-CE2 3.49Å; Y200-F294 HydrophobicContact CG-CE2 3.49Å; Y200-F294 VanDerWaalsContact CG-CE2 3.49Å; Y200-F294 AromaticContact CG-CG 3.69Å; Y200-F294 HydrophobicContact CG-CG 3.69Å; Y200-F294 AromaticContact CG-CZ 3.45Å; Y200-F294 HydrophobicContact CG-CZ 3.45Å; Y200-F294 VanDerWaalsContact CG-CZ 3.45Å; Y200-F294 AromaticContact CZ-CD1 3.69Å; Y200-F294 AromaticContact CZ-CG 3.87Å; L232-F294 HydrophobicContact CD2-CD1 4.08Å; L232-F294 HydrophobicContact CD2-CE1 3.74Å; H235-F294 AromaticContact CD2-CD1 3.77Å; L290-F294 VanDerWaalsContact O-CB 3.24Å; L290-F294 WeakPolarHBondContact O-CB 3.39Å; L290-F294 PolarHBondContact O-N 2.95Å; M292-F294 VanDerWaalsContact C-N 3.28Å; M292-F294 PolarHBondContact O-N 3.2Å; F294-Y297 HydrophobicContact CD2-CD1 4.31Å; F294-Y297 HydrophobicContact CE2-CD1 4.38Å; F294-Y297 WeakPolarHBondContact O-CB 3.22Å; F294-Y297 PolarHBondContact O-N 3.02Å; F294-L298 HydrophobicContact CD1-CD1 4.1Å; F294-L298 HydrophobicContact CD1-CG 4.5Å; F294-L298 HydrophobicContact CD2-CG 4.33Å; F294-L298 HydrophobicContact CE1-CD1 3.51Å; F294-L298 HydrophobicContact CE1-CG 4.11Å; F294-L298 HydrophobicContact CE2-CD1 4.2Å; F294-L298 HydrophobicContact CE2-CD2 3.89Å; F294-L298 HydrophobicContact CE2-CG 3.92Å; F294-L298 HydrophobicContact CZ-CD1 3.57Å; F294-L298 HydrophobicContact CZ-CD2 3.87Å; F294-L298 HydrophobicContact CZ-CG 3.81Å; F294-L298 WeakPolarHBondContact O-CG 3.27Å; F294-L298 PolarHBondContact O-N 3.3Å |
| 295 | L | 91.6 | Very high | 86.4 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -65 | -41.1 | 176.1 | -152.3 | 155.2 | 0 | 0 | 0 | 111.5 | H235 V238 F251 W255 M292 L293 L298 H299 | H235-L295 HydrophobicContact CB-CD1 4.1Å; H235-L295 HydrophobicContact CB-CG 4.42Å; H235-L295 VanDerWaalsContact CD2-CB 3.48Å; H235-L295 WeakPolarHBondContact CD2-CB 3.5Å; V238-L295 HydrophobicContact CB-CD1 4.08Å; V238-L295 HydrophobicContact CB-CD2 4.21Å; V238-L295 HydrophobicContact CG1-CD1 4.26Å; V238-L295 HydrophobicContact CG1-CD2 3.61Å; V238-L295 HydrophobicContact CG2-CD1 4.08Å; F251-L295 HydrophobicContact CE2-CD2 3.41Å; F251-L295 VanDerWaalsContact CE2-CD2 3.41Å; F251-L295 HydrophobicContact CZ-CD2 3.66Å; W255-L295 HydrophobicContact CB-CD2 4.38Å; W255-L295 HydrophobicContact CG-CD2 4.44Å; M292-L295 PolarHBondContact O-N 2.95Å; L293-L295 VanDerWaalsContact C-N 3.29Å; L293-L295 PolarHBondContact O-N 3.03Å; L295-L298 PolarHBondContact O-N 3.48Å; L295-H299 PolarHBondContact O-N 3.14Å; L295-H299 VanDerWaalsContact O-N 3.13Å |
| 296 | L | 90.6 | Very high | 85 | Confident | 45 Ų | 45 | 40.8 Ų | 40.8 | 24% | 0.236 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -63.2 | -42.4 | 173.5 | -68.4 | 171.5 | 0 | 0 | 0 | 111.7 | F251 Y252 W255 M292 L293 H299 F300 | F251-L296 HydrophobicContact CE1-CD2 3.77Å; F251-L296 HydrophobicContact CZ-CD2 4.14Å; Y252-L296 HydrophobicContact CE1-CD2 4.38Å; W255-L296 HydrophobicContact CD2-CD2 4.35Å; W255-L296 HydrophobicContact CG-CD2 4.44Å; W255-L296 HydrophobicContact CZ2-CD1 3.72Å; W255-L296 HydrophobicContact CZ2-CD2 4.44Å; W255-L296 HydrophobicContact CZ2-CG 4.11Å; M292-L296 PolarHBondContact O-N 3.38Å; L293-L296 WeakPolarHBondContact O-CB 3.4Å; L293-L296 PolarHBondContact O-N 3.26Å; L296-H299 PolarHBondContact O-N 3.23Å; L296-F300 HydrophobicContact CD2-CD2 4.31Å; L296-F300 HydrophobicContact CD2-CE2 3.94Å; L296-F300 WeakPolarHBondContact O-CD2 3.3Å; L296-F300 PolarHBondContact O-N 2.93Å |
| 297 | Y | 90.9 | Very high | 83.7 | Confident | 94 Ų | 94 | 42.7 Ų | 42.7 | 37% | 0.369 | 22% | 0.222 | S | C | . | . | I | π-helix | trans | -59 | -47.8 | 176.7 | 173.1 | -91 | 0 | 0 | 0 | 110.8 | T196 L293 F294 H299 F300 A301 Y302 | T196-Y297 HydrophobicContact CG2-CE1 4.41Å; L293-Y297 WeakPolarHBondContact O-CB 3.44Å; L293-Y297 PolarHBondContact O-N 3.43Å; F294-Y297 HydrophobicContact CD2-CD1 4.31Å; F294-Y297 HydrophobicContact CE2-CD1 4.38Å; F294-Y297 WeakPolarHBondContact O-CB 3.22Å; F294-Y297 PolarHBondContact O-N 3.02Å; Y297-H299 VanDerWaalsContact C-N 3.31Å; Y297-H299 PolarHBondContact O-N 3.31Å; Y297-F300 PolarHBondContact O-N 3.2Å; Y297-A301 HydrophobicContact CD2-CB 3.36Å; Y297-A301 HydrophobicContact CE2-CB 3.58Å; Y297-A301 HydrophobicContact CG-CB 4.05Å; Y297-A301 CarbonylContact O-C 3.18Å; Y297-A301 WeakPolarHBondContact O-CA 3.26Å; Y297-A301 WeakPolarHBondContact O-CB 3.42Å; Y297-A301 PolarHBondContact O-N 2.74Å; Y297-Y302 PolarHBondContact O-N 2.77Å |
| 298 | L | 89 | Confident | 82.3 | Confident | 0 Ų | 0 | 44.1 Ų | 44.1 | 0% | 0 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -63.4 | -34.3 | 178.8 | -71 | -176.4 | 0 | 0 | 0 | 113.3 | L169 L173 L239 Y243 F294 L295 Y302 | L169-L298 HydrophobicContact CD1-CD1 4.07Å; L169-L298 HydrophobicContact CD2-CD1 4.02Å; L169-L298 HydrophobicContact CG-CD1 4.31Å; L173-L298 HydrophobicContact CD1-CD2 3.88Å; L173-L298 HydrophobicContact CD2-CB 4.45Å; L173-L298 HydrophobicContact CD2-CD2 4.24Å; L239-L298 HydrophobicContact CD1-CB 3.97Å; L239-L298 HydrophobicContact CD1-CD1 3.69Å; L239-L298 HydrophobicContact CD2-CB 4.38Å; Y243-L298 PolarHBondContact OH-O 2.94Å; F294-L298 HydrophobicContact CD1-CD1 4.1Å; F294-L298 HydrophobicContact CD1-CG 4.5Å; F294-L298 HydrophobicContact CD2-CG 4.33Å; F294-L298 HydrophobicContact CE1-CD1 3.51Å; F294-L298 HydrophobicContact CE1-CG 4.11Å; F294-L298 HydrophobicContact CE2-CD1 4.2Å; F294-L298 HydrophobicContact CE2-CD2 3.89Å; F294-L298 HydrophobicContact CE2-CG 3.92Å; F294-L298 HydrophobicContact CZ-CD1 3.57Å; F294-L298 HydrophobicContact CZ-CD2 3.87Å; F294-L298 HydrophobicContact CZ-CG 3.81Å; F294-L298 WeakPolarHBondContact O-CG 3.27Å; F294-L298 PolarHBondContact O-N 3.3Å; L295-L298 PolarHBondContact O-N 3.48Å; L298-Y302 VanDerWaalsContact O-CB 3.24Å; L298-Y302 WeakPolarHBondContact O-CB 3.27Å |
| 299 | H | 84.3 | Confident | 81 | Confident | 19 Ų | 19 | 45.4 Ų | 45.4 | 9% | 0.088 | 24% | 0.239 | C | C | . | . | I | π-helix | trans | -81.6 | -35.9 | 179.4 | 179.9 | -86.6 | 0 | 0 | 0 | 113.6 | L239 T242 H248 F251 L295 L296 Y297 H303 | L239-H299 HydrophobicContact CD2-CB 4.23Å; T242-H299 WeakPolarHBondContact CG2-NE2 3.4Å; H248-H299 AromaticContact ND1-CE1 3.92Å; F251-H299 AromaticContact CD1-ND1 3.98Å; F251-H299 HydrophobicContact CD2-CB 4.21Å; F251-H299 AromaticContact CD2-CD2 3.4Å; F251-H299 WeakPolarHBondContact CD2-CD2 3.27Å; F251-H299 AromaticContact CD2-CG 3.71Å; F251-H299 AromaticContact CD2-NE2 3.86Å; F251-H299 HydrophobicContact CE1-CB 4.08Å; F251-H299 AromaticContact CE1-CG 3.86Å; F251-H299 AromaticContact CE1-ND1 3.85Å; F251-H299 HydrophobicContact CE2-CB 3.37Å; F251-H299 AromaticContact CE2-CD2 3.5Å; F251-H299 AromaticContact CE2-CG 3.38Å; F251-H299 AromaticContact CG-CD2 3.84Å; F251-H299 AromaticContact CG-NE2 3.83Å; F251-H299 HydrophobicContact CZ-CB 3.29Å; F251-H299 AromaticContact CZ-CG 3.47Å; F251-H299 VanDerWaalsContact CZ-CG 3.47Å; F251-H299 AromaticContact CZ-ND1 3.94Å; L295-H299 PolarHBondContact O-N 3.14Å; L295-H299 VanDerWaalsContact O-N 3.13Å; L296-H299 PolarHBondContact O-N 3.23Å; Y297-H299 VanDerWaalsContact C-N 3.31Å; Y297-H299 PolarHBondContact O-N 3.31Å; H299-H303 PolarHBondContact O-CD2 2.79Å |
| 300 | F | 81 | Confident | 79.6 | Confident | 75 Ų | 75 | 43.8 Ų | 43.8 | 33% | 0.329 | 22% | 0.224 | S | C | . | . | I | π-helix | trans | -107.2 | -56.2 | -174.3 | -65.7 | -66.9 | 0 | 0 | 0 | 113.4 | F251 Y252 L296 Y297 K304 | F251-F300 HydrophobicContact CD1-CE2 4.29Å; F251-F300 HydrophobicContact CD1-CZ 4.25Å; F251-F300 AromaticContact CE1-CE2 3.68Å; F251-F300 HydrophobicContact CE1-CE2 3.68Å; F251-F300 HydrophobicContact CE1-CZ 4.09Å; F251-F300 HydrophobicContact CZ-CE2 4.47Å; Y252-F300 HydrophobicContact CE1-CE2 4.38Å; Y252-F300 HydrophobicContact CE1-CZ 4.43Å; Y252-F300 AromaticContact CZ-CZ 3.9Å; Y252-F300 WeakPolarHBondContact OH-CZ 3.31Å; L296-F300 HydrophobicContact CD2-CD2 4.31Å; L296-F300 HydrophobicContact CD2-CE2 3.94Å; L296-F300 WeakPolarHBondContact O-CD2 3.3Å; L296-F300 PolarHBondContact O-N 2.93Å; Y297-F300 PolarHBondContact O-N 3.2Å; F300-K304 WeakPolarHBondContact O-CG 3.05Å; F300-K304 PolarHBondContact O-N 3.04Å; F300-K304 VanDerWaalsContact O-N 3.13Å |
| 301 | A | 67.9 | Low | 78.3 | Confident | 32 Ų | 32 | 46.4 Ų | 46.4 | 26% | 0.264 | 24% | 0.239 | S | C | . | . | I | π-helix | trans | -72.6 | -34.6 | -172.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y297 K304 V305 | Y297-A301 HydrophobicContact CD2-CB 3.36Å; Y297-A301 HydrophobicContact CE2-CB 3.58Å; Y297-A301 HydrophobicContact CG-CB 4.05Å; Y297-A301 CarbonylContact O-C 3.18Å; Y297-A301 WeakPolarHBondContact O-CA 3.26Å; Y297-A301 WeakPolarHBondContact O-CB 3.42Å; Y297-A301 PolarHBondContact O-N 2.74Å; A301-K304 PolarHBondContact O-N 2.9Å; A301-V305 WeakPolarHBondContact O-CB 3.3Å; A301-V305 WeakPolarHBondContact O-CG2 3.23Å; A301-V305 PolarHBondContact O-N 3.29Å |
| 302 | Y | 68.5 | Low | 77.1 | Confident | 2 Ų | 2 | 51.7 Ų | 51.7 | 1% | 0.008 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.5 | -48.2 | 175.4 | -173.4 | -102.7 | 0 | 0 | 0 | 111.6 | L173 M177 T192 A193 Y297 L298 K304 V305 V306 | L173-Y302 HydrophobicContact CB-CE1 4.05Å; L173-Y302 HydrophobicContact CD1-CE1 4.48Å; L173-Y302 HydrophobicContact CD1-CE2 4.35Å; L173-Y302 HydrophobicContact CD2-CD1 4.09Å; L173-Y302 HydrophobicContact CD2-CE1 4.17Å; L173-Y302 HydrophobicContact CG-CE1 4.46Å; M177-Y302 HydrophobicContact CE-CE1 3.88Å; M177-Y302 WeakPolarHBondContact CE-OH 3.17Å; M177-Y302 HydrophobicContact CG-CE1 4.04Å; M177-Y302 HydrophobicContact SD-CE1 3.57Å; M177-Y302 VanDerWaalsContact SD-CE1 3.57Å; M177-Y302 PolarHBondContact SD-OH 2.72Å; T192-Y302 HydrophobicContact CG2-CE2 4.43Å; A193-Y302 WeakPolarHBondContact CB-OH 3.21Å; Y297-Y302 PolarHBondContact O-N 2.77Å; L298-Y302 VanDerWaalsContact O-CB 3.24Å; L298-Y302 WeakPolarHBondContact O-CB 3.27Å; Y302-K304 VanDerWaalsContact C-N 3.28Å; Y302-K304 PolarHBondContact O-N 2.84Å; Y302-V305 PolarHBondContact O-N 3.21Å; Y302-V306 HydrophobicContact CD1-CG2 4.06Å; Y302-V306 HydrophobicContact CD2-CG2 4.36Å; Y302-V306 HydrophobicContact CE1-CG2 3.79Å; Y302-V306 HydrophobicContact CE2-CG2 4.1Å; Y302-V306 HydrophobicContact CG-CG2 4.34Å; Y302-V306 VanDerWaalsContact O-CB 3.28Å; Y302-V306 WeakPolarHBondContact O-CB 3.34Å; Y302-V306 WeakPolarHBondContact O-CG2 3.15Å; Y302-V306 PolarHBondContact O-N 2.83Å |
| 303 | H | 68.6 | Low | 75.5 | Confident | 43 Ų | 43 | 55 Ų | 55 | 20% | 0.199 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -58 | -41.8 | 174.7 | -81.1 | -85.6 | 0 | 0 | 0 | 111.7 | Y243 H299 V306 E307 | Y243-H303 AromaticContact CE1-NE2 3.31Å; Y243-H303 VanDerWaalsContact CE1-NE2 3.31Å; Y243-H303 WeakPolarHBondContact CE1-NE2 3.45Å; Y243-H303 AromaticContact CZ-NE2 3.62Å; H299-H303 PolarHBondContact O-CD2 2.79Å; H303-V306 PolarHBondContact O-N 3.14Å; H303-E307 VanDerWaalsContact O-CB 3.31Å; H303-E307 WeakPolarHBondContact O-CB 3.31Å; H303-E307 WeakPolarHBondContact O-CG 3.49Å; H303-E307 PolarHBondContact O-N 3.31Å |
| 304 | K | 68.8 | Low | 74.1 | Confident | 137 Ų | 137 | 54.1 Ų | 54.1 | 60% | 0.596 | 28% | 0.282 | S | S | * | . | H | α-helix | trans | -66.1 | -42.4 | 176.6 | -72.6 | -74 | 161.8 | -145.6 | 0 | 114.3 | F300 A301 Y302 V306 E307 G308 | F300-K304 WeakPolarHBondContact O-CG 3.05Å; F300-K304 PolarHBondContact O-N 3.04Å; F300-K304 VanDerWaalsContact O-N 3.13Å; A301-K304 PolarHBondContact O-N 2.9Å; Y302-K304 VanDerWaalsContact C-N 3.28Å; Y302-K304 PolarHBondContact O-N 2.84Å; K304-V306 VanDerWaalsContact C-N 3.31Å; K304-E307 IonicContact NZ-OE2 2.82Å; K304-E307 PolarHBondContact NZ-OE2 3.18Å; K304-G308 PolarHBondContact O-N 3.21Å |
| 305 | V | 66.4 | Low | 72 | Confident | 62 Ų | 62 | 54.9 Ų | 54.9 | 38% | 0.376 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -66.4 | -38.8 | 177.7 | 168.2 | 0 | 0 | 0 | 0 | 110.1 | A301 Y302 I309 | A301-V305 WeakPolarHBondContact O-CB 3.3Å; A301-V305 WeakPolarHBondContact O-CG2 3.23Å; A301-V305 PolarHBondContact O-N 3.29Å; Y302-V305 PolarHBondContact O-N 3.21Å; V305-I309 HydrophobicContact CG1-CD1 3.83Å; V305-I309 WeakPolarHBondContact O-CB 3.47Å; V305-I309 WeakPolarHBondContact O-CD1 3.3Å; V305-I309 WeakPolarHBondContact O-CG1 3.25Å; V305-I309 PolarHBondContact O-N 2.9Å |
| 306 | V | 64.7 | Low | 70.1 | Confident | 15 Ų | 15 | 61.3 Ų | 61.3 | 9% | 0.091 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -69.1 | -48.4 | 177.5 | 167.8 | 0 | 0 | 0 | 0 | 111.1 | M177 Y302 H303 K304 G308 I309 L310 | M177-V306 HydrophobicContact CE-CB 3.87Å; M177-V306 HydrophobicContact CE-CG1 3.26Å; M177-V306 HydrophobicContact CE-CG2 3.28Å; Y302-V306 HydrophobicContact CD1-CG2 4.06Å; Y302-V306 HydrophobicContact CD2-CG2 4.36Å; Y302-V306 HydrophobicContact CE1-CG2 3.79Å; Y302-V306 HydrophobicContact CE2-CG2 4.1Å; Y302-V306 HydrophobicContact CG-CG2 4.34Å; Y302-V306 VanDerWaalsContact O-CB 3.28Å; Y302-V306 WeakPolarHBondContact O-CB 3.34Å; Y302-V306 WeakPolarHBondContact O-CG2 3.15Å; Y302-V306 PolarHBondContact O-N 2.83Å; H303-V306 PolarHBondContact O-N 3.14Å; K304-V306 VanDerWaalsContact C-N 3.31Å; V306-G308 VanDerWaalsContact C-N 3.3Å; V306-G308 PolarHBondContact O-N 3.24Å; V306-I309 PolarHBondContact O-N 2.98Å; V306-L310 HydrophobicContact CG1-CD1 3.84Å; V306-L310 HydrophobicContact CG1-CG 4.46Å; V306-L310 WeakPolarHBondContact O-CB 3.32Å; V306-L310 VanDerWaalsContact O-CG 3.28Å; V306-L310 WeakPolarHBondContact O-CG 3.3Å; V306-L310 PolarHBondContact O-N 3.05Å |
| 307 | E | 67.7 | Low | 68.2 | Low | 85 Ų | 85 | 66.5 Ų | 66.5 | 40% | 0.397 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -52.3 | -50 | 172.6 | -78.5 | 167.2 | -167 | 0 | 0 | 110.3 | H303 K304 I309 L310 D311 | H303-E307 VanDerWaalsContact O-CB 3.31Å; H303-E307 WeakPolarHBondContact O-CB 3.31Å; H303-E307 WeakPolarHBondContact O-CG 3.49Å; H303-E307 PolarHBondContact O-N 3.31Å; K304-E307 IonicContact NZ-OE2 2.82Å; K304-E307 PolarHBondContact NZ-OE2 3.18Å; E307-I309 PolarHBondContact O-N 3.43Å; E307-L310 PolarHBondContact O-N 3.12Å; E307-D311 PolarHBondContact O-N 3.08Å |
| 308 | G | 66.8 | Low | 66.3 | Low | 32 Ų | 32 | 67.1 Ų | 67.1 | 33% | 0.33 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -64.2 | -39.1 | 179.2 | 0 | 0 | 0 | 0 | 0 | 114.1 | K304 V306 L310 T312 | K304-G308 PolarHBondContact O-N 3.21Å; V306-G308 VanDerWaalsContact C-N 3.3Å; V306-G308 PolarHBondContact O-N 3.24Å; G308-L310 VanDerWaalsContact C-N 3.34Å; G308-T312 WeakPolarHBondContact O-CG2 3.37Å; G308-T312 PolarHBondContact O-N 3.49Å; G308-T312 VanDerWaalsContact O-N 3.11Å; G308-T312 PolarHBondContact O-OG1 3.03Å |
| 309 | I | 67.1 | Low | 64.3 | Low | 55 Ų | 55 | 72 Ų | 72 | 28% | 0.282 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 174.5 | -71.7 | 166.4 | 0 | 0 | 0 | 110.1 | V305 V306 E307 T312 L313 | V305-I309 HydrophobicContact CG1-CD1 3.83Å; V305-I309 WeakPolarHBondContact O-CB 3.47Å; V305-I309 WeakPolarHBondContact O-CD1 3.3Å; V305-I309 WeakPolarHBondContact O-CG1 3.25Å; V305-I309 PolarHBondContact O-N 2.9Å; V306-I309 PolarHBondContact O-N 2.98Å; E307-I309 PolarHBondContact O-N 3.43Å; I309-T312 PolarHBondContact O-N 3.08Å; I309-T312 PolarHBondContact O-OG1 3.43Å; I309-L313 HydrophobicContact CG2-CD1 3.64Å; I309-L313 HydrophobicContact CG2-CG 4.35Å; I309-L313 WeakPolarHBondContact O-CB 3.31Å; I309-L313 VanDerWaalsContact O-CG 3.24Å; I309-L313 WeakPolarHBondContact O-CG 3.33Å; I309-L313 PolarHBondContact O-N 3.35Å |
| 310 | L | 66 | Low | 62.7 | Low | 10 Ų | 10 | 77.2 Ų | 77.2 | 5% | 0.052 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -63.1 | -47.8 | 177.3 | -71.7 | 166.8 | 0 | 0 | 0 | 111.4 | T182 I184 L189 V306 E307 G308 T312 L313 E314 | T182-L310 HydrophobicContact CG2-CD1 3.71Å; I184-L310 HydrophobicContact CB-CD2 3.95Å; I184-L310 HydrophobicContact CD1-CD2 4.13Å; I184-L310 HydrophobicContact CG1-CD2 4.33Å; I184-L310 HydrophobicContact CG2-CD2 4.44Å; L189-L310 HydrophobicContact CD1-CD2 4.41Å; V306-L310 HydrophobicContact CG1-CD1 3.84Å; V306-L310 HydrophobicContact CG1-CG 4.46Å; V306-L310 WeakPolarHBondContact O-CB 3.32Å; V306-L310 VanDerWaalsContact O-CG 3.28Å; V306-L310 WeakPolarHBondContact O-CG 3.3Å; V306-L310 PolarHBondContact O-N 3.05Å; E307-L310 PolarHBondContact O-N 3.12Å; G308-L310 VanDerWaalsContact C-N 3.34Å; L310-T312 VanDerWaalsContact C-N 3.26Å; L310-T312 PolarHBondContact O-N 3.16Å; L310-L313 CarbonylContact O-C 3.52Å; L310-L313 PolarHBondContact O-N 3.31Å; L310-E314 WeakPolarHBondContact O-CB 3.45Å; L310-E314 WeakPolarHBondContact O-CG 3.4Å; L310-E314 PolarHBondContact O-N 3.47Å |
| 311 | D | 68.1 | Low | 61 | Low | 116 Ų | 116 | 80.1 Ų | 80.1 | 62% | 0.62 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -58.7 | -37 | 178.4 | -71.7 | -17.2 | 0 | 0 | 0 | 112.3 | E307 | E307-D311 PolarHBondContact O-N 3.08Å |
| 312 | T | 68.4 | Low | 59.8 | Low | 111 Ų | 111 | 86.7 Ų | 86.7 | 68% | 0.681 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -74.4 | -30.5 | 176.2 | 58.3 | 0 | 0 | 0 | 0 | 113.6 | G308 I309 L310 | G308-T312 WeakPolarHBondContact O-CG2 3.37Å; G308-T312 PolarHBondContact O-N 3.49Å; G308-T312 VanDerWaalsContact O-N 3.11Å; G308-T312 PolarHBondContact O-OG1 3.03Å; I309-T312 PolarHBondContact O-N 3.08Å; I309-T312 PolarHBondContact O-OG1 3.43Å; L310-T312 VanDerWaalsContact C-N 3.26Å; L310-T312 PolarHBondContact O-N 3.16Å |
| 313 | L | 62.1 | Low | 58.5 | Low | 95 Ų | 95 | 97.5 Ų | 97.5 | 50% | 0.497 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -79.5 | -27.9 | 175.7 | -70.2 | 169.5 | 0 | 0 | 0 | 112.1 | I309 L310 G315 | I309-L313 HydrophobicContact CG2-CD1 3.64Å; I309-L313 HydrophobicContact CG2-CG 4.35Å; I309-L313 WeakPolarHBondContact O-CB 3.31Å; I309-L313 VanDerWaalsContact O-CG 3.24Å; I309-L313 WeakPolarHBondContact O-CG 3.33Å; I309-L313 PolarHBondContact O-N 3.35Å; L310-L313 CarbonylContact O-C 3.52Å; L310-L313 PolarHBondContact O-N 3.31Å; L313-G315 VanDerWaalsContact C-N 3.32Å; L313-G315 PolarHBondContact O-N 3.17Å |
| 314 | E | 63 | Low | 57.2 | Low | 93 Ų | 93 | 101.2 Ų | 101.2 | 44% | 0.435 | 55% | 0.548 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.9 | 18.1 | 177 | -73.5 | -170.7 | 179.1 | 0 | 0 | 114.4 | I184 L310 | I184-E314 HydrophobicContact CD1-CB 4.47Å; I184-E314 VanDerWaalsContact CD1-CD 3.5Å; I184-E314 HydrophobicContact CD1-CG 3.08Å; I184-E314 WeakPolarHBondContact CD1-OE1 3.14Å; I184-E314 HydrophobicContact CG1-CG 4.44Å; L310-E314 WeakPolarHBondContact O-CB 3.45Å; L310-E314 WeakPolarHBondContact O-CG 3.4Å; L310-E314 PolarHBondContact O-N 3.47Å |
| 315 | G | 51.2 | Low | 55.8 | Low | 31 Ų | 31 | 99.3 Ų | 99.3 | 32% | 0.32 | 55% | 0.55 | S | S | . | * | trans | -44.7 | 162.8 | -173.2 | 0 | 0 | 0 | 0 | 0 | 116.4 | L313 N317 | L313-G315 VanDerWaalsContact C-N 3.32Å; L313-G315 PolarHBondContact O-N 3.17Å; G315-N317 PolarHBondContact O-N 3.02Å | ||
| 316 | P | 51.8 | Low | 54.6 | Low | 136 Ų | 136 | 107.5 Ų | 107.5 | 88% | 0.883 | 57% | 0.574 | S | S | * | * | S | Bend | trans | -60.9 | 8.5 | -154 | -21.6 | 31.5 | 0 | 0 | 0 | 119.6 | ||
| 317 | N | 49.1 | Very low | 53.4 | Low | 153 Ų | 153 | 114 Ų | 114 | 82% | 0.818 | 61% | 0.609 | S | S | * | * | trans | -125.4 | 54.3 | -175.1 | -80 | -76.8 | 0 | 0 | 0 | 112.6 | G315 | G315-N317 PolarHBondContact O-N 3.02Š| ||
| 318 | I | 51.8 | Low | 52.5 | Low | 108 Ų | 108 | 116.5 Ų | 116.5 | 55% | 0.554 | 62% | 0.623 | S | S | * | * | trans | -122.1 | 104.7 | 164.7 | -45.6 | 174.9 | 0 | 0 | 0 | 107.6 | ||||
| 319 | P | 48 | Very low | 51 | Low | 103 Ų | 103 | 120 Ų | 120 | 67% | 0.669 | 64% | 0.641 | S | S | * | * | trans | -60.3 | 148.8 | 168.3 | 26 | -31.6 | 0 | 0 | 0 | 109.2 | I321 | P319-I321 PolarHBondContact O-N 3.34Å; P319-I321 VanDerWaalsContact O-N 3.16Å | ||
| 320 | P | 49.7 | Very low | 49.9 | Very low | 127 Ų | 127 | 122 Ų | 122 | 83% | 0.825 | 67% | 0.665 | S | S | * | * | trans | -54.1 | 125.9 | -174 | 22.1 | -32.9 | 0 | 0 | 0 | 110.4 | Q322 | P320-Q322 PolarHBondContact O-N 2.89Š| ||
| 321 | I | 45.5 | Very low | 48.8 | Very low | 136 Ų | 136 | 127.7 Ų | 127.7 | 70% | 0.697 | 70% | 0.7 | S | S | * | * | trans | -43.1 | 111.8 | -178.2 | -65.5 | 166.3 | 0 | 0 | 0 | 110.6 | P319 R323 | P319-I321 PolarHBondContact O-N 3.34Å; P319-I321 VanDerWaalsContact O-N 3.16Å; I321-R323 PolarHBondContact O-N 3.22Å; I321-R323 VanDerWaalsContact O-N 3.12Å | ||
| 322 | Q | 41.5 | Very low | 47.4 | Very low | 171 Ų | 171 | 129.4 Ų | 129.4 | 80% | 0.799 | 71% | 0.708 | S | S | * | * | trans | -67.2 | 106.6 | 164.4 | -174.9 | 173.2 | 13.3 | 0 | 0 | 107.4 | P320 V324 | P320-Q322 PolarHBondContact O-N 2.89Å; Q322-V324 PolarHBondContact O-N 3.35Å | ||
| 323 | R | 43.1 | Very low | 46.1 | Very low | 228 Ų | 228 | 128.5 Ų | 128.5 | 86% | 0.86 | 71% | 0.712 | S | S | * | * | trans | -61.3 | 101.9 | 168.1 | -62.3 | -177 | -171.9 | 129.9 | 1.2 | 107.4 | I321 P325 | I321-R323 PolarHBondContact O-N 3.22Å; I321-R323 VanDerWaalsContact O-N 3.12Å; R323-P325 VanDerWaalsContact O-CD 3.27Å; R323-P325 WeakPolarHBondContact O-CD 3.43Å | ||
| 324 | V | 41.1 | Very low | 45.1 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 73% | 0.733 | 73% | 0.728 | S | S | * | * | trans | -76.8 | 112.3 | 163 | 178.3 | 0 | 0 | 0 | 0 | 106 | Q322 R326 | Q322-V324 PolarHBondContact O-N 3.35Å; V324-R326 PolarHBondContact O-N 3.04Å | ||
| 325 | P | 39.5 | Very low | 44.2 | Very low | 98 Ų | 98 | 128.5 Ų | 128.5 | 64% | 0.636 | 74% | 0.741 | S | S | * | * | trans | -62.2 | 123.3 | 173 | -13.3 | 29 | 0 | 0 | 0 | 107.5 | R323 D327 | R323-P325 VanDerWaalsContact O-CD 3.27Å; R323-P325 WeakPolarHBondContact O-CD 3.43Å; P325-D327 PolarHBondContact O-N 3.27Å | ||
| 326 | R | 41.3 | Very low | 43.7 | Very low | 233 Ų | 233 | 138.2 Ų | 138.2 | 88% | 0.879 | 77% | 0.768 | S | S | * | * | trans | -70 | 110.2 | 162.5 | -162.4 | 172.3 | -174.4 | 144.1 | -0 | 105 | V324 I328 | V324-R326 PolarHBondContact O-N 3.04Å; R326-I328 VanDerWaalsContact C-N 3.29Å; R326-I328 VanDerWaalsContact O-CG1 3.26Å; R326-I328 WeakPolarHBondContact O-CG1 3.27Å; R326-I328 PolarHBondContact O-N 2.97Å | ||
| 327 | D | 38.8 | Very low | 43.2 | Very low | 152 Ų | 152 | 139.8 Ų | 139.8 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | trans | -62.8 | 92.5 | 177.3 | -68.6 | -41.8 | 0 | 0 | 0 | 109.2 | P325 | P325-D327 PolarHBondContact O-N 3.27Š| ||
| 328 | I | 47.9 | Very low | 43.1 | Very low | 138 Ų | 138 | 135.3 Ų | 135.3 | 71% | 0.708 | 75% | 0.748 | S | S | * | * | trans | -87.9 | 115.5 | 167.3 | -26.8 | 178.4 | 0 | 0 | 0 | 105 | R326 A330 | R326-I328 VanDerWaalsContact C-N 3.29Å; R326-I328 VanDerWaalsContact O-CG1 3.26Å; R326-I328 WeakPolarHBondContact O-CG1 3.27Å; R326-I328 PolarHBondContact O-N 2.97Å; I328-A330 PolarHBondContact O-N 3.18Å; I328-A330 VanDerWaalsContact O-N 3.16Å | ||
| 329 | P | 36.2 | Very low | 42.7 | Very low | 106 Ų | 106 | 136.1 Ų | 136.1 | 69% | 0.688 | 76% | 0.758 | S | S | * | * | trans | -55.2 | 126.9 | 178.5 | 18.4 | -28.9 | 0 | 0 | 0 | 109.6 | V331 | P329-V331 PolarHBondContact O-N 3.22Š| ||
| 330 | A | 43 | Very low | 42.7 | Very low | 96 Ų | 96 | 136.3 Ų | 136.3 | 79% | 0.793 | 76% | 0.757 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | 22.6 | -167.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | I328 | I328-A330 PolarHBondContact O-N 3.18Å; I328-A330 VanDerWaalsContact O-N 3.16Å |
| 331 | V | 43.8 | Very low | 42.5 | Very low | 130 Ų | 130 | 135.2 Ų | 135.2 | 79% | 0.788 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.5 | -16.5 | -174.7 | -174.7 | 0 | 0 | 0 | 0 | 112.4 | P329 | P329-V331 PolarHBondContact O-N 3.22Š|
| 332 | L | 39.6 | Very low | 42.5 | Very low | 152 Ų | 152 | 135.2 Ų | 135.2 | 80% | 0.796 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -101.1 | -1.4 | -178.2 | -116.6 | 118.5 | 0 | 0 | 0 | 115.6 | A334 | L332-A334 VanDerWaalsContact C-N 3.25Å; L332-A334 PolarHBondContact O-N 2.94Å |
| 333 | A | 40.2 | Very low | 42.7 | Very low | 91 Ų | 91 | 132.3 Ų | 132.3 | 75% | 0.752 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -75.7 | -9.3 | 179 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 334 | A | 40.6 | Very low | 42.9 | Very low | 102 Ų | 102 | 124.4 Ų | 124.4 | 84% | 0.843 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -87.6 | -2.9 | -179 | 0 | 0 | 0 | 0 | 0 | 114.7 | L332 | L332-A334 VanDerWaalsContact C-N 3.25Å; L332-A334 PolarHBondContact O-N 2.94Å |
| 335 | A | 45.3 | Very low | 43.2 | Very low | 86 Ų | 86 | 122.4 Ų | 122.4 | 71% | 0.711 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -104.6 | 5.9 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||
| 336 | R | 39.9 | Very low | 43.8 | Very low | 236 Ų | 236 | 120.8 Ų | 120.8 | 89% | 0.891 | 70% | 0.7 | S | S | * | * | trans | -109.5 | 97.9 | 170.2 | -87.4 | -175.9 | 176 | 156 | -0.9 | 110.9 | ||||
| 337 | L | 40.2 | Very low | 44.1 | Very low | 168 Ų | 168 | 116.8 Ų | 116.8 | 88% | 0.88 | 69% | 0.689 | S | S | * | * | trans | -57 | 157.3 | 161.1 | -89.3 | 158.5 | 0 | 0 | 0 | 111.3 | ||||
| 338 | P | 47.1 | Very low | 44.7 | Very low | 59 Ų | 59 | 112.4 Ų | 112.4 | 38% | 0.383 | 67% | 0.674 | S | S | . | * | -116.4 | 132.2 | -122.4 | 16.8 | 5.2 | 0 | 0 | 0 | 113.9 | T340 I341 | P338-T340 WeakPolarHBondContact CB-OG1 3.39Å; P338-T340 PolarHBondContact O-N 3.37Å; P338-I341 HydrophobicContact CG-CD1 3.93Å; P338-I341 HydrophobicContact CG-CG1 4.21Å | |||
| 339 | T | 44.7 | Very low | 45 | Very low | 125 Ų | 125 | 109.7 Ų | 109.7 | 77% | 0.767 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -6.4 | 170.4 | 40.6 | 0 | 0 | 0 | 0 | 113.9 | ||
| 340 | T | 46.7 | Very low | 45.7 | Very low | 107 Ų | 107 | 107.4 Ų | 107.4 | 66% | 0.656 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -77.2 | -21.1 | 178.3 | 35.5 | 0 | 0 | 0 | 0 | 114.2 | P338 | P338-T340 WeakPolarHBondContact CB-OG1 3.39Å; P338-T340 PolarHBondContact O-N 3.37Å |
| 341 | I | 47.4 | Very low | 46.2 | Very low | 104 Ų | 104 | 107.7 Ų | 107.7 | 53% | 0.533 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -76.5 | -35.9 | 179.4 | -59.7 | 179.4 | 0 | 0 | 0 | 111.2 | P338 N343 A344 T345 | P338-I341 HydrophobicContact CG-CD1 3.93Å; P338-I341 HydrophobicContact CG-CG1 4.21Å; I341-N343 VanDerWaalsContact C-N 3.3Å; I341-N343 PolarHBondContact O-N 3.15Å; I341-A344 PolarHBondContact O-N 3.08Å; I341-T345 PolarHBondContact O-N 3.24Å; I341-T345 VanDerWaalsContact O-N 3.14Å; I341-T345 PolarHBondContact O-OG1 2.91Å |
| 342 | L | 45.6 | Very low | 46.6 | Very low | 137 Ų | 137 | 106 Ų | 106 | 72% | 0.717 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -63.3 | -34.1 | -179.3 | -87.5 | 153.4 | 0 | 0 | 0 | 113.2 | A346 | L342-A346 PolarHBondContact O-N 3.3Å |
| 343 | N | 45.4 | Very low | 47 | Very low | 110 Ų | 110 | 105.2 Ų | 105.2 | 59% | 0.588 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -77.7 | -29 | 179.7 | -154.5 | -2.2 | 0 | 0 | 0 | 112.4 | I341 K347 | I341-N343 VanDerWaalsContact C-N 3.3Å; I341-N343 PolarHBondContact O-N 3.15Å; N343-K347 PolarHBondContact O-N 2.95Å |
| 344 | A | 46.7 | Very low | 47.5 | Very low | 62 Ų | 62 | 109.2 Ų | 109.2 | 51% | 0.512 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -73.4 | -39.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | I341 K347 A348 | I341-A344 PolarHBondContact O-N 3.08Å; A344-K347 PolarHBondContact O-N 2.81Å; A344-A348 PolarHBondContact O-N 3.15Å |
| 345 | T | 48.1 | Very low | 47.9 | Very low | 79 Ų | 79 | 108.5 Ų | 108.5 | 49% | 0.485 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -69.5 | -37.2 | 177.9 | -37.6 | 0 | 0 | 0 | 0 | 111.9 | I341 A348 V349 | I341-T345 PolarHBondContact O-N 3.24Å; I341-T345 VanDerWaalsContact O-N 3.14Å; I341-T345 PolarHBondContact O-OG1 2.91Å; T345-A348 PolarHBondContact O-N 2.69Å; T345-V349 WeakPolarHBondContact O-CG2 3.43Å; T345-V349 PolarHBondContact O-N 2.76Å; T345-V349 VanDerWaalsContact O-N 3.12Å |
| 346 | A | 51 | Low | 48 | Very low | 63 Ų | 63 | 115.8 Ų | 115.8 | 52% | 0.521 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -65.7 | -38 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | L342 A350 | L342-A346 PolarHBondContact O-N 3.3Å; A346-A350 PolarHBondContact O-N 2.89Å |
| 347 | K | 47.7 | Very low | 48.4 | Very low | 149 Ų | 149 | 109.8 Ų | 109.8 | 65% | 0.648 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -70.2 | -35.6 | 173.9 | -82.7 | -174.7 | 174.3 | -176.1 | 0 | 112.9 | N343 A344 A350 V351 | N343-K347 PolarHBondContact O-N 2.95Å; A344-K347 PolarHBondContact O-N 2.81Å; K347-A350 PolarHBondContact O-N 3.18Å; K347-V351 WeakPolarHBondContact O-CG2 3.26Å; K347-V351 PolarHBondContact O-N 3.38Å |
| 348 | A | 51 | Low | 48.8 | Very low | 60 Ų | 60 | 106.7 Ų | 106.7 | 50% | 0.496 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -67.7 | -36.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | A344 T345 T352 | A344-A348 PolarHBondContact O-N 3.15Å; T345-A348 PolarHBondContact O-N 2.69Å; A348-T352 PolarHBondContact O-N 3.33Å; A348-T352 PolarHBondContact O-OG1 3.37Å |
| 349 | V | 54.3 | Low | 48.9 | Very low | 82 Ų | 82 | 109.3 Ų | 109.3 | 50% | 0.497 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -72.9 | -33.8 | 176.7 | 174.9 | 0 | 0 | 0 | 0 | 111.9 | T345 V351 T352 L353 | T345-V349 WeakPolarHBondContact O-CG2 3.43Å; T345-V349 PolarHBondContact O-N 2.76Å; T345-V349 VanDerWaalsContact O-N 3.12Å; V349-V351 VanDerWaalsContact C-N 3.34Å; V349-V351 PolarHBondContact O-N 3.16Å; V349-T352 PolarHBondContact O-N 3.39Å; V349-T352 PolarHBondContact O-OG1 3.24Å; V349-L353 HydrophobicContact CG1-CD1 4.31Å; V349-L353 PolarHBondContact O-N 3.13Å |
| 350 | A | 51.9 | Low | 49.2 | Very low | 58 Ų | 58 | 108.4 Ų | 108.4 | 48% | 0.479 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -68.1 | -32.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113 | A346 K347 | A346-A350 PolarHBondContact O-N 2.89Å; K347-A350 PolarHBondContact O-N 3.18Å |
| 351 | V | 53.3 | Low | 49.3 | Very low | 102 Ų | 102 | 108.5 Ų | 108.5 | 62% | 0.618 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -75.8 | -30.2 | 178.1 | 173.7 | 0 | 0 | 0 | 0 | 112.2 | K347 V349 | K347-V351 WeakPolarHBondContact O-CG2 3.26Å; K347-V351 PolarHBondContact O-N 3.38Å; V349-V351 VanDerWaalsContact C-N 3.34Å; V349-V351 PolarHBondContact O-N 3.16Å |
| 352 | T | 51.4 | Low | 49.4 | Very low | 93 Ų | 93 | 108.8 Ų | 108.8 | 57% | 0.571 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -79.4 | -18.7 | 178.4 | 21.4 | 0 | 0 | 0 | 0 | 114 | A348 V349 S355 | A348-T352 PolarHBondContact O-N 3.33Å; A348-T352 PolarHBondContact O-OG1 3.37Å; V349-T352 PolarHBondContact O-N 3.39Å; V349-T352 PolarHBondContact O-OG1 3.24Å; T352-S355 PolarHBondContact O-OG 2.84Å |
| 353 | L | 49.5 | Very low | 49.7 | Very low | 137 Ų | 137 | 106.8 Ų | 106.8 | 72% | 0.717 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.4 | -11 | 175.3 | -95.8 | 154.6 | 0 | 0 | 0 | 114 | V349 | V349-L353 HydrophobicContact CG1-CD1 4.31Å; V349-L353 PolarHBondContact O-N 3.13Å |
| 354 | Q | 49.7 | Very low | 50 | Low | 175 Ų | 175 | 106.5 Ų | 106.5 | 82% | 0.818 | 62% | 0.621 | S | S | * | * | S | Bend | trans | -92.2 | -4.7 | 175.1 | -74.8 | -173.3 | -32.4 | 0 | 0 | 113.6 | ||
| 355 | S | 50.1 | Low | 50.3 | Low | 86 Ų | 86 | 110.3 Ų | 110.3 | 60% | 0.601 | 63% | 0.63 | S | S | * | * | trans | -110 | 24.5 | -177.7 | 64.7 | 0 | 0 | 0 | 0 | 114.4 | T352 | T352-S355 PolarHBondContact O-OG 2.84Š| ||
| 356 | H | 46 | Very low | 50.5 | Low | 239 Ų | 239 | 113.1 Ų | 113.1 | 100% | 1.106 | 64% | 0.643 | S | S | * | * | trans | -130.3 | 0 | 172.8 | -111.3 | -66.2 | 0 | 0 | 0 | 112.8 |
Retrieved 356 of 356 residues in 83.3 ms
(Link to these results)