| 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 | 42.6 | Very low | 49.8 | Very low | 233 Ų | 233 | 148.5 Ų | 148.5 | 100% | 1.148 | 87% | 0.872 | S | S | * | * | 0 | 126.6 | 0 | -49.7 | 172.3 | -165.8 | 0 | 0 | 106.3 | |||||
| 2 | F | 47.5 | Very low | 51.3 | Low | 208 Ų | 208 | 146.1 Ų | 146.1 | 91% | 0.912 | 86% | 0.863 | S | S | * | * | cis | -105.1 | -179.8 | -4.6 | -100.5 | -103.4 | 0 | 0 | 0 | 111.9 | ||||
| 3 | I | 49.3 | Very low | 50.9 | Low | 170 Ų | 170 | 147 Ų | 147 | 87% | 0.872 | 86% | 0.862 | S | S | * | * | trans | -127.8 | 146.2 | -174.2 | -67.2 | 172.5 | 0 | 0 | 0 | 109.9 | ||||
| 4 | G | 48.5 | Very low | 51.1 | Low | 71 Ų | 71 | 142.1 Ų | 142.1 | 73% | 0.732 | 85% | 0.846 | S | S | * | * | trans | 111.7 | 154.1 | 155.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 5 | A | 53.5 | Low | 50.7 | Low | 105 Ų | 105 | 142 Ų | 142 | 87% | 0.868 | 84% | 0.84 | S | S | * | * | cis | -157.7 | 155.1 | -13.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 6 | L | 48.2 | Very low | 50.5 | Low | 175 Ų | 175 | 143 Ų | 143 | 92% | 0.916 | 84% | 0.839 | S | S | * | * | trans | -86.8 | 137.7 | 175.4 | -74.5 | 151.9 | 0 | 0 | 0 | 111.7 | ||||
| 7 | K | 53.4 | Low | 50.4 | Low | 215 Ų | 215 | 142.1 Ų | 142.1 | 94% | 0.935 | 84% | 0.843 | S | S | * | * | trans | -149.2 | 154.3 | 146.3 | -148.3 | 78.1 | 179.9 | -170.6 | 0 | 109.3 | ||||
| 8 | A | 45.9 | Very low | 50.2 | Low | 91 Ų | 91 | 140.3 Ų | 140.3 | 75% | 0.752 | 84% | 0.838 | S | S | * | * | trans | -119.6 | 159 | -164.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 9 | A | 46.7 | Very low | 50 | Low | 102 Ų | 102 | 139.4 Ų | 139.4 | 84% | 0.843 | 84% | 0.839 | S | S | * | * | trans | 30.9 | 124.7 | 147.4 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 10 | T | 57.8 | Low | 49.9 | Very low | 132 Ų | 132 | 136.4 Ų | 136.4 | 81% | 0.81 | 83% | 0.83 | S | S | * | * | -148.2 | 154 | 125.6 | -163.9 | 0 | 0 | 0 | 0 | 110.4 | |||||
| 11 | V | 54.9 | Low | 49.8 | Very low | 132 Ų | 132 | 139.1 Ų | 139.1 | 80% | 0.8 | 83% | 0.834 | S | S | * | * | trans | -146.2 | 131.7 | 173.2 | -178.5 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 12 | P | 67.5 | Low | 50.2 | Low | 119 Ų | 119 | 131.9 Ų | 131.9 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -114.5 | 167.9 | 158.8 | 35.1 | -24.2 | 0 | 0 | 0 | 112.5 | ||||
| 13 | D | 46.4 | Very low | 50.1 | Low | 158 Ų | 158 | 128 Ų | 128 | 85% | 0.845 | 81% | 0.806 | S | S | * | * | trans | -115.2 | 173.1 | -163.2 | -150.6 | -42.5 | 0 | 0 | 0 | 112.7 | ||||
| 14 | A | 53.3 | Low | 50.3 | Low | 78 Ų | 78 | 126.9 Ų | 126.9 | 65% | 0.645 | 81% | 0.807 | S | S | * | * | trans | 67.8 | 162.2 | 168.5 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 15 | N | 44.8 | Very low | 49.9 | Very low | 141 Ų | 141 | 131.5 Ų | 131.5 | 75% | 0.754 | 81% | 0.81 | S | S | * | * | cis | -148.6 | 174.6 | 15.8 | -152.4 | -67.2 | 0 | 0 | 0 | 112.7 | ||||
| 16 | L | 47.8 | Very low | 49.3 | Very low | 158 Ų | 158 | 133.1 Ų | 133.1 | 83% | 0.827 | 80% | 0.803 | S | S | * | * | trans | -53.4 | 153.9 | -173.2 | -58.3 | 161.8 | 0 | 0 | 0 | 117.1 | ||||
| 17 | S | 49.1 | Very low | 49.1 | Very low | 128 Ų | 128 | 134.2 Ų | 134.2 | 90% | 0.895 | 80% | 0.801 | S | S | * | * | -148.4 | 155.5 | 129.9 | -167 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 18 | S | 46.3 | Very low | 48.3 | Very low | 109 Ų | 109 | 128.9 Ų | 128.9 | 76% | 0.762 | 79% | 0.79 | S | S | * | * | trans | -131.5 | 148.5 | -166.7 | -179.1 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 19 | S | 47 | Very low | 48.1 | Very low | 123 Ų | 123 | 130.2 Ų | 130.2 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -155.5 | 156 | 152.7 | -163.1 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 20 | A | 47 | Very low | 47.7 | Very low | 79 Ų | 79 | 132.5 Ų | 132.5 | 65% | 0.653 | 80% | 0.798 | S | S | * | * | trans | -133.1 | -164.9 | -165.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 21 | H | 47.8 | Very low | 46.9 | Very low | 195 Ų | 195 | 131.7 Ų | 131.7 | 90% | 0.903 | 80% | 0.798 | S | S | * | * | trans | 90.8 | 137.3 | -171.3 | -67.3 | -94.7 | 0 | 0 | 0 | 115.3 | ||||
| 22 | A | 51.5 | Low | 46 | Very low | 80 Ų | 80 | 131.3 Ų | 131.3 | 66% | 0.661 | 80% | 0.801 | S | S | * | * | cis | -158.1 | 155.8 | -13.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 23 | P | 44.9 | Very low | 44.7 | Very low | 127 Ų | 127 | 129 Ų | 129 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | trans | -99.2 | 140.1 | 175.7 | 36.3 | -30.9 | 0 | 0 | 0 | 113.2 | ||||
| 24 | V | 53 | Low | 44.3 | Very low | 146 Ų | 146 | 127.2 Ų | 127.2 | 89% | 0.885 | 79% | 0.792 | S | S | * | * | trans | -139.1 | 144.7 | 166.6 | -172.1 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 25 | Q | 41 | Very low | 44 | Very low | 169 Ų | 169 | 131.7 Ų | 131.7 | 79% | 0.79 | 80% | 0.799 | S | S | * | * | trans | -96.1 | 170.1 | -173.7 | -80.1 | -83.3 | 14.8 | 0 | 0 | 113.2 | ||||
| 26 | L | 40.8 | Very low | 43.8 | Very low | 139 Ų | 139 | 134.5 Ų | 134.5 | 73% | 0.728 | 81% | 0.807 | S | S | * | * | trans | 64.2 | 115.1 | 160.4 | -67.2 | 152.7 | 0 | 0 | 0 | 118.1 | ||||
| 27 | F | 44.2 | Very low | 43.9 | Very low | 198 Ų | 198 | 132 Ų | 132 | 87% | 0.868 | 80% | 0.803 | S | S | * | * | -160.2 | 149.3 | 91 | -123.8 | -90.7 | 0 | 0 | 0 | 112.6 | |||||
| 28 | S | 35.6 | Very low | 44.1 | Very low | 103 Ų | 103 | 131.2 Ų | 131.2 | 72% | 0.72 | 79% | 0.793 | S | S | * | * | trans | -82.6 | 133.2 | 179.2 | -56.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 29 | S | 42.7 | Very low | 44.8 | Very low | 119 Ų | 119 | 131 Ų | 131 | 83% | 0.832 | 79% | 0.789 | S | S | * | * | trans | -146 | 97.6 | 166.1 | -84.2 | 0 | 0 | 0 | 0 | 110.7 | S31 | S29-S31 PolarHBondContact O-N 3.09Š| ||
| 30 | T | 37.3 | Very low | 44.8 | Very low | 150 Ų | 150 | 133.7 Ų | 133.7 | 92% | 0.92 | 79% | 0.786 | S | S | * | * | trans | -71.2 | 114.5 | 172.4 | 47 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 31 | S | 42.5 | Very low | 45.9 | Very low | 115 Ų | 115 | 132.5 Ų | 132.5 | 80% | 0.804 | 77% | 0.773 | S | S | * | * | trans | -128.5 | 106.2 | 169.1 | -163.1 | 0 | 0 | 0 | 0 | 110.4 | S29 A33 | S29-S31 PolarHBondContact O-N 3.09Å; S31-A33 PolarHBondContact O-N 2.7Å; S31-A33 VanDerWaalsContact O-N 3.11Å | ||
| 32 | S | 34.8 | Very low | 46.2 | Very low | 124 Ų | 124 | 128.1 Ų | 128.1 | 87% | 0.867 | 76% | 0.759 | S | S | * | * | trans | -79.1 | 85.9 | -178.8 | 52.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 33 | A | 41.5 | Very low | 47 | Very low | 70 Ų | 70 | 128.4 Ų | 128.4 | 58% | 0.579 | 75% | 0.753 | S | S | * | * | trans | -88.9 | 105.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | S31 H35 | S31-A33 PolarHBondContact O-N 2.7Å; S31-A33 VanDerWaalsContact O-N 3.11Å; A33-H35 PolarHBondContact O-N 2.11Å | ||
| 34 | S | 36.9 | Very low | 47.8 | Very low | 121 Ų | 121 | 127.5 Ų | 127.5 | 85% | 0.846 | 74% | 0.741 | S | S | * | * | trans | -76.2 | 82.6 | -178.4 | 40.3 | 0 | 0 | 0 | 0 | 112.6 | Q36 | S34-Q36 PolarHBondContact O-N 3.37Š| ||
| 35 | H | 47.8 | Very low | 48.5 | Very low | 172 Ų | 172 | 126.9 Ų | 126.9 | 80% | 0.796 | 73% | 0.732 | S | S | * | * | trans | -69.5 | 91.9 | 175.3 | -81 | -85.7 | 0 | 0 | 0 | 112.5 | A33 S37 | A33-H35 PolarHBondContact O-N 2.11Å; H35-S37 VanDerWaalsContact C-N 3.25Å; H35-S37 PolarHBondContact O-N 3.43Å | ||
| 36 | Q | 39.7 | Very low | 49.3 | Very low | 199 Ų | 199 | 125.1 Ų | 125.1 | 93% | 0.93 | 73% | 0.727 | S | S | * | * | trans | -68.1 | 77.8 | 170.6 | -173.5 | 175.4 | 75.9 | 0 | 0 | 110.6 | S34 | S34-Q36 PolarHBondContact O-N 3.37Š| ||
| 37 | S | 50.5 | Low | 50 | Low | 105 Ų | 105 | 122.4 Ų | 122.4 | 73% | 0.734 | 72% | 0.719 | S | S | * | * | trans | -84 | 139.6 | -178.6 | -165.4 | 0 | 0 | 0 | 0 | 112.1 | H35 | H35-S37 VanDerWaalsContact C-N 3.25Å; H35-S37 PolarHBondContact O-N 3.43Å | ||
| 38 | T | 53.1 | Low | 50.1 | Low | 112 Ų | 112 | 118.3 Ų | 118.3 | 69% | 0.687 | 71% | 0.713 | S | S | * | * | trans | -75.3 | 142.7 | -176.4 | 47.3 | 0 | 0 | 0 | 0 | 112.3 | F40 | T38-F40 PolarHBondContact O-N 2.72Š| ||
| 39 | P | 60.9 | Low | 50.5 | Low | 106 Ų | 106 | 120.8 Ų | 120.8 | 69% | 0.688 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -81.9 | 35.5 | -166.2 | 35.5 | -39.7 | 0 | 0 | 0 | 114.6 | ||
| 40 | F | 47.9 | Very low | 50.9 | Low | 178 Ų | 178 | 122.9 Ų | 122.9 | 78% | 0.781 | 71% | 0.714 | S | S | * | * | trans | -146.2 | 84.2 | 179.4 | -64.4 | -68.7 | 0 | 0 | 0 | 110.6 | T38 | T38-F40 PolarHBondContact O-N 2.72Š| ||
| 41 | S | 70.4 | Confident | 51.7 | Low | 55 Ų | 55 | 123.7 Ų | 123.7 | 39% | 0.385 | 71% | 0.707 | S | S | . | * | trans | -76.1 | 153.6 | 166.4 | -171.7 | 0 | 0 | 0 | 0 | 110.5 | T43 D44 | S41-T43 PolarHBondContact O-N 3.22Å; S41-T43 PolarHBondContact OG-N 2.89Å; S41-T43 PolarHBondContact OG-OG1 3.49Å; S41-D44 WeakPolarHBondContact CA-OD2 3.19Å; S41-D44 VanDerWaalsContact CB-OD2 3.32Å; S41-D44 WeakPolarHBondContact CB-OD2 2.91Å; S41-D44 PolarHBondContact N-OD2 3.43Å; S41-D44 PolarHBondContact O-N 3.01Å | ||
| 42 | V | 54.2 | Low | 52 | Low | 102 Ų | 102 | 126.3 Ų | 126.3 | 62% | 0.618 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -66.4 | -24.4 | 170.5 | 177.3 | 0 | 0 | 0 | 0 | 111 | D44 I45 L46 | V42-D44 VanDerWaalsContact C-N 3.32Å; V42-D44 PolarHBondContact O-N 3.41Å; V42-I45 PolarHBondContact O-N 3.14Å; V42-L46 HydrophobicContact CG1-CD1 4.05Å |
| 43 | T | 67 | Low | 52.5 | Low | 86 Ų | 86 | 128.2 Ų | 128.2 | 53% | 0.528 | 70% | 0.702 | S | S | . | * | H | α-helix | trans | -58.1 | -43.2 | 174.1 | -27.6 | 0 | 0 | 0 | 0 | 111.8 | S41 I45 L46 S47 | S41-T43 PolarHBondContact O-N 3.22Å; S41-T43 PolarHBondContact OG-N 2.89Å; S41-T43 PolarHBondContact OG-OG1 3.49Å; T43-I45 PolarHBondContact O-N 3.43Å; T43-I45 VanDerWaalsContact O-N 3.07Å; T43-L46 PolarHBondContact O-N 3.14Å; T43-S47 PolarHBondContact O-N 3.21Å |
| 44 | D | 63.2 | Low | 53 | Low | 108 Ų | 108 | 131.7 Ų | 131.7 | 58% | 0.578 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -65.6 | -16 | -176.4 | -43.7 | -34 | 0 | 0 | 0 | 112.8 | S41 V42 | S41-D44 WeakPolarHBondContact CA-OD2 3.19Å; S41-D44 VanDerWaalsContact CB-OD2 3.32Å; S41-D44 WeakPolarHBondContact CB-OD2 2.91Å; S41-D44 PolarHBondContact N-OD2 3.43Å; S41-D44 PolarHBondContact O-N 3.01Å; V42-D44 VanDerWaalsContact C-N 3.32Å; V42-D44 PolarHBondContact O-N 3.41Å |
| 45 | I | 65.9 | Low | 53.5 | Low | 134 Ų | 134 | 128.4 Ų | 128.4 | 69% | 0.687 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -92.5 | -21.3 | -179.6 | -52.4 | 176.6 | 0 | 0 | 0 | 111.2 | V42 T43 | V42-I45 PolarHBondContact O-N 3.14Å; T43-I45 PolarHBondContact O-N 3.43Å; T43-I45 VanDerWaalsContact O-N 3.07Å |
| 46 | L | 58.6 | Low | 53.8 | Low | 131 Ų | 131 | 125.3 Ų | 125.3 | 69% | 0.686 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -107.1 | -11.7 | -171.6 | -76.3 | 164.8 | 0 | 0 | 0 | 114.4 | V42 T43 P48 | V42-L46 HydrophobicContact CG1-CD1 4.05Å; T43-L46 PolarHBondContact O-N 3.14Å; L46-P48 WeakPolarHBondContact O-CD 3.13Å |
| 47 | S | 56 | Low | 54.3 | Low | 82 Ų | 82 | 123.8 Ų | 123.8 | 57% | 0.573 | 67% | 0.673 | S | S | * | * | trans | -108.4 | 75.6 | 176.8 | -60.6 | 0 | 0 | 0 | 0 | 113 | T43 | T43-S47 PolarHBondContact O-N 3.21Š| ||
| 48 | P | 46.4 | Very low | 54.3 | Low | 113 Ų | 113 | 126.2 Ų | 126.2 | 73% | 0.734 | 68% | 0.677 | S | S | * | * | trans | -75.8 | 132.8 | 166.5 | 32.1 | -31.9 | 0 | 0 | 0 | 110.3 | L46 | L46-P48 WeakPolarHBondContact O-CD 3.13Š| ||
| 49 | L | 42.8 | Very low | 54.3 | Low | 155 Ų | 155 | 129.1 Ų | 129.1 | 81% | 0.812 | 68% | 0.68 | S | S | * | * | S | Bend | trans | 69.5 | 132.9 | -166.8 | -118.3 | 58.6 | 0 | 0 | 0 | 110.2 | ||
| 50 | E | 52.4 | Low | 53.7 | Low | 163 Ų | 163 | 128.1 Ų | 128.1 | 76% | 0.762 | 68% | 0.68 | S | S | * | * | S | Bend | cis | -139.5 | -10 | 41.1 | -68.9 | 166.4 | 102.3 | 0 | 0 | 116.4 | H52 Q53 | E50-H52 PolarHBondContact O-N 3.05Å; E50-Q53 PolarHBondContact O-N 3.22Å |
| 51 | E | 53.3 | Low | 53.7 | Low | 166 Ų | 166 | 127.7 Ų | 127.7 | 78% | 0.776 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | -14.1 | -163.6 | -69.7 | -177.8 | 87.3 | 0 | 0 | 117.9 | Q53 S55 | E51-Q53 PolarHBondContact O-N 2.95Å; E51-S55 PolarHBondContact O-OG 3.31Å |
| 52 | H | 49.2 | Very low | 52.9 | Low | 171 Ų | 171 | 134.6 Ų | 134.6 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -3.2 | -176.2 | -85.6 | 65.5 | 0 | 0 | 0 | 115.4 | E50 | E50-H52 PolarHBondContact O-N 3.05Š|
| 53 | Q | 45.4 | Very low | 52.2 | Low | 163 Ų | 163 | 135 Ų | 135 | 76% | 0.762 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -48.3 | 169.8 | -84.2 | -173.2 | 86.7 | 0 | 0 | 112.9 | E50 E51 S55 V56 | E50-Q53 PolarHBondContact O-N 3.22Å; E51-Q53 PolarHBondContact O-N 2.95Å; Q53-S55 PolarHBondContact O-N 3.1Å; Q53-V56 PolarHBondContact O-N 3.49Å |
| 54 | L | 51.5 | Low | 51 | Low | 143 Ų | 143 | 139.1 Ų | 139.1 | 75% | 0.749 | 73% | 0.726 | S | S | * | * | H | α-helix | trans | -61.8 | -31.7 | -176.9 | -69.4 | 170.5 | 0 | 0 | 0 | 113.1 | V56 | L54-V56 VanDerWaalsContact C-N 3.26Å; L54-V56 PolarHBondContact O-N 2.94Å |
| 55 | S | 48.6 | Very low | 49.7 | Very low | 52 Ų | 52 | 141.6 Ų | 141.6 | 36% | 0.364 | 74% | 0.736 | S | S | . | * | H | α-helix | trans | -75.1 | -7.2 | -178.2 | 51.5 | 0 | 0 | 0 | 0 | 115.2 | E51 Q53 | E51-S55 PolarHBondContact O-OG 3.31Å; Q53-S55 PolarHBondContact O-N 3.1Å |
| 56 | V | 52.6 | Low | 48.9 | Very low | 108 Ų | 108 | 144.5 Ų | 144.5 | 66% | 0.655 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -96 | -38.7 | 175.9 | -178.1 | 0 | 0 | 0 | 0 | 111.5 | Q53 L54 L58 | Q53-V56 PolarHBondContact O-N 3.49Å; L54-V56 VanDerWaalsContact C-N 3.26Å; L54-V56 PolarHBondContact O-N 2.94Å; V56-L58 VanDerWaalsContact C-N 3.31Å; V56-L58 PolarHBondContact O-N 2.87Å |
| 57 | Q | 50.6 | Low | 48.1 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 78% | 0.78 | 76% | 0.757 | S | S | * | * | H | α-helix | trans | -62.9 | -37.3 | 179.6 | -152.6 | 84.5 | 56.7 | 0 | 0 | 112.2 | K59 | Q57-K59 VanDerWaalsContact C-N 3.31Å; Q57-K59 PolarHBondContact O-N 3.27Å |
| 58 | L | 51.2 | Low | 47.7 | Very low | 156 Ų | 156 | 150.2 Ų | 150.2 | 82% | 0.817 | 77% | 0.771 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | 8.7 | -168.3 | -148.5 | 73.5 | 0 | 0 | 0 | 115.2 | V56 | V56-L58 VanDerWaalsContact C-N 3.31Å; V56-L58 PolarHBondContact O-N 2.87Å |
| 59 | K | 51.7 | Low | 47.5 | Very low | 173 Ų | 173 | 150.5 Ų | 150.5 | 75% | 0.752 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.2 | 5.5 | -175.5 | -69.6 | 173.2 | -175.3 | 160.4 | 0 | 114.4 | Q57 | Q57-K59 VanDerWaalsContact C-N 3.31Å; Q57-K59 PolarHBondContact O-N 3.27Å |
| 60 | A | 48 | Very low | 47.5 | Very low | 84 Ų | 84 | 151.8 Ų | 151.8 | 69% | 0.694 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -89 | -7.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||
| 61 | L | 48.9 | Very low | 47.2 | Very low | 169 Ų | 169 | 150.1 Ų | 150.1 | 89% | 0.885 | 77% | 0.771 | S | S | * | * | trans | -122.1 | 106.2 | -174.1 | -71.1 | 164.5 | 0 | 0 | 0 | 110.7 | ||||
| 62 | K | 52.5 | Low | 46.7 | Very low | 201 Ų | 201 | 146.1 Ų | 146.1 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | trans | -104.2 | 140.6 | 173.7 | -110.6 | 177.2 | 176.4 | 176.9 | 0 | 110 | ||||
| 63 | P | 40.6 | Very low | 46.7 | Very low | 111 Ų | 111 | 142.9 Ų | 142.9 | 72% | 0.721 | 78% | 0.777 | S | S | * | * | trans | -82.9 | 124 | -172.2 | 31.3 | -34.3 | 0 | 0 | 0 | 113.3 | ||||
| 64 | Q | 41.3 | Very low | 46.8 | Very low | 172 Ų | 172 | 141.9 Ų | 141.9 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -137.1 | 83.8 | 166.3 | -83.6 | -63.1 | -86.6 | 0 | 0 | 112.2 | M66 | Q64-M66 PolarHBondContact O-N 3.41Š| ||
| 65 | M | 36.8 | Very low | 46.8 | Very low | 160 Ų | 160 | 143.4 Ų | 143.4 | 79% | 0.788 | 79% | 0.791 | S | S | * | * | 36.8 | 81.4 | 111.8 | -53.7 | -72.7 | -81.3 | 0 | 0 | 117 | |||||
| 66 | M | 48.2 | Very low | 47 | Very low | 194 Ų | 194 | 148.7 Ų | 148.7 | 96% | 0.956 | 82% | 0.815 | S | S | * | * | trans | -167.3 | 157.8 | 136.7 | -110 | 173.3 | -178.2 | 0 | 0 | 112 | Q64 | Q64-M66 PolarHBondContact O-N 3.41Š| ||
| 67 | M | 42.7 | Very low | 46.8 | Very low | 171 Ų | 171 | 149.3 Ų | 149.3 | 84% | 0.842 | 82% | 0.821 | S | S | * | * | trans | -77.6 | 139.5 | -174.9 | -60.7 | -67.6 | -169.8 | 0 | 0 | 112 | ||||
| 68 | N | 47.1 | Very low | 46.4 | Very low | 162 Ų | 162 | 150.8 Ų | 150.8 | 87% | 0.866 | 83% | 0.825 | S | S | * | * | -176.7 | 144 | 111.4 | -88.7 | -12.1 | 0 | 0 | 0 | 111.3 | |||||
| 69 | S | 41.9 | Very low | 46.2 | Very low | 120 Ų | 120 | 149.3 Ų | 149.3 | 84% | 0.839 | 83% | 0.828 | S | S | * | * | trans | -81.1 | 149.5 | 177.9 | -49.2 | 0 | 0 | 0 | 0 | 112 | ||||
| 70 | F | 43.1 | Very low | 45.9 | Very low | 181 Ų | 181 | 145.5 Ų | 145.5 | 79% | 0.794 | 83% | 0.829 | S | S | * | * | 167.1 | 121 | 114.4 | -166.6 | -116.4 | 0 | 0 | 0 | 112.1 | |||||
| 71 | D | 46.1 | Very low | 45.6 | Very low | 128 Ų | 128 | 152.7 Ų | 152.7 | 68% | 0.684 | 84% | 0.84 | S | S | * | * | trans | 41.8 | 87.2 | 150.5 | -61.2 | 14.9 | 0 | 0 | 0 | 121.4 | ||||
| 72 | G | 43.9 | Very low | 45.6 | Very low | 82 Ų | 82 | 155.7 Ų | 155.7 | 85% | 0.845 | 84% | 0.839 | S | S | * | * | 53.5 | 115.4 | 101.6 | 0 | 0 | 0 | 0 | 0 | 122.3 | |||||
| 73 | A | 48.2 | Very low | 45.4 | Very low | 103 Ų | 103 | 150.8 Ų | 150.8 | 85% | 0.851 | 83% | 0.83 | S | S | * | * | trans | -156.8 | 140.5 | 138 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 74 | T | 46.6 | Very low | 45.5 | Very low | 143 Ų | 143 | 154.2 Ų | 154.2 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | trans | -96.3 | 130.2 | 179.6 | 42.9 | 0 | 0 | 0 | 0 | 112 | ||||
| 75 | L | 52.5 | Low | 46.1 | Very low | 175 Ų | 175 | 151.4 Ų | 151.4 | 92% | 0.916 | 83% | 0.833 | S | S | * | * | trans | -108.5 | 112.1 | 171.9 | -71.6 | 177.5 | 0 | 0 | 0 | 110.6 | ||||
| 76 | N | 52.5 | Low | 46.6 | Very low | 162 Ų | 162 | 149.9 Ų | 149.9 | 87% | 0.866 | 83% | 0.832 | S | S | * | * | trans | -104.9 | 108.7 | 179.7 | -147.9 | 12.2 | 0 | 0 | 0 | 108.9 | F78 | N76-F78 PolarHBondContact O-N 3.36Å; N76-F78 VanDerWaalsContact O-N 3.09Å | ||
| 77 | P | 49.5 | Very low | 46.7 | Very low | 122 Ų | 122 | 146.4 Ų | 146.4 | 79% | 0.792 | 82% | 0.822 | S | S | * | * | trans | -91.4 | 65 | -158.7 | 36.1 | -38 | 0 | 0 | 0 | 114.2 | ||||
| 78 | F | 40.6 | Very low | 46.7 | Very low | 198 Ų | 198 | 147 Ų | 147 | 87% | 0.868 | 82% | 0.823 | S | S | * | * | trans | -153.3 | 61.8 | 173.1 | -141.5 | -89.6 | 0 | 0 | 0 | 117 | N76 | N76-F78 PolarHBondContact O-N 3.36Å; N76-F78 VanDerWaalsContact O-N 3.09Å | ||
| 79 | S | 47.9 | Very low | 46.7 | Very low | 125 Ų | 125 | 145.3 Ų | 145.3 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -172.8 | 149 | 160.8 | -85.5 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 80 | A | 46.1 | Very low | 46.8 | Very low | 93 Ų | 93 | 143.6 Ų | 143.6 | 77% | 0.769 | 81% | 0.811 | S | S | * | * | cis | -157.1 | 169.6 | -16.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 81 | Y | 41.1 | Very low | 47 | Very low | 235 Ų | 235 | 139.7 Ų | 139.7 | 92% | 0.922 | 81% | 0.806 | S | S | * | * | trans | -65.3 | 130.1 | -178.7 | -77.3 | -108 | 0 | 0 | 0 | 114 | ||||
| 82 | R | 48.7 | Very low | 47.2 | Very low | 232 Ų | 232 | 141 Ų | 141 | 88% | 0.875 | 81% | 0.81 | S | S | * | * | trans | -173.3 | 128.8 | 132.8 | -111.8 | 170.6 | -178.1 | -104.6 | 1.2 | 116.7 | ||||
| 83 | S | 47.6 | Very low | 47.6 | Very low | 98 Ų | 98 | 144.7 Ų | 144.7 | 69% | 0.685 | 81% | 0.805 | S | S | * | * | trans | 43.2 | 123.7 | 142.9 | 54.7 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 84 | H | 42.6 | Very low | 47.9 | Very low | 183 Ų | 183 | 147.7 Ų | 147.7 | 85% | 0.847 | 80% | 0.801 | S | S | * | * | trans | -72.2 | -169.1 | 156.8 | -43.3 | -85.3 | 0 | 0 | 0 | 111.8 | ||||
| 85 | P | 53.9 | Low | 48.5 | Very low | 113 Ų | 113 | 145.4 Ų | 145.4 | 73% | 0.734 | 79% | 0.789 | S | S | * | * | cis | -147 | -177.8 | 2.8 | 40.8 | -18.5 | 0 | 0 | 0 | 119.6 | ||||
| 86 | V | 48 | Very low | 48.3 | Very low | 128 Ų | 128 | 142.7 Ų | 142.7 | 78% | 0.776 | 79% | 0.785 | S | S | * | * | trans | 89.3 | 116.2 | 134.8 | 143.9 | 0 | 0 | 0 | 0 | 123.8 | ||||
| 87 | V | 49.9 | Very low | 48.2 | Very low | 120 Ų | 120 | 139.5 Ų | 139.5 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | 69.4 | 119.6 | 138 | 177.1 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 88 | Q | 43.8 | Very low | 48 | Very low | 185 Ų | 185 | 137.5 Ų | 137.5 | 86% | 0.864 | 78% | 0.782 | S | S | * | * | 173.1 | 169.5 | 127.1 | -95.7 | 176.6 | 57.9 | 0 | 0 | 110.3 | |||||
| 89 | T | 45.8 | Very low | 48.2 | Very low | 125 Ų | 125 | 133.2 Ų | 133.2 | 77% | 0.767 | 78% | 0.783 | S | S | * | * | -157.8 | 172.2 | -83.1 | -172.9 | 0 | 0 | 0 | 0 | 110.3 | |||||
| 90 | A | 44.5 | Very low | 48 | Very low | 85 Ų | 85 | 135.5 Ų | 135.5 | 70% | 0.702 | 78% | 0.78 | S | S | * | * | trans | 74.6 | 151.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 91 | S | 46.9 | Very low | 47.8 | Very low | 98 Ų | 98 | 140 Ų | 140 | 69% | 0.685 | 79% | 0.785 | S | S | * | * | cis | -173.1 | 159.2 | -26 | -95.6 | 0 | 0 | 0 | 0 | 112 | ||||
| 92 | M | 51.5 | Low | 47.9 | Very low | 157 Ų | 157 | 133.8 Ų | 133.8 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | 73.9 | 153.8 | 170.5 | -48.3 | -42.9 | -175.1 | 0 | 0 | 116.7 | ||||
| 93 | H | 51.1 | Low | 47.7 | Very low | 159 Ų | 159 | 133.4 Ų | 133.4 | 74% | 0.736 | 77% | 0.772 | S | S | * | * | cis | -148.2 | 161.3 | -12.6 | -86.4 | 143.9 | 0 | 0 | 0 | 107.3 | ||||
| 94 | H | 54.2 | Low | 47.4 | Very low | 165 Ų | 165 | 136.8 Ų | 136.8 | 76% | 0.764 | 78% | 0.782 | S | S | * | * | cis | 94 | 128.6 | 11.8 | -157.4 | -103.5 | 0 | 0 | 0 | 116.1 | ||||
| 95 | P | 60.7 | Low | 47.5 | Very low | 95 Ų | 95 | 132 Ų | 132 | 62% | 0.617 | 78% | 0.782 | S | S | * | * | cis | -146.6 | -160.7 | -18.9 | 45.4 | -26.7 | 0 | 0 | 0 | 116.8 | ||||
| 96 | S | 48.4 | Very low | 46.9 | Very low | 119 Ų | 119 | 130.3 Ų | 130.3 | 83% | 0.832 | 79% | 0.785 | S | S | * | * | trans | 87.2 | 146.4 | 158 | -97.1 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 97 | A | 48.7 | Very low | 46.4 | Very low | 94 Ų | 94 | 130.4 Ų | 130.4 | 78% | 0.777 | 79% | 0.79 | S | S | * | * | cis | -157.8 | 154.2 | -1.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 98 | G | 46.3 | Very low | 46.5 | Very low | 80 Ų | 80 | 130.8 Ų | 130.8 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | 76.6 | 149.9 | 156.1 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 99 | A | 44.7 | Very low | 46.4 | Very low | 108 Ų | 108 | 126 Ų | 126 | 89% | 0.893 | 79% | 0.794 | S | S | * | * | cis | -157.1 | 170.8 | -11 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 100 | Q | 42.6 | Very low | 46.1 | Very low | 174 Ų | 174 | 123.6 Ų | 123.6 | 81% | 0.813 | 80% | 0.795 | S | S | * | * | trans | -127.9 | 151.1 | -170.9 | -67.7 | -178.2 | -21.9 | 0 | 0 | 115.5 | ||||
| 101 | Q | 43.8 | Very low | 45.9 | Very low | 188 Ų | 188 | 125.1 Ų | 125.1 | 88% | 0.879 | 81% | 0.807 | S | S | * | * | trans | -177.5 | 134.6 | 148 | -103.7 | 164.2 | 86 | 0 | 0 | 107.4 | ||||
| 102 | T | 42 | Very low | 45.6 | Very low | 104 Ų | 104 | 124.3 Ų | 124.3 | 64% | 0.638 | 81% | 0.814 | S | S | * | * | cis | 82.6 | 102.3 | 11.9 | -42.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 103 | Y | 44.5 | Very low | 45 | Very low | 223 Ų | 223 | 123 Ų | 123 | 88% | 0.875 | 82% | 0.821 | S | S | * | * | -168.2 | 177.4 | 119.4 | -119.6 | -89.1 | 0 | 0 | 0 | 112.9 | |||||
| 104 | L | 40.5 | Very low | 44.6 | Very low | 170 Ų | 170 | 120.2 Ų | 120.2 | 89% | 0.89 | 83% | 0.825 | S | S | * | * | trans | -125.3 | 160.1 | -165.8 | -68.5 | 165 | 0 | 0 | 0 | 114 | ||||
| 105 | G | 45.6 | Very low | 44.2 | Very low | 83 Ų | 83 | 118.9 Ų | 118.9 | 86% | 0.856 | 83% | 0.828 | S | S | * | * | trans | 130.7 | 157.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 106 | G | 41 | Very low | 43.6 | Very low | 77 Ų | 77 | 119.8 Ų | 119.8 | 79% | 0.794 | 83% | 0.834 | S | S | * | * | cis | 172.9 | 142.9 | -4.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 107 | C | 38.3 | Very low | 43 | Very low | 130 Ų | 130 | 123.2 Ų | 123.2 | 88% | 0.878 | 84% | 0.835 | S | S | * | * | trans | -96.9 | -173.3 | -172.3 | -30 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 108 | P | 51.7 | Low | 42.6 | Very low | 128 Ų | 128 | 123.1 Ų | 123.1 | 83% | 0.831 | 83% | 0.828 | S | S | * | * | cis | -135.5 | -179.5 | -19.1 | 39.4 | -22.3 | 0 | 0 | 0 | 114.9 | ||||
| 109 | G | 41.8 | Very low | 42.3 | Very low | 83 Ų | 83 | 123.9 Ų | 123.9 | 86% | 0.856 | 83% | 0.826 | S | S | * | * | trans | 97.7 | 158.3 | 159.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 110 | G | 39.9 | Very low | 42 | Very low | 75 Ų | 75 | 126.2 Ų | 126.2 | 77% | 0.773 | 82% | 0.819 | S | S | * | * | cis | 170.7 | 121.5 | -10.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 111 | A | 39.8 | Very low | 42 | Very low | 117 Ų | 117 | 126.9 Ų | 126.9 | 97% | 0.967 | 82% | 0.815 | S | S | * | * | trans | 59.2 | 146.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 112 | G | 40.5 | Very low | 41.6 | Very low | 81 Ų | 81 | 126.7 Ų | 126.7 | 84% | 0.835 | 81% | 0.814 | S | S | * | * | trans | 140.1 | 112.1 | 167.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 113 | S | 39.2 | Very low | 41.5 | Very low | 131 Ų | 131 | 126.6 Ų | 126.6 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | trans | -76.4 | 135.5 | 176.7 | -52.2 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 114 | A | 42.7 | Very low | 41.4 | Very low | 99 Ų | 99 | 121.2 Ų | 121.2 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | trans | -172.6 | 136.3 | 133.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 115 | V | 45.7 | Very low | 41.4 | Very low | 137 Ų | 137 | 119.7 Ų | 119.7 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | trans | -93.4 | 168 | 154.8 | -66.8 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 116 | P | 48.5 | Very low | 41.4 | Very low | 114 Ų | 114 | 119.4 Ų | 119.4 | 74% | 0.74 | 81% | 0.809 | S | S | * | * | cis | -150.5 | -177.8 | 23.6 | 45.5 | -24.8 | 0 | 0 | 0 | 118.8 | ||||
| 117 | F | 36.2 | Very low | 41.6 | Very low | 192 Ų | 192 | 122 Ų | 122 | 84% | 0.842 | 81% | 0.805 | S | S | * | * | trans | 57.2 | 106.8 | 138.2 | -170.3 | -102.7 | 0 | 0 | 0 | 121.3 | ||||
| 118 | S | 39 | Very low | 42 | Very low | 91 Ų | 91 | 125.5 Ų | 125.5 | 64% | 0.636 | 81% | 0.805 | S | S | * | * | 170.1 | 145 | 120.9 | -78 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 119 | A | 40.7 | Very low | 41.7 | Very low | 96 Ų | 96 | 124.4 Ų | 124.4 | 79% | 0.793 | 80% | 0.801 | S | S | * | * | trans | 59.4 | 149.5 | 156 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||||
| 120 | Q | 37.8 | Very low | 41.9 | Very low | 157 Ų | 157 | 130 Ų | 130 | 73% | 0.734 | 80% | 0.798 | S | S | * | * | cis | -162 | 179.4 | -17.7 | -177.5 | 160.7 | -58.1 | 0 | 0 | 107.3 | ||||
| 121 | Y | 42.9 | Very low | 42.3 | Very low | 189 Ų | 189 | 129.6 Ų | 129.6 | 74% | 0.741 | 79% | 0.787 | S | S | * | * | trans | 82.6 | 74.3 | 173.3 | -62.5 | -83.7 | 0 | 0 | 0 | 119.3 | ||||
| 122 | Q | 35.3 | Very low | 42.6 | Very low | 183 Ų | 183 | 127.8 Ų | 127.8 | 86% | 0.855 | 77% | 0.772 | S | S | * | * | 48.2 | 101.1 | 108.4 | -169.1 | 173.7 | 8.8 | 0 | 0 | 119.8 | |||||
| 123 | A | 39.8 | Very low | 43 | Very low | 102 Ų | 102 | 127.4 Ų | 127.4 | 84% | 0.843 | 76% | 0.76 | S | S | * | * | trans | -149 | 151.3 | 152 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 124 | S | 41.8 | Very low | 43.4 | Very low | 111 Ų | 111 | 124.4 Ų | 124.4 | 78% | 0.776 | 74% | 0.743 | S | S | * | * | trans | -51.6 | 148.6 | -165.6 | -51.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 125 | P | 41.1 | Very low | 43.6 | Very low | 138 Ų | 138 | 122.8 Ų | 122.8 | 90% | 0.896 | 73% | 0.73 | S | S | * | * | trans | -89.7 | 118.9 | 167.1 | 34 | -29.7 | 0 | 0 | 0 | 112.1 | ||||
| 126 | A | 45 | Very low | 43.8 | Very low | 76 Ų | 76 | 119.9 Ų | 119.9 | 63% | 0.628 | 72% | 0.72 | S | S | * | * | trans | -129.9 | -31.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 127 | D | 46.2 | Very low | 43.9 | Very low | 132 Ų | 132 | 120.4 Ų | 120.4 | 71% | 0.706 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -93.5 | -4.6 | -157 | -58.2 | -85.4 | 0 | 0 | 0 | 117 | S129 | D127-S129 PolarHBondContact O-N 3.37Š|
| 128 | F | 45.8 | Very low | 44.7 | Very low | 204 Ų | 204 | 118.6 Ų | 118.6 | 90% | 0.895 | 71% | 0.711 | S | S | * | * | G | 310 helix | trans | -84.3 | -5.1 | -171.2 | -92.8 | -84.4 | 0 | 0 | 0 | 116.2 | Y130 | F128-Y130 PolarHBondContact O-N 3.39Š|
| 129 | S | 45.6 | Very low | 45.3 | Very low | 105 Ų | 105 | 119.9 Ų | 119.9 | 73% | 0.734 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -78.6 | -9.3 | -172.2 | -60.7 | 0 | 0 | 0 | 0 | 115.5 | D127 A131 | D127-S129 PolarHBondContact O-N 3.37Å; S129-A131 PolarHBondContact O-N 2.82Å |
| 130 | Y | 45.9 | Very low | 45.7 | Very low | 201 Ų | 201 | 118.5 Ų | 118.5 | 79% | 0.788 | 70% | 0.704 | S | S | * | * | G | 310 helix | trans | -75.4 | -23.1 | -172.7 | 87.8 | -93.6 | 0 | 0 | 0 | 114.5 | F128 | F128-Y130 PolarHBondContact O-N 3.39Š|
| 131 | A | 49.8 | Very low | 46.2 | Very low | 66 Ų | 66 | 114.9 Ų | 114.9 | 55% | 0.545 | 70% | 0.701 | S | S | . | * | S | Bend | trans | -72.1 | -31.6 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | S129 A133 A134 | S129-A131 PolarHBondContact O-N 2.82Å; A131-A133 PolarHBondContact O-N 2.96Å; A131-A134 PolarHBondContact O-N 2.9Å |
| 132 | A | 45.9 | Very low | 46.5 | Very low | 79 Ų | 79 | 110.1 Ų | 110.1 | 65% | 0.653 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -31.9 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | A134 A135 | A132-A134 PolarHBondContact O-N 3.33Å; A132-A135 PolarHBondContact O-N 3.06Å |
| 133 | A | 47.6 | Very low | 47.2 | Very low | 72 Ų | 72 | 105.9 Ų | 105.9 | 60% | 0.595 | 70% | 0.697 | S | S | * | * | H | α-helix | trans | -65.8 | -23.5 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | A131 A135 | A131-A133 PolarHBondContact O-N 2.96Å; A133-A135 VanDerWaalsContact C-N 3.31Å; A133-A135 PolarHBondContact O-N 3.31Å |
| 134 | A | 47.5 | Very low | 47.8 | Very low | 68 Ų | 68 | 104.9 Ų | 104.9 | 56% | 0.562 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -70.5 | -23.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | A131 A132 | A131-A134 PolarHBondContact O-N 2.9Å; A132-A134 PolarHBondContact O-N 3.33Å |
| 135 | A | 48.3 | Very low | 47.9 | Very low | 65 Ų | 65 | 102.9 Ų | 102.9 | 54% | 0.537 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -75.6 | -46.9 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112 | A132 A133 N137 Q138 | A132-A135 PolarHBondContact O-N 3.06Å; A133-A135 VanDerWaalsContact C-N 3.31Å; A133-A135 PolarHBondContact O-N 3.31Å; A135-N137 VanDerWaalsContact C-N 3.27Å; A135-N137 PolarHBondContact O-N 2.99Å; A135-Q138 PolarHBondContact O-N 2.97Å |
| 136 | A | 48.9 | Very low | 48.3 | Very low | 76 Ų | 76 | 107.3 Ų | 107.3 | 63% | 0.628 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -63.4 | -29.9 | -175.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | Q138 | A136-Q138 PolarHBondContact O-N 3.28Å |
| 137 | N | 50.7 | Low | 48.1 | Very low | 126 Ų | 126 | 112.2 Ų | 112.2 | 67% | 0.674 | 68% | 0.677 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | -5.8 | -174.3 | -152 | 8.7 | 0 | 0 | 0 | 114.2 | A135 | A135-N137 VanDerWaalsContact C-N 3.27Å; A135-N137 PolarHBondContact O-N 2.99Å |
| 138 | Q | 52.9 | Low | 47.7 | Very low | 153 Ų | 153 | 107 Ų | 107 | 72% | 0.715 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.8 | -29.6 | 177.5 | -66.3 | -175.3 | 71.8 | 0 | 0 | 112.7 | A135 A136 | A135-Q138 PolarHBondContact O-N 2.97Å; A136-Q138 PolarHBondContact O-N 3.28Å |
| 139 | T | 52.3 | Low | 47.1 | Very low | 119 Ų | 119 | 98.9 Ų | 98.9 | 73% | 0.73 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -33.8 | -176.9 | -47.8 | 0 | 0 | 0 | 0 | 112.7 | A141 | T139-A141 VanDerWaalsContact C-N 3.31Å; T139-A141 PolarHBondContact O-N 3.5Å |
| 140 | A | 48.3 | Very low | 47 | Very low | 67 Ų | 67 | 100.1 Ų | 100.1 | 55% | 0.554 | 62% | 0.624 | S | S | * | * | G | 310 helix | trans | -68.4 | -26.2 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | A142 A143 | A140-A142 PolarHBondContact O-N 2.92Å; A140-A143 PolarHBondContact O-N 3.23Å |
| 141 | A | 48.1 | Very low | 46.8 | Very low | 81 Ų | 81 | 99 Ų | 99 | 67% | 0.669 | 63% | 0.625 | S | S | * | * | G | 310 helix | trans | -66.4 | -19.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.1 | T139 | T139-A141 VanDerWaalsContact C-N 3.31Å; T139-A141 PolarHBondContact O-N 3.5Å |
| 142 | A | 50.1 | Low | 46.1 | Very low | 88 Ų | 88 | 101.6 Ų | 101.6 | 73% | 0.727 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -74 | -23.3 | -178 | 0 | 0 | 0 | 0 | 0 | 114.1 | A140 | A140-A142 PolarHBondContact O-N 2.92Š|
| 143 | A | 49.6 | Very low | 45.9 | Very low | 94 Ų | 94 | 102.1 Ų | 102.1 | 78% | 0.777 | 64% | 0.643 | S | S | * | * | S | Bend | trans | -89.7 | -13.6 | -165.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | A140 | A140-A143 PolarHBondContact O-N 3.23Š|
| 144 | A | 51.7 | Low | 45.8 | Very low | 81 Ų | 81 | 108.7 Ų | 108.7 | 67% | 0.669 | 65% | 0.652 | S | S | * | * | S | Bend | trans | -100.9 | 16.2 | -162.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 145 | S | 44.4 | Very low | 45.3 | Very low | 69 Ų | 69 | 112.9 Ų | 112.9 | 48% | 0.483 | 66% | 0.658 | S | S | . | * | trans | -118.6 | 140.4 | -162.1 | -150.3 | 0 | 0 | 0 | 0 | 113.5 | I157 | S145-I157 VanDerWaalsContact CB-CD1 3.47Å; S145-I157 WeakPolarHBondContact O-CG2 3.45Å; S145-I157 WeakPolarHBondContact OG-CD1 3.38Å | ||
| 146 | W | 50.1 | Low | 44.7 | Very low | 232 Ų | 232 | 112 Ų | 112 | 88% | 0.879 | 66% | 0.655 | S | S | * | * | trans | -104.7 | 3 | -155.7 | -75.7 | 73.6 | 0 | 0 | 0 | 116.4 | ||||
| 147 | Y | 40.8 | Very low | 44.6 | Very low | 179 Ų | 179 | 110.1 Ų | 110.1 | 70% | 0.702 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -143.2 | 101.9 | -172.5 | -82.8 | -85.9 | 0 | 0 | 0 | 116 | I157 | Y147-I157 VanDerWaalsContact O-CD1 3.31Å; Y147-I157 WeakPolarHBondContact O-CD1 3.26Å |
| 148 | G | 37.5 | Very low | 44.5 | Very low | 22 Ų | 22 | 109.7 Ų | 109.7 | 23% | 0.227 | 64% | 0.638 | C | S | . | * | trans | 36.7 | 105.7 | 144 | 0 | 0 | 0 | 0 | 0 | 119.9 | N150 I157 | G148-N150 PolarHBondContact O-N 2.92Å; G148-N150 PolarHBondContact O-ND2 3.05Å; G148-N150 VanDerWaalsContact O-ND2 3.11Å; G148-I157 CarbonylContact C-O 3.4Å; G148-I157 VanDerWaalsContact C-O 3.27Å; G148-I157 WeakPolarHBondContact CA-O 3.36Å; G148-I157 PolarHBondContact N-O 3.27Å | ||
| 149 | A | 33.7 | Very low | 44.4 | Very low | 34 Ų | 34 | 111.6 Ų | 111.6 | 28% | 0.281 | 64% | 0.639 | S | S | . | * | trans | -49.9 | 118.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | I157 | A149-I157 VanDerWaalsContact CB-N 3.27Å; A149-I157 PolarHBondContact N-O 3.42Å | ||
| 150 | N | 42.7 | Very low | 44.3 | Very low | 131 Ų | 131 | 114.3 Ų | 114.3 | 70% | 0.701 | 65% | 0.648 | S | S | * | * | trans | -133.6 | 82.1 | 168.8 | -83.9 | -92.6 | 0 | 0 | 0 | 109.3 | G148 D152 | G148-N150 PolarHBondContact O-N 2.92Å; G148-N150 PolarHBondContact O-ND2 3.05Å; G148-N150 VanDerWaalsContact O-ND2 3.11Å; N150-D152 VanDerWaalsContact C-N 3.31Å; N150-D152 PolarHBondContact O-N 2.74Å | ||
| 151 | H | 42.7 | Very low | 44.4 | Very low | 178 Ų | 178 | 120 Ų | 120 | 82% | 0.824 | 67% | 0.665 | S | S | * | * | S | Bend | trans | 32 | 52 | 137.9 | -48 | -67.8 | 0 | 0 | 0 | 118.8 | ||
| 152 | D | 35.4 | Very low | 44 | Very low | 120 Ų | 120 | 119.5 Ų | 119.5 | 64% | 0.642 | 67% | 0.668 | S | S | * | * | S | Bend | -111.8 | 145.5 | 129 | -145 | -40.1 | 0 | 0 | 0 | 107 | N150 R154 F155 | N150-D152 VanDerWaalsContact C-N 3.31Å; N150-D152 PolarHBondContact O-N 2.74Å; D152-R154 PolarHBondContact O-N 3.39Å; D152-F155 PolarHBondContact O-N 3.5Å | |
| 153 | G | 39.7 | Very low | 43.7 | Very low | 90 Ų | 90 | 122.2 Ų | 122.2 | 93% | 0.928 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | 16.5 | -166.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 154 | R | 46.4 | Very low | 43.2 | Very low | 210 Ų | 210 | 123 Ų | 123 | 79% | 0.792 | 68% | 0.682 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -141.3 | -7.9 | -166.1 | -154 | 173.2 | -171.5 | -173.7 | 3 | 113.8 | D152 | D152-R154 PolarHBondContact O-N 3.39Š|
| 155 | F | 37.1 | Very low | 42.7 | Very low | 156 Ų | 156 | 122.9 Ų | 122.9 | 68% | 0.684 | 69% | 0.688 | S | S | * | * | trans | -143.9 | 26 | -170.5 | -62.2 | -68.3 | 0 | 0 | 0 | 115.2 | D152 | D152-F155 PolarHBondContact O-N 3.5Š| ||
| 156 | G | 34.9 | Very low | 42.6 | Very low | 45 Ų | 45 | 125.9 Ų | 125.9 | 46% | 0.464 | 71% | 0.709 | S | S | . | * | trans | -93.4 | 134.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 157 | I | 47.5 | Very low | 42.6 | Very low | 38 Ų | 38 | 119.3 Ų | 119.3 | 20% | 0.195 | 71% | 0.705 | C | S | . | * | trans | -128.7 | 91.8 | -169.8 | -56.3 | 157.4 | 0 | 0 | 0 | 110.9 | S145 Y147 G148 A149 R159 | S145-I157 VanDerWaalsContact CB-CD1 3.47Å; S145-I157 WeakPolarHBondContact O-CG2 3.45Å; S145-I157 WeakPolarHBondContact OG-CD1 3.38Å; Y147-I157 VanDerWaalsContact O-CD1 3.31Å; Y147-I157 WeakPolarHBondContact O-CD1 3.26Å; G148-I157 CarbonylContact C-O 3.4Å; G148-I157 VanDerWaalsContact C-O 3.27Å; G148-I157 WeakPolarHBondContact CA-O 3.36Å; G148-I157 PolarHBondContact N-O 3.27Å; A149-I157 VanDerWaalsContact CB-N 3.27Å; A149-I157 PolarHBondContact N-O 3.42Å; I157-R159 PolarHBondContact O-N 2.9Å | ||
| 158 | P | 48.1 | Very low | 42.8 | Very low | 117 Ų | 117 | 117.2 Ų | 117.2 | 76% | 0.76 | 71% | 0.713 | S | S | * | * | trans | -58.6 | 130 | -169.3 | -26.6 | 35.5 | 0 | 0 | 0 | 114.4 | ||||
| 159 | R | 50.7 | Low | 43 | Very low | 193 Ų | 193 | 119.2 Ų | 119.2 | 73% | 0.728 | 73% | 0.734 | S | S | * | * | trans | -86.3 | 108 | 167.4 | -90.3 | -173.9 | 174.8 | -175.9 | -0.6 | 109.3 | I157 M161 | I157-R159 PolarHBondContact O-N 2.9Å; R159-M161 PolarHBondContact O-N 2.95Å | ||
| 160 | L | 50.9 | Low | 44.3 | Very low | 176 Ų | 176 | 125.7 Ų | 125.7 | 92% | 0.921 | 76% | 0.76 | S | S | * | * | trans | -78.7 | 106.8 | 174.2 | -177.3 | 69.5 | 0 | 0 | 0 | 110.3 | ||||
| 161 | M | 50.1 | Low | 44.6 | Very low | 187 Ų | 187 | 125.7 Ų | 125.7 | 92% | 0.921 | 77% | 0.767 | S | S | * | * | trans | -149.4 | 82.8 | 169.7 | -158.3 | 165.7 | -168.5 | 0 | 0 | 113.1 | R159 | R159-M161 PolarHBondContact O-N 2.95Š| ||
| 162 | G | 39 | Very low | 45.3 | Very low | 70 Ų | 70 | 125.6 Ų | 125.6 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | trans | 59.1 | 105.9 | 146.8 | 0 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 163 | T | 44.9 | Very low | 46 | Very low | 145 Ų | 145 | 124.4 Ų | 124.4 | 89% | 0.89 | 77% | 0.77 | S | S | * | * | trans | -132.8 | 150.4 | 136.3 | 57.4 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 164 | A | 38.6 | Very low | 46.7 | Very low | 111 Ų | 111 | 127.8 Ų | 127.8 | 92% | 0.917 | 76% | 0.764 | S | S | * | * | trans | -67.9 | 151.9 | -170.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 165 | G | 41 | Very low | 46.9 | Very low | 77 Ų | 77 | 123.7 Ų | 123.7 | 79% | 0.794 | 76% | 0.763 | S | S | * | * | trans | 179.4 | 105.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 166 | S | 43.1 | Very low | 47.4 | Very low | 132 Ų | 132 | 119.9 Ų | 119.9 | 92% | 0.923 | 76% | 0.76 | S | S | * | * | trans | -51.1 | 128.1 | -170.6 | -50.1 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 167 | A | 50.5 | Low | 48.3 | Very low | 95 Ų | 95 | 125.3 Ų | 125.3 | 79% | 0.785 | 78% | 0.777 | S | S | * | * | trans | -159.3 | 129.9 | 150.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 168 | P | 44.5 | Very low | 48.3 | Very low | 134 Ų | 134 | 126.9 Ų | 126.9 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | trans | -96.8 | 146.8 | -179 | 35.7 | -32.9 | 0 | 0 | 0 | 114 | ||||
| 169 | G | 41.4 | Very low | 48.2 | Very low | 65 Ų | 65 | 125.1 Ų | 125.1 | 67% | 0.67 | 80% | 0.798 | S | S | * | * | trans | 95.8 | 100.6 | 158.4 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 170 | M | 60.2 | Low | 48.4 | Very low | 170 Ų | 170 | 121.9 Ų | 121.9 | 84% | 0.837 | 80% | 0.804 | S | S | * | * | -166.7 | 127.8 | 125.1 | -81.3 | -40.4 | 146.3 | 0 | 0 | 108.9 | M172 | M170-M172 PolarHBondContact O-N 3.23Å; M170-M172 VanDerWaalsContact O-N 3.15Å | |||
| 171 | P | 49.5 | Very low | 48.5 | Very low | 130 Ų | 130 | 116.5 Ų | 116.5 | 84% | 0.844 | 79% | 0.791 | S | S | * | * | trans | -83.1 | 89.7 | -179.8 | 32.7 | -33.6 | 0 | 0 | 0 | 111.7 | S173 | P171-S173 PolarHBondContact O-N 3.32Š| ||
| 172 | M | 56.8 | Low | 48.7 | Very low | 176 Ų | 176 | 116 Ų | 116 | 87% | 0.867 | 79% | 0.789 | S | S | * | * | trans | -70.8 | 113.4 | 170.6 | -78.9 | -67.1 | -170.8 | 0 | 0 | 110.7 | M170 | M170-M172 PolarHBondContact O-N 3.23Å; M170-M172 VanDerWaalsContact O-N 3.15Å | ||
| 173 | S | 50.3 | Low | 49.5 | Very low | 95 Ų | 95 | 118.6 Ų | 118.6 | 66% | 0.664 | 79% | 0.785 | S | S | * | * | trans | -65.5 | 132 | -175 | -167.1 | 0 | 0 | 0 | 0 | 112.9 | P171 T175 | P171-S173 PolarHBondContact O-N 3.32Å; S173-T175 PolarHBondContact O-N 3.22Å; S173-T175 PolarHBondContact OG-OG1 3.22Å | ||
| 174 | M | 54.8 | Low | 50 | Low | 162 Ų | 162 | 117 Ų | 117 | 80% | 0.798 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -73.2 | 17.4 | -176.1 | -78.3 | -78.4 | -75.7 | 0 | 0 | 115.1 | A176 | M174-A176 PolarHBondContact O-N 3.38Š|
| 175 | T | 50.9 | Low | 51 | Low | 124 Ų | 124 | 117.1 Ų | 117.1 | 76% | 0.761 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | 5.6 | -167.4 | -29 | 0 | 0 | 0 | 0 | 114.5 | S173 | S173-T175 PolarHBondContact O-N 3.22Å; S173-T175 PolarHBondContact OG-OG1 3.22Å |
| 176 | A | 46.7 | Very low | 51.8 | Low | 75 Ų | 75 | 117.3 Ų | 117.3 | 62% | 0.62 | 76% | 0.756 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | -21.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | M174 G178 | M174-A176 PolarHBondContact O-N 3.38Å; A176-G178 VanDerWaalsContact C-N 3.26Å; A176-G178 PolarHBondContact O-N 3.46Å |
| 177 | L | 55.1 | Low | 52.5 | Low | 159 Ų | 159 | 118.6 Ų | 118.6 | 83% | 0.832 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82 | 61.1 | -173.8 | -65.7 | 174.7 | 0 | 0 | 0 | 112.5 | ||
| 178 | G | 46.7 | Very low | 52.7 | Low | 72 Ų | 72 | 115.3 Ų | 115.3 | 74% | 0.742 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -167.8 | -18.4 | 178.4 | 0 | 0 | 0 | 0 | 0 | 117.3 | A176 C180 | A176-G178 VanDerWaalsContact C-N 3.26Å; A176-G178 PolarHBondContact O-N 3.46Å; G178-C180 PolarHBondContact O-N 3.48Å |
| 179 | A | 47.3 | Very low | 53.1 | Low | 79 Ų | 79 | 112.8 Ų | 112.8 | 65% | 0.653 | 71% | 0.708 | S | S | * | * | trans | -86.1 | -2.3 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | G181 | A179-G181 PolarHBondContact O-N 3.21Š| ||
| 180 | C | 54.4 | Low | 53.9 | Low | 125 Ų | 125 | 114 Ų | 114 | 85% | 0.845 | 71% | 0.712 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 44.8 | -168 | -54.3 | 0 | 0 | 0 | 0 | 114.8 | G178 | G178-C180 PolarHBondContact O-N 3.48Š|
| 181 | G | 52.7 | Low | 53.8 | Low | 64 Ų | 64 | 109.1 Ų | 109.1 | 66% | 0.66 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -150.1 | 2.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 116.7 | A179 | A179-G181 PolarHBondContact O-N 3.21Š|
| 182 | M | 53.8 | Low | 54 | Low | 176 Ų | 176 | 105.9 Ų | 105.9 | 87% | 0.867 | 69% | 0.689 | S | S | * | * | trans | -131.9 | 22.3 | -170.9 | -74.3 | -72.8 | 162 | 0 | 0 | 114 | ||||
| 183 | I | 56.5 | Low | 53.8 | Low | 125 Ų | 125 | 102.5 Ų | 102.5 | 64% | 0.641 | 67% | 0.673 | S | S | * | * | trans | -92.1 | 107.1 | 175.2 | -56.7 | 178.8 | 0 | 0 | 0 | 108.9 | A188 | I183-A188 HydrophobicContact CG2-CB 3.89Š| ||
| 184 | D | 54.7 | Low | 54 | Low | 112 Ų | 112 | 106.9 Ų | 106.9 | 60% | 0.599 | 68% | 0.683 | S | S | * | * | trans | -51.2 | 137.5 | 169 | -76 | -66.2 | 0 | 0 | 0 | 111.1 | A186 K187 A188 | D184-A186 PolarHBondContact O-N 3.22Å; D184-A186 VanDerWaalsContact O-N 3.12Å; D184-K187 HydrophobicContact CB-CB 4.3Å; D184-K187 PolarHBondContact O-N 3.42Å; D184-A188 PolarHBondContact O-N 3.25Å | ||
| 185 | P | 59.2 | Low | 53.9 | Low | 112 Ų | 112 | 105.6 Ų | 105.6 | 73% | 0.727 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -59.6 | -29.3 | 179.9 | 23.4 | -33.2 | 0 | 0 | 0 | 112.4 | A189 | P185-A189 PolarHBondContact O-N 2.86Å; P185-A189 VanDerWaalsContact O-N 3.14Å |
| 186 | A | 59.5 | Low | 54.2 | Low | 81 Ų | 81 | 104.2 Ų | 104.2 | 67% | 0.669 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -65.4 | -34.5 | 172.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | D184 A190 | D184-A186 PolarHBondContact O-N 3.22Å; D184-A186 VanDerWaalsContact O-N 3.12Å; A186-A190 PolarHBondContact O-N 2.84Å |
| 187 | K | 56.9 | Low | 54.6 | Low | 159 Ų | 159 | 108.9 Ų | 108.9 | 69% | 0.691 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -85.1 | -28.3 | 180 | -159.2 | 164.7 | -173.9 | 171.5 | 0 | 112.4 | D184 A190 A191 | D184-K187 HydrophobicContact CB-CB 4.3Å; D184-K187 PolarHBondContact O-N 3.42Å; K187-A190 PolarHBondContact O-N 2.79Å; K187-A191 PolarHBondContact O-N 3.31Å |
| 188 | A | 53.8 | Low | 54.7 | Low | 27 Ų | 27 | 105.5 Ų | 105.5 | 22% | 0.223 | 67% | 0.673 | C | S | . | * | H | α-helix | trans | -61.7 | -43.3 | 166.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | I183 D184 A190 A191 | I183-A188 HydrophobicContact CG2-CB 3.89Å; D184-A188 PolarHBondContact O-N 3.25Å; A188-A190 VanDerWaalsContact C-N 3.31Å; A188-A190 PolarHBondContact O-N 2.84Å; A188-A191 PolarHBondContact O-N 3Å; A188-A191 VanDerWaalsContact O-N 3.11Å |
| 189 | A | 54.3 | Low | 55.5 | Low | 80 Ų | 80 | 109.9 Ų | 109.9 | 66% | 0.661 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -60.6 | -38 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113 | P185 A191 | P185-A189 PolarHBondContact O-N 2.86Å; P185-A189 VanDerWaalsContact O-N 3.14Å; A189-A191 VanDerWaalsContact C-N 3.27Å; A189-A191 PolarHBondContact O-N 3.06Å |
| 190 | A | 56.9 | Low | 56.4 | Low | 90 Ų | 90 | 117.8 Ų | 117.8 | 74% | 0.744 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -69.5 | -20.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114 | A186 K187 A188 G192 | A186-A190 PolarHBondContact O-N 2.84Å; K187-A190 PolarHBondContact O-N 2.79Å; A188-A190 VanDerWaalsContact C-N 3.31Å; A188-A190 PolarHBondContact O-N 2.84Å; A190-G192 VanDerWaalsContact C-N 3.31Å; A190-G192 PolarHBondContact O-N 3.41Å |
| 191 | A | 58.8 | Low | 57.5 | Low | 68 Ų | 68 | 123.5 Ų | 123.5 | 56% | 0.562 | 69% | 0.691 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 2.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | K187 A188 A189 I193 | K187-A191 PolarHBondContact O-N 3.31Å; A188-A191 PolarHBondContact O-N 3Å; A188-A191 VanDerWaalsContact O-N 3.11Å; A189-A191 VanDerWaalsContact C-N 3.27Å; A189-A191 PolarHBondContact O-N 3.06Å; A191-I193 PolarHBondContact O-N 2.89Å |
| 192 | G | 53.1 | Low | 58.6 | Low | 62 Ų | 62 | 129.9 Ų | 129.9 | 64% | 0.639 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 71.6 | -11.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | A190 Q194 | A190-G192 VanDerWaalsContact C-N 3.31Å; A190-G192 PolarHBondContact O-N 3.41Å; G192-Q194 VanDerWaalsContact C-N 3.29Å; G192-Q194 PolarHBondContact O-N 3.09Å |
| 193 | I | 54.3 | Low | 60.1 | Low | 106 Ų | 106 | 132.1 Ų | 132.1 | 54% | 0.544 | 70% | 0.699 | S | S | . | * | trans | -76.9 | 80.9 | 177.9 | -52.4 | -175.5 | 0 | 0 | 0 | 109.6 | A191 F195 | A191-I193 PolarHBondContact O-N 2.89Å; I193-F195 VanDerWaalsContact C-N 3.26Å; I193-F195 HydrophobicContact CB-CE2 4.42Å; I193-F195 HydrophobicContact CG2-CD2 3.83Å; I193-F195 HydrophobicContact CG2-CE1 4.43Å; I193-F195 HydrophobicContact CG2-CE2 3.53Å; I193-F195 HydrophobicContact CG2-CG 4.41Å; I193-F195 HydrophobicContact CG2-CZ 3.87Å; I193-F195 PolarHBondContact O-N 3.31Å | ||
| 194 | Q | 53.2 | Low | 61.7 | Low | 187 Ų | 187 | 137.2 Ų | 137.2 | 87% | 0.874 | 71% | 0.71 | S | S | * | * | trans | -69.4 | 82.6 | 168.3 | -66.4 | -166.7 | 15.2 | 0 | 0 | 110.4 | G192 P196 | G192-Q194 VanDerWaalsContact C-N 3.29Å; G192-Q194 PolarHBondContact O-N 3.09Å; Q194-P196 WeakPolarHBondContact O-CD 3.46Å | ||
| 195 | F | 52.2 | Low | 63.3 | Low | 135 Ų | 135 | 137.5 Ų | 137.5 | 59% | 0.592 | 72% | 0.716 | S | S | * | * | trans | -55.5 | 126.8 | 159.6 | -71.7 | -78.2 | 0 | 0 | 0 | 108.5 | I193 M197 | I193-F195 VanDerWaalsContact C-N 3.26Å; I193-F195 HydrophobicContact CB-CE2 4.42Å; I193-F195 HydrophobicContact CG2-CD2 3.83Å; I193-F195 HydrophobicContact CG2-CE1 4.43Å; I193-F195 HydrophobicContact CG2-CE2 3.53Å; I193-F195 HydrophobicContact CG2-CG 4.41Å; I193-F195 HydrophobicContact CG2-CZ 3.87Å; I193-F195 PolarHBondContact O-N 3.31Å; F195-M197 HydrophobicContact CB-CE 4Å; F195-M197 HydrophobicContact CB-CG 4.05Å; F195-M197 HydrophobicContact CG-CE 4.39Å; F195-M197 PolarHBondContact O-N 2.59Å | ||
| 196 | P | 57.7 | Low | 65 | Low | 94 Ų | 94 | 139.5 Ų | 139.5 | 61% | 0.61 | 72% | 0.72 | S | S | * | * | trans | -78.1 | 55.7 | -173 | 31.4 | -36.5 | 0 | 0 | 0 | 112.7 | Q194 A198 Q199 | Q194-P196 WeakPolarHBondContact O-CD 3.46Å; P196-A198 PolarHBondContact O-N 2.76Å; P196-Q199 HydrophobicContact CB-CG 4.36Å; P196-Q199 PolarHBondContact O-N 3.37Å | ||
| 197 | M | 55.2 | Low | 66.7 | Low | 173 Ų | 173 | 138.8 Ų | 138.8 | 85% | 0.852 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.1 | 26.8 | 178.7 | -59.7 | -169.1 | -178.1 | 0 | 0 | 113.9 | F195 | F195-M197 HydrophobicContact CB-CE 4Å; F195-M197 HydrophobicContact CB-CG 4.05Å; F195-M197 HydrophobicContact CG-CE 4.39Å; F195-M197 PolarHBondContact O-N 2.59Å |
| 198 | A | 58.4 | Low | 68.6 | Low | 89 Ų | 89 | 135 Ų | 135 | 74% | 0.736 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -142.7 | 5.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | P196 R200 | P196-A198 PolarHBondContact O-N 2.76Å; A198-R200 VanDerWaalsContact C-N 3.28Å; A198-R200 PolarHBondContact O-N 3.01Å |
| 199 | Q | 61.8 | Low | 70.7 | Confident | 164 Ų | 164 | 141 Ų | 141 | 77% | 0.766 | 72% | 0.715 | S | S | * | * | trans | -68 | 85.2 | 174.2 | -79.6 | -168.2 | -10.2 | 0 | 0 | 111.3 | P196 R201 | P196-Q199 HydrophobicContact CB-CG 4.36Å; P196-Q199 PolarHBondContact O-N 3.37Å; Q199-R201 PolarHBondContact O-N 2.92Å | ||
| 200 | R | 67.3 | Low | 72.8 | Confident | 245 Ų | 245 | 140.5 Ų | 140.5 | 93% | 0.925 | 71% | 0.712 | S | S | * | * | trans | -50.4 | 105.9 | 173.5 | -83.9 | 179.8 | 161.5 | 172.5 | -5.1 | 110 | A198 K202 | A198-R200 VanDerWaalsContact C-N 3.28Å; A198-R200 PolarHBondContact O-N 3.01Å; R200-K202 PolarHBondContact O-N 3.41Å; R200-K202 VanDerWaalsContact O-N 3.16Å | ||
| 201 | R | 76.8 | Confident | 74.8 | Confident | 244 Ų | 244 | 137.7 Ų | 137.7 | 92% | 0.921 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 121.9 | 172.1 | -68.8 | 178.9 | 175.7 | 172.1 | -1 | 108.8 | Q199 R203 | Q199-R201 PolarHBondContact O-N 2.92Å; R201-R203 PolarHBondContact O-N 3.3Å |
| 202 | K | 76.8 | Confident | 76.6 | Confident | 199 Ų | 199 | 135.9 Ų | 135.9 | 87% | 0.865 | 67% | 0.665 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 125.6 | -179.3 | -166.9 | 83.2 | 171.3 | -171.6 | 0 | 109 | R200 R204 | R200-K202 PolarHBondContact O-N 3.41Å; R200-K202 VanDerWaalsContact O-N 3.16Å; K202-R204 PolarHBondContact O-N 3.27Å |
| 203 | R | 85.9 | Confident | 78.8 | Confident | 223 Ų | 223 | 139.6 Ų | 139.6 | 84% | 0.842 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 124 | -177.9 | -171.1 | 176.9 | 78.1 | 173.6 | 2.8 | 109.5 | R201 V205 | R201-R203 PolarHBondContact O-N 3.3Å; R203-V205 PolarHBondContact O-N 3.36Å |
| 204 | R | 88.3 | Confident | 80.9 | Confident | 232 Ų | 232 | 136 Ų | 136 | 88% | 0.875 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.7 | 173.9 | -69.8 | -179.3 | 176 | 167.6 | -0.5 | 108.8 | K202 | K202-R204 PolarHBondContact O-N 3.27Š|
| 205 | V | 89.2 | Confident | 83 | Confident | 118 Ų | 118 | 127 Ų | 127 | 72% | 0.715 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 131.8 | 172.4 | 179.7 | 0 | 0 | 0 | 0 | 107.6 | R203 | R203-V205 PolarHBondContact O-N 3.36Š|
| 206 | L | 93.8 | Very high | 85.2 | Confident | 154 Ų | 154 | 123.9 Ų | 123.9 | 81% | 0.806 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -95.5 | 149 | 171.1 | -58.3 | 180 | 0 | 0 | 0 | 109.1 | ||
| 207 | F | 96.4 | Very high | 87.1 | Confident | 65 Ų | 65 | 125.2 Ų | 125.2 | 29% | 0.285 | 58% | 0.579 | S | S | . | * | P | Polyproline II helix | trans | -76.2 | 151.5 | 171.1 | -56.3 | -48 | 0 | 0 | 0 | 110.2 | Q211 V212 L239 Q243 W247 | F207-Q211 HydrophobicContact CB-CB 4.15Å; F207-V212 HydrophobicContact CB-CG2 4.03Å; F207-L239 HydrophobicContact CD1-CD1 3.8Å; F207-L239 HydrophobicContact CD1-CD2 3.63Å; F207-L239 HydrophobicContact CD1-CG 4.4Å; F207-L239 HydrophobicContact CE1-CD1 3.8Å; F207-L239 HydrophobicContact CE1-CD2 3.59Å; F207-L239 HydrophobicContact CE1-CG 4.38Å; F207-L239 HydrophobicContact CG-CD1 4.3Å; F207-L239 HydrophobicContact CZ-CD1 4.31Å; F207-Q243 HydrophobicContact CE1-CB 4.38Å; F207-Q243 HydrophobicContact CE1-CG 4.36Å; F207-Q243 HydrophobicContact CZ-CB 4.12Å; F207-Q243 HydrophobicContact CZ-CG 4.29Å; F207-W247 AromaticContact CD2-CD1 3.98Å; F207-W247 AromaticContact CE2-CD1 3.87Å |
| 208 | T | 97.7 | Very high | 89.2 | Confident | 81 Ų | 81 | 120.9 Ų | 120.9 | 50% | 0.497 | 55% | 0.554 | S | S | . | * | P | Polyproline II helix | trans | -72.5 | 158.1 | 175.6 | 70.9 | 0 | 0 | 0 | 0 | 110.9 | A210 Q211 V212 | T208-A210 PolarHBondContact O-N 3.08Å; T208-Q211 WeakPolarHBondContact O-CB 3.44Å; T208-Q211 PolarHBondContact O-N 2.96Å; T208-Q211 WeakPolarHBondContact OG1-CG 3.39Å; T208-Q211 PolarHBondContact OG1-N 3.11Å; T208-V212 PolarHBondContact O-N 3.36Å |
| 209 | Q | 97.7 | Very high | 91 | Very high | 151 Ų | 151 | 117.2 Ų | 117.2 | 71% | 0.706 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -59.5 | -33.5 | 179.3 | -170.9 | 59.4 | 26.7 | 0 | 0 | 112.5 | V212 Y213 | Q209-V212 PolarHBondContact O-N 2.87Å; Q209-Y213 WeakPolarHBondContact O-CB 3.35Å; Q209-Y213 PolarHBondContact O-N 3.5Å |
| 210 | A | 97.7 | Very high | 92.7 | Very high | 71 Ų | 71 | 115.3 Ų | 115.3 | 59% | 0.587 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -66.5 | -40.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | T208 Y213 E214 | T208-A210 PolarHBondContact O-N 3.08Å; A210-Y213 PolarHBondContact O-N 2.98Å; A210-E214 PolarHBondContact O-N 3.12Å; A210-E214 VanDerWaalsContact O-N 3.14Å |
| 211 | Q | 98.2 | Very high | 94.1 | Very high | 30 Ų | 30 | 109.6 Ų | 109.6 | 14% | 0.14 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -63.2 | -44.3 | 173.8 | -72.7 | 173 | -32.5 | 0 | 0 | 111.3 | F207 T208 L215 I237 | F207-Q211 HydrophobicContact CB-CB 4.15Å; T208-Q211 WeakPolarHBondContact O-CB 3.44Å; T208-Q211 PolarHBondContact O-N 2.96Å; T208-Q211 WeakPolarHBondContact OG1-CG 3.39Å; T208-Q211 PolarHBondContact OG1-N 3.11Å; Q211-L215 WeakPolarHBondContact O-CB 3.19Å; Q211-L215 WeakPolarHBondContact O-CD1 3.31Å; Q211-L215 WeakPolarHBondContact O-CG 3.28Å; Q211-L215 PolarHBondContact O-N 3.19Å; Q211-I237 HydrophobicContact CG-CB 4.33Å; Q211-I237 WeakPolarHBondContact CG-O 3.4Å; Q211-I237 PolarHBondContact NE2-O 3.27Å |
| 212 | V | 98 | Very high | 95.1 | Very high | 30 Ų | 30 | 101.5 Ų | 101.5 | 18% | 0.182 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 176.8 | 178.1 | 0 | 0 | 0 | 0 | 111.1 | F207 T208 Q209 L215 E216 | F207-V212 HydrophobicContact CB-CG2 4.03Å; T208-V212 PolarHBondContact O-N 3.36Å; Q209-V212 PolarHBondContact O-N 2.87Å; V212-L215 PolarHBondContact O-N 3.16Å; V212-E216 HydrophobicContact CG1-CG 4.37Å; V212-E216 WeakPolarHBondContact O-CG 3.48Å; V212-E216 PolarHBondContact O-N 2.95Å |
| 213 | Y | 98.1 | Very high | 96.1 | Very high | 140 Ų | 140 | 96 Ų | 96 | 55% | 0.549 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -58.2 | -49.5 | 177.7 | 175.3 | -92.7 | 0 | 0 | 0 | 112.7 | Q209 A210 E216 R217 | Q209-Y213 WeakPolarHBondContact O-CB 3.35Å; Q209-Y213 PolarHBondContact O-N 3.5Å; A210-Y213 PolarHBondContact O-N 2.98Å; Y213-E216 PolarHBondContact O-N 2.77Å; Y213-R217 VanDerWaalsContact O-CB 3.31Å; Y213-R217 WeakPolarHBondContact O-CB 3.29Å; Y213-R217 PolarHBondContact O-N 3.37Å |
| 214 | E | 98.2 | Very high | 96.7 | Very high | 30 Ų | 30 | 93.3 Ų | 93.3 | 14% | 0.14 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -68.6 | -35.5 | 178.6 | -81.5 | -60 | 132.5 | 0 | 0 | 112.8 | A210 R217 R218 M236 I237 | A210-E214 PolarHBondContact O-N 3.12Å; A210-E214 VanDerWaalsContact O-N 3.14Å; E214-R217 PolarHBondContact O-N 3.31Å; E214-R217 WeakPolarHBondContact OE1-CD 3.33Å; E214-R217 IonicContact OE1-CZ 3.65Å; E214-R217 IonicContact OE1-NE 3.81Å; E214-R217 IonicContact OE1-NH1 2.72Å; E214-R217 PolarHBondContact OE1-NH1 2.96Å; E214-R217 IonicContact OE2-NH1 3.43Å; E214-R217 PolarHBondContact OE2-NH1 3.3Å; E214-R218 WeakPolarHBondContact O-CG 3.49Å; E214-R218 PolarHBondContact O-N 2.91Å; E214-M236 HydrophobicContact CB-CE 4.31Å; E214-M236 HydrophobicContact CG-CE 4.07Å; E214-M236 VanDerWaalsContact OE2-CE 3.26Å; E214-M236 WeakPolarHBondContact OE2-CE 3.34Å; E214-I237 HydrophobicContact CB-CG2 3.76Å; E214-I237 HydrophobicContact CG-CG2 4.35Å |
| 215 | L | 98.5 | Very high | 97.1 | Very high | 0 Ų | 0 | 83.5 Ų | 83.5 | 0% | 0 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 171.9 | -73.6 | 165 | 0 | 0 | 0 | 111.6 | Q211 V212 F219 L233 I237 L239 V244 W247 F248 | Q211-L215 WeakPolarHBondContact O-CB 3.19Å; Q211-L215 WeakPolarHBondContact O-CD1 3.31Å; Q211-L215 WeakPolarHBondContact O-CG 3.28Å; Q211-L215 PolarHBondContact O-N 3.19Å; V212-L215 PolarHBondContact O-N 3.16Å; L215-F219 VanDerWaalsContact O-CB 3.27Å; L215-F219 WeakPolarHBondContact O-CB 3.07Å; L215-F219 PolarHBondContact O-N 3.41Å; L215-L233 HydrophobicContact CD2-CD2 4.24Å; L215-I237 HydrophobicContact CD1-CD1 4.15Å; L215-I237 HydrophobicContact CD2-CD1 3.64Å; L215-I237 HydrophobicContact CG-CD1 3.67Å; L215-L239 HydrophobicContact CD1-CD1 4.17Å; L215-V244 HydrophobicContact CD2-CG1 4.06Å; L215-V244 HydrophobicContact CD2-CG2 4.36Å; L215-W247 HydrophobicContact CB-CD2 3.9Å; L215-W247 HydrophobicContact CB-CE3 3.92Å; L215-W247 HydrophobicContact CB-CH2 3.74Å; L215-W247 HydrophobicContact CB-CZ2 3.68Å; L215-W247 HydrophobicContact CB-CZ3 3.86Å; L215-W247 HydrophobicContact CD1-CD2 3.94Å; L215-W247 HydrophobicContact CD1-CG 3.86Å; L215-W247 HydrophobicContact CD2-CD2 4.24Å; L215-W247 HydrophobicContact CD2-CE3 4.14Å; L215-W247 HydrophobicContact CD2-CG 4.5Å; L215-W247 HydrophobicContact CG-CD2 4.25Å; L215-W247 HydrophobicContact CG-CE3 4.45Å; L215-F248 HydrophobicContact CD2-CD2 4.38Å; L215-F248 HydrophobicContact CD2-CE2 3.9Å |
| 216 | E | 98.1 | Very high | 97.5 | Very high | 68 Ų | 68 | 80.3 Ų | 80.3 | 32% | 0.318 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -70.3 | -37.4 | 176.1 | -72.1 | -169.1 | 176.6 | 0 | 0 | 113.3 | V212 Y213 F219 K220 W247 H251 | V212-E216 HydrophobicContact CG1-CG 4.37Å; V212-E216 WeakPolarHBondContact O-CG 3.48Å; V212-E216 PolarHBondContact O-N 2.95Å; Y213-E216 PolarHBondContact O-N 2.77Å; E216-F219 PolarHBondContact O-N 3.47Å; E216-K220 WeakPolarHBondContact O-CB 3.35Å; E216-K220 VanDerWaalsContact O-CG 3.29Å; E216-K220 WeakPolarHBondContact O-CG 3.43Å; E216-K220 PolarHBondContact O-N 3.02Å; E216-W247 HydrophobicContact CB-CH2 4.5Å; E216-W247 HydrophobicContact CG-CH2 3.79Å; E216-W247 HydrophobicContact CG-CZ2 3.75Å; E216-H251 IonicContact OE1-CE1 3.93Å |
| 217 | R | 97.9 | Very high | 97.7 | Very high | 122 Ų | 122 | 75.2 Ų | 75.2 | 46% | 0.46 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.1 | -49.4 | 174.5 | -176.2 | -173.8 | 179.9 | -164.4 | -0.7 | 110.7 | Y213 E214 K220 Q221 | Y213-R217 VanDerWaalsContact O-CB 3.31Å; Y213-R217 WeakPolarHBondContact O-CB 3.29Å; Y213-R217 PolarHBondContact O-N 3.37Å; E214-R217 PolarHBondContact O-N 3.31Å; E214-R217 WeakPolarHBondContact OE1-CD 3.33Å; E214-R217 IonicContact OE1-CZ 3.65Å; E214-R217 IonicContact OE1-NE 3.81Å; E214-R217 IonicContact OE1-NH1 2.72Å; E214-R217 PolarHBondContact OE1-NH1 2.96Å; E214-R217 IonicContact OE2-NH1 3.43Å; E214-R217 PolarHBondContact OE2-NH1 3.3Å; R217-K220 PolarHBondContact O-N 3.29Å; R217-Q221 PolarHBondContact O-N 3.11Å |
| 218 | R | 97.7 | Very high | 97.7 | Very high | 82 Ų | 82 | 76.2 Ų | 76.2 | 31% | 0.309 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -67.3 | -37.8 | 175.2 | -65.6 | -57.4 | -167 | 155.5 | 8.2 | 112.2 | E214 K220 Q221 Q222 L233 F248 | E214-R218 WeakPolarHBondContact O-CG 3.49Å; E214-R218 PolarHBondContact O-N 2.91Å; R218-K220 VanDerWaalsContact C-N 3.32Å; R218-K220 PolarHBondContact O-N 3.32Å; R218-Q221 VanDerWaalsContact CD-OE1 3.29Å; R218-Q221 WeakPolarHBondContact O-CB 3.39Å; R218-Q221 PolarHBondContact O-N 3.42Å; R218-Q222 PolarHBondContact O-N 3.47Å; R218-L233 HydrophobicContact CB-CD2 3.96Å; R218-L233 HydrophobicContact CG-CD1 3.82Å; R218-L233 HydrophobicContact CG-CD2 3.93Å; R218-F248 HydrophobicContact CB-CZ 4.3Å |
| 219 | F | 98.1 | Very high | 97.7 | Very high | 13 Ų | 13 | 75.8 Ų | 75.8 | 6% | 0.057 | 37% | 0.367 | C | S | . | . | H | α-helix | trans | -66.8 | -29.6 | 175.4 | -173.5 | -101.2 | 0 | 0 | 0 | 113.6 | L215 E216 K223 W247 F248 H251 R252 | L215-F219 VanDerWaalsContact O-CB 3.27Å; L215-F219 WeakPolarHBondContact O-CB 3.07Å; L215-F219 PolarHBondContact O-N 3.41Å; E216-F219 PolarHBondContact O-N 3.47Å; F219-K223 HydrophobicContact CD1-CD 4.13Å; F219-K223 HydrophobicContact CD2-CD 4.25Å; F219-K223 HydrophobicContact CE1-CD 3.59Å; F219-K223 HydrophobicContact CE2-CB 3.96Å; F219-K223 HydrophobicContact CE2-CD 3.72Å; F219-K223 HydrophobicContact CE2-CG 4.45Å; F219-K223 HydrophobicContact CG-CD 4.44Å; F219-K223 HydrophobicContact CZ-CB 4.3Å; F219-K223 HydrophobicContact CZ-CD 3.38Å; F219-K223 HydrophobicContact CZ-CG 4.39Å; F219-K223 WeakPolarHBondContact O-CD 3.32Å; F219-K223 WeakPolarHBondContact O-CE 3.49Å; F219-K223 PolarHBondContact O-NZ 3.26Å; F219-W247 HydrophobicContact CB-CH2 4.16Å; F219-W247 HydrophobicContact CB-CZ3 3.93Å; F219-W247 HydrophobicContact CG-CZ3 4.31Å; F219-F248 HydrophobicContact CB-CE1 4.11Å; F219-F248 HydrophobicContact CB-CZ 4.2Å; F219-F248 AromaticContact CD2-CD1 3.77Å; F219-F248 HydrophobicContact CD2-CD1 3.77Å; F219-F248 AromaticContact CD2-CE1 3.72Å; F219-F248 HydrophobicContact CD2-CE1 3.72Å; F219-F248 HydrophobicContact CE2-CD1 4.45Å; F219-F248 HydrophobicContact CG-CE1 4.43Å; F219-H251 AromaticContact CD1-CD2 3.32Å; F219-H251 WeakPolarHBondContact CD1-CD2 3.29Å; F219-H251 AromaticContact CD1-NE2 3.34Å; F219-H251 VanDerWaalsContact CD1-NE2 3.34Å; F219-H251 WeakPolarHBondContact CD1-NE2 3.48Å; F219-H251 AromaticContact CE1-CD2 3.2Å; F219-H251 WeakPolarHBondContact CE1-CD2 3.41Å; F219-H251 AromaticContact CE1-NE2 3.51Å; F219-H251 AromaticContact CG-CD2 3.89Å; F219-H251 AromaticContact CZ-CD2 3.68Å; F219-R252 HydrophobicContact CE2-CG 3.66Å; F219-R252 HydrophobicContact CZ-CG 3.91Å |
| 220 | K | 97.1 | Very high | 97.8 | Very high | 124 Ų | 124 | 71.3 Ų | 71.3 | 54% | 0.539 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -64.3 | -42.7 | 172.2 | -77 | 164.3 | -174.5 | 168.8 | 0 | 110.8 | E216 R217 R218 | E216-K220 WeakPolarHBondContact O-CB 3.35Å; E216-K220 VanDerWaalsContact O-CG 3.29Å; E216-K220 WeakPolarHBondContact O-CG 3.43Å; E216-K220 PolarHBondContact O-N 3.02Å; R217-K220 PolarHBondContact O-N 3.29Å; R218-K220 VanDerWaalsContact C-N 3.32Å; R218-K220 PolarHBondContact O-N 3.32Å |
| 221 | Q | 97.1 | Very high | 97.8 | Very high | 125 Ų | 125 | 72.3 Ų | 72.3 | 58% | 0.584 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -67.8 | -47.5 | 175.3 | -64.3 | 171 | -20.9 | 0 | 0 | 112.8 | R217 R218 | R217-Q221 PolarHBondContact O-N 3.11Å; R218-Q221 VanDerWaalsContact CD-OE1 3.29Å; R218-Q221 WeakPolarHBondContact O-CB 3.39Å; R218-Q221 PolarHBondContact O-N 3.42Å |
| 222 | Q | 97.1 | Very high | 97.8 | Very high | 73 Ų | 73 | 75.9 Ų | 75.9 | 34% | 0.341 | 35% | 0.353 | S | S | . | . | trans | -147 | 116.6 | -167.8 | -175.2 | 173.1 | -18.7 | 0 | 0 | 111.5 | R218 Y224 L225 E229 | R218-Q222 PolarHBondContact O-N 3.47Å; Q222-Y224 VanDerWaalsContact C-N 3.31Å; Q222-Y224 WeakPolarHBondContact CG-O 3.27Å; Q222-Y224 PolarHBondContact NE2-O 3.19Å; Q222-Y224 PolarHBondContact O-N 3.28Å; Q222-L225 HydrophobicContact CB-CD2 4.42Å; Q222-L225 HydrophobicContact CG-CD2 4.22Å; Q222-E229 VanDerWaalsContact NE2-CD 3.26Å; Q222-E229 PolarHBondContact NE2-OE1 3.01Å; Q222-E229 PolarHBondContact NE2-OE2 3.38Å; Q222-E229 PolarHBondContact OE1-OE1 3.3Å | ||
| 223 | K | 97.1 | Very high | 97.8 | Very high | 85 Ų | 85 | 74.6 Ų | 74.6 | 37% | 0.37 | 35% | 0.345 | S | S | . | . | S | Bend | trans | -75.5 | -17.8 | -175.2 | -49.8 | -64.9 | 166.7 | -158.7 | 0 | 113.7 | F219 R252 | F219-K223 HydrophobicContact CD1-CD 4.13Å; F219-K223 HydrophobicContact CD2-CD 4.25Å; F219-K223 HydrophobicContact CE1-CD 3.59Å; F219-K223 HydrophobicContact CE2-CB 3.96Å; F219-K223 HydrophobicContact CE2-CD 3.72Å; F219-K223 HydrophobicContact CE2-CG 4.45Å; F219-K223 HydrophobicContact CG-CD 4.44Å; F219-K223 HydrophobicContact CZ-CB 4.3Å; F219-K223 HydrophobicContact CZ-CD 3.38Å; F219-K223 HydrophobicContact CZ-CG 4.39Å; F219-K223 WeakPolarHBondContact O-CD 3.32Å; F219-K223 WeakPolarHBondContact O-CE 3.49Å; F219-K223 PolarHBondContact O-NZ 3.26Å; K223-R252 WeakPolarHBondContact O-CD 3.26Å |
| 224 | Y | 98.1 | Very high | 97.8 | Very high | 165 Ų | 165 | 68 Ų | 68 | 65% | 0.647 | 32% | 0.32 | S | S | * | . | S | Bend | trans | -136.6 | 108.9 | -174.6 | -64.4 | -110.4 | 0 | 0 | 0 | 109.8 | Q222 | Q222-Y224 VanDerWaalsContact C-N 3.31Å; Q222-Y224 WeakPolarHBondContact CG-O 3.27Å; Q222-Y224 PolarHBondContact NE2-O 3.19Å; Q222-Y224 PolarHBondContact O-N 3.28Å |
| 225 | L | 97.3 | Very high | 97.8 | Very high | 26 Ų | 26 | 73.2 Ų | 73.2 | 14% | 0.136 | 34% | 0.344 | C | S | . | . | trans | -89.6 | 134.6 | 174.8 | -60.3 | 179.7 | 0 | 0 | 0 | 111.5 | Q222 E229 R230 L233 V244 F248 | Q222-L225 HydrophobicContact CB-CD2 4.42Å; Q222-L225 HydrophobicContact CG-CD2 4.22Å; L225-E229 HydrophobicContact CB-CB 4.43Å; L225-E229 HydrophobicContact CD2-CB 4.21Å; L225-R230 HydrophobicContact CB-CB 4.25Å; L225-R230 HydrophobicContact CD1-CB 4.49Å; L225-R230 PolarHBondContact O-NH2 3.49Å; L225-L233 HydrophobicContact CD1-CD2 3.62Å; L225-V244 HydrophobicContact CD1-CG1 4.22Å; L225-F248 HydrophobicContact CD1-CD1 4.37Å; L225-F248 HydrophobicContact CD1-CD2 4.22Å; L225-F248 HydrophobicContact CD1-CE1 3.83Å; L225-F248 HydrophobicContact CD1-CE2 3.67Å; L225-F248 HydrophobicContact CD1-CZ 3.47Å; L225-F248 VanDerWaalsContact CD1-CZ 3.47Å; L225-F248 HydrophobicContact CD2-CE1 4.36Å; L225-F248 HydrophobicContact CD2-CZ 4.48Å; L225-F248 HydrophobicContact CG-CD1 4.16Å; L225-F248 HydrophobicContact CG-CE1 3.67Å; L225-F248 HydrophobicContact CG-CE2 4.43Å; L225-F248 HydrophobicContact CG-CZ 3.85Å | ||
| 226 | S | 97.9 | Very high | 97.8 | Very high | 52 Ų | 52 | 77.2 Ų | 77.2 | 36% | 0.364 | 36% | 0.364 | S | S | . | . | trans | -64 | -173.8 | 166.5 | 71 | 0 | 0 | 0 | 0 | 111.9 | P228 E229 R230 | S226-P228 WeakPolarHBondContact OG-CD 3.16Å; S226-E229 WeakPolarHBondContact CA-OE2 3.23Å; S226-E229 WeakPolarHBondContact CB-OE2 3.38Å; S226-E229 PolarHBondContact N-OE2 3.23Å; S226-E229 WeakPolarHBondContact OG-CG 3.47Å; S226-E229 PolarHBondContact OG-OE2 3.24Å; S226-R230 VanDerWaalsContact O-CB 3.23Å; S226-R230 WeakPolarHBondContact O-CB 3.15Å; S226-R230 VanDerWaalsContact O-CZ 3.3Å; S226-R230 PolarHBondContact O-NH2 2.82Å | ||
| 227 | A | 97.5 | Very high | 97.7 | Very high | 46 Ų | 46 | 74.7 Ų | 74.7 | 38% | 0.38 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -67.4 | -59.7 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | E229 R230 E231 | A227-E229 PolarHBondContact O-N 3.26Å; A227-R230 WeakPolarHBondContact O-CB 3.5Å; A227-R230 PolarHBondContact O-N 2.86Å; A227-R230 VanDerWaalsContact O-N 3.09Å; A227-E231 PolarHBondContact O-N 3.03Å |
| 228 | P | 97.8 | Very high | 97.7 | Very high | 87 Ų | 87 | 75.5 Ų | 75.5 | 57% | 0.565 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -63.9 | -39 | -173.9 | 24.3 | -35.4 | 0 | 0 | 0 | 113.4 | S226 R230 E231 H232 | S226-P228 WeakPolarHBondContact OG-CD 3.16Å; P228-R230 PolarHBondContact O-N 2.85Å; P228-E231 PolarHBondContact O-N 2.86Å; P228-H232 WeakPolarHBondContact O-CB 3.41Å; P228-H232 PolarHBondContact O-N 3.27Å |
| 229 | E | 97.8 | Very high | 97.7 | Very high | 71 Ų | 71 | 72.8 Ų | 72.8 | 33% | 0.332 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -61.2 | -35.9 | 176.4 | -62.4 | 163.4 | 133.5 | 0 | 0 | 112 | Q222 L225 S226 A227 L233 | Q222-E229 VanDerWaalsContact NE2-CD 3.26Å; Q222-E229 PolarHBondContact NE2-OE1 3.01Å; Q222-E229 PolarHBondContact NE2-OE2 3.38Å; Q222-E229 PolarHBondContact OE1-OE1 3.3Å; L225-E229 HydrophobicContact CB-CB 4.43Å; L225-E229 HydrophobicContact CD2-CB 4.21Å; S226-E229 WeakPolarHBondContact CA-OE2 3.23Å; S226-E229 WeakPolarHBondContact CB-OE2 3.38Å; S226-E229 PolarHBondContact N-OE2 3.23Å; S226-E229 WeakPolarHBondContact OG-CG 3.47Å; S226-E229 PolarHBondContact OG-OE2 3.24Å; A227-E229 PolarHBondContact O-N 3.26Å; E229-L233 VanDerWaalsContact O-CB 3.29Å; E229-L233 WeakPolarHBondContact O-CB 3.35Å; E229-L233 PolarHBondContact O-N 2.86Å |
| 230 | R | 98.2 | Very high | 97.7 | Very high | 57 Ų | 57 | 75.3 Ų | 75.3 | 22% | 0.215 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -74 | -35.3 | 179.3 | -167.7 | -169.4 | -46.2 | 124.4 | 8.3 | 111.6 | L225 S226 A227 P228 A234 P241 V244 | L225-R230 HydrophobicContact CB-CB 4.25Å; L225-R230 HydrophobicContact CD1-CB 4.49Å; L225-R230 PolarHBondContact O-NH2 3.49Å; S226-R230 VanDerWaalsContact O-CB 3.23Å; S226-R230 WeakPolarHBondContact O-CB 3.15Å; S226-R230 VanDerWaalsContact O-CZ 3.3Å; S226-R230 PolarHBondContact O-NH2 2.82Å; A227-R230 WeakPolarHBondContact O-CB 3.5Å; A227-R230 PolarHBondContact O-N 2.86Å; A227-R230 VanDerWaalsContact O-N 3.09Å; P228-R230 PolarHBondContact O-N 2.85Å; R230-A234 WeakPolarHBondContact O-CB 3.4Å; R230-A234 PolarHBondContact O-N 2.76Å; R230-P241 WeakPolarHBondContact CD-O 3.49Å; R230-V244 HydrophobicContact CG-CB 3.87Å; R230-V244 HydrophobicContact CG-CG1 3.7Å |
| 231 | E | 98.2 | Very high | 97.8 | Very high | 93 Ų | 93 | 71.7 Ų | 71.7 | 44% | 0.435 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -69.3 | -45.9 | 174.9 | -74.9 | 159.8 | -151.7 | 0 | 0 | 111.3 | A227 P228 L233 A234 Q235 P241 | A227-E231 PolarHBondContact O-N 3.03Å; P228-E231 PolarHBondContact O-N 2.86Å; E231-L233 PolarHBondContact O-N 3.36Å; E231-A234 WeakPolarHBondContact O-CB 3.21Å; E231-A234 PolarHBondContact O-N 3.48Å; E231-Q235 VanDerWaalsContact O-CG 3.28Å; E231-Q235 WeakPolarHBondContact O-CG 3.3Å; E231-Q235 PolarHBondContact O-N 3.12Å; E231-P241 HydrophobicContact CG-CB 4.23Å; E231-P241 HydrophobicContact CG-CG 3.86Å |
| 232 | H | 98.1 | Very high | 97.8 | Very high | 104 Ų | 104 | 70 Ų | 70 | 48% | 0.481 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -59.9 | -46 | 173.1 | 176.6 | 67.7 | 0 | 0 | 0 | 112.2 | P228 A234 Q235 M236 | P228-H232 WeakPolarHBondContact O-CB 3.41Å; P228-H232 PolarHBondContact O-N 3.27Å; H232-A234 PolarHBondContact O-N 3.44Å; H232-Q235 PolarHBondContact O-N 3.33Å; H232-M236 WeakPolarHBondContact O-CB 3.49Å; H232-M236 PolarHBondContact O-N 3.07Å |
| 233 | L | 98.2 | Very high | 97.8 | Very high | 4 Ų | 4 | 69.6 Ų | 69.6 | 2% | 0.021 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -62.9 | -42.8 | 175.8 | -179.6 | 55.1 | 0 | 0 | 0 | 111.9 | L215 R218 L225 E229 E231 M236 I237 V244 F248 | L215-L233 HydrophobicContact CD2-CD2 4.24Å; R218-L233 HydrophobicContact CB-CD2 3.96Å; R218-L233 HydrophobicContact CG-CD1 3.82Å; R218-L233 HydrophobicContact CG-CD2 3.93Å; L225-L233 HydrophobicContact CD1-CD2 3.62Å; E229-L233 VanDerWaalsContact O-CB 3.29Å; E229-L233 WeakPolarHBondContact O-CB 3.35Å; E229-L233 PolarHBondContact O-N 2.86Å; E231-L233 PolarHBondContact O-N 3.36Å; L233-M236 HydrophobicContact CD1-CE 3.81Å; L233-M236 PolarHBondContact O-N 2.8Å; L233-I237 HydrophobicContact CD1-CD1 4.24Å; L233-I237 HydrophobicContact CD1-CG2 4.02Å; L233-I237 HydrophobicContact CG-CD1 4.21Å; L233-I237 WeakPolarHBondContact O-CG1 3.05Å; L233-I237 PolarHBondContact O-N 3.44Å; L233-I237 VanDerWaalsContact O-N 3.14Å; L233-V244 HydrophobicContact CD2-CG1 4.01Å; L233-V244 HydrophobicContact CG-CG1 4.47Å; L233-F248 HydrophobicContact CD2-CE2 3.97Å; L233-F248 HydrophobicContact CD2-CZ 4.25Å |
| 234 | A | 98.3 | Very high | 97.9 | Very high | 2 Ų | 2 | 65.6 Ų | 65.6 | 2% | 0.017 | 34% | 0.342 | C | S | . | . | H | α-helix | trans | -59.6 | -45.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112 | R230 E231 H232 N238 L239 P241 V244 | R230-A234 WeakPolarHBondContact O-CB 3.4Å; R230-A234 PolarHBondContact O-N 2.76Å; E231-A234 WeakPolarHBondContact O-CB 3.21Å; E231-A234 PolarHBondContact O-N 3.48Å; H232-A234 PolarHBondContact O-N 3.44Å; A234-N238 PolarHBondContact O-N 3.25Å; A234-N238 VanDerWaalsContact O-N 3.1Å; A234-L239 CarbonylContact C-O 3.27Å; A234-L239 WeakPolarHBondContact CB-O 3.49Å; A234-L239 PolarHBondContact O-N 3.48Å; A234-L239 VanDerWaalsContact O-O 3.05Å; A234-P241 HydrophobicContact CB-CB 4.43Å; A234-P241 HydrophobicContact CB-CG 3.94Å; A234-V244 HydrophobicContact CB-CG2 3.9Å |
| 235 | Q | 98 | Very high | 97.9 | Very high | 139 Ų | 139 | 63.3 Ų | 63.3 | 65% | 0.65 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -58.6 | -52 | 172.6 | -69.5 | 164.1 | 1.3 | 0 | 0 | 111.2 | E231 H232 I237 N238 | E231-Q235 VanDerWaalsContact O-CG 3.28Å; E231-Q235 WeakPolarHBondContact O-CG 3.3Å; E231-Q235 PolarHBondContact O-N 3.12Å; H232-Q235 PolarHBondContact O-N 3.33Å; Q235-I237 VanDerWaalsContact C-N 3.27Å; Q235-I237 PolarHBondContact O-N 3.39Å; Q235-N238 PolarHBondContact O-N 3.14Å |
| 236 | M | 97.7 | Very high | 97.9 | Very high | 84 Ų | 84 | 65.9 Ų | 65.9 | 41% | 0.414 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.5 | -34.4 | -175.9 | -169.4 | -177.5 | 80.8 | 0 | 0 | 113.6 | E214 H232 L233 | E214-M236 HydrophobicContact CB-CE 4.31Å; E214-M236 HydrophobicContact CG-CE 4.07Å; E214-M236 VanDerWaalsContact OE2-CE 3.26Å; E214-M236 WeakPolarHBondContact OE2-CE 3.34Å; H232-M236 WeakPolarHBondContact O-CB 3.49Å; H232-M236 PolarHBondContact O-N 3.07Å; L233-M236 HydrophobicContact CD1-CE 3.81Å; L233-M236 PolarHBondContact O-N 2.8Å |
| 237 | I | 97.4 | Very high | 97.9 | Very high | 14 Ų | 14 | 64.8 Ų | 64.8 | 7% | 0.072 | 34% | 0.336 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | 8.4 | -177.2 | 74.5 | -171.3 | 0 | 0 | 0 | 113.9 | Q211 E214 L215 L233 Q235 L239 V244 | Q211-I237 HydrophobicContact CG-CB 4.33Å; Q211-I237 WeakPolarHBondContact CG-O 3.4Å; Q211-I237 PolarHBondContact NE2-O 3.27Å; E214-I237 HydrophobicContact CB-CG2 3.76Å; E214-I237 HydrophobicContact CG-CG2 4.35Å; L215-I237 HydrophobicContact CD1-CD1 4.15Å; L215-I237 HydrophobicContact CD2-CD1 3.64Å; L215-I237 HydrophobicContact CG-CD1 3.67Å; L233-I237 HydrophobicContact CD1-CD1 4.24Å; L233-I237 HydrophobicContact CD1-CG2 4.02Å; L233-I237 HydrophobicContact CG-CD1 4.21Å; L233-I237 WeakPolarHBondContact O-CG1 3.05Å; L233-I237 PolarHBondContact O-N 3.44Å; L233-I237 VanDerWaalsContact O-N 3.14Å; Q235-I237 VanDerWaalsContact C-N 3.27Å; Q235-I237 PolarHBondContact O-N 3.39Å; I237-L239 HydrophobicContact CD1-CB 4.49Å; I237-L239 HydrophobicContact CD1-CD1 3.83Å; I237-L239 HydrophobicContact CD1-CG 4.33Å; I237-L239 HydrophobicContact CG1-CB 4.08Å; I237-L239 HydrophobicContact CG1-CD1 4.04Å; I237-L239 HydrophobicContact CG1-CG 3.98Å; I237-L239 PolarHBondContact O-N 3.45Å; I237-V244 HydrophobicContact CD1-CG2 4.31Å |
| 238 | N | 97.7 | Very high | 98 | Very high | 140 Ų | 140 | 62.9 Ų | 62.9 | 75% | 0.749 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 50.4 | -178 | -64.4 | -85.4 | 0 | 0 | 0 | 113.3 | A234 Q235 | A234-N238 PolarHBondContact O-N 3.25Å; A234-N238 VanDerWaalsContact O-N 3.1Å; Q235-N238 PolarHBondContact O-N 3.14Å |
| 239 | L | 97.3 | Very high | 98 | Very high | 24 Ų | 24 | 63.9 Ų | 63.9 | 13% | 0.126 | 32% | 0.316 | C | S | . | . | trans | -124.7 | 166.9 | 171.1 | -68.9 | -178.2 | 0 | 0 | 0 | 110.4 | F207 L215 A234 I237 Q243 V244 | F207-L239 HydrophobicContact CD1-CD1 3.8Å; F207-L239 HydrophobicContact CD1-CD2 3.63Å; F207-L239 HydrophobicContact CD1-CG 4.4Å; F207-L239 HydrophobicContact CE1-CD1 3.8Å; F207-L239 HydrophobicContact CE1-CD2 3.59Å; F207-L239 HydrophobicContact CE1-CG 4.38Å; F207-L239 HydrophobicContact CG-CD1 4.3Å; F207-L239 HydrophobicContact CZ-CD1 4.31Å; L215-L239 HydrophobicContact CD1-CD1 4.17Å; A234-L239 CarbonylContact C-O 3.27Å; A234-L239 WeakPolarHBondContact CB-O 3.49Å; A234-L239 PolarHBondContact O-N 3.48Å; A234-L239 VanDerWaalsContact O-O 3.05Å; I237-L239 HydrophobicContact CD1-CB 4.49Å; I237-L239 HydrophobicContact CD1-CD1 3.83Å; I237-L239 HydrophobicContact CD1-CG 4.33Å; I237-L239 HydrophobicContact CG1-CB 4.08Å; I237-L239 HydrophobicContact CG1-CD1 4.04Å; I237-L239 HydrophobicContact CG1-CG 3.98Å; I237-L239 PolarHBondContact O-N 3.45Å; L239-Q243 HydrophobicContact CB-CB 4.41Å; L239-V244 HydrophobicContact CB-CG2 4.32Å | ||
| 240 | T | 98 | Very high | 98 | Very high | 66 Ų | 66 | 65.1 Ų | 65.1 | 41% | 0.405 | 33% | 0.325 | S | S | . | . | trans | -80.2 | 149.7 | 170.9 | 61.1 | 0 | 0 | 0 | 0 | 111.4 | T242 Q243 V244 | T240-T242 PolarHBondContact O-N 2.97Å; T240-T242 VanDerWaalsContact O-N 3.11Å; T240-Q243 WeakPolarHBondContact O-CB 3.5Å; T240-Q243 PolarHBondContact O-N 3.42Å; T240-Q243 WeakPolarHBondContact OG1-CB 3.34Å; T240-Q243 VanDerWaalsContact OG1-CG 3.3Å; T240-Q243 WeakPolarHBondContact OG1-CG 3.38Å; T240-Q243 PolarHBondContact OG1-N 2.92Å; T240-Q243 VanDerWaalsContact OG1-N 3.12Å; T240-Q243 PolarHBondContact OG1-OE1 3.04Å; T240-V244 PolarHBondContact O-N 3.4Å; T240-V244 VanDerWaalsContact O-N 3.08Å | ||
| 241 | P | 98.2 | Very high | 97.9 | Very high | 49 Ų | 49 | 64 Ų | 64 | 32% | 0.318 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -55.2 | -30.1 | 172.6 | -26.3 | 34.8 | 0 | 0 | 0 | 113.1 | R230 E231 A234 V244 K245 | R230-P241 WeakPolarHBondContact CD-O 3.49Å; E231-P241 HydrophobicContact CG-CB 4.23Å; E231-P241 HydrophobicContact CG-CG 3.86Å; A234-P241 HydrophobicContact CB-CB 4.43Å; A234-P241 HydrophobicContact CB-CG 3.94Å; P241-V244 PolarHBondContact O-N 3.36Å; P241-K245 WeakPolarHBondContact O-CB 3.3Å; P241-K245 PolarHBondContact O-N 3.43Å |
| 242 | T | 98.1 | Very high | 97.9 | Very high | 88 Ų | 88 | 63.2 Ų | 63.2 | 54% | 0.54 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -68.3 | -41.8 | 174.2 | -56.5 | 0 | 0 | 0 | 0 | 112.6 | T240 K245 I246 | T240-T242 PolarHBondContact O-N 2.97Å; T240-T242 VanDerWaalsContact O-N 3.11Å; T242-K245 WeakPolarHBondContact O-CB 3.48Å; T242-K245 PolarHBondContact O-N 2.94Å; T242-I246 HydrophobicContact CG2-CD1 3.95Å; T242-I246 WeakPolarHBondContact O-CB 3.2Å; T242-I246 VanDerWaalsContact O-CG1 3.3Å; T242-I246 WeakPolarHBondContact O-CG1 3.32Å; T242-I246 PolarHBondContact O-N 3.31Å |
| 243 | Q | 97.7 | Very high | 97.9 | Very high | 66 Ų | 66 | 64.4 Ų | 64.4 | 31% | 0.308 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -63.2 | -42.5 | 173 | -77.6 | 160.5 | -53 | 0 | 0 | 111.5 | F207 L239 T240 I246 W247 | F207-Q243 HydrophobicContact CE1-CB 4.38Å; F207-Q243 HydrophobicContact CE1-CG 4.36Å; F207-Q243 HydrophobicContact CZ-CB 4.12Å; F207-Q243 HydrophobicContact CZ-CG 4.29Å; L239-Q243 HydrophobicContact CB-CB 4.41Å; T240-Q243 WeakPolarHBondContact O-CB 3.5Å; T240-Q243 PolarHBondContact O-N 3.42Å; T240-Q243 WeakPolarHBondContact OG1-CB 3.34Å; T240-Q243 VanDerWaalsContact OG1-CG 3.3Å; T240-Q243 WeakPolarHBondContact OG1-CG 3.38Å; T240-Q243 PolarHBondContact OG1-N 2.92Å; T240-Q243 VanDerWaalsContact OG1-N 3.12Å; T240-Q243 PolarHBondContact OG1-OE1 3.04Å; Q243-I246 PolarHBondContact O-N 3.42Å; Q243-W247 WeakPolarHBondContact O-CB 3.27Å; Q243-W247 PolarHBondContact O-N 3.13Å |
| 244 | V | 98.1 | Very high | 97.8 | Very high | 1 Ų | 1 | 69.7 Ų | 69.7 | 1% | 0.006 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62.9 | -44.6 | 175.1 | -177.1 | 0 | 0 | 0 | 0 | 110.8 | L215 L225 R230 L233 A234 I237 L239 T240 P241 I246 W247 F248 | L215-V244 HydrophobicContact CD2-CG1 4.06Å; L215-V244 HydrophobicContact CD2-CG2 4.36Å; L225-V244 HydrophobicContact CD1-CG1 4.22Å; R230-V244 HydrophobicContact CG-CB 3.87Å; R230-V244 HydrophobicContact CG-CG1 3.7Å; L233-V244 HydrophobicContact CD2-CG1 4.01Å; L233-V244 HydrophobicContact CG-CG1 4.47Å; A234-V244 HydrophobicContact CB-CG2 3.9Å; I237-V244 HydrophobicContact CD1-CG2 4.31Å; L239-V244 HydrophobicContact CB-CG2 4.32Å; T240-V244 PolarHBondContact O-N 3.4Å; T240-V244 VanDerWaalsContact O-N 3.08Å; P241-V244 PolarHBondContact O-N 3.36Å; V244-I246 PolarHBondContact O-N 3.01Å; V244-W247 PolarHBondContact O-N 3.33Å; V244-F248 HydrophobicContact CG1-CD2 3.77Å; V244-F248 HydrophobicContact CG1-CE2 3.88Å; V244-F248 WeakPolarHBondContact O-CB 3.42Å; V244-F248 WeakPolarHBondContact O-CD2 3.5Å; V244-F248 PolarHBondContact O-N 3.04Å |
| 245 | K | 98.1 | Very high | 97.6 | Very high | 116 Ų | 116 | 72 Ų | 72 | 50% | 0.504 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -54.7 | -48.9 | 174.6 | -179 | -177.2 | 176.5 | -177.5 | 0 | 111.7 | P241 T242 Q249 | P241-K245 WeakPolarHBondContact O-CB 3.3Å; P241-K245 PolarHBondContact O-N 3.43Å; T242-K245 WeakPolarHBondContact O-CB 3.48Å; T242-K245 PolarHBondContact O-N 2.94Å; K245-Q249 WeakPolarHBondContact O-CB 3.41Å; K245-Q249 PolarHBondContact O-N 2.83Å |
| 246 | I | 97.8 | Very high | 97.5 | Very high | 81 Ų | 81 | 72.5 Ų | 72.5 | 42% | 0.415 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -67.7 | -42.2 | -179.5 | -69.1 | 167.3 | 0 | 0 | 0 | 111 | T242 Q243 V244 Q249 N250 | T242-I246 HydrophobicContact CG2-CD1 3.95Å; T242-I246 WeakPolarHBondContact O-CB 3.2Å; T242-I246 VanDerWaalsContact O-CG1 3.3Å; T242-I246 WeakPolarHBondContact O-CG1 3.32Å; T242-I246 PolarHBondContact O-N 3.31Å; Q243-I246 PolarHBondContact O-N 3.42Å; V244-I246 PolarHBondContact O-N 3.01Å; I246-Q249 PolarHBondContact O-N 3Å; I246-N250 WeakPolarHBondContact O-CB 3.39Å; I246-N250 VanDerWaalsContact O-CG 3.25Å; I246-N250 PolarHBondContact O-N 3.32Å |
| 247 | W | 98.2 | Very high | 97.4 | Very high | 29 Ų | 29 | 75.7 Ų | 75.7 | 11% | 0.11 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -61.3 | -48 | 176.3 | -172.6 | 100.7 | 0 | 0 | 0 | 111 | F207 L215 E216 F219 Q243 V244 Q249 N250 H251 | F207-W247 AromaticContact CD2-CD1 3.98Å; F207-W247 AromaticContact CE2-CD1 3.87Å; L215-W247 HydrophobicContact CB-CD2 3.9Å; L215-W247 HydrophobicContact CB-CE3 3.92Å; L215-W247 HydrophobicContact CB-CH2 3.74Å; L215-W247 HydrophobicContact CB-CZ2 3.68Å; L215-W247 HydrophobicContact CB-CZ3 3.86Å; L215-W247 HydrophobicContact CD1-CD2 3.94Å; L215-W247 HydrophobicContact CD1-CG 3.86Å; L215-W247 HydrophobicContact CD2-CD2 4.24Å; L215-W247 HydrophobicContact CD2-CE3 4.14Å; L215-W247 HydrophobicContact CD2-CG 4.5Å; L215-W247 HydrophobicContact CG-CD2 4.25Å; L215-W247 HydrophobicContact CG-CE3 4.45Å; E216-W247 HydrophobicContact CB-CH2 4.5Å; E216-W247 HydrophobicContact CG-CH2 3.79Å; E216-W247 HydrophobicContact CG-CZ2 3.75Å; F219-W247 HydrophobicContact CB-CH2 4.16Å; F219-W247 HydrophobicContact CB-CZ3 3.93Å; F219-W247 HydrophobicContact CG-CZ3 4.31Å; Q243-W247 WeakPolarHBondContact O-CB 3.27Å; Q243-W247 PolarHBondContact O-N 3.13Å; V244-W247 PolarHBondContact O-N 3.33Å; W247-Q249 VanDerWaalsContact C-N 3.27Å; W247-Q249 PolarHBondContact O-N 2.87Å; W247-N250 PolarHBondContact O-N 3.36Å; W247-H251 HydrophobicContact CD2-CB 4.38Å; W247-H251 HydrophobicContact CE3-CB 4.05Å; W247-H251 HydrophobicContact CH2-CB 4.04Å; W247-H251 AromaticContact CH2-CE1 3.65Å; W247-H251 AromaticContact CH2-CG 3.6Å; W247-H251 AromaticContact CH2-ND1 3.15Å; W247-H251 WeakPolarHBondContact CH2-ND1 3.5Å; W247-H251 HydrophobicContact CZ2-CB 4.39Å; W247-H251 AromaticContact CZ2-CE1 3.93Å; W247-H251 AromaticContact CZ2-ND1 3.26Å; W247-H251 VanDerWaalsContact CZ2-ND1 3.26Å; W247-H251 WeakPolarHBondContact CZ2-ND1 3.49Å; W247-H251 HydrophobicContact CZ3-CB 3.86Å; W247-H251 AromaticContact CZ3-CG 3.86Å; W247-H251 AromaticContact CZ3-ND1 3.89Å; W247-H251 VanDerWaalsContact O-CB 3.27Å; W247-H251 WeakPolarHBondContact O-CB 3.47Å; W247-H251 PolarHBondContact O-N 2.89Å |
| 248 | F | 98.4 | Very high | 97.1 | Very high | 5 Ų | 5 | 77.7 Ų | 77.7 | 2% | 0.022 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -63.4 | -30.5 | 176.8 | -90.1 | -105.6 | 0 | 0 | 0 | 112.7 | L215 R218 F219 L225 L233 V244 R252 | L215-F248 HydrophobicContact CD2-CD2 4.38Å; L215-F248 HydrophobicContact CD2-CE2 3.9Å; R218-F248 HydrophobicContact CB-CZ 4.3Å; F219-F248 HydrophobicContact CB-CE1 4.11Å; F219-F248 HydrophobicContact CB-CZ 4.2Å; F219-F248 AromaticContact CD2-CD1 3.77Å; F219-F248 HydrophobicContact CD2-CD1 3.77Å; F219-F248 AromaticContact CD2-CE1 3.72Å; F219-F248 HydrophobicContact CD2-CE1 3.72Å; F219-F248 HydrophobicContact CE2-CD1 4.45Å; F219-F248 HydrophobicContact CG-CE1 4.43Å; L225-F248 HydrophobicContact CD1-CD1 4.37Å; L225-F248 HydrophobicContact CD1-CD2 4.22Å; L225-F248 HydrophobicContact CD1-CE1 3.83Å; L225-F248 HydrophobicContact CD1-CE2 3.67Å; L225-F248 HydrophobicContact CD1-CZ 3.47Å; L225-F248 VanDerWaalsContact CD1-CZ 3.47Å; L225-F248 HydrophobicContact CD2-CE1 4.36Å; L225-F248 HydrophobicContact CD2-CZ 4.48Å; L225-F248 HydrophobicContact CG-CD1 4.16Å; L225-F248 HydrophobicContact CG-CE1 3.67Å; L225-F248 HydrophobicContact CG-CE2 4.43Å; L225-F248 HydrophobicContact CG-CZ 3.85Å; L233-F248 HydrophobicContact CD2-CE2 3.97Å; L233-F248 HydrophobicContact CD2-CZ 4.25Å; V244-F248 HydrophobicContact CG1-CD2 3.77Å; V244-F248 HydrophobicContact CG1-CE2 3.88Å; V244-F248 WeakPolarHBondContact O-CB 3.42Å; V244-F248 WeakPolarHBondContact O-CD2 3.5Å; V244-F248 PolarHBondContact O-N 3.04Å; F248-R252 WeakPolarHBondContact O-CB 3.42Å; F248-R252 WeakPolarHBondContact O-CG 3.4Å; F248-R252 PolarHBondContact O-N 3.48Å; F248-R252 PolarHBondContact O-NE 2.86Å |
| 249 | Q | 97.9 | Very high | 96.8 | Very high | 108 Ų | 108 | 74 Ų | 74 | 51% | 0.505 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -70.7 | -49.1 | 172.9 | -174.5 | 173.7 | 6 | 0 | 0 | 111.9 | K245 I246 W247 H251 R252 Y253 | K245-Q249 WeakPolarHBondContact O-CB 3.41Å; K245-Q249 PolarHBondContact O-N 2.83Å; I246-Q249 PolarHBondContact O-N 3Å; W247-Q249 VanDerWaalsContact C-N 3.27Å; W247-Q249 PolarHBondContact O-N 2.87Å; Q249-H251 PolarHBondContact O-N 3.11Å; Q249-R252 PolarHBondContact O-N 3.45Å; Q249-Y253 WeakPolarHBondContact O-CB 3.49Å; Q249-Y253 PolarHBondContact O-N 3.23Å |
| 250 | N | 98 | Very high | 96.4 | Very high | 97 Ų | 97 | 79.5 Ų | 79.5 | 52% | 0.519 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64.1 | -40.3 | 179.4 | -70.2 | -13.2 | 0 | 0 | 0 | 112 | I246 W247 Y253 K254 | I246-N250 WeakPolarHBondContact O-CB 3.39Å; I246-N250 VanDerWaalsContact O-CG 3.25Å; I246-N250 PolarHBondContact O-N 3.32Å; W247-N250 PolarHBondContact O-N 3.36Å; N250-Y253 WeakPolarHBondContact O-CB 3.34Å; N250-Y253 PolarHBondContact O-N 2.78Å; N250-K254 PolarHBondContact O-N 2.89Å |
| 251 | H | 97.6 | Very high | 96 | Very high | 33 Ų | 33 | 80.9 Ų | 80.9 | 15% | 0.153 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -68.3 | -43.4 | 179.6 | -163.6 | 107.8 | 0 | 0 | 0 | 111.3 | E216 F219 W247 Q249 Y253 K254 C255 | E216-H251 IonicContact OE1-CE1 3.93Å; F219-H251 AromaticContact CD1-CD2 3.32Å; F219-H251 WeakPolarHBondContact CD1-CD2 3.29Å; F219-H251 AromaticContact CD1-NE2 3.34Å; F219-H251 VanDerWaalsContact CD1-NE2 3.34Å; F219-H251 WeakPolarHBondContact CD1-NE2 3.48Å; F219-H251 AromaticContact CE1-CD2 3.2Å; F219-H251 WeakPolarHBondContact CE1-CD2 3.41Å; F219-H251 AromaticContact CE1-NE2 3.51Å; F219-H251 AromaticContact CG-CD2 3.89Å; F219-H251 AromaticContact CZ-CD2 3.68Å; W247-H251 HydrophobicContact CD2-CB 4.38Å; W247-H251 HydrophobicContact CE3-CB 4.05Å; W247-H251 HydrophobicContact CH2-CB 4.04Å; W247-H251 AromaticContact CH2-CE1 3.65Å; W247-H251 AromaticContact CH2-CG 3.6Å; W247-H251 AromaticContact CH2-ND1 3.15Å; W247-H251 WeakPolarHBondContact CH2-ND1 3.5Å; W247-H251 HydrophobicContact CZ2-CB 4.39Å; W247-H251 AromaticContact CZ2-CE1 3.93Å; W247-H251 AromaticContact CZ2-ND1 3.26Å; W247-H251 VanDerWaalsContact CZ2-ND1 3.26Å; W247-H251 WeakPolarHBondContact CZ2-ND1 3.49Å; W247-H251 HydrophobicContact CZ3-CB 3.86Å; W247-H251 AromaticContact CZ3-CG 3.86Å; W247-H251 AromaticContact CZ3-ND1 3.89Å; W247-H251 VanDerWaalsContact O-CB 3.27Å; W247-H251 WeakPolarHBondContact O-CB 3.47Å; W247-H251 PolarHBondContact O-N 2.89Å; Q249-H251 PolarHBondContact O-N 3.11Å; H251-Y253 VanDerWaalsContact C-N 3.3Å; H251-Y253 PolarHBondContact O-N 3.38Å; H251-K254 WeakPolarHBondContact O-CB 3.36Å; H251-K254 PolarHBondContact O-N 3Å; H251-C255 PolarHBondContact O-N 3.26Å; H251-C255 PolarHBondContact O-SG 2.86Å; H251-C255 VanDerWaalsContact O-SG 3.32Å |
| 252 | R | 97.9 | Very high | 95.5 | Very high | 78 Ų | 78 | 83.5 Ų | 83.5 | 29% | 0.294 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.7 | -40.1 | 169.5 | -77.6 | 177.6 | -70.7 | 168.3 | 2.6 | 112.6 | F219 K223 F248 Q249 K256 | F219-R252 HydrophobicContact CE2-CG 3.66Å; F219-R252 HydrophobicContact CZ-CG 3.91Å; K223-R252 WeakPolarHBondContact O-CD 3.26Å; F248-R252 WeakPolarHBondContact O-CB 3.42Å; F248-R252 WeakPolarHBondContact O-CG 3.4Å; F248-R252 PolarHBondContact O-N 3.48Å; F248-R252 PolarHBondContact O-NE 2.86Å; Q249-R252 PolarHBondContact O-N 3.45Å; R252-K256 WeakPolarHBondContact O-CB 3.32Å; R252-K256 PolarHBondContact O-N 2.97Å |
| 253 | Y | 97.8 | Very high | 94.9 | Very high | 129 Ų | 129 | 82.7 Ų | 82.7 | 51% | 0.506 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -65.2 | -40.4 | 176 | -179.3 | -90.6 | 0 | 0 | 0 | 112 | Q249 N250 H251 K256 R257 | Q249-Y253 WeakPolarHBondContact O-CB 3.49Å; Q249-Y253 PolarHBondContact O-N 3.23Å; N250-Y253 WeakPolarHBondContact O-CB 3.34Å; N250-Y253 PolarHBondContact O-N 2.78Å; H251-Y253 VanDerWaalsContact C-N 3.3Å; H251-Y253 PolarHBondContact O-N 3.38Å; Y253-K256 PolarHBondContact O-N 3.18Å; Y253-R257 WeakPolarHBondContact O-CB 3.36Å; Y253-R257 PolarHBondContact O-N 3.19Å; Y253-R257 PolarHBondContact OH-NH1 3.13Å |
| 254 | K | 96.1 | Very high | 94.3 | Very high | 115 Ų | 115 | 86 Ų | 86 | 50% | 0.5 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -57.3 | -53.5 | 173.6 | -170.1 | -169.7 | 173.1 | -173.8 | 0 | 110.8 | N250 H251 K256 R257 Q258 | N250-K254 PolarHBondContact O-N 2.89Å; H251-K254 WeakPolarHBondContact O-CB 3.36Å; H251-K254 PolarHBondContact O-N 3Å; K254-K256 PolarHBondContact O-N 3.24Å; K254-R257 PolarHBondContact O-N 3.4Å; K254-R257 VanDerWaalsContact O-N 3.13Å; K254-Q258 WeakPolarHBondContact O-CG 3.38Å; K254-Q258 PolarHBondContact O-N 2.95Å; K254-Q258 PolarHBondContact O-OE1 3.24Å |
| 255 | C | 94.5 | Very high | 93.5 | Very high | 49 Ų | 49 | 91.4 Ų | 91.4 | 33% | 0.331 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -58 | -46.4 | 178.7 | -58.8 | 0 | 0 | 0 | 0 | 112.2 | H251 R257 Q258 A259 | H251-C255 PolarHBondContact O-N 3.26Å; H251-C255 PolarHBondContact O-SG 2.86Å; H251-C255 VanDerWaalsContact O-SG 3.32Å; C255-R257 VanDerWaalsContact C-N 3.29Å; C255-R257 PolarHBondContact O-N 3Å; C255-Q258 PolarHBondContact O-N 3.48Å; C255-A259 PolarHBondContact O-N 3Å |
| 256 | K | 95.6 | Very high | 92.3 | Very high | 150 Ų | 150 | 92.2 Ų | 92.2 | 65% | 0.652 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -62.1 | -36 | 177.8 | -172.6 | 172.3 | 69.9 | 171 | 0 | 112.5 | R252 Y253 K254 K260 | R252-K256 WeakPolarHBondContact O-CB 3.32Å; R252-K256 PolarHBondContact O-N 2.97Å; Y253-K256 PolarHBondContact O-N 3.18Å; K254-K256 PolarHBondContact O-N 3.24Å; K256-K260 PolarHBondContact O-N 3.48Å |
| 257 | R | 94.4 | Very high | 90.6 | Very high | 151 Ų | 151 | 91 Ų | 91 | 57% | 0.57 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -69.6 | -45.6 | 177.1 | -172.8 | 168.5 | 177.4 | 146.5 | -4.8 | 111.4 | Y253 K254 C255 A259 K260 E261 | Y253-R257 WeakPolarHBondContact O-CB 3.36Å; Y253-R257 PolarHBondContact O-N 3.19Å; Y253-R257 PolarHBondContact OH-NH1 3.13Å; K254-R257 PolarHBondContact O-N 3.4Å; K254-R257 VanDerWaalsContact O-N 3.13Å; C255-R257 VanDerWaalsContact C-N 3.29Å; C255-R257 PolarHBondContact O-N 3Å; R257-A259 VanDerWaalsContact C-N 3.34Å; R257-A259 PolarHBondContact O-N 3.5Å; R257-K260 PolarHBondContact O-N 2.86Å; R257-E261 WeakPolarHBondContact O-CB 3.47Å; R257-E261 PolarHBondContact O-N 2.72Å |
| 258 | Q | 92.3 | Very high | 88.5 | Confident | 57 Ų | 57 | 99.5 Ų | 99.5 | 27% | 0.266 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -61 | -39.4 | 176.9 | -69.7 | 171.3 | -66.3 | 0 | 0 | 112.5 | K254 C255 E261 K262 C327 | K254-Q258 WeakPolarHBondContact O-CG 3.38Å; K254-Q258 PolarHBondContact O-N 2.95Å; K254-Q258 PolarHBondContact O-OE1 3.24Å; C255-Q258 PolarHBondContact O-N 3.48Å; Q258-E261 PolarHBondContact O-N 3.3Å; Q258-K262 PolarHBondContact O-N 2.94Å; Q258-C327 PolarHBondContact NE2-SG 2.92Å; Q258-C327 VanDerWaalsContact NE2-SG 3.41Å |
| 259 | A | 90.3 | Very high | 86.1 | Confident | 63 Ų | 63 | 105.1 Ų | 105.1 | 52% | 0.521 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | C255 R257 E261 A263 | C255-A259 PolarHBondContact O-N 3Å; R257-A259 VanDerWaalsContact C-N 3.34Å; R257-A259 PolarHBondContact O-N 3.5Å; A259-E261 VanDerWaalsContact C-N 3.32Å; A259-E261 PolarHBondContact O-N 2.89Å; A259-A263 PolarHBondContact O-N 3.35Å |
| 260 | K | 90 | Very high | 83.8 | Confident | 138 Ų | 138 | 106 Ų | 106 | 60% | 0.6 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -66 | -34.6 | 175.4 | -177.2 | 171.4 | 179.8 | 174.7 | 0 | 112.4 | K256 R257 M264 | K256-K260 PolarHBondContact O-N 3.48Å; R257-K260 PolarHBondContact O-N 2.86Å; K260-M264 VanDerWaalsContact CE-CE 3.48Å; K260-M264 HydrophobicContact CG-CE 4.43Å; K260-M264 HydrophobicContact CG-SD 4.39Å; K260-M264 WeakPolarHBondContact O-CG 3.11Å; K260-M264 PolarHBondContact O-N 3.28Å |
| 261 | E | 89.8 | Confident | 81.5 | Confident | 95 Ų | 95 | 109.4 Ų | 109.4 | 44% | 0.444 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -70.3 | -43.5 | 179.7 | -172.4 | 163.5 | -169.3 | 0 | 0 | 112 | R257 Q258 A259 M264 Q265 | R257-E261 WeakPolarHBondContact O-CB 3.47Å; R257-E261 PolarHBondContact O-N 2.72Å; Q258-E261 PolarHBondContact O-N 3.3Å; A259-E261 VanDerWaalsContact C-N 3.32Å; A259-E261 PolarHBondContact O-N 2.89Å; E261-M264 PolarHBondContact O-N 3.44Å; E261-M264 VanDerWaalsContact O-N 3.13Å; E261-Q265 WeakPolarHBondContact O-CG 3.13Å; E261-Q265 PolarHBondContact O-N 3.21Å |
| 262 | K | 87.5 | Confident | 79.3 | Confident | 105 Ų | 105 | 116.3 Ų | 116.3 | 46% | 0.457 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -57.6 | -50.7 | 170.9 | -76.1 | -179 | 170.1 | -72.8 | 0 | 111.9 | Q258 M264 Q265 D266 | Q258-K262 PolarHBondContact O-N 2.94Å; K262-M264 PolarHBondContact O-N 3.36Å; K262-Q265 PolarHBondContact O-N 2.87Å; K262-D266 PolarHBondContact O-N 3.24Å |
| 263 | A | 85.6 | Confident | 77 | Confident | 71 Ų | 71 | 117.6 Ų | 117.6 | 59% | 0.587 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -59.7 | -17.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | A259 | A259-A263 PolarHBondContact O-N 3.35Å |
| 264 | M | 84.4 | Confident | 74.5 | Confident | 135 Ų | 135 | 118.4 Ų | 118.4 | 67% | 0.665 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -90.3 | -21.1 | 172.3 | -74.5 | 177.1 | 160.2 | 0 | 0 | 113.7 | K260 E261 K262 | K260-M264 VanDerWaalsContact CE-CE 3.48Å; K260-M264 HydrophobicContact CG-CE 4.43Å; K260-M264 HydrophobicContact CG-SD 4.39Å; K260-M264 WeakPolarHBondContact O-CG 3.11Å; K260-M264 PolarHBondContact O-N 3.28Å; E261-M264 PolarHBondContact O-N 3.44Å; E261-M264 VanDerWaalsContact O-N 3.13Å; K262-M264 PolarHBondContact O-N 3.36Å |
| 265 | Q | 80.5 | Confident | 72.1 | Confident | 115 Ų | 115 | 122.6 Ų | 122.6 | 54% | 0.537 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -85.8 | -42.7 | 176.3 | -67.8 | 174.7 | 10.1 | 0 | 0 | 111.3 | E261 K262 G267 | E261-Q265 WeakPolarHBondContact O-CG 3.13Å; E261-Q265 PolarHBondContact O-N 3.21Å; K262-Q265 PolarHBondContact O-N 2.87Å; Q265-G267 PolarHBondContact O-N 3.11Å |
| 266 | D | 73.8 | Confident | 69.6 | Low | 132 Ų | 132 | 123.8 Ų | 123.8 | 71% | 0.706 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -69.5 | -14.6 | 177.4 | -60.3 | -46.1 | 0 | 0 | 0 | 112.7 | K262 R268 | K262-D266 PolarHBondContact O-N 3.24Å; D266-R268 PolarHBondContact O-N 3Å |
| 267 | G | 61.8 | Low | 67.2 | Low | 57 Ų | 57 | 122.2 Ų | 122.2 | 59% | 0.588 | 66% | 0.664 | S | S | * | * | trans | -70 | 30.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 116 | Q265 | Q265-G267 PolarHBondContact O-N 3.11Š| ||
| 268 | R | 53.3 | Low | 65 | Low | 207 Ų | 207 | 120.3 Ų | 120.3 | 78% | 0.781 | 67% | 0.673 | S | S | * | * | trans | -68.6 | 125.1 | 167.4 | -170.1 | -176.8 | -168 | -147.4 | 3.8 | 107.8 | D266 T270 | D266-R268 PolarHBondContact O-N 3Å; R268-T270 PolarHBondContact O-N 2.87Å | ||
| 269 | P | 48.8 | Very low | 62.7 | Low | 123 Ų | 123 | 122.8 Ų | 122.8 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | trans | -71.2 | 92.8 | -175 | 28.1 | -34.8 | 0 | 0 | 0 | 111.3 | H271 | P269-H271 PolarHBondContact O-N 3.11Å; P269-H271 VanDerWaalsContact O-N 3.08Å | ||
| 270 | T | 49.3 | Very low | 60.6 | Low | 126 Ų | 126 | 126.7 Ų | 126.7 | 77% | 0.773 | 71% | 0.709 | S | S | * | * | trans | -70.7 | 97.5 | 165.3 | 28.8 | 0 | 0 | 0 | 0 | 109 | R268 Q272 | R268-T270 PolarHBondContact O-N 2.87Å; T270-Q272 PolarHBondContact O-N 2.91Å | ||
| 271 | H | 50.6 | Low | 58.8 | Low | 169 Ų | 169 | 129 Ų | 129 | 78% | 0.782 | 72% | 0.722 | S | S | * | * | trans | -46.3 | 101.8 | 171.4 | 175.1 | -71.1 | 0 | 0 | 0 | 111.1 | P269 P273 | P269-H271 PolarHBondContact O-N 3.11Å; P269-H271 VanDerWaalsContact O-N 3.08Å; H271-P273 WeakPolarHBondContact O-CD 3.31Å | ||
| 272 | Q | 50.2 | Low | 56.7 | Low | 178 Ų | 178 | 132.2 Ų | 132.2 | 83% | 0.832 | 74% | 0.737 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 120.5 | 178.5 | -66.3 | -172.7 | 28.4 | 0 | 0 | 109.8 | T270 V274 | T270-Q272 PolarHBondContact O-N 2.91Å; Q272-V274 PolarHBondContact O-N 3.24Å |
| 273 | P | 50.2 | Low | 55.1 | Low | 104 Ų | 104 | 132 Ų | 132 | 68% | 0.675 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -79.4 | 119.5 | 171.4 | 31.6 | -30.2 | 0 | 0 | 0 | 109.3 | H271 K275 | H271-P273 WeakPolarHBondContact O-CD 3.31Å; P273-K275 PolarHBondContact O-N 3.28Å |
| 274 | V | 46.4 | Very low | 53.1 | Low | 147 Ų | 147 | 131.5 Ų | 131.5 | 89% | 0.891 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 125.2 | 168.6 | -72.5 | 0 | 0 | 0 | 0 | 109.9 | Q272 | Q272-V274 PolarHBondContact O-N 3.24Š|
| 275 | K | 45.1 | Very low | 51.2 | Low | 202 Ų | 202 | 131.7 Ų | 131.7 | 88% | 0.878 | 76% | 0.764 | S | S | * | * | trans | -138.3 | 111.8 | 167.8 | -84 | -163.9 | 171 | -170.1 | 0 | 109.6 | P273 | P273-K275 PolarHBondContact O-N 3.28Š| ||
| 276 | G | 41.1 | Very low | 49.5 | Very low | 75 Ų | 75 | 129.9 Ų | 129.9 | 77% | 0.773 | 78% | 0.777 | S | S | * | * | trans | -93.7 | 135.4 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 277 | S | 45.8 | Very low | 48.2 | Very low | 117 Ų | 117 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -164.9 | 119.2 | 157 | -66.6 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 278 | S | 48 | Very low | 47.7 | Very low | 110 Ų | 110 | 133.1 Ų | 133.1 | 77% | 0.769 | 79% | 0.788 | S | S | * | * | 66.9 | 93.5 | 51.2 | -165.2 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 279 | S | 44.7 | Very low | 47.7 | Very low | 110 Ų | 110 | 128.5 Ų | 128.5 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | trans | 175.1 | 107.1 | 136.6 | -91.2 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 280 | D | 46.3 | Very low | 47.8 | Very low | 144 Ų | 144 | 129 Ų | 129 | 77% | 0.77 | 78% | 0.781 | S | S | * | * | trans | 28.3 | 166.3 | 136.5 | -55.1 | -88.5 | 0 | 0 | 0 | 124.8 | ||||
| 281 | Q | 51.2 | Low | 47.7 | Very low | 187 Ų | 187 | 131.8 Ų | 131.8 | 87% | 0.874 | 78% | 0.784 | S | S | * | * | trans | 81.6 | 137.6 | 177.8 | -55.7 | 176 | 3.6 | 0 | 0 | 115 | ||||
| 282 | E | 45.6 | Very low | 47.7 | Very low | 162 Ų | 162 | 128.9 Ų | 128.9 | 76% | 0.757 | 78% | 0.783 | S | S | * | * | cis | -150.7 | 175.6 | -0.4 | -145.9 | -163.1 | 82.4 | 0 | 0 | 111.6 | ||||
| 283 | S | 53.7 | Low | 48.1 | Very low | 100 Ų | 100 | 126.6 Ų | 126.6 | 70% | 0.699 | 78% | 0.783 | S | S | * | * | trans | 16.7 | 143.5 | 155 | 55.2 | 0 | 0 | 0 | 0 | 122 | ||||
| 284 | G | 44 | Very low | 47.8 | Very low | 62 Ų | 62 | 127.3 Ų | 127.3 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | cis | 162.3 | 152.7 | -0.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 285 | C | 44.1 | Very low | 47.8 | Very low | 139 Ų | 139 | 124.7 Ų | 124.7 | 94% | 0.939 | 79% | 0.785 | S | S | * | * | trans | 39.8 | 136.3 | 173.1 | 63.1 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 286 | G | 46.2 | Very low | 48.2 | Very low | 77 Ų | 77 | 120.6 Ų | 120.6 | 79% | 0.794 | 78% | 0.781 | S | S | * | * | cis | 128.6 | 87.3 | -0.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 287 | D | 46.6 | Very low | 48.6 | Very low | 154 Ų | 154 | 123.2 Ų | 123.2 | 82% | 0.824 | 79% | 0.785 | S | S | * | * | trans | -155 | 159 | 152 | -165.3 | -117.4 | 0 | 0 | 0 | 111.1 | ||||
| 288 | S | 50.6 | Low | 48.5 | Very low | 103 Ų | 103 | 121.9 Ų | 121.9 | 72% | 0.72 | 78% | 0.781 | S | S | * | * | trans | -170.1 | 149.3 | -178.7 | -72.3 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 289 | P | 53.4 | Low | 48.7 | Very low | 109 Ų | 109 | 122.2 Ų | 122.2 | 71% | 0.708 | 78% | 0.781 | S | S | * | * | -163.8 | -172.5 | 87.6 | 43.5 | -21.9 | 0 | 0 | 0 | 118 | |||||
| 290 | L | 49.9 | Very low | 48.5 | Very low | 135 Ų | 135 | 122 Ų | 122 | 71% | 0.707 | 78% | 0.779 | S | S | * | * | trans | 66.1 | 113.2 | 161.1 | -54.9 | 174.1 | 0 | 0 | 0 | 117.7 | ||||
| 291 | H | 47.7 | Very low | 48.5 | Very low | 183 Ų | 183 | 126.3 Ų | 126.3 | 85% | 0.847 | 79% | 0.785 | S | S | * | * | -155.1 | 171.5 | 65.6 | -87.7 | 92.6 | 0 | 0 | 0 | 114.8 | |||||
| 292 | S | 50.4 | Low | 48.2 | Very low | 109 Ų | 109 | 123 Ų | 123 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | trans | -98 | 160.6 | -159.6 | -58.4 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 293 | P | 59.1 | Low | 48.3 | Very low | 129 Ų | 129 | 121.1 Ų | 121.1 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | trans | -98.5 | 176.1 | -172.9 | 39.8 | -37.7 | 0 | 0 | 0 | 115 | ||||
| 294 | S | 44.2 | Very low | 47.7 | Very low | 120 Ų | 120 | 123 Ų | 123 | 84% | 0.839 | 78% | 0.78 | S | S | * | * | trans | -157 | 154.1 | 167.3 | -165.5 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 295 | A | 46.5 | Very low | 48.1 | Very low | 92 Ų | 92 | 125 Ų | 125 | 76% | 0.76 | 78% | 0.784 | S | S | * | * | trans | 68.4 | 73.4 | 159.1 | 0 | 0 | 0 | 0 | 0 | 122 | ||||
| 296 | S | 52.9 | Low | 47.9 | Very low | 115 Ų | 115 | 123.9 Ų | 123.9 | 80% | 0.804 | 78% | 0.777 | S | S | * | * | -22.5 | 177.2 | 129.7 | -49.4 | 0 | 0 | 0 | 0 | 119.1 | |||||
| 297 | P | 50.8 | Low | 48.3 | Very low | 130 Ų | 130 | 125 Ų | 125 | 84% | 0.844 | 77% | 0.771 | S | S | * | * | cis | -137.2 | -173.3 | -34.6 | 35.1 | -15 | 0 | 0 | 0 | 114.3 | ||||
| 298 | A | 43.6 | Very low | 48.2 | Very low | 89 Ų | 89 | 124.7 Ų | 124.7 | 74% | 0.736 | 77% | 0.769 | S | S | * | * | trans | -104.2 | 166.5 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 299 | P | 50.4 | Low | 48.3 | Very low | 118 Ų | 118 | 126.9 Ų | 126.9 | 77% | 0.766 | 77% | 0.771 | S | S | * | * | -152.3 | 131.5 | 129.2 | 35.4 | -16.6 | 0 | 0 | 0 | 118.5 | |||||
| 300 | S | 42.3 | Very low | 48.2 | Very low | 106 Ų | 106 | 127.6 Ų | 127.6 | 74% | 0.741 | 77% | 0.773 | S | S | * | * | 48.4 | 151.4 | 123 | -49.3 | 0 | 0 | 0 | 0 | 125.7 | |||||
| 301 | R | 44.7 | Very low | 48 | Very low | 233 Ų | 233 | 130.9 Ų | 130.9 | 88% | 0.879 | 78% | 0.782 | S | S | * | * | trans | 88.8 | 144.1 | 163.5 | -52.7 | 177.4 | -161.3 | -98.7 | -0.4 | 115.1 | ||||
| 302 | T | 45.8 | Very low | 47.5 | Very low | 118 Ų | 118 | 127.3 Ų | 127.3 | 72% | 0.724 | 78% | 0.777 | S | S | * | * | cis | -155.7 | 162.3 | 4.3 | -3.9 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 303 | T | 48 | Very low | 47.6 | Very low | 123 Ų | 123 | 127.4 Ų | 127.4 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | trans | 8.9 | 149.8 | 151 | 55.4 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 304 | D | 40.9 | Very low | 47.4 | Very low | 140 Ų | 140 | 132.9 Ų | 132.9 | 75% | 0.749 | 78% | 0.78 | S | S | * | * | cis | -168.8 | 175.6 | 46.9 | -171.6 | 42.4 | 0 | 0 | 0 | 115.2 | ||||
| 305 | S | 51.9 | Low | 47.8 | Very low | 104 Ų | 104 | 136.5 Ų | 136.5 | 73% | 0.727 | 78% | 0.78 | S | S | * | * | trans | 84.9 | 135 | 153.4 | -85.1 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 306 | S | 40.6 | Very low | 48.3 | Very low | 114 Ų | 114 | 139.4 Ų | 139.4 | 80% | 0.797 | 78% | 0.781 | S | S | * | * | trans | -152 | -171.7 | -173.6 | -144.8 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 307 | P | 54.3 | Low | 48.3 | Very low | 101 Ų | 101 | 138.1 Ų | 138.1 | 66% | 0.656 | 78% | 0.778 | S | S | * | * | cis | -136.2 | -180 | -14.2 | 39 | -19.8 | 0 | 0 | 0 | 115.4 | ||||
| 308 | D | 43.8 | Very low | 48.4 | Very low | 148 Ų | 148 | 137.4 Ų | 137.4 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | trans | 80.6 | 158.8 | 135.4 | -106.5 | -52.3 | 0 | 0 | 0 | 127.2 | ||||
| 309 | I | 53.2 | Low | 48.6 | Very low | 148 Ų | 148 | 140.8 Ų | 140.8 | 76% | 0.759 | 78% | 0.776 | S | S | * | * | trans | 99.2 | 114.6 | 146.3 | -92.8 | 167.8 | 0 | 0 | 0 | 123.4 | ||||
| 310 | V | 50.6 | Low | 48.6 | Very low | 124 Ų | 124 | 140.5 Ų | 140.5 | 75% | 0.752 | 77% | 0.772 | S | S | * | * | trans | 78.6 | 82.6 | 151.7 | -179.4 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 311 | K | 46.5 | Very low | 49.3 | Very low | 204 Ų | 204 | 143.4 Ų | 143.4 | 89% | 0.887 | 78% | 0.779 | S | S | * | * | 12.8 | 120.1 | 122.3 | -62.4 | 167.2 | -179.9 | 167.6 | 0 | 119.4 | |||||
| 312 | S | 38 | Very low | 49.7 | Very low | 108 Ų | 108 | 136.3 Ų | 136.3 | 76% | 0.755 | 76% | 0.761 | S | S | * | * | trans | -162.2 | 122.5 | 135.7 | -173.6 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 313 | P | 51.4 | Low | 50.4 | Low | 112 Ų | 112 | 139.6 Ų | 139.6 | 73% | 0.727 | 77% | 0.765 | S | S | * | * | trans | -144.7 | 107.1 | 135.9 | 32.7 | -15.2 | 0 | 0 | 0 | 112.8 | K315 | P313-K315 PolarHBondContact O-N 2.7Š| ||
| 314 | R | 54.7 | Low | 50.3 | Low | 244 Ų | 244 | 139.6 Ų | 139.6 | 92% | 0.921 | 76% | 0.761 | S | S | * | * | trans | -72.7 | 109 | 165 | -73.4 | -171.8 | 178.1 | -168.6 | -0.1 | 109.3 | ||||
| 315 | K | 52.4 | Low | 50.7 | Low | 195 Ų | 195 | 140.7 Ų | 140.7 | 85% | 0.848 | 76% | 0.761 | S | S | * | * | trans | -75.4 | 121.4 | 173.9 | -63.5 | -178.5 | -179.1 | -179.1 | 0 | 109.8 | P313 | P313-K315 PolarHBondContact O-N 2.7Š| ||
| 316 | I | 57.6 | Low | 50.5 | Low | 153 Ų | 153 | 145 Ų | 145 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | -90.1 | 113.1 | 160.3 | -63.5 | 175.1 | 0 | 0 | 0 | 106.5 | V318 | I316-V318 HydrophobicContact CG2-CG2 4.17Š| ||
| 317 | A | 53.5 | Low | 50.5 | Low | 89 Ų | 89 | 142.8 Ų | 142.8 | 74% | 0.736 | 75% | 0.751 | S | S | * | * | trans | -82.1 | 131.8 | 170.8 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 318 | V | 51.4 | Low | 50.3 | Low | 114 Ų | 114 | 142.5 Ų | 142.5 | 69% | 0.691 | 75% | 0.75 | S | S | * | * | trans | -121 | 122.5 | 173.2 | -173.1 | 0 | 0 | 0 | 0 | 107.2 | I316 V320 | I316-V318 HydrophobicContact CG2-CG2 4.17Å; V318-V320 PolarHBondContact O-N 3.35Å | ||
| 319 | N | 48.5 | Very low | 50.2 | Low | 160 Ų | 160 | 143.2 Ų | 143.2 | 86% | 0.856 | 75% | 0.754 | S | S | * | * | trans | -74.3 | 88.1 | -175 | -67.9 | 9.9 | 0 | 0 | 0 | 110.4 | L321 | N319-L321 PolarHBondContact O-N 2.85Š| ||
| 320 | V | 51.2 | Low | 49.6 | Very low | 113 Ų | 113 | 139 Ų | 139 | 69% | 0.685 | 75% | 0.746 | S | S | * | * | trans | -83.2 | 109 | 172.8 | 178.8 | 0 | 0 | 0 | 0 | 109.1 | V318 V322 | V318-V320 PolarHBondContact O-N 3.35Å; V320-V322 PolarHBondContact O-N 2.96Å | ||
| 321 | L | 55.5 | Low | 49.1 | Very low | 167 Ų | 167 | 141.7 Ų | 141.7 | 87% | 0.874 | 75% | 0.751 | S | S | * | * | trans | -66.5 | 97.6 | 171.5 | -179.7 | 65.7 | 0 | 0 | 0 | 109.6 | N319 K323 | N319-L321 PolarHBondContact O-N 2.85Å; L321-K323 PolarHBondContact O-N 3.08Å | ||
| 322 | V | 53.9 | Low | 48.7 | Very low | 84 Ų | 84 | 139.7 Ų | 139.7 | 51% | 0.509 | 75% | 0.745 | S | S | . | * | trans | -71.7 | 113.9 | 175.2 | 177.9 | 0 | 0 | 0 | 0 | 109 | V320 | V320-V322 PolarHBondContact O-N 2.96Š| ||
| 323 | K | 61.1 | Low | 49.1 | Very low | 186 Ų | 186 | 139.6 Ų | 139.6 | 81% | 0.809 | 74% | 0.741 | S | S | * | * | trans | -83.8 | 113.9 | 163.2 | -175.2 | 164.8 | -178.9 | 171.5 | 0 | 108 | L321 E325 | L321-K323 PolarHBondContact O-N 3.08Å; K323-E325 PolarHBondContact O-N 2.84Å | ||
| 324 | D | 44.8 | Very low | 48.5 | Very low | 124 Ų | 124 | 139.3 Ų | 139.3 | 66% | 0.663 | 74% | 0.742 | S | S | * | * | trans | -70 | 113 | -172.9 | -118.9 | -63.2 | 0 | 0 | 0 | 112 | ||||
| 325 | E | 50.1 | Low | 48 | Very low | 162 Ų | 162 | 133.2 Ų | 133.2 | 76% | 0.757 | 73% | 0.732 | S | S | * | * | trans | -117.6 | 110 | 163.6 | -68 | -158.7 | 135.9 | 0 | 0 | 109.2 | K323 C327 | K323-E325 PolarHBondContact O-N 2.84Å; E325-C327 PolarHBondContact O-N 3.48Å | ||
| 326 | K | 46.6 | Very low | 47.5 | Very low | 194 Ų | 194 | 131.6 Ų | 131.6 | 84% | 0.843 | 73% | 0.731 | S | S | * | * | trans | -57.9 | 95.9 | -169.4 | -175 | 175 | -180 | 174.5 | 0 | 112.3 | C328 | K326-C328 PolarHBondContact O-N 3.23Š| ||
| 327 | C | 40.7 | Very low | 47.2 | Very low | 68 Ų | 68 | 131.4 Ų | 131.4 | 46% | 0.459 | 73% | 0.73 | S | S | . | * | P | Polyproline II helix | trans | -64 | 132.6 | 170.6 | -68.4 | 0 | 0 | 0 | 0 | 109.7 | Q258 E325 D329 | Q258-C327 PolarHBondContact NE2-SG 2.92Å; Q258-C327 VanDerWaalsContact NE2-SG 3.41Å; E325-C327 PolarHBondContact O-N 3.48Å; C327-D329 PolarHBondContact O-N 3.33Å |
| 328 | C | 49.8 | Very low | 46.6 | Very low | 96 Ų | 96 | 130.4 Ų | 130.4 | 65% | 0.649 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -70 | 120 | -166.1 | -46.1 | 0 | 0 | 0 | 0 | 112.1 | K326 | K326-C328 PolarHBondContact O-N 3.23Š|
| 329 | D | 43.6 | Very low | 46.5 | Very low | 163 Ų | 163 | 134.4 Ų | 134.4 | 87% | 0.872 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -88.6 | 158.9 | 165.7 | -144.7 | -46.5 | 0 | 0 | 0 | 110.6 | C327 | C327-D329 PolarHBondContact O-N 3.33Š|
| 330 | G | 39.5 | Very low | 46.4 | Very low | 58 Ų | 58 | 130.9 Ų | 130.9 | 60% | 0.598 | 74% | 0.736 | S | S | * | * | trans | 60.6 | 96.7 | 168.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 331 | Q | 41 | Very low | 46.1 | Very low | 182 Ų | 182 | 133.5 Ų | 133.5 | 85% | 0.85 | 74% | 0.74 | S | S | * | * | -165.8 | 124.5 | 128.3 | -158.3 | 69.8 | -12 | 0 | 0 | 110 | |||||
| 332 | Q | 37.5 | Very low | 45.5 | Very low | 162 Ų | 162 | 134.1 Ų | 134.1 | 76% | 0.757 | 74% | 0.739 | S | S | * | * | trans | -73.8 | 147.6 | 169.1 | -72.4 | -77.7 | 20.3 | 0 | 0 | 110.3 | S334 | Q332-S334 PolarHBondContact O-N 3.48Š| ||
| 333 | P | 45.5 | Very low | 44.6 | Very low | 105 Ų | 105 | 138.8 Ų | 138.8 | 68% | 0.682 | 76% | 0.755 | S | S | * | * | trans | -70.8 | 116.1 | 166.3 | 30 | -31.2 | 0 | 0 | 0 | 109.4 | T335 | P333-T335 PolarHBondContact O-N 3.37Š| ||
| 334 | S | 40.4 | Very low | 44 | Very low | 106 Ų | 106 | 135.6 Ų | 135.6 | 74% | 0.741 | 75% | 0.753 | S | S | * | * | trans | -70.7 | 92.9 | 177.6 | -59.1 | 0 | 0 | 0 | 0 | 111.3 | Q332 I336 | Q332-S334 PolarHBondContact O-N 3.48Å; S334-I336 PolarHBondContact O-N 3.47Å; S334-I336 VanDerWaalsContact O-N 3.11Å | ||
| 335 | T | 43.3 | Very low | 43.8 | Very low | 117 Ų | 117 | 137.4 Ų | 137.4 | 72% | 0.718 | 76% | 0.758 | S | S | * | * | trans | -64.3 | 106.5 | 166.4 | -62 | 0 | 0 | 0 | 0 | 109.3 | P333 I337 | P333-T335 PolarHBondContact O-N 3.37Å; T335-I337 HydrophobicContact CG2-CD1 4.13Å; T335-I337 HydrophobicContact CG2-CG1 4.1Å; T335-I337 PolarHBondContact O-N 2.95Å | ||
| 336 | I | 42.8 | Very low | 44.1 | Very low | 161 Ų | 161 | 137.6 Ų | 137.6 | 83% | 0.826 | 76% | 0.762 | S | S | * | * | trans | -76.7 | 108.7 | 171.5 | -62.7 | 178.6 | 0 | 0 | 0 | 108.5 | S334 | S334-I336 PolarHBondContact O-N 3.47Å; S334-I336 VanDerWaalsContact O-N 3.11Å | ||
| 337 | I | 50.7 | Low | 44.4 | Very low | 149 Ų | 149 | 135.9 Ų | 135.9 | 76% | 0.764 | 76% | 0.762 | S | S | * | * | trans | -125.8 | 136.7 | 158.6 | -68.6 | 175.7 | 0 | 0 | 0 | 106.1 | T335 | T335-I337 HydrophobicContact CG2-CD1 4.13Å; T335-I337 HydrophobicContact CG2-CG1 4.1Å; T335-I337 PolarHBondContact O-N 2.95Å | ||
| 338 | G | 40.9 | Very low | 44.3 | Very low | 68 Ų | 68 | 138.7 Ų | 138.7 | 70% | 0.701 | 78% | 0.783 | S | S | * | * | trans | -72.9 | 148.2 | -159.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 339 | M | 50.1 | Low | 44.4 | Very low | 197 Ų | 197 | 138.8 Ų | 138.8 | 97% | 0.97 | 79% | 0.79 | S | S | * | * | trans | -121.7 | 144.4 | 151.8 | -72.2 | -172.3 | 167 | 0 | 0 | 107.9 | ||||
| 340 | A | 46 | Very low | 44.6 | Very low | 87 Ų | 87 | 136.1 Ų | 136.1 | 72% | 0.719 | 78% | 0.776 | S | S | * | * | trans | -107.9 | 170.2 | -168.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 341 | Q | 43.6 | Very low | 44.9 | Very low | 168 Ų | 168 | 142.5 Ų | 142.5 | 79% | 0.785 | 79% | 0.788 | S | S | * | * | trans | 75.2 | 150.3 | 160.2 | -124.5 | 68.8 | 13 | 0 | 0 | 119.4 | ||||
| 342 | Q | 43.2 | Very low | 45.3 | Very low | 180 Ų | 180 | 141.1 Ų | 141.1 | 84% | 0.841 | 78% | 0.779 | S | S | * | * | trans | 77.8 | 91.5 | 154.3 | -134.1 | 112.2 | 24.8 | 0 | 0 | 118.9 | ||||
| 343 | Q | 35.2 | Very low | 45.6 | Very low | 182 Ų | 182 | 138.5 Ų | 138.5 | 85% | 0.85 | 78% | 0.778 | S | S | * | * | trans | -74.1 | 162.5 | 150.3 | -65.6 | 175.7 | -76.3 | 0 | 0 | 110.5 | ||||
| 344 | P | 48.1 | Very low | 45.5 | Very low | 119 Ų | 119 | 139.6 Ų | 139.6 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | -132.9 | 144.4 | 129 | 36.6 | -27.9 | 0 | 0 | 0 | 114.4 | |||||
| 345 | E | 40.4 | Very low | 45.6 | Very low | 161 Ų | 161 | 139.8 Ų | 139.8 | 75% | 0.752 | 78% | 0.78 | S | S | * | * | trans | -19.2 | 134.6 | 159.4 | -58.3 | -66.6 | 91.6 | 0 | 0 | 117.6 | ||||
| 346 | I | 57.4 | Low | 45.8 | Very low | 166 Ų | 166 | 141.8 Ų | 141.8 | 85% | 0.851 | 79% | 0.785 | S | S | * | * | trans | -129.7 | 134.5 | 148.5 | 54 | 172.4 | 0 | 0 | 0 | 109.6 | ||||
| 347 | N | 52.4 | Low | 46.1 | Very low | 158 Ų | 158 | 139.7 Ų | 139.7 | 85% | 0.845 | 78% | 0.782 | S | S | * | * | trans | -74.4 | 144.2 | -163.9 | -72.1 | -79.4 | 0 | 0 | 0 | 114.3 | ||||
| 348 | S | 38.1 | Very low | 45.4 | Very low | 127 Ų | 127 | 139 Ų | 139 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | -74.5 | 139.1 | 169.5 | -63.7 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 349 | A | 53.9 | Low | 45.9 | Very low | 98 Ų | 98 | 143.8 Ų | 143.8 | 81% | 0.81 | 80% | 0.798 | S | S | * | * | trans | -147.1 | 144.3 | 157.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 350 | D | 47 | Very low | 45.6 | Very low | 107 Ų | 107 | 137 Ų | 137 | 57% | 0.572 | 78% | 0.779 | S | S | * | * | trans | -29.4 | 136.9 | 179 | -87.2 | -114 | 0 | 0 | 0 | 117.8 | K352 | D350-K352 WeakPolarHBondContact OD1-CE 3.18Å; D350-K352 IonicContact OD1-NZ 2.7Å; D350-K352 PolarHBondContact OD1-NZ 2.86Å | ||
| 351 | F | 45.1 | Very low | 45.4 | Very low | 193 Ų | 193 | 140.1 Ų | 140.1 | 85% | 0.846 | 78% | 0.778 | S | S | * | * | -154.2 | 120.7 | 96 | -122.2 | -87.3 | 0 | 0 | 0 | 114.8 | |||||
| 352 | K | 49.6 | Very low | 45.5 | Very low | 153 Ų | 153 | 137.9 Ų | 137.9 | 67% | 0.665 | 78% | 0.779 | S | S | * | * | trans | -37.9 | 141.9 | 174.5 | -58.7 | 119 | 170.8 | 137.1 | 0 | 116.4 | D350 | D350-K352 WeakPolarHBondContact OD1-CE 3.18Å; D350-K352 IonicContact OD1-NZ 2.7Å; D350-K352 PolarHBondContact OD1-NZ 2.86Å | ||
| 353 | S | 44 | Very low | 45.6 | Very low | 106 Ų | 106 | 138.8 Ų | 138.8 | 74% | 0.741 | 77% | 0.774 | S | S | * | * | 154.9 | 133.6 | 110.7 | -167.7 | 0 | 0 | 0 | 0 | 114.2 | |||||
| 354 | V | 43.5 | Very low | 46 | Very low | 129 Ų | 129 | 133.1 Ų | 133.1 | 78% | 0.782 | 76% | 0.759 | S | S | * | * | trans | 61.8 | 126 | 149 | 161.5 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 355 | T | 43 | Very low | 45.8 | Very low | 110 Ų | 110 | 136.1 Ų | 136.1 | 68% | 0.675 | 76% | 0.763 | S | S | * | * | cis | -165.6 | 155.8 | -1 | -147.3 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 356 | L | 48 | Very low | 45.9 | Very low | 159 Ų | 159 | 132.8 Ų | 132.8 | 83% | 0.832 | 76% | 0.757 | S | S | * | * | trans | 65.5 | 155.7 | 163.3 | -65.3 | 173 | 0 | 0 | 0 | 120.3 | ||||
| 357 | P | 47.1 | Very low | 45.2 | Very low | 117 Ų | 117 | 129.5 Ų | 129.5 | 76% | 0.76 | 76% | 0.755 | S | S | * | * | trans | -123.5 | 170 | -149.9 | 42.6 | -29.7 | 0 | 0 | 0 | 116.7 | ||||
| 358 | C | 36.9 | Very low | 45.3 | Very low | 134 Ų | 134 | 130.1 Ų | 130.1 | 91% | 0.905 | 75% | 0.752 | S | S | * | * | trans | -72.8 | 148.7 | 168.8 | -71.9 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 359 | N | 52.3 | Low | 45.5 | Very low | 168 Ų | 168 | 129.6 Ų | 129.6 | 90% | 0.898 | 75% | 0.749 | S | S | * | * | trans | -149.1 | 141.1 | 163 | -148.5 | 8.5 | 0 | 0 | 0 | 106 | ||||
| 360 | G | 42.4 | Very low | 45.1 | Very low | 54 Ų | 54 | 134.5 Ų | 134.5 | 56% | 0.557 | 75% | 0.752 | S | S | * | * | cis | 150.2 | 52 | 2.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 361 | Q | 42.7 | Very low | 44.8 | Very low | 153 Ų | 153 | 134.5 Ų | 134.5 | 72% | 0.715 | 76% | 0.761 | S | S | * | * | trans | -140.3 | 106.4 | -174.3 | -86.9 | -73.2 | -86.6 | 0 | 0 | 113 | ||||
| 362 | P | 44.3 | Very low | 44.6 | Very low | 122 Ų | 122 | 131.1 Ų | 131.1 | 79% | 0.792 | 76% | 0.759 | S | S | * | * | trans | -133.3 | 108.4 | 161.6 | 34.3 | -17.2 | 0 | 0 | 0 | 112.5 | ||||
| 363 | W | 47.1 | Very low | 44.4 | Very low | 198 Ų | 198 | 128 Ų | 128 | 75% | 0.75 | 76% | 0.763 | S | S | * | * | trans | -157.4 | 130.5 | 165.3 | 59.2 | -66.8 | 0 | 0 | 0 | 107.9 | ||||
| 364 | A | 43.5 | Very low | 44.8 | Very low | 64 Ų | 64 | 129.2 Ų | 129.2 | 53% | 0.529 | 77% | 0.768 | S | S | . | * | 64 | 142.4 | 104.3 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 365 | Q | 44 | Very low | 45.1 | Very low | 181 Ų | 181 | 128.8 Ų | 128.8 | 85% | 0.846 | 77% | 0.77 | S | S | * | * | cis | -165.4 | 142.7 | -5.8 | -114.6 | 170.9 | 58.8 | 0 | 0 | 107.3 | ||||
| 366 | S | 42.2 | Very low | 45.1 | Very low | 92 Ų | 92 | 128.1 Ų | 128.1 | 64% | 0.643 | 78% | 0.776 | S | S | * | * | trans | -172.6 | 91.9 | 156.2 | -93.2 | 0 | 0 | 0 | 0 | 112.1 | H368 | S366-H368 WeakPolarHBondContact CB-NE2 3.32Å; S366-H368 PolarHBondContact OG-NE2 3.15Å | ||
| 367 | A | 42.6 | Very low | 45.6 | Very low | 97 Ų | 97 | 127.4 Ų | 127.4 | 80% | 0.802 | 78% | 0.779 | S | S | * | * | trans | -103.9 | 115.8 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 368 | H | 53.4 | Low | 45.4 | Very low | 171 Ų | 171 | 131.9 Ų | 131.9 | 79% | 0.792 | 79% | 0.786 | S | S | * | * | trans | -120.2 | 86.4 | 179.7 | -66.3 | -97.9 | 0 | 0 | 0 | 109.2 | S366 F370 | S366-H368 WeakPolarHBondContact CB-NE2 3.32Å; S366-H368 PolarHBondContact OG-NE2 3.15Å; H368-F370 PolarHBondContact O-N 3.27Å | ||
| 369 | S | 42.5 | Very low | 46 | Very low | 116 Ų | 116 | 129 Ų | 129 | 81% | 0.811 | 78% | 0.78 | S | S | * | * | trans | -75.6 | 111.6 | 173.3 | -61.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 370 | F | 45.4 | Very low | 45.5 | Very low | 200 Ų | 200 | 124.4 Ų | 124.4 | 88% | 0.877 | 77% | 0.772 | S | S | * | * | trans | -127.5 | 119.3 | 162.7 | -86.2 | -77.6 | 0 | 0 | 0 | 111 | H368 | H368-F370 PolarHBondContact O-N 3.27Š| ||
| 371 | S | 40.4 | Very low | 45.8 | Very low | 108 Ų | 108 | 132 Ų | 132 | 76% | 0.755 | 79% | 0.79 | S | S | * | * | trans | -97.9 | 143.1 | 167.4 | 179.2 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 372 | C | 41.2 | Very low | 46.1 | Very low | 121 Ų | 121 | 129.2 Ų | 129.2 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | 173.4 | 132 | 126.5 | -97 | 0 | 0 | 0 | 0 | 113 | |||||
| 373 | A | 46.5 | Very low | 46.3 | Very low | 89 Ų | 89 | 126.8 Ų | 126.8 | 74% | 0.736 | 79% | 0.79 | S | S | * | * | trans | 45.3 | 131.6 | 147.1 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 374 | P | 50.9 | Low | 46.1 | Very low | 131 Ų | 131 | 124.4 Ų | 124.4 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -76.3 | 152.5 | 156.2 | 35.2 | -33 | 0 | 0 | 0 | 110.6 | ||||
| 375 | S | 51.6 | Low | 46.4 | Very low | 119 Ų | 119 | 129.1 Ų | 129.1 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | trans | -128.2 | 138 | 168.9 | -166.1 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 376 | A | 43 | Very low | 46.6 | Very low | 97 Ų | 97 | 124 Ų | 124 | 80% | 0.802 | 80% | 0.803 | S | S | * | * | trans | -91.1 | 147.7 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 377 | T | 57.9 | Low | 46.6 | Very low | 144 Ų | 144 | 130.9 Ų | 130.9 | 88% | 0.883 | 82% | 0.817 | S | S | * | * | trans | -122.6 | 120.6 | 169.2 | -48.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 378 | F | 42.7 | Very low | 46.8 | Very low | 210 Ų | 210 | 132.2 Ų | 132.2 | 92% | 0.921 | 82% | 0.82 | S | S | * | * | trans | -104.7 | 130.4 | -175.1 | -176.1 | -87.1 | 0 | 0 | 0 | 110.5 | ||||
| 379 | G | 50.5 | Low | 46.4 | Very low | 74 Ų | 74 | 129.2 Ų | 129.2 | 76% | 0.763 | 82% | 0.818 | S | S | * | * | trans | 168.5 | 138.3 | 172 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 380 | G | 41.5 | Very low | 46.6 | Very low | 71 Ų | 71 | 128.4 Ų | 128.4 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | cis | 139.7 | 77.8 | -2.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 381 | F | 48.8 | Very low | 47 | Very low | 214 Ų | 214 | 125.4 Ų | 125.4 | 94% | 0.939 | 82% | 0.816 | S | S | * | * | trans | -147.6 | 150.7 | 167.7 | -141.9 | -95.5 | 0 | 0 | 0 | 110.9 | ||||
| 382 | A | 47.5 | Very low | 47.5 | Very low | 94 Ų | 94 | 125.7 Ų | 125.7 | 78% | 0.777 | 82% | 0.816 | S | S | * | * | trans | -138.4 | 160.9 | -168.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 383 | G | 48.3 | Very low | 48 | Very low | 71 Ų | 71 | 125.1 Ų | 125.1 | 73% | 0.732 | 81% | 0.813 | S | S | * | * | trans | 137 | 91.1 | -174.5 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 384 | N | 43.2 | Very low | 48 | Very low | 149 Ų | 149 | 125.6 Ų | 125.6 | 80% | 0.797 | 81% | 0.811 | S | S | * | * | 92 | 146.2 | 51.3 | -167 | 23 | 0 | 0 | 0 | 112.3 | |||||
| 385 | L | 51 | Low | 48.4 | Very low | 162 Ų | 162 | 125.2 Ų | 125.2 | 85% | 0.848 | 81% | 0.809 | S | S | * | * | trans | 73 | 130.3 | -174.3 | -45.7 | 177.9 | 0 | 0 | 0 | 114.4 | ||||
| 386 | G | 46.7 | Very low | 48 | Very low | 73 Ų | 73 | 129.4 Ų | 129.4 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | cis | -164.6 | 175.2 | -1.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 387 | Y | 43.1 | Very low | 48.3 | Very low | 238 Ų | 238 | 135.7 Ų | 135.7 | 93% | 0.933 | 81% | 0.812 | S | S | * | * | trans | -64.9 | 145.7 | -176.8 | -92.3 | -129.8 | 0 | 0 | 0 | 114.1 | ||||
| 388 | S | 46.6 | Very low | 47.8 | Very low | 124 Ų | 124 | 132.3 Ų | 132.3 | 87% | 0.867 | 80% | 0.799 | S | S | * | * | -167.5 | 161.6 | 103.2 | -155.9 | 0 | 0 | 0 | 0 | 113.7 | |||||
| 389 | S | 45 | Very low | 48.2 | Very low | 109 Ų | 109 | 129.4 Ų | 129.4 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | trans | -89.4 | 141.6 | -170.1 | 170.6 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 390 | A | 47 | Very low | 48.1 | Very low | 98 Ų | 98 | 134.5 Ų | 134.5 | 81% | 0.81 | 80% | 0.795 | S | S | * | * | trans | -168.5 | 131.3 | 132.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 391 | V | 52.6 | Low | 48.1 | Very low | 137 Ų | 137 | 135.3 Ų | 135.3 | 83% | 0.83 | 80% | 0.795 | S | S | * | * | trans | -128.4 | 167.7 | 159.2 | -116 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 392 | P | 52.6 | Low | 48 | Very low | 115 Ų | 115 | 137 Ų | 137 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | cis | -122 | -158.6 | 30.7 | 28.7 | -3 | 0 | 0 | 0 | 111.4 | ||||
| 393 | S | 51 | Low | 47.9 | Very low | 109 Ų | 109 | 135.8 Ų | 135.8 | 76% | 0.762 | 79% | 0.792 | S | S | * | * | cis | -156.5 | 177.7 | 16.8 | -34.9 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 394 | S | 46 | Very low | 47.5 | Very low | 99 Ų | 99 | 148 Ų | 148 | 69% | 0.692 | 82% | 0.816 | S | S | * | * | trans | -122.1 | 163 | 159.2 | -178.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 395 | P | 60.5 | Low | 47.7 | Very low | 123 Ų | 123 | 148 Ų | 148 | 80% | 0.799 | 82% | 0.817 | S | S | * | * | -137.5 | 159.5 | 111.9 | 38.6 | -29.4 | 0 | 0 | 0 | 115.9 | |||||
| 396 | Y | 42.7 | Very low | 47.6 | Very low | 206 Ų | 206 | 147.2 Ų | 147.2 | 81% | 0.808 | 82% | 0.815 | S | S | * | * | trans | -44.2 | 147.4 | 165.4 | -88.5 | -132.9 | 0 | 0 | 0 | 114.7 | ||||
| 397 | Y | 48.5 | Very low | 47.6 | Very low | 229 Ų | 229 | 151.3 Ų | 151.3 | 90% | 0.898 | 82% | 0.819 | S | S | * | * | -156.9 | 153.6 | 103 | -114.6 | -83 | 0 | 0 | 0 | 110.8 | |||||
| 398 | A | 47.6 | Very low | 47.9 | Very low | 74 Ų | 74 | 146.2 Ų | 146.2 | 61% | 0.612 | 81% | 0.812 | S | S | * | * | trans | -121.3 | -167.1 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 399 | I | 50.6 | Low | 47.9 | Very low | 149 Ų | 149 | 147.6 Ų | 147.6 | 76% | 0.764 | 81% | 0.809 | S | S | * | * | trans | 75.8 | 121.7 | 170.6 | -55.6 | 180 | 0 | 0 | 0 | 112.3 | ||||
| 400 | H | 49.5 | Very low | 48.1 | Very low | 180 Ų | 180 | 150.2 Ų | 150.2 | 83% | 0.833 | 81% | 0.812 | S | S | * | * | cis | -152.3 | 168.6 | 19.6 | -122.9 | 163 | 0 | 0 | 0 | 112.5 | ||||
| 401 | A | 41.7 | Very low | 48.2 | Very low | 88 Ų | 88 | 153.9 Ų | 153.9 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -101.6 | 138.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 402 | R | 45.9 | Very low | 47.9 | Very low | 250 Ų | 250 | 155.2 Ų | 155.2 | 94% | 0.943 | 81% | 0.81 | S | S | * | * | trans | -175.9 | 132.1 | 161.6 | -98 | 154.1 | -172.4 | -155.8 | 1.6 | 106.9 | ||||
| 403 | G | 45.4 | Very low | 47.5 | Very low | 69 Ų | 69 | 158.6 Ų | 158.6 | 71% | 0.711 | 82% | 0.816 | S | S | * | * | cis | 126.6 | 58.9 | 0.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 404 | W | 40.5 | Very low | 47.2 | Very low | 327 Ų | 327 | 163.1 Ų | 163.1 | 100% | 1.239 | 82% | 0.821 | S | S | * | * | trans | -150.4 | 0 | 169.2 | -87.4 | 86.7 | 0 | 0 | 0 | 108 |
Retrieved 404 of 404 residues in 161.9 ms
(Link to these results)