| 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 | 32.2 | Very low | 32.3 | Very low | 230 Ų | 230 | 154.5 Ų | 154.5 | 100% | 1.133 | 83% | 0.832 | S | S | * | * | 0 | 135.8 | 0 | -72.1 | 158.5 | 68.3 | 0 | 0 | 107.4 | |||||
| 2 | N | 33.6 | Very low | 32 | Very low | 157 Ų | 157 | 151.7 Ų | 151.7 | 84% | 0.84 | 83% | 0.833 | S | S | * | * | trans | 40.4 | 118.6 | 153.7 | -55.3 | 21.7 | 0 | 0 | 0 | 120.6 | ||||
| 3 | E | 33.1 | Very low | 31.8 | Very low | 183 Ų | 183 | 158.8 Ų | 158.8 | 86% | 0.855 | 84% | 0.84 | S | S | * | * | trans | -57.1 | 175.1 | 141.2 | -79.6 | -166.2 | 141.1 | 0 | 0 | 111.9 | ||||
| 4 | P | 51.8 | Low | 31.6 | Very low | 101 Ų | 101 | 157.1 Ų | 157.1 | 66% | 0.656 | 84% | 0.839 | S | S | * | * | cis | -150.1 | -177 | 28.4 | 39.5 | -15.1 | 0 | 0 | 0 | 119.2 | ||||
| 5 | T | 35.9 | Very low | 31.7 | Very low | 124 Ų | 124 | 155 Ų | 155 | 76% | 0.761 | 84% | 0.838 | S | S | * | * | trans | 54.6 | 148.6 | 145.7 | 40.9 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 6 | E | 33.8 | Very low | 31.7 | Very low | 159 Ų | 159 | 157.3 Ų | 157.3 | 74% | 0.743 | 84% | 0.841 | S | S | * | * | cis | -163 | -175.7 | -3.8 | -142.8 | -176.4 | -167.6 | 0 | 0 | 112.4 | ||||
| 7 | N | 27.2 | Very low | 31.7 | Very low | 119 Ų | 119 | 155 Ų | 155 | 64% | 0.636 | 84% | 0.837 | S | S | * | * | trans | 81.3 | 110.4 | 152.5 | -80.6 | -62.6 | 0 | 0 | 0 | 121.5 | ||||
| 8 | R | 29.1 | Very low | 31.6 | Very low | 246 Ų | 246 | 152.8 Ų | 152.8 | 93% | 0.928 | 83% | 0.825 | S | S | * | * | -169.7 | 159.8 | 103.2 | -101 | 176.6 | -172.2 | -147.6 | 0.6 | 113.4 | |||||
| 9 | L | 28.1 | Very low | 31.5 | Very low | 169 Ų | 169 | 151.8 Ų | 151.8 | 89% | 0.885 | 82% | 0.824 | S | S | * | * | trans | -82.8 | 152.9 | -174.2 | -68.9 | 75.6 | 0 | 0 | 0 | 113.7 | ||||
| 10 | G | 27.1 | Very low | 31.4 | Very low | 81 Ų | 81 | 155.1 Ų | 155.1 | 84% | 0.835 | 82% | 0.824 | S | S | * | * | trans | -151.7 | 146.7 | 162.3 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 11 | C | 23.6 | Very low | 31.2 | Very low | 131 Ų | 131 | 155.8 Ų | 155.8 | 89% | 0.885 | 83% | 0.827 | S | S | * | * | trans | -136.6 | 126.9 | -171.5 | 177.5 | 0 | 0 | 0 | 0 | 112 | ||||
| 12 | S | 28.4 | Very low | 30.9 | Very low | 120 Ų | 120 | 157 Ų | 157 | 84% | 0.839 | 82% | 0.819 | S | S | * | * | trans | -153 | 148.1 | 168.3 | 56.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 13 | R | 28.9 | Very low | 30.6 | Very low | 244 Ų | 244 | 159.3 Ų | 159.3 | 92% | 0.921 | 82% | 0.822 | S | S | * | * | trans | -84.7 | 154.8 | -166 | -57.7 | 164.6 | -179.8 | 156.6 | -2.4 | 113.1 | ||||
| 14 | T | 29.8 | Very low | 30.2 | Very low | 135 Ų | 135 | 154 Ų | 154 | 83% | 0.828 | 82% | 0.816 | S | S | * | * | trans | -120.4 | 137.6 | 164.5 | 49.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 15 | P | 32.5 | Very low | 29.1 | Very low | 126 Ų | 126 | 158.7 Ų | 158.7 | 82% | 0.818 | 83% | 0.829 | S | S | * | * | trans | -96.5 | 146.9 | 170.6 | 35.7 | -31.2 | 0 | 0 | 0 | 112.9 | ||||
| 16 | E | 32.2 | Very low | 28.7 | Very low | 191 Ų | 191 | 161.3 Ų | 161.3 | 89% | 0.893 | 83% | 0.832 | S | S | * | * | trans | -89.2 | 162.5 | 169.8 | -59.6 | 173.6 | 117 | 0 | 0 | 112 | ||||
| 17 | P | 32.3 | Very low | 28.5 | Very low | 119 Ų | 119 | 160.9 Ų | 160.9 | 77% | 0.773 | 83% | 0.834 | S | S | * | * | trans | -104.4 | 133.3 | 150.7 | 33.8 | -26.2 | 0 | 0 | 0 | 112.6 | ||||
| 18 | D | 30 | Very low | 28.5 | Very low | 116 Ų | 116 | 162.2 Ų | 162.2 | 62% | 0.62 | 84% | 0.841 | S | S | * | * | trans | -75.3 | 136 | -174.9 | -176.9 | 7.7 | 0 | 0 | 0 | 113.1 | R20 | D18-R20 IonicContact OD1-NE 2.8Å; D18-R20 IonicContact OD2-CZ 3.36Å; D18-R20 IonicContact OD2-NE 3.27Å; D18-R20 PolarHBondContact OD2-NE 3.07Å; D18-R20 IonicContact OD2-NH2 3.08Å; D18-R20 PolarHBondContact OD2-NH2 3.29Å | ||
| 19 | V | 29.2 | Very low | 28.4 | Very low | 133 Ų | 133 | 153.3 Ų | 153.3 | 81% | 0.806 | 83% | 0.826 | S | S | * | * | trans | -115 | 102.5 | 178.3 | 178.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 20 | R | 29.5 | Very low | 28.4 | Very low | 217 Ų | 217 | 150.7 Ų | 150.7 | 82% | 0.819 | 82% | 0.817 | S | S | * | * | trans | -101 | 111.3 | -177.4 | -66.3 | -171.9 | -177.9 | -166.1 | -1 | 113.9 | D18 | D18-R20 IonicContact OD1-NE 2.8Å; D18-R20 IonicContact OD2-CZ 3.36Å; D18-R20 IonicContact OD2-NE 3.27Å; D18-R20 PolarHBondContact OD2-NE 3.07Å; D18-R20 IonicContact OD2-NH2 3.08Å; D18-R20 PolarHBondContact OD2-NH2 3.29Å | ||
| 21 | L | 27.5 | Very low | 28.5 | Very low | 171 Ų | 171 | 158.5 Ų | 158.5 | 90% | 0.895 | 82% | 0.821 | S | S | * | * | trans | -90.4 | 137.9 | 159.1 | -75.6 | 163.1 | 0 | 0 | 0 | 110.3 | ||||
| 22 | R | 26.3 | Very low | 28.7 | Very low | 256 Ų | 256 | 162.6 Ų | 162.6 | 97% | 0.966 | 82% | 0.818 | S | S | * | * | trans | -147.2 | 147.3 | 161.8 | -153 | 170.2 | -172.6 | -177.8 | 2 | 112.7 | ||||
| 23 | K | 26.9 | Very low | 28.7 | Very low | 205 Ų | 205 | 159.6 Ų | 159.6 | 89% | 0.891 | 81% | 0.806 | S | S | * | * | trans | -78.2 | 135.2 | -174.6 | -60.8 | 176.8 | 178 | -179.9 | 0 | 112.7 | ||||
| 24 | G | 24.2 | Very low | 28.6 | Very low | 72 Ų | 72 | 153.4 Ų | 153.4 | 74% | 0.742 | 79% | 0.791 | S | S | * | * | 49.1 | 141.9 | 116.2 | 0 | 0 | 0 | 0 | 0 | 122 | |||||
| 25 | H | 28.3 | Very low | 28.5 | Very low | 198 Ų | 198 | 153.9 Ų | 153.9 | 92% | 0.917 | 79% | 0.789 | S | S | * | * | trans | -140.1 | 159.8 | 157.4 | -121.8 | -96.2 | 0 | 0 | 0 | 110.1 | ||||
| 26 | H | 27.3 | Very low | 28.3 | Very low | 179 Ų | 179 | 155.3 Ų | 155.3 | 83% | 0.829 | 79% | 0.789 | S | S | * | * | trans | -134.6 | 167.9 | -175.3 | -140.5 | -71.4 | 0 | 0 | 0 | 109.5 | ||||
| 27 | L | 30.1 | Very low | 28.1 | Very low | 150 Ų | 150 | 151 Ų | 151 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | trans | 118.4 | 137.8 | 175 | -70.3 | 163.4 | 0 | 0 | 0 | 111.5 | ||||
| 28 | D | 28 | Very low | 27.9 | Very low | 148 Ų | 148 | 154.8 Ų | 154.8 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | cis | -153.7 | -176.7 | -13.7 | -153.6 | -14.7 | 0 | 0 | 0 | 110 | ||||
| 29 | G | 27.3 | Very low | 27.7 | Very low | 59 Ų | 59 | 157.5 Ų | 157.5 | 61% | 0.608 | 80% | 0.797 | S | S | * | * | trans | -69.4 | -165.9 | -174.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 30 | T | 27.1 | Very low | 27.6 | Very low | 113 Ų | 113 | 154.6 Ų | 154.6 | 69% | 0.693 | 79% | 0.794 | S | S | * | * | cis | -174.8 | 127.3 | 43.3 | -64.7 | 0 | 0 | 0 | 0 | 114 | ||||
| 31 | R | 29.5 | Very low | 27.5 | Very low | 245 Ų | 245 | 150.7 Ų | 150.7 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | trans | 58.2 | 161.7 | 158 | -61.5 | 169 | -174.4 | 168.5 | 0.1 | 117.3 | ||||
| 32 | R | 27.8 | Very low | 27.5 | Very low | 217 Ų | 217 | 150.8 Ų | 150.8 | 82% | 0.819 | 79% | 0.79 | S | S | * | * | cis | -151.1 | 159.8 | -8.1 | -167.5 | -166.2 | 174 | 170.9 | -0.8 | 105 | D34 | R32-D34 IonicContact CZ-OD2 3.14Å; R32-D34 IonicContact NE-OD2 2.83Å; R32-D34 PolarHBondContact NE-OD2 3.47Å; R32-D34 IonicContact NH2-OD2 2.65Å; R32-D34 PolarHBondContact NH2-OD2 3.49Å | ||
| 33 | G | 27.5 | Very low | 27.6 | Very low | 57 Ų | 57 | 146.3 Ų | 146.3 | 59% | 0.588 | 78% | 0.779 | S | S | * | * | cis | 118.2 | 147.3 | 3.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 34 | D | 27.6 | Very low | 28.1 | Very low | 114 Ų | 114 | 141.8 Ų | 141.8 | 61% | 0.61 | 77% | 0.771 | S | S | * | * | trans | 71.4 | 113.4 | 179.3 | -45.1 | -40.3 | 0 | 0 | 0 | 115 | R32 | R32-D34 IonicContact CZ-OD2 3.14Å; R32-D34 IonicContact NE-OD2 2.83Å; R32-D34 PolarHBondContact NE-OD2 3.47Å; R32-D34 IonicContact NH2-OD2 2.65Å; R32-D34 PolarHBondContact NH2-OD2 3.49Å | ||
| 35 | N | 27.6 | Very low | 28.2 | Very low | 145 Ų | 145 | 144.4 Ų | 144.4 | 78% | 0.775 | 77% | 0.767 | S | S | * | * | 69.3 | 127 | 79.5 | -80.5 | 28.3 | 0 | 0 | 0 | 112.6 | |||||
| 36 | D | 28.4 | Very low | 28.1 | Very low | 156 Ų | 156 | 141.7 Ų | 141.7 | 83% | 0.834 | 76% | 0.758 | S | S | * | * | -153.5 | 175.8 | 58.6 | -101 | -32.7 | 0 | 0 | 0 | 115.2 | |||||
| 37 | S | 26.9 | Very low | 28 | Very low | 102 Ų | 102 | 141.1 Ų | 141.1 | 71% | 0.713 | 76% | 0.756 | S | S | * | * | trans | -96.1 | 156.1 | 179.4 | 58.3 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 38 | H | 29.3 | Very low | 27.8 | Very low | 198 Ų | 198 | 138.4 Ų | 138.4 | 92% | 0.917 | 76% | 0.755 | S | S | * | * | trans | -146.8 | 139.2 | 149.4 | -108 | -72.5 | 0 | 0 | 0 | 111.7 | ||||
| 39 | Q | 26.2 | Very low | 27.6 | Very low | 173 Ų | 173 | 136.7 Ų | 136.7 | 81% | 0.808 | 76% | 0.755 | S | S | * | * | trans | -123 | 147.1 | 177.4 | 178.8 | 176.4 | -5.6 | 0 | 0 | 108.1 | ||||
| 40 | G | 26.4 | Very low | 27.4 | Very low | 72 Ų | 72 | 139.5 Ų | 139.5 | 74% | 0.742 | 76% | 0.76 | S | S | * | * | trans | 179.7 | 104.9 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 41 | D | 27.1 | Very low | 27.3 | Very low | 134 Ų | 134 | 141.9 Ų | 141.9 | 72% | 0.717 | 77% | 0.768 | S | S | * | * | trans | -76.1 | 146.8 | 177.5 | -46.9 | -89.6 | 0 | 0 | 0 | 111.8 | ||||
| 42 | L | 28.3 | Very low | 27 | Very low | 174 Ų | 174 | 134.7 Ų | 134.7 | 91% | 0.911 | 76% | 0.755 | S | S | * | * | -167.5 | 126.2 | 129.8 | -129.6 | 69.1 | 0 | 0 | 0 | 112.4 | |||||
| 43 | E | 28.2 | Very low | 27 | Very low | 161 Ų | 161 | 129 Ų | 129 | 75% | 0.752 | 75% | 0.748 | S | S | * | * | trans | -109.7 | 153.9 | 156.1 | -144.4 | -171.6 | -142.7 | 0 | 0 | 107 | ||||
| 44 | P | 37.4 | Very low | 26.9 | Very low | 111 Ų | 111 | 134.1 Ų | 134.1 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | -150.4 | 141.1 | 90.1 | 36.6 | -18.1 | 0 | 0 | 0 | 117.2 | |||||
| 45 | I | 26.3 | Very low | 26.8 | Very low | 126 Ų | 126 | 137 Ų | 137 | 65% | 0.646 | 77% | 0.766 | S | S | * | * | trans | 16.7 | 118.3 | 130.1 | -20.7 | 174.8 | 0 | 0 | 0 | 118.7 | ||||
| 46 | L | 26.1 | Very low | 26.7 | Very low | 141 Ų | 141 | 138.9 Ų | 138.9 | 74% | 0.738 | 77% | 0.767 | S | S | * | * | -178.3 | 145.5 | 106.4 | -120 | 92.5 | 0 | 0 | 0 | 115.9 | |||||
| 47 | E | 25.5 | Very low | 26.5 | Very low | 168 Ų | 168 | 139.8 Ų | 139.8 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | trans | 38.9 | 101.5 | 150.3 | -68.4 | -177.5 | 164.7 | 0 | 0 | 124.2 | ||||
| 48 | A | 25.1 | Very low | 26.3 | Very low | 92 Ų | 92 | 139.7 Ų | 139.7 | 76% | 0.76 | 76% | 0.763 | S | S | * | * | 62 | 119.2 | 107.9 | 0 | 0 | 0 | 0 | 0 | 123.4 | |||||
| 49 | S | 23.4 | Very low | 26.1 | Very low | 112 Ų | 112 | 135 Ų | 135 | 78% | 0.783 | 75% | 0.753 | S | S | * | * | 135.2 | 149.9 | 105.9 | 79 | 0 | 0 | 0 | 0 | 118.8 | |||||
| 50 | V | 23.7 | Very low | 26.1 | Very low | 119 Ų | 119 | 135.8 Ų | 135.8 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | trans | 59.5 | 109.1 | 158.7 | -167.2 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 51 | L | 24.8 | Very low | 26 | Very low | 163 Ų | 163 | 140.5 Ų | 140.5 | 85% | 0.853 | 76% | 0.759 | S | S | * | * | -161.4 | 133.1 | 111.4 | -119.2 | 86.1 | 0 | 0 | 0 | 106.3 | |||||
| 52 | S | 23.6 | Very low | 25.9 | Very low | 94 Ų | 94 | 142 Ų | 142 | 66% | 0.657 | 76% | 0.761 | S | S | * | * | cis | 68.3 | 130 | 34 | -154.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 53 | S | 26.6 | Very low | 25.7 | Very low | 98 Ų | 98 | 142 Ų | 142 | 69% | 0.685 | 76% | 0.757 | S | S | * | * | cis | -160.8 | -172.1 | -4.4 | 59.8 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 54 | H | 26.5 | Very low | 25.6 | Very low | 163 Ų | 163 | 140.3 Ų | 140.3 | 76% | 0.755 | 76% | 0.761 | S | S | * | * | cis | -158.2 | 155.5 | 5.5 | -148 | -65.9 | 0 | 0 | 0 | 111.6 | ||||
| 55 | H | 25.7 | Very low | 25.1 | Very low | 174 Ų | 174 | 139.9 Ų | 139.9 | 81% | 0.806 | 76% | 0.761 | S | S | * | * | trans | -76.6 | 139.1 | 167.8 | -121.7 | -32.1 | 0 | 0 | 0 | 113.4 | ||||
| 56 | K | 25.5 | Very low | 25.4 | Very low | 185 Ų | 185 | 141.8 Ų | 141.8 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | trans | 167.3 | 153.9 | 149.3 | -99.5 | 158 | -171.6 | 172.1 | 0 | 111.1 | ||||
| 57 | K | 24.4 | Very low | 25.6 | Very low | 176 Ų | 176 | 144.2 Ų | 144.2 | 77% | 0.765 | 78% | 0.78 | S | S | * | * | cis | -163.6 | 172.6 | -4.4 | -151.8 | -174.2 | 178.4 | -161.9 | 0 | 109.7 | ||||
| 58 | S | 22.5 | Very low | 25.8 | Very low | 99 Ų | 99 | 140.2 Ų | 140.2 | 69% | 0.692 | 78% | 0.776 | S | S | * | * | trans | 63.2 | 149.9 | 158.6 | 38.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 59 | S | 23.9 | Very low | 26.3 | Very low | 100 Ų | 100 | 141.6 Ų | 141.6 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | cis | 140 | 149.9 | -19.2 | 60.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 60 | E | 26.6 | Very low | 26.5 | Very low | 189 Ų | 189 | 145.4 Ų | 145.4 | 88% | 0.883 | 78% | 0.782 | S | S | * | * | trans | 87.8 | 172.3 | 177.4 | -59.8 | 177 | -173.5 | 0 | 0 | 116.3 | ||||
| 61 | E | 25.6 | Very low | 27.1 | Very low | 172 Ų | 172 | 147.6 Ų | 147.6 | 80% | 0.804 | 78% | 0.784 | S | S | * | * | trans | -116.5 | -176.1 | -132.4 | -50.4 | -175.8 | 142.2 | 0 | 0 | 116.7 | ||||
| 62 | H | 23.8 | Very low | 27.7 | Very low | 166 Ų | 166 | 147 Ų | 147 | 77% | 0.769 | 78% | 0.782 | S | S | * | * | trans | 72.4 | 154 | -176.7 | -69.3 | 38.6 | 0 | 0 | 0 | 113.8 | ||||
| 63 | E | 25.3 | Very low | 28.7 | Very low | 174 Ų | 174 | 150.9 Ų | 150.9 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | cis | -141.4 | 178.1 | 10 | -150 | 158.3 | -137.4 | 0 | 0 | 111.5 | ||||
| 64 | C | 24.4 | Very low | 29.5 | Very low | 124 Ų | 124 | 149.2 Ų | 149.2 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -96.8 | 124 | 178.9 | -174.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 65 | S | 27.2 | Very low | 30.5 | Very low | 103 Ų | 103 | 148.4 Ų | 148.4 | 72% | 0.72 | 78% | 0.782 | S | S | * | * | trans | -144 | 132.1 | 173 | 58.1 | 0 | 0 | 0 | 0 | 111 | ||||
| 66 | D | 32.8 | Very low | 31.6 | Very low | 165 Ų | 165 | 148.4 Ų | 148.4 | 88% | 0.882 | 79% | 0.785 | S | S | * | * | trans | -68.7 | 130.1 | -179.6 | -56.8 | -82.3 | 0 | 0 | 0 | 112.7 | ||||
| 67 | E | 30 | Very low | 32.9 | Very low | 192 Ų | 192 | 143.5 Ų | 143.5 | 90% | 0.897 | 79% | 0.787 | S | S | * | * | trans | -124.1 | 143.2 | 155.3 | -72 | -159.8 | 147.6 | 0 | 0 | 110 | ||||
| 68 | A | 30.6 | Very low | 34.4 | Very low | 85 Ų | 85 | 138.5 Ų | 138.5 | 70% | 0.702 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 154 | -171.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q70 | A68-Q70 PolarHBondContact O-N 3.3Š|
| 69 | P | 34.5 | Very low | 36.7 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 78% | 0.779 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 121.6 | 174.3 | 26.4 | -34.5 | 0 | 0 | 0 | 110.4 | E71 | P69-E71 PolarHBondContact O-N 2.83Š|
| 70 | Q | 29.3 | Very low | 38.9 | Very low | 193 Ų | 193 | 137.2 Ų | 137.2 | 90% | 0.902 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 122.6 | 166.3 | -74.1 | -176.4 | -28.6 | 0 | 0 | 109 | A68 | A68-Q70 PolarHBondContact O-N 3.3Š|
| 71 | E | 35.1 | Very low | 41 | Very low | 164 Ų | 164 | 135 Ų | 135 | 77% | 0.766 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 127 | 173.7 | -62.7 | -174.4 | 123.7 | 0 | 0 | 109.3 | P69 E73 | P69-E71 PolarHBondContact O-N 2.83Å; E71-E73 VanDerWaalsContact C-N 3.34Å; E71-E73 PolarHBondContact O-N 3.2Å |
| 72 | D | 38.3 | Very low | 43.1 | Very low | 151 Ų | 151 | 131.1 Ų | 131.1 | 81% | 0.807 | 73% | 0.733 | S | S | * | * | trans | -76.4 | 86.8 | 179.5 | -166.1 | 13.4 | 0 | 0 | 0 | 109.3 | G74 F75 | D72-G74 PolarHBondContact O-N 2.88Å; D72-F75 PolarHBondContact O-N 3.27Å | ||
| 73 | E | 43.4 | Very low | 45.4 | Very low | 176 Ų | 176 | 126.5 Ų | 126.5 | 82% | 0.822 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | 63.4 | -176.5 | -88.2 | -80.7 | -147.6 | 0 | 0 | 113.1 | E71 | E71-E73 VanDerWaalsContact C-N 3.34Å; E71-E73 PolarHBondContact O-N 3.2Å |
| 74 | G | 43.8 | Very low | 47.6 | Very low | 62 Ų | 62 | 120.6 Ų | 120.6 | 64% | 0.639 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -152.7 | -12.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D72 | D72-G74 PolarHBondContact O-N 2.88Š|
| 75 | F | 47.9 | Very low | 49.8 | Very low | 146 Ų | 146 | 120 Ų | 120 | 64% | 0.64 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -89.5 | -23.7 | -174.3 | -165.4 | -111 | 0 | 0 | 0 | 115.1 | D72 Q83 | D72-F75 PolarHBondContact O-N 3.27Å; F75-Q83 VanDerWaalsContact CZ-NE2 3.26Å |
| 76 | M | 48.1 | Very low | 52.2 | Low | 175 Ų | 175 | 119 Ų | 119 | 86% | 0.862 | 66% | 0.661 | S | S | * | * | S | Bend | trans | -92.2 | -3.3 | -174.8 | -70.4 | -153.3 | -172.3 | 0 | 0 | 115.8 | ||
| 77 | G | 53.2 | Low | 54.1 | Low | 81 Ų | 81 | 114 Ų | 114 | 84% | 0.835 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -87.4 | -5.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||
| 78 | M | 56.3 | Low | 56.2 | Low | 71 Ų | 71 | 110.6 Ų | 110.6 | 35% | 0.35 | 63% | 0.629 | S | S | . | * | S | Bend | trans | -100.7 | 138.1 | -164.7 | -154.2 | 151.2 | 79 | 0 | 0 | 112.7 | L82 Q83 H86 | M78-L82 HydrophobicContact CE-CG 4.29Å; M78-L82 HydrophobicContact CG-CB 3.92Å; M78-L82 HydrophobicContact CG-CD2 3.67Å; M78-L82 HydrophobicContact CG-CG 3.72Å; M78-L82 HydrophobicContact SD-CD2 3.85Å; M78-L82 HydrophobicContact SD-CG 3.78Å; M78-Q83 HydrophobicContact CE-CB 4.33Å; M78-H86 HydrophobicContact CE-CB 4.12Å |
| 79 | S | 70.1 | Confident | 58.3 | Low | 66 Ų | 66 | 111.5 Ų | 111.5 | 46% | 0.462 | 62% | 0.619 | S | S | . | * | trans | -64 | 145.4 | -179.6 | 73.6 | 0 | 0 | 0 | 0 | 111.1 | L81 L82 Q83 | S79-L81 PolarHBondContact O-N 3.16Å; S79-L82 PolarHBondContact O-N 2.91Å; S79-L82 PolarHBondContact OG-N 3.24Å; S79-Q83 PolarHBondContact O-N 2.92Å | ||
| 80 | P | 70.9 | Confident | 60 | Low | 107 Ų | 107 | 111.6 Ų | 111.6 | 70% | 0.695 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -56.2 | -30 | -176.3 | -28.6 | 35.6 | 0 | 0 | 0 | 113.9 | A84 | P80-A84 VanDerWaalsContact O-CB 3.28Å; P80-A84 WeakPolarHBondContact O-CB 3.5Å; P80-A84 PolarHBondContact O-N 2.76Å |
| 81 | L | 69.6 | Low | 62 | Low | 143 Ų | 143 | 108.1 Ų | 108.1 | 75% | 0.749 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.5 | -41.6 | 176.8 | -129.8 | 172.1 | 0 | 0 | 0 | 112.1 | S79 H85 | S79-L81 PolarHBondContact O-N 3.16Å; L81-H85 PolarHBondContact O-N 3.15Å |
| 82 | L | 70.1 | Confident | 63.6 | Low | 90 Ų | 90 | 106.2 Ų | 106.2 | 47% | 0.471 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -76.1 | -33.4 | 177.8 | -176.3 | 57.2 | 0 | 0 | 0 | 111.6 | M78 S79 H85 H86 | M78-L82 HydrophobicContact CE-CG 4.29Å; M78-L82 HydrophobicContact CG-CB 3.92Å; M78-L82 HydrophobicContact CG-CD2 3.67Å; M78-L82 HydrophobicContact CG-CG 3.72Å; M78-L82 HydrophobicContact SD-CD2 3.85Å; M78-L82 HydrophobicContact SD-CG 3.78Å; S79-L82 PolarHBondContact O-N 2.91Å; S79-L82 PolarHBondContact OG-N 3.24Å; L82-H85 PolarHBondContact O-N 3.29Å; L82-H86 WeakPolarHBondContact O-CB 3.39Å; L82-H86 PolarHBondContact O-N 3.38Å |
| 83 | Q | 73.5 | Confident | 64.7 | Low | 69 Ų | 69 | 104 Ų | 104 | 32% | 0.322 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.6 | -41 | 170.9 | -159.4 | 178.3 | 36.5 | 0 | 0 | 111.4 | F75 M78 S79 A87 | F75-Q83 VanDerWaalsContact CZ-NE2 3.26Å; M78-Q83 HydrophobicContact CE-CB 4.33Å; S79-Q83 PolarHBondContact O-N 2.92Å; Q83-A87 WeakPolarHBondContact O-CB 3.31Å; Q83-A87 PolarHBondContact O-N 3.3Å |
| 84 | A | 71.3 | Confident | 65.7 | Low | 49 Ų | 49 | 102 Ų | 102 | 41% | 0.405 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.7 | -42.4 | 172 | 0 | 0 | 0 | 0 | 0 | 112.5 | P80 A87 M88 | P80-A84 VanDerWaalsContact O-CB 3.28Å; P80-A84 WeakPolarHBondContact O-CB 3.5Å; P80-A84 PolarHBondContact O-N 2.76Å; A84-A87 PolarHBondContact O-N 3.33Å; A84-M88 WeakPolarHBondContact O-CG 3.46Å; A84-M88 PolarHBondContact O-N 3.06Å |
| 85 | H | 70.4 | Confident | 66.6 | Low | 113 Ų | 113 | 102.5 Ų | 102.5 | 52% | 0.523 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -59.5 | -49.7 | 176.4 | -168 | -71.2 | 0 | 0 | 0 | 111.8 | L81 L82 A87 M88 E89 | L81-H85 PolarHBondContact O-N 3.15Å; L82-H85 PolarHBondContact O-N 3.29Å; H85-A87 VanDerWaalsContact C-N 3.28Å; H85-A87 PolarHBondContact O-N 3.42Å; H85-M88 WeakPolarHBondContact O-CB 3.49Å; H85-M88 PolarHBondContact O-N 3.5Å; H85-M88 VanDerWaalsContact O-N 3.15Å; H85-E89 IonicContact ND1-OE2 2.91Å; H85-E89 WeakPolarHBondContact O-CB 3.2Å; H85-E89 PolarHBondContact O-N 2.95Å |
| 86 | H | 76.3 | Confident | 67 | Low | 80 Ų | 80 | 99.1 Ų | 99.1 | 37% | 0.37 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.2 | -29.1 | 178.5 | -177.6 | -135.4 | 0 | 0 | 0 | 112.7 | M78 L82 K90 | M78-H86 HydrophobicContact CE-CB 4.12Å; L82-H86 WeakPolarHBondContact O-CB 3.39Å; L82-H86 PolarHBondContact O-N 3.38Å; H86-K90 VanDerWaalsContact NE2-CE 3.34Å; H86-K90 WeakPolarHBondContact NE2-CE 3.41Å; H86-K90 WeakPolarHBondContact O-CB 3.41Å; H86-K90 WeakPolarHBondContact O-CG 3.48Å; H86-K90 PolarHBondContact O-N 3.37Å; H86-K90 VanDerWaalsContact O-N 3.1Å |
| 87 | A | 74 | Confident | 67.3 | Low | 62 Ų | 62 | 96.4 Ų | 96.4 | 51% | 0.512 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -71.8 | -38.1 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q83 A84 H85 M91 | Q83-A87 WeakPolarHBondContact O-CB 3.31Å; Q83-A87 PolarHBondContact O-N 3.3Å; A84-A87 PolarHBondContact O-N 3.33Å; H85-A87 VanDerWaalsContact C-N 3.28Å; H85-A87 PolarHBondContact O-N 3.42Å; A87-M91 WeakPolarHBondContact O-CB 3.28Å; A87-M91 PolarHBondContact O-N 2.78Å |
| 88 | M | 73.1 | Confident | 67.3 | Low | 120 Ų | 120 | 96.2 Ų | 96.2 | 59% | 0.591 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -64.5 | -45.8 | 172.1 | -74.1 | 176.2 | 57.8 | 0 | 0 | 111.4 | A84 H85 K90 M91 E92 | A84-M88 WeakPolarHBondContact O-CG 3.46Å; A84-M88 PolarHBondContact O-N 3.06Å; H85-M88 WeakPolarHBondContact O-CB 3.49Å; H85-M88 PolarHBondContact O-N 3.5Å; H85-M88 VanDerWaalsContact O-N 3.15Å; M88-K90 VanDerWaalsContact C-N 3.34Å; M88-K90 PolarHBondContact O-N 3.5Å; M88-M91 CarbonylContact O-C 3.58Å; M88-M91 WeakPolarHBondContact O-CA 3.34Å; M88-M91 WeakPolarHBondContact O-CB 3.22Å; M88-M91 PolarHBondContact O-N 3.26Å; M88-E92 WeakPolarHBondContact O-CG 3Å; M88-E92 PolarHBondContact O-N 2.84Å |
| 89 | E | 74.8 | Confident | 67.1 | Low | 104 Ų | 104 | 99.2 Ų | 99.2 | 49% | 0.486 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.1 | -41.4 | 178.3 | -169.7 | 169.1 | -164.6 | 0 | 0 | 111.9 | H85 E92 E93 | H85-E89 IonicContact ND1-OE2 2.91Å; H85-E89 WeakPolarHBondContact O-CB 3.2Å; H85-E89 PolarHBondContact O-N 2.95Å; E89-E92 PolarHBondContact O-N 2.57Å; E89-E93 PolarHBondContact O-N 2.81Å |
| 90 | K | 71.2 | Confident | 66.2 | Low | 122 Ų | 122 | 99.4 Ų | 99.4 | 53% | 0.53 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -69.5 | -32.3 | 171.2 | -75.5 | -176.2 | 175.2 | -179.9 | 0 | 113.8 | H86 M88 F94 | H86-K90 VanDerWaalsContact NE2-CE 3.34Å; H86-K90 WeakPolarHBondContact NE2-CE 3.41Å; H86-K90 WeakPolarHBondContact O-CB 3.41Å; H86-K90 WeakPolarHBondContact O-CG 3.48Å; H86-K90 PolarHBondContact O-N 3.37Å; H86-K90 VanDerWaalsContact O-N 3.1Å; M88-K90 VanDerWaalsContact C-N 3.34Å; M88-K90 PolarHBondContact O-N 3.5Å; K90-F94 VanDerWaalsContact O-CB 3.3Å; K90-F94 WeakPolarHBondContact O-CB 3.4Å; K90-F94 PolarHBondContact O-N 3.16Å |
| 91 | M | 69.7 | Low | 65.5 | Low | 119 Ų | 119 | 96.8 Ų | 96.8 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -66.5 | -42.3 | 171.8 | -177.1 | 73.7 | 87.2 | 0 | 0 | 110.7 | A87 M88 F94 V95 | A87-M91 WeakPolarHBondContact O-CB 3.28Å; A87-M91 PolarHBondContact O-N 2.78Å; M88-M91 CarbonylContact O-C 3.58Å; M88-M91 WeakPolarHBondContact O-CA 3.34Å; M88-M91 WeakPolarHBondContact O-CB 3.22Å; M88-M91 PolarHBondContact O-N 3.26Å; M91-F94 PolarHBondContact O-N 3.18Å; M91-V95 HydrophobicContact CG-CG2 4.35Å; M91-V95 WeakPolarHBondContact O-CB 3.36Å; M91-V95 VanDerWaalsContact O-CG2 3.26Å; M91-V95 WeakPolarHBondContact O-CG2 3.3Å; M91-V95 PolarHBondContact O-N 2.9Å; M91-V95 HydrophobicContact SD-CG2 4.44Å |
| 92 | E | 68.9 | Low | 65.6 | Low | 125 Ų | 125 | 100 Ų | 100 | 58% | 0.584 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -64.8 | -44.6 | 176.3 | -72.4 | -176.8 | 173.2 | 0 | 0 | 111.5 | M88 E89 F94 V95 C96 | M88-E92 WeakPolarHBondContact O-CG 3Å; M88-E92 PolarHBondContact O-N 2.84Å; E89-E92 PolarHBondContact O-N 2.57Å; E92-F94 VanDerWaalsContact C-N 3.34Å; E92-F94 PolarHBondContact O-N 2.97Å; E92-V95 PolarHBondContact O-N 3.41Å; E92-C96 WeakPolarHBondContact O-CB 3.06Å; E92-C96 PolarHBondContact O-N 2.88Å; E92-C96 PolarHBondContact O-SG 2.66Å |
| 93 | E | 62.9 | Low | 66.6 | Low | 104 Ų | 104 | 96.3 Ų | 96.3 | 49% | 0.486 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -55.7 | -47.2 | 170.2 | -89.4 | -139.7 | 123.8 | 0 | 0 | 112.2 | E89 C96 K97 | E89-E93 PolarHBondContact O-N 2.81Å; E93-C96 PolarHBondContact O-N 2.82Å; E93-K97 WeakPolarHBondContact O-CB 3.49Å; E93-K97 WeakPolarHBondContact O-CD 3.15Å; E93-K97 VanDerWaalsContact O-CG 3.23Å; E93-K97 WeakPolarHBondContact O-CG 3.43Å; E93-K97 PolarHBondContact O-N 3.21Å; E93-K97 IonicContact OE1-NZ 2.69Å; E93-K97 PolarHBondContact OE1-NZ 3.13Å; E93-K97 IonicContact OE2-NZ 3.57Å; E93-K97 PolarHBondContact OE2-NZ 2.86Å |
| 94 | F | 63.3 | Low | 67.6 | Low | 134 Ų | 134 | 102.9 Ų | 102.9 | 59% | 0.588 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.9 | -45 | -177.6 | 179.9 | -101.2 | 0 | 0 | 0 | 111.7 | K90 M91 E92 C96 K97 V98 | K90-F94 VanDerWaalsContact O-CB 3.3Å; K90-F94 WeakPolarHBondContact O-CB 3.4Å; K90-F94 PolarHBondContact O-N 3.16Å; M91-F94 PolarHBondContact O-N 3.18Å; E92-F94 VanDerWaalsContact C-N 3.34Å; E92-F94 PolarHBondContact O-N 2.97Å; F94-C96 VanDerWaalsContact C-N 3.34Å; F94-C96 PolarHBondContact O-N 2.76Å; F94-K97 PolarHBondContact O-N 3.49Å; F94-V98 HydrophobicContact CD1-CG2 4.28Å; F94-V98 HydrophobicContact CD2-CG2 4.45Å; F94-V98 HydrophobicContact CE1-CG2 3.89Å; F94-V98 HydrophobicContact CE2-CG2 4.08Å; F94-V98 HydrophobicContact CZ-CG2 3.77Å; F94-V98 WeakPolarHBondContact O-CB 3.42Å; F94-V98 WeakPolarHBondContact O-CG2 3.48Å; F94-V98 PolarHBondContact O-N 2.71Å |
| 95 | V | 63 | Low | 68.9 | Low | 73 Ų | 73 | 102.8 Ų | 102.8 | 44% | 0.442 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59 | -45.5 | 173.9 | 168.6 | 0 | 0 | 0 | 0 | 110.2 | M91 E92 V98 W99 | M91-V95 HydrophobicContact CG-CG2 4.35Å; M91-V95 WeakPolarHBondContact O-CB 3.36Å; M91-V95 VanDerWaalsContact O-CG2 3.26Å; M91-V95 WeakPolarHBondContact O-CG2 3.3Å; M91-V95 PolarHBondContact O-N 2.9Å; M91-V95 HydrophobicContact SD-CG2 4.44Å; E92-V95 PolarHBondContact O-N 3.41Å; V95-V98 PolarHBondContact O-N 2.94Å; V95-W99 VanDerWaalsContact O-CB 3.26Å; V95-W99 WeakPolarHBondContact O-CB 3.2Å; V95-W99 PolarHBondContact O-N 3.22Å |
| 96 | C | 56 | Low | 70.2 | Confident | 75 Ų | 75 | 99 Ų | 99 | 51% | 0.507 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58.7 | -50.6 | 174.5 | -70 | 0 | 0 | 0 | 0 | 112 | E92 E93 F94 V98 W99 E100 | E92-C96 WeakPolarHBondContact O-CB 3.06Å; E92-C96 PolarHBondContact O-N 2.88Å; E92-C96 PolarHBondContact O-SG 2.66Å; E93-C96 PolarHBondContact O-N 2.82Å; F94-C96 VanDerWaalsContact C-N 3.34Å; F94-C96 PolarHBondContact O-N 2.76Å; C96-V98 VanDerWaalsContact C-N 3.3Å; C96-V98 PolarHBondContact O-N 2.87Å; C96-W99 PolarHBondContact O-N 3.21Å; C96-W99 VanDerWaalsContact O-N 3.08Å; C96-E100 WeakPolarHBondContact O-CG 3.36Å; C96-E100 PolarHBondContact O-N 3.3Å |
| 97 | K | 53.6 | Low | 71.2 | Confident | 118 Ų | 118 | 97.1 Ų | 97.1 | 51% | 0.513 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.7 | -34.5 | 180 | -73 | 164.1 | -173.2 | 170.7 | 0 | 112.5 | E93 F94 | E93-K97 WeakPolarHBondContact O-CB 3.49Å; E93-K97 WeakPolarHBondContact O-CD 3.15Å; E93-K97 VanDerWaalsContact O-CG 3.23Å; E93-K97 WeakPolarHBondContact O-CG 3.43Å; E93-K97 PolarHBondContact O-N 3.21Å; E93-K97 IonicContact OE1-NZ 2.69Å; E93-K97 PolarHBondContact OE1-NZ 3.13Å; E93-K97 IonicContact OE2-NZ 3.57Å; E93-K97 PolarHBondContact OE2-NZ 2.86Å; F94-K97 PolarHBondContact O-N 3.49Å |
| 98 | V | 54 | Low | 72.3 | Confident | 76 Ų | 76 | 95.4 Ų | 95.4 | 46% | 0.461 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -73.4 | -38.1 | 172.9 | 171.7 | 0 | 0 | 0 | 0 | 111.6 | F94 V95 C96 G101 R102 | F94-V98 HydrophobicContact CD1-CG2 4.28Å; F94-V98 HydrophobicContact CD2-CG2 4.45Å; F94-V98 HydrophobicContact CE1-CG2 3.89Å; F94-V98 HydrophobicContact CE2-CG2 4.08Å; F94-V98 HydrophobicContact CZ-CG2 3.77Å; F94-V98 WeakPolarHBondContact O-CB 3.42Å; F94-V98 WeakPolarHBondContact O-CG2 3.48Å; F94-V98 PolarHBondContact O-N 2.71Å; V95-V98 PolarHBondContact O-N 2.94Å; C96-V98 VanDerWaalsContact C-N 3.3Å; C96-V98 PolarHBondContact O-N 2.87Å; V98-G101 PolarHBondContact O-N 3.02Å; V98-G101 VanDerWaalsContact O-N 3.16Å; V98-R102 PolarHBondContact O-N 3Å |
| 99 | W | 53.2 | Low | 73.5 | Confident | 135 Ų | 135 | 95.3 Ų | 95.3 | 51% | 0.511 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -70.4 | -35.6 | -179.9 | -156.1 | -85.7 | 0 | 0 | 0 | 113 | V95 C96 G101 R102 W103 | V95-W99 VanDerWaalsContact O-CB 3.26Å; V95-W99 WeakPolarHBondContact O-CB 3.2Å; V95-W99 PolarHBondContact O-N 3.22Å; C96-W99 PolarHBondContact O-N 3.21Å; C96-W99 VanDerWaalsContact O-N 3.08Å; W99-G101 PolarHBondContact O-N 2.98Å; W99-R102 PolarHBondContact O-N 2.9Å; W99-W103 PolarHBondContact O-N 3.43Å |
| 100 | E | 50.2 | Low | 74.6 | Confident | 69 Ų | 69 | 94.5 Ų | 94.5 | 32% | 0.322 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -54.9 | -24 | 169.6 | -73.3 | -152.5 | 130.1 | 0 | 0 | 112.8 | C96 S131 | C96-E100 WeakPolarHBondContact O-CG 3.36Å; C96-E100 PolarHBondContact O-N 3.3Å; E100-S131 WeakPolarHBondContact OE1-CB 3.42Å; E100-S131 PolarHBondContact OE1-OG 2.93Å |
| 101 | G | 55.4 | Low | 75.8 | Confident | 52 Ų | 52 | 89.1 Ų | 89.1 | 54% | 0.536 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -84.6 | -32.7 | 173.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | V98 W99 | V98-G101 PolarHBondContact O-N 3.02Å; V98-G101 VanDerWaalsContact O-N 3.16Å; W99-G101 PolarHBondContact O-N 2.98Å |
| 102 | R | 73.1 | Confident | 77.1 | Confident | 211 Ų | 211 | 85.3 Ų | 85.3 | 80% | 0.796 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -143.5 | 31.6 | -157.5 | -66.7 | -168.1 | 175.9 | -171.8 | 0.2 | 117.3 | V98 W99 R104 | V98-R102 PolarHBondContact O-N 3Å; W99-R102 PolarHBondContact O-N 2.9Å; R102-R104 PolarHBondContact O-N 3.27Å |
| 103 | W | 91.6 | Very high | 78.4 | Confident | 13 Ų | 13 | 85.3 Ų | 85.3 | 5% | 0.049 | 43% | 0.426 | C | S | . | . | P | Polyproline II helix | trans | -59.8 | 133.9 | 172 | 75.5 | -98.3 | 0 | 0 | 0 | 113 | W99 V105 R126 P127 M129 R141 H143 | W99-W103 PolarHBondContact O-N 3.43Å; W103-V105 HydrophobicContact CH2-CG1 4.36Å; W103-V105 HydrophobicContact CZ3-CG1 3.77Å; W103-R126 HydrophobicContact CH2-CG 3.67Å; W103-R126 HydrophobicContact CZ2-CG 4.33Å; W103-R126 HydrophobicContact CZ3-CB 4.42Å; W103-R126 HydrophobicContact CZ3-CG 3.85Å; W103-P127 HydrophobicContact CB-CG 4.15Å; W103-P127 HydrophobicContact CE3-CG 4.22Å; W103-M129 HydrophobicContact CB-SD 3.76Å; W103-M129 HydrophobicContact CD2-CE 4.16Å; W103-M129 HydrophobicContact CD2-SD 3.84Å; W103-M129 HydrophobicContact CG-CE 4.34Å; W103-M129 HydrophobicContact CG-SD 3.4Å; W103-R141 VanDerWaalsContact CE3-NH2 3.3Å; W103-R141 HydrophobicContact CH2-CB 4.17Å; W103-R141 HydrophobicContact CH2-CG 4.49Å; W103-R141 VanDerWaalsContact CH2-NH2 3.27Å; W103-R141 HydrophobicContact CZ2-CB 3.78Å; W103-R141 HydrophobicContact CZ2-CG 3.75Å; W103-R141 VanDerWaalsContact CZ2-CZ 3.44Å; W103-R141 PolarHBondContact O-NH1 2.74Å; W103-R141 PolarHBondContact O-NH2 3.25Å; W103-H143 HydrophobicContact CH2-CB 4.27Å; W103-H143 AromaticContact CH2-CD2 3.78Å |
| 104 | R | 94.4 | Very high | 80 | Confident | 207 Ų | 207 | 83.6 Ų | 83.6 | 78% | 0.781 | 42% | 0.415 | S | S | * | . | P | Polyproline II helix | trans | -102.7 | 154.3 | 172.9 | -70.8 | 179.8 | 64.3 | 178.5 | -1.5 | 110.5 | R102 P127 | R102-R104 PolarHBondContact O-N 3.27Å; R104-P127 WeakPolarHBondContact O-CD 3.21Å |
| 105 | V | 97.2 | Very high | 81.6 | Confident | 46 Ų | 46 | 77.8 Ų | 77.8 | 28% | 0.279 | 39% | 0.39 | S | S | . | . | P | Polyproline II helix | trans | -67.6 | 147.3 | 168.8 | -71.7 | 0 | 0 | 0 | 0 | 110.9 | W103 G124 H125 H143 | W103-V105 HydrophobicContact CH2-CG1 4.36Å; W103-V105 HydrophobicContact CZ3-CG1 3.77Å; V105-G124 WeakPolarHBondContact CG1-O 3.48Å; V105-H125 CarbonylContact C-O 3.45Å; V105-H125 WeakPolarHBondContact CA-O 3.3Å; V105-H125 WeakPolarHBondContact CB-O 3.16Å; V105-H143 HydrophobicContact CG1-CB 4.13Å |
| 106 | I | 97.5 | Very high | 83.2 | Confident | 35 Ų | 35 | 77 Ų | 77 | 18% | 0.179 | 38% | 0.381 | C | S | . | . | B | Isolated β-bridge | trans | -121.1 | 159.4 | -177.1 | 55.7 | 169.1 | 0 | 0 | 0 | 111.5 | V110 L111 G124 H125 P127 | I106-V110 HydrophobicContact CB-CG2 4Å; I106-V110 HydrophobicContact CD1-CG2 4.19Å; I106-L111 HydrophobicContact CD1-CD2 3.65Å; I106-L111 HydrophobicContact CD1-CG 4.48Å; I106-L111 HydrophobicContact CG1-CD2 4.29Å; I106-G124 PolarHBondContact O-N 2.73Å; I106-H125 HydrophobicContact CG1-CB 4.17Å; I106-H125 PolarHBondContact N-O 3.01Å; I106-H125 PolarHBondContact O-N 3.27Å; I106-P127 HydrophobicContact CD1-CB 4.07Å |
| 107 | P | 98.1 | Very high | 85 | Confident | 39 Ų | 39 | 75.4 Ų | 75.4 | 25% | 0.253 | 37% | 0.368 | S | S | . | . | trans | -77.9 | 165.9 | 170.4 | 34.9 | -36.7 | 0 | 0 | 0 | 112.1 | D109 V110 L122 | P107-D109 WeakPolarHBondContact CB-OD1 3.34Å; P107-D109 VanDerWaalsContact CG-OD1 3.28Å; P107-D109 WeakPolarHBondContact CG-OD1 3.49Å; P107-V110 HydrophobicContact CG-CG2 4.02Å; P107-V110 WeakPolarHBondContact O-CG2 3.45Å; P107-L122 CarbonylContact C-O 3.2Å; P107-L122 WeakPolarHBondContact CA-O 3.44Å | ||
| 108 | H | 98 | Very high | 87 | Confident | 27 Ų | 27 | 70.4 Ų | 70.4 | 13% | 0.125 | 35% | 0.346 | C | S | . | . | S | Bend | trans | -68.7 | -32.2 | -174 | -178.2 | -76.6 | 0 | 0 | 0 | 114.1 | V110 L111 L121 L122 H125 | H108-V110 VanDerWaalsContact C-N 3.32Å; H108-V110 PolarHBondContact O-N 3.33Å; H108-L111 HydrophobicContact CB-CD1 4.37Å; H108-L111 WeakPolarHBondContact O-CB 3.5Å; H108-L111 PolarHBondContact O-N 2.92Å; H108-L121 WeakPolarHBondContact CB-O 3.37Å; H108-L122 PolarHBondContact N-O 3.11Å; H108-H125 AromaticContact CD2-NE2 3.89Å |
| 109 | D | 97.4 | Very high | 89.1 | Confident | 118 Ų | 118 | 70.9 Ų | 70.9 | 63% | 0.631 | 35% | 0.346 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.6 | -36 | -176 | 56.9 | -64.2 | 0 | 0 | 0 | 113.1 | P107 L111 | P107-D109 WeakPolarHBondContact CB-OD1 3.34Å; P107-D109 VanDerWaalsContact CG-OD1 3.28Å; P107-D109 WeakPolarHBondContact CG-OD1 3.49Å; D109-L111 VanDerWaalsContact C-N 3.34Å; D109-L111 PolarHBondContact O-N 3.1Å |
| 110 | V | 97.5 | Very high | 91.2 | Very high | 86 Ų | 86 | 66.3 Ų | 66.3 | 52% | 0.521 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.3 | 6.7 | 178.5 | -55.8 | 0 | 0 | 0 | 0 | 114.4 | I106 P107 H108 | I106-V110 HydrophobicContact CB-CG2 4Å; I106-V110 HydrophobicContact CD1-CG2 4.19Å; P107-V110 HydrophobicContact CG-CG2 4.02Å; P107-V110 WeakPolarHBondContact O-CG2 3.45Å; H108-V110 VanDerWaalsContact C-N 3.32Å; H108-V110 PolarHBondContact O-N 3.33Å |
| 111 | L | 97.3 | Very high | 93.5 | Very high | 9 Ų | 9 | 63.5 Ų | 63.5 | 5% | 0.047 | 32% | 0.317 | C | S | . | . | S | Bend | trans | -68.5 | 150.1 | 174.9 | -72.4 | 171.8 | 0 | 0 | 0 | 111.8 | I106 H108 D109 L115 K116 H125 | I106-L111 HydrophobicContact CD1-CD2 3.65Å; I106-L111 HydrophobicContact CD1-CG 4.48Å; I106-L111 HydrophobicContact CG1-CD2 4.29Å; H108-L111 HydrophobicContact CB-CD1 4.37Å; H108-L111 WeakPolarHBondContact O-CB 3.5Å; H108-L111 PolarHBondContact O-N 2.92Å; D109-L111 VanDerWaalsContact C-N 3.34Å; D109-L111 PolarHBondContact O-N 3.1Å; L111-L115 HydrophobicContact CB-CB 4.36Å; L111-L115 HydrophobicContact CD1-CB 4.37Å; L111-L115 HydrophobicContact CD2-CB 3.97Å; L111-L115 HydrophobicContact CD2-CD1 4.07Å; L111-L115 HydrophobicContact CG-CB 4.48Å; L111-K116 HydrophobicContact CB-CG 3.82Å; L111-K116 HydrophobicContact CD1-CG 4.33Å; L111-K116 WeakPolarHBondContact O-CE 3.31Å; L111-K116 PolarHBondContact O-NZ 3.43Å; L111-H125 HydrophobicContact CD1-CB 4.29Å; L111-H125 HydrophobicContact CD2-CB 3.98Å |
| 112 | P | 96.9 | Very high | 95.5 | Very high | 39 Ų | 39 | 64.9 Ų | 64.9 | 25% | 0.253 | 31% | 0.312 | S | S | . | . | trans | -71 | 150.8 | 159.5 | 34.1 | -35.5 | 0 | 0 | 0 | 109.8 | W114 L115 | P112-W114 VanDerWaalsContact C-N 3.27Å; P112-W114 HydrophobicContact CG-CZ2 4.07Å; P112-W114 PolarHBondContact O-N 2.82Å; P112-W114 VanDerWaalsContact O-N 3.15Å; P112-L115 HydrophobicContact CG-CB 4.33Å; P112-L115 HydrophobicContact CG-CD1 3.85Å; P112-L115 HydrophobicContact CG-CG 4.06Å; P112-L115 PolarHBondContact O-N 3.02Å | ||
| 113 | D | 96.4 | Very high | 96.7 | Very high | 126 Ų | 126 | 59.2 Ų | 59.2 | 67% | 0.674 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -65.7 | -26.2 | -165.3 | -58.3 | -43.3 | 0 | 0 | 0 | 114.6 | L115 K116 | D113-L115 PolarHBondContact O-N 3.01Å; D113-K116 PolarHBondContact O-N 3.35Å; D113-K116 VanDerWaalsContact O-N 3.08Å; D113-K116 WeakPolarHBondContact OD1-CD 3.42Å; D113-K116 IonicContact OD1-NZ 2.71Å; D113-K116 PolarHBondContact OD1-NZ 3.47Å |
| 114 | W | 96.4 | Very high | 97 | Very high | 67 Ų | 67 | 58.8 Ų | 58.8 | 25% | 0.254 | 29% | 0.294 | S | S | . | . | G | 310 helix | trans | -69.5 | -8.5 | 173.5 | 60.3 | -90.6 | 0 | 0 | 0 | 114.3 | P112 P128 Y205 S208 E209 | P112-W114 VanDerWaalsContact C-N 3.27Å; P112-W114 HydrophobicContact CG-CZ2 4.07Å; P112-W114 PolarHBondContact O-N 2.82Å; P112-W114 VanDerWaalsContact O-N 3.15Å; W114-P128 HydrophobicContact CH2-CB 4.42Å; W114-P128 HydrophobicContact CZ2-CB 4.11Å; W114-Y205 VanDerWaalsContact CZ3-O 3.29Å; W114-Y205 WeakPolarHBondContact CZ3-O 3.25Å; W114-Y205 PolarHBondContact O-OH 2.86Å; W114-S208 VanDerWaalsContact CH2-C 3.5Å; W114-S208 VanDerWaalsContact CH2-CA 3.4Å; W114-E209 HydrophobicContact CB-CB 4.48Å; W114-E209 HydrophobicContact CB-CG 3.86Å; W114-E209 HydrophobicContact CD2-CB 3.99Å; W114-E209 HydrophobicContact CD2-CG 4.33Å; W114-E209 HydrophobicContact CG-CB 3.94Å; W114-E209 HydrophobicContact CG-CG 3.84Å |
| 115 | L | 97.4 | Very high | 97.2 | Very high | 12 Ų | 12 | 49.8 Ų | 49.8 | 6% | 0.063 | 26% | 0.261 | C | S | . | . | G | 310 helix | trans | -102.4 | -4.3 | 169.9 | -66.1 | -178.9 | 0 | 0 | 0 | 113.8 | L111 P112 D113 D117 Y205 | L111-L115 HydrophobicContact CB-CB 4.36Å; L111-L115 HydrophobicContact CD1-CB 4.37Å; L111-L115 HydrophobicContact CD2-CB 3.97Å; L111-L115 HydrophobicContact CD2-CD1 4.07Å; L111-L115 HydrophobicContact CG-CB 4.48Å; P112-L115 HydrophobicContact CG-CB 4.33Å; P112-L115 HydrophobicContact CG-CD1 3.85Å; P112-L115 HydrophobicContact CG-CG 4.06Å; P112-L115 PolarHBondContact O-N 3.02Å; D113-L115 PolarHBondContact O-N 3.01Å; L115-D117 VanDerWaalsContact C-N 3.35Å; L115-D117 PolarHBondContact O-N 3.43Å; L115-D117 VanDerWaalsContact O-N 3.15Å; L115-Y205 WeakPolarHBondContact CA-OH 3.44Å; L115-Y205 HydrophobicContact CD2-CD1 4.02Å; L115-Y205 HydrophobicContact CD2-CD2 4.27Å; L115-Y205 HydrophobicContact CD2-CE1 3.74Å; L115-Y205 HydrophobicContact CD2-CE2 3.98Å; L115-Y205 HydrophobicContact CD2-CG 4.27Å; L115-Y205 WeakPolarHBondContact CD2-O 3.4Å |
| 116 | K | 96.3 | Very high | 97.2 | Very high | 58 Ų | 58 | 47.9 Ų | 47.9 | 25% | 0.252 | 25% | 0.249 | S | C | . | . | trans | -88.6 | 60.1 | -177.6 | -65.9 | -179.5 | -175.7 | 146.6 | 0 | 112.5 | L111 D113 P272 | L111-K116 HydrophobicContact CB-CG 3.82Å; L111-K116 HydrophobicContact CD1-CG 4.33Å; L111-K116 WeakPolarHBondContact O-CE 3.31Å; L111-K116 PolarHBondContact O-NZ 3.43Å; D113-K116 PolarHBondContact O-N 3.35Å; D113-K116 VanDerWaalsContact O-N 3.08Å; D113-K116 WeakPolarHBondContact OD1-CD 3.42Å; D113-K116 IonicContact OD1-NZ 2.71Å; D113-K116 PolarHBondContact OD1-NZ 3.47Å; K116-P272 WeakPolarHBondContact O-CG 3.1Å | ||
| 117 | D | 93.1 | Very high | 97.2 | Very high | 41 Ų | 41 | 46.6 Ų | 46.6 | 22% | 0.219 | 24% | 0.243 | C | C | . | . | S | Bend | trans | -72.6 | -40.4 | 176.1 | -178.5 | 57.3 | 0 | 0 | 0 | 112.8 | L115 R275 R278 | L115-D117 VanDerWaalsContact C-N 3.35Å; L115-D117 PolarHBondContact O-N 3.43Å; L115-D117 VanDerWaalsContact O-N 3.15Å; D117-R275 PolarHBondContact O-NH1 3.19Å; D117-R275 VanDerWaalsContact O-NH1 3.15Å; D117-R275 PolarHBondContact O-NH2 3.27Å; D117-R275 IonicContact OD1-CZ 3.61Å; D117-R275 IonicContact OD1-NH1 3.52Å; D117-R275 IonicContact OD1-NH2 3.11Å; D117-R275 PolarHBondContact OD1-NH2 3.06Å; D117-R275 VanDerWaalsContact OD1-NH2 3.11Å; D117-R275 IonicContact OD2-CZ 3.98Å; D117-R275 IonicContact OD2-NH2 2.64Å; D117-R275 PolarHBondContact OD2-NH2 3.21Å; D117-R278 IonicContact OD1-NH2 2.66Å |
| 118 | N | 96.1 | Very high | 97.2 | Very high | 12 Ų | 12 | 47.6 Ų | 47.6 | 6% | 0.064 | 25% | 0.249 | C | C | . | . | trans | -137.3 | 99.3 | -169.5 | -168.4 | -3.7 | 0 | 0 | 0 | 113.3 | F120 L121 R331 E334 | N118-F120 PolarHBondContact O-N 2.9Å; N118-F120 VanDerWaalsContact O-N 3.15Å; N118-F120 PolarHBondContact OD1-N 2.91Å; N118-L121 HydrophobicContact CB-CD1 4.21Å; N118-L121 HydrophobicContact CB-CG 4.24Å; N118-L121 PolarHBondContact O-N 3.08Å; N118-L121 VanDerWaalsContact O-N 3.16Å; N118-R331 VanDerWaalsContact OD1-CD 3.31Å; N118-R331 WeakPolarHBondContact OD1-CD 3.15Å; N118-R331 PolarHBondContact OD1-NH1 2.83Å; N118-E334 PolarHBondContact ND2-OE1 3.46Å | ||
| 119 | D | 96.8 | Very high | 97 | Very high | 86 Ų | 86 | 46.7 Ų | 46.7 | 46% | 0.46 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -68.5 | -3.4 | 180 | 57.6 | -44.2 | 0 | 0 | 0 | 115.5 | L122 R331 | D119-L122 WeakPolarHBondContact O-CD2 2.93Å; D119-R331 IonicContact OD1-CZ 3.37Å; D119-R331 IonicContact OD1-NH1 2.66Å; D119-R331 PolarHBondContact OD1-NH1 2.9Å; D119-R331 IonicContact OD1-NH2 3.13Å; D119-R331 PolarHBondContact OD1-NH2 3.42Å; D119-R331 VanDerWaalsContact OD1-NH2 3.13Å |
| 120 | F | 98 | Very high | 97 | Very high | 39 Ų | 39 | 45.8 Ų | 45.8 | 17% | 0.171 | 25% | 0.246 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | -15 | 171.1 | -58.4 | -44.6 | 0 | 0 | 0 | 113.8 | N118 R331 E334 R335 P338 G339 | N118-F120 PolarHBondContact O-N 2.9Å; N118-F120 VanDerWaalsContact O-N 3.15Å; N118-F120 PolarHBondContact OD1-N 2.91Å; F120-R331 HydrophobicContact CD2-CB 3.93Å; F120-R331 HydrophobicContact CE2-CB 4.03Å; F120-E334 HydrophobicContact CB-CB 4.06Å; F120-E334 HydrophobicContact CB-CG 3.63Å; F120-E334 HydrophobicContact CD2-CG 4.13Å; F120-E334 HydrophobicContact CG-CG 4.35Å; F120-R335 HydrophobicContact CD2-CB 4.07Å; F120-R335 HydrophobicContact CE2-CB 3.75Å; F120-R335 HydrophobicContact CE2-CG 4.11Å; F120-R335 HydrophobicContact CZ-CB 4.2Å; F120-R335 HydrophobicContact CZ-CG 4.1Å; F120-P338 HydrophobicContact CD1-CG 4.22Å; F120-P338 WeakPolarHBondContact O-CA 3.23Å; F120-G339 PolarHBondContact O-N 3Å |
| 121 | L | 98.2 | Very high | 96.9 | Very high | 11 Ų | 11 | 43 Ų | 43 | 6% | 0.058 | 23% | 0.23 | C | C | . | . | trans | -91.5 | 104.1 | 174.7 | -53.1 | -179 | 0 | 0 | 0 | 108 | H108 N118 H125 E334 D342 H346 | H108-L121 WeakPolarHBondContact CB-O 3.37Å; N118-L121 HydrophobicContact CB-CD1 4.21Å; N118-L121 HydrophobicContact CB-CG 4.24Å; N118-L121 PolarHBondContact O-N 3.08Å; N118-L121 VanDerWaalsContact O-N 3.16Å; L121-H125 PolarHBondContact O-NE2 2.64Å; L121-E334 HydrophobicContact CD2-CB 4.04Å; L121-E334 HydrophobicContact CD2-CG 4.05Å; L121-D342 WeakPolarHBondContact CA-OD1 3.23Å; L121-H346 HydrophobicContact CD2-CB 3.77Å | ||
| 122 | L | 98.2 | Very high | 96.9 | Very high | 81 Ų | 81 | 47 Ų | 47 | 42% | 0.424 | 25% | 0.247 | S | C | . | . | trans | -90.7 | -34.4 | -162.5 | -59.9 | -175.5 | 0 | 0 | 0 | 113.3 | P107 H108 D119 P338 D342 | P107-L122 CarbonylContact C-O 3.2Å; P107-L122 WeakPolarHBondContact CA-O 3.44Å; H108-L122 PolarHBondContact N-O 3.11Å; D119-L122 WeakPolarHBondContact O-CD2 2.93Å; L122-P338 HydrophobicContact CD1-CB 4.12Å; L122-P338 HydrophobicContact CG-CB 4.4Å; L122-D342 PolarHBondContact N-OD1 3.19Å; L122-D342 PolarHBondContact N-OD2 3.17Å | ||
| 123 | H | 97.8 | Very high | 96.9 | Very high | 91 Ų | 91 | 54.3 Ų | 54.3 | 42% | 0.421 | 27% | 0.27 | S | S | . | . | S | Bend | trans | -135.8 | 174.6 | 179.7 | -151.9 | -79.8 | 0 | 0 | 0 | 111.5 | T144 D342 | H123-T144 WeakPolarHBondContact O-CG2 3.48Å; H123-D342 WeakPolarHBondContact CA-OD2 3.29Å; H123-D342 PolarHBondContact N-OD2 3.41Å; H123-D342 WeakPolarHBondContact O-CB 3.36Å |
| 124 | G | 97.3 | Very high | 96.8 | Very high | 5 Ų | 5 | 48.6 Ų | 48.6 | 5% | 0.052 | 24% | 0.24 | C | C | . | . | trans | 91.2 | 4.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | V105 I106 H143 T144 | V105-G124 WeakPolarHBondContact CG1-O 3.48Å; I106-G124 PolarHBondContact O-N 2.73Å; G124-H143 CarbonylContact O-C 3.53Å; G124-H143 WeakPolarHBondContact O-CA 3.34Å; G124-H143 WeakPolarHBondContact O-CB 3.41Å; G124-T144 PolarHBondContact O-N 3.23Å | ||
| 125 | H | 98.5 | Very high | 96.9 | Very high | 17 Ų | 17 | 45.4 Ų | 45.4 | 8% | 0.079 | 23% | 0.228 | C | C | . | . | B | Isolated β-bridge | trans | -71.8 | 153.4 | -179.7 | -63.8 | -71.4 | 0 | 0 | 0 | 112.1 | V105 I106 H108 L111 L121 T144 | V105-H125 CarbonylContact C-O 3.45Å; V105-H125 WeakPolarHBondContact CA-O 3.3Å; V105-H125 WeakPolarHBondContact CB-O 3.16Å; I106-H125 HydrophobicContact CG1-CB 4.17Å; I106-H125 PolarHBondContact N-O 3.01Å; I106-H125 PolarHBondContact O-N 3.27Å; H108-H125 AromaticContact CD2-NE2 3.89Å; L111-H125 HydrophobicContact CD1-CB 4.29Å; L111-H125 HydrophobicContact CD2-CB 3.98Å; L121-H125 PolarHBondContact O-NE2 2.64Å; H125-T144 PolarHBondContact ND1-OG1 3.49Å |
| 126 | R | 98.2 | Very high | 97 | Very high | 7 Ų | 7 | 48.7 Ų | 48.7 | 3% | 0.026 | 24% | 0.242 | C | C | . | . | P | Polyproline II helix | trans | -82 | 137.2 | 170 | -69.5 | 179.3 | -66.8 | 172.4 | 10.1 | 109.6 | W103 M129 S138 H143 H202 T203 C206 | W103-R126 HydrophobicContact CH2-CG 3.67Å; W103-R126 HydrophobicContact CZ2-CG 4.33Å; W103-R126 HydrophobicContact CZ3-CB 4.42Å; W103-R126 HydrophobicContact CZ3-CG 3.85Å; R126-M129 HydrophobicContact CB-CE 4.12Å; R126-M129 HydrophobicContact CG-CE 4.38Å; R126-S138 PolarHBondContact NH1-OG 3.2Å; R126-H143 HydrophobicContact CG-CB 3.96Å; R126-H202 PolarHBondContact NH2-O 3.09Å; R126-T203 PolarHBondContact NH1-O 3.15Å; R126-C206 HydrophobicContact CB-CB 3.82Å |
| 127 | P | 97.3 | Very high | 97 | Very high | 7 Ų | 7 | 52.2 Ų | 52.2 | 5% | 0.045 | 26% | 0.257 | C | S | . | . | P | Polyproline II helix | trans | -65.5 | 161.4 | 167.6 | 30.5 | -33.9 | 0 | 0 | 0 | 110.5 | W103 R104 I106 M129 | W103-P127 HydrophobicContact CB-CG 4.15Å; W103-P127 HydrophobicContact CE3-CG 4.22Å; R104-P127 WeakPolarHBondContact O-CD 3.21Å; I106-P127 HydrophobicContact CD1-CB 4.07Å; P127-M129 HydrophobicContact CG-CG 4.22Å; P127-M129 HydrophobicContact CG-SD 4.4Å; P127-M129 WeakPolarHBondContact O-CG 3.2Å; P127-M129 PolarHBondContact O-N 3.48Å |
| 128 | P | 97.4 | Very high | 97.2 | Very high | 61 Ų | 61 | 50.2 Ų | 50.2 | 40% | 0.396 | 25% | 0.247 | S | C | . | . | P | Polyproline II helix | trans | -57.3 | 130.9 | 167 | 25.8 | -33.9 | 0 | 0 | 0 | 109.9 | W114 C206 | W114-P128 HydrophobicContact CH2-CB 4.42Å; W114-P128 HydrophobicContact CZ2-CB 4.11Å; P128-C206 CarbonylContact C-O 3.59Å; P128-C206 WeakPolarHBondContact CA-O 3.34Å |
| 129 | M | 95.6 | Very high | 97.3 | Very high | 7 Ų | 7 | 50.3 Ų | 50.3 | 3% | 0.034 | 25% | 0.247 | C | C | . | . | trans | -140.8 | 91.3 | -175.2 | -72.9 | -175.6 | -63.9 | 0 | 0 | 109.6 | W103 R126 P127 S131 A134 C206 H207 | W103-M129 HydrophobicContact CB-SD 3.76Å; W103-M129 HydrophobicContact CD2-CE 4.16Å; W103-M129 HydrophobicContact CD2-SD 3.84Å; W103-M129 HydrophobicContact CG-CE 4.34Å; W103-M129 HydrophobicContact CG-SD 3.4Å; R126-M129 HydrophobicContact CB-CE 4.12Å; R126-M129 HydrophobicContact CG-CE 4.38Å; P127-M129 HydrophobicContact CG-CG 4.22Å; P127-M129 HydrophobicContact CG-SD 4.4Å; P127-M129 WeakPolarHBondContact O-CG 3.2Å; P127-M129 PolarHBondContact O-N 3.48Å; M129-S131 PolarHBondContact O-N 3.15Å; M129-A134 HydrophobicContact CB-CB 4.4Å; M129-A134 HydrophobicContact SD-CB 4.19Å; M129-C206 VanDerWaalsContact CE-SG 3.56Å; M129-C206 PolarHBondContact N-O 2.88Å; M129-H207 CarbonylContact C-O 3.58Å; M129-H207 WeakPolarHBondContact O-CA 3.22Å | ||
| 130 | P | 95.8 | Very high | 97.4 | Very high | 100 Ų | 100 | 54.2 Ų | 54.2 | 65% | 0.649 | 26% | 0.26 | S | S | * | . | trans | -75.7 | 46.4 | -177 | 33.3 | -37.4 | 0 | 0 | 0 | 112.9 | H207 | P130-H207 VanDerWaalsContact C-NE2 3.34Š| ||
| 131 | S | 95.8 | Very high | 97.4 | Very high | 26 Ų | 26 | 56.5 Ų | 56.5 | 18% | 0.182 | 27% | 0.268 | C | S | . | . | trans | -137.4 | 113.4 | 173 | 167.5 | 0 | 0 | 0 | 0 | 108.3 | E100 M129 R133 A134 C135 H207 | E100-S131 WeakPolarHBondContact OE1-CB 3.42Å; E100-S131 PolarHBondContact OE1-OG 2.93Å; M129-S131 PolarHBondContact O-N 3.15Å; S131-R133 PolarHBondContact O-N 3.22Å; S131-R133 PolarHBondContact OG-N 3.15Å; S131-A134 WeakPolarHBondContact O-CB 3.42Å; S131-A134 PolarHBondContact O-N 3.19Å; S131-A134 VanDerWaalsContact O-N 3.07Å; S131-A134 PolarHBondContact OG-N 3.47Å; S131-C135 PolarHBondContact O-N 3.45Å; S131-C135 PolarHBondContact O-SG 3.15Å; S131-H207 PolarHBondContact N-NE2 3.08Å | ||
| 132 | F | 97.2 | Very high | 97.4 | Very high | 95 Ų | 95 | 61.4 Ų | 61.4 | 42% | 0.417 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -55.3 | -34.7 | 172 | -74 | -75.6 | 0 | 0 | 0 | 111.4 | A134 C135 F136 V204 H207 V211 | F132-A134 VanDerWaalsContact C-N 3.34Å; F132-A134 PolarHBondContact O-N 3.29Å; F132-C135 WeakPolarHBondContact O-CB 3.33Å; F132-C135 PolarHBondContact O-N 3.03Å; F132-C135 VanDerWaalsContact O-N 3.14Å; F132-F136 WeakPolarHBondContact O-CD2 3.35Å; F132-F136 PolarHBondContact O-N 2.68Å; F132-V204 HydrophobicContact CD1-CB 4.41Å; F132-V204 HydrophobicContact CD1-CG1 3.79Å; F132-V204 HydrophobicContact CE1-CB 4.18Å; F132-V204 HydrophobicContact CE1-CG1 3.87Å; F132-H207 AromaticContact CD1-CD2 3.92Å; F132-H207 AromaticContact CD2-CD2 3.93Å; F132-H207 AromaticContact CD2-NE2 3.51Å; F132-H207 AromaticContact CE2-NE2 3.6Å; F132-H207 AromaticContact CG-CD2 3.86Å; F132-H207 AromaticContact CG-NE2 3.91Å; F132-H207 PolarHBondContact N-CD2 2.96Å; F132-H207 PolarHBondContact N-NE2 2.88Å; F132-V211 HydrophobicContact CE1-CG1 3.91Å; F132-V211 HydrophobicContact CZ-CG1 3.99Å; F132-V211 HydrophobicContact CZ-CG2 3.95Å |
| 133 | R | 96.8 | Very high | 97.4 | Very high | 191 Ų | 191 | 57.5 Ų | 57.5 | 72% | 0.721 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -60.6 | -42.6 | 176.5 | -167.2 | -174.8 | -170.4 | -168.5 | 7.1 | 111.7 | S131 K137 | S131-R133 PolarHBondContact O-N 3.22Å; S131-R133 PolarHBondContact OG-N 3.15Å; R133-K137 WeakPolarHBondContact O-CB 3.29Å; R133-K137 PolarHBondContact O-N 3.47Å |
| 134 | A | 95.6 | Very high | 97.4 | Very high | 6 Ų | 6 | 53.3 Ų | 53.3 | 5% | 0.05 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -66.7 | -39.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | M129 S131 F132 K137 S138 | M129-A134 HydrophobicContact CB-CB 4.4Å; M129-A134 HydrophobicContact SD-CB 4.19Å; S131-A134 WeakPolarHBondContact O-CB 3.42Å; S131-A134 PolarHBondContact O-N 3.19Å; S131-A134 VanDerWaalsContact O-N 3.07Å; S131-A134 PolarHBondContact OG-N 3.47Å; F132-A134 VanDerWaalsContact C-N 3.34Å; F132-A134 PolarHBondContact O-N 3.29Å; A134-K137 PolarHBondContact O-N 2.76Å; A134-S138 PolarHBondContact O-N 3.13Å |
| 135 | C | 97.9 | Very high | 97.5 | Very high | 0 Ų | 0 | 54 Ų | 54 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -62.7 | -53 | 177.1 | -62.8 | 0 | 0 | 0 | 0 | 112.2 | S131 F132 K137 S138 | S131-C135 PolarHBondContact O-N 3.45Å; S131-C135 PolarHBondContact O-SG 3.15Å; F132-C135 WeakPolarHBondContact O-CB 3.33Å; F132-C135 PolarHBondContact O-N 3.03Å; F132-C135 VanDerWaalsContact O-N 3.14Å; C135-K137 VanDerWaalsContact C-N 3.33Å; C135-K137 PolarHBondContact O-N 2.84Å; C135-S138 WeakPolarHBondContact O-CB 3.5Å; C135-S138 PolarHBondContact O-N 2.96Å; C135-S138 PolarHBondContact O-OG 3.4Å |
| 136 | F | 98.3 | Very high | 97.5 | Very high | 82 Ų | 82 | 53.7 Ų | 53.7 | 36% | 0.36 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -64.9 | -34.6 | 176.7 | -81.2 | -85.2 | 0 | 0 | 0 | 112.6 | F132 S138 I139 W199 L200 T203 V204 | F132-F136 WeakPolarHBondContact O-CD2 3.35Å; F132-F136 PolarHBondContact O-N 2.68Å; F136-S138 PolarHBondContact O-N 3.08Å; F136-I139 HydrophobicContact CD1-CD1 3.95Å; F136-I139 WeakPolarHBondContact O-CB 3.26Å; F136-I139 VanDerWaalsContact O-CG1 3.25Å; F136-I139 WeakPolarHBondContact O-CG1 3.36Å; F136-I139 PolarHBondContact O-N 3.37Å; F136-W199 HydrophobicContact CE1-CH2 4.03Å; F136-W199 AromaticContact CE1-CZ3 3.82Å; F136-W199 HydrophobicContact CE1-CZ3 3.82Å; F136-L200 HydrophobicContact CE1-CD2 4.2Å; F136-L200 HydrophobicContact CZ-CD2 3.91Å; F136-T203 HydrophobicContact CD1-CG2 3.85Å; F136-T203 HydrophobicContact CD2-CG2 4.34Å; F136-T203 HydrophobicContact CE1-CG2 4.06Å; F136-T203 HydrophobicContact CG-CG2 4Å; F136-T203 HydrophobicContact CZ-CG2 4.38Å; F136-V204 HydrophobicContact CE2-CG1 4.18Å |
| 137 | K | 97.3 | Very high | 97.5 | Very high | 131 Ų | 131 | 53.4 Ų | 53.4 | 57% | 0.57 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -66.2 | -22 | 172.2 | -170.6 | 177.5 | 177.5 | -171.2 | 0 | 112.7 | R133 A134 C135 I139 | R133-K137 WeakPolarHBondContact O-CB 3.29Å; R133-K137 PolarHBondContact O-N 3.47Å; A134-K137 PolarHBondContact O-N 2.76Å; C135-K137 VanDerWaalsContact C-N 3.33Å; C135-K137 PolarHBondContact O-N 2.84Å; K137-I139 VanDerWaalsContact C-N 3.29Å; K137-I139 PolarHBondContact O-N 3.5Å |
| 138 | S | 97.8 | Very high | 97.6 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -72.1 | -16.5 | 175.8 | 76.9 | 0 | 0 | 0 | 0 | 114.1 | R126 A134 C135 F136 F140 R141 H143 | R126-S138 PolarHBondContact NH1-OG 3.2Å; A134-S138 PolarHBondContact O-N 3.13Å; C135-S138 WeakPolarHBondContact O-CB 3.5Å; C135-S138 PolarHBondContact O-N 2.96Å; C135-S138 PolarHBondContact O-OG 3.4Å; F136-S138 PolarHBondContact O-N 3.08Å; S138-F140 PolarHBondContact O-N 3.37Å; S138-R141 WeakPolarHBondContact O-CA 3.17Å; S138-R141 WeakPolarHBondContact O-CB 3.25Å; S138-R141 PolarHBondContact O-N 3.08Å; S138-H143 PolarHBondContact O-NE2 3.41Å |
| 139 | I | 98.4 | Very high | 97.7 | Very high | 13 Ų | 13 | 50.3 Ų | 50.3 | 7% | 0.067 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -31.5 | 173.5 | -58.5 | 176.5 | 0 | 0 | 0 | 111.7 | F136 K137 I149 W150 L153 W199 T203 | F136-I139 HydrophobicContact CD1-CD1 3.95Å; F136-I139 WeakPolarHBondContact O-CB 3.26Å; F136-I139 VanDerWaalsContact O-CG1 3.25Å; F136-I139 WeakPolarHBondContact O-CG1 3.36Å; F136-I139 PolarHBondContact O-N 3.37Å; K137-I139 VanDerWaalsContact C-N 3.29Å; K137-I139 PolarHBondContact O-N 3.5Å; I139-I149 HydrophobicContact CG1-CD1 4.48Å; I139-I149 HydrophobicContact CG1-CG2 4.18Å; I139-I149 HydrophobicContact CG2-CG2 4.18Å; I139-W150 HydrophobicContact CG2-CZ2 3.91Å; I139-W150 PolarHBondContact O-NE1 3.37Å; I139-L153 HydrophobicContact CG2-CD2 4.45Å; I139-W199 HydrophobicContact CD1-CZ3 4.32Å; I139-T203 HydrophobicContact CD1-CG2 3.9Å; I139-T203 HydrophobicContact CG1-CG2 3.97Å |
| 140 | F | 97.7 | Very high | 97.8 | Very high | 168 Ų | 168 | 54.4 Ų | 54.4 | 74% | 0.737 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -96.9 | 19.5 | 177.5 | -53.8 | -78.1 | 0 | 0 | 0 | 113.6 | S138 W150 | S138-F140 PolarHBondContact O-N 3.37Å; F140-W150 HydrophobicContact CD1-CZ2 4.13Å; F140-W150 HydrophobicContact CE1-CH2 4.21Å; F140-W150 AromaticContact CE1-CZ2 3.91Å; F140-W150 HydrophobicContact CE1-CZ2 3.91Å |
| 141 | R | 97.5 | Very high | 98 | Very high | 88 Ų | 88 | 50.9 Ų | 50.9 | 33% | 0.332 | 23% | 0.225 | S | C | . | . | S | Bend | trans | -114.6 | 156.7 | 173.2 | -78.7 | -83.1 | -60.4 | -96.1 | -5.2 | 109.9 | W103 S138 T146 | W103-R141 VanDerWaalsContact CE3-NH2 3.3Å; W103-R141 HydrophobicContact CH2-CB 4.17Å; W103-R141 HydrophobicContact CH2-CG 4.49Å; W103-R141 VanDerWaalsContact CH2-NH2 3.27Å; W103-R141 HydrophobicContact CZ2-CB 3.78Å; W103-R141 HydrophobicContact CZ2-CG 3.75Å; W103-R141 VanDerWaalsContact CZ2-CZ 3.44Å; W103-R141 PolarHBondContact O-NH1 2.74Å; W103-R141 PolarHBondContact O-NH2 3.25Å; S138-R141 WeakPolarHBondContact O-CA 3.17Å; S138-R141 WeakPolarHBondContact O-CB 3.25Å; S138-R141 PolarHBondContact O-N 3.08Å; R141-T146 WeakPolarHBondContact O-CG2 3.28Å; R141-T146 PolarHBondContact O-OG1 3.38Å |
| 142 | I | 98.4 | Very high | 98.1 | Very high | 113 Ų | 113 | 49.9 Ų | 49.9 | 58% | 0.579 | 22% | 0.218 | S | C | * | . | trans | -91.5 | 124.3 | 170.8 | -55.6 | -179.9 | 0 | 0 | 0 | 108.8 | T146 I343 | I142-T146 WeakPolarHBondContact CA-OG1 3.42Å; I142-I343 HydrophobicContact CG2-CD1 4.45Å; I142-I343 HydrophobicContact CG2-CG2 3.53Å | ||
| 143 | H | 98.5 | Very high | 98.2 | Very high | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -164.5 | 174 | 176.8 | 52.6 | 73.8 | 0 | 0 | 0 | 109.3 | W103 V105 G124 R126 S138 E145 T146 | W103-H143 HydrophobicContact CH2-CB 4.27Å; W103-H143 AromaticContact CH2-CD2 3.78Å; V105-H143 HydrophobicContact CG1-CB 4.13Å; G124-H143 CarbonylContact O-C 3.53Å; G124-H143 WeakPolarHBondContact O-CA 3.34Å; G124-H143 WeakPolarHBondContact O-CB 3.41Å; R126-H143 HydrophobicContact CG-CB 3.96Å; S138-H143 PolarHBondContact O-NE2 3.41Å; H143-E145 VanDerWaalsContact C-N 3.29Å; H143-E145 PolarHBondContact ND1-N 2.97Å; H143-E145 PolarHBondContact O-N 3.4Å; H143-T146 PolarHBondContact CE1-N 3Å; H143-T146 PolarHBondContact CE1-OG1 3.16Å; H143-T146 PolarHBondContact N-OG1 3.2Å; H143-T146 PolarHBondContact ND1-N 2.87Å; H143-T146 PolarHBondContact ND1-OG1 3.07Å; H143-T146 WeakPolarHBondContact O-CB 3.41Å; H143-T146 PolarHBondContact O-N 3.37Å; H143-T146 PolarHBondContact O-OG1 3.15Å |
| 144 | T | 98.7 | Very high | 98.3 | Very high | 2 Ų | 2 | 43 Ų | 43 | 1% | 0.012 | 20% | 0.198 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -49.5 | -46.2 | -179.9 | 52.2 | 0 | 0 | 0 | 0 | 113.4 | H123 G124 H125 T146 D342 | H123-T144 WeakPolarHBondContact O-CG2 3.48Å; G124-T144 PolarHBondContact O-N 3.23Å; H125-T144 PolarHBondContact ND1-OG1 3.49Å; T144-T146 VanDerWaalsContact C-N 3.31Å; T144-T146 PolarHBondContact O-N 3.02Å; T144-D342 VanDerWaalsContact CA-O 3.3Å; T144-D342 WeakPolarHBondContact CA-O 3.35Å; T144-D342 WeakPolarHBondContact CB-O 3.44Å; T144-D342 WeakPolarHBondContact CG2-O 3.26Å |
| 145 | E | 98.8 | Very high | 98.4 | Very high | 20 Ų | 20 | 42.9 Ų | 42.9 | 9% | 0.093 | 20% | 0.199 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.2 | -5.6 | -179.2 | -58.4 | -57 | 148.1 | 0 | 0 | 115.9 | H143 G147 N148 I149 H202 Y205 | H143-E145 VanDerWaalsContact C-N 3.29Å; H143-E145 PolarHBondContact ND1-N 2.97Å; H143-E145 PolarHBondContact O-N 3.4Å; E145-G147 PolarHBondContact O-N 2.89Å; E145-N148 PolarHBondContact O-N 3.37Å; E145-N148 PolarHBondContact OE2-ND2 2.74Å; E145-I149 HydrophobicContact CB-CD1 4.38Å; E145-I149 WeakPolarHBondContact O-CG1 3.27Å; E145-I149 PolarHBondContact O-N 2.6Å; E145-H202 IonicContact OE2-CE1 3.84Å; E145-H202 IonicContact OE2-CG 2.8Å; E145-H202 IonicContact OE2-ND1 3.59Å; E145-H202 PolarHBondContact OE2-ND1 3.03Å; E145-Y205 HydrophobicContact CG-CD1 4.29Å |
| 146 | T | 98.7 | Very high | 98.5 | Very high | 10 Ų | 10 | 43.4 Ų | 43.4 | 6% | 0.061 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.7 | -44.8 | -174.4 | -55.9 | 0 | 0 | 0 | 0 | 111.3 | R141 I142 H143 T144 W150 | R141-T146 WeakPolarHBondContact O-CG2 3.28Å; R141-T146 PolarHBondContact O-OG1 3.38Å; I142-T146 WeakPolarHBondContact CA-OG1 3.42Å; H143-T146 PolarHBondContact CE1-N 3Å; H143-T146 PolarHBondContact CE1-OG1 3.16Å; H143-T146 PolarHBondContact N-OG1 3.2Å; H143-T146 PolarHBondContact ND1-N 2.87Å; H143-T146 PolarHBondContact ND1-OG1 3.07Å; H143-T146 WeakPolarHBondContact O-CB 3.41Å; H143-T146 PolarHBondContact O-N 3.37Å; H143-T146 PolarHBondContact O-OG1 3.15Å; T144-T146 VanDerWaalsContact C-N 3.31Å; T144-T146 PolarHBondContact O-N 3.02Å; T146-W150 PolarHBondContact O-N 3.42Å; T146-W150 VanDerWaalsContact O-N 3.15Å |
| 147 | G | 98.5 | Very high | 98.5 | Very high | 2 Ų | 2 | 43.1 Ų | 43.1 | 2% | 0.021 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64.8 | -37.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | E145 T151 Q349 | E145-G147 PolarHBondContact O-N 2.89Å; G147-T151 WeakPolarHBondContact O-CB 3.31Å; G147-T151 VanDerWaalsContact O-CG2 3.28Å; G147-T151 WeakPolarHBondContact O-CG2 3.49Å; G147-T151 PolarHBondContact O-N 3.08Å; G147-T151 PolarHBondContact O-OG1 2.86Å; G147-Q349 VanDerWaalsContact CA-NE2 3.34Å |
| 148 | N | 98.8 | Very high | 98.6 | Very high | 3 Ų | 3 | 41.2 Ų | 41.2 | 2% | 0.016 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -68.1 | -41.7 | -179 | -61.3 | -13.7 | 0 | 0 | 0 | 111.3 | E145 T151 H202 H346 Q349 H352 | E145-N148 PolarHBondContact O-N 3.37Å; E145-N148 PolarHBondContact OE2-ND2 2.74Å; N148-T151 PolarHBondContact O-OG1 2.92Å; N148-T151 VanDerWaalsContact O-OG1 3.09Å; N148-H202 HydrophobicContact CB-CB 4.19Å; N148-H346 PolarHBondContact OD1-NE2 2.89Å; N148-Q349 WeakPolarHBondContact OD1-CA 3.32Å; N148-Q349 PolarHBondContact OD1-N 3.42Å; N148-H352 PolarHBondContact O-CE1 3.35Å; N148-H352 PolarHBondContact O-ND1 2.88Å |
| 149 | I | 98.9 | Very high | 98.6 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.1 | -56.1 | 176.1 | -62.2 | 164.6 | 0 | 0 | 0 | 110.8 | I139 E145 T151 H152 L153 H202 | I139-I149 HydrophobicContact CG1-CD1 4.48Å; I139-I149 HydrophobicContact CG1-CG2 4.18Å; I139-I149 HydrophobicContact CG2-CG2 4.18Å; E145-I149 HydrophobicContact CB-CD1 4.38Å; E145-I149 WeakPolarHBondContact O-CG1 3.27Å; E145-I149 PolarHBondContact O-N 2.6Å; I149-T151 PolarHBondContact O-N 2.92Å; I149-H152 PolarHBondContact O-N 2.94Å; I149-L153 WeakPolarHBondContact O-CB 3.43Å; I149-L153 PolarHBondContact O-N 3.27Å; I149-H202 HydrophobicContact CG1-CB 3.72Å |
| 150 | W | 98.9 | Very high | 98.6 | Very high | 92 Ų | 92 | 44.4 Ų | 44.4 | 35% | 0.348 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66.9 | -33.3 | -169.2 | -84.4 | 94.4 | 0 | 0 | 0 | 113.6 | I139 F140 T146 L154 | I139-W150 HydrophobicContact CG2-CZ2 3.91Å; I139-W150 PolarHBondContact O-NE1 3.37Å; F140-W150 HydrophobicContact CD1-CZ2 4.13Å; F140-W150 HydrophobicContact CE1-CH2 4.21Å; F140-W150 AromaticContact CE1-CZ2 3.91Å; F140-W150 HydrophobicContact CE1-CZ2 3.91Å; T146-W150 PolarHBondContact O-N 3.42Å; T146-W150 VanDerWaalsContact O-N 3.15Å; W150-L154 HydrophobicContact CE3-CD1 4.11Å; W150-L154 HydrophobicContact CE3-CD2 4.27Å; W150-L154 HydrophobicContact CE3-CG 4.04Å; W150-L154 HydrophobicContact CZ3-CD2 4.31Å; W150-L154 VanDerWaalsContact O-CB 3.31Å; W150-L154 WeakPolarHBondContact O-CB 3.45Å; W150-L154 VanDerWaalsContact O-CG 3.25Å; W150-L154 WeakPolarHBondContact O-CG 3.37Å; W150-L154 PolarHBondContact O-N 2.96Å |
| 151 | T | 98.8 | Very high | 98.7 | Very high | 27 Ų | 27 | 39.4 Ų | 39.4 | 17% | 0.166 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.8 | -51 | 176.4 | 44 | 0 | 0 | 0 | 0 | 112.1 | G147 N148 I149 G155 Q349 H352 I353 | G147-T151 WeakPolarHBondContact O-CB 3.31Å; G147-T151 VanDerWaalsContact O-CG2 3.28Å; G147-T151 WeakPolarHBondContact O-CG2 3.49Å; G147-T151 PolarHBondContact O-N 3.08Å; G147-T151 PolarHBondContact O-OG1 2.86Å; N148-T151 PolarHBondContact O-OG1 2.92Å; N148-T151 VanDerWaalsContact O-OG1 3.09Å; I149-T151 PolarHBondContact O-N 2.92Å; T151-G155 PolarHBondContact O-N 3.26Å; T151-Q349 HydrophobicContact CG2-CG 4.32Å; T151-H352 WeakPolarHBondContact OG1-CB 3.36Å; T151-H352 PolarHBondContact OG1-ND1 3.21Å; T151-I353 HydrophobicContact CG2-CD1 4.4Å; T151-I353 HydrophobicContact CG2-CG1 3.81Å |
| 152 | H | 98.8 | Very high | 98.7 | Very high | 4 Ų | 4 | 37 Ų | 37 | 2% | 0.019 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -79.3 | -26.6 | 179.5 | -76.8 | -179.5 | 0 | 0 | 0 | 113.7 | I149 C156 L195 S198 W199 H352 | I149-H152 PolarHBondContact O-N 2.94Å; H152-C156 WeakPolarHBondContact O-CB 3.36Å; H152-C156 PolarHBondContact O-N 3.3Å; H152-L195 HydrophobicContact CB-CD2 4.1Å; H152-L195 WeakPolarHBondContact CD2-CD2 3.42Å; H152-S198 WeakPolarHBondContact ND1-CB 3.46Å; H152-S198 PolarHBondContact ND1-OG 2.87Å; H152-W199 HydrophobicContact CB-CB 4.03Å; H152-H352 AromaticContact CD2-CG 3.81Å; H152-H352 AromaticContact CD2-ND1 3.77Å; H152-H352 AromaticContact CE1-CD2 3.39Å; H152-H352 PolarHBondContact CE1-CD2 2.95Å; H152-H352 AromaticContact CE1-CE1 3.59Å; H152-H352 AromaticContact CE1-CG 3.36Å; H152-H352 AromaticContact CE1-ND1 3.52Å; H152-H352 AromaticContact CE1-NE2 3.53Å; H152-H352 AromaticContact CG-CE1 3.86Å; H152-H352 AromaticContact CG-CG 3.96Å; H152-H352 AromaticContact CG-ND1 3.48Å; H152-H352 AromaticContact ND1-CD2 3.87Å; H152-H352 AromaticContact ND1-CE1 3.26Å; H152-H352 PolarHBondContact ND1-CE1 3.3Å; H152-H352 VanDerWaalsContact ND1-CE1 3.26Å; H152-H352 AromaticContact ND1-CG 3.67Å; H152-H352 AromaticContact ND1-ND1 3.3Å; H152-H352 PolarHBondContact ND1-ND1 3.28Å; H152-H352 AromaticContact ND1-NE2 3.62Å; H152-H352 VanDerWaalsContact NE2-CA 3.34Å; H152-H352 WeakPolarHBondContact NE2-CA 3.32Å; H152-H352 WeakPolarHBondContact NE2-CB 3.46Å; H152-H352 AromaticContact NE2-CD2 3.86Å; H152-H352 AromaticContact NE2-CG 3.47Å; H152-H352 AromaticContact NE2-ND1 3.82Å; H152-H352 PolarHBondContact NE2-O 3.43Å |
| 153 | L | 98.8 | Very high | 98.7 | Very high | 36 Ų | 36 | 31.9 Ų | 31.9 | 19% | 0.188 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.4 | -49.6 | 171.3 | 176.8 | 60.7 | 0 | 0 | 0 | 111.5 | I139 I149 C156 V157 W199 | I139-L153 HydrophobicContact CG2-CD2 4.45Å; I149-L153 WeakPolarHBondContact O-CB 3.43Å; I149-L153 PolarHBondContact O-N 3.27Å; L153-C156 WeakPolarHBondContact O-CB 3.43Å; L153-C156 PolarHBondContact O-N 2.93Å; L153-V157 PolarHBondContact O-N 3.15Å; L153-V157 VanDerWaalsContact O-N 3.13Å; L153-W199 HydrophobicContact CB-CB 4.08Å; L153-W199 HydrophobicContact CB-CD2 4.32Å; L153-W199 HydrophobicContact CB-CG 3.99Å; L153-W199 HydrophobicContact CD1-CD2 3.8Å; L153-W199 HydrophobicContact CD1-CE3 4.17Å; L153-W199 HydrophobicContact CD1-CG 4.19Å; L153-W199 HydrophobicContact CD1-CH2 4.45Å; L153-W199 HydrophobicContact CD1-CZ2 4.07Å; L153-W199 HydrophobicContact CD1-CZ3 4.48Å |
| 154 | L | 98.8 | Very high | 98.7 | Very high | 105 Ų | 105 | 35.9 Ų | 35.9 | 55% | 0.55 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -65.9 | -40.6 | 176.8 | -68.2 | 172.1 | 0 | 0 | 0 | 111.5 | W150 C156 V157 F158 | W150-L154 HydrophobicContact CE3-CD1 4.11Å; W150-L154 HydrophobicContact CE3-CD2 4.27Å; W150-L154 HydrophobicContact CE3-CG 4.04Å; W150-L154 HydrophobicContact CZ3-CD2 4.31Å; W150-L154 VanDerWaalsContact O-CB 3.31Å; W150-L154 WeakPolarHBondContact O-CB 3.45Å; W150-L154 VanDerWaalsContact O-CG 3.25Å; W150-L154 WeakPolarHBondContact O-CG 3.37Å; W150-L154 PolarHBondContact O-N 2.96Å; L154-C156 VanDerWaalsContact C-N 3.34Å; L154-C156 PolarHBondContact O-N 3.04Å; L154-V157 PolarHBondContact O-N 2.89Å; L154-F158 WeakPolarHBondContact O-CB 3.28Å; L154-F158 PolarHBondContact O-N 3.37Å |
| 155 | G | 98.8 | Very high | 98.7 | Very high | 5 Ų | 5 | 43.4 Ų | 43.4 | 5% | 0.052 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.9 | -44.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | T151 V157 F158 F159 | T151-G155 PolarHBondContact O-N 3.26Å; G155-V157 PolarHBondContact O-N 3.26Å; G155-F158 PolarHBondContact O-N 2.83Å; G155-F159 WeakPolarHBondContact O-CD2 3.32Å; G155-F159 PolarHBondContact O-N 3.4Å |
| 156 | C | 98.9 | Very high | 98.7 | Very high | 11 Ų | 11 | 42.7 Ų | 42.7 | 7% | 0.074 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -60.8 | -45.8 | 178.4 | -175.9 | 0 | 0 | 0 | 0 | 112 | H152 L153 L154 L160 L195 S196 | H152-C156 WeakPolarHBondContact O-CB 3.36Å; H152-C156 PolarHBondContact O-N 3.3Å; L153-C156 WeakPolarHBondContact O-CB 3.43Å; L153-C156 PolarHBondContact O-N 2.93Å; L154-C156 VanDerWaalsContact C-N 3.34Å; L154-C156 PolarHBondContact O-N 3.04Å; C156-L160 VanDerWaalsContact O-CB 3.26Å; C156-L160 WeakPolarHBondContact O-CB 3.46Å; C156-L160 PolarHBondContact O-N 2.87Å; C156-L195 HydrophobicContact CB-CB 3.87Å; C156-S196 PolarHBondContact SG-OG 3.01Å |
| 157 | V | 98.8 | Very high | 98.6 | Very high | 76 Ų | 76 | 45.5 Ų | 45.5 | 46% | 0.461 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -65.1 | -42 | 176.5 | 176.5 | 0 | 0 | 0 | 0 | 110.8 | L153 L154 G155 L160 C161 | L153-V157 PolarHBondContact O-N 3.15Å; L153-V157 VanDerWaalsContact O-N 3.13Å; L154-V157 PolarHBondContact O-N 2.89Å; G155-V157 PolarHBondContact O-N 3.26Å; V157-L160 PolarHBondContact O-N 2.69Å; V157-C161 WeakPolarHBondContact O-CB 3.34Å; V157-C161 PolarHBondContact O-N 2.75Å; V157-C161 PolarHBondContact O-SG 2.72Å; V157-C161 VanDerWaalsContact O-SG 3.4Å |
| 158 | F | 98.8 | Very high | 98.6 | Very high | 91 Ų | 91 | 53.4 Ų | 53.4 | 40% | 0.399 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -59.1 | -50.9 | 176.3 | 171.8 | -99.7 | 0 | 0 | 0 | 112.3 | L154 G155 L160 C161 L162 F360 | L154-F158 WeakPolarHBondContact O-CB 3.28Å; L154-F158 PolarHBondContact O-N 3.37Å; G155-F158 PolarHBondContact O-N 2.83Å; F158-L160 PolarHBondContact O-N 3.28Å; F158-C161 PolarHBondContact O-N 2.87Å; F158-L162 HydrophobicContact CE1-CD2 3.92Å; F158-L162 HydrophobicContact CZ-CD2 3.98Å; F158-L162 WeakPolarHBondContact O-CB 3.35Å; F158-L162 PolarHBondContact O-N 3.47Å; F158-F360 AromaticContact CE1-CD2 3.78Å; F158-F360 HydrophobicContact CE1-CD2 3.78Å; F158-F360 HydrophobicContact CE1-CE2 4.38Å; F158-F360 HydrophobicContact CE1-CG 4.48Å; F158-F360 AromaticContact CZ-CD2 3.71Å; F158-F360 HydrophobicContact CZ-CD2 3.71Å; F158-F360 AromaticContact CZ-CE2 3.84Å; F158-F360 HydrophobicContact CZ-CE2 3.84Å |
| 159 | F | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 56.8 Ų | 56.8 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -68.8 | -31.8 | 178.8 | -82.9 | -75.4 | 0 | 0 | 0 | 113.2 | G155 L162 G163 F187 F188 A191 I192 L195 V356 A359 F360 | G155-F159 WeakPolarHBondContact O-CD2 3.32Å; G155-F159 PolarHBondContact O-N 3.4Å; F159-L162 HydrophobicContact CD1-CD2 4.35Å; F159-L162 HydrophobicContact CE1-CD2 4.32Å; F159-G163 PolarHBondContact O-N 2.92Å; F159-F187 HydrophobicContact CD1-CZ 4.5Å; F159-F187 HydrophobicContact CE1-CE1 4.26Å; F159-F187 AromaticContact CE1-CZ 3.99Å; F159-F187 HydrophobicContact CE1-CZ 3.99Å; F159-F188 HydrophobicContact CD1-CD1 4.22Å; F159-F188 HydrophobicContact CD1-CE1 4.17Å; F159-A191 HydrophobicContact CD1-CB 4.31Å; F159-A191 HydrophobicContact CG-CB 4.31Å; F159-I192 HydrophobicContact CB-CG1 4.18Å; F159-L195 HydrophobicContact CD2-CD1 3.58Å; F159-L195 HydrophobicContact CE2-CD1 4.24Å; F159-L195 HydrophobicContact CG-CD1 4.38Å; F159-V356 HydrophobicContact CE2-CG1 4.46Å; F159-A359 HydrophobicContact CE1-CB 4.17Å; F159-A359 HydrophobicContact CE2-CB 3.85Å; F159-A359 HydrophobicContact CZ-CB 3.47Å; F159-A359 VanDerWaalsContact CZ-CB 3.47Å; F159-F360 HydrophobicContact CZ-CB 4.13Å |
| 160 | L | 98.8 | Very high | 98.4 | Very high | 80 Ų | 80 | 60.7 Ų | 60.7 | 42% | 0.419 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63.6 | -50.7 | 172 | 178.8 | 62.4 | 0 | 0 | 0 | 111.3 | C156 V157 F158 G163 I164 I192 | C156-L160 VanDerWaalsContact O-CB 3.26Å; C156-L160 WeakPolarHBondContact O-CB 3.46Å; C156-L160 PolarHBondContact O-N 2.87Å; V157-L160 PolarHBondContact O-N 2.69Å; F158-L160 PolarHBondContact O-N 3.28Å; L160-G163 PolarHBondContact O-N 2.98Å; L160-I164 HydrophobicContact CD1-CD1 3.98Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 WeakPolarHBondContact O-CD1 3.44Å; L160-I164 VanDerWaalsContact O-CG1 3.25Å; L160-I164 WeakPolarHBondContact O-CG1 3.46Å; L160-I164 PolarHBondContact O-N 3.47Å; L160-I192 HydrophobicContact CB-CD1 4.27Å; L160-I192 HydrophobicContact CB-CG1 4.48Å; L160-I192 HydrophobicContact CD1-CD1 4.08Å |
| 161 | C | 98.8 | Very high | 98.4 | Very high | 62 Ų | 62 | 60.9 Ų | 60.9 | 42% | 0.419 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -61.6 | -47.8 | 176.1 | -70.5 | 0 | 0 | 0 | 0 | 111.7 | V157 F158 G163 I164 F165 | V157-C161 WeakPolarHBondContact O-CB 3.34Å; V157-C161 PolarHBondContact O-N 2.75Å; V157-C161 PolarHBondContact O-SG 2.72Å; V157-C161 VanDerWaalsContact O-SG 3.4Å; F158-C161 PolarHBondContact O-N 2.87Å; C161-G163 VanDerWaalsContact C-N 3.34Å; C161-G163 PolarHBondContact O-N 3.05Å; C161-I164 PolarHBondContact O-N 2.81Å; C161-F165 WeakPolarHBondContact O-CD2 3.4Å; C161-F165 PolarHBondContact O-N 3.28Å |
| 162 | L | 98.6 | Very high | 98.2 | Very high | 38 Ų | 38 | 66.5 Ų | 66.5 | 20% | 0.199 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -59.9 | -42.6 | 179.5 | -177 | 61.4 | 0 | 0 | 0 | 111.9 | F158 F159 F165 Y166 F188 F360 F363 | F158-L162 HydrophobicContact CE1-CD2 3.92Å; F158-L162 HydrophobicContact CZ-CD2 3.98Å; F158-L162 WeakPolarHBondContact O-CB 3.35Å; F158-L162 PolarHBondContact O-N 3.47Å; F159-L162 HydrophobicContact CD1-CD2 4.35Å; F159-L162 HydrophobicContact CE1-CD2 4.32Å; L162-F165 PolarHBondContact O-N 2.97Å; L162-Y166 WeakPolarHBondContact O-CB 3.39Å; L162-Y166 PolarHBondContact O-N 3.43Å; L162-F188 HydrophobicContact CB-CE1 4.24Å; L162-F188 HydrophobicContact CD2-CE1 4.17Å; L162-F188 HydrophobicContact CG-CE1 3.93Å; L162-F188 HydrophobicContact CG-CZ 4.13Å; L162-F360 HydrophobicContact CD2-CD2 4.44Å; L162-F363 HydrophobicContact CD1-CE1 4.07Å; L162-F363 HydrophobicContact CD1-CZ 4.2Å; L162-F363 HydrophobicContact CD2-CD1 3.87Å; L162-F363 HydrophobicContact CD2-CE1 3.88Å; L162-F363 HydrophobicContact CD2-CG 4.31Å; L162-F363 HydrophobicContact CD2-CZ 4.34Å; L162-F363 HydrophobicContact CG-CE1 4.28Å; L162-F363 HydrophobicContact CG-CZ 4.34Å |
| 163 | G | 98.4 | Very high | 98 | Very high | 6 Ų | 6 | 67.9 Ų | 67.9 | 6% | 0.062 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -63 | -44.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F159 L160 C161 Y166 M167 | F159-G163 PolarHBondContact O-N 2.92Å; L160-G163 PolarHBondContact O-N 2.98Å; C161-G163 VanDerWaalsContact C-N 3.34Å; C161-G163 PolarHBondContact O-N 3.05Å; G163-Y166 WeakPolarHBondContact O-CB 3.48Å; G163-Y166 PolarHBondContact O-N 2.95Å; G163-M167 WeakPolarHBondContact O-CG 3.32Å; G163-M167 PolarHBondContact O-N 2.95Å |
| 164 | I | 98.4 | Very high | 98 | Very high | 84 Ų | 84 | 66.6 Ų | 66.6 | 43% | 0.431 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -60.4 | -48.5 | 175 | -70 | 165.3 | 0 | 0 | 0 | 110.7 | L160 C161 Y166 M167 F168 | L160-I164 HydrophobicContact CD1-CD1 3.98Å; L160-I164 HydrophobicContact CG-CD1 4.04Å; L160-I164 WeakPolarHBondContact O-CD1 3.44Å; L160-I164 VanDerWaalsContact O-CG1 3.25Å; L160-I164 WeakPolarHBondContact O-CG1 3.46Å; L160-I164 PolarHBondContact O-N 3.47Å; C161-I164 PolarHBondContact O-N 2.81Å; I164-Y166 VanDerWaalsContact C-N 3.27Å; I164-Y166 PolarHBondContact O-N 3.39Å; I164-M167 PolarHBondContact O-N 3.4Å; I164-F168 HydrophobicContact CG2-CD2 3.83Å; I164-F168 HydrophobicContact CG2-CE2 3.84Å; I164-F168 VanDerWaalsContact O-CD2 3.26Å; I164-F168 WeakPolarHBondContact O-CD2 3.29Å; I164-F168 PolarHBondContact O-N 2.88Å; I164-F168 VanDerWaalsContact O-N 3.13Å |
| 165 | F | 98.3 | Very high | 97.9 | Very high | 159 Ų | 159 | 64 Ų | 64 | 70% | 0.697 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -59.1 | -37.1 | 175 | -89.4 | -77.4 | 0 | 0 | 0 | 112.4 | C161 L162 F168 R169 | C161-F165 WeakPolarHBondContact O-CD2 3.4Å; C161-F165 PolarHBondContact O-N 3.28Å; L162-F165 PolarHBondContact O-N 2.97Å; F165-F168 CarbonylContact O-C 3.57Å; F165-F168 PolarHBondContact O-N 2.86Å; F165-R169 PolarHBondContact O-N 3.11Å; F165-R169 VanDerWaalsContact O-N 3.1Å |
| 166 | Y | 97.9 | Very high | 97.7 | Very high | 6 Ų | 6 | 65 Ų | 65 | 2% | 0.024 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -65.4 | -43.6 | 176.5 | -161.1 | -89.9 | 0 | 0 | 0 | 112.5 | L162 G163 I164 F168 R169 F174 F184 F188 F363 | L162-Y166 WeakPolarHBondContact O-CB 3.39Å; L162-Y166 PolarHBondContact O-N 3.43Å; G163-Y166 WeakPolarHBondContact O-CB 3.48Å; G163-Y166 PolarHBondContact O-N 2.95Å; I164-Y166 VanDerWaalsContact C-N 3.27Å; I164-Y166 PolarHBondContact O-N 3.39Å; Y166-F168 PolarHBondContact O-N 2.8Å; Y166-R169 PolarHBondContact O-N 3.02Å; Y166-R169 VanDerWaalsContact O-N 3.15Å; Y166-F174 AromaticContact CE1-CE1 3.89Å; Y166-F174 HydrophobicContact CE1-CE1 3.89Å; Y166-F174 HydrophobicContact CE1-CZ 4.28Å; Y166-F174 AromaticContact CZ-CE1 3.91Å; Y166-F184 HydrophobicContact CD1-CB 3.92Å; Y166-F184 HydrophobicContact CD1-CD1 4.33Å; Y166-F184 HydrophobicContact CD1-CG 4.15Å; Y166-F184 HydrophobicContact CE1-CB 3.55Å; Y166-F184 AromaticContact CE1-CD1 3.79Å; Y166-F184 HydrophobicContact CE1-CD1 3.79Å; Y166-F184 AromaticContact CE1-CD2 3.74Å; Y166-F184 HydrophobicContact CE1-CD2 3.74Å; Y166-F184 HydrophobicContact CE1-CE1 4.38Å; Y166-F184 HydrophobicContact CE1-CE2 4.33Å; Y166-F184 AromaticContact CE1-CG 3.42Å; Y166-F184 HydrophobicContact CE1-CG 3.42Å; Y166-F184 VanDerWaalsContact CE1-CG 3.42Å; Y166-F184 AromaticContact CE2-CD1 3.99Å; Y166-F184 HydrophobicContact CE2-CD1 3.99Å; Y166-F184 AromaticContact CE2-CE1 3.93Å; Y166-F184 HydrophobicContact CE2-CE1 3.93Å; Y166-F184 HydrophobicContact CE2-CG 4.42Å; Y166-F184 HydrophobicContact CE2-CZ 4.3Å; Y166-F184 AromaticContact CZ-CD1 3.61Å; Y166-F184 AromaticContact CZ-CD2 3.72Å; Y166-F184 AromaticContact CZ-CE1 3.73Å; Y166-F184 AromaticContact CZ-CE2 3.82Å; Y166-F184 AromaticContact CZ-CG 3.59Å; Y166-F184 AromaticContact CZ-CZ 3.83Å; Y166-F184 VanDerWaalsContact OH-CD2 3.31Å; Y166-F184 WeakPolarHBondContact OH-CD2 3.44Å; Y166-F184 WeakPolarHBondContact OH-CE2 3.36Å; Y166-F184 VanDerWaalsContact OH-CZ 3.23Å; Y166-F184 WeakPolarHBondContact OH-CZ 3.34Å; Y166-F188 HydrophobicContact CD1-CE2 4.14Å; Y166-F188 HydrophobicContact CD2-CE2 4.43Å; Y166-F188 AromaticContact CG-CE2 3.84Å; Y166-F188 HydrophobicContact CG-CE2 3.84Å; Y166-F188 HydrophobicContact CG-CZ 4.34Å; Y166-F363 AromaticContact CD2-CE2 3.86Å; Y166-F363 HydrophobicContact CD2-CE2 3.86Å; Y166-F363 HydrophobicContact CD2-CZ 4.01Å; Y166-F363 HydrophobicContact CE2-CE2 4.05Å; Y166-F363 HydrophobicContact CE2-CZ 4.3Å |
| 167 | M | 97.4 | Very high | 97.6 | Very high | 69 Ų | 69 | 66.2 Ų | 66.2 | 34% | 0.34 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -62.1 | -33.5 | 175.8 | -63 | -54.2 | 148.2 | 0 | 0 | 112.2 | G163 I164 K181 F188 | G163-M167 WeakPolarHBondContact O-CG 3.32Å; G163-M167 PolarHBondContact O-N 2.95Å; I164-M167 PolarHBondContact O-N 3.4Å; M167-K181 WeakPolarHBondContact CE-O 3.46Å; M167-K181 WeakPolarHBondContact O-CE 3.26Å; M167-K181 PolarHBondContact O-NZ 2.99Å; M167-K181 HydrophobicContact SD-CB 3.94Å; M167-K181 HydrophobicContact SD-CG 4.3Å; M167-F188 HydrophobicContact CE-CD2 4.32Å |
| 168 | F | 97.8 | Very high | 97.6 | Very high | 168 Ų | 168 | 69.3 Ų | 69.3 | 74% | 0.737 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -1.3 | 176.1 | -72.6 | -63.2 | 0 | 0 | 0 | 115.3 | I164 F165 Y166 | I164-F168 HydrophobicContact CG2-CD2 3.83Å; I164-F168 HydrophobicContact CG2-CE2 3.84Å; I164-F168 VanDerWaalsContact O-CD2 3.26Å; I164-F168 WeakPolarHBondContact O-CD2 3.29Å; I164-F168 PolarHBondContact O-N 2.88Å; I164-F168 VanDerWaalsContact O-N 3.13Å; F165-F168 CarbonylContact O-C 3.57Å; F165-F168 PolarHBondContact O-N 2.86Å; Y166-F168 PolarHBondContact O-N 2.8Å |
| 169 | R | 97.4 | Very high | 97.5 | Very high | 74 Ų | 74 | 70.5 Ų | 70.5 | 28% | 0.279 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -57 | 137.7 | 170.3 | -82.1 | -171.3 | 77 | 163.2 | 2.9 | 109.9 | F165 Y166 N171 F174 K181 E371 | F165-R169 PolarHBondContact O-N 3.11Å; F165-R169 VanDerWaalsContact O-N 3.1Å; Y166-R169 PolarHBondContact O-N 3.02Å; Y166-R169 VanDerWaalsContact O-N 3.15Å; R169-N171 PolarHBondContact O-N 3.1Å; R169-F174 HydrophobicContact CB-CE2 3.71Å; R169-F174 HydrophobicContact CB-CZ 3.74Å; R169-K181 PolarHBondContact O-NZ 2.87Å; R169-E371 IonicContact CZ-OE1 3.06Å; R169-E371 IonicContact NH1-OE1 2.82Å; R169-E371 PolarHBondContact NH1-OE1 2.8Å; R169-E371 IonicContact NH2-OE1 2.89Å; R169-E371 PolarHBondContact NH2-OE1 2.84Å |
| 170 | P | 97.3 | Very high | 97.4 | Very high | 81 Ų | 81 | 70.5 Ų | 70.5 | 53% | 0.526 | 37% | 0.367 | S | S | . | . | trans | -56.1 | 134.3 | 179.8 | -27.7 | 35.9 | 0 | 0 | 0 | 112.9 | I172 S173 F174 | P170-I172 HydrophobicContact CB-CD1 4.49Å; P170-I172 HydrophobicContact CB-CG1 3.8Å; P170-I172 PolarHBondContact O-N 3.15Å; P170-S173 PolarHBondContact O-N 2.87Å; P170-S173 VanDerWaalsContact O-N 3.08Å; P170-F174 WeakPolarHBondContact O-CD2 3.24Å; P170-F174 WeakPolarHBondContact O-CE2 3.36Å | ||
| 171 | N | 97.4 | Very high | 97.4 | Very high | 97 Ų | 97 | 68 Ų | 68 | 52% | 0.519 | 35% | 0.352 | S | S | . | . | G | 310 helix | trans | -60.6 | -19.7 | -178.2 | -71.4 | -3.9 | 0 | 0 | 0 | 113.5 | R169 S173 F174 P177 K181 | R169-N171 PolarHBondContact O-N 3.1Å; N171-S173 PolarHBondContact O-N 3.37Å; N171-F174 PolarHBondContact O-N 3.03Å; N171-P177 HydrophobicContact CB-CB 3.88Å; N171-P177 HydrophobicContact CB-CG 3.93Å; N171-P177 WeakPolarHBondContact O-CG 3.3Å; N171-K181 PolarHBondContact OD1-NZ 2.97Å |
| 172 | I | 95.4 | Very high | 97.4 | Very high | 144 Ų | 144 | 69 Ų | 69 | 74% | 0.738 | 36% | 0.356 | S | S | * | . | G | 310 helix | trans | -67.2 | -8.8 | 175.2 | 61 | 168.3 | 0 | 0 | 0 | 114.6 | P170 F374 | P170-I172 HydrophobicContact CB-CD1 4.49Å; P170-I172 HydrophobicContact CB-CG1 3.8Å; P170-I172 PolarHBondContact O-N 3.15Å; I172-F374 WeakPolarHBondContact O-CE2 3.34Å; I172-F374 VanDerWaalsContact O-CZ 3.24Å; I172-F374 WeakPolarHBondContact O-CZ 3.25Å |
| 173 | S | 95.1 | Very high | 97.4 | Very high | 33 Ų | 33 | 67.9 Ų | 67.9 | 23% | 0.231 | 35% | 0.351 | C | S | . | . | G | 310 helix | trans | -96.7 | 11.7 | 176.1 | -56 | 0 | 0 | 0 | 0 | 113.7 | P170 N171 Q370 F374 | P170-S173 PolarHBondContact O-N 2.87Å; P170-S173 VanDerWaalsContact O-N 3.08Å; N171-S173 PolarHBondContact O-N 3.37Å; S173-Q370 PolarHBondContact O-NE2 3.26Å; S173-F374 VanDerWaalsContact C-CD2 3.49Å |
| 174 | F | 97.1 | Very high | 97.4 | Very high | 10 Ų | 10 | 67.6 Ų | 67.6 | 4% | 0.044 | 35% | 0.348 | C | S | . | . | trans | -133.2 | 150.8 | -175.6 | -55.5 | -101.5 | 0 | 0 | 0 | 109.6 | Y166 R169 P170 N171 P177 E180 K181 | Y166-F174 AromaticContact CE1-CE1 3.89Å; Y166-F174 HydrophobicContact CE1-CE1 3.89Å; Y166-F174 HydrophobicContact CE1-CZ 4.28Å; Y166-F174 AromaticContact CZ-CE1 3.91Å; R169-F174 HydrophobicContact CB-CE2 3.71Å; R169-F174 HydrophobicContact CB-CZ 3.74Å; P170-F174 WeakPolarHBondContact O-CD2 3.24Å; P170-F174 WeakPolarHBondContact O-CE2 3.36Å; N171-F174 PolarHBondContact O-N 3.03Å; F174-P177 HydrophobicContact CB-CB 3.96Å; F174-P177 HydrophobicContact CB-CG 3.93Å; F174-P177 HydrophobicContact CG-CB 4.43Å; F174-E180 HydrophobicContact CD1-CB 3.82Å; F174-E180 VanDerWaalsContact CD1-OE2 3.3Å; F174-E180 WeakPolarHBondContact CD1-OE2 3.36Å; F174-K181 HydrophobicContact CE1-CG 4.29Å; F174-K181 HydrophobicContact CZ-CG 4.42Å | ||
| 175 | V | 96.8 | Very high | 97.4 | Very high | 51 Ų | 51 | 64.7 Ų | 64.7 | 31% | 0.309 | 34% | 0.338 | S | S | . | . | S | Bend | trans | -82.6 | -44.8 | 177 | -179.6 | 0 | 0 | 0 | 0 | 110.5 | E180 R373 F374 G378 | V175-E180 WeakPolarHBondContact CA-OE1 3.16Å; V175-E180 WeakPolarHBondContact CB-OE1 3.25Å; V175-E180 PolarHBondContact N-OE1 2.96Å; V175-R373 HydrophobicContact CG2-CG 4.41Å; V175-F374 HydrophobicContact CG2-CD2 4.38Å; V175-G378 VanDerWaalsContact CG1-CA 3.49Å |
| 176 | A | 96.3 | Very high | 97.4 | Very high | 24 Ų | 24 | 60.8 Ų | 60.8 | 20% | 0.198 | 32% | 0.324 | C | S | . | . | S | Bend | trans | -128.2 | 72.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 109.8 | L178 Q179 E180 | A176-L178 VanDerWaalsContact C-N 3.26Å; A176-L178 PolarHBondContact O-N 2.91Å; A176-Q179 HydrophobicContact CB-CB 4.25Å; A176-Q179 PolarHBondContact O-N 3.34Å; A176-E180 PolarHBondContact N-OE1 2.77Å; A176-E180 PolarHBondContact O-N 3.13Å |
| 177 | P | 96.3 | Very high | 97.5 | Very high | 37 Ų | 37 | 60.5 Ų | 60.5 | 24% | 0.24 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -55 | -34.3 | -162.2 | -21.9 | 26.4 | 0 | 0 | 0 | 115.4 | N171 F174 K181 | N171-P177 HydrophobicContact CB-CB 3.88Å; N171-P177 HydrophobicContact CB-CG 3.93Å; N171-P177 WeakPolarHBondContact O-CG 3.3Å; F174-P177 HydrophobicContact CB-CB 3.96Å; F174-P177 HydrophobicContact CB-CG 3.93Å; F174-P177 HydrophobicContact CG-CB 4.43Å; P177-K181 VanDerWaalsContact O-CB 3.27Å; P177-K181 WeakPolarHBondContact O-CB 3.49Å; P177-K181 VanDerWaalsContact O-CG 3.25Å; P177-K181 WeakPolarHBondContact O-CG 3.47Å; P177-K181 PolarHBondContact O-N 3.45Å; P177-K181 VanDerWaalsContact O-N 3.17Å |
| 178 | L | 97.6 | Very high | 97.6 | Very high | 142 Ų | 142 | 57.5 Ų | 57.5 | 74% | 0.743 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -70.6 | -46.8 | 177.6 | 179.1 | 60.9 | 0 | 0 | 0 | 112 | A176 V182 | A176-L178 VanDerWaalsContact C-N 3.26Å; A176-L178 PolarHBondContact O-N 2.91Å; L178-V182 VanDerWaalsContact O-CG2 3.29Å; L178-V182 WeakPolarHBondContact O-CG2 3.25Å; L178-V182 PolarHBondContact O-N 3.16Å |
| 179 | Q | 97.1 | Very high | 97.6 | Very high | 116 Ų | 116 | 53.9 Ų | 53.9 | 54% | 0.542 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -69.3 | -44.6 | -179.1 | -67.7 | -179.7 | -10.6 | 0 | 0 | 111 | A176 K181 V182 V183 Y236 | A176-Q179 HydrophobicContact CB-CB 4.25Å; A176-Q179 PolarHBondContact O-N 3.34Å; Q179-K181 VanDerWaalsContact C-N 3.34Å; Q179-K181 PolarHBondContact O-N 3.11Å; Q179-V182 PolarHBondContact O-N 3.45Å; Q179-V182 VanDerWaalsContact O-N 3.12Å; Q179-V183 PolarHBondContact O-N 3.37Å; Q179-Y236 PolarHBondContact OE1-OH 2.92Å |
| 180 | E | 97.9 | Very high | 97.7 | Very high | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61 | -42 | 178.1 | -66.9 | -179.4 | -131.3 | 0 | 0 | 111.5 | F174 V175 A176 V183 F184 Y236 Y237 Q370 | F174-E180 HydrophobicContact CD1-CB 3.82Å; F174-E180 VanDerWaalsContact CD1-OE2 3.3Å; F174-E180 WeakPolarHBondContact CD1-OE2 3.36Å; V175-E180 WeakPolarHBondContact CA-OE1 3.16Å; V175-E180 WeakPolarHBondContact CB-OE1 3.25Å; V175-E180 PolarHBondContact N-OE1 2.96Å; A176-E180 PolarHBondContact N-OE1 2.77Å; A176-E180 PolarHBondContact O-N 3.13Å; E180-V183 WeakPolarHBondContact O-CG2 3.29Å; E180-F184 WeakPolarHBondContact O-CD2 3.32Å; E180-F184 PolarHBondContact O-N 2.94Å; E180-Y236 HydrophobicContact CG-CE1 4.12Å; E180-Y237 WeakPolarHBondContact CG-OH 3.39Å; E180-Y237 PolarHBondContact OE2-OH 2.82Å; E180-Q370 VanDerWaalsContact OE2-CG 3.23Å; E180-Q370 WeakPolarHBondContact OE2-CG 3.41Å; E180-Q370 PolarHBondContact OE2-NE2 3.43Å |
| 181 | K | 98.4 | Very high | 97.7 | Very high | 28 Ų | 28 | 46.8 Ų | 46.8 | 12% | 0.122 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -69.2 | -31.4 | 174.7 | -73.5 | 177.2 | 178.6 | -177.7 | 0 | 113 | M167 R169 N171 F174 P177 Q179 G185 | M167-K181 WeakPolarHBondContact CE-O 3.46Å; M167-K181 WeakPolarHBondContact O-CE 3.26Å; M167-K181 PolarHBondContact O-NZ 2.99Å; M167-K181 HydrophobicContact SD-CB 3.94Å; M167-K181 HydrophobicContact SD-CG 4.3Å; R169-K181 PolarHBondContact O-NZ 2.87Å; N171-K181 PolarHBondContact OD1-NZ 2.97Å; F174-K181 HydrophobicContact CE1-CG 4.29Å; F174-K181 HydrophobicContact CZ-CG 4.42Å; P177-K181 VanDerWaalsContact O-CB 3.27Å; P177-K181 WeakPolarHBondContact O-CB 3.49Å; P177-K181 VanDerWaalsContact O-CG 3.25Å; P177-K181 WeakPolarHBondContact O-CG 3.47Å; P177-K181 PolarHBondContact O-N 3.45Å; P177-K181 VanDerWaalsContact O-N 3.17Å; Q179-K181 VanDerWaalsContact C-N 3.34Å; Q179-K181 PolarHBondContact O-N 3.11Å; K181-G185 WeakPolarHBondContact O-CA 3.49Å; K181-G185 PolarHBondContact O-N 3.23Å |
| 182 | V | 98.6 | Very high | 97.8 | Very high | 81 Ų | 81 | 43.9 Ų | 43.9 | 49% | 0.491 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67.2 | -46.7 | 173.5 | 166.3 | 0 | 0 | 0 | 0 | 111.9 | L178 Q179 F184 G185 L186 | L178-V182 VanDerWaalsContact O-CG2 3.29Å; L178-V182 WeakPolarHBondContact O-CG2 3.25Å; L178-V182 PolarHBondContact O-N 3.16Å; Q179-V182 PolarHBondContact O-N 3.45Å; Q179-V182 VanDerWaalsContact O-N 3.12Å; V182-F184 PolarHBondContact O-N 2.9Å; V182-G185 PolarHBondContact O-N 2.88Å; V182-G185 VanDerWaalsContact O-N 3.14Å; V182-L186 HydrophobicContact CG1-CD1 4.35Å; V182-L186 PolarHBondContact O-N 3.26Å |
| 183 | V | 98.4 | Very high | 98 | Very high | 16 Ų | 16 | 39.6 Ų | 39.6 | 10% | 0.097 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -67.1 | -38.7 | -178.9 | -60.8 | 0 | 0 | 0 | 0 | 112.4 | Q179 E180 L186 F187 V232 P233 Y236 | Q179-V183 PolarHBondContact O-N 3.37Å; E180-V183 WeakPolarHBondContact O-CG2 3.29Å; V183-L186 PolarHBondContact O-N 3.35Å; V183-F187 PolarHBondContact O-N 3.34Å; V183-V232 HydrophobicContact CB-CG1 4Å; V183-V232 HydrophobicContact CG1-CG1 3.95Å; V183-P233 HydrophobicContact CB-CB 4.35Å; V183-P233 HydrophobicContact CG2-CB 4.16Å; V183-Y236 HydrophobicContact CG1-CD2 4.13Å; V183-Y236 HydrophobicContact CG1-CG 4.08Å; V183-Y236 HydrophobicContact CG2-CD1 4Å; V183-Y236 HydrophobicContact CG2-CE1 4.48Å; V183-Y236 HydrophobicContact CG2-CG 4.21Å |
| 184 | F | 98.7 | Very high | 98.1 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -67 | -37.6 | 169.9 | -88.3 | -94.4 | 0 | 0 | 0 | 112.2 | Y166 E180 V182 L186 F187 F188 P233 Y237 F363 V366 Q370 | Y166-F184 HydrophobicContact CD1-CB 3.92Å; Y166-F184 HydrophobicContact CD1-CD1 4.33Å; Y166-F184 HydrophobicContact CD1-CG 4.15Å; Y166-F184 HydrophobicContact CE1-CB 3.55Å; Y166-F184 AromaticContact CE1-CD1 3.79Å; Y166-F184 HydrophobicContact CE1-CD1 3.79Å; Y166-F184 AromaticContact CE1-CD2 3.74Å; Y166-F184 HydrophobicContact CE1-CD2 3.74Å; Y166-F184 HydrophobicContact CE1-CE1 4.38Å; Y166-F184 HydrophobicContact CE1-CE2 4.33Å; Y166-F184 AromaticContact CE1-CG 3.42Å; Y166-F184 HydrophobicContact CE1-CG 3.42Å; Y166-F184 VanDerWaalsContact CE1-CG 3.42Å; Y166-F184 AromaticContact CE2-CD1 3.99Å; Y166-F184 HydrophobicContact CE2-CD1 3.99Å; Y166-F184 AromaticContact CE2-CE1 3.93Å; Y166-F184 HydrophobicContact CE2-CE1 3.93Å; Y166-F184 HydrophobicContact CE2-CG 4.42Å; Y166-F184 HydrophobicContact CE2-CZ 4.3Å; Y166-F184 AromaticContact CZ-CD1 3.61Å; Y166-F184 AromaticContact CZ-CD2 3.72Å; Y166-F184 AromaticContact CZ-CE1 3.73Å; Y166-F184 AromaticContact CZ-CE2 3.82Å; Y166-F184 AromaticContact CZ-CG 3.59Å; Y166-F184 AromaticContact CZ-CZ 3.83Å; Y166-F184 VanDerWaalsContact OH-CD2 3.31Å; Y166-F184 WeakPolarHBondContact OH-CD2 3.44Å; Y166-F184 WeakPolarHBondContact OH-CE2 3.36Å; Y166-F184 VanDerWaalsContact OH-CZ 3.23Å; Y166-F184 WeakPolarHBondContact OH-CZ 3.34Å; E180-F184 WeakPolarHBondContact O-CD2 3.32Å; E180-F184 PolarHBondContact O-N 2.94Å; V182-F184 PolarHBondContact O-N 2.9Å; F184-L186 VanDerWaalsContact C-N 3.28Å; F184-L186 PolarHBondContact O-N 2.9Å; F184-F187 WeakPolarHBondContact O-CB 3.5Å; F184-F187 PolarHBondContact O-N 2.73Å; F184-F188 HydrophobicContact CB-CD2 4.36Å; F184-F188 HydrophobicContact CB-CE2 4.26Å; F184-F188 HydrophobicContact CD1-CE2 4.17Å; F184-F188 WeakPolarHBondContact O-CD2 3.46Å; F184-F188 PolarHBondContact O-N 3.04Å; F184-P233 HydrophobicContact CD2-CB 4.34Å; F184-P233 HydrophobicContact CE2-CB 4.45Å; F184-Y237 HydrophobicContact CD2-CE2 4.47Å; F184-Y237 AromaticContact CE2-CE2 3.67Å; F184-Y237 HydrophobicContact CE2-CE2 3.67Å; F184-Y237 HydrophobicContact CZ-CE2 4.44Å; F184-F363 HydrophobicContact CD1-CD2 4.2Å; F184-F363 HydrophobicContact CD1-CE2 4.03Å; F184-F363 AromaticContact CE1-CD2 3.93Å; F184-F363 HydrophobicContact CE1-CD2 3.93Å; F184-F363 AromaticContact CE1-CE2 3.78Å; F184-F363 HydrophobicContact CE1-CE2 3.78Å; F184-V366 HydrophobicContact CD1-CG2 4.48Å; F184-V366 HydrophobicContact CE1-CB 4.48Å; F184-V366 HydrophobicContact CE1-CG2 3.64Å; F184-V366 HydrophobicContact CZ-CB 4.19Å; F184-V366 HydrophobicContact CZ-CG2 3.83Å; F184-Q370 HydrophobicContact CE2-CB 4.14Å; F184-Q370 HydrophobicContact CE2-CG 4.34Å; F184-Q370 HydrophobicContact CZ-CB 4.29Å |
| 185 | G | 98.6 | Very high | 98.2 | Very high | 22 Ų | 22 | 37.8 Ų | 37.8 | 23% | 0.227 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -59.7 | -36.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | K181 V182 F188 L189 | K181-G185 WeakPolarHBondContact O-CA 3.49Å; K181-G185 PolarHBondContact O-N 3.23Å; V182-G185 PolarHBondContact O-N 2.88Å; V182-G185 VanDerWaalsContact O-N 3.14Å; G185-F188 PolarHBondContact O-N 2.93Å; G185-L189 VanDerWaalsContact O-CB 3.26Å; G185-L189 WeakPolarHBondContact O-CB 3.07Å; G185-L189 PolarHBondContact O-N 3.13Å |
| 186 | L | 98.8 | Very high | 98.3 | Very high | 77 Ų | 77 | 36.6 Ų | 36.6 | 40% | 0.403 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -69.3 | -37.2 | 174.6 | -70.4 | 167.1 | 0 | 0 | 0 | 112.6 | V182 V183 F184 G190 V232 | V182-L186 HydrophobicContact CG1-CD1 4.35Å; V182-L186 PolarHBondContact O-N 3.26Å; V183-L186 PolarHBondContact O-N 3.35Å; F184-L186 VanDerWaalsContact C-N 3.28Å; F184-L186 PolarHBondContact O-N 2.9Å; L186-G190 PolarHBondContact O-N 3.05Å; L186-V232 HydrophobicContact CB-CB 4.49Å; L186-V232 HydrophobicContact CB-CG2 4.41Å; L186-V232 HydrophobicContact CD1-CG1 3.97Å |
| 187 | F | 98.8 | Very high | 98.5 | Very high | 0 Ų | 0 | 37.7 Ų | 37.7 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.8 | -50.3 | 169.2 | 161.7 | -104.7 | 0 | 0 | 0 | 111.8 | F159 V183 F184 L189 G190 A191 L226 G229 P233 A359 H362 F363 | F159-F187 HydrophobicContact CD1-CZ 4.5Å; F159-F187 HydrophobicContact CE1-CE1 4.26Å; F159-F187 AromaticContact CE1-CZ 3.99Å; F159-F187 HydrophobicContact CE1-CZ 3.99Å; V183-F187 PolarHBondContact O-N 3.34Å; F184-F187 WeakPolarHBondContact O-CB 3.5Å; F184-F187 PolarHBondContact O-N 2.73Å; F187-L189 VanDerWaalsContact C-N 3.31Å; F187-L189 PolarHBondContact O-N 3.49Å; F187-G190 PolarHBondContact O-N 2.95Å; F187-A191 HydrophobicContact CE2-CB 4.44Å; F187-A191 HydrophobicContact CZ-CB 4.45Å; F187-A191 PolarHBondContact O-N 2.76Å; F187-L226 HydrophobicContact CE2-CD1 4.11Å; F187-G229 WeakPolarHBondContact CA-O 3.43Å; F187-P233 HydrophobicContact CB-CG 3.95Å; F187-A359 WeakPolarHBondContact CZ-O 3.3Å; F187-H362 AromaticContact CD2-CD2 3.72Å; F187-H362 AromaticContact CE2-CD2 3.54Å; F187-F363 HydrophobicContact CE1-CB 3.83Å; F187-F363 HydrophobicContact CE1-CD2 4.09Å; F187-F363 HydrophobicContact CE1-CG 4.36Å; F187-F363 HydrophobicContact CZ-CB 4.04Å |
| 188 | F | 98.8 | Very high | 98.6 | Very high | 6 Ų | 6 | 36 Ų | 36 | 3% | 0.026 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.8 | -39.7 | 178.8 | -76.1 | -64.1 | 0 | 0 | 0 | 111.9 | F159 L162 Y166 M167 F184 G185 A191 I192 F363 | F159-F188 HydrophobicContact CD1-CD1 4.22Å; F159-F188 HydrophobicContact CD1-CE1 4.17Å; L162-F188 HydrophobicContact CB-CE1 4.24Å; L162-F188 HydrophobicContact CD2-CE1 4.17Å; L162-F188 HydrophobicContact CG-CE1 3.93Å; L162-F188 HydrophobicContact CG-CZ 4.13Å; Y166-F188 HydrophobicContact CD1-CE2 4.14Å; Y166-F188 HydrophobicContact CD2-CE2 4.43Å; Y166-F188 AromaticContact CG-CE2 3.84Å; Y166-F188 HydrophobicContact CG-CE2 3.84Å; Y166-F188 HydrophobicContact CG-CZ 4.34Å; M167-F188 HydrophobicContact CE-CD2 4.32Å; F184-F188 HydrophobicContact CB-CD2 4.36Å; F184-F188 HydrophobicContact CB-CE2 4.26Å; F184-F188 HydrophobicContact CD1-CE2 4.17Å; F184-F188 WeakPolarHBondContact O-CD2 3.46Å; F184-F188 PolarHBondContact O-N 3.04Å; G185-F188 PolarHBondContact O-N 2.93Å; F188-A191 PolarHBondContact O-N 3Å; F188-I192 HydrophobicContact CB-CD1 4.38Å; F188-I192 VanDerWaalsContact O-CB 3.31Å; F188-I192 WeakPolarHBondContact O-CB 3.36Å; F188-I192 WeakPolarHBondContact O-CD1 3.46Å; F188-I192 WeakPolarHBondContact O-CG1 3.39Å; F188-I192 PolarHBondContact O-N 3.44Å; F188-F363 HydrophobicContact CE1-CD2 4.33Å; F188-F363 HydrophobicContact CE1-CE2 4.44Å; F188-F363 HydrophobicContact CE2-CD2 4.5Å; F188-F363 HydrophobicContact CE2-CE2 4.2Å; F188-F363 AromaticContact CZ-CD2 3.76Å; F188-F363 HydrophobicContact CZ-CD2 3.76Å; F188-F363 AromaticContact CZ-CE2 3.54Å; F188-F363 HydrophobicContact CZ-CE2 3.54Å; F188-F363 HydrophobicContact CZ-CZ 4.34Å |
| 189 | L | 98.8 | Very high | 98.6 | Very high | 93 Ų | 93 | 31.3 Ų | 31.3 | 49% | 0.487 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -60.1 | -48.3 | 174.2 | -179.2 | 63.3 | 0 | 0 | 0 | 111.5 | G185 F187 A191 I192 L193 | G185-L189 VanDerWaalsContact O-CB 3.26Å; G185-L189 WeakPolarHBondContact O-CB 3.07Å; G185-L189 PolarHBondContact O-N 3.13Å; F187-L189 VanDerWaalsContact C-N 3.31Å; F187-L189 PolarHBondContact O-N 3.49Å; L189-A191 PolarHBondContact O-N 2.84Å; L189-I192 PolarHBondContact O-N 3.49Å; L189-L193 HydrophobicContact CD1-CD1 3.81Å; L189-L193 HydrophobicContact CD1-CG 4.05Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.5Å; L189-L193 WeakPolarHBondContact O-CB 3.19Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.24Å; L189-L193 PolarHBondContact O-N 3.11Å |
| 190 | G | 98.8 | Very high | 98.7 | Very high | 5 Ų | 5 | 27.8 Ų | 27.8 | 5% | 0.052 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -59.4 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | L186 F187 C194 | L186-G190 PolarHBondContact O-N 3.05Å; F187-G190 PolarHBondContact O-N 2.95Å; G190-C194 WeakPolarHBondContact O-CB 3.38Å; G190-C194 PolarHBondContact O-N 3Å |
| 191 | A | 98.8 | Very high | 98.8 | Very high | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.8 | -47.6 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113 | F159 F187 F188 L189 C194 L195 L226 | F159-A191 HydrophobicContact CD1-CB 4.31Å; F159-A191 HydrophobicContact CG-CB 4.31Å; F187-A191 HydrophobicContact CE2-CB 4.44Å; F187-A191 HydrophobicContact CZ-CB 4.45Å; F187-A191 PolarHBondContact O-N 2.76Å; F188-A191 PolarHBondContact O-N 3Å; L189-A191 PolarHBondContact O-N 2.84Å; A191-C194 PolarHBondContact O-N 3.06Å; A191-L195 WeakPolarHBondContact O-CB 3.37Å; A191-L195 VanDerWaalsContact O-CG 3.25Å; A191-L195 WeakPolarHBondContact O-CG 3.39Å; A191-L195 PolarHBondContact O-N 3.4Å; A191-L226 HydrophobicContact CB-CD1 3.98Å |
| 192 | I | 98.9 | Very high | 98.8 | Very high | 36 Ų | 36 | 27.4 Ų | 27.4 | 19% | 0.185 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -65 | -43 | -179.7 | -67.2 | 162.3 | 0 | 0 | 0 | 110.4 | F159 L160 F188 L189 S196 | F159-I192 HydrophobicContact CB-CG1 4.18Å; L160-I192 HydrophobicContact CB-CD1 4.27Å; L160-I192 HydrophobicContact CB-CG1 4.48Å; L160-I192 HydrophobicContact CD1-CD1 4.08Å; F188-I192 HydrophobicContact CB-CD1 4.38Å; F188-I192 VanDerWaalsContact O-CB 3.31Å; F188-I192 WeakPolarHBondContact O-CB 3.36Å; F188-I192 WeakPolarHBondContact O-CD1 3.46Å; F188-I192 WeakPolarHBondContact O-CG1 3.39Å; F188-I192 PolarHBondContact O-N 3.44Å; L189-I192 PolarHBondContact O-N 3.49Å; I192-S196 WeakPolarHBondContact O-CB 3.47Å; I192-S196 PolarHBondContact O-N 3.47Å; I192-S196 PolarHBondContact O-OG 3.31Å |
| 193 | L | 98.8 | Very high | 98.8 | Very high | 54 Ų | 54 | 23.6 Ų | 23.6 | 28% | 0.283 | 13% | 0.127 | S | C | . | . | H | α-helix | trans | -64.8 | -45.7 | 176.4 | -71.2 | 175.3 | 0 | 0 | 0 | 112.1 | L189 L195 S196 F197 L225 | L189-L193 HydrophobicContact CD1-CD1 3.81Å; L189-L193 HydrophobicContact CD1-CG 4.05Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.5Å; L189-L193 WeakPolarHBondContact O-CB 3.19Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.24Å; L189-L193 PolarHBondContact O-N 3.11Å; L193-L195 PolarHBondContact O-N 2.83Å; L193-S196 PolarHBondContact O-N 3.07Å; L193-F197 HydrophobicContact CB-CE2 4.15Å; L193-F197 HydrophobicContact CB-CZ 4.42Å; L193-F197 HydrophobicContact CD2-CE1 4.35Å; L193-F197 HydrophobicContact CD2-CE2 4.5Å; L193-F197 HydrophobicContact CD2-CZ 3.95Å; L193-F197 WeakPolarHBondContact O-CB 3.11Å; L193-F197 WeakPolarHBondContact O-CD2 3.25Å; L193-F197 VanDerWaalsContact O-CG 3.25Å; L193-F197 WeakPolarHBondContact O-CG 3.33Å; L193-F197 PolarHBondContact O-N 3.4Å; L193-L225 HydrophobicContact CD1-CD1 4.26Å |
| 194 | C | 98.9 | Very high | 98.8 | Very high | 4 Ų | 4 | 22.9 Ų | 22.9 | 3% | 0.027 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -56.2 | -53.1 | 177 | -176.7 | 0 | 0 | 0 | 0 | 111.9 | G190 A191 S196 S198 G222 L226 | G190-C194 WeakPolarHBondContact O-CB 3.38Å; G190-C194 PolarHBondContact O-N 3Å; A191-C194 PolarHBondContact O-N 3.06Å; C194-S196 VanDerWaalsContact C-N 3.35Å; C194-S196 PolarHBondContact O-N 3.36Å; C194-S198 VanDerWaalsContact O-CB 3.3Å; C194-S198 WeakPolarHBondContact O-CB 3.35Å; C194-S198 PolarHBondContact O-N 3.09Å; C194-S198 VanDerWaalsContact O-N 3.11Å; C194-G222 VanDerWaalsContact CB-O 3.27Å; C194-G222 WeakPolarHBondContact CB-O 3.4Å; C194-G222 PolarHBondContact SG-O 2.89Å; C194-L226 HydrophobicContact CB-CB 3.78Å; C194-L226 HydrophobicContact CB-CD2 4.39Å |
| 195 | L | 98.8 | Very high | 98.8 | Very high | 2 Ų | 2 | 24.3 Ų | 24.3 | 1% | 0.01 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -67.7 | -37.2 | -178.2 | -63.2 | 169.4 | 0 | 0 | 0 | 111.1 | H152 C156 F159 A191 L193 S198 W199 V355 V356 | H152-L195 HydrophobicContact CB-CD2 4.1Å; H152-L195 WeakPolarHBondContact CD2-CD2 3.42Å; C156-L195 HydrophobicContact CB-CB 3.87Å; F159-L195 HydrophobicContact CD2-CD1 3.58Å; F159-L195 HydrophobicContact CE2-CD1 4.24Å; F159-L195 HydrophobicContact CG-CD1 4.38Å; A191-L195 WeakPolarHBondContact O-CB 3.37Å; A191-L195 VanDerWaalsContact O-CG 3.25Å; A191-L195 WeakPolarHBondContact O-CG 3.39Å; A191-L195 PolarHBondContact O-N 3.4Å; L193-L195 PolarHBondContact O-N 2.83Å; L195-S198 PolarHBondContact O-N 3.3Å; L195-W199 PolarHBondContact O-N 2.92Å; L195-V355 HydrophobicContact CD2-CG1 4.34Å; L195-V356 HydrophobicContact CD2-CG2 3.91Å |
| 196 | S | 98.9 | Very high | 98.8 | Very high | 25 Ų | 25 | 23.3 Ų | 23.3 | 18% | 0.175 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -61.2 | -55.2 | 175.3 | -66.1 | 0 | 0 | 0 | 0 | 112.7 | C156 I192 L193 C194 S198 W199 L200 | C156-S196 PolarHBondContact SG-OG 3.01Å; I192-S196 WeakPolarHBondContact O-CB 3.47Å; I192-S196 PolarHBondContact O-N 3.47Å; I192-S196 PolarHBondContact O-OG 3.31Å; L193-S196 PolarHBondContact O-N 3.07Å; C194-S196 VanDerWaalsContact C-N 3.35Å; C194-S196 PolarHBondContact O-N 3.36Å; S196-S198 PolarHBondContact O-N 3.35Å; S196-W199 PolarHBondContact O-N 3.26Å; S196-L200 VanDerWaalsContact O-CB 3.26Å; S196-L200 WeakPolarHBondContact O-CB 3.33Å; S196-L200 WeakPolarHBondContact O-CD1 3.42Å; S196-L200 WeakPolarHBondContact O-CG 3.25Å; S196-L200 PolarHBondContact O-N 3.01Å |
| 197 | F | 98.9 | Very high | 98.8 | Very high | 47 Ų | 47 | 20.6 Ų | 20.6 | 21% | 0.206 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -60 | -37.3 | -179.8 | -63.6 | -26.6 | 0 | 0 | 0 | 111.3 | L193 F201 L218 L225 | L193-F197 HydrophobicContact CB-CE2 4.15Å; L193-F197 HydrophobicContact CB-CZ 4.42Å; L193-F197 HydrophobicContact CD2-CE1 4.35Å; L193-F197 HydrophobicContact CD2-CE2 4.5Å; L193-F197 HydrophobicContact CD2-CZ 3.95Å; L193-F197 WeakPolarHBondContact O-CB 3.11Å; L193-F197 WeakPolarHBondContact O-CD2 3.25Å; L193-F197 VanDerWaalsContact O-CG 3.25Å; L193-F197 WeakPolarHBondContact O-CG 3.33Å; L193-F197 PolarHBondContact O-N 3.4Å; F197-F201 VanDerWaalsContact O-CB 3.22Å; F197-F201 WeakPolarHBondContact O-CB 3.16Å; F197-F201 PolarHBondContact O-N 3.02Å; F197-L218 HydrophobicContact CB-CB 4.05Å; F197-L218 HydrophobicContact CD1-CB 4.35Å; F197-L218 HydrophobicContact CD2-CB 4.29Å; F197-L218 VanDerWaalsContact CD2-O 3.31Å; F197-L218 WeakPolarHBondContact CD2-O 3.31Å; F197-L218 HydrophobicContact CG-CB 4Å; F197-L225 HydrophobicContact CE2-CD1 4.14Å |
| 198 | S | 98.8 | Very high | 98.7 | Very high | 2 Ų | 2 | 22.6 Ų | 22.6 | 1% | 0.014 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -68.9 | -52.5 | 179.3 | -162.9 | 0 | 0 | 0 | 0 | 113.6 | H152 C194 L195 S196 L200 F201 H202 D219 | H152-S198 WeakPolarHBondContact ND1-CB 3.46Å; H152-S198 PolarHBondContact ND1-OG 2.87Å; C194-S198 VanDerWaalsContact O-CB 3.3Å; C194-S198 WeakPolarHBondContact O-CB 3.35Å; C194-S198 PolarHBondContact O-N 3.09Å; C194-S198 VanDerWaalsContact O-N 3.11Å; L195-S198 PolarHBondContact O-N 3.3Å; S196-S198 PolarHBondContact O-N 3.35Å; S198-L200 VanDerWaalsContact C-N 3.27Å; S198-L200 PolarHBondContact O-N 3.35Å; S198-F201 PolarHBondContact O-N 2.92Å; S198-H202 PolarHBondContact O-CD2 3.46Å; S198-H202 VanDerWaalsContact O-CD2 3.23Å; S198-H202 PolarHBondContact O-N 3.41Å; S198-D219 WeakPolarHBondContact CA-OD1 3.43Å; S198-D219 WeakPolarHBondContact CB-OD1 3.24Å; S198-D219 PolarHBondContact OG-OD1 2.71Å |
| 199 | W | 98.9 | Very high | 98.7 | Very high | 43 Ų | 43 | 26.4 Ų | 26.4 | 16% | 0.163 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.5 | -32 | 179.4 | 81.5 | -108.2 | 0 | 0 | 0 | 111.8 | F136 I139 H152 L153 L195 S196 T203 | F136-W199 HydrophobicContact CE1-CH2 4.03Å; F136-W199 AromaticContact CE1-CZ3 3.82Å; F136-W199 HydrophobicContact CE1-CZ3 3.82Å; I139-W199 HydrophobicContact CD1-CZ3 4.32Å; H152-W199 HydrophobicContact CB-CB 4.03Å; L153-W199 HydrophobicContact CB-CB 4.08Å; L153-W199 HydrophobicContact CB-CD2 4.32Å; L153-W199 HydrophobicContact CB-CG 3.99Å; L153-W199 HydrophobicContact CD1-CD2 3.8Å; L153-W199 HydrophobicContact CD1-CE3 4.17Å; L153-W199 HydrophobicContact CD1-CG 4.19Å; L153-W199 HydrophobicContact CD1-CH2 4.45Å; L153-W199 HydrophobicContact CD1-CZ2 4.07Å; L153-W199 HydrophobicContact CD1-CZ3 4.48Å; L195-W199 PolarHBondContact O-N 2.92Å; S196-W199 PolarHBondContact O-N 3.26Å; W199-T203 VanDerWaalsContact O-CB 3.3Å; W199-T203 WeakPolarHBondContact O-CB 3.5Å; W199-T203 PolarHBondContact O-N 3.31Å; W199-T203 PolarHBondContact O-OG1 3.07Å |
| 200 | L | 98.9 | Very high | 98.6 | Very high | 42 Ų | 42 | 24.4 Ų | 24.4 | 22% | 0.22 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -64.5 | -49.2 | 171.2 | -73.9 | 168.9 | 0 | 0 | 0 | 111.5 | F136 S196 S198 T203 V204 F215 | F136-L200 HydrophobicContact CE1-CD2 4.2Å; F136-L200 HydrophobicContact CZ-CD2 3.91Å; S196-L200 VanDerWaalsContact O-CB 3.26Å; S196-L200 WeakPolarHBondContact O-CB 3.33Å; S196-L200 WeakPolarHBondContact O-CD1 3.42Å; S196-L200 WeakPolarHBondContact O-CG 3.25Å; S196-L200 PolarHBondContact O-N 3.01Å; S198-L200 VanDerWaalsContact C-N 3.27Å; S198-L200 PolarHBondContact O-N 3.35Å; L200-T203 WeakPolarHBondContact O-CA 3.49Å; L200-T203 WeakPolarHBondContact O-CB 3.48Å; L200-T203 PolarHBondContact O-N 2.85Å; L200-T203 VanDerWaalsContact O-N 3.11Å; L200-V204 WeakPolarHBondContact O-CG2 3.21Å; L200-V204 PolarHBondContact O-N 3.43Å; L200-F215 HydrophobicContact CB-CD1 4.1Å; L200-F215 HydrophobicContact CB-CE1 3.92Å |
| 201 | F | 98.8 | Very high | 98.6 | Very high | 15 Ų | 15 | 25.3 Ų | 25.3 | 7% | 0.066 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -54 | -56.4 | 175.2 | 166.7 | -118 | 0 | 0 | 0 | 111 | F197 S198 T203 V204 Y205 F215 D219 | F197-F201 VanDerWaalsContact O-CB 3.22Å; F197-F201 WeakPolarHBondContact O-CB 3.16Å; F197-F201 PolarHBondContact O-N 3.02Å; S198-F201 PolarHBondContact O-N 2.92Å; F201-T203 PolarHBondContact O-N 3.27Å; F201-V204 CarbonylContact O-C 3.48Å; F201-V204 PolarHBondContact O-N 2.97Å; F201-V204 VanDerWaalsContact O-N 3.11Å; F201-Y205 HydrophobicContact CD2-CD2 4.47Å; F201-Y205 AromaticContact CE2-CD2 3.49Å; F201-Y205 HydrophobicContact CE2-CD2 3.49Å; F201-Y205 VanDerWaalsContact CE2-CD2 3.49Å; F201-Y205 HydrophobicContact CE2-CE2 4.15Å; F201-Y205 HydrophobicContact CE2-CG 4.27Å; F201-Y205 AromaticContact CZ-CD2 3.55Å; F201-Y205 HydrophobicContact CZ-CD2 3.55Å; F201-Y205 AromaticContact CZ-CE2 3.93Å; F201-Y205 HydrophobicContact CZ-CE2 3.93Å; F201-Y205 HydrophobicContact CZ-CG 4.22Å; F201-Y205 WeakPolarHBondContact O-CA 3.23Å; F201-Y205 VanDerWaalsContact O-CB 3.32Å; F201-Y205 WeakPolarHBondContact O-CB 3.37Å; F201-Y205 PolarHBondContact O-N 3.5Å; F201-F215 HydrophobicContact CB-CB 3.94Å; F201-F215 HydrophobicContact CD2-CB 3.73Å; F201-F215 HydrophobicContact CG-CB 4.3Å; F201-D219 HydrophobicContact CB-CB 4.09Å; F201-D219 HydrophobicContact CD1-CB 3.97Å; F201-D219 HydrophobicContact CG-CB 4.12Å |
| 202 | H | 98.8 | Very high | 98.5 | Very high | 6 Ų | 6 | 25.7 Ų | 25.7 | 3% | 0.028 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -61.9 | -27.8 | 179 | -74.3 | -77.4 | 0 | 0 | 0 | 112.7 | R126 E145 N148 I149 S198 H348 H352 | R126-H202 PolarHBondContact NH2-O 3.09Å; E145-H202 IonicContact OE2-CE1 3.84Å; E145-H202 IonicContact OE2-CG 2.8Å; E145-H202 IonicContact OE2-ND1 3.59Å; E145-H202 PolarHBondContact OE2-ND1 3.03Å; N148-H202 HydrophobicContact CB-CB 4.19Å; I149-H202 HydrophobicContact CG1-CB 3.72Å; S198-H202 PolarHBondContact O-CD2 3.46Å; S198-H202 VanDerWaalsContact O-CD2 3.23Å; S198-H202 PolarHBondContact O-N 3.41Å; H202-H348 AromaticContact CE1-CD2 3.63Å; H202-H348 AromaticContact CE1-CE1 3.89Å; H202-H348 AromaticContact CE1-NE2 3.15Å; H202-H348 PolarHBondContact CE1-NE2 3.35Å; H202-H348 AromaticContact NE2-CD2 3.79Å; H202-H348 AromaticContact NE2-CE1 3.89Å; H202-H348 AromaticContact NE2-NE2 3.01Å; H202-H348 PolarHBondContact NE2-NE2 3.01Å; H202-H352 AromaticContact CD2-CE1 3.5Å; H202-H352 AromaticContact CD2-NE2 3.97Å; H202-H352 AromaticContact NE2-CE1 3.49Å; H202-H352 PolarHBondContact NE2-CE1 3.5Å; H202-H352 AromaticContact NE2-NE2 3.5Å; H202-H352 PolarHBondContact NE2-NE2 3.38Å |
| 203 | T | 98.8 | Very high | 98.4 | Very high | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -67.5 | -51.3 | 171.4 | -63 | 0 | 0 | 0 | 0 | 111.7 | R126 F136 I139 W199 L200 F201 | R126-T203 PolarHBondContact NH1-O 3.15Å; F136-T203 HydrophobicContact CD1-CG2 3.85Å; F136-T203 HydrophobicContact CD2-CG2 4.34Å; F136-T203 HydrophobicContact CE1-CG2 4.06Å; F136-T203 HydrophobicContact CG-CG2 4Å; F136-T203 HydrophobicContact CZ-CG2 4.38Å; I139-T203 HydrophobicContact CD1-CG2 3.9Å; I139-T203 HydrophobicContact CG1-CG2 3.97Å; W199-T203 VanDerWaalsContact O-CB 3.3Å; W199-T203 WeakPolarHBondContact O-CB 3.5Å; W199-T203 PolarHBondContact O-N 3.31Å; W199-T203 PolarHBondContact O-OG1 3.07Å; L200-T203 WeakPolarHBondContact O-CA 3.49Å; L200-T203 WeakPolarHBondContact O-CB 3.48Å; L200-T203 PolarHBondContact O-N 2.85Å; L200-T203 VanDerWaalsContact O-N 3.11Å; F201-T203 PolarHBondContact O-N 3.27Å |
| 204 | V | 98.7 | Very high | 98.4 | Very high | 1 Ų | 1 | 31.1 Ų | 31.1 | 1% | 0.006 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -90.9 | 1.5 | -174.7 | -50.5 | 0 | 0 | 0 | 0 | 114.2 | F132 F136 L200 F201 C206 H207 V211 F215 | F132-V204 HydrophobicContact CD1-CB 4.41Å; F132-V204 HydrophobicContact CD1-CG1 3.79Å; F132-V204 HydrophobicContact CE1-CB 4.18Å; F132-V204 HydrophobicContact CE1-CG1 3.87Å; F136-V204 HydrophobicContact CE2-CG1 4.18Å; L200-V204 WeakPolarHBondContact O-CG2 3.21Å; L200-V204 PolarHBondContact O-N 3.43Å; F201-V204 CarbonylContact O-C 3.48Å; F201-V204 PolarHBondContact O-N 2.97Å; F201-V204 VanDerWaalsContact O-N 3.11Å; V204-C206 PolarHBondContact O-N 3.41Å; V204-H207 WeakPolarHBondContact O-CB 3.24Å; V204-H207 PolarHBondContact O-N 3.33Å; V204-V211 HydrophobicContact CB-CG1 4.05Å; V204-V211 HydrophobicContact CG2-CG1 3.72Å; V204-F215 HydrophobicContact CG2-CB 4.07Å; V204-F215 HydrophobicContact CG2-CD1 3.99Å; V204-F215 HydrophobicContact CG2-CD2 3.7Å; V204-F215 HydrophobicContact CG2-CE1 4.37Å; V204-F215 HydrophobicContact CG2-CE2 4.09Å; V204-F215 HydrophobicContact CG2-CG 3.64Å; V204-F215 HydrophobicContact CG2-CZ 4.4Å |
| 205 | Y | 98.6 | Very high | 98.4 | Very high | 30 Ų | 30 | 32.9 Ų | 32.9 | 12% | 0.118 | 17% | 0.173 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -53.1 | -33.9 | -174.1 | 179.1 | -130.8 | 0 | 0 | 0 | 113.3 | W114 L115 E145 F201 S212 | W114-Y205 VanDerWaalsContact CZ3-O 3.29Å; W114-Y205 WeakPolarHBondContact CZ3-O 3.25Å; W114-Y205 PolarHBondContact O-OH 2.86Å; L115-Y205 WeakPolarHBondContact CA-OH 3.44Å; L115-Y205 HydrophobicContact CD2-CD1 4.02Å; L115-Y205 HydrophobicContact CD2-CD2 4.27Å; L115-Y205 HydrophobicContact CD2-CE1 3.74Å; L115-Y205 HydrophobicContact CD2-CE2 3.98Å; L115-Y205 HydrophobicContact CD2-CG 4.27Å; L115-Y205 WeakPolarHBondContact CD2-O 3.4Å; E145-Y205 HydrophobicContact CG-CD1 4.29Å; F201-Y205 HydrophobicContact CD2-CD2 4.47Å; F201-Y205 AromaticContact CE2-CD2 3.49Å; F201-Y205 HydrophobicContact CE2-CD2 3.49Å; F201-Y205 VanDerWaalsContact CE2-CD2 3.49Å; F201-Y205 HydrophobicContact CE2-CE2 4.15Å; F201-Y205 HydrophobicContact CE2-CG 4.27Å; F201-Y205 AromaticContact CZ-CD2 3.55Å; F201-Y205 HydrophobicContact CZ-CD2 3.55Å; F201-Y205 AromaticContact CZ-CE2 3.93Å; F201-Y205 HydrophobicContact CZ-CE2 3.93Å; F201-Y205 HydrophobicContact CZ-CG 4.22Å; F201-Y205 WeakPolarHBondContact O-CA 3.23Å; F201-Y205 VanDerWaalsContact O-CB 3.32Å; F201-Y205 WeakPolarHBondContact O-CB 3.37Å; F201-Y205 PolarHBondContact O-N 3.5Å; Y205-S212 WeakPolarHBondContact CD2-OG 3.37Å; Y205-S212 VanDerWaalsContact CE2-OG 3.25Å; Y205-S212 WeakPolarHBondContact CE2-OG 3.4Å |
| 206 | C | 98.3 | Very high | 98.3 | Very high | 2 Ų | 2 | 33.2 Ų | 33.2 | 1% | 0.014 | 18% | 0.175 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -87.8 | 9.5 | 178.1 | 64.3 | 0 | 0 | 0 | 0 | 115.3 | R126 P128 M129 V204 | R126-C206 HydrophobicContact CB-CB 3.82Å; P128-C206 CarbonylContact C-O 3.59Å; P128-C206 WeakPolarHBondContact CA-O 3.34Å; M129-C206 VanDerWaalsContact CE-SG 3.56Å; M129-C206 PolarHBondContact N-O 2.88Å; V204-C206 PolarHBondContact O-N 3.41Å |
| 207 | H | 98.4 | Very high | 98.3 | Very high | 20 Ų | 20 | 33.8 Ų | 33.8 | 9% | 0.093 | 17% | 0.174 | C | C | . | . | S | Bend | trans | -71 | -68.9 | -172.8 | -174.3 | -76.6 | 0 | 0 | 0 | 112.9 | M129 P130 S131 F132 V204 V211 | M129-H207 CarbonylContact C-O 3.58Å; M129-H207 WeakPolarHBondContact O-CA 3.22Å; P130-H207 VanDerWaalsContact C-NE2 3.34Å; S131-H207 PolarHBondContact N-NE2 3.08Å; F132-H207 AromaticContact CD1-CD2 3.92Å; F132-H207 AromaticContact CD2-CD2 3.93Å; F132-H207 AromaticContact CD2-NE2 3.51Å; F132-H207 AromaticContact CE2-NE2 3.6Å; F132-H207 AromaticContact CG-CD2 3.86Å; F132-H207 AromaticContact CG-NE2 3.91Å; F132-H207 PolarHBondContact N-CD2 2.96Å; F132-H207 PolarHBondContact N-NE2 2.88Å; V204-H207 WeakPolarHBondContact O-CB 3.24Å; V204-H207 PolarHBondContact O-N 3.33Å; H207-V211 HydrophobicContact CB-CB 4.12Å; H207-V211 HydrophobicContact CB-CG1 3.92Å |
| 208 | S | 98 | Very high | 98.3 | Very high | 41 Ų | 41 | 34.2 Ų | 34.2 | 29% | 0.287 | 18% | 0.179 | S | C | . | . | trans | -163.3 | 159.6 | 177.5 | 56.4 | 0 | 0 | 0 | 0 | 109.1 | W114 G210 V211 S212 | W114-S208 VanDerWaalsContact CH2-C 3.5Å; W114-S208 VanDerWaalsContact CH2-CA 3.4Å; S208-G210 VanDerWaalsContact C-N 3.33Å; S208-G210 PolarHBondContact O-N 3.45Å; S208-V211 PolarHBondContact O-N 3.5Å; S208-V211 VanDerWaalsContact O-N 3.12Å; S208-S212 WeakPolarHBondContact O-CB 3.46Å; S208-S212 PolarHBondContact O-N 3.3Å | ||
| 209 | E | 97.4 | Very high | 98.3 | Very high | 87 Ų | 87 | 34.6 Ų | 34.6 | 41% | 0.407 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -53.4 | -46.8 | -175.1 | -167.9 | -155.6 | 124.3 | 0 | 0 | 112.7 | W114 V211 S212 R213 | W114-E209 HydrophobicContact CB-CB 4.48Å; W114-E209 HydrophobicContact CB-CG 3.86Å; W114-E209 HydrophobicContact CD2-CB 3.99Å; W114-E209 HydrophobicContact CD2-CG 4.33Å; W114-E209 HydrophobicContact CG-CB 3.94Å; W114-E209 HydrophobicContact CG-CG 3.84Å; E209-V211 PolarHBondContact O-N 3.49Å; E209-S212 PolarHBondContact O-N 3.39Å; E209-R213 HydrophobicContact CG-CG 4.35Å; E209-R213 WeakPolarHBondContact O-CB 3.32Å; E209-R213 WeakPolarHBondContact O-CG 3.3Å; E209-R213 PolarHBondContact O-N 2.67Å; E209-R213 WeakPolarHBondContact OE1-CD 3.37Å; E209-R213 IonicContact OE1-CZ 3.75Å; E209-R213 IonicContact OE1-NE 3.58Å; E209-R213 IonicContact OE1-NH1 2.78Å; E209-R213 PolarHBondContact OE1-NH1 2.91Å |
| 210 | G | 97.9 | Very high | 98.2 | Very high | 51 Ų | 51 | 33.5 Ų | 33.5 | 53% | 0.526 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -63.3 | -37.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | S208 L214 | S208-G210 VanDerWaalsContact C-N 3.33Å; S208-G210 PolarHBondContact O-N 3.45Å; G210-L214 WeakPolarHBondContact O-CB 3.5Å; G210-L214 PolarHBondContact O-N 2.91Å |
| 211 | V | 98.3 | Very high | 98.2 | Very high | 24 Ų | 24 | 32 Ų | 32 | 15% | 0.145 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -70.9 | -43.3 | 175.1 | 173.2 | 0 | 0 | 0 | 0 | 110.3 | F132 V204 H207 S208 E209 L214 F215 | F132-V211 HydrophobicContact CE1-CG1 3.91Å; F132-V211 HydrophobicContact CZ-CG1 3.99Å; F132-V211 HydrophobicContact CZ-CG2 3.95Å; V204-V211 HydrophobicContact CB-CG1 4.05Å; V204-V211 HydrophobicContact CG2-CG1 3.72Å; H207-V211 HydrophobicContact CB-CB 4.12Å; H207-V211 HydrophobicContact CB-CG1 3.92Å; S208-V211 PolarHBondContact O-N 3.5Å; S208-V211 VanDerWaalsContact O-N 3.12Å; E209-V211 PolarHBondContact O-N 3.49Å; V211-L214 PolarHBondContact O-N 2.94Å; V211-F215 HydrophobicContact CG1-CD2 3.97Å; V211-F215 HydrophobicContact CG1-CE2 4.23Å; V211-F215 WeakPolarHBondContact O-CD2 3.22Å; V211-F215 PolarHBondContact O-N 3.26Å |
| 212 | S | 97.9 | Very high | 98.2 | Very high | 8 Ų | 8 | 31.3 Ų | 31.3 | 6% | 0.056 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.2 | -46.3 | 176.5 | -175.9 | 0 | 0 | 0 | 0 | 112 | Y205 S208 E209 L214 F215 S216 | Y205-S212 WeakPolarHBondContact CD2-OG 3.37Å; Y205-S212 VanDerWaalsContact CE2-OG 3.25Å; Y205-S212 WeakPolarHBondContact CE2-OG 3.4Å; S208-S212 WeakPolarHBondContact O-CB 3.46Å; S208-S212 PolarHBondContact O-N 3.3Å; E209-S212 PolarHBondContact O-N 3.39Å; S212-L214 PolarHBondContact O-N 3.2Å; S212-F215 PolarHBondContact O-N 2.88Å; S212-S216 WeakPolarHBondContact O-CB 3.19Å; S212-S216 PolarHBondContact O-N 3.33Å; S212-S216 PolarHBondContact O-OG 3.11Å |
| 213 | R | 96.6 | Very high | 98.2 | Very high | 105 Ų | 105 | 32.3 Ų | 32.3 | 40% | 0.396 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -67.9 | -27.5 | 176 | -75.7 | 173.3 | 62.4 | -168.2 | -4.2 | 114.3 | E209 S216 K217 D267 | E209-R213 HydrophobicContact CG-CG 4.35Å; E209-R213 WeakPolarHBondContact O-CB 3.32Å; E209-R213 WeakPolarHBondContact O-CG 3.3Å; E209-R213 PolarHBondContact O-N 2.67Å; E209-R213 WeakPolarHBondContact OE1-CD 3.37Å; E209-R213 IonicContact OE1-CZ 3.75Å; E209-R213 IonicContact OE1-NE 3.58Å; E209-R213 IonicContact OE1-NH1 2.78Å; E209-R213 PolarHBondContact OE1-NH1 2.91Å; R213-S216 PolarHBondContact O-OG 3.19Å; R213-K217 WeakPolarHBondContact O-CD 3.4Å; R213-K217 WeakPolarHBondContact O-CE 3.34Å; R213-K217 VanDerWaalsContact O-CG 3.25Å; R213-K217 WeakPolarHBondContact O-CG 3.33Å; R213-D267 IonicContact CZ-OD1 3.8Å; R213-D267 IonicContact NE-OD1 2.73Å; R213-D267 PolarHBondContact NE-OD1 3.23Å; R213-D267 VanDerWaalsContact NE-OD1 3.08Å; R213-D267 IonicContact NH2-OD1 2.83Å; R213-D267 PolarHBondContact NH2-OD1 2.87Å; R213-D267 IonicContact NH2-OD2 3.38Å; R213-D267 PolarHBondContact NH2-OD2 3.33Å |
| 214 | L | 98.2 | Very high | 98.2 | Very high | 99 Ų | 99 | 32.3 Ų | 32.3 | 52% | 0.518 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -73.2 | -50.6 | 172.5 | 175.7 | 60.7 | 0 | 0 | 0 | 110.6 | G210 V211 S212 K217 L218 | G210-L214 WeakPolarHBondContact O-CB 3.5Å; G210-L214 PolarHBondContact O-N 2.91Å; V211-L214 PolarHBondContact O-N 2.94Å; S212-L214 PolarHBondContact O-N 3.2Å; L214-K217 PolarHBondContact O-N 3.32Å; L214-L218 PolarHBondContact O-N 2.59Å |
| 215 | F | 98.3 | Very high | 98.2 | Very high | 41 Ų | 41 | 34.7 Ų | 34.7 | 18% | 0.18 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -74.4 | -27.6 | -174.7 | -83.1 | -97.6 | 0 | 0 | 0 | 113.5 | L200 F201 V204 V211 S212 K217 L218 D219 | L200-F215 HydrophobicContact CB-CD1 4.1Å; L200-F215 HydrophobicContact CB-CE1 3.92Å; F201-F215 HydrophobicContact CB-CB 3.94Å; F201-F215 HydrophobicContact CD2-CB 3.73Å; F201-F215 HydrophobicContact CG-CB 4.3Å; V204-F215 HydrophobicContact CG2-CB 4.07Å; V204-F215 HydrophobicContact CG2-CD1 3.99Å; V204-F215 HydrophobicContact CG2-CD2 3.7Å; V204-F215 HydrophobicContact CG2-CE1 4.37Å; V204-F215 HydrophobicContact CG2-CE2 4.09Å; V204-F215 HydrophobicContact CG2-CG 3.64Å; V204-F215 HydrophobicContact CG2-CZ 4.4Å; V211-F215 HydrophobicContact CG1-CD2 3.97Å; V211-F215 HydrophobicContact CG1-CE2 4.23Å; V211-F215 WeakPolarHBondContact O-CD2 3.22Å; V211-F215 PolarHBondContact O-N 3.26Å; S212-F215 PolarHBondContact O-N 2.88Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.14Å; F215-L218 HydrophobicContact CD1-CD1 4.22Å; F215-L218 HydrophobicContact CE1-CD1 4.4Å; F215-L218 HydrophobicContact CG-CD1 4.49Å; F215-L218 WeakPolarHBondContact O-CB 3.3Å; F215-L218 PolarHBondContact O-N 3.23Å; F215-D219 PolarHBondContact O-N 2.76Å |
| 216 | S | 97.5 | Very high | 98.2 | Very high | 8 Ų | 8 | 34 Ų | 34 | 6% | 0.056 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.5 | -36.2 | 171.9 | 62.4 | 0 | 0 | 0 | 0 | 112.4 | S212 R213 L218 D219 Y220 | S212-S216 WeakPolarHBondContact O-CB 3.19Å; S212-S216 PolarHBondContact O-N 3.33Å; S212-S216 PolarHBondContact O-OG 3.11Å; R213-S216 PolarHBondContact O-OG 3.19Å; S216-L218 VanDerWaalsContact C-N 3.3Å; S216-L218 PolarHBondContact O-N 2.91Å; S216-D219 PolarHBondContact O-N 3.44Å; S216-Y220 WeakPolarHBondContact O-CB 3.3Å; S216-Y220 WeakPolarHBondContact O-CD1 3.27Å; S216-Y220 WeakPolarHBondContact O-CD2 3.42Å; S216-Y220 PolarHBondContact O-N 3.11Å |
| 217 | K | 98.3 | Very high | 98.2 | Very high | 37 Ų | 37 | 33.9 Ų | 33.9 | 16% | 0.161 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.1 | -35.2 | 173.1 | -65.3 | 177.2 | -171.4 | -162.7 | 0 | 111.6 | R213 L214 F215 S221 Q265 D267 | R213-K217 WeakPolarHBondContact O-CD 3.4Å; R213-K217 WeakPolarHBondContact O-CE 3.34Å; R213-K217 VanDerWaalsContact O-CG 3.25Å; R213-K217 WeakPolarHBondContact O-CG 3.33Å; L214-K217 PolarHBondContact O-N 3.32Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.14Å; K217-S221 VanDerWaalsContact O-CB 3.28Å; K217-S221 WeakPolarHBondContact O-CB 3.42Å; K217-S221 PolarHBondContact O-N 3.45Å; K217-S221 PolarHBondContact O-OG 2.84Å; K217-Q265 VanDerWaalsContact CE-O 3.31Å; K217-Q265 WeakPolarHBondContact CE-O 3.22Å; K217-Q265 PolarHBondContact NZ-O 3.04Å; K217-D267 WeakPolarHBondContact CE-OD1 3.4Å; K217-D267 IonicContact NZ-OD1 3.65Å; K217-D267 PolarHBondContact NZ-OD1 3.39Å; K217-D267 IonicContact NZ-OD2 3.67Å |
| 218 | L | 98.5 | Very high | 98.2 | Very high | 57 Ų | 57 | 34.3 Ų | 34.3 | 30% | 0.298 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -69.8 | -45.5 | 173.6 | -65.1 | 175.4 | 0 | 0 | 0 | 112.2 | F197 L214 F215 S216 S221 G222 | F197-L218 HydrophobicContact CB-CB 4.05Å; F197-L218 HydrophobicContact CD1-CB 4.35Å; F197-L218 HydrophobicContact CD2-CB 4.29Å; F197-L218 VanDerWaalsContact CD2-O 3.31Å; F197-L218 WeakPolarHBondContact CD2-O 3.31Å; F197-L218 HydrophobicContact CG-CB 4Å; L214-L218 PolarHBondContact O-N 2.59Å; F215-L218 HydrophobicContact CD1-CD1 4.22Å; F215-L218 HydrophobicContact CE1-CD1 4.4Å; F215-L218 HydrophobicContact CG-CD1 4.49Å; F215-L218 WeakPolarHBondContact O-CB 3.3Å; F215-L218 PolarHBondContact O-N 3.23Å; S216-L218 VanDerWaalsContact C-N 3.3Å; S216-L218 PolarHBondContact O-N 2.91Å; L218-S221 PolarHBondContact O-N 2.97Å; L218-G222 PolarHBondContact O-N 3.45Å |
| 219 | D | 98.4 | Very high | 98.3 | Very high | 10 Ų | 10 | 32.7 Ų | 32.7 | 5% | 0.053 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -55.4 | -52.6 | 175.4 | 175.2 | 71.5 | 0 | 0 | 0 | 111.3 | S198 F201 F215 S216 S221 G222 I223 | S198-D219 WeakPolarHBondContact CA-OD1 3.43Å; S198-D219 WeakPolarHBondContact CB-OD1 3.24Å; S198-D219 PolarHBondContact OG-OD1 2.71Å; F201-D219 HydrophobicContact CB-CB 4.09Å; F201-D219 HydrophobicContact CD1-CB 3.97Å; F201-D219 HydrophobicContact CG-CB 4.12Å; F215-D219 PolarHBondContact O-N 2.76Å; S216-D219 PolarHBondContact O-N 3.44Å; D219-S221 PolarHBondContact O-N 2.66Å; D219-G222 WeakPolarHBondContact O-CA 3.49Å; D219-G222 PolarHBondContact O-N 2.8Å; D219-I223 PolarHBondContact O-N 3.5Å |
| 220 | Y | 97.7 | Very high | 98.3 | Very high | 19 Ų | 19 | 29 Ų | 29 | 8% | 0.075 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -62.6 | -38.8 | 177.5 | -60.9 | -12.6 | 0 | 0 | 0 | 112.9 | S216 G222 I223 F269 A270 R278 F282 | S216-Y220 WeakPolarHBondContact O-CB 3.3Å; S216-Y220 WeakPolarHBondContact O-CD1 3.27Å; S216-Y220 WeakPolarHBondContact O-CD2 3.42Å; S216-Y220 PolarHBondContact O-N 3.11Å; Y220-G222 VanDerWaalsContact C-N 3.28Å; Y220-G222 PolarHBondContact O-N 2.76Å; Y220-I223 PolarHBondContact O-N 3.36Å; Y220-F269 AromaticContact CD2-CD1 3.69Å; Y220-F269 HydrophobicContact CD2-CD1 3.69Å; Y220-F269 AromaticContact CD2-CE1 3.86Å; Y220-F269 HydrophobicContact CD2-CE1 3.86Å; Y220-F269 AromaticContact CE2-CD1 3.98Å; Y220-F269 HydrophobicContact CE2-CD1 3.98Å; Y220-F269 HydrophobicContact CE2-CE1 4.41Å; Y220-F269 HydrophobicContact CG-CE1 4.33Å; Y220-A270 HydrophobicContact CE2-CB 4.01Å; Y220-R278 VanDerWaalsContact CZ-CD 3.49Å; Y220-F282 WeakPolarHBondContact O-CE1 3.49Å; Y220-F282 VanDerWaalsContact O-CZ 3.27Å; Y220-F282 WeakPolarHBondContact O-CZ 3.33Å |
| 221 | S | 98.6 | Very high | 98.4 | Very high | 11 Ų | 11 | 27.3 Ų | 27.3 | 8% | 0.077 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -66.1 | -33.7 | 174.5 | -57.5 | 0 | 0 | 0 | 0 | 111.7 | K217 L218 D219 I223 A224 L225 Q265 | K217-S221 VanDerWaalsContact O-CB 3.28Å; K217-S221 WeakPolarHBondContact O-CB 3.42Å; K217-S221 PolarHBondContact O-N 3.45Å; K217-S221 PolarHBondContact O-OG 2.84Å; L218-S221 PolarHBondContact O-N 2.97Å; D219-S221 PolarHBondContact O-N 2.66Å; S221-I223 VanDerWaalsContact C-N 3.35Å; S221-I223 PolarHBondContact O-N 3.42Å; S221-A224 PolarHBondContact O-N 3.01Å; S221-L225 WeakPolarHBondContact O-CG 3.5Å; S221-L225 PolarHBondContact O-N 3.07Å; S221-Q265 PolarHBondContact OG-NE2 3.5Å |
| 222 | G | 98.7 | Very high | 98.4 | Very high | 0 Ų | 0 | 27.3 Ų | 27.3 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -57.3 | -44.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | C194 L218 D219 Y220 A224 L225 L226 | C194-G222 VanDerWaalsContact CB-O 3.27Å; C194-G222 WeakPolarHBondContact CB-O 3.4Å; C194-G222 PolarHBondContact SG-O 2.89Å; L218-G222 PolarHBondContact O-N 3.45Å; D219-G222 WeakPolarHBondContact O-CA 3.49Å; D219-G222 PolarHBondContact O-N 2.8Å; Y220-G222 VanDerWaalsContact C-N 3.28Å; Y220-G222 PolarHBondContact O-N 2.76Å; G222-A224 VanDerWaalsContact C-N 3.32Å; G222-A224 PolarHBondContact O-N 3.4Å; G222-L225 PolarHBondContact O-N 3.04Å; G222-L225 VanDerWaalsContact O-N 3.13Å; G222-L226 PolarHBondContact O-N 3.41Å |
| 223 | I | 98.7 | Very high | 98.4 | Very high | 28 Ų | 28 | 27 Ų | 27 | 14% | 0.144 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.2 | -45.3 | 177.8 | -58 | 171.8 | 0 | 0 | 0 | 110.6 | D219 Y220 S221 L226 I227 F282 | D219-I223 PolarHBondContact O-N 3.5Å; Y220-I223 PolarHBondContact O-N 3.36Å; S221-I223 VanDerWaalsContact C-N 3.35Å; S221-I223 PolarHBondContact O-N 3.42Å; I223-L226 PolarHBondContact O-N 3.15Å; I223-I227 HydrophobicContact CG2-CD1 3.94Å; I223-I227 WeakPolarHBondContact O-CD1 3.46Å; I223-I227 VanDerWaalsContact O-CG1 3.3Å; I223-I227 WeakPolarHBondContact O-CG1 3.42Å; I223-I227 PolarHBondContact O-N 3.47Å; I223-I227 VanDerWaalsContact O-N 3.07Å; I223-F282 HydrophobicContact CB-CD1 4.02Å; I223-F282 HydrophobicContact CB-CE1 4.07Å; I223-F282 HydrophobicContact CB-CG 4.33Å; I223-F282 HydrophobicContact CB-CZ 4.41Å; I223-F282 HydrophobicContact CD1-CD2 4.17Å; I223-F282 HydrophobicContact CD1-CE2 4.16Å; I223-F282 HydrophobicContact CG2-CB 3.93Å; I223-F282 HydrophobicContact CG2-CD1 3.6Å; I223-F282 HydrophobicContact CG2-CD2 4.29Å; I223-F282 HydrophobicContact CG2-CE1 4.18Å; I223-F282 HydrophobicContact CG2-CG 3.68Å |
| 224 | A | 98.7 | Very high | 98.5 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -64 | -40.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | S221 G222 I227 M228 A260 I261 F282 L285 | S221-A224 PolarHBondContact O-N 3.01Å; G222-A224 VanDerWaalsContact C-N 3.32Å; G222-A224 PolarHBondContact O-N 3.4Å; A224-I227 PolarHBondContact O-N 2.92Å; A224-M228 WeakPolarHBondContact O-CB 3.36Å; A224-M228 VanDerWaalsContact O-CG 3.29Å; A224-M228 WeakPolarHBondContact O-CG 3.2Å; A224-M228 PolarHBondContact O-N 3.47Å; A224-A260 HydrophobicContact CB-CB 4.36Å; A224-I261 HydrophobicContact CB-CD1 4.14Å; A224-I261 HydrophobicContact CB-CG1 3.65Å; A224-F282 HydrophobicContact CB-CE1 4.27Å; A224-L285 HydrophobicContact CB-CD2 4.11Å |
| 225 | L | 98.8 | Very high | 98.5 | Very high | 50 Ų | 50 | 17.9 Ų | 17.9 | 26% | 0.262 | 9% | 0.092 | S | C | . | . | H | α-helix | trans | -64.6 | -38.6 | 177.4 | -69.2 | 170.9 | 0 | 0 | 0 | 112.8 | L193 F197 S221 G222 G229 I261 | L193-L225 HydrophobicContact CD1-CD1 4.26Å; F197-L225 HydrophobicContact CE2-CD1 4.14Å; S221-L225 WeakPolarHBondContact O-CG 3.5Å; S221-L225 PolarHBondContact O-N 3.07Å; G222-L225 PolarHBondContact O-N 3.04Å; G222-L225 VanDerWaalsContact O-N 3.13Å; L225-G229 PolarHBondContact O-N 3.28Å; L225-I261 HydrophobicContact CD2-CD1 4.17Å; L225-I261 HydrophobicContact CG-CD1 4.32Å |
| 226 | L | 98.9 | Very high | 98.5 | Very high | 15 Ų | 15 | 17.7 Ų | 17.7 | 8% | 0.079 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -63.8 | -46.6 | 172.2 | 167.4 | 59.2 | 0 | 0 | 0 | 111.3 | F187 A191 C194 G222 I223 G229 S230 V355 A359 | F187-L226 HydrophobicContact CE2-CD1 4.11Å; A191-L226 HydrophobicContact CB-CD1 3.98Å; C194-L226 HydrophobicContact CB-CB 3.78Å; C194-L226 HydrophobicContact CB-CD2 4.39Å; G222-L226 PolarHBondContact O-N 3.41Å; I223-L226 PolarHBondContact O-N 3.15Å; L226-G229 PolarHBondContact O-N 3.05Å; L226-S230 WeakPolarHBondContact O-CB 3.31Å; L226-S230 PolarHBondContact O-N 3.44Å; L226-S230 PolarHBondContact O-OG 3.42Å; L226-V355 HydrophobicContact CD2-CG1 3.96Å; L226-A359 HydrophobicContact CD1-CB 4.39Å |
| 227 | I | 98.8 | Very high | 98.5 | Very high | 1 Ų | 1 | 18 Ų | 18 | 1% | 0.005 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -61.5 | -51.6 | 178.8 | -63.2 | 160.7 | 0 | 0 | 0 | 110.2 | I223 A224 G229 S230 F231 I253 F282 L285 Y321 | I223-I227 HydrophobicContact CG2-CD1 3.94Å; I223-I227 WeakPolarHBondContact O-CD1 3.46Å; I223-I227 VanDerWaalsContact O-CG1 3.3Å; I223-I227 WeakPolarHBondContact O-CG1 3.42Å; I223-I227 PolarHBondContact O-N 3.47Å; I223-I227 VanDerWaalsContact O-N 3.07Å; A224-I227 PolarHBondContact O-N 2.92Å; I227-G229 PolarHBondContact O-N 2.82Å; I227-S230 PolarHBondContact O-N 3.27Å; I227-S230 PolarHBondContact O-OG 3.12Å; I227-F231 HydrophobicContact CG2-CD2 4.29Å; I227-F231 HydrophobicContact CG2-CE2 3.93Å; I227-F231 VanDerWaalsContact O-CD2 3.32Å; I227-F231 WeakPolarHBondContact O-CD2 3.39Å; I227-F231 PolarHBondContact O-N 3.26Å; I227-I253 HydrophobicContact CG2-CD1 4.32Å; I227-F282 HydrophobicContact CD1-CB 4.46Å; I227-F282 HydrophobicContact CD1-CD1 4.47Å; I227-L285 HydrophobicContact CB-CD2 4.22Å; I227-L285 HydrophobicContact CB-CG 4.41Å; I227-L285 HydrophobicContact CD1-CB 4.24Å; I227-L285 HydrophobicContact CD1-CD2 3.86Å; I227-L285 HydrophobicContact CD1-CG 4.17Å; I227-L285 HydrophobicContact CG2-CD2 4.24Å; I227-L285 HydrophobicContact CG2-CG 3.89Å; I227-Y321 HydrophobicContact CD1-CE1 4.46Å; I227-Y321 HydrophobicContact CG1-CE1 4.32Å; I227-Y321 WeakPolarHBondContact CG1-OH 3.16Å |
| 228 | M | 98.8 | Very high | 98.4 | Very high | 29 Ų | 29 | 16.5 Ų | 16.5 | 14% | 0.143 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -54.5 | -49.6 | 176 | -73.5 | 168.8 | 58.7 | 0 | 0 | 111.8 | A224 S230 F231 C254 I261 | A224-M228 WeakPolarHBondContact O-CB 3.36Å; A224-M228 VanDerWaalsContact O-CG 3.29Å; A224-M228 WeakPolarHBondContact O-CG 3.2Å; A224-M228 PolarHBondContact O-N 3.47Å; M228-S230 VanDerWaalsContact C-N 3.32Å; M228-S230 PolarHBondContact O-N 2.9Å; M228-F231 PolarHBondContact O-N 2.93Å; M228-C254 HydrophobicContact CE-CB 4.45Å; M228-I261 HydrophobicContact SD-CD1 4.44Å |
| 229 | G | 98.8 | Very high | 98.3 | Very high | 6 Ų | 6 | 14.3 Ų | 14.3 | 6% | 0.062 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -60.4 | -38.8 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113 | F187 L225 L226 I227 F231 V232 P233 | F187-G229 WeakPolarHBondContact CA-O 3.43Å; L225-G229 PolarHBondContact O-N 3.28Å; L226-G229 PolarHBondContact O-N 3.05Å; I227-G229 PolarHBondContact O-N 2.82Å; G229-F231 VanDerWaalsContact C-N 3.33Å; G229-F231 PolarHBondContact O-N 2.8Å; G229-V232 PolarHBondContact O-N 2.78Å; G229-P233 WeakPolarHBondContact O-CD 3.25Å |
| 230 | S | 98.8 | Very high | 98.2 | Very high | 9 Ų | 9 | 16.2 Ų | 16.2 | 6% | 0.063 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -66.3 | -30.8 | 178.4 | 75.5 | 0 | 0 | 0 | 0 | 113.6 | L226 I227 M228 V232 H362 | L226-S230 WeakPolarHBondContact O-CB 3.31Å; L226-S230 PolarHBondContact O-N 3.44Å; L226-S230 PolarHBondContact O-OG 3.42Å; I227-S230 PolarHBondContact O-N 3.27Å; I227-S230 PolarHBondContact O-OG 3.12Å; M228-S230 VanDerWaalsContact C-N 3.32Å; M228-S230 PolarHBondContact O-N 2.9Å; S230-V232 VanDerWaalsContact C-N 3.28Å; S230-V232 PolarHBondContact O-N 2.98Å; S230-H362 PolarHBondContact O-CE1 3.14Å; S230-H362 PolarHBondContact O-NE2 2.85Å; S230-H362 VanDerWaalsContact O-NE2 3.1Å |
| 231 | F | 98.8 | Very high | 98 | Very high | 16 Ų | 16 | 16.5 Ų | 16.5 | 7% | 0.07 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -70.4 | -26 | 178 | -85 | -128.8 | 0 | 0 | 0 | 112.1 | I227 M228 G229 W234 L235 I253 | I227-F231 HydrophobicContact CG2-CD2 4.29Å; I227-F231 HydrophobicContact CG2-CE2 3.93Å; I227-F231 VanDerWaalsContact O-CD2 3.32Å; I227-F231 WeakPolarHBondContact O-CD2 3.39Å; I227-F231 PolarHBondContact O-N 3.26Å; M228-F231 PolarHBondContact O-N 2.93Å; G229-F231 VanDerWaalsContact C-N 3.33Å; G229-F231 PolarHBondContact O-N 2.8Å; F231-W234 HydrophobicContact CD1-CE3 4.43Å; F231-W234 HydrophobicContact CD1-CZ3 4.23Å; F231-W234 HydrophobicContact CE1-CZ3 4.25Å; F231-L235 HydrophobicContact CB-CD1 4.17Å; F231-L235 HydrophobicContact CD1-CD1 4.21Å; F231-L235 VanDerWaalsContact O-CB 3.27Å; F231-L235 WeakPolarHBondContact O-CB 3.33Å; F231-L235 VanDerWaalsContact O-CG 3.24Å; F231-L235 WeakPolarHBondContact O-CG 3.47Å; F231-L235 PolarHBondContact O-N 3.27Å; F231-I253 HydrophobicContact CB-CG1 4.16Å; F231-I253 HydrophobicContact CB-CG2 3.99Å; F231-I253 HydrophobicContact CD1-CB 3.9Å; F231-I253 HydrophobicContact CD1-CD1 3.98Å; F231-I253 HydrophobicContact CD1-CG1 3.69Å; F231-I253 HydrophobicContact CD1-CG2 4.18Å; F231-I253 HydrophobicContact CD2-CD1 4.36Å; F231-I253 HydrophobicContact CD2-CG1 4.19Å; F231-I253 HydrophobicContact CE1-CB 4.38Å; F231-I253 HydrophobicContact CE1-CD1 3.76Å; F231-I253 HydrophobicContact CE1-CG1 4.03Å; F231-I253 HydrophobicContact CE2-CD1 4.18Å; F231-I253 HydrophobicContact CE2-CG1 4.49Å; F231-I253 HydrophobicContact CG-CB 4.32Å; F231-I253 HydrophobicContact CG-CD1 4.27Å; F231-I253 HydrophobicContact CG-CG1 3.77Å; F231-I253 HydrophobicContact CG-CG2 4.34Å; F231-I253 HydrophobicContact CZ-CD1 3.86Å; F231-I253 HydrophobicContact CZ-CG1 4.41Å |
| 232 | V | 98.8 | Very high | 97.8 | Very high | 25 Ų | 25 | 18.2 Ų | 18.2 | 15% | 0.152 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -63.2 | -58 | -174.3 | -169.4 | 0 | 0 | 0 | 0 | 113.7 | V183 L186 G229 S230 Y236 L250 | V183-V232 HydrophobicContact CB-CG1 4Å; V183-V232 HydrophobicContact CG1-CG1 3.95Å; L186-V232 HydrophobicContact CB-CB 4.49Å; L186-V232 HydrophobicContact CB-CG2 4.41Å; L186-V232 HydrophobicContact CD1-CG1 3.97Å; G229-V232 PolarHBondContact O-N 2.78Å; S230-V232 VanDerWaalsContact C-N 3.28Å; S230-V232 PolarHBondContact O-N 2.98Å; V232-Y236 WeakPolarHBondContact O-CB 3.38Å; V232-Y236 PolarHBondContact O-N 3.02Å; V232-Y236 VanDerWaalsContact O-N 3.14Å; V232-L250 HydrophobicContact CB-CD2 4.39Å; V232-L250 HydrophobicContact CG1-CD2 4.34Å; V232-L250 HydrophobicContact CG2-CD2 4.17Å |
| 233 | P | 98.6 | Very high | 97.6 | Very high | 0 Ų | 0 | 21.9 Ų | 21.9 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -67.6 | -36.3 | 178.4 | 28 | -34.1 | 0 | 0 | 0 | 111.8 | V183 F184 F187 G229 Y236 Y237 V366 | V183-P233 HydrophobicContact CB-CB 4.35Å; V183-P233 HydrophobicContact CG2-CB 4.16Å; F184-P233 HydrophobicContact CD2-CB 4.34Å; F184-P233 HydrophobicContact CE2-CB 4.45Å; F187-P233 HydrophobicContact CB-CG 3.95Å; G229-P233 WeakPolarHBondContact O-CD 3.25Å; P233-Y236 PolarHBondContact O-N 3.08Å; P233-Y237 WeakPolarHBondContact O-CD2 3.36Å; P233-Y237 PolarHBondContact O-N 3.15Å; P233-V366 HydrophobicContact CB-CB 4.29Å; P233-V366 HydrophobicContact CB-CG1 4.42Å; P233-V366 HydrophobicContact CB-CG2 4.34Å; P233-V366 HydrophobicContact CG-CB 4.47Å; P233-V366 HydrophobicContact CG-CG1 4.32Å; P233-V366 HydrophobicContact CG-CG2 4.2Å |
| 234 | W | 98.6 | Very high | 97.6 | Very high | 14 Ų | 14 | 27.3 Ų | 27.3 | 5% | 0.053 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.4 | -45.9 | -178.9 | 172.7 | 59.5 | 0 | 0 | 0 | 113 | F231 S238 P292 T293 L314 V366 | F231-W234 HydrophobicContact CD1-CE3 4.43Å; F231-W234 HydrophobicContact CD1-CZ3 4.23Å; F231-W234 HydrophobicContact CE1-CZ3 4.25Å; W234-S238 PolarHBondContact NE1-OG 3.49Å; W234-S238 VanDerWaalsContact O-CB 3.27Å; W234-S238 WeakPolarHBondContact O-CB 3.36Å; W234-S238 PolarHBondContact O-N 3.38Å; W234-S238 PolarHBondContact O-OG 3.02Å; W234-P292 HydrophobicContact CH2-CB 3.99Å; W234-P292 HydrophobicContact CH2-CG 3.86Å; W234-P292 HydrophobicContact CZ3-CB 4.26Å; W234-P292 HydrophobicContact CZ3-CG 3.89Å; W234-T293 WeakPolarHBondContact CH2-OG1 3.31Å; W234-T293 WeakPolarHBondContact CZ2-OG1 3.43Å; W234-L314 HydrophobicContact CZ2-CD1 4.04Å; W234-L314 HydrophobicContact CZ2-CD2 4.1Å; W234-V366 HydrophobicContact CB-CG1 3.77Å |
| 235 | L | 98.3 | Very high | 97.5 | Very high | 0 Ų | 0 | 27.7 Ų | 27.7 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -66.5 | -38.4 | 175.3 | -69.1 | 174.4 | 0 | 0 | 0 | 111.4 | F231 Y237 S238 F239 L250 P292 | F231-L235 HydrophobicContact CB-CD1 4.17Å; F231-L235 HydrophobicContact CD1-CD1 4.21Å; F231-L235 VanDerWaalsContact O-CB 3.27Å; F231-L235 WeakPolarHBondContact O-CB 3.33Å; F231-L235 VanDerWaalsContact O-CG 3.24Å; F231-L235 WeakPolarHBondContact O-CG 3.47Å; F231-L235 PolarHBondContact O-N 3.27Å; L235-Y237 PolarHBondContact O-N 2.8Å; L235-S238 PolarHBondContact O-N 3.47Å; L235-F239 HydrophobicContact CD2-CD2 3.85Å; L235-F239 HydrophobicContact CD2-CE2 3.76Å; L235-F239 PolarHBondContact O-N 3.19Å; L235-L250 HydrophobicContact CD1-CD2 3.92Å; L235-L250 HydrophobicContact CD1-CG 3.99Å; L235-P292 HydrophobicContact CD2-CB 3.74Å; L235-P292 HydrophobicContact CD2-CG 4.19Å |
| 236 | Y | 98.3 | Very high | 97.4 | Very high | 37 Ų | 37 | 26 Ų | 26 | 15% | 0.145 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -57.2 | -44.6 | 177.7 | 176.5 | -97.2 | 0 | 0 | 0 | 113 | Q179 E180 V183 V232 P233 Y240 | Q179-Y236 PolarHBondContact OE1-OH 2.92Å; E180-Y236 HydrophobicContact CG-CE1 4.12Å; V183-Y236 HydrophobicContact CG1-CD2 4.13Å; V183-Y236 HydrophobicContact CG1-CG 4.08Å; V183-Y236 HydrophobicContact CG2-CD1 4Å; V183-Y236 HydrophobicContact CG2-CE1 4.48Å; V183-Y236 HydrophobicContact CG2-CG 4.21Å; V232-Y236 WeakPolarHBondContact O-CB 3.38Å; V232-Y236 PolarHBondContact O-N 3.02Å; V232-Y236 VanDerWaalsContact O-N 3.14Å; P233-Y236 PolarHBondContact O-N 3.08Å; Y236-Y240 HydrophobicContact CD1-CD2 4.45Å; Y236-Y240 HydrophobicContact CE1-CD2 4.03Å; Y236-Y240 AromaticContact CE1-CE2 3.89Å; Y236-Y240 HydrophobicContact CE1-CE2 3.89Å; Y236-Y240 AromaticContact CZ-CE2 3.85Å; Y236-Y240 VanDerWaalsContact O-CA 3.26Å; Y236-Y240 WeakPolarHBondContact O-CA 3.35Å; Y236-Y240 WeakPolarHBondContact O-CB 3.37Å; Y236-Y240 PolarHBondContact O-N 3.32Å |
| 237 | Y | 97.2 | Very high | 97.4 | Very high | 13 Ų | 13 | 31.7 Ų | 31.7 | 5% | 0.051 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -80.1 | -35.2 | 176.4 | -64.6 | -68.5 | 0 | 0 | 0 | 113.5 | E180 F184 P233 L235 Y240 L369 Q370 R373 | E180-Y237 WeakPolarHBondContact CG-OH 3.39Å; E180-Y237 PolarHBondContact OE2-OH 2.82Å; F184-Y237 HydrophobicContact CD2-CE2 4.47Å; F184-Y237 AromaticContact CE2-CE2 3.67Å; F184-Y237 HydrophobicContact CE2-CE2 3.67Å; F184-Y237 HydrophobicContact CZ-CE2 4.44Å; P233-Y237 WeakPolarHBondContact O-CD2 3.36Å; P233-Y237 PolarHBondContact O-N 3.15Å; L235-Y237 PolarHBondContact O-N 2.8Å; Y237-Y240 HydrophobicContact CD1-CD2 4.49Å; Y237-L369 HydrophobicContact CD2-CB 4.13Å; Y237-L369 HydrophobicContact CG-CB 4.03Å; Y237-Q370 HydrophobicContact CE1-CB 4.12Å; Y237-Q370 HydrophobicContact CE1-CG 4.16Å; Y237-Q370 HydrophobicContact CE2-CB 4.1Å; Y237-Q370 VanDerWaalsContact OH-CG 3.29Å; Y237-Q370 WeakPolarHBondContact OH-CG 3.42Å; Y237-R373 HydrophobicContact CD1-CB 3.94Å; Y237-R373 HydrophobicContact CD1-CG 4.18Å; Y237-R373 HydrophobicContact CE1-CB 4.2Å; Y237-R373 HydrophobicContact CE1-CG 4.29Å |
| 238 | S | 95.9 | Very high | 97.4 | Very high | 7 Ų | 7 | 35.5 Ų | 35.5 | 5% | 0.049 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -70 | -37.2 | -178.2 | -56.5 | 0 | 0 | 0 | 0 | 112.5 | W234 L235 Y296 Q310 | W234-S238 PolarHBondContact NE1-OG 3.49Å; W234-S238 VanDerWaalsContact O-CB 3.27Å; W234-S238 WeakPolarHBondContact O-CB 3.36Å; W234-S238 PolarHBondContact O-N 3.38Å; W234-S238 PolarHBondContact O-OG 3.02Å; L235-S238 PolarHBondContact O-N 3.47Å; S238-Y296 WeakPolarHBondContact O-CD2 3.28Å; S238-Y296 WeakPolarHBondContact O-CE2 3.12Å; S238-Q310 PolarHBondContact OG-NE2 3.24Å |
| 239 | F | 96.4 | Very high | 97.4 | Very high | 10 Ų | 10 | 35.9 Ų | 35.9 | 4% | 0.044 | 18% | 0.179 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -110.3 | 29.9 | 179.1 | -65.8 | -78.9 | 0 | 0 | 0 | 112 | L235 C241 N242 P245 C246 Y249 P292 H295 | L235-F239 HydrophobicContact CD2-CD2 3.85Å; L235-F239 HydrophobicContact CD2-CE2 3.76Å; L235-F239 PolarHBondContact O-N 3.19Å; F239-C241 VanDerWaalsContact C-N 3.3Å; F239-C241 PolarHBondContact O-N 3.05Å; F239-N242 CarbonylContact O-C 3.32Å; F239-N242 PolarHBondContact O-N 3.48Å; F239-N242 VanDerWaalsContact O-N 3.07Å; F239-N242 VanDerWaalsContact O-O 3.13Å; F239-P245 HydrophobicContact CD1-CB 3.93Å; F239-P245 HydrophobicContact CD1-CG 3.61Å; F239-P245 HydrophobicContact CE1-CB 4Å; F239-P245 HydrophobicContact CE1-CG 4.04Å; F239-P245 HydrophobicContact CG-CG 4.34Å; F239-C246 HydrophobicContact CB-CB 3.64Å; F239-Y249 HydrophobicContact CE1-CE2 4.41Å; F239-Y249 AromaticContact CE2-CD2 3.94Å; F239-Y249 HydrophobicContact CE2-CD2 3.94Å; F239-Y249 HydrophobicContact CE2-CE2 4.2Å; F239-Y249 HydrophobicContact CZ-CD2 4.06Å; F239-Y249 AromaticContact CZ-CE2 3.84Å; F239-Y249 HydrophobicContact CZ-CE2 3.84Å; F239-P292 HydrophobicContact CE2-CB 3.85Å; F239-P292 HydrophobicContact CZ-CB 4.21Å; F239-P292 WeakPolarHBondContact CZ-O 3.42Å; F239-H295 HydrophobicContact CZ-CB 4.24Å |
| 240 | Y | 95.4 | Very high | 97.4 | Very high | 50 Ų | 50 | 37.4 Ų | 37.4 | 20% | 0.196 | 19% | 0.186 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -55.9 | -40.6 | -174.3 | -169.9 | -84.6 | 0 | 0 | 0 | 113.4 | Y236 Y237 R373 | Y236-Y240 HydrophobicContact CD1-CD2 4.45Å; Y236-Y240 HydrophobicContact CE1-CD2 4.03Å; Y236-Y240 AromaticContact CE1-CE2 3.89Å; Y236-Y240 HydrophobicContact CE1-CE2 3.89Å; Y236-Y240 AromaticContact CZ-CE2 3.85Å; Y236-Y240 VanDerWaalsContact O-CA 3.26Å; Y236-Y240 WeakPolarHBondContact O-CA 3.35Å; Y236-Y240 WeakPolarHBondContact O-CB 3.37Å; Y236-Y240 PolarHBondContact O-N 3.32Å; Y237-Y240 HydrophobicContact CD1-CD2 4.49Å; Y240-R373 HydrophobicContact CD2-CG 4.28Å; Y240-R373 HydrophobicContact CE2-CG 4Å |
| 241 | C | 94.4 | Very high | 97.4 | Very high | 25 Ų | 25 | 42.2 Ų | 42.2 | 17% | 0.169 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.5 | -12.1 | 178.8 | -62.9 | 0 | 0 | 0 | 0 | 113.9 | F239 P243 C380 D384 | F239-C241 VanDerWaalsContact C-N 3.3Å; F239-C241 PolarHBondContact O-N 3.05Å; C241-P243 WeakPolarHBondContact O-CD 3.4Å; C241-C380 WeakPolarHBondContact CA-SG 3.24Å; C241-C380 HydrophobicContact CB-CB 3.69Å; C241-C380 WeakPolarHBondContact CB-SG 3.35Å; C241-C380 WeakPolarHBondContact SG-CB 3.36Å; C241-C380 CovalentContact SG-SG 2.03Å; C241-C380 PolarHBondContact SG-SG 3.24Å; C241-D384 HydrophobicContact CB-CB 4.14Å; C241-D384 WeakPolarHBondContact CB-O 3.45Å |
| 242 | N | 95.1 | Very high | 97.4 | Very high | 48 Ų | 48 | 44.7 Ų | 44.7 | 26% | 0.257 | 23% | 0.226 | S | C | . | . | trans | -123.7 | 83.1 | -177.1 | -161.8 | -23.4 | 0 | 0 | 0 | 110.2 | F239 Q244 P245 | F239-N242 CarbonylContact O-C 3.32Å; F239-N242 PolarHBondContact O-N 3.48Å; F239-N242 VanDerWaalsContact O-N 3.07Å; F239-N242 VanDerWaalsContact O-O 3.13Å; N242-Q244 PolarHBondContact O-N 2.88Å; N242-P245 HydrophobicContact CB-CG 4.11Å; N242-P245 VanDerWaalsContact O-CD 3.25Å; N242-P245 WeakPolarHBondContact O-CD 3.19Å; N242-P245 VanDerWaalsContact O-CG 3.3Å; N242-P245 WeakPolarHBondContact O-CG 3.48Å; N242-P245 WeakPolarHBondContact OD1-CD 3.22Å | ||
| 243 | P | 94.5 | Very high | 97.4 | Very high | 76 Ų | 76 | 43.7 Ų | 43.7 | 49% | 0.494 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -70.1 | -27.8 | -166.9 | 25.7 | -34.7 | 0 | 0 | 0 | 114.1 | C241 C246 F247 | C241-P243 WeakPolarHBondContact O-CD 3.4Å; P243-C246 VanDerWaalsContact O-CB 3.3Å; P243-C246 WeakPolarHBondContact O-CB 3.33Å; P243-C246 PolarHBondContact O-N 2.91Å; P243-F247 HydrophobicContact CB-CD2 4.34Å; P243-F247 HydrophobicContact CB-CE2 4.11Å; P243-F247 WeakPolarHBondContact O-CD2 3.24Å; P243-F247 PolarHBondContact O-N 3.49Å |
| 244 | Q | 97.2 | Very high | 97.4 | Very high | 142 Ų | 142 | 46.1 Ų | 46.1 | 66% | 0.664 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -61.3 | -54.4 | -177.5 | -175.8 | -178.1 | -48.4 | 0 | 0 | 113.4 | N242 C246 F247 I248 | N242-Q244 PolarHBondContact O-N 2.88Å; Q244-C246 VanDerWaalsContact C-N 3.27Å; Q244-C246 PolarHBondContact O-N 3.29Å; Q244-F247 PolarHBondContact O-N 3.44Å; Q244-I248 HydrophobicContact CG-CD1 3.88Å; Q244-I248 WeakPolarHBondContact O-CG1 3.31Å; Q244-I248 PolarHBondContact O-N 2.98Å |
| 245 | P | 97.5 | Very high | 97.4 | Very high | 8 Ų | 8 | 49.8 Ų | 49.8 | 5% | 0.052 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.9 | -33.9 | 173.8 | 23.9 | -33.2 | 0 | 0 | 0 | 112.2 | F239 N242 F247 I248 Y249 | F239-P245 HydrophobicContact CD1-CB 3.93Å; F239-P245 HydrophobicContact CD1-CG 3.61Å; F239-P245 HydrophobicContact CE1-CB 4Å; F239-P245 HydrophobicContact CE1-CG 4.04Å; F239-P245 HydrophobicContact CG-CG 4.34Å; N242-P245 HydrophobicContact CB-CG 4.11Å; N242-P245 VanDerWaalsContact O-CD 3.25Å; N242-P245 WeakPolarHBondContact O-CD 3.19Å; N242-P245 VanDerWaalsContact O-CG 3.3Å; N242-P245 WeakPolarHBondContact O-CG 3.48Å; N242-P245 WeakPolarHBondContact OD1-CD 3.22Å; P245-F247 PolarHBondContact O-N 2.88Å; P245-I248 PolarHBondContact O-N 3.43Å; P245-Y249 HydrophobicContact CB-CD2 4.13Å; P245-Y249 HydrophobicContact CB-CE2 3.9Å; P245-Y249 WeakPolarHBondContact O-CB 3.25Å; P245-Y249 WeakPolarHBondContact O-CD2 3.3Å; P245-Y249 PolarHBondContact O-N 3.19Å |
| 246 | C | 97.6 | Very high | 97.4 | Very high | 14 Ų | 14 | 53.3 Ų | 53.3 | 10% | 0.095 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -55.3 | -54.3 | 174 | -164.1 | 0 | 0 | 0 | 0 | 111.3 | F239 P243 Q244 I248 Y249 L250 | F239-C246 HydrophobicContact CB-CB 3.64Å; P243-C246 VanDerWaalsContact O-CB 3.3Å; P243-C246 WeakPolarHBondContact O-CB 3.33Å; P243-C246 PolarHBondContact O-N 2.91Å; Q244-C246 VanDerWaalsContact C-N 3.27Å; Q244-C246 PolarHBondContact O-N 3.29Å; C246-I248 PolarHBondContact O-N 3.21Å; C246-Y249 PolarHBondContact O-N 3.13Å; C246-L250 WeakPolarHBondContact O-CB 3.47Å; C246-L250 VanDerWaalsContact O-CG 3.23Å; C246-L250 WeakPolarHBondContact O-CG 3.28Å; C246-L250 PolarHBondContact O-N 3.34Å |
| 247 | F | 97.8 | Very high | 97.4 | Very high | 135 Ų | 135 | 51.6 Ų | 51.6 | 59% | 0.592 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -63 | -40.5 | 177.4 | -72.7 | -61.8 | 0 | 0 | 0 | 113 | P243 Q244 P245 L250 I251 | P243-F247 HydrophobicContact CB-CD2 4.34Å; P243-F247 HydrophobicContact CB-CE2 4.11Å; P243-F247 WeakPolarHBondContact O-CD2 3.24Å; P243-F247 PolarHBondContact O-N 3.49Å; Q244-F247 PolarHBondContact O-N 3.44Å; P245-F247 PolarHBondContact O-N 2.88Å; F247-L250 PolarHBondContact O-N 2.92Å; F247-I251 VanDerWaalsContact O-CG1 3.29Å; F247-I251 WeakPolarHBondContact O-CG1 3.33Å; F247-I251 PolarHBondContact O-N 3.32Å |
| 248 | I | 98.5 | Very high | 97.5 | Very high | 81 Ų | 81 | 55.3 Ų | 55.3 | 42% | 0.415 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.8 | -48 | 178.1 | -69.1 | 167.3 | 0 | 0 | 0 | 110.8 | Q244 P245 C246 I251 V252 | Q244-I248 HydrophobicContact CG-CD1 3.88Å; Q244-I248 WeakPolarHBondContact O-CG1 3.31Å; Q244-I248 PolarHBondContact O-N 2.98Å; P245-I248 PolarHBondContact O-N 3.43Å; C246-I248 PolarHBondContact O-N 3.21Å; I248-I251 PolarHBondContact O-N 3.3Å; I248-V252 WeakPolarHBondContact O-CG2 3.43Å; I248-V252 PolarHBondContact O-N 2.84Å |
| 249 | Y | 98.6 | Very high | 97.6 | Very high | 37 Ų | 37 | 57.2 Ų | 57.2 | 15% | 0.145 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.7 | -33.1 | -179.6 | -67.8 | -53.5 | 0 | 0 | 0 | 112.9 | F239 P245 C246 V252 I253 I291 P292 H295 | F239-Y249 HydrophobicContact CE1-CE2 4.41Å; F239-Y249 AromaticContact CE2-CD2 3.94Å; F239-Y249 HydrophobicContact CE2-CD2 3.94Å; F239-Y249 HydrophobicContact CE2-CE2 4.2Å; F239-Y249 HydrophobicContact CZ-CD2 4.06Å; F239-Y249 AromaticContact CZ-CE2 3.84Å; F239-Y249 HydrophobicContact CZ-CE2 3.84Å; P245-Y249 HydrophobicContact CB-CD2 4.13Å; P245-Y249 HydrophobicContact CB-CE2 3.9Å; P245-Y249 WeakPolarHBondContact O-CB 3.25Å; P245-Y249 WeakPolarHBondContact O-CD2 3.3Å; P245-Y249 PolarHBondContact O-N 3.19Å; C246-Y249 PolarHBondContact O-N 3.13Å; Y249-V252 PolarHBondContact O-N 3.39Å; Y249-I253 WeakPolarHBondContact O-CG2 3.43Å; Y249-I253 PolarHBondContact O-N 3.3Å; Y249-I291 HydrophobicContact CE1-CG2 3.91Å; Y249-P292 HydrophobicContact CD1-CB 4.14Å; Y249-P292 HydrophobicContact CD1-CG 4.22Å; Y249-P292 HydrophobicContact CD2-CB 3.7Å; Y249-P292 HydrophobicContact CE1-CB 4.33Å; Y249-P292 HydrophobicContact CE2-CB 3.89Å; Y249-P292 HydrophobicContact CG-CB 3.85Å; Y249-P292 HydrophobicContact CG-CG 4.23Å; Y249-H295 HydrophobicContact CE2-CB 4.29Å; Y249-H295 AromaticContact CE2-ND1 3.53Å; Y249-H295 AromaticContact CZ-ND1 3.63Å; Y249-H295 PolarHBondContact OH-ND1 3.34Å |
| 250 | L | 98.6 | Very high | 97.7 | Very high | 38 Ų | 38 | 57 Ų | 57 | 20% | 0.199 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 170.6 | -73.3 | 168.6 | 0 | 0 | 0 | 112.2 | V232 L235 C246 F247 I253 C254 | V232-L250 HydrophobicContact CB-CD2 4.39Å; V232-L250 HydrophobicContact CG1-CD2 4.34Å; V232-L250 HydrophobicContact CG2-CD2 4.17Å; L235-L250 HydrophobicContact CD1-CD2 3.92Å; L235-L250 HydrophobicContact CD1-CG 3.99Å; C246-L250 WeakPolarHBondContact O-CB 3.47Å; C246-L250 VanDerWaalsContact O-CG 3.23Å; C246-L250 WeakPolarHBondContact O-CG 3.28Å; C246-L250 PolarHBondContact O-N 3.34Å; F247-L250 PolarHBondContact O-N 2.92Å; L250-I253 WeakPolarHBondContact O-CG2 3.21Å; L250-C254 WeakPolarHBondContact O-CB 3Å; L250-C254 PolarHBondContact O-N 3.49Å; L250-C254 VanDerWaalsContact O-N 3.16Å; L250-C254 PolarHBondContact O-SG 2.87Å |
| 251 | I | 98.7 | Very high | 97.8 | Very high | 110 Ų | 110 | 56.4 Ų | 56.4 | 56% | 0.564 | 31% | 0.308 | S | S | * | . | H | α-helix | trans | -64.3 | -46.3 | 174.4 | -69.2 | 164 | 0 | 0 | 0 | 110.4 | F247 I248 C254 V255 | F247-I251 VanDerWaalsContact O-CG1 3.29Å; F247-I251 WeakPolarHBondContact O-CG1 3.33Å; F247-I251 PolarHBondContact O-N 3.32Å; I248-I251 PolarHBondContact O-N 3.3Å; I251-C254 PolarHBondContact O-N 2.89Å; I251-V255 HydrophobicContact CG2-CG2 4.4Å; I251-V255 WeakPolarHBondContact O-CG2 3.18Å; I251-V255 PolarHBondContact O-N 2.98Å |
| 252 | V | 98.6 | Very high | 98 | Very high | 68 Ų | 68 | 60.7 Ų | 60.7 | 41% | 0.412 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -61.4 | -47.8 | -179.1 | 169.7 | 0 | 0 | 0 | 0 | 111.9 | I248 Y249 C254 V255 L256 | I248-V252 WeakPolarHBondContact O-CG2 3.43Å; I248-V252 PolarHBondContact O-N 2.84Å; Y249-V252 PolarHBondContact O-N 3.39Å; V252-C254 VanDerWaalsContact C-N 3.32Å; V252-C254 PolarHBondContact O-N 2.92Å; V252-V255 PolarHBondContact O-N 3.48Å; V252-L256 HydrophobicContact CG1-CD1 3.81Å; V252-L256 HydrophobicContact CG1-CG 4.34Å; V252-L256 WeakPolarHBondContact O-CB 3.36Å; V252-L256 WeakPolarHBondContact O-CG 3.33Å; V252-L256 PolarHBondContact O-N 3.11Å |
| 253 | I | 98.7 | Very high | 98.2 | Very high | 4 Ų | 4 | 61.4 Ų | 61.4 | 2% | 0.021 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -67.1 | -33.6 | 179.5 | -166.3 | 64.2 | 0 | 0 | 0 | 112.1 | I227 F231 Y249 L250 G257 L285 | I227-I253 HydrophobicContact CG2-CD1 4.32Å; F231-I253 HydrophobicContact CB-CG1 4.16Å; F231-I253 HydrophobicContact CB-CG2 3.99Å; F231-I253 HydrophobicContact CD1-CB 3.9Å; F231-I253 HydrophobicContact CD1-CD1 3.98Å; F231-I253 HydrophobicContact CD1-CG1 3.69Å; F231-I253 HydrophobicContact CD1-CG2 4.18Å; F231-I253 HydrophobicContact CD2-CD1 4.36Å; F231-I253 HydrophobicContact CD2-CG1 4.19Å; F231-I253 HydrophobicContact CE1-CB 4.38Å; F231-I253 HydrophobicContact CE1-CD1 3.76Å; F231-I253 HydrophobicContact CE1-CG1 4.03Å; F231-I253 HydrophobicContact CE2-CD1 4.18Å; F231-I253 HydrophobicContact CE2-CG1 4.49Å; F231-I253 HydrophobicContact CG-CB 4.32Å; F231-I253 HydrophobicContact CG-CD1 4.27Å; F231-I253 HydrophobicContact CG-CG1 3.77Å; F231-I253 HydrophobicContact CG-CG2 4.34Å; F231-I253 HydrophobicContact CZ-CD1 3.86Å; F231-I253 HydrophobicContact CZ-CG1 4.41Å; Y249-I253 WeakPolarHBondContact O-CG2 3.43Å; Y249-I253 PolarHBondContact O-N 3.3Å; L250-I253 WeakPolarHBondContact O-CG2 3.21Å; I253-G257 PolarHBondContact O-N 3.04Å; I253-L285 HydrophobicContact CD1-CD1 3.75Å; I253-L285 HydrophobicContact CD1-CG 4.3Å |
| 254 | C | 98.6 | Very high | 98.3 | Very high | 52 Ų | 52 | 57.9 Ų | 57.9 | 35% | 0.351 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65.5 | -44.2 | 173.1 | -74.7 | 0 | 0 | 0 | 0 | 112.2 | M228 L250 I251 V252 G257 I258 | M228-C254 HydrophobicContact CE-CB 4.45Å; L250-C254 WeakPolarHBondContact O-CB 3Å; L250-C254 PolarHBondContact O-N 3.49Å; L250-C254 VanDerWaalsContact O-N 3.16Å; L250-C254 PolarHBondContact O-SG 2.87Å; I251-C254 PolarHBondContact O-N 2.89Å; V252-C254 VanDerWaalsContact C-N 3.32Å; V252-C254 PolarHBondContact O-N 2.92Å; C254-G257 PolarHBondContact O-N 3.5Å; C254-I258 WeakPolarHBondContact O-CB 3.26Å; C254-I258 WeakPolarHBondContact O-CD1 3.45Å; C254-I258 WeakPolarHBondContact O-CG1 3.41Å; C254-I258 PolarHBondContact O-N 3.34Å |
| 255 | V | 98.7 | Very high | 98.2 | Very high | 90 Ų | 90 | 55 Ų | 55 | 55% | 0.545 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -63.8 | -45.5 | 176.7 | 170.4 | 0 | 0 | 0 | 0 | 111.3 | I251 V252 A259 | I251-V255 HydrophobicContact CG2-CG2 4.4Å; I251-V255 WeakPolarHBondContact O-CG2 3.18Å; I251-V255 PolarHBondContact O-N 2.98Å; V252-V255 PolarHBondContact O-N 3.48Å; V255-A259 WeakPolarHBondContact O-CB 3.42Å; V255-A259 PolarHBondContact O-N 3.49Å |
| 256 | L | 98.7 | Very high | 98.1 | Very high | 75 Ų | 75 | 61 Ų | 61 | 39% | 0.393 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -65.5 | -40.1 | 177.7 | -67.6 | 173.8 | 0 | 0 | 0 | 112.2 | V252 A259 A260 L285 | V252-L256 HydrophobicContact CG1-CD1 3.81Å; V252-L256 HydrophobicContact CG1-CG 4.34Å; V252-L256 WeakPolarHBondContact O-CB 3.36Å; V252-L256 WeakPolarHBondContact O-CG 3.33Å; V252-L256 PolarHBondContact O-N 3.11Å; L256-A259 PolarHBondContact O-N 3Å; L256-A260 PolarHBondContact O-N 2.84Å; L256-L285 HydrophobicContact CB-CD1 3.47Å; L256-L285 VanDerWaalsContact CB-CD1 3.47Å |
| 257 | G | 98.6 | Very high | 97.9 | Very high | 0 Ų | 0 | 63.5 Ų | 63.5 | 0% | 0 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -68.5 | -42.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | I253 C254 A259 A260 I261 | I253-G257 PolarHBondContact O-N 3.04Å; C254-G257 PolarHBondContact O-N 3.5Å; G257-A259 VanDerWaalsContact C-N 3.33Å; G257-A259 PolarHBondContact O-N 2.9Å; G257-A260 PolarHBondContact O-N 3.49Å; G257-I261 WeakPolarHBondContact O-CG1 3.3Å; G257-I261 PolarHBondContact O-N 3.44Å |
| 258 | I | 98.7 | Very high | 97.7 | Very high | 91 Ų | 91 | 61.1 Ų | 61.1 | 47% | 0.467 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 172.3 | -70.4 | 165.5 | 0 | 0 | 0 | 110.6 | C254 A260 I261 I262 | C254-I258 WeakPolarHBondContact O-CB 3.26Å; C254-I258 WeakPolarHBondContact O-CD1 3.45Å; C254-I258 WeakPolarHBondContact O-CG1 3.41Å; C254-I258 PolarHBondContact O-N 3.34Å; I258-A260 PolarHBondContact O-N 3.48Å; I258-I261 PolarHBondContact O-N 3.07Å; I258-I262 HydrophobicContact CG2-CD1 3.85Å; I258-I262 HydrophobicContact CG2-CG1 4.48Å; I258-I262 VanDerWaalsContact O-CG1 3.31Å; I258-I262 WeakPolarHBondContact O-CG1 3.49Å; I258-I262 PolarHBondContact O-N 3.47Å |
| 259 | A | 98.6 | Very high | 97.4 | Very high | 47 Ų | 47 | 57.3 Ų | 57.3 | 39% | 0.388 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.7 | -41.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V255 L256 G257 I262 V263 | V255-A259 WeakPolarHBondContact O-CB 3.42Å; V255-A259 PolarHBondContact O-N 3.49Å; L256-A259 PolarHBondContact O-N 3Å; G257-A259 VanDerWaalsContact C-N 3.33Å; G257-A259 PolarHBondContact O-N 2.9Å; A259-I262 PolarHBondContact O-N 3.37Å; A259-V263 WeakPolarHBondContact O-CG2 3.27Å; A259-V263 PolarHBondContact O-N 3.26Å |
| 260 | A | 98.5 | Very high | 97.1 | Very high | 5 Ų | 5 | 57 Ų | 57 | 4% | 0.041 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -64.5 | -38.3 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | A224 L256 G257 I258 S264 V281 F282 L285 | A224-A260 HydrophobicContact CB-CB 4.36Å; L256-A260 PolarHBondContact O-N 2.84Å; G257-A260 PolarHBondContact O-N 3.49Å; I258-A260 PolarHBondContact O-N 3.48Å; A260-S264 WeakPolarHBondContact O-CB 3.44Å; A260-S264 PolarHBondContact O-N 2.95Å; A260-S264 PolarHBondContact O-OG 2.7Å; A260-V281 HydrophobicContact CB-CG1 3.98Å; A260-F282 HydrophobicContact CB-CE1 4.37Å; A260-L285 HydrophobicContact CB-CD2 4.04Å |
| 261 | I | 98.5 | Very high | 96.7 | Very high | 39 Ų | 39 | 56.9 Ų | 56.9 | 20% | 0.2 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.2 | -44 | 173 | -69.3 | 166.4 | 0 | 0 | 0 | 110.6 | A224 L225 M228 G257 I258 S264 Q265 | A224-I261 HydrophobicContact CB-CD1 4.14Å; A224-I261 HydrophobicContact CB-CG1 3.65Å; L225-I261 HydrophobicContact CD2-CD1 4.17Å; L225-I261 HydrophobicContact CG-CD1 4.32Å; M228-I261 HydrophobicContact SD-CD1 4.44Å; G257-I261 WeakPolarHBondContact O-CG1 3.3Å; G257-I261 PolarHBondContact O-N 3.44Å; I258-I261 PolarHBondContact O-N 3.07Å; I261-S264 WeakPolarHBondContact O-CB 3.21Å; I261-S264 PolarHBondContact O-N 3.47Å; I261-Q265 WeakPolarHBondContact O-CG 3.42Å; I261-Q265 PolarHBondContact O-N 3.13Å; I261-Q265 PolarHBondContact O-NE2 3.4Å |
| 262 | I | 98.3 | Very high | 96.3 | Very high | 115 Ų | 115 | 54 Ų | 54 | 59% | 0.59 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -63.5 | -47 | 177.7 | -69.5 | 165.6 | 0 | 0 | 0 | 111 | I258 A259 S264 Q265 | I258-I262 HydrophobicContact CG2-CD1 3.85Å; I258-I262 HydrophobicContact CG2-CG1 4.48Å; I258-I262 VanDerWaalsContact O-CG1 3.31Å; I258-I262 WeakPolarHBondContact O-CG1 3.49Å; I258-I262 PolarHBondContact O-N 3.47Å; A259-I262 PolarHBondContact O-N 3.37Å; I262-S264 PolarHBondContact O-N 2.93Å; I262-Q265 WeakPolarHBondContact O-CB 3.48Å; I262-Q265 PolarHBondContact O-N 3.39Å |
| 263 | V | 97.8 | Very high | 96 | Very high | 63 Ų | 63 | 58 Ų | 58 | 38% | 0.382 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -58.6 | -37.4 | 174.4 | 168.9 | 0 | 0 | 0 | 0 | 111.1 | A259 Q265 W266 F269 | A259-V263 WeakPolarHBondContact O-CG2 3.27Å; A259-V263 PolarHBondContact O-N 3.26Å; V263-Q265 PolarHBondContact O-N 3.06Å; V263-W266 WeakPolarHBondContact O-CB 3.48Å; V263-W266 PolarHBondContact O-N 2.89Å; V263-W266 VanDerWaalsContact O-N 3.15Å; V263-F269 HydrophobicContact CG1-CD2 3.73Å; V263-F269 HydrophobicContact CG1-CE2 3.68Å; V263-F269 HydrophobicContact CG1-CG 4.33Å; V263-F269 HydrophobicContact CG1-CZ 4.22Å |
| 264 | S | 96.8 | Very high | 95.9 | Very high | 2 Ų | 2 | 61.3 Ų | 61.3 | 1% | 0.014 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -65.2 | -16.8 | 177.1 | -59.5 | 0 | 0 | 0 | 0 | 114.1 | A260 I261 I262 W266 | A260-S264 WeakPolarHBondContact O-CB 3.44Å; A260-S264 PolarHBondContact O-N 2.95Å; A260-S264 PolarHBondContact O-OG 2.7Å; I261-S264 WeakPolarHBondContact O-CB 3.21Å; I261-S264 PolarHBondContact O-N 3.47Å; I262-S264 PolarHBondContact O-N 2.93Å; S264-W266 VanDerWaalsContact C-N 3.34Å |
| 265 | Q | 96 | Very high | 95.7 | Very high | 82 Ų | 82 | 59.4 Ų | 59.4 | 38% | 0.383 | 31% | 0.31 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.7 | -15.1 | 175.7 | -51.4 | -45.2 | -57.2 | 0 | 0 | 113.5 | K217 S221 I261 I262 V263 D267 | K217-Q265 VanDerWaalsContact CE-O 3.31Å; K217-Q265 WeakPolarHBondContact CE-O 3.22Å; K217-Q265 PolarHBondContact NZ-O 3.04Å; S221-Q265 PolarHBondContact OG-NE2 3.5Å; I261-Q265 WeakPolarHBondContact O-CG 3.42Å; I261-Q265 PolarHBondContact O-N 3.13Å; I261-Q265 PolarHBondContact O-NE2 3.4Å; I262-Q265 WeakPolarHBondContact O-CB 3.48Å; I262-Q265 PolarHBondContact O-N 3.39Å; V263-Q265 PolarHBondContact O-N 3.06Å; Q265-D267 PolarHBondContact O-N 3.39Å |
| 266 | W | 95.8 | Very high | 95.5 | Very high | 133 Ų | 133 | 57.5 Ų | 57.5 | 50% | 0.504 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -75.8 | 122 | -178.1 | -177.3 | 41.5 | 0 | 0 | 0 | 111 | V263 S264 M268 F269 Y274 | V263-W266 WeakPolarHBondContact O-CB 3.48Å; V263-W266 PolarHBondContact O-N 2.89Å; V263-W266 VanDerWaalsContact O-N 3.15Å; S264-W266 VanDerWaalsContact C-N 3.34Å; W266-M268 HydrophobicContact CD2-CB 3.81Å; W266-M268 HydrophobicContact CD2-CG 4.34Å; W266-M268 HydrophobicContact CE3-CB 4.06Å; W266-M268 HydrophobicContact CG-CB 4.48Å; W266-M268 HydrophobicContact CH2-CB 3.87Å; W266-M268 HydrophobicContact CH2-CG 4.28Å; W266-M268 HydrophobicContact CZ2-CB 3.6Å; W266-M268 HydrophobicContact CZ2-CG 3.59Å; W266-M268 HydrophobicContact CZ3-CB 4.08Å; W266-M268 PolarHBondContact O-N 3.14Å; W266-M268 VanDerWaalsContact O-N 3.13Å; W266-F269 HydrophobicContact CE3-CB 4.42Å; W266-F269 WeakPolarHBondContact O-CB 3.19Å; W266-F269 PolarHBondContact O-N 3.42Å; W266-Y274 AromaticContact CH2-CE1 3.96Å; W266-Y274 HydrophobicContact CH2-CE1 3.96Å; W266-Y274 HydrophobicContact CZ3-CD1 4.36Å; W266-Y274 AromaticContact CZ3-CE1 3.72Å; W266-Y274 HydrophobicContact CZ3-CE1 3.72Å |
| 267 | D | 92.5 | Very high | 95.4 | Very high | 67 Ų | 67 | 57.2 Ų | 57.2 | 36% | 0.358 | 31% | 0.31 | S | S | . | . | G | 310 helix | trans | -60 | -30 | -172.3 | -64.5 | -72.4 | 0 | 0 | 0 | 114 | R213 K217 Q265 F269 A270 | R213-D267 IonicContact CZ-OD1 3.8Å; R213-D267 IonicContact NE-OD1 2.73Å; R213-D267 PolarHBondContact NE-OD1 3.23Å; R213-D267 VanDerWaalsContact NE-OD1 3.08Å; R213-D267 IonicContact NH2-OD1 2.83Å; R213-D267 PolarHBondContact NH2-OD1 2.87Å; R213-D267 IonicContact NH2-OD2 3.38Å; R213-D267 PolarHBondContact NH2-OD2 3.33Å; K217-D267 WeakPolarHBondContact CE-OD1 3.4Å; K217-D267 IonicContact NZ-OD1 3.65Å; K217-D267 PolarHBondContact NZ-OD1 3.39Å; K217-D267 IonicContact NZ-OD2 3.67Å; Q265-D267 PolarHBondContact O-N 3.39Å; D267-F269 VanDerWaalsContact C-N 3.25Å; D267-F269 PolarHBondContact O-N 2.74Å; D267-A270 PolarHBondContact O-N 3.07Å |
| 268 | M | 93 | Very high | 95.3 | Very high | 85 Ų | 85 | 57.4 Ų | 57.4 | 42% | 0.419 | 31% | 0.311 | S | S | . | . | G | 310 helix | trans | -63.5 | -30.7 | 175 | -62.6 | -58.7 | -60.9 | 0 | 0 | 112.7 | W266 A270 T271 Y274 | W266-M268 HydrophobicContact CD2-CB 3.81Å; W266-M268 HydrophobicContact CD2-CG 4.34Å; W266-M268 HydrophobicContact CE3-CB 4.06Å; W266-M268 HydrophobicContact CG-CB 4.48Å; W266-M268 HydrophobicContact CH2-CB 3.87Å; W266-M268 HydrophobicContact CH2-CG 4.28Å; W266-M268 HydrophobicContact CZ2-CB 3.6Å; W266-M268 HydrophobicContact CZ2-CG 3.59Å; W266-M268 HydrophobicContact CZ3-CB 4.08Å; W266-M268 PolarHBondContact O-N 3.14Å; W266-M268 VanDerWaalsContact O-N 3.13Å; M268-A270 PolarHBondContact O-N 3.01Å; M268-T271 WeakPolarHBondContact O-CB 3.26Å; M268-T271 PolarHBondContact O-N 3.32Å; M268-T271 PolarHBondContact O-OG1 3.28Å; M268-Y274 HydrophobicContact CB-CE2 4.35Å; M268-Y274 HydrophobicContact CE-CE2 4.13Å; M268-Y274 WeakPolarHBondContact O-CD2 3.41Å |
| 269 | F | 93.6 | Very high | 95.1 | Very high | 1 Ų | 1 | 53.6 Ų | 53.6 | 0% | 0.004 | 29% | 0.293 | C | S | . | . | G | 310 helix | trans | -62.8 | -29.1 | -178.6 | -171.4 | -108.5 | 0 | 0 | 0 | 112.2 | Y220 V263 W266 D267 V277 R278 V281 F282 | Y220-F269 AromaticContact CD2-CD1 3.69Å; Y220-F269 HydrophobicContact CD2-CD1 3.69Å; Y220-F269 AromaticContact CD2-CE1 3.86Å; Y220-F269 HydrophobicContact CD2-CE1 3.86Å; Y220-F269 AromaticContact CE2-CD1 3.98Å; Y220-F269 HydrophobicContact CE2-CD1 3.98Å; Y220-F269 HydrophobicContact CE2-CE1 4.41Å; Y220-F269 HydrophobicContact CG-CE1 4.33Å; V263-F269 HydrophobicContact CG1-CD2 3.73Å; V263-F269 HydrophobicContact CG1-CE2 3.68Å; V263-F269 HydrophobicContact CG1-CG 4.33Å; V263-F269 HydrophobicContact CG1-CZ 4.22Å; W266-F269 HydrophobicContact CE3-CB 4.42Å; W266-F269 WeakPolarHBondContact O-CB 3.19Å; W266-F269 PolarHBondContact O-N 3.42Å; D267-F269 VanDerWaalsContact C-N 3.25Å; D267-F269 PolarHBondContact O-N 2.74Å; F269-V277 HydrophobicContact CE2-CG1 4.41Å; F269-R278 HydrophobicContact CD1-CG 3.96Å; F269-R278 HydrophobicContact CD2-CG 4.13Å; F269-R278 HydrophobicContact CE1-CB 4.41Å; F269-R278 HydrophobicContact CE1-CG 3.74Å; F269-R278 HydrophobicContact CE2-CB 4.39Å; F269-R278 HydrophobicContact CE2-CG 3.89Å; F269-R278 HydrophobicContact CG-CG 4.18Å; F269-R278 HydrophobicContact CZ-CB 4.07Å; F269-R278 HydrophobicContact CZ-CG 3.72Å; F269-R278 VanDerWaalsContact O-CD 3.24Å; F269-R278 WeakPolarHBondContact O-CD 3.28Å; F269-R278 WeakPolarHBondContact O-CG 3.38Å; F269-R278 PolarHBondContact O-NH1 3.21Å; F269-V281 HydrophobicContact CE2-CB 4.45Å; F269-V281 HydrophobicContact CE2-CG2 4.16Å; F269-V281 HydrophobicContact CZ-CB 4.38Å; F269-V281 HydrophobicContact CZ-CG1 4.46Å; F269-F282 HydrophobicContact CE1-CE2 4.02Å; F269-F282 HydrophobicContact CE1-CZ 4.19Å; F269-F282 AromaticContact CZ-CE2 3.99Å; F269-F282 HydrophobicContact CZ-CE2 3.99Å; F269-F282 HydrophobicContact CZ-CZ 4.28Å |
| 270 | A | 91.6 | Very high | 95.1 | Very high | 29 Ų | 29 | 53.5 Ų | 53.5 | 24% | 0.24 | 30% | 0.297 | C | S | . | . | G | 310 helix | trans | -76.1 | -19.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114 | Y220 D267 M268 R278 | Y220-A270 HydrophobicContact CE2-CB 4.01Å; D267-A270 PolarHBondContact O-N 3.07Å; M268-A270 PolarHBondContact O-N 3.01Å; A270-R278 VanDerWaalsContact C-NH1 3.25Å; A270-R278 PolarHBondContact O-NH1 3.48Å; A270-R278 VanDerWaalsContact O-NH1 3.11Å |
| 271 | T | 90.8 | Very high | 95.1 | Very high | 36 Ų | 36 | 55.4 Ų | 55.4 | 22% | 0.221 | 31% | 0.308 | C | S | . | . | S | Bend | trans | -66.5 | 150.5 | -174.3 | 65.8 | 0 | 0 | 0 | 0 | 112.6 | M268 Q273 Y274 R278 | M268-T271 WeakPolarHBondContact O-CB 3.26Å; M268-T271 PolarHBondContact O-N 3.32Å; M268-T271 PolarHBondContact O-OG1 3.28Å; T271-Q273 PolarHBondContact O-N 3.25Å; T271-Q273 VanDerWaalsContact O-N 3.15Å; T271-Q273 PolarHBondContact OG1-OE1 2.94Å; T271-Y274 PolarHBondContact O-N 3.28Å; T271-Y274 VanDerWaalsContact OG1-CD2 3.31Å; T271-Y274 WeakPolarHBondContact OG1-CD2 3.4Å; T271-R278 PolarHBondContact O-NH1 2.86Å |
| 272 | P | 90.4 | Very high | 95.1 | Very high | 49 Ų | 49 | 54.5 Ų | 54.5 | 32% | 0.318 | 30% | 0.302 | S | S | . | . | G | 310 helix | trans | -59.6 | -29.3 | -175.5 | -27.3 | 36.7 | 0 | 0 | 0 | 114.3 | K116 Y274 R275 | K116-P272 WeakPolarHBondContact O-CG 3.1Å; P272-Y274 VanDerWaalsContact C-N 3.29Å; P272-Y274 PolarHBondContact O-N 3.05Å; P272-R275 VanDerWaalsContact O-CB 3.27Å; P272-R275 WeakPolarHBondContact O-CB 3.34Å; P272-R275 PolarHBondContact O-N 3.47Å |
| 273 | Q | 92.9 | Very high | 95 | Very high | 154 Ų | 154 | 51 Ų | 51 | 72% | 0.72 | 29% | 0.285 | S | S | * | . | G | 310 helix | trans | -63.5 | -34.5 | 177.1 | -62.3 | 80.2 | -2.2 | 0 | 0 | 111.8 | T271 R275 | T271-Q273 PolarHBondContact O-N 3.25Å; T271-Q273 VanDerWaalsContact O-N 3.15Å; T271-Q273 PolarHBondContact OG1-OE1 2.94Å; Q273-R275 VanDerWaalsContact C-N 3.32Å; Q273-R275 PolarHBondContact O-N 2.67Å |
| 274 | Y | 95.8 | Very high | 95.1 | Very high | 73 Ų | 73 | 50 Ų | 50 | 29% | 0.286 | 29% | 0.287 | S | S | . | . | G | 310 helix | trans | -86.2 | 4.4 | -179.6 | -79.5 | -104.4 | 0 | 0 | 0 | 113.5 | W266 M268 T271 P272 G276 V277 R278 | W266-Y274 AromaticContact CH2-CE1 3.96Å; W266-Y274 HydrophobicContact CH2-CE1 3.96Å; W266-Y274 HydrophobicContact CZ3-CD1 4.36Å; W266-Y274 AromaticContact CZ3-CE1 3.72Å; W266-Y274 HydrophobicContact CZ3-CE1 3.72Å; M268-Y274 HydrophobicContact CB-CE2 4.35Å; M268-Y274 HydrophobicContact CE-CE2 4.13Å; M268-Y274 WeakPolarHBondContact O-CD2 3.41Å; T271-Y274 PolarHBondContact O-N 3.28Å; T271-Y274 VanDerWaalsContact OG1-CD2 3.31Å; T271-Y274 WeakPolarHBondContact OG1-CD2 3.4Å; P272-Y274 VanDerWaalsContact C-N 3.29Å; P272-Y274 PolarHBondContact O-N 3.05Å; Y274-G276 VanDerWaalsContact C-N 3.26Å; Y274-G276 PolarHBondContact O-N 3.31Å; Y274-V277 HydrophobicContact CD1-CB 4.02Å; Y274-V277 HydrophobicContact CD1-CG1 4.29Å; Y274-V277 HydrophobicContact CD1-CG2 3.85Å; Y274-V277 HydrophobicContact CE1-CG2 4.46Å; Y274-V277 HydrophobicContact CG-CG2 4.5Å; Y274-V277 CarbonylContact O-C 3.52Å; Y274-V277 WeakPolarHBondContact O-CA 3.41Å; Y274-V277 WeakPolarHBondContact O-CB 3.41Å; Y274-V277 PolarHBondContact O-N 2.94Å; Y274-R278 PolarHBondContact O-N 2.89Å |
| 275 | R | 94.2 | Very high | 95.1 | Very high | 11 Ų | 11 | 50.3 Ų | 50.3 | 4% | 0.042 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -51.8 | -41.5 | 178.4 | -178.7 | -176.7 | -84.7 | 111 | -19.9 | 113.3 | D117 P272 Q273 R278 A279 Y328 | D117-R275 PolarHBondContact O-NH1 3.19Å; D117-R275 VanDerWaalsContact O-NH1 3.15Å; D117-R275 PolarHBondContact O-NH2 3.27Å; D117-R275 IonicContact OD1-CZ 3.61Å; D117-R275 IonicContact OD1-NH1 3.52Å; D117-R275 IonicContact OD1-NH2 3.11Å; D117-R275 PolarHBondContact OD1-NH2 3.06Å; D117-R275 VanDerWaalsContact OD1-NH2 3.11Å; D117-R275 IonicContact OD2-CZ 3.98Å; D117-R275 IonicContact OD2-NH2 2.64Å; D117-R275 PolarHBondContact OD2-NH2 3.21Å; P272-R275 VanDerWaalsContact O-CB 3.27Å; P272-R275 WeakPolarHBondContact O-CB 3.34Å; P272-R275 PolarHBondContact O-N 3.47Å; Q273-R275 VanDerWaalsContact C-N 3.32Å; Q273-R275 PolarHBondContact O-N 2.67Å; R275-R278 PolarHBondContact O-N 2.83Å; R275-A279 PolarHBondContact O-N 2.63Å; R275-A279 VanDerWaalsContact O-N 3.09Å; R275-Y328 HydrophobicContact CG-CD1 4.17Å; R275-Y328 HydrophobicContact CG-CE1 3.56Å |
| 276 | G | 93.8 | Very high | 95.2 | Very high | 50 Ų | 50 | 47 Ų | 47 | 52% | 0.515 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -67.9 | -33.5 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | Y274 G280 | Y274-G276 VanDerWaalsContact C-N 3.26Å; Y274-G276 PolarHBondContact O-N 3.31Å; G276-G280 PolarHBondContact O-N 3.4Å |
| 277 | V | 97 | Very high | 95.2 | Very high | 70 Ų | 70 | 43.9 Ų | 43.9 | 42% | 0.424 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -70 | -43.3 | 175.1 | -175.6 | 0 | 0 | 0 | 0 | 110.5 | F269 Y274 A279 G280 V281 | F269-V277 HydrophobicContact CE2-CG1 4.41Å; Y274-V277 HydrophobicContact CD1-CB 4.02Å; Y274-V277 HydrophobicContact CD1-CG1 4.29Å; Y274-V277 HydrophobicContact CD1-CG2 3.85Å; Y274-V277 HydrophobicContact CE1-CG2 4.46Å; Y274-V277 HydrophobicContact CG-CG2 4.5Å; Y274-V277 CarbonylContact O-C 3.52Å; Y274-V277 WeakPolarHBondContact O-CA 3.41Å; Y274-V277 WeakPolarHBondContact O-CB 3.41Å; Y274-V277 PolarHBondContact O-N 2.94Å; V277-A279 PolarHBondContact O-N 3.35Å; V277-G280 PolarHBondContact O-N 3.2Å; V277-V281 HydrophobicContact CG1-CG2 4.4Å; V277-V281 WeakPolarHBondContact O-CG2 3.46Å; V277-V281 PolarHBondContact O-N 3.21Å |
| 278 | R | 96.9 | Very high | 95.5 | Very high | 3 Ų | 3 | 42.1 Ų | 42.1 | 1% | 0.011 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -54.8 | -51 | 172.8 | -64 | -163.5 | -71 | -90.4 | 14.6 | 111.2 | D117 Y220 F269 A270 T271 Y274 R275 G280 V281 F282 Y328 | D117-R278 IonicContact OD1-NH2 2.66Å; Y220-R278 VanDerWaalsContact CZ-CD 3.49Å; F269-R278 HydrophobicContact CD1-CG 3.96Å; F269-R278 HydrophobicContact CD2-CG 4.13Å; F269-R278 HydrophobicContact CE1-CB 4.41Å; F269-R278 HydrophobicContact CE1-CG 3.74Å; F269-R278 HydrophobicContact CE2-CB 4.39Å; F269-R278 HydrophobicContact CE2-CG 3.89Å; F269-R278 HydrophobicContact CG-CG 4.18Å; F269-R278 HydrophobicContact CZ-CB 4.07Å; F269-R278 HydrophobicContact CZ-CG 3.72Å; F269-R278 VanDerWaalsContact O-CD 3.24Å; F269-R278 WeakPolarHBondContact O-CD 3.28Å; F269-R278 WeakPolarHBondContact O-CG 3.38Å; F269-R278 PolarHBondContact O-NH1 3.21Å; A270-R278 VanDerWaalsContact C-NH1 3.25Å; A270-R278 PolarHBondContact O-NH1 3.48Å; A270-R278 VanDerWaalsContact O-NH1 3.11Å; T271-R278 PolarHBondContact O-NH1 2.86Å; Y274-R278 PolarHBondContact O-N 2.89Å; R275-R278 PolarHBondContact O-N 2.83Å; R278-G280 PolarHBondContact O-N 3.27Å; R278-V281 PolarHBondContact O-N 2.7Å; R278-F282 WeakPolarHBondContact O-CD2 3.41Å; R278-F282 PolarHBondContact O-N 2.93Å; R278-F282 VanDerWaalsContact O-N 3.16Å; R278-Y328 PolarHBondContact NE-OH 2.89Å; R278-Y328 PolarHBondContact NH2-OH 3.32Å; R278-Y328 VanDerWaalsContact NH2-OH 3.13Å |
| 279 | A | 95.3 | Very high | 95.7 | Very high | 12 Ų | 12 | 38.4 Ų | 38.4 | 10% | 0.099 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -58.5 | -45.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | R275 V277 L283 Y328 A329 | R275-A279 PolarHBondContact O-N 2.63Å; R275-A279 VanDerWaalsContact O-N 3.09Å; V277-A279 PolarHBondContact O-N 3.35Å; A279-L283 WeakPolarHBondContact O-CB 3.49Å; A279-L283 PolarHBondContact O-N 3.04Å; A279-Y328 HydrophobicContact CB-CD1 4.21Å; A279-A329 HydrophobicContact CB-CB 3.88Å |
| 280 | G | 97.6 | Very high | 95.9 | Very high | 45 Ų | 45 | 42.8 Ų | 42.8 | 46% | 0.464 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | G276 V277 R278 G284 | G276-G280 PolarHBondContact O-N 3.4Å; V277-G280 PolarHBondContact O-N 3.2Å; R278-G280 PolarHBondContact O-N 3.27Å; G280-G284 PolarHBondContact O-N 2.91Å |
| 281 | V | 98.3 | Very high | 96.2 | Very high | 45 Ų | 45 | 46 Ų | 46 | 27% | 0.273 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -64.3 | -51.7 | 178.2 | 167.9 | 0 | 0 | 0 | 0 | 111.2 | A260 F269 V277 R278 G284 L285 | A260-V281 HydrophobicContact CB-CG1 3.98Å; F269-V281 HydrophobicContact CE2-CB 4.45Å; F269-V281 HydrophobicContact CE2-CG2 4.16Å; F269-V281 HydrophobicContact CZ-CB 4.38Å; F269-V281 HydrophobicContact CZ-CG1 4.46Å; V277-V281 HydrophobicContact CG1-CG2 4.4Å; V277-V281 WeakPolarHBondContact O-CG2 3.46Å; V277-V281 PolarHBondContact O-N 3.21Å; R278-V281 PolarHBondContact O-N 2.7Å; V281-G284 PolarHBondContact O-N 3.47Å; V281-L285 WeakPolarHBondContact O-CB 3.36Å; V281-L285 PolarHBondContact O-N 3.19Å |
| 282 | F | 98.1 | Very high | 96.5 | Very high | 19 Ų | 19 | 44.5 Ų | 44.5 | 8% | 0.083 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -74.8 | -34.9 | -177.2 | -63.5 | -60.1 | 0 | 0 | 0 | 113.1 | Y220 I223 A224 I227 A260 F269 R278 L285 G286 | Y220-F282 WeakPolarHBondContact O-CE1 3.49Å; Y220-F282 VanDerWaalsContact O-CZ 3.27Å; Y220-F282 WeakPolarHBondContact O-CZ 3.33Å; I223-F282 HydrophobicContact CB-CD1 4.02Å; I223-F282 HydrophobicContact CB-CE1 4.07Å; I223-F282 HydrophobicContact CB-CG 4.33Å; I223-F282 HydrophobicContact CB-CZ 4.41Å; I223-F282 HydrophobicContact CD1-CD2 4.17Å; I223-F282 HydrophobicContact CD1-CE2 4.16Å; I223-F282 HydrophobicContact CG2-CB 3.93Å; I223-F282 HydrophobicContact CG2-CD1 3.6Å; I223-F282 HydrophobicContact CG2-CD2 4.29Å; I223-F282 HydrophobicContact CG2-CE1 4.18Å; I223-F282 HydrophobicContact CG2-CG 3.68Å; A224-F282 HydrophobicContact CB-CE1 4.27Å; I227-F282 HydrophobicContact CD1-CB 4.46Å; I227-F282 HydrophobicContact CD1-CD1 4.47Å; A260-F282 HydrophobicContact CB-CE1 4.37Å; F269-F282 HydrophobicContact CE1-CE2 4.02Å; F269-F282 HydrophobicContact CE1-CZ 4.19Å; F269-F282 AromaticContact CZ-CE2 3.99Å; F269-F282 HydrophobicContact CZ-CE2 3.99Å; F269-F282 HydrophobicContact CZ-CZ 4.28Å; R278-F282 WeakPolarHBondContact O-CD2 3.41Å; R278-F282 PolarHBondContact O-N 2.93Å; R278-F282 VanDerWaalsContact O-N 3.16Å; F282-L285 PolarHBondContact O-N 3.32Å; F282-G286 PolarHBondContact O-N 2.91Å |
| 283 | L | 97.9 | Very high | 96.8 | Very high | 41 Ų | 41 | 43.3 Ų | 43.3 | 22% | 0.215 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.5 | -41.7 | 172 | -176.8 | 62.8 | 0 | 0 | 0 | 111 | A279 G286 L287 I322 A325 | A279-L283 WeakPolarHBondContact O-CB 3.49Å; A279-L283 PolarHBondContact O-N 3.04Å; L283-G286 PolarHBondContact O-N 3.3Å; L283-L287 HydrophobicContact CD1-CD1 3.87Å; L283-L287 HydrophobicContact CD1-CG 3.97Å; L283-L287 HydrophobicContact CD2-CD1 4.39Å; L283-L287 HydrophobicContact CG-CD1 3.79Å; L283-L287 HydrophobicContact CG-CG 4.23Å; L283-L287 VanDerWaalsContact O-CB 3.3Å; L283-L287 WeakPolarHBondContact O-CB 3.37Å; L283-L287 VanDerWaalsContact O-CG 3.3Å; L283-L287 WeakPolarHBondContact O-CG 3.38Å; L283-L287 PolarHBondContact O-N 2.85Å; L283-I322 HydrophobicContact CD1-CG1 4.1Å; L283-A325 HydrophobicContact CB-CB 4.23Å; L283-A325 HydrophobicContact CD1-CB 4.19Å; L283-A325 HydrophobicContact CD2-CB 4.08Å; L283-A325 HydrophobicContact CG-CB 4.4Å |
| 284 | G | 98.2 | Very high | 96.9 | Very high | 42 Ų | 42 | 40.3 Ų | 40.3 | 43% | 0.433 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63.3 | -40.3 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | G280 V281 L287 S288 | G280-G284 PolarHBondContact O-N 2.91Å; V281-G284 PolarHBondContact O-N 3.47Å; G284-L287 PolarHBondContact O-N 3.4Å; G284-S288 PolarHBondContact O-N 3.4Å |
| 285 | L | 98.3 | Very high | 97 | Very high | 9 Ų | 9 | 39.8 Ų | 39.8 | 5% | 0.047 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.1 | -45.1 | 175.4 | -174.2 | 64.5 | 0 | 0 | 0 | 111.5 | A224 I227 I253 L256 A260 V281 F282 S288 | A224-L285 HydrophobicContact CB-CD2 4.11Å; I227-L285 HydrophobicContact CB-CD2 4.22Å; I227-L285 HydrophobicContact CB-CG 4.41Å; I227-L285 HydrophobicContact CD1-CB 4.24Å; I227-L285 HydrophobicContact CD1-CD2 3.86Å; I227-L285 HydrophobicContact CD1-CG 4.17Å; I227-L285 HydrophobicContact CG2-CD2 4.24Å; I227-L285 HydrophobicContact CG2-CG 3.89Å; I253-L285 HydrophobicContact CD1-CD1 3.75Å; I253-L285 HydrophobicContact CD1-CG 4.3Å; L256-L285 HydrophobicContact CB-CD1 3.47Å; L256-L285 VanDerWaalsContact CB-CD1 3.47Å; A260-L285 HydrophobicContact CB-CD2 4.04Å; V281-L285 WeakPolarHBondContact O-CB 3.36Å; V281-L285 PolarHBondContact O-N 3.19Å; F282-L285 PolarHBondContact O-N 3.32Å; L285-S288 WeakPolarHBondContact O-CB 3.39Å; L285-S288 PolarHBondContact O-OG 2.89Å |
| 286 | G | 96.8 | Very high | 97 | Very high | 13 Ų | 13 | 39.7 Ų | 39.7 | 13% | 0.134 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -66.2 | -48.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | F282 L283 S288 G289 | F282-G286 PolarHBondContact O-N 2.91Å; L283-G286 PolarHBondContact O-N 3.3Å; G286-S288 PolarHBondContact O-N 2.93Å; G286-G289 PolarHBondContact O-N 3.39Å |
| 287 | L | 97.3 | Very high | 97.1 | Very high | 67 Ų | 67 | 39.1 Ų | 39.1 | 35% | 0.351 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -69.8 | -13.9 | -179.4 | -68 | -179 | 0 | 0 | 0 | 113.7 | L283 G284 G289 I290 I322 | L283-L287 HydrophobicContact CD1-CD1 3.87Å; L283-L287 HydrophobicContact CD1-CG 3.97Å; L283-L287 HydrophobicContact CD2-CD1 4.39Å; L283-L287 HydrophobicContact CG-CD1 3.79Å; L283-L287 HydrophobicContact CG-CG 4.23Å; L283-L287 VanDerWaalsContact O-CB 3.3Å; L283-L287 WeakPolarHBondContact O-CB 3.37Å; L283-L287 VanDerWaalsContact O-CG 3.3Å; L283-L287 WeakPolarHBondContact O-CG 3.38Å; L283-L287 PolarHBondContact O-N 2.85Å; G284-L287 PolarHBondContact O-N 3.4Å; L287-G289 PolarHBondContact O-N 3.49Å; L287-G289 VanDerWaalsContact O-N 3.07Å; L287-I290 WeakPolarHBondContact O-CB 3.21Å; L287-I290 WeakPolarHBondContact O-CG2 3.47Å; L287-I290 PolarHBondContact O-N 3.28Å; L287-I322 HydrophobicContact CD1-CG1 4.43Å |
| 288 | S | 98.1 | Very high | 97 | Very high | 30 Ų | 30 | 42.3 Ų | 42.3 | 21% | 0.21 | 25% | 0.251 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | -23.9 | 171 | 75.6 | 0 | 0 | 0 | 0 | 112.9 | G284 L285 G286 I290 I291 P292 | G284-S288 PolarHBondContact O-N 3.4Å; L285-S288 WeakPolarHBondContact O-CB 3.39Å; L285-S288 PolarHBondContact O-OG 2.89Å; G286-S288 PolarHBondContact O-N 2.93Å; S288-I290 PolarHBondContact O-N 3.49Å; S288-I290 VanDerWaalsContact O-N 3.07Å; S288-I291 PolarHBondContact O-N 3.32Å; S288-I291 VanDerWaalsContact O-N 3.14Å; S288-P292 WeakPolarHBondContact O-CD 3.4Å |
| 289 | G | 96.9 | Very high | 96.7 | Very high | 8 Ų | 8 | 44.9 Ų | 44.9 | 8% | 0.082 | 27% | 0.27 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.9 | -13.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | G286 L287 I291 P292 T293 | G286-G289 PolarHBondContact O-N 3.39Å; L287-G289 PolarHBondContact O-N 3.49Å; L287-G289 VanDerWaalsContact O-N 3.07Å; G289-I291 PolarHBondContact O-N 2.89Å; G289-P292 WeakPolarHBondContact O-CD 3.46Å; G289-P292 WeakPolarHBondContact O-CG 3.43Å; G289-T293 WeakPolarHBondContact O-CB 3.43Å; G289-T293 PolarHBondContact O-N 3.13Å; G289-T293 PolarHBondContact O-OG1 3.12Å |
| 290 | I | 97.1 | Very high | 96.4 | Very high | 93 Ų | 93 | 46.9 Ų | 46.9 | 48% | 0.477 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.4 | -31.9 | 171.8 | -165.1 | 58 | 0 | 0 | 0 | 112.3 | L287 S288 T293 L294 | L287-I290 WeakPolarHBondContact O-CB 3.21Å; L287-I290 WeakPolarHBondContact O-CG2 3.47Å; L287-I290 PolarHBondContact O-N 3.28Å; S288-I290 PolarHBondContact O-N 3.49Å; S288-I290 VanDerWaalsContact O-N 3.07Å; I290-T293 PolarHBondContact O-N 3.05Å; I290-L294 HydrophobicContact CD1-CG 4.34Å; I290-L294 HydrophobicContact CG1-CD1 4.03Å; I290-L294 HydrophobicContact CG1-CG 4.28Å; I290-L294 WeakPolarHBondContact O-CB 3.49Å; I290-L294 VanDerWaalsContact O-CG 3.26Å; I290-L294 WeakPolarHBondContact O-CG 3.35Å; I290-L294 PolarHBondContact O-N 3.34Å |
| 291 | I | 98 | Very high | 96.1 | Very high | 96 Ų | 96 | 46.1 Ų | 46.1 | 49% | 0.492 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -68.8 | -54.5 | -179.1 | -53.7 | -59.5 | 0 | 0 | 0 | 111.8 | Y249 S288 G289 T293 L294 H295 | Y249-I291 HydrophobicContact CE1-CG2 3.91Å; S288-I291 PolarHBondContact O-N 3.32Å; S288-I291 VanDerWaalsContact O-N 3.14Å; G289-I291 PolarHBondContact O-N 2.89Å; I291-T293 VanDerWaalsContact C-N 3.28Å; I291-T293 PolarHBondContact O-N 3.32Å; I291-L294 PolarHBondContact O-N 3.49Å; I291-H295 PolarHBondContact O-N 3.4Å |
| 292 | P | 97.5 | Very high | 95.7 | Very high | 4 Ų | 4 | 50.7 Ų | 50.7 | 3% | 0.026 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -60.5 | -34 | 170.3 | 15.8 | -25.5 | 0 | 0 | 0 | 113.2 | W234 L235 F239 Y249 S288 G289 H295 Y296 | W234-P292 HydrophobicContact CH2-CB 3.99Å; W234-P292 HydrophobicContact CH2-CG 3.86Å; W234-P292 HydrophobicContact CZ3-CB 4.26Å; W234-P292 HydrophobicContact CZ3-CG 3.89Å; L235-P292 HydrophobicContact CD2-CB 3.74Å; L235-P292 HydrophobicContact CD2-CG 4.19Å; F239-P292 HydrophobicContact CE2-CB 3.85Å; F239-P292 HydrophobicContact CZ-CB 4.21Å; F239-P292 WeakPolarHBondContact CZ-O 3.42Å; Y249-P292 HydrophobicContact CD1-CB 4.14Å; Y249-P292 HydrophobicContact CD1-CG 4.22Å; Y249-P292 HydrophobicContact CD2-CB 3.7Å; Y249-P292 HydrophobicContact CE1-CB 4.33Å; Y249-P292 HydrophobicContact CE2-CB 3.89Å; Y249-P292 HydrophobicContact CG-CB 3.85Å; Y249-P292 HydrophobicContact CG-CG 4.23Å; S288-P292 WeakPolarHBondContact O-CD 3.4Å; G289-P292 WeakPolarHBondContact O-CD 3.46Å; G289-P292 WeakPolarHBondContact O-CG 3.43Å; P292-H295 PolarHBondContact O-N 2.95Å; P292-Y296 WeakPolarHBondContact O-CB 3.26Å; P292-Y296 PolarHBondContact O-N 3.16Å |
| 293 | T | 96.3 | Very high | 95.2 | Very high | 24 Ų | 24 | 56.2 Ų | 56.2 | 15% | 0.147 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 175.9 | -57 | 0 | 0 | 0 | 0 | 111.7 | W234 G289 I290 I291 Y296 V297 L314 | W234-T293 WeakPolarHBondContact CH2-OG1 3.31Å; W234-T293 WeakPolarHBondContact CZ2-OG1 3.43Å; G289-T293 WeakPolarHBondContact O-CB 3.43Å; G289-T293 PolarHBondContact O-N 3.13Å; G289-T293 PolarHBondContact O-OG1 3.12Å; I290-T293 PolarHBondContact O-N 3.05Å; I291-T293 VanDerWaalsContact C-N 3.28Å; I291-T293 PolarHBondContact O-N 3.32Å; T293-Y296 PolarHBondContact O-N 3.08Å; T293-V297 WeakPolarHBondContact O-CG2 3.24Å; T293-V297 PolarHBondContact O-N 2.84Å; T293-L314 HydrophobicContact CG2-CD1 3.83Å |
| 294 | L | 96.3 | Very high | 94.6 | Very high | 92 Ų | 92 | 57.4 Ų | 57.4 | 48% | 0.482 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -66 | -41.2 | 177.9 | -74 | 169.9 | 0 | 0 | 0 | 111.7 | I290 I291 V297 I298 | I290-L294 HydrophobicContact CD1-CG 4.34Å; I290-L294 HydrophobicContact CG1-CD1 4.03Å; I290-L294 HydrophobicContact CG1-CG 4.28Å; I290-L294 WeakPolarHBondContact O-CB 3.49Å; I290-L294 VanDerWaalsContact O-CG 3.26Å; I290-L294 WeakPolarHBondContact O-CG 3.35Å; I290-L294 PolarHBondContact O-N 3.34Å; I291-L294 PolarHBondContact O-N 3.49Å; L294-V297 PolarHBondContact O-N 3Å; L294-I298 WeakPolarHBondContact O-CB 3.25Å; L294-I298 WeakPolarHBondContact O-CD1 3.43Å; L294-I298 WeakPolarHBondContact O-CG1 3.34Å; L294-I298 PolarHBondContact O-N 3.23Å |
| 295 | H | 97.1 | Very high | 94 | Very high | 62 Ų | 62 | 55.4 Ų | 55.4 | 29% | 0.287 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -59 | -51.1 | 174 | -168.6 | 161.2 | 0 | 0 | 0 | 110.8 | F239 Y249 I291 P292 V297 I298 S299 | F239-H295 HydrophobicContact CZ-CB 4.24Å; Y249-H295 HydrophobicContact CE2-CB 4.29Å; Y249-H295 AromaticContact CE2-ND1 3.53Å; Y249-H295 AromaticContact CZ-ND1 3.63Å; Y249-H295 PolarHBondContact OH-ND1 3.34Å; I291-H295 PolarHBondContact O-N 3.4Å; P292-H295 PolarHBondContact O-N 2.95Å; H295-V297 PolarHBondContact O-N 2.97Å; H295-I298 PolarHBondContact O-N 3.27Å; H295-I298 VanDerWaalsContact O-N 3.09Å; H295-S299 PolarHBondContact CD2-OG 3.14Å; H295-S299 PolarHBondContact O-N 3.21Å; H295-S299 PolarHBondContact O-OG 3.43Å |
| 296 | Y | 95 | Very high | 93.5 | Very high | 9 Ų | 9 | 57 Ų | 57 | 4% | 0.035 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -54.9 | -47.8 | 177.1 | 178.6 | -100.3 | 0 | 0 | 0 | 112 | S238 P292 T293 I298 S299 E300 A305 Q310 | S238-Y296 WeakPolarHBondContact O-CD2 3.28Å; S238-Y296 WeakPolarHBondContact O-CE2 3.12Å; P292-Y296 WeakPolarHBondContact O-CB 3.26Å; P292-Y296 PolarHBondContact O-N 3.16Å; T293-Y296 PolarHBondContact O-N 3.08Å; Y296-I298 VanDerWaalsContact C-N 3.3Å; Y296-I298 PolarHBondContact O-N 3.01Å; Y296-S299 PolarHBondContact O-N 3.35Å; Y296-E300 HydrophobicContact CD2-CG 3.8Å; Y296-E300 HydrophobicContact CE2-CB 4.24Å; Y296-E300 HydrophobicContact CE2-CG 3.54Å; Y296-E300 HydrophobicContact CG-CG 4.48Å; Y296-E300 VanDerWaalsContact O-CB 3.25Å; Y296-E300 WeakPolarHBondContact O-CB 3.46Å; Y296-E300 PolarHBondContact O-N 3.32Å; Y296-A305 HydrophobicContact CD1-CB 4.21Å; Y296-A305 HydrophobicContact CE1-CB 3.76Å; Y296-Q310 HydrophobicContact CE1-CB 4.45Å; Y296-Q310 HydrophobicContact CE1-CG 4.08Å; Y296-Q310 VanDerWaalsContact CZ-NE2 3.29Å |
| 297 | V | 94.6 | Very high | 92.8 | Very high | 38 Ų | 38 | 61.4 Ų | 61.4 | 23% | 0.23 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.5 | -28.2 | 178.7 | 172.3 | 0 | 0 | 0 | 0 | 113.1 | T293 L294 H295 G301 A305 | T293-V297 WeakPolarHBondContact O-CG2 3.24Å; T293-V297 PolarHBondContact O-N 2.84Å; L294-V297 PolarHBondContact O-N 3Å; H295-V297 PolarHBondContact O-N 2.97Å; V297-G301 CarbonylContact O-C 3.56Å; V297-G301 VanDerWaalsContact O-CA 3.24Å; V297-G301 WeakPolarHBondContact O-CA 3.39Å; V297-G301 PolarHBondContact O-N 3.41Å; V297-A305 HydrophobicContact CG2-CB 3.91Å |
| 298 | I | 95.2 | Very high | 92.1 | Very high | 136 Ų | 136 | 59.5 Ų | 59.5 | 70% | 0.697 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -75.6 | -44.8 | 176.4 | -72 | 164.6 | 0 | 0 | 0 | 111.3 | L294 H295 Y296 | L294-I298 WeakPolarHBondContact O-CB 3.25Å; L294-I298 WeakPolarHBondContact O-CD1 3.43Å; L294-I298 WeakPolarHBondContact O-CG1 3.34Å; L294-I298 PolarHBondContact O-N 3.23Å; H295-I298 PolarHBondContact O-N 3.27Å; H295-I298 VanDerWaalsContact O-N 3.09Å; Y296-I298 VanDerWaalsContact C-N 3.3Å; Y296-I298 PolarHBondContact O-N 3.01Å |
| 299 | S | 91.8 | Very high | 91.4 | Very high | 58 Ų | 58 | 59.1 Ų | 59.1 | 41% | 0.406 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -72.8 | -49.7 | 179.2 | -61.5 | 0 | 0 | 0 | 0 | 112.6 | H295 Y296 | H295-S299 PolarHBondContact CD2-OG 3.14Å; H295-S299 PolarHBondContact O-N 3.21Å; H295-S299 PolarHBondContact O-OG 3.43Å; Y296-S299 PolarHBondContact O-N 3.35Å |
| 300 | E | 89.2 | Confident | 90.8 | Very high | 53 Ų | 53 | 59.1 Ų | 59.1 | 25% | 0.248 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -88 | -13.5 | -171.1 | -64.6 | -92.7 | 107.4 | 0 | 0 | 112.8 | Y296 K304 | Y296-E300 HydrophobicContact CD2-CG 3.8Å; Y296-E300 HydrophobicContact CE2-CB 4.24Å; Y296-E300 HydrophobicContact CE2-CG 3.54Å; Y296-E300 HydrophobicContact CG-CG 4.48Å; Y296-E300 VanDerWaalsContact O-CB 3.25Å; Y296-E300 WeakPolarHBondContact O-CB 3.46Å; Y296-E300 PolarHBondContact O-N 3.32Å; E300-K304 HydrophobicContact CB-CB 4.28Å; E300-K304 HydrophobicContact CB-CD 4.05Å; E300-K304 HydrophobicContact CB-CG 4.45Å; E300-K304 WeakPolarHBondContact O-CB 3.32Å; E300-K304 IonicContact OE1-NZ 2.76Å; E300-K304 PolarHBondContact OE1-NZ 2.98Å; E300-K304 WeakPolarHBondContact OE2-CD 3.25Å; E300-K304 WeakPolarHBondContact OE2-CE 3.43Å; E300-K304 IonicContact OE2-NZ 3Å; E300-K304 PolarHBondContact OE2-NZ 3.49Å |
| 301 | G | 90 | Very high | 90.4 | Very high | 29 Ų | 29 | 56.5 Ų | 56.5 | 30% | 0.299 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | 77.2 | 151 | -175.8 | 0 | 0 | 0 | 0 | 0 | 114 | V297 L303 K304 A305 | V297-G301 CarbonylContact O-C 3.56Å; V297-G301 VanDerWaalsContact O-CA 3.24Å; V297-G301 WeakPolarHBondContact O-CA 3.39Å; V297-G301 PolarHBondContact O-N 3.41Å; G301-L303 PolarHBondContact O-N 3.24Å; G301-L303 VanDerWaalsContact O-N 3.14Å; G301-K304 PolarHBondContact O-N 3.1Å; G301-A305 PolarHBondContact O-N 3.44Å |
| 302 | F | 89.6 | Confident | 90.1 | Very high | 142 Ų | 142 | 53.9 Ų | 53.9 | 62% | 0.623 | 31% | 0.309 | S | S | * | . | H | α-helix | trans | -54.7 | -34.5 | -179.7 | -177 | -93 | 0 | 0 | 0 | 113.4 | A306 I311 | F302-A306 HydrophobicContact CE1-CB 4.37Å; F302-A306 VanDerWaalsContact O-CB 3.22Å; F302-A306 WeakPolarHBondContact O-CB 3.39Å; F302-A306 PolarHBondContact O-N 3.22Å; F302-I311 HydrophobicContact CD2-CD1 3.77Å; F302-I311 HydrophobicContact CE2-CD1 3.6Å; F302-I311 HydrophobicContact CG-CD1 4.48Å; F302-I311 HydrophobicContact CZ-CD1 4.16Å |
| 303 | L | 87.7 | Confident | 89.9 | Confident | 134 Ų | 134 | 57.5 Ų | 57.5 | 70% | 0.702 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -67.6 | -46.8 | -178.4 | -175.3 | 62.9 | 0 | 0 | 0 | 112.3 | G301 A306 T307 | G301-L303 PolarHBondContact O-N 3.24Å; G301-L303 VanDerWaalsContact O-N 3.14Å; L303-A306 PolarHBondContact O-N 2.95Å; L303-T307 HydrophobicContact CD1-CG2 4.04Å; L303-T307 HydrophobicContact CG-CG2 4.42Å; L303-T307 WeakPolarHBondContact O-CG2 3.49Å; L303-T307 PolarHBondContact O-N 2.67Å; L303-T307 PolarHBondContact O-OG1 2.95Å; L303-T307 VanDerWaalsContact O-OG1 3.05Å |
| 304 | K | 85.8 | Confident | 89.7 | Confident | 67 Ų | 67 | 58.6 Ų | 58.6 | 29% | 0.291 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -63.6 | -42.9 | 178.6 | -159.5 | 168.3 | 176.3 | -164.3 | 0 | 109.9 | E300 G301 A306 T307 I308 D384 | E300-K304 HydrophobicContact CB-CB 4.28Å; E300-K304 HydrophobicContact CB-CD 4.05Å; E300-K304 HydrophobicContact CB-CG 4.45Å; E300-K304 WeakPolarHBondContact O-CB 3.32Å; E300-K304 IonicContact OE1-NZ 2.76Å; E300-K304 PolarHBondContact OE1-NZ 2.98Å; E300-K304 WeakPolarHBondContact OE2-CD 3.25Å; E300-K304 WeakPolarHBondContact OE2-CE 3.43Å; E300-K304 IonicContact OE2-NZ 3Å; E300-K304 PolarHBondContact OE2-NZ 3.49Å; G301-K304 PolarHBondContact O-N 3.1Å; K304-A306 VanDerWaalsContact C-N 3.34Å; K304-A306 PolarHBondContact O-N 3.4Å; K304-T307 PolarHBondContact O-OG1 3.19Å; K304-I308 HydrophobicContact CG-CD1 3.95Å; K304-I308 WeakPolarHBondContact O-CB 3.46Å; K304-I308 WeakPolarHBondContact O-CD1 3.31Å; K304-I308 VanDerWaalsContact O-CG1 3.28Å; K304-I308 WeakPolarHBondContact O-CG1 3.36Å; K304-I308 PolarHBondContact O-N 2.9Å; K304-I308 VanDerWaalsContact O-N 3.12Å; K304-D384 IonicContact NZ-OD1 3.32Å; K304-D384 PolarHBondContact NZ-OD1 2.86Å |
| 305 | A | 85.6 | Confident | 89.7 | Confident | 0 Ų | 0 | 59.7 Ų | 59.7 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -65.3 | -30.7 | 174.8 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y296 V297 G301 Q310 I311 | Y296-A305 HydrophobicContact CD1-CB 4.21Å; Y296-A305 HydrophobicContact CE1-CB 3.76Å; V297-A305 HydrophobicContact CG2-CB 3.91Å; G301-A305 PolarHBondContact O-N 3.44Å; A305-Q310 PolarHBondContact O-N 3.49Å; A305-I311 HydrophobicContact CB-CD1 3.88Å; A305-I311 HydrophobicContact CB-CG1 3.99Å; A305-I311 PolarHBondContact O-N 3.27Å |
| 306 | A | 86.8 | Confident | 89.7 | Confident | 43 Ų | 43 | 60.3 Ų | 60.3 | 36% | 0.355 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -79 | -43.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | F302 L303 K304 G309 I311 | F302-A306 HydrophobicContact CE1-CB 4.37Å; F302-A306 VanDerWaalsContact O-CB 3.22Å; F302-A306 WeakPolarHBondContact O-CB 3.39Å; F302-A306 PolarHBondContact O-N 3.22Å; L303-A306 PolarHBondContact O-N 2.95Å; K304-A306 VanDerWaalsContact C-N 3.34Å; K304-A306 PolarHBondContact O-N 3.4Å; A306-G309 WeakPolarHBondContact O-CA 3.46Å; A306-G309 PolarHBondContact O-N 2.92Å; A306-I311 HydrophobicContact CB-CD1 4.26Å |
| 307 | T | 82.1 | Confident | 89.8 | Confident | 104 Ų | 104 | 60.9 Ų | 60.9 | 64% | 0.638 | 34% | 0.339 | S | S | * | . | H | α-helix | trans | -72.4 | -32.8 | -176.9 | 53.6 | 0 | 0 | 0 | 0 | 113.2 | L303 K304 G309 | L303-T307 HydrophobicContact CD1-CG2 4.04Å; L303-T307 HydrophobicContact CG-CG2 4.42Å; L303-T307 WeakPolarHBondContact O-CG2 3.49Å; L303-T307 PolarHBondContact O-N 2.67Å; L303-T307 PolarHBondContact O-OG1 2.95Å; L303-T307 VanDerWaalsContact O-OG1 3.05Å; K304-T307 PolarHBondContact O-OG1 3.19Å; T307-G309 PolarHBondContact O-N 3.37Å |
| 308 | I | 83.9 | Confident | 89.8 | Confident | 28 Ų | 28 | 60.6 Ų | 60.6 | 14% | 0.144 | 34% | 0.341 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.6 | -10.4 | 169.7 | -62.4 | 168.2 | 0 | 0 | 0 | 111 | K304 Q310 L369 F372 | K304-I308 HydrophobicContact CG-CD1 3.95Å; K304-I308 WeakPolarHBondContact O-CB 3.46Å; K304-I308 WeakPolarHBondContact O-CD1 3.31Å; K304-I308 VanDerWaalsContact O-CG1 3.28Å; K304-I308 WeakPolarHBondContact O-CG1 3.36Å; K304-I308 PolarHBondContact O-N 2.9Å; K304-I308 VanDerWaalsContact O-N 3.12Å; I308-Q310 HydrophobicContact CB-CG 4.45Å; I308-Q310 HydrophobicContact CG2-CG 3.95Å; I308-Q310 PolarHBondContact O-N 3.43Å; I308-L369 HydrophobicContact CG2-CD2 3.63Å; I308-F372 HydrophobicContact CD1-CD1 4.18Å; I308-F372 HydrophobicContact CD1-CE1 3.51Å; I308-F372 HydrophobicContact CD1-CZ 3.78Å; I308-F372 HydrophobicContact CG1-CD1 4.18Å; I308-F372 HydrophobicContact CG1-CD2 4.46Å; I308-F372 HydrophobicContact CG1-CE1 3.76Å; I308-F372 HydrophobicContact CG1-CE2 4.07Å; I308-F372 HydrophobicContact CG1-CZ 3.71Å; I308-F372 HydrophobicContact CG2-CD1 4.36Å |
| 309 | G | 82.6 | Confident | 90 | Very high | 21 Ų | 21 | 57.2 Ų | 57.2 | 22% | 0.216 | 33% | 0.329 | C | S | . | . | S | Bend | trans | 78 | 1.7 | 178 | 0 | 0 | 0 | 0 | 0 | 114.7 | A306 T307 I311 G312 W313 | A306-G309 WeakPolarHBondContact O-CA 3.46Å; A306-G309 PolarHBondContact O-N 2.92Å; T307-G309 PolarHBondContact O-N 3.37Å; G309-I311 VanDerWaalsContact C-N 3.28Å; G309-I311 PolarHBondContact O-N 3.25Å; G309-G312 PolarHBondContact O-N 3.44Å; G309-W313 PolarHBondContact O-N 3.39Å |
| 310 | Q | 85.4 | Confident | 90.2 | Very high | 8 Ų | 8 | 55.9 Ų | 55.9 | 4% | 0.037 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -48.5 | -49.4 | -180 | -74.1 | -121.7 | 39.9 | 0 | 0 | 111.7 | S238 Y296 A305 I308 G312 W313 L314 L369 | S238-Q310 PolarHBondContact OG-NE2 3.24Å; Y296-Q310 HydrophobicContact CE1-CB 4.45Å; Y296-Q310 HydrophobicContact CE1-CG 4.08Å; Y296-Q310 VanDerWaalsContact CZ-NE2 3.29Å; A305-Q310 PolarHBondContact O-N 3.49Å; I308-Q310 HydrophobicContact CB-CG 4.45Å; I308-Q310 HydrophobicContact CG2-CG 3.95Å; I308-Q310 PolarHBondContact O-N 3.43Å; Q310-G312 VanDerWaalsContact C-N 3.31Å; Q310-G312 PolarHBondContact O-N 2.71Å; Q310-W313 PolarHBondContact O-N 3.2Å; Q310-L314 HydrophobicContact CB-CD1 4.37Å; Q310-L314 VanDerWaalsContact O-CB 3.31Å; Q310-L314 WeakPolarHBondContact O-CB 3.19Å; Q310-L314 VanDerWaalsContact O-CG 3.24Å; Q310-L314 WeakPolarHBondContact O-CG 3.33Å; Q310-L314 PolarHBondContact O-N 2.92Å; Q310-L369 HydrophobicContact CG-CD2 4.11Å |
| 311 | I | 87.8 | Confident | 90.4 | Very high | 38 Ų | 38 | 56.2 Ų | 56.2 | 20% | 0.195 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.5 | -41.3 | -177.8 | -59.7 | 175.3 | 0 | 0 | 0 | 111.3 | F302 A305 A306 G309 M315 | F302-I311 HydrophobicContact CD2-CD1 3.77Å; F302-I311 HydrophobicContact CE2-CD1 3.6Å; F302-I311 HydrophobicContact CG-CD1 4.48Å; F302-I311 HydrophobicContact CZ-CD1 4.16Å; A305-I311 HydrophobicContact CB-CD1 3.88Å; A305-I311 HydrophobicContact CB-CG1 3.99Å; A305-I311 PolarHBondContact O-N 3.27Å; A306-I311 HydrophobicContact CB-CD1 4.26Å; G309-I311 VanDerWaalsContact C-N 3.28Å; G309-I311 PolarHBondContact O-N 3.25Å; I311-M315 HydrophobicContact CG2-CE 4.05Å; I311-M315 HydrophobicContact CG2-CG 4.42Å; I311-M315 HydrophobicContact CG2-SD 4.22Å; I311-M315 WeakPolarHBondContact O-CB 3.31Å; I311-M315 VanDerWaalsContact O-CG 3.25Å; I311-M315 WeakPolarHBondContact O-CG 3.33Å; I311-M315 PolarHBondContact O-N 3.4Å |
| 312 | G | 91.6 | Very high | 90.8 | Very high | 41 Ų | 41 | 58.9 Ų | 58.9 | 42% | 0.423 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64.1 | -48.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | G309 Q310 M315 L316 | G309-G312 PolarHBondContact O-N 3.44Å; Q310-G312 VanDerWaalsContact C-N 3.31Å; Q310-G312 PolarHBondContact O-N 2.71Å; G312-M315 PolarHBondContact O-N 3.47Å; G312-L316 PolarHBondContact O-N 3.39Å; G312-L316 VanDerWaalsContact O-N 3.11Å |
| 313 | W | 93.6 | Very high | 91.2 | Very high | 80 Ų | 80 | 55.1 Ų | 55.1 | 30% | 0.303 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -67.1 | -39.9 | 178.6 | -63.6 | 113.1 | 0 | 0 | 0 | 112.3 | G309 Q310 L316 M317 V361 H364 | G309-W313 PolarHBondContact O-N 3.39Å; Q310-W313 PolarHBondContact O-N 3.2Å; W313-L316 HydrophobicContact CE3-CD2 4.27Å; W313-L316 HydrophobicContact CZ3-CD2 4.17Å; W313-L316 PolarHBondContact O-N 3.39Å; W313-M317 WeakPolarHBondContact O-CB 3.43Å; W313-M317 WeakPolarHBondContact O-CG 3.25Å; W313-M317 PolarHBondContact O-N 2.89Å; W313-V361 HydrophobicContact CE3-CG1 3.97Å; W313-V361 HydrophobicContact CZ3-CG1 4.32Å; W313-H364 AromaticContact CE2-ND1 3.89Å; W313-H364 AromaticContact CH2-CE1 3.37Å; W313-H364 WeakPolarHBondContact CH2-CE1 3.29Å; W313-H364 AromaticContact CH2-ND1 3.24Å; W313-H364 WeakPolarHBondContact CH2-ND1 3.43Å; W313-H364 AromaticContact CZ2-CE1 3.36Å; W313-H364 WeakPolarHBondContact CZ2-CE1 3.43Å; W313-H364 AromaticContact CZ2-ND1 3.35Å; W313-H364 WeakPolarHBondContact CZ2-ND1 3.41Å; W313-H364 AromaticContact CZ3-ND1 3.7Å |
| 314 | L | 92.9 | Very high | 91.7 | Very high | 47 Ų | 47 | 48.8 Ų | 48.8 | 25% | 0.246 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -67.6 | -37.6 | 177.7 | -69.3 | 169.5 | 0 | 0 | 0 | 112.4 | W234 T293 Q310 M317 A318 | W234-L314 HydrophobicContact CZ2-CD1 4.04Å; W234-L314 HydrophobicContact CZ2-CD2 4.1Å; T293-L314 HydrophobicContact CG2-CD1 3.83Å; Q310-L314 HydrophobicContact CB-CD1 4.37Å; Q310-L314 VanDerWaalsContact O-CB 3.31Å; Q310-L314 WeakPolarHBondContact O-CB 3.19Å; Q310-L314 VanDerWaalsContact O-CG 3.24Å; Q310-L314 WeakPolarHBondContact O-CG 3.33Å; Q310-L314 PolarHBondContact O-N 2.92Å; L314-M317 PolarHBondContact O-N 3.31Å; L314-A318 WeakPolarHBondContact O-CB 3.32Å; L314-A318 PolarHBondContact O-N 2.96Å |
| 315 | M | 94.8 | Very high | 92.2 | Very high | 116 Ų | 116 | 46.2 Ų | 46.2 | 57% | 0.571 | 27% | 0.271 | S | S | * | . | H | α-helix | trans | -65 | -40.1 | 172.3 | -74.5 | -172.7 | -52.1 | 0 | 0 | 112.3 | I311 G312 A318 S319 | I311-M315 HydrophobicContact CG2-CE 4.05Å; I311-M315 HydrophobicContact CG2-CG 4.42Å; I311-M315 HydrophobicContact CG2-SD 4.22Å; I311-M315 WeakPolarHBondContact O-CB 3.31Å; I311-M315 VanDerWaalsContact O-CG 3.25Å; I311-M315 WeakPolarHBondContact O-CG 3.33Å; I311-M315 PolarHBondContact O-N 3.4Å; G312-M315 PolarHBondContact O-N 3.47Å; M315-A318 PolarHBondContact O-N 2.97Å; M315-S319 WeakPolarHBondContact O-CB 3.42Å; M315-S319 PolarHBondContact O-N 2.99Å; M315-S319 PolarHBondContact O-OG 2.99Å |
| 316 | L | 97.1 | Very high | 92.8 | Very high | 74 Ų | 74 | 48.7 Ų | 48.7 | 39% | 0.387 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -65.2 | -43.6 | 174.8 | -178.8 | 58.1 | 0 | 0 | 0 | 111.2 | G312 W313 S319 L320 V361 | G312-L316 PolarHBondContact O-N 3.39Å; G312-L316 VanDerWaalsContact O-N 3.11Å; W313-L316 HydrophobicContact CE3-CD2 4.27Å; W313-L316 HydrophobicContact CZ3-CD2 4.17Å; W313-L316 PolarHBondContact O-N 3.39Å; L316-S319 WeakPolarHBondContact O-CB 3.42Å; L316-S319 PolarHBondContact O-N 3.37Å; L316-L320 HydrophobicContact CD1-CD1 4.48Å; L316-L320 HydrophobicContact CD1-CG 4.47Å; L316-L320 HydrophobicContact CG-CD1 4.29Å; L316-L320 WeakPolarHBondContact O-CG 3.14Å; L316-L320 PolarHBondContact O-N 3.43Å; L316-V361 HydrophobicContact CD2-CG1 3.66Å; L316-V361 HydrophobicContact CD2-CG2 4.24Å; L316-V361 HydrophobicContact CG-CG1 3.96Å |
| 317 | M | 97.3 | Very high | 93.3 | Very high | 21 Ų | 21 | 48.1 Ų | 48.1 | 10% | 0.103 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60.2 | -47.9 | 174.1 | -74.6 | -56.2 | -56.2 | 0 | 0 | 112.3 | W313 L314 S319 L320 Y321 G358 V361 H362 | W313-M317 WeakPolarHBondContact O-CB 3.43Å; W313-M317 WeakPolarHBondContact O-CG 3.25Å; W313-M317 PolarHBondContact O-N 2.89Å; L314-M317 PolarHBondContact O-N 3.31Å; M317-S319 VanDerWaalsContact C-N 3.28Å; M317-S319 PolarHBondContact O-N 3.4Å; M317-L320 PolarHBondContact O-N 2.9Å; M317-L320 HydrophobicContact SD-CD1 4.5Å; M317-Y321 HydrophobicContact CE-CD2 4.04Å; M317-Y321 HydrophobicContact CE-CE2 3.66Å; M317-Y321 WeakPolarHBondContact O-CD2 3.47Å; M317-Y321 PolarHBondContact O-N 3.06Å; M317-G358 WeakPolarHBondContact CE-O 3.26Å; M317-V361 HydrophobicContact CG-CG1 4.22Å; M317-V361 HydrophobicContact SD-CB 3.87Å; M317-V361 HydrophobicContact SD-CG1 3.67Å; M317-H362 HydrophobicContact CE-CB 3.92Å; M317-H362 HydrophobicContact SD-CB 3.92Å; M317-H362 PolarHBondContact SD-N 2.99Å |
| 318 | A | 95.6 | Very high | 94 | Very high | 33 Ų | 33 | 44 Ų | 44 | 27% | 0.273 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -59.3 | -40.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L314 M315 Y321 I322 | L314-A318 WeakPolarHBondContact O-CB 3.32Å; L314-A318 PolarHBondContact O-N 2.96Å; M315-A318 PolarHBondContact O-N 2.97Å; A318-Y321 PolarHBondContact O-N 3.41Å; A318-I322 WeakPolarHBondContact O-CB 3.32Å; A318-I322 VanDerWaalsContact O-CG1 3.24Å; A318-I322 WeakPolarHBondContact O-CG1 2.98Å; A318-I322 PolarHBondContact O-N 3.09Å |
| 319 | S | 98 | Very high | 94.6 | Very high | 65 Ų | 65 | 44.5 Ų | 44.5 | 46% | 0.455 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -62.4 | -45.6 | 175.4 | -57.3 | 0 | 0 | 0 | 0 | 111.8 | M315 L316 M317 T323 | M315-S319 WeakPolarHBondContact O-CB 3.42Å; M315-S319 PolarHBondContact O-N 2.99Å; M315-S319 PolarHBondContact O-OG 2.99Å; L316-S319 WeakPolarHBondContact O-CB 3.42Å; L316-S319 PolarHBondContact O-N 3.37Å; M317-S319 VanDerWaalsContact C-N 3.28Å; M317-S319 PolarHBondContact O-N 3.4Å; S319-T323 VanDerWaalsContact O-CB 3.29Å; S319-T323 WeakPolarHBondContact O-CB 3.22Å; S319-T323 PolarHBondContact O-N 2.88Å; S319-T323 PolarHBondContact O-OG1 2.95Å |
| 320 | L | 97.8 | Very high | 95.3 | Very high | 30 Ų | 30 | 45 Ų | 45 | 16% | 0.157 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -63.6 | -44.4 | 176.7 | -68.7 | 169.4 | 0 | 0 | 0 | 112 | L316 M317 G324 F354 V361 | L316-L320 HydrophobicContact CD1-CD1 4.48Å; L316-L320 HydrophobicContact CD1-CG 4.47Å; L316-L320 HydrophobicContact CG-CD1 4.29Å; L316-L320 WeakPolarHBondContact O-CG 3.14Å; L316-L320 PolarHBondContact O-N 3.43Å; M317-L320 PolarHBondContact O-N 2.9Å; M317-L320 HydrophobicContact SD-CD1 4.5Å; L320-G324 PolarHBondContact O-N 3.46Å; L320-F354 HydrophobicContact CB-CD1 4.28Å; L320-F354 HydrophobicContact CD2-CD1 3.68Å; L320-F354 HydrophobicContact CD2-CE1 3.74Å; L320-F354 WeakPolarHBondContact O-CD1 3.23Å; L320-V361 HydrophobicContact CD1-CB 4.18Å; L320-V361 HydrophobicContact CD1-CG1 4.39Å; L320-V361 HydrophobicContact CD1-CG2 4.04Å |
| 321 | Y | 93.1 | Very high | 95.9 | Very high | 60 Ų | 60 | 46.3 Ų | 46.3 | 24% | 0.235 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.5 | -51 | 176.1 | -95.7 | -85.6 | 0 | 0 | 0 | 112.1 | I227 M317 A318 A325 | I227-Y321 HydrophobicContact CD1-CE1 4.46Å; I227-Y321 HydrophobicContact CG1-CE1 4.32Å; I227-Y321 WeakPolarHBondContact CG1-OH 3.16Å; M317-Y321 HydrophobicContact CE-CD2 4.04Å; M317-Y321 HydrophobicContact CE-CE2 3.66Å; M317-Y321 WeakPolarHBondContact O-CD2 3.47Å; M317-Y321 PolarHBondContact O-N 3.06Å; A318-Y321 PolarHBondContact O-N 3.41Å; Y321-A325 VanDerWaalsContact O-CB 3.25Å; Y321-A325 WeakPolarHBondContact O-CB 3.35Å; Y321-A325 PolarHBondContact O-N 3.39Å |
| 322 | I | 97.8 | Very high | 96.4 | Very high | 84 Ų | 84 | 47 Ų | 47 | 43% | 0.431 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.3 | -46 | -177.1 | -68.1 | 166.8 | 0 | 0 | 0 | 110.6 | L283 L287 A318 A326 | L283-I322 HydrophobicContact CD1-CG1 4.1Å; L287-I322 HydrophobicContact CD1-CG1 4.43Å; A318-I322 WeakPolarHBondContact O-CB 3.32Å; A318-I322 VanDerWaalsContact O-CG1 3.24Å; A318-I322 WeakPolarHBondContact O-CG1 2.98Å; A318-I322 PolarHBondContact O-N 3.09Å; I322-A326 WeakPolarHBondContact O-CB 3.47Å; I322-A326 PolarHBondContact O-N 3.43Å |
| 323 | T | 98.2 | Very high | 96.8 | Very high | 63 Ų | 63 | 46.3 Ų | 46.3 | 39% | 0.387 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -66.3 | -44.3 | 179 | -58.9 | 0 | 0 | 0 | 0 | 111.8 | S319 A326 L327 F354 | S319-T323 VanDerWaalsContact O-CB 3.29Å; S319-T323 WeakPolarHBondContact O-CB 3.22Å; S319-T323 PolarHBondContact O-N 2.88Å; S319-T323 PolarHBondContact O-OG1 2.95Å; T323-A326 PolarHBondContact O-N 2.87Å; T323-L327 HydrophobicContact CG2-CD1 4.15Å; T323-L327 HydrophobicContact CG2-CG 4.39Å; T323-L327 WeakPolarHBondContact O-CG 3.49Å; T323-L327 PolarHBondContact O-N 2.95Å; T323-F354 HydrophobicContact CG2-CE1 3.63Å; T323-F354 HydrophobicContact CG2-CE2 4.48Å; T323-F354 HydrophobicContact CG2-CZ 3.55Å |
| 324 | G | 97.8 | Very high | 97 | Very high | 2 Ų | 2 | 42.6 Ų | 42.6 | 2% | 0.021 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -60.5 | -48.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | L320 A326 L327 Y328 | L320-G324 PolarHBondContact O-N 3.46Å; G324-A326 PolarHBondContact O-N 3.45Å; G324-L327 PolarHBondContact O-N 2.85Å; G324-Y328 WeakPolarHBondContact O-CB 3.15Å; G324-Y328 PolarHBondContact O-N 2.93Å; G324-Y328 VanDerWaalsContact O-N 3.08Å |
| 325 | A | 96.1 | Very high | 97.2 | Very high | 13 Ų | 13 | 45.9 Ų | 45.9 | 11% | 0.107 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.3 | -37.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | L283 Y321 A329 | L283-A325 HydrophobicContact CB-CB 4.23Å; L283-A325 HydrophobicContact CD1-CB 4.19Å; L283-A325 HydrophobicContact CD2-CB 4.08Å; L283-A325 HydrophobicContact CG-CB 4.4Å; Y321-A325 VanDerWaalsContact O-CB 3.25Å; Y321-A325 WeakPolarHBondContact O-CB 3.35Å; Y321-A325 PolarHBondContact O-N 3.39Å; A325-A329 VanDerWaalsContact O-CB 3.25Å; A325-A329 WeakPolarHBondContact O-CB 3.09Å; A325-A329 PolarHBondContact O-N 3.29Å |
| 326 | A | 97.8 | Very high | 97.4 | Very high | 52 Ų | 52 | 46.4 Ų | 46.4 | 43% | 0.43 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -66.6 | -44.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | I322 T323 G324 A330 | I322-A326 WeakPolarHBondContact O-CB 3.47Å; I322-A326 PolarHBondContact O-N 3.43Å; T323-A326 PolarHBondContact O-N 2.87Å; G324-A326 PolarHBondContact O-N 3.45Å; A326-A330 WeakPolarHBondContact O-CB 3.32Å; A326-A330 PolarHBondContact O-N 3.16Å |
| 327 | L | 97.8 | Very high | 97.4 | Very high | 30 Ų | 30 | 48.7 Ų | 48.7 | 16% | 0.157 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -58.8 | -49.9 | 175.2 | -71.9 | 173.1 | 0 | 0 | 0 | 111 | T323 G324 R331 I332 S347 L350 F354 | T323-L327 HydrophobicContact CG2-CD1 4.15Å; T323-L327 HydrophobicContact CG2-CG 4.39Å; T323-L327 WeakPolarHBondContact O-CG 3.49Å; T323-L327 PolarHBondContact O-N 2.95Å; G324-L327 PolarHBondContact O-N 2.85Å; L327-R331 WeakPolarHBondContact O-CA 3.26Å; L327-R331 PolarHBondContact O-N 2.96Å; L327-I332 HydrophobicContact CD2-CB 3.93Å; L327-I332 HydrophobicContact CD2-CG2 3.71Å; L327-I332 PolarHBondContact O-N 3.42Å; L327-S347 VanDerWaalsContact O-CB 3.29Å; L327-S347 WeakPolarHBondContact O-CB 3.38Å; L327-L350 HydrophobicContact CD1-CB 4.23Å; L327-L350 HydrophobicContact CD1-CD1 4.41Å; L327-F354 HydrophobicContact CD1-CD2 4.35Å; L327-F354 HydrophobicContact CD1-CE2 3.89Å; L327-F354 HydrophobicContact CD1-CZ 4.36Å |
| 328 | Y | 97.8 | Very high | 97.4 | Very high | 18 Ų | 18 | 50.4 Ų | 50.4 | 7% | 0.071 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -58.6 | -52.6 | 177.5 | 175.5 | -98.4 | 0 | 0 | 0 | 112.6 | R275 R278 A279 G324 R331 H348 F351 | R275-Y328 HydrophobicContact CG-CD1 4.17Å; R275-Y328 HydrophobicContact CG-CE1 3.56Å; R278-Y328 PolarHBondContact NE-OH 2.89Å; R278-Y328 PolarHBondContact NH2-OH 3.32Å; R278-Y328 VanDerWaalsContact NH2-OH 3.13Å; A279-Y328 HydrophobicContact CB-CD1 4.21Å; G324-Y328 WeakPolarHBondContact O-CB 3.15Å; G324-Y328 PolarHBondContact O-N 2.93Å; G324-Y328 VanDerWaalsContact O-N 3.08Å; Y328-R331 PolarHBondContact O-N 2.91Å; Y328-H348 AromaticContact CD2-ND1 3.84Å; Y328-H348 AromaticContact CE2-CE1 3.89Å; Y328-H348 AromaticContact CE2-ND1 3.47Å; Y328-H348 WeakPolarHBondContact CE2-ND1 3.25Å; Y328-F351 HydrophobicContact CD2-CD1 4.26Å; Y328-F351 HydrophobicContact CD2-CG 4.44Å |
| 329 | A | 96.7 | Very high | 97.5 | Very high | 39 Ų | 39 | 50.1 Ų | 50.1 | 32% | 0.322 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.9 | -40.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A279 A325 | A279-A329 HydrophobicContact CB-CB 3.88Å; A325-A329 VanDerWaalsContact O-CB 3.25Å; A325-A329 WeakPolarHBondContact O-CB 3.09Å; A325-A329 PolarHBondContact O-N 3.29Å |
| 330 | A | 97.1 | Very high | 97.5 | Very high | 31 Ų | 31 | 55.2 Ų | 55.2 | 26% | 0.256 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -78.8 | -19 | 180 | 0 | 0 | 0 | 0 | 0 | 113.3 | A326 I332 R335 | A326-A330 WeakPolarHBondContact O-CB 3.32Å; A326-A330 PolarHBondContact O-N 3.16Å; A330-I332 HydrophobicContact CB-CD1 3.65Å; A330-I332 HydrophobicContact CB-CG1 3.81Å; A330-R335 PolarHBondContact O-NE 3.43Å; A330-R335 PolarHBondContact O-NH2 3.47Å |
| 331 | R | 98.2 | Very high | 97.5 | Very high | 36 Ų | 36 | 54.5 Ų | 54.5 | 14% | 0.136 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 60 | 50.4 | -173.4 | -60.5 | -167 | -92.6 | 150.8 | -10.1 | 112.9 | N118 D119 F120 L327 Y328 E334 R335 | N118-R331 VanDerWaalsContact OD1-CD 3.31Å; N118-R331 WeakPolarHBondContact OD1-CD 3.15Å; N118-R331 PolarHBondContact OD1-NH1 2.83Å; D119-R331 IonicContact OD1-CZ 3.37Å; D119-R331 IonicContact OD1-NH1 2.66Å; D119-R331 PolarHBondContact OD1-NH1 2.9Å; D119-R331 IonicContact OD1-NH2 3.13Å; D119-R331 PolarHBondContact OD1-NH2 3.42Å; D119-R331 VanDerWaalsContact OD1-NH2 3.13Å; F120-R331 HydrophobicContact CD2-CB 3.93Å; F120-R331 HydrophobicContact CE2-CB 4.03Å; L327-R331 WeakPolarHBondContact O-CA 3.26Å; L327-R331 PolarHBondContact O-N 2.96Å; Y328-R331 PolarHBondContact O-N 2.91Å; R331-E334 HydrophobicContact CB-CG 4.47Å; R331-E334 WeakPolarHBondContact CB-OE1 3.18Å; R331-R335 WeakPolarHBondContact O-CB 3.31Å; R331-R335 PolarHBondContact O-N 3.01Å |
| 332 | I | 98.3 | Very high | 97.7 | Very high | 51 Ų | 51 | 52.5 Ų | 52.5 | 26% | 0.262 | 28% | 0.281 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102 | 133.4 | 179.4 | -70.2 | 174.1 | 0 | 0 | 0 | 108.7 | L327 A330 F336 S347 | L327-I332 HydrophobicContact CD2-CB 3.93Å; L327-I332 HydrophobicContact CD2-CG2 3.71Å; L327-I332 PolarHBondContact O-N 3.42Å; A330-I332 HydrophobicContact CB-CD1 3.65Å; A330-I332 HydrophobicContact CB-CG1 3.81Å; I332-F336 HydrophobicContact CB-CE2 4.39Å; I332-F336 HydrophobicContact CD1-CE2 3.91Å; I332-F336 HydrophobicContact CD1-CZ 4.05Å; I332-F336 HydrophobicContact CG1-CD2 4.48Å; I332-F336 HydrophobicContact CG1-CE2 3.75Å; I332-F336 HydrophobicContact CG1-CZ 4.16Å; I332-F336 HydrophobicContact CG2-CD2 4.34Å; I332-F336 HydrophobicContact CG2-CE2 3.89Å; I332-S347 VanDerWaalsContact O-CA 3.3Å; I332-S347 WeakPolarHBondContact O-CA 3.2Å; I332-S347 WeakPolarHBondContact O-CB 3.27Å |
| 333 | P | 98.4 | Very high | 97.7 | Very high | 28 Ų | 28 | 50.2 Ų | 50.2 | 18% | 0.182 | 27% | 0.269 | C | S | . | . | T | Hydrogen-bonded Turn | cis | -94.2 | -5.6 | 11.8 | 37 | -37.2 | 0 | 0 | 0 | 116.2 | R335 F336 F337 F345 | P333-R335 PolarHBondContact O-N 2.93Å; P333-R335 VanDerWaalsContact O-N 3.16Å; P333-F336 WeakPolarHBondContact O-CB 3.27Å; P333-F336 PolarHBondContact O-N 3.01Å; P333-F337 HydrophobicContact CB-CD2 4.47Å; P333-F337 PolarHBondContact O-N 3.4Å; P333-F345 WeakPolarHBondContact CD-O 3.46Å; P333-F345 WeakPolarHBondContact CG-O 3.31Å |
| 334 | E | 98.4 | Very high | 97.7 | Very high | 1 Ų | 1 | 53.3 Ų | 53.3 | 1% | 0.005 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -26.9 | -171.1 | 69.1 | -85.3 | -159.1 | 0 | 0 | 113.9 | N118 F120 L121 R331 F336 F337 P338 C341 S347 | N118-E334 PolarHBondContact ND2-OE1 3.46Å; F120-E334 HydrophobicContact CB-CB 4.06Å; F120-E334 HydrophobicContact CB-CG 3.63Å; F120-E334 HydrophobicContact CD2-CG 4.13Å; F120-E334 HydrophobicContact CG-CG 4.35Å; L121-E334 HydrophobicContact CD2-CB 4.04Å; L121-E334 HydrophobicContact CD2-CG 4.05Å; R331-E334 HydrophobicContact CB-CG 4.47Å; R331-E334 WeakPolarHBondContact CB-OE1 3.18Å; E334-F336 PolarHBondContact O-N 3.49Å; E334-F337 CarbonylContact O-C 3.56Å; E334-F337 PolarHBondContact O-N 3.48Å; E334-P338 WeakPolarHBondContact O-CA 3.42Å; E334-P338 VanDerWaalsContact O-CD 3.31Å; E334-P338 WeakPolarHBondContact O-CD 3.48Å; E334-P338 WeakPolarHBondContact O-CG 3.04Å; E334-C341 HydrophobicContact CB-CB 3.97Å; E334-S347 WeakPolarHBondContact OE1-CB 3.33Å; E334-S347 PolarHBondContact OE1-OG 2.88Å; E334-S347 WeakPolarHBondContact OE2-CB 3.24Å; E334-S347 PolarHBondContact OE2-N 2.9Å; E334-S347 PolarHBondContact OE2-OG 3.22Å |
| 335 | R | 98 | Very high | 97.8 | Very high | 117 Ų | 117 | 59.5 Ų | 59.5 | 44% | 0.442 | 30% | 0.3 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -53.6 | -37.3 | 168 | 175.6 | -174.8 | -63.4 | -93.9 | -1 | 113.1 | F120 A330 R331 P333 | F120-R335 HydrophobicContact CD2-CB 4.07Å; F120-R335 HydrophobicContact CE2-CB 3.75Å; F120-R335 HydrophobicContact CE2-CG 4.11Å; F120-R335 HydrophobicContact CZ-CB 4.2Å; F120-R335 HydrophobicContact CZ-CG 4.1Å; A330-R335 PolarHBondContact O-NE 3.43Å; A330-R335 PolarHBondContact O-NH2 3.47Å; R331-R335 WeakPolarHBondContact O-CB 3.31Å; R331-R335 PolarHBondContact O-N 3.01Å; P333-R335 PolarHBondContact O-N 2.93Å; P333-R335 VanDerWaalsContact O-N 3.16Å |
| 336 | F | 98.1 | Very high | 97.9 | Very high | 126 Ų | 126 | 59 Ų | 59 | 55% | 0.553 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.9 | -26.5 | -178.8 | -56.2 | -53.5 | 0 | 0 | 0 | 112.2 | I332 P333 E334 | I332-F336 HydrophobicContact CB-CE2 4.39Å; I332-F336 HydrophobicContact CD1-CE2 3.91Å; I332-F336 HydrophobicContact CD1-CZ 4.05Å; I332-F336 HydrophobicContact CG1-CD2 4.48Å; I332-F336 HydrophobicContact CG1-CE2 3.75Å; I332-F336 HydrophobicContact CG1-CZ 4.16Å; I332-F336 HydrophobicContact CG2-CD2 4.34Å; I332-F336 HydrophobicContact CG2-CE2 3.89Å; P333-F336 WeakPolarHBondContact O-CB 3.27Å; P333-F336 PolarHBondContact O-N 3.01Å; E334-F336 PolarHBondContact O-N 3.49Å |
| 337 | F | 97.4 | Very high | 97.9 | Very high | 122 Ų | 122 | 56.6 Ų | 56.6 | 54% | 0.535 | 28% | 0.276 | S | S | . | . | S | Bend | trans | -134.2 | 65.6 | -178.5 | -47.4 | -71.2 | 0 | 0 | 0 | 112.7 | P333 E334 G339 K340 | P333-F337 HydrophobicContact CB-CD2 4.47Å; P333-F337 PolarHBondContact O-N 3.4Å; E334-F337 CarbonylContact O-C 3.56Å; E334-F337 PolarHBondContact O-N 3.48Å; F337-G339 PolarHBondContact O-N 3.21Å; F337-K340 HydrophobicContact CB-CB 3.83Å; F337-K340 HydrophobicContact CB-CG 4Å; F337-K340 WeakPolarHBondContact O-CB 3.39Å; F337-K340 PolarHBondContact O-N 2.95Å; F337-K340 VanDerWaalsContact O-N 3.07Å |
| 338 | P | 98 | Very high | 98 | Very high | 58 Ų | 58 | 56.4 Ų | 56.4 | 38% | 0.377 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.4 | 138.9 | 177.9 | -24.4 | 34.8 | 0 | 0 | 0 | 111.5 | F120 L122 E334 K340 | F120-P338 HydrophobicContact CD1-CG 4.22Å; F120-P338 WeakPolarHBondContact O-CA 3.23Å; L122-P338 HydrophobicContact CD1-CB 4.12Å; L122-P338 HydrophobicContact CG-CB 4.4Å; E334-P338 WeakPolarHBondContact O-CA 3.42Å; E334-P338 VanDerWaalsContact O-CD 3.31Å; E334-P338 WeakPolarHBondContact O-CD 3.48Å; E334-P338 WeakPolarHBondContact O-CG 3.04Å; P338-K340 PolarHBondContact O-N 3.17Å |
| 339 | G | 96.4 | Very high | 98 | Very high | 27 Ų | 27 | 56.2 Ų | 56.2 | 28% | 0.278 | 27% | 0.274 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 72.2 | 6.9 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | F120 F337 D342 | F120-G339 PolarHBondContact O-N 3Å; F337-G339 PolarHBondContact O-N 3.21Å; G339-D342 WeakPolarHBondContact CA-OD1 3.35Å; G339-D342 PolarHBondContact N-OD1 3.38Å |
| 340 | K | 97.9 | Very high | 98.1 | Very high | 172 Ų | 172 | 56.2 Ų | 56.2 | 75% | 0.748 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.3 | -28.1 | 176.1 | -55.9 | -58.2 | 179.4 | -170.1 | 0 | 113.5 | F337 P338 | F337-K340 HydrophobicContact CB-CB 3.83Å; F337-K340 HydrophobicContact CB-CG 4Å; F337-K340 WeakPolarHBondContact O-CB 3.39Å; F337-K340 PolarHBondContact O-N 2.95Å; F337-K340 VanDerWaalsContact O-N 3.07Å; P338-K340 PolarHBondContact O-N 3.17Å |
| 341 | C | 97.9 | Very high | 98.2 | Very high | 15 Ų | 15 | 56.6 Ų | 56.6 | 10% | 0.101 | 26% | 0.264 | C | S | . | . | S | Bend | trans | -101.4 | 14.3 | 178.1 | -61.4 | 0 | 0 | 0 | 0 | 113 | E334 I343 W344 H346 | E334-C341 HydrophobicContact CB-CB 3.97Å; C341-I343 PolarHBondContact O-N 3.37Å; C341-W344 WeakPolarHBondContact CA-O 3.05Å; C341-W344 PolarHBondContact O-N 2.9Å; C341-H346 HydrophobicContact CB-CB 4.23Å; C341-H346 PolarHBondContact O-ND1 3.45Å |
| 342 | D | 97.9 | Very high | 98.2 | Very high | 18 Ų | 18 | 55 Ų | 55 | 10% | 0.096 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -51.9 | -32.9 | -173.3 | -76 | 4.1 | 0 | 0 | 0 | 114.9 | L121 L122 H123 T144 G339 | L121-D342 WeakPolarHBondContact CA-OD1 3.23Å; L122-D342 PolarHBondContact N-OD1 3.19Å; L122-D342 PolarHBondContact N-OD2 3.17Å; H123-D342 WeakPolarHBondContact CA-OD2 3.29Å; H123-D342 PolarHBondContact N-OD2 3.41Å; H123-D342 WeakPolarHBondContact O-CB 3.36Å; T144-D342 VanDerWaalsContact CA-O 3.3Å; T144-D342 WeakPolarHBondContact CA-O 3.35Å; T144-D342 WeakPolarHBondContact CB-O 3.44Å; T144-D342 WeakPolarHBondContact CG2-O 3.26Å; G339-D342 WeakPolarHBondContact CA-OD1 3.35Å; G339-D342 PolarHBondContact N-OD1 3.38Å |
| 343 | I | 98.3 | Very high | 98.2 | Very high | 35 Ų | 35 | 56.2 Ų | 56.2 | 18% | 0.179 | 27% | 0.265 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -114.2 | -28.9 | -176.5 | -51.7 | -61.2 | 0 | 0 | 0 | 112.2 | I142 C341 | I142-I343 HydrophobicContact CG2-CD1 4.45Å; I142-I343 HydrophobicContact CG2-CG2 3.53Å; C341-I343 PolarHBondContact O-N 3.37Å |
| 344 | W | 98.5 | Very high | 98.3 | Very high | 128 Ų | 128 | 57.6 Ų | 57.6 | 49% | 0.485 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -141.3 | 138.3 | -167.7 | -58.4 | 123.6 | 0 | 0 | 0 | 111.7 | C341 H346 | C341-W344 WeakPolarHBondContact CA-O 3.05Å; C341-W344 PolarHBondContact O-N 2.9Å; W344-H346 VanDerWaalsContact C-N 3.25Å; W344-H346 PolarHBondContact O-N 3.37Å |
| 345 | F | 98.3 | Very high | 98.3 | Very high | 133 Ų | 133 | 58.7 Ų | 58.7 | 58% | 0.583 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.1 | 18.5 | 174.1 | -48.9 | -70.2 | 0 | 0 | 0 | 115.8 | P333 L350 | P333-F345 WeakPolarHBondContact CD-O 3.46Å; P333-F345 WeakPolarHBondContact CG-O 3.31Å; F345-L350 HydrophobicContact CB-CD2 4.48Å; F345-L350 HydrophobicContact CD1-CD2 4.25Å |
| 346 | H | 98.7 | Very high | 98.3 | Very high | 1 Ų | 1 | 54.7 Ų | 54.7 | 1% | 0.005 | 26% | 0.263 | C | S | . | . | trans | -65.8 | 156.1 | 163.7 | 54 | -77.1 | 0 | 0 | 0 | 111.6 | L121 N148 C341 W344 H348 Q349 L350 | L121-H346 HydrophobicContact CD2-CB 3.77Å; N148-H346 PolarHBondContact OD1-NE2 2.89Å; C341-H346 HydrophobicContact CB-CB 4.23Å; C341-H346 PolarHBondContact O-ND1 3.45Å; W344-H346 VanDerWaalsContact C-N 3.25Å; W344-H346 PolarHBondContact O-N 3.37Å; H346-H348 VanDerWaalsContact C-N 3.26Å; H346-H348 PolarHBondContact O-N 2.82Å; H346-H348 VanDerWaalsContact O-N 3.1Å; H346-Q349 PolarHBondContact O-N 2.85Å; H346-L350 PolarHBondContact O-N 3.3Å; H346-L350 VanDerWaalsContact O-N 3.08Å | ||
| 347 | S | 98.6 | Very high | 98.3 | Very high | 3 Ų | 3 | 50.5 Ų | 50.5 | 2% | 0.021 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -49.4 | -40 | -173.1 | 64.2 | 0 | 0 | 0 | 0 | 114.8 | L327 I332 E334 L350 F351 | L327-S347 VanDerWaalsContact O-CB 3.29Å; L327-S347 WeakPolarHBondContact O-CB 3.38Å; I332-S347 VanDerWaalsContact O-CA 3.3Å; I332-S347 WeakPolarHBondContact O-CA 3.2Å; I332-S347 WeakPolarHBondContact O-CB 3.27Å; E334-S347 WeakPolarHBondContact OE1-CB 3.33Å; E334-S347 PolarHBondContact OE1-OG 2.88Å; E334-S347 WeakPolarHBondContact OE2-CB 3.24Å; E334-S347 PolarHBondContact OE2-N 2.9Å; E334-S347 PolarHBondContact OE2-OG 3.22Å; S347-L350 PolarHBondContact O-N 3.06Å; S347-F351 WeakPolarHBondContact O-CB 3.14Å; S347-F351 PolarHBondContact O-N 3.06Å |
| 348 | H | 98.6 | Very high | 98.4 | Very high | 25 Ų | 25 | 45 Ų | 45 | 12% | 0.116 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -70.1 | -38.8 | -178.9 | -158.6 | 99.8 | 0 | 0 | 0 | 112.4 | H202 Y328 H346 F351 H352 | H202-H348 AromaticContact CE1-CD2 3.63Å; H202-H348 AromaticContact CE1-CE1 3.89Å; H202-H348 AromaticContact CE1-NE2 3.15Å; H202-H348 PolarHBondContact CE1-NE2 3.35Å; H202-H348 AromaticContact NE2-CD2 3.79Å; H202-H348 AromaticContact NE2-CE1 3.89Å; H202-H348 AromaticContact NE2-NE2 3.01Å; H202-H348 PolarHBondContact NE2-NE2 3.01Å; Y328-H348 AromaticContact CD2-ND1 3.84Å; Y328-H348 AromaticContact CE2-CE1 3.89Å; Y328-H348 AromaticContact CE2-ND1 3.47Å; Y328-H348 WeakPolarHBondContact CE2-ND1 3.25Å; H346-H348 VanDerWaalsContact C-N 3.26Å; H346-H348 PolarHBondContact O-N 2.82Å; H346-H348 VanDerWaalsContact O-N 3.1Å; H348-F351 PolarHBondContact O-N 3.46Å; H348-H352 AromaticContact CD2-CD2 3.57Å; H348-H352 AromaticContact CD2-CE1 3.96Å; H348-H352 AromaticContact CD2-NE2 3.26Å; H348-H352 PolarHBondContact CD2-NE2 2.74Å; H348-H352 VanDerWaalsContact CD2-NE2 3.26Å; H348-H352 AromaticContact NE2-CD2 3.6Å; H348-H352 AromaticContact NE2-CE1 3.82Å; H348-H352 AromaticContact NE2-NE2 2.93Å; H348-H352 PolarHBondContact NE2-NE2 3.14Å; H348-H352 PolarHBondContact O-CD2 2.89Å; H348-H352 VanDerWaalsContact O-CD2 3.26Å; H348-H352 PolarHBondContact O-N 3.42Å |
| 349 | Q | 98.8 | Very high | 98.4 | Very high | 15 Ų | 15 | 42.6 Ų | 42.6 | 7% | 0.07 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -66.9 | -39.6 | 173 | -171.7 | -173.5 | 18.5 | 0 | 0 | 111.1 | G147 N148 T151 H346 H352 I353 | G147-Q349 VanDerWaalsContact CA-NE2 3.34Å; N148-Q349 WeakPolarHBondContact OD1-CA 3.32Å; N148-Q349 PolarHBondContact OD1-N 3.42Å; T151-Q349 HydrophobicContact CG2-CG 4.32Å; H346-Q349 PolarHBondContact O-N 2.85Å; Q349-H352 PolarHBondContact O-N 2.92Å; Q349-I353 WeakPolarHBondContact O-CG1 3.22Å; Q349-I353 PolarHBondContact O-N 2.97Å |
| 350 | L | 98.8 | Very high | 98.5 | Very high | 38 Ų | 38 | 45.7 Ų | 45.7 | 20% | 0.199 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -63.3 | -44.4 | 174.7 | -62.1 | 180 | 0 | 0 | 0 | 110.8 | L327 F345 H346 S347 H352 I353 F354 | L327-L350 HydrophobicContact CD1-CB 4.23Å; L327-L350 HydrophobicContact CD1-CD1 4.41Å; F345-L350 HydrophobicContact CB-CD2 4.48Å; F345-L350 HydrophobicContact CD1-CD2 4.25Å; H346-L350 PolarHBondContact O-N 3.3Å; H346-L350 VanDerWaalsContact O-N 3.08Å; S347-L350 PolarHBondContact O-N 3.06Å; L350-H352 VanDerWaalsContact C-N 3.32Å; L350-H352 PolarHBondContact O-N 3.49Å; L350-I353 WeakPolarHBondContact O-CB 3.4Å; L350-I353 PolarHBondContact O-N 3.24Å; L350-I353 VanDerWaalsContact O-N 3.08Å; L350-F354 WeakPolarHBondContact O-CD2 3Å; L350-F354 PolarHBondContact O-N 3.42Å |
| 351 | F | 98.6 | Very high | 98.6 | Very high | 39 Ų | 39 | 38.7 Ų | 38.7 | 17% | 0.171 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -56.5 | -43.2 | 175.4 | 175.5 | -113 | 0 | 0 | 0 | 112.1 | Y328 S347 H348 I353 F354 V355 | Y328-F351 HydrophobicContact CD2-CD1 4.26Å; Y328-F351 HydrophobicContact CD2-CG 4.44Å; S347-F351 WeakPolarHBondContact O-CB 3.14Å; S347-F351 PolarHBondContact O-N 3.06Å; H348-F351 PolarHBondContact O-N 3.46Å; F351-I353 VanDerWaalsContact C-N 3.33Å; F351-I353 PolarHBondContact O-N 3.1Å; F351-F354 WeakPolarHBondContact O-CB 3.03Å; F351-F354 PolarHBondContact O-N 2.99Å; F351-F354 VanDerWaalsContact O-N 3.13Å; F351-V355 HydrophobicContact CD1-CG2 4.48Å; F351-V355 HydrophobicContact CD2-CG2 4.38Å; F351-V355 HydrophobicContact CE1-CG2 4.04Å; F351-V355 HydrophobicContact CE2-CG2 3.93Å; F351-V355 HydrophobicContact CZ-CG2 3.74Å; F351-V355 WeakPolarHBondContact O-CG2 3.37Å; F351-V355 PolarHBondContact O-N 3Å |
| 352 | H | 98.8 | Very high | 98.6 | Very high | 2 Ų | 2 | 39.1 Ų | 39.1 | 1% | 0.009 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -58.9 | -41.8 | 174.2 | -77.4 | -150.4 | 0 | 0 | 0 | 112.9 | N148 T151 H152 H202 H348 Q349 L350 F354 V355 V356 | N148-H352 PolarHBondContact O-CE1 3.35Å; N148-H352 PolarHBondContact O-ND1 2.88Å; T151-H352 WeakPolarHBondContact OG1-CB 3.36Å; T151-H352 PolarHBondContact OG1-ND1 3.21Å; H152-H352 AromaticContact CD2-CG 3.81Å; H152-H352 AromaticContact CD2-ND1 3.77Å; H152-H352 AromaticContact CE1-CD2 3.39Å; H152-H352 PolarHBondContact CE1-CD2 2.95Å; H152-H352 AromaticContact CE1-CE1 3.59Å; H152-H352 AromaticContact CE1-CG 3.36Å; H152-H352 AromaticContact CE1-ND1 3.52Å; H152-H352 AromaticContact CE1-NE2 3.53Å; H152-H352 AromaticContact CG-CE1 3.86Å; H152-H352 AromaticContact CG-CG 3.96Å; H152-H352 AromaticContact CG-ND1 3.48Å; H152-H352 AromaticContact ND1-CD2 3.87Å; H152-H352 AromaticContact ND1-CE1 3.26Å; H152-H352 PolarHBondContact ND1-CE1 3.3Å; H152-H352 VanDerWaalsContact ND1-CE1 3.26Å; H152-H352 AromaticContact ND1-CG 3.67Å; H152-H352 AromaticContact ND1-ND1 3.3Å; H152-H352 PolarHBondContact ND1-ND1 3.28Å; H152-H352 AromaticContact ND1-NE2 3.62Å; H152-H352 VanDerWaalsContact NE2-CA 3.34Å; H152-H352 WeakPolarHBondContact NE2-CA 3.32Å; H152-H352 WeakPolarHBondContact NE2-CB 3.46Å; H152-H352 AromaticContact NE2-CD2 3.86Å; H152-H352 AromaticContact NE2-CG 3.47Å; H152-H352 AromaticContact NE2-ND1 3.82Å; H152-H352 PolarHBondContact NE2-O 3.43Å; H202-H352 AromaticContact CD2-CE1 3.5Å; H202-H352 AromaticContact CD2-NE2 3.97Å; H202-H352 AromaticContact NE2-CE1 3.49Å; H202-H352 PolarHBondContact NE2-CE1 3.5Å; H202-H352 AromaticContact NE2-NE2 3.5Å; H202-H352 PolarHBondContact NE2-NE2 3.38Å; H348-H352 AromaticContact CD2-CD2 3.57Å; H348-H352 AromaticContact CD2-CE1 3.96Å; H348-H352 AromaticContact CD2-NE2 3.26Å; H348-H352 PolarHBondContact CD2-NE2 2.74Å; H348-H352 VanDerWaalsContact CD2-NE2 3.26Å; H348-H352 AromaticContact NE2-CD2 3.6Å; H348-H352 AromaticContact NE2-CE1 3.82Å; H348-H352 AromaticContact NE2-NE2 2.93Å; H348-H352 PolarHBondContact NE2-NE2 3.14Å; H348-H352 PolarHBondContact O-CD2 2.89Å; H348-H352 VanDerWaalsContact O-CD2 3.26Å; H348-H352 PolarHBondContact O-N 3.42Å; Q349-H352 PolarHBondContact O-N 2.92Å; L350-H352 VanDerWaalsContact C-N 3.32Å; L350-H352 PolarHBondContact O-N 3.49Å; H352-F354 VanDerWaalsContact C-N 3.34Å; H352-F354 PolarHBondContact O-N 3.24Å; H352-V355 PolarHBondContact O-N 2.88Å; H352-V356 WeakPolarHBondContact O-CG2 3.41Å; H352-V356 PolarHBondContact O-N 3.15Å; H352-V356 VanDerWaalsContact O-N 3.07Å |
| 353 | I | 98.8 | Very high | 98.6 | Very high | 78 Ų | 78 | 39.2 Ų | 39.2 | 40% | 0.4 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -64.5 | -40.4 | 175.9 | -63.9 | 164.9 | 0 | 0 | 0 | 110.6 | T151 Q349 L350 F351 V356 A357 | T151-I353 HydrophobicContact CG2-CD1 4.4Å; T151-I353 HydrophobicContact CG2-CG1 3.81Å; Q349-I353 WeakPolarHBondContact O-CG1 3.22Å; Q349-I353 PolarHBondContact O-N 2.97Å; L350-I353 WeakPolarHBondContact O-CB 3.4Å; L350-I353 PolarHBondContact O-N 3.24Å; L350-I353 VanDerWaalsContact O-N 3.08Å; F351-I353 VanDerWaalsContact C-N 3.33Å; F351-I353 PolarHBondContact O-N 3.1Å; I353-V356 PolarHBondContact O-N 3.15Å; I353-A357 VanDerWaalsContact O-CB 3.24Å; I353-A357 WeakPolarHBondContact O-CB 3.39Å; I353-A357 PolarHBondContact O-N 3.33Å |
| 354 | F | 98.7 | Very high | 98.6 | Very high | 56 Ų | 56 | 40.9 Ų | 40.9 | 25% | 0.246 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -65.2 | -36 | 175 | -89.6 | -101.4 | 0 | 0 | 0 | 113 | L320 T323 L327 L350 F351 H352 G358 | L320-F354 HydrophobicContact CB-CD1 4.28Å; L320-F354 HydrophobicContact CD2-CD1 3.68Å; L320-F354 HydrophobicContact CD2-CE1 3.74Å; L320-F354 WeakPolarHBondContact O-CD1 3.23Å; T323-F354 HydrophobicContact CG2-CE1 3.63Å; T323-F354 HydrophobicContact CG2-CE2 4.48Å; T323-F354 HydrophobicContact CG2-CZ 3.55Å; L327-F354 HydrophobicContact CD1-CD2 4.35Å; L327-F354 HydrophobicContact CD1-CE2 3.89Å; L327-F354 HydrophobicContact CD1-CZ 4.36Å; L350-F354 WeakPolarHBondContact O-CD2 3Å; L350-F354 PolarHBondContact O-N 3.42Å; F351-F354 WeakPolarHBondContact O-CB 3.03Å; F351-F354 PolarHBondContact O-N 2.99Å; F351-F354 VanDerWaalsContact O-N 3.13Å; H352-F354 VanDerWaalsContact C-N 3.34Å; H352-F354 PolarHBondContact O-N 3.24Å; F354-G358 PolarHBondContact O-N 3.34Å |
| 355 | V | 98.8 | Very high | 98.6 | Very high | 25 Ų | 25 | 35.2 Ų | 35.2 | 15% | 0.152 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -64.8 | -48.9 | 174.3 | 169.5 | 0 | 0 | 0 | 0 | 111 | L195 L226 F351 H352 G358 A359 | L195-V355 HydrophobicContact CD2-CG1 4.34Å; L226-V355 HydrophobicContact CD2-CG1 3.96Å; F351-V355 HydrophobicContact CD1-CG2 4.48Å; F351-V355 HydrophobicContact CD2-CG2 4.38Å; F351-V355 HydrophobicContact CE1-CG2 4.04Å; F351-V355 HydrophobicContact CE2-CG2 3.93Å; F351-V355 HydrophobicContact CZ-CG2 3.74Å; F351-V355 WeakPolarHBondContact O-CG2 3.37Å; F351-V355 PolarHBondContact O-N 3Å; H352-V355 PolarHBondContact O-N 2.88Å; V355-G358 PolarHBondContact O-N 3.1Å; V355-A359 WeakPolarHBondContact O-CB 3.25Å; V355-A359 PolarHBondContact O-N 3.33Å |
| 356 | V | 98.8 | Very high | 98.6 | Very high | 33 Ų | 33 | 29 Ų | 29 | 20% | 0.2 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -63.6 | -44.4 | 178.4 | 173.5 | 0 | 0 | 0 | 0 | 111.4 | F159 L195 H352 I353 F360 | F159-V356 HydrophobicContact CE2-CG1 4.46Å; L195-V356 HydrophobicContact CD2-CG2 3.91Å; H352-V356 WeakPolarHBondContact O-CG2 3.41Å; H352-V356 PolarHBondContact O-N 3.15Å; H352-V356 VanDerWaalsContact O-N 3.07Å; I353-V356 PolarHBondContact O-N 3.15Å; V356-F360 PolarHBondContact O-N 3.13Å; V356-F360 VanDerWaalsContact O-N 3.13Å |
| 357 | A | 98.7 | Very high | 98.6 | Very high | 38 Ų | 38 | 29.5 Ų | 29.5 | 31% | 0.314 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -64.5 | -43.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I353 F360 V361 | I353-A357 VanDerWaalsContact O-CB 3.24Å; I353-A357 WeakPolarHBondContact O-CB 3.39Å; I353-A357 PolarHBondContact O-N 3.33Å; A357-F360 PolarHBondContact O-N 3.19Å; A357-V361 WeakPolarHBondContact O-CG2 3.3Å; A357-V361 PolarHBondContact O-N 3.13Å |
| 358 | G | 98.6 | Very high | 98.5 | Very high | 6 Ų | 6 | 32.2 Ų | 32.2 | 6% | 0.062 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.7 | -44.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | M317 F354 V355 F360 V361 H362 | M317-G358 WeakPolarHBondContact CE-O 3.26Å; F354-G358 PolarHBondContact O-N 3.34Å; V355-G358 PolarHBondContact O-N 3.1Å; G358-F360 VanDerWaalsContact C-N 3.27Å; G358-F360 PolarHBondContact O-N 3.18Å; G358-V361 PolarHBondContact O-N 2.77Å; G358-H362 VanDerWaalsContact O-CB 3.28Å; G358-H362 WeakPolarHBondContact O-CB 3.04Å; G358-H362 PolarHBondContact O-N 3.48Å |
| 359 | A | 98.8 | Very high | 98.4 | Very high | 8 Ų | 8 | 31.6 Ų | 31.6 | 7% | 0.066 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -60.7 | -36.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F159 F187 L226 V355 F363 | F159-A359 HydrophobicContact CE1-CB 4.17Å; F159-A359 HydrophobicContact CE2-CB 3.85Å; F159-A359 HydrophobicContact CZ-CB 3.47Å; F159-A359 VanDerWaalsContact CZ-CB 3.47Å; F187-A359 WeakPolarHBondContact CZ-O 3.3Å; L226-A359 HydrophobicContact CD1-CB 4.39Å; V355-A359 WeakPolarHBondContact O-CB 3.25Å; V355-A359 PolarHBondContact O-N 3.33Å; A359-F363 WeakPolarHBondContact O-CB 3.11Å; A359-F363 PolarHBondContact O-N 2.63Å |
| 360 | F | 98.8 | Very high | 98.3 | Very high | 92 Ų | 92 | 30.9 Ų | 30.9 | 40% | 0.404 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -76.1 | -41.2 | 179.2 | -177.9 | -108.6 | 0 | 0 | 0 | 112.8 | F158 F159 L162 V356 A357 G358 H362 F363 H364 | F158-F360 AromaticContact CE1-CD2 3.78Å; F158-F360 HydrophobicContact CE1-CD2 3.78Å; F158-F360 HydrophobicContact CE1-CE2 4.38Å; F158-F360 HydrophobicContact CE1-CG 4.48Å; F158-F360 AromaticContact CZ-CD2 3.71Å; F158-F360 HydrophobicContact CZ-CD2 3.71Å; F158-F360 AromaticContact CZ-CE2 3.84Å; F158-F360 HydrophobicContact CZ-CE2 3.84Å; F159-F360 HydrophobicContact CZ-CB 4.13Å; L162-F360 HydrophobicContact CD2-CD2 4.44Å; V356-F360 PolarHBondContact O-N 3.13Å; V356-F360 VanDerWaalsContact O-N 3.13Å; A357-F360 PolarHBondContact O-N 3.19Å; G358-F360 VanDerWaalsContact C-N 3.27Å; G358-F360 PolarHBondContact O-N 3.18Å; F360-H362 VanDerWaalsContact C-N 3.31Å; F360-H362 PolarHBondContact O-N 3Å; F360-F363 HydrophobicContact CD2-CD1 4.31Å; F360-F363 HydrophobicContact CE2-CD1 4.25Å; F360-F363 PolarHBondContact O-N 3.4Å; F360-H364 WeakPolarHBondContact O-CB 3.2Å; F360-H364 PolarHBondContact O-N 2.83Å |
| 361 | V | 98.6 | Very high | 98.1 | Very high | 25 Ų | 25 | 33 Ų | 33 | 15% | 0.152 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.7 | -39.8 | 173.2 | 170.5 | 0 | 0 | 0 | 0 | 110.9 | W313 L316 M317 L320 A357 G358 H364 G365 | W313-V361 HydrophobicContact CE3-CG1 3.97Å; W313-V361 HydrophobicContact CZ3-CG1 4.32Å; L316-V361 HydrophobicContact CD2-CG1 3.66Å; L316-V361 HydrophobicContact CD2-CG2 4.24Å; L316-V361 HydrophobicContact CG-CG1 3.96Å; M317-V361 HydrophobicContact CG-CG1 4.22Å; M317-V361 HydrophobicContact SD-CB 3.87Å; M317-V361 HydrophobicContact SD-CG1 3.67Å; L320-V361 HydrophobicContact CD1-CB 4.18Å; L320-V361 HydrophobicContact CD1-CG1 4.39Å; L320-V361 HydrophobicContact CD1-CG2 4.04Å; A357-V361 WeakPolarHBondContact O-CG2 3.3Å; A357-V361 PolarHBondContact O-N 3.13Å; G358-V361 PolarHBondContact O-N 2.77Å; V361-H364 PolarHBondContact O-N 3.18Å; V361-G365 PolarHBondContact O-N 3.49Å |
| 362 | H | 98.6 | Very high | 97.9 | Very high | 23 Ų | 23 | 35.1 Ų | 35.1 | 11% | 0.106 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.3 | -52.4 | 172.3 | 175.4 | 79.6 | 0 | 0 | 0 | 111.3 | F187 S230 M317 G358 F360 H364 G365 V366 | F187-H362 AromaticContact CD2-CD2 3.72Å; F187-H362 AromaticContact CE2-CD2 3.54Å; S230-H362 PolarHBondContact O-CE1 3.14Å; S230-H362 PolarHBondContact O-NE2 2.85Å; S230-H362 VanDerWaalsContact O-NE2 3.1Å; M317-H362 HydrophobicContact CE-CB 3.92Å; M317-H362 HydrophobicContact SD-CB 3.92Å; M317-H362 PolarHBondContact SD-N 2.99Å; G358-H362 VanDerWaalsContact O-CB 3.28Å; G358-H362 WeakPolarHBondContact O-CB 3.04Å; G358-H362 PolarHBondContact O-N 3.48Å; F360-H362 VanDerWaalsContact C-N 3.31Å; F360-H362 PolarHBondContact O-N 3Å; H362-H364 VanDerWaalsContact C-N 3.29Å; H362-H364 PolarHBondContact O-N 3.25Å; H362-G365 PolarHBondContact O-N 2.03Å; H362-G365 VanDerWaalsContact O-N 3.08Å; H362-V366 WeakPolarHBondContact O-CG2 3.32Å; H362-V366 PolarHBondContact O-N 3.07Å |
| 363 | F | 98.6 | Very high | 97.7 | Very high | 21 Ų | 21 | 36.1 Ų | 36.1 | 9% | 0.092 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -53.6 | -45.4 | 177.1 | 169.1 | -103 | 0 | 0 | 0 | 112.1 | L162 Y166 F184 F187 F188 A359 F360 V366 S367 | L162-F363 HydrophobicContact CD1-CE1 4.07Å; L162-F363 HydrophobicContact CD1-CZ 4.2Å; L162-F363 HydrophobicContact CD2-CD1 3.87Å; L162-F363 HydrophobicContact CD2-CE1 3.88Å; L162-F363 HydrophobicContact CD2-CG 4.31Å; L162-F363 HydrophobicContact CD2-CZ 4.34Å; L162-F363 HydrophobicContact CG-CE1 4.28Å; L162-F363 HydrophobicContact CG-CZ 4.34Å; Y166-F363 AromaticContact CD2-CE2 3.86Å; Y166-F363 HydrophobicContact CD2-CE2 3.86Å; Y166-F363 HydrophobicContact CD2-CZ 4.01Å; Y166-F363 HydrophobicContact CE2-CE2 4.05Å; Y166-F363 HydrophobicContact CE2-CZ 4.3Å; F184-F363 HydrophobicContact CD1-CD2 4.2Å; F184-F363 HydrophobicContact CD1-CE2 4.03Å; F184-F363 AromaticContact CE1-CD2 3.93Å; F184-F363 HydrophobicContact CE1-CD2 3.93Å; F184-F363 AromaticContact CE1-CE2 3.78Å; F184-F363 HydrophobicContact CE1-CE2 3.78Å; F187-F363 HydrophobicContact CE1-CB 3.83Å; F187-F363 HydrophobicContact CE1-CD2 4.09Å; F187-F363 HydrophobicContact CE1-CG 4.36Å; F187-F363 HydrophobicContact CZ-CB 4.04Å; F188-F363 HydrophobicContact CE1-CD2 4.33Å; F188-F363 HydrophobicContact CE1-CE2 4.44Å; F188-F363 HydrophobicContact CE2-CD2 4.5Å; F188-F363 HydrophobicContact CE2-CE2 4.2Å; F188-F363 AromaticContact CZ-CD2 3.76Å; F188-F363 HydrophobicContact CZ-CD2 3.76Å; F188-F363 AromaticContact CZ-CE2 3.54Å; F188-F363 HydrophobicContact CZ-CE2 3.54Å; F188-F363 HydrophobicContact CZ-CZ 4.34Å; A359-F363 WeakPolarHBondContact O-CB 3.11Å; A359-F363 PolarHBondContact O-N 2.63Å; F360-F363 HydrophobicContact CD2-CD1 4.31Å; F360-F363 HydrophobicContact CE2-CD1 4.25Å; F360-F363 PolarHBondContact O-N 3.4Å; F363-V366 WeakPolarHBondContact O-CG2 3.29Å; F363-V366 PolarHBondContact O-N 3.39Å; F363-S367 VanDerWaalsContact O-CB 3.31Å; F363-S367 WeakPolarHBondContact O-CB 3.24Å; F363-S367 PolarHBondContact O-N 3.11Å |
| 364 | H | 98.3 | Very high | 97.6 | Very high | 69 Ų | 69 | 36.6 Ų | 36.6 | 32% | 0.319 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60.8 | -45.7 | 176.2 | -174.9 | -86.5 | 0 | 0 | 0 | 111.8 | W313 F360 V361 H362 V366 S367 N368 | W313-H364 AromaticContact CE2-ND1 3.89Å; W313-H364 AromaticContact CH2-CE1 3.37Å; W313-H364 WeakPolarHBondContact CH2-CE1 3.29Å; W313-H364 AromaticContact CH2-ND1 3.24Å; W313-H364 WeakPolarHBondContact CH2-ND1 3.43Å; W313-H364 AromaticContact CZ2-CE1 3.36Å; W313-H364 WeakPolarHBondContact CZ2-CE1 3.43Å; W313-H364 AromaticContact CZ2-ND1 3.35Å; W313-H364 WeakPolarHBondContact CZ2-ND1 3.41Å; W313-H364 AromaticContact CZ3-ND1 3.7Å; F360-H364 WeakPolarHBondContact O-CB 3.2Å; F360-H364 PolarHBondContact O-N 2.83Å; V361-H364 PolarHBondContact O-N 3.18Å; H362-H364 VanDerWaalsContact C-N 3.29Å; H362-H364 PolarHBondContact O-N 3.25Å; H364-V366 PolarHBondContact O-N 3.27Å; H364-S367 PolarHBondContact O-N 3.02Å; H364-N368 PolarHBondContact CE1-ND2 3.34Å; H364-N368 PolarHBondContact O-N 3.44Å; H364-N368 PolarHBondContact O-OD1 2.99Å |
| 365 | G | 97.8 | Very high | 97.4 | Very high | 9 Ų | 9 | 41.1 Ų | 41.1 | 9% | 0.093 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -58.7 | -46.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V361 H362 N368 L369 | V361-G365 PolarHBondContact O-N 3.49Å; H362-G365 PolarHBondContact O-N 2.03Å; H362-G365 VanDerWaalsContact O-N 3.08Å; G365-N368 PolarHBondContact O-N 3.26Å; G365-L369 PolarHBondContact O-N 3.31Å; G365-L369 VanDerWaalsContact O-N 3.16Å |
| 366 | V | 98.1 | Very high | 97.1 | Very high | 2 Ų | 2 | 44.4 Ų | 44.4 | 1% | 0.012 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -75.7 | -27.1 | 178.6 | -62 | 0 | 0 | 0 | 0 | 113.4 | F184 P233 W234 H362 F363 H364 L369 Q370 | F184-V366 HydrophobicContact CD1-CG2 4.48Å; F184-V366 HydrophobicContact CE1-CB 4.48Å; F184-V366 HydrophobicContact CE1-CG2 3.64Å; F184-V366 HydrophobicContact CZ-CB 4.19Å; F184-V366 HydrophobicContact CZ-CG2 3.83Å; P233-V366 HydrophobicContact CB-CB 4.29Å; P233-V366 HydrophobicContact CB-CG1 4.42Å; P233-V366 HydrophobicContact CB-CG2 4.34Å; P233-V366 HydrophobicContact CG-CB 4.47Å; P233-V366 HydrophobicContact CG-CG1 4.32Å; P233-V366 HydrophobicContact CG-CG2 4.2Å; W234-V366 HydrophobicContact CB-CG1 3.77Å; H362-V366 WeakPolarHBondContact O-CG2 3.32Å; H362-V366 PolarHBondContact O-N 3.07Å; F363-V366 WeakPolarHBondContact O-CG2 3.29Å; F363-V366 PolarHBondContact O-N 3.39Å; H364-V366 PolarHBondContact O-N 3.27Å; V366-L369 PolarHBondContact O-N 3.31Å; V366-Q370 PolarHBondContact O-N 3.08Å |
| 367 | S | 97.9 | Very high | 96.7 | Very high | 12 Ų | 12 | 43.9 Ų | 43.9 | 8% | 0.084 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -65.4 | -40.4 | 170.5 | -165.4 | 0 | 0 | 0 | 0 | 111.2 | F363 H364 L369 Q370 E371 | F363-S367 VanDerWaalsContact O-CB 3.31Å; F363-S367 WeakPolarHBondContact O-CB 3.24Å; F363-S367 PolarHBondContact O-N 3.11Å; H364-S367 PolarHBondContact O-N 3.02Å; S367-L369 VanDerWaalsContact C-N 3.34Å; S367-L369 PolarHBondContact O-N 2.9Å; S367-Q370 WeakPolarHBondContact O-CB 3.34Å; S367-Q370 PolarHBondContact O-N 3.04Å; S367-E371 PolarHBondContact O-N 3.36Å |
| 368 | N | 96.9 | Very high | 96.4 | Very high | 60 Ų | 60 | 43.9 Ų | 43.9 | 32% | 0.321 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -68.6 | -33.5 | 176.4 | -69.1 | 14.1 | 0 | 0 | 0 | 112.1 | H364 G365 E371 F372 | H364-N368 PolarHBondContact CE1-ND2 3.34Å; H364-N368 PolarHBondContact O-N 3.44Å; H364-N368 PolarHBondContact O-OD1 2.99Å; G365-N368 PolarHBondContact O-N 3.26Å; N368-E371 PolarHBondContact O-N 3.02Å; N368-F372 WeakPolarHBondContact O-CB 3.37Å; N368-F372 PolarHBondContact O-N 2.88Å |
| 369 | L | 96.3 | Very high | 95.9 | Very high | 13 Ų | 13 | 46.4 Ų | 46.4 | 7% | 0.068 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.2 | -38.3 | 170.5 | -81.8 | 161.2 | 0 | 0 | 0 | 112.4 | Y237 I308 Q310 G365 V366 S367 R373 | Y237-L369 HydrophobicContact CD2-CB 4.13Å; Y237-L369 HydrophobicContact CG-CB 4.03Å; I308-L369 HydrophobicContact CG2-CD2 3.63Å; Q310-L369 HydrophobicContact CG-CD2 4.11Å; G365-L369 PolarHBondContact O-N 3.31Å; G365-L369 VanDerWaalsContact O-N 3.16Å; V366-L369 PolarHBondContact O-N 3.31Å; S367-L369 VanDerWaalsContact C-N 3.34Å; S367-L369 PolarHBondContact O-N 2.9Å; L369-R373 WeakPolarHBondContact O-CB 3.34Å; L369-R373 PolarHBondContact O-N 3.21Å |
| 370 | Q | 97.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.3 | -49 | 173.5 | -170.4 | -79.5 | -28.5 | 0 | 0 | 111.4 | S173 E180 F184 Y237 V366 S367 F372 R373 F374 | S173-Q370 PolarHBondContact O-NE2 3.26Å; E180-Q370 VanDerWaalsContact OE2-CG 3.23Å; E180-Q370 WeakPolarHBondContact OE2-CG 3.41Å; E180-Q370 PolarHBondContact OE2-NE2 3.43Å; F184-Q370 HydrophobicContact CE2-CB 4.14Å; F184-Q370 HydrophobicContact CE2-CG 4.34Å; F184-Q370 HydrophobicContact CZ-CB 4.29Å; Y237-Q370 HydrophobicContact CE1-CB 4.12Å; Y237-Q370 HydrophobicContact CE1-CG 4.16Å; Y237-Q370 HydrophobicContact CE2-CB 4.1Å; Y237-Q370 VanDerWaalsContact OH-CG 3.29Å; Y237-Q370 WeakPolarHBondContact OH-CG 3.42Å; V366-Q370 PolarHBondContact O-N 3.08Å; S367-Q370 WeakPolarHBondContact O-CB 3.34Å; S367-Q370 PolarHBondContact O-N 3.04Å; Q370-F372 VanDerWaalsContact C-N 3.33Å; Q370-F372 PolarHBondContact O-N 3.46Å; Q370-R373 CarbonylContact O-C 3.58Å; Q370-R373 PolarHBondContact O-N 2.75Å; Q370-R373 VanDerWaalsContact O-N 3.13Å; Q370-F374 PolarHBondContact O-N 3.17Å |
| 371 | E | 95.5 | Very high | 94.4 | Very high | 81 Ų | 81 | 47 Ų | 47 | 38% | 0.379 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -68.6 | -32.9 | -177.5 | -67.7 | -174.9 | 172.1 | 0 | 0 | 111.5 | R169 S367 N368 F374 M375 | R169-E371 IonicContact CZ-OE1 3.06Å; R169-E371 IonicContact NH1-OE1 2.82Å; R169-E371 PolarHBondContact NH1-OE1 2.8Å; R169-E371 IonicContact NH2-OE1 2.89Å; R169-E371 PolarHBondContact NH2-OE1 2.84Å; S367-E371 PolarHBondContact O-N 3.36Å; N368-E371 PolarHBondContact O-N 3.02Å; E371-F374 PolarHBondContact O-N 2.76Å; E371-M375 WeakPolarHBondContact O-CG 3.27Å; E371-M375 PolarHBondContact O-N 3.2Å; E371-M375 VanDerWaalsContact O-N 3.1Å |
| 372 | F | 94.4 | Very high | 92.3 | Very high | 84 Ų | 84 | 54.4 Ų | 54.4 | 37% | 0.368 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -61.9 | -47.8 | 167.6 | 178.1 | -101.9 | 0 | 0 | 0 | 112.2 | I308 N368 Q370 F374 M375 I376 | I308-F372 HydrophobicContact CD1-CD1 4.18Å; I308-F372 HydrophobicContact CD1-CE1 3.51Å; I308-F372 HydrophobicContact CD1-CZ 3.78Å; I308-F372 HydrophobicContact CG1-CD1 4.18Å; I308-F372 HydrophobicContact CG1-CD2 4.46Å; I308-F372 HydrophobicContact CG1-CE1 3.76Å; I308-F372 HydrophobicContact CG1-CE2 4.07Å; I308-F372 HydrophobicContact CG1-CZ 3.71Å; I308-F372 HydrophobicContact CG2-CD1 4.36Å; N368-F372 WeakPolarHBondContact O-CB 3.37Å; N368-F372 PolarHBondContact O-N 2.88Å; Q370-F372 VanDerWaalsContact C-N 3.33Å; Q370-F372 PolarHBondContact O-N 3.46Å; F372-F374 VanDerWaalsContact C-N 3.3Å; F372-F374 PolarHBondContact O-N 2.74Å; F372-M375 PolarHBondContact O-N 3.43Å; F372-M375 VanDerWaalsContact O-N 3.15Å; F372-I376 HydrophobicContact CD1-CD1 4.26Å; F372-I376 HydrophobicContact CE1-CD1 3.68Å; F372-I376 HydrophobicContact CE2-CG2 4.32Å; F372-I376 HydrophobicContact CZ-CD1 4.14Å; F372-I376 HydrophobicContact CZ-CG2 4.2Å; F372-I376 PolarHBondContact O-N 2.83Å |
| 373 | R | 94.9 | Very high | 90.3 | Very high | 23 Ų | 23 | 61.7 Ų | 61.7 | 9% | 0.087 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -62.6 | -35.3 | 176.5 | 177.1 | 50.8 | 66.2 | -179.1 | 4 | 112 | V175 Y237 Y240 L369 Q370 G377 G379 | V175-R373 HydrophobicContact CG2-CG 4.41Å; Y237-R373 HydrophobicContact CD1-CB 3.94Å; Y237-R373 HydrophobicContact CD1-CG 4.18Å; Y237-R373 HydrophobicContact CE1-CB 4.2Å; Y237-R373 HydrophobicContact CE1-CG 4.29Å; Y240-R373 HydrophobicContact CD2-CG 4.28Å; Y240-R373 HydrophobicContact CE2-CG 4Å; L369-R373 WeakPolarHBondContact O-CB 3.34Å; L369-R373 PolarHBondContact O-N 3.21Å; Q370-R373 CarbonylContact O-C 3.58Å; Q370-R373 PolarHBondContact O-N 2.75Å; Q370-R373 VanDerWaalsContact O-N 3.13Å; R373-G377 WeakPolarHBondContact CD-O 3.3Å; R373-G377 PolarHBondContact NH1-O 3.42Å; R373-G377 WeakPolarHBondContact O-CA 3.29Å; R373-G377 PolarHBondContact O-N 3.41Å; R373-G379 PolarHBondContact NH1-O 3.12Å |
| 374 | F | 95.7 | Very high | 88.2 | Confident | 88 Ų | 88 | 63.1 Ų | 63.1 | 39% | 0.386 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.9 | -41.4 | 173 | -179.4 | -105.1 | 0 | 0 | 0 | 112.3 | I172 S173 V175 Q370 E371 F372 | I172-F374 WeakPolarHBondContact O-CE2 3.34Å; I172-F374 VanDerWaalsContact O-CZ 3.24Å; I172-F374 WeakPolarHBondContact O-CZ 3.25Å; S173-F374 VanDerWaalsContact C-CD2 3.49Å; V175-F374 HydrophobicContact CG2-CD2 4.38Å; Q370-F374 PolarHBondContact O-N 3.17Å; E371-F374 PolarHBondContact O-N 2.76Å; F372-F374 VanDerWaalsContact C-N 3.3Å; F372-F374 PolarHBondContact O-N 2.74Å |
| 375 | M | 93.9 | Very high | 85.6 | Confident | 151 Ų | 151 | 62.6 Ų | 62.6 | 74% | 0.744 | 35% | 0.354 | S | S | * | . | H | α-helix | trans | -68.5 | -32 | 179.3 | -71.1 | -61.6 | -59.7 | 0 | 0 | 114.3 | E371 F372 | E371-M375 WeakPolarHBondContact O-CG 3.27Å; E371-M375 PolarHBondContact O-N 3.2Å; E371-M375 VanDerWaalsContact O-N 3.1Å; F372-M375 PolarHBondContact O-N 3.43Å; F372-M375 VanDerWaalsContact O-N 3.15Å |
| 376 | I | 92.1 | Very high | 82.5 | Confident | 94 Ų | 94 | 71.1 Ų | 71.1 | 48% | 0.482 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -94.9 | -14.1 | 177 | 66.5 | 173 | 0 | 0 | 0 | 113.8 | F372 | F372-I376 HydrophobicContact CD1-CD1 4.26Å; F372-I376 HydrophobicContact CE1-CD1 3.68Å; F372-I376 HydrophobicContact CE2-CG2 4.32Å; F372-I376 HydrophobicContact CZ-CD1 4.14Å; F372-I376 HydrophobicContact CZ-CG2 4.2Å; F372-I376 PolarHBondContact O-N 2.83Å |
| 377 | G | 92.3 | Very high | 81.8 | Confident | 22 Ų | 22 | 74.6 Ų | 74.6 | 23% | 0.227 | 42% | 0.416 | C | S | . | . | trans | 79.5 | 178.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | R373 G379 | R373-G377 WeakPolarHBondContact CD-O 3.3Å; R373-G377 PolarHBondContact NH1-O 3.42Å; R373-G377 WeakPolarHBondContact O-CA 3.29Å; R373-G377 PolarHBondContact O-N 3.41Å; G377-G379 VanDerWaalsContact C-N 3.29Å; G377-G379 PolarHBondContact O-N 2.97Å | ||
| 378 | G | 90.6 | Very high | 80.9 | Confident | 39 Ų | 39 | 77.8 Ų | 77.8 | 40% | 0.402 | 43% | 0.434 | S | S | . | . | S | Bend | trans | -82.9 | 2.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | V175 | V175-G378 VanDerWaalsContact CG1-CA 3.49Š|
| 379 | G | 90.2 | Very high | 80 | Confident | 58 Ų | 58 | 78.8 Ų | 78.8 | 60% | 0.598 | 44% | 0.44 | S | S | * | . | trans | -71.2 | 147 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | R373 G377 | R373-G379 PolarHBondContact NH1-O 3.12Å; G377-G379 VanDerWaalsContact C-N 3.29Å; G377-G379 PolarHBondContact O-N 2.97Å | ||
| 380 | C | 87.9 | Confident | 79.1 | Confident | 57 Ų | 57 | 82.7 Ų | 82.7 | 39% | 0.385 | 46% | 0.462 | S | S | . | . | trans | -124.3 | 133.9 | 164.1 | -61.5 | 0 | 0 | 0 | 0 | 106.3 | C241 D384 | C241-C380 WeakPolarHBondContact CA-SG 3.24Å; C241-C380 HydrophobicContact CB-CB 3.69Å; C241-C380 WeakPolarHBondContact CB-SG 3.35Å; C241-C380 WeakPolarHBondContact SG-CB 3.36Å; C241-C380 CovalentContact SG-SG 2.03Å; C241-C380 PolarHBondContact SG-SG 3.24Å; C380-D384 HydrophobicContact CB-CB 4.33Å | ||
| 381 | S | 77.3 | Confident | 77.9 | Confident | 57 Ų | 57 | 87.9 Ų | 87.9 | 40% | 0.399 | 49% | 0.491 | S | S | . | . | trans | -78.7 | 166.7 | 172.1 | 72.7 | 0 | 0 | 0 | 0 | 110.3 | E383 D384 | S381-E383 PolarHBondContact O-N 2.97Å; S381-E383 PolarHBondContact OG-N 3.05Å; S381-D384 WeakPolarHBondContact CB-OD2 3.42Å; S381-D384 PolarHBondContact N-OD2 2.65Å; S381-D384 VanDerWaalsContact N-OD2 3.11Å; S381-D384 PolarHBondContact O-N 3.35Å; S381-D384 PolarHBondContact OG-N 3.25Å; S381-D384 PolarHBondContact OG-OD2 2.83Å | ||
| 382 | E | 54.2 | Low | 76.8 | Confident | 179 Ų | 179 | 88.3 Ų | 88.3 | 84% | 0.836 | 50% | 0.498 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.6 | -13.8 | 173.9 | -57.1 | -136.5 | 142.4 | 0 | 0 | 112.6 | ||
| 383 | E | 57.4 | Low | 75.5 | Confident | 177 Ų | 177 | 88.6 Ų | 88.6 | 83% | 0.827 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -81.7 | -21.2 | 167.7 | -71.1 | -169.3 | 129.3 | 0 | 0 | 113.3 | S381 A385 | S381-E383 PolarHBondContact O-N 2.97Å; S381-E383 PolarHBondContact OG-N 3.05Å; E383-A385 PolarHBondContact O-N 3Å |
| 384 | D | 53.6 | Low | 74 | Confident | 50 Ų | 50 | 93.7 Ų | 93.7 | 27% | 0.267 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.7 | 6.5 | 174.6 | -63.6 | -78.7 | 0 | 0 | 0 | 113 | C241 K304 C380 S381 | C241-D384 HydrophobicContact CB-CB 4.14Å; C241-D384 WeakPolarHBondContact CB-O 3.45Å; K304-D384 IonicContact NZ-OD1 3.32Å; K304-D384 PolarHBondContact NZ-OD1 2.86Å; C380-D384 HydrophobicContact CB-CB 4.33Å; S381-D384 WeakPolarHBondContact CB-OD2 3.42Å; S381-D384 PolarHBondContact N-OD2 2.65Å; S381-D384 VanDerWaalsContact N-OD2 3.11Å; S381-D384 PolarHBondContact O-N 3.35Å; S381-D384 PolarHBondContact OG-N 3.25Å; S381-D384 PolarHBondContact OG-OD2 2.83Å |
| 385 | A | 42.9 | Very low | 72.2 | Confident | 58 Ų | 58 | 94.2 Ų | 94.2 | 48% | 0.479 | 55% | 0.553 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -123.9 | 4.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | E383 | E383-A385 PolarHBondContact O-N 3Š|
| 386 | L | 34.3 | Very low | 70.3 | Confident | 188 Ų | 188 | 89 Ų | 89 | 98% | 0.984 | 54% | 0.535 | S | S | * | . | trans | -106.4 | 0 | -179.1 | -73.2 | 167 | 0 | 0 | 0 | 112.6 |
Retrieved 386 of 386 residues in 245.3 ms
(Link to these results)