| 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 | 43.5 | Very low | 46.5 | Very low | 245 Ų | 245 | 148.5 Ų | 148.5 | 100% | 1.207 | 81% | 0.812 | S | S | * | * | 0 | 118 | 0 | -66.8 | 175.1 | 96.2 | 0 | 0 | 107.3 | |||||
| 2 | S | 40.3 | Very low | 46.6 | Very low | 116 Ų | 116 | 149.7 Ų | 149.7 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | trans | 46.6 | 105.6 | 165.9 | -53 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 3 | N | 42.5 | Very low | 46.5 | Very low | 145 Ų | 145 | 147.8 Ų | 147.8 | 78% | 0.775 | 81% | 0.807 | S | S | * | * | 67.6 | 100.5 | 86.6 | -82.1 | 10.8 | 0 | 0 | 0 | 113.5 | |||||
| 4 | T | 51.6 | Low | 46.3 | Very low | 127 Ų | 127 | 144.2 Ų | 144.2 | 78% | 0.779 | 80% | 0.798 | S | S | * | * | 60.9 | 114.3 | 83.6 | 61.5 | 0 | 0 | 0 | 0 | 115.9 | |||||
| 5 | T | 52.2 | Low | 46.2 | Very low | 112 Ų | 112 | 145.7 Ų | 145.7 | 69% | 0.687 | 80% | 0.804 | S | S | * | * | trans | -155.6 | 95.7 | 163.7 | -45.3 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 6 | E | 46.3 | Very low | 46.5 | Very low | 171 Ų | 171 | 146.6 Ų | 146.6 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | 104.5 | 113.9 | 107.4 | -76.3 | 171.4 | -170.8 | 0 | 0 | 110.3 | |||||
| 7 | H | 47.4 | Very low | 46.7 | Very low | 179 Ų | 179 | 144.7 Ų | 144.7 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | 48.9 | 143 | 78.9 | -92.3 | -38.9 | 0 | 0 | 0 | 112.8 | |||||
| 8 | N | 46.9 | Very low | 46.4 | Very low | 121 Ų | 121 | 148.1 Ų | 148.1 | 65% | 0.647 | 81% | 0.808 | S | S | * | * | cis | -179.3 | 140.3 | -5.4 | -166.8 | 4.1 | 0 | 0 | 0 | 102.6 | ||||
| 9 | N | 45.3 | Very low | 46.8 | Very low | 153 Ų | 153 | 146.8 Ų | 146.8 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -176.2 | 93.7 | 146.7 | -107.4 | -9.5 | 0 | 0 | 0 | 110.5 | ||||
| 10 | S | 43.4 | Very low | 47 | Very low | 101 Ų | 101 | 150.6 Ų | 150.6 | 71% | 0.706 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -79.6 | 120.5 | 148.1 | 64.7 | 0 | 0 | 0 | 0 | 107.5 | ||
| 11 | N | 52.8 | Low | 46.6 | Very low | 163 Ų | 163 | 149 Ų | 149 | 87% | 0.872 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -97.4 | 123 | 167 | -134 | 11.3 | 0 | 0 | 0 | 108.6 | ||
| 12 | M | 47 | Very low | 46.7 | Very low | 163 Ų | 163 | 146.3 Ų | 146.3 | 80% | 0.803 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -96.9 | 166.7 | -174.9 | -165.2 | 179.2 | 165.3 | 0 | 0 | 108.2 | ||
| 13 | V | 45.7 | Very low | 46.9 | Very low | 126 Ų | 126 | 146.8 Ų | 146.8 | 76% | 0.764 | 78% | 0.783 | S | S | * | * | trans | 85.4 | 122.1 | 163.6 | -158.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 14 | S | 43.2 | Very low | 46.8 | Very low | 97 Ų | 97 | 147.2 Ų | 147.2 | 68% | 0.678 | 79% | 0.786 | S | S | * | * | cis | -148.4 | 132.6 | 45.6 | -46.3 | 0 | 0 | 0 | 0 | 113 | ||||
| 15 | D | 45.8 | Very low | 46.5 | Very low | 166 Ų | 166 | 150.4 Ų | 150.4 | 89% | 0.888 | 79% | 0.789 | S | S | * | * | trans | -63.9 | 132.7 | 157.7 | -69 | -53.1 | 0 | 0 | 0 | 110.2 | ||||
| 16 | L | 50.3 | Low | 46 | Very low | 160 Ų | 160 | 152.4 Ų | 152.4 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | trans | -129.8 | 143.2 | 156.8 | -96.1 | 111.2 | 0 | 0 | 0 | 109.9 | ||||
| 17 | P | 49.9 | Very low | 46 | Very low | 115 Ų | 115 | 150.8 Ų | 150.8 | 75% | 0.747 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -85.7 | 145.3 | -154.3 | 33.6 | -34.4 | 0 | 0 | 0 | 113.4 | ||
| 18 | F | 41.7 | Very low | 45.7 | Very low | 205 Ų | 205 | 147.8 Ų | 147.8 | 90% | 0.899 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 136.2 | 162.8 | -78.3 | -90.5 | 0 | 0 | 0 | 111.4 | ||
| 19 | P | 53.9 | Low | 45.5 | Very low | 125 Ų | 125 | 146.2 Ų | 146.2 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -82.9 | 130.8 | 150.7 | 2.6 | 16.2 | 0 | 0 | 0 | 109.9 | ||
| 20 | R | 49.9 | Very low | 45.4 | Very low | 222 Ų | 222 | 146 Ų | 146 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -53 | 151.8 | 175.3 | -93.3 | 173.6 | 158.3 | 135 | -5.8 | 115.3 | ||
| 21 | D | 40.1 | Very low | 45.4 | Very low | 117 Ų | 117 | 146.8 Ų | 146.8 | 63% | 0.626 | 79% | 0.792 | S | S | * | * | trans | 43 | 110.7 | 138.1 | -64.6 | -42.1 | 0 | 0 | 0 | 118.2 | ||||
| 22 | H | 44.4 | Very low | 44.9 | Very low | 189 Ų | 189 | 146.2 Ų | 146.2 | 88% | 0.875 | 79% | 0.789 | S | S | * | * | -148 | 95.7 | 120.5 | -74.3 | -54.2 | 0 | 0 | 0 | 109.2 | |||||
| 23 | T | 45.1 | Very low | 44.8 | Very low | 125 Ų | 125 | 147.5 Ų | 147.5 | 77% | 0.767 | 79% | 0.793 | S | S | * | * | trans | 9.7 | 119 | 148.1 | 43.5 | 0 | 0 | 0 | 0 | 119 | K25 | T23-K25 PolarHBondContact O-N 3.13Š| ||
| 24 | N | 40.2 | Very low | 44.6 | Very low | 155 Ų | 155 | 150.5 Ų | 150.5 | 83% | 0.829 | 80% | 0.798 | S | S | * | * | trans | -39.6 | 120.5 | 151.5 | -73.6 | -31.8 | 0 | 0 | 0 | 113.1 | ||||
| 25 | K | 44.7 | Very low | 44.9 | Very low | 194 Ų | 194 | 151.2 Ų | 151.2 | 84% | 0.843 | 80% | 0.803 | S | S | * | * | trans | -137.4 | 107.9 | 140.1 | -96.7 | -170.9 | 175.1 | -170.4 | 0 | 107.4 | T23 | T23-K25 PolarHBondContact O-N 3.13Š| ||
| 26 | I | 43 | Very low | 44.9 | Very low | 153 Ų | 153 | 149.8 Ų | 149.8 | 79% | 0.785 | 80% | 0.796 | S | S | * | * | trans | -84.6 | 104.6 | 163.8 | -62.2 | 169.4 | 0 | 0 | 0 | 104.5 | ||||
| 27 | D | 44.7 | Very low | 44.4 | Very low | 137 Ų | 137 | 150.1 Ų | 150.1 | 73% | 0.733 | 80% | 0.798 | S | S | * | * | trans | -106.9 | 121.4 | 162.1 | -113.2 | -30.3 | 0 | 0 | 0 | 106.7 | ||||
| 28 | P | 41.6 | Very low | 44.2 | Very low | 117 Ų | 117 | 150 Ų | 150 | 76% | 0.76 | 80% | 0.795 | S | S | * | * | trans | -101 | 99.8 | 169.7 | 33.3 | -21.1 | 0 | 0 | 0 | 108.4 | ||||
| 29 | A | 44.2 | Very low | 44.5 | Very low | 87 Ų | 87 | 146.6 Ų | 146.6 | 72% | 0.719 | 79% | 0.791 | S | S | * | * | trans | -152.2 | 133.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 30 | D | 41.4 | Very low | 44.3 | Very low | 150 Ų | 150 | 146.6 Ų | 146.6 | 80% | 0.802 | 79% | 0.789 | S | S | * | * | trans | 65.2 | 112.6 | 165.5 | -79.2 | -28.7 | 0 | 0 | 0 | 120.9 | ||||
| 31 | P | 44.3 | Very low | 44.4 | Very low | 116 Ų | 116 | 139.8 Ų | 139.8 | 75% | 0.753 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -96.4 | 81.8 | 155.5 | 35.9 | -21.4 | 0 | 0 | 0 | 108.5 | ||
| 32 | D | 41.7 | Very low | 44.7 | Very low | 151 Ų | 151 | 142 Ų | 142 | 81% | 0.807 | 79% | 0.792 | S | S | * | * | trans | -168.7 | 84 | 164.5 | -90.4 | -30.1 | 0 | 0 | 0 | 109.2 | ||||
| 33 | E | 44.9 | Very low | 45 | Very low | 190 Ų | 190 | 138.4 Ų | 138.4 | 89% | 0.888 | 78% | 0.779 | S | S | * | * | trans | -146.9 | 117.1 | 157.8 | -126.3 | 178.1 | -170.6 | 0 | 0 | 111.8 | S35 | E33-S35 PolarHBondContact O-N 2.73Å; E33-S35 VanDerWaalsContact O-N 3.13Å | ||
| 34 | H | 42.8 | Very low | 45.6 | Very low | 189 Ų | 189 | 138.3 Ų | 138.3 | 88% | 0.875 | 78% | 0.781 | S | S | * | * | trans | -52.3 | 105 | 171.1 | -70.8 | -72.4 | 0 | 0 | 0 | 111.7 | ||||
| 35 | S | 48.1 | Very low | 46.3 | Very low | 113 Ų | 113 | 134.9 Ų | 134.9 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -103.1 | 85.8 | 165.8 | 63.9 | 0 | 0 | 0 | 0 | 110.3 | E33 | E33-S35 PolarHBondContact O-N 2.73Å; E33-S35 VanDerWaalsContact O-N 3.13Å | ||
| 36 | N | 45.6 | Very low | 46.7 | Very low | 136 Ų | 136 | 130.7 Ų | 130.7 | 73% | 0.727 | 76% | 0.764 | S | S | * | * | trans | 22.8 | 111.4 | 150 | -66.7 | -30.2 | 0 | 0 | 0 | 118.2 | T38 | N36-T38 VanDerWaalsContact C-N 3.27Å; N36-T38 PolarHBondContact O-N 2.82Å | ||
| 37 | D | 40.2 | Very low | 47 | Very low | 167 Ų | 167 | 127 Ų | 127 | 89% | 0.893 | 77% | 0.765 | S | S | * | * | trans | -52 | 92.1 | 142.3 | -87.9 | -34.1 | 0 | 0 | 0 | 109.5 | ||||
| 38 | T | 45.6 | Very low | 47.6 | Very low | 111 Ų | 111 | 130 Ų | 130 | 68% | 0.681 | 77% | 0.771 | S | S | * | * | trans | -91.6 | 98.6 | 152.6 | 44.4 | 0 | 0 | 0 | 0 | 107.4 | N36 V40 | N36-T38 VanDerWaalsContact C-N 3.27Å; N36-T38 PolarHBondContact O-N 2.82Å; T38-V40 PolarHBondContact O-N 3.41Å | ||
| 39 | V | 47.3 | Very low | 48.1 | Very low | 134 Ų | 134 | 128.4 Ų | 128.4 | 81% | 0.812 | 76% | 0.763 | S | S | * | * | trans | -55.7 | 91.1 | 157.4 | 176.6 | 0 | 0 | 0 | 0 | 106.7 | A41 | V39-A41 PolarHBondContact O-N 3.08Š| ||
| 40 | V | 50.6 | Low | 48.6 | Very low | 125 Ų | 125 | 130.1 Ų | 130.1 | 76% | 0.758 | 76% | 0.76 | S | S | * | * | trans | -71.9 | 107.2 | 165 | 177 | 0 | 0 | 0 | 0 | 104.8 | T38 D42 | T38-V40 PolarHBondContact O-N 3.41Å; V40-D42 PolarHBondContact O-N 3.2Å | ||
| 41 | A | 52.1 | Low | 49.1 | Very low | 80 Ų | 80 | 131 Ų | 131 | 66% | 0.661 | 76% | 0.759 | S | S | * | * | trans | -53.4 | 124.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109 | V39 D43 | V39-A41 PolarHBondContact O-N 3.08Å; A41-D43 PolarHBondContact O-N 2.74Å | ||
| 42 | D | 47.5 | Very low | 49.4 | Very low | 162 Ų | 162 | 132 Ų | 132 | 87% | 0.866 | 75% | 0.754 | S | S | * | * | trans | -50.8 | 103.8 | 169.4 | -84.7 | -41.1 | 0 | 0 | 0 | 109.3 | V40 P44 | V40-D42 PolarHBondContact O-N 3.2Å; D42-P44 VanDerWaalsContact O-CD 3.28Å; D42-P44 WeakPolarHBondContact O-CD 3.27Å | ||
| 43 | D | 49.8 | Very low | 50.1 | Low | 115 Ų | 115 | 127.6 Ų | 127.6 | 62% | 0.615 | 74% | 0.735 | S | S | * | * | trans | -89.8 | 105.7 | 163.2 | -161.6 | -7.8 | 0 | 0 | 0 | 107.2 | A41 A45 | A41-D43 PolarHBondContact O-N 2.74Å; D43-A45 PolarHBondContact O-N 3.05Å | ||
| 44 | P | 57.4 | Low | 50.7 | Low | 123 Ų | 123 | 120.2 Ų | 120.2 | 80% | 0.799 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.7 | 4.6 | -175.5 | 28.6 | -34.7 | 0 | 0 | 0 | 113.4 | D42 | D42-P44 VanDerWaalsContact O-CD 3.28Å; D42-P44 WeakPolarHBondContact O-CD 3.27Å |
| 45 | A | 55.1 | Low | 51.3 | Low | 83 Ų | 83 | 116.7 Ų | 116.7 | 69% | 0.686 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -8.5 | -174.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | D43 | D43-A45 PolarHBondContact O-N 3.05Š|
| 46 | T | 52.5 | Low | 52.2 | Low | 105 Ų | 105 | 116.2 Ų | 116.2 | 64% | 0.644 | 69% | 0.685 | S | S | * | * | trans | -113.7 | 37.7 | -176.9 | 33 | 0 | 0 | 0 | 0 | 114.1 | K48 | T46-K48 PolarHBondContact O-N 3.07Š| ||
| 47 | G | 50.3 | Low | 53.2 | Low | 77 Ų | 77 | 116.3 Ų | 116.3 | 79% | 0.794 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.6 | 36 | 179.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 48 | K | 55.9 | Low | 54.8 | Low | 198 Ų | 198 | 112.6 Ų | 112.6 | 86% | 0.861 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.4 | -0.7 | -179.1 | -74.7 | -173.1 | 178.8 | 177.4 | 0 | 115.6 | T46 | T46-K48 PolarHBondContact O-N 3.07Š|
| 49 | S | 54 | Low | 56.1 | Low | 85 Ų | 85 | 113 Ų | 113 | 59% | 0.594 | 66% | 0.656 | S | S | * | * | S | Bend | trans | -90.2 | -14.2 | -176.6 | 44.6 | 0 | 0 | 0 | 0 | 116.1 | ||
| 50 | D | 53.3 | Low | 57.4 | Low | 122 Ų | 122 | 108.9 Ų | 108.9 | 65% | 0.652 | 63% | 0.634 | S | S | * | * | S | Bend | trans | -95.3 | -14.6 | -168.7 | -66.4 | -28.6 | 0 | 0 | 0 | 116.1 | H52 S53 G54 | D50-H52 VanDerWaalsContact C-N 3.34Å; D50-H52 PolarHBondContact O-N 2.68Å; D50-S53 PolarHBondContact O-N 2.91Å; D50-S53 PolarHBondContact O-OG 3.26Å; D50-G54 PolarHBondContact O-N 3.29Å |
| 51 | Q | 51.5 | Low | 58.7 | Low | 169 Ų | 169 | 106.3 Ų | 106.3 | 79% | 0.79 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -69.5 | -29.2 | 179.6 | -77.6 | -173.9 | -9.2 | 0 | 0 | 113.4 | L55 | Q51-L55 PolarHBondContact O-N 2.81Å |
| 52 | H | 52.1 | Low | 60 | Low | 138 Ų | 138 | 107.8 Ų | 107.8 | 64% | 0.639 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -75.1 | -25.4 | 175.5 | -77.5 | -70.5 | 0 | 0 | 0 | 112.9 | D50 N56 | D50-H52 VanDerWaalsContact C-N 3.34Å; D50-H52 PolarHBondContact O-N 2.68Å; H52-N56 VanDerWaalsContact O-CG 3.3Å; H52-N56 PolarHBondContact O-N 3.17Å; H52-N56 PolarHBondContact O-ND2 3.31Å |
| 53 | S | 55.6 | Low | 61.6 | Low | 58 Ų | 58 | 104.4 Ų | 104.4 | 41% | 0.406 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -72.7 | -36.8 | 178.5 | 91.1 | 0 | 0 | 0 | 0 | 111.8 | D50 K57 | D50-S53 PolarHBondContact O-N 2.91Å; D50-S53 PolarHBondContact O-OG 3.26Å; S53-K57 PolarHBondContact O-N 3.15Å |
| 54 | G | 56.5 | Low | 63.1 | Low | 34 Ų | 34 | 103.8 Ų | 103.8 | 35% | 0.351 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -67.5 | -45.1 | 177 | 0 | 0 | 0 | 0 | 0 | 112.9 | D50 N56 K57 V58 | D50-G54 PolarHBondContact O-N 3.29Å; G54-N56 VanDerWaalsContact C-N 3.35Å; G54-N56 PolarHBondContact O-N 3.03Å; G54-K57 PolarHBondContact O-N 3.36Å; G54-V58 WeakPolarHBondContact O-CG2 3.46Å; G54-V58 PolarHBondContact O-N 3.45Å |
| 55 | L | 57.4 | Low | 64.2 | Low | 115 Ų | 115 | 101.1 Ų | 101.1 | 60% | 0.602 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -62.6 | -40.1 | 177.9 | -82.4 | 162.2 | 0 | 0 | 0 | 112.3 | Q51 K57 V58 Q59 | Q51-L55 PolarHBondContact O-N 2.81Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 3.42Å; L55-V58 PolarHBondContact O-N 3.42Å; L55-Q59 WeakPolarHBondContact O-CB 3.45Å; L55-Q59 PolarHBondContact O-N 3.22Å |
| 56 | N | 65.8 | Low | 65.5 | Low | 103 Ų | 103 | 100.3 Ų | 100.3 | 55% | 0.551 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.1 | -37.2 | 176.1 | -73.1 | -14.9 | 0 | 0 | 0 | 112.2 | H52 G54 S60 | H52-N56 VanDerWaalsContact O-CG 3.3Å; H52-N56 PolarHBondContact O-N 3.17Å; H52-N56 PolarHBondContact O-ND2 3.31Å; G54-N56 VanDerWaalsContact C-N 3.35Å; G54-N56 PolarHBondContact O-N 3.03Å; N56-S60 WeakPolarHBondContact O-CB 3.33Å; N56-S60 PolarHBondContact O-N 3.1Å; N56-S60 PolarHBondContact O-OG 3.05Å |
| 57 | K | 67.1 | Low | 67 | Low | 139 Ų | 139 | 98.2 Ų | 98.2 | 60% | 0.604 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -66.5 | -43.1 | 174.7 | -79.2 | 176.3 | 178.9 | 175.3 | 0 | 112.4 | S53 G54 L55 Q59 S60 N61 | S53-K57 PolarHBondContact O-N 3.15Å; G54-K57 PolarHBondContact O-N 3.36Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 3.42Å; K57-Q59 VanDerWaalsContact C-N 3.34Å; K57-S60 WeakPolarHBondContact CA-OG 3.33Å; K57-S60 PolarHBondContact O-N 3.02Å; K57-S60 PolarHBondContact O-OG 3.04Å; K57-N61 WeakPolarHBondContact O-CB 3.39Å; K57-N61 PolarHBondContact O-N 3.16Å; K57-N61 PolarHBondContact O-ND2 3.27Å; K57-N61 PolarHBondContact O-OD1 3.37Å |
| 58 | V | 72.5 | Confident | 68.6 | Low | 88 Ų | 88 | 97.2 Ų | 97.2 | 53% | 0.533 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.2 | -41.9 | 177 | 176.1 | 0 | 0 | 0 | 0 | 110.5 | G54 L55 N61 L62 | G54-V58 WeakPolarHBondContact O-CG2 3.46Å; G54-V58 PolarHBondContact O-N 3.45Å; L55-V58 PolarHBondContact O-N 3.42Å; V58-N61 PolarHBondContact O-N 3.43Å; V58-L62 HydrophobicContact CG1-CD1 4.21Å; V58-L62 WeakPolarHBondContact O-CG 3.47Å; V58-L62 PolarHBondContact O-N 2.97Å |
| 59 | Q | 73.4 | Confident | 70 | Confident | 119 Ų | 119 | 92.1 Ų | 92.1 | 56% | 0.556 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -65.7 | -41.6 | 177.3 | -170.4 | 175.2 | -10.4 | 0 | 0 | 112.1 | L55 K57 N61 L62 I63 | L55-Q59 WeakPolarHBondContact O-CB 3.45Å; L55-Q59 PolarHBondContact O-N 3.22Å; K57-Q59 VanDerWaalsContact C-N 3.34Å; Q59-N61 VanDerWaalsContact C-N 3.32Å; Q59-N61 PolarHBondContact O-N 3.21Å; Q59-L62 PolarHBondContact O-N 3.09Å; Q59-I63 HydrophobicContact CG-CD1 4.25Å; Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.36Å; Q59-I63 PolarHBondContact O-N 3.34Å |
| 60 | S | 74.1 | Confident | 71.5 | Confident | 49 Ų | 49 | 90.8 Ų | 90.8 | 34% | 0.343 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 174.3 | 61.7 | 0 | 0 | 0 | 0 | 111.6 | N56 K57 L62 I63 I64 | N56-S60 WeakPolarHBondContact O-CB 3.33Å; N56-S60 PolarHBondContact O-N 3.1Å; N56-S60 PolarHBondContact O-OG 3.05Å; K57-S60 WeakPolarHBondContact CA-OG 3.33Å; K57-S60 PolarHBondContact O-N 3.02Å; K57-S60 PolarHBondContact O-OG 3.04Å; S60-L62 PolarHBondContact O-N 3.46Å; S60-I63 PolarHBondContact O-N 3.12Å; S60-I64 VanDerWaalsContact O-CG1 3.25Å; S60-I64 WeakPolarHBondContact O-CG1 3.27Å; S60-I64 PolarHBondContact O-N 3.18Å |
| 61 | N | 78.4 | Confident | 73.1 | Confident | 70 Ų | 70 | 89.3 Ų | 89.3 | 37% | 0.374 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64.7 | -41.3 | 178.3 | -69.5 | -3.1 | 0 | 0 | 0 | 111.5 | K57 V58 Q59 I63 I64 L65 | K57-N61 WeakPolarHBondContact O-CB 3.39Å; K57-N61 PolarHBondContact O-N 3.16Å; K57-N61 PolarHBondContact O-ND2 3.27Å; K57-N61 PolarHBondContact O-OD1 3.37Å; V58-N61 PolarHBondContact O-N 3.43Å; Q59-N61 VanDerWaalsContact C-N 3.32Å; Q59-N61 PolarHBondContact O-N 3.21Å; N61-I63 PolarHBondContact O-N 3.5Å; N61-I64 PolarHBondContact O-N 3.22Å; N61-L65 WeakPolarHBondContact O-CB 3.48Å; N61-L65 PolarHBondContact O-N 3.31Å |
| 62 | L | 80 | Confident | 74.7 | Confident | 111 Ų | 111 | 82.3 Ų | 82.3 | 58% | 0.581 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -62.9 | -40.6 | 174.6 | -78.3 | 170 | 0 | 0 | 0 | 112.4 | V58 Q59 S60 L65 S66 | V58-L62 HydrophobicContact CG1-CD1 4.21Å; V58-L62 WeakPolarHBondContact O-CG 3.47Å; V58-L62 PolarHBondContact O-N 2.97Å; Q59-L62 PolarHBondContact O-N 3.09Å; S60-L62 PolarHBondContact O-N 3.46Å; L62-L65 PolarHBondContact O-N 3.5Å; L62-S66 WeakPolarHBondContact O-CB 3.28Å; L62-S66 PolarHBondContact O-N 3.35Å |
| 63 | I | 80.9 | Confident | 76.3 | Confident | 92 Ų | 92 | 80.7 Ų | 80.7 | 47% | 0.472 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.2 | -48 | 175.4 | -68.4 | 164.7 | 0 | 0 | 0 | 109.8 | Q59 S60 N61 L65 S66 C67 | Q59-I63 HydrophobicContact CG-CD1 4.25Å; Q59-I63 VanDerWaalsContact O-CG1 3.28Å; Q59-I63 WeakPolarHBondContact O-CG1 3.36Å; Q59-I63 PolarHBondContact O-N 3.34Å; S60-I63 PolarHBondContact O-N 3.12Å; N61-I63 PolarHBondContact O-N 3.5Å; I63-L65 VanDerWaalsContact C-N 3.34Å; I63-L65 PolarHBondContact O-N 3.08Å; I63-S66 PolarHBondContact O-N 3.39Å; I63-S66 PolarHBondContact O-OG 2.8Å; I63-C67 PolarHBondContact O-N 2.88Å; I63-C67 PolarHBondContact O-SG 3.34Å; I63-C67 VanDerWaalsContact O-SG 3.42Å |
| 64 | I | 81 | Confident | 77.7 | Confident | 101 Ų | 101 | 83.4 Ų | 83.4 | 52% | 0.518 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -59.1 | -46.3 | 177.8 | -66.7 | 163.2 | 0 | 0 | 0 | 110.5 | S60 N61 S66 C67 V68 | S60-I64 VanDerWaalsContact O-CG1 3.25Å; S60-I64 WeakPolarHBondContact O-CG1 3.27Å; S60-I64 PolarHBondContact O-N 3.18Å; N61-I64 PolarHBondContact O-N 3.22Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 2.87Å; I64-C67 WeakPolarHBondContact O-CB 3.49Å; I64-C67 PolarHBondContact O-N 3.26Å; I64-C67 VanDerWaalsContact O-N 3.17Å; I64-V68 HydrophobicContact CG2-CG2 4.4Å; I64-V68 WeakPolarHBondContact O-CG2 3.47Å; I64-V68 PolarHBondContact O-N 3.49Å |
| 65 | L | 80.1 | Confident | 79.1 | Confident | 68 Ų | 68 | 86 Ų | 86 | 36% | 0.356 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.8 | -42.1 | 178.8 | -151.8 | 108.5 | 0 | 0 | 0 | 111.5 | N61 L62 I63 C67 V68 L69 | N61-L65 WeakPolarHBondContact O-CB 3.48Å; N61-L65 PolarHBondContact O-N 3.31Å; L62-L65 PolarHBondContact O-N 3.5Å; I63-L65 VanDerWaalsContact C-N 3.34Å; I63-L65 PolarHBondContact O-N 3.08Å; L65-C67 VanDerWaalsContact C-N 3.34Å; L65-C67 PolarHBondContact O-N 3.34Å; L65-V68 PolarHBondContact O-N 2.86Å; L65-L69 HydrophobicContact CD2-CD1 4Å; L65-L69 WeakPolarHBondContact O-CB 3.34Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 3.32Å |
| 66 | S | 82.8 | Confident | 80.3 | Confident | 65 Ų | 65 | 84.7 Ų | 84.7 | 46% | 0.455 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.3 | -39.6 | 176.5 | 79.9 | 0 | 0 | 0 | 0 | 112.2 | L62 I63 I64 S70 | L62-S66 WeakPolarHBondContact O-CB 3.28Å; L62-S66 PolarHBondContact O-N 3.35Å; I63-S66 PolarHBondContact O-N 3.39Å; I63-S66 PolarHBondContact O-OG 2.8Å; I64-S66 VanDerWaalsContact C-N 3.32Å; I64-S66 PolarHBondContact O-N 2.87Å; S66-S70 WeakPolarHBondContact O-CB 3.34Å; S66-S70 PolarHBondContact O-N 2.82Å |
| 67 | C | 83.6 | Confident | 81.1 | Confident | 61 Ų | 61 | 84.4 Ų | 84.4 | 41% | 0.412 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -65 | -46.1 | 175.2 | -71.7 | 0 | 0 | 0 | 0 | 111.3 | I63 I64 L65 L69 S70 I71 | I63-C67 PolarHBondContact O-N 2.88Å; I63-C67 PolarHBondContact O-SG 3.34Å; I63-C67 VanDerWaalsContact O-SG 3.42Å; I64-C67 WeakPolarHBondContact O-CB 3.49Å; I64-C67 PolarHBondContact O-N 3.26Å; I64-C67 VanDerWaalsContact O-N 3.17Å; L65-C67 VanDerWaalsContact C-N 3.34Å; L65-C67 PolarHBondContact O-N 3.34Å; C67-L69 PolarHBondContact O-N 2.83Å; C67-S70 PolarHBondContact O-N 2.84Å; C67-S70 PolarHBondContact O-OG 3.26Å; C67-I71 VanDerWaalsContact O-CG1 3.32Å; C67-I71 WeakPolarHBondContact O-CG1 3.27Å; C67-I71 PolarHBondContact O-N 3.49Å |
| 68 | V | 85.1 | Confident | 81.9 | Confident | 57 Ų | 57 | 82.9 Ų | 82.9 | 35% | 0.345 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 179.1 | 174.5 | 0 | 0 | 0 | 0 | 110.9 | I64 L65 S70 I71 G72 F191 | I64-V68 HydrophobicContact CG2-CG2 4.4Å; I64-V68 WeakPolarHBondContact O-CG2 3.47Å; I64-V68 PolarHBondContact O-N 3.49Å; L65-V68 PolarHBondContact O-N 2.86Å; V68-S70 PolarHBondContact O-N 3.49Å; V68-I71 PolarHBondContact O-N 3.45Å; V68-G72 PolarHBondContact O-N 3.31Å; V68-F191 HydrophobicContact CG1-CE1 4.36Å |
| 69 | L | 84.4 | Confident | 82.2 | Confident | 91 Ų | 91 | 85 Ų | 85 | 48% | 0.476 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.4 | -43.8 | 175.3 | -73.7 | 168.7 | 0 | 0 | 0 | 111.7 | L65 C67 I71 G72 I73 | L65-L69 HydrophobicContact CD2-CD1 4Å; L65-L69 WeakPolarHBondContact O-CB 3.34Å; L65-L69 WeakPolarHBondContact O-CG 3.46Å; L65-L69 PolarHBondContact O-N 3.32Å; C67-L69 PolarHBondContact O-N 2.83Å; L69-I71 VanDerWaalsContact C-N 3.33Å; L69-I71 PolarHBondContact O-N 2.88Å; L69-G72 PolarHBondContact O-N 2.98Å; L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.46Å; L69-I73 PolarHBondContact O-N 3.25Å |
| 70 | S | 85.5 | Confident | 82.4 | Confident | 56 Ų | 56 | 82.6 Ų | 82.6 | 39% | 0.392 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.1 | -41.9 | 178 | 77.7 | 0 | 0 | 0 | 0 | 112 | S66 C67 V68 I73 L74 | S66-S70 WeakPolarHBondContact O-CB 3.34Å; S66-S70 PolarHBondContact O-N 2.82Å; C67-S70 PolarHBondContact O-N 2.84Å; C67-S70 PolarHBondContact O-OG 3.26Å; V68-S70 PolarHBondContact O-N 3.49Å; S70-I73 PolarHBondContact O-N 3.01Å; S70-L74 WeakPolarHBondContact O-CB 3.4Å; S70-L74 VanDerWaalsContact O-CG 3.27Å; S70-L74 WeakPolarHBondContact O-CG 3.32Å; S70-L74 PolarHBondContact O-N 3.42Å |
| 71 | I | 86.9 | Confident | 82.5 | Confident | 91 Ų | 91 | 85.6 Ų | 85.6 | 47% | 0.467 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -69.1 | -41.6 | 177.9 | -66.1 | 163 | 0 | 0 | 0 | 110.4 | C67 V68 L69 I73 L74 L75 | C67-I71 VanDerWaalsContact O-CG1 3.32Å; C67-I71 WeakPolarHBondContact O-CG1 3.27Å; C67-I71 PolarHBondContact O-N 3.49Å; V68-I71 PolarHBondContact O-N 3.45Å; L69-I71 VanDerWaalsContact C-N 3.33Å; L69-I71 PolarHBondContact O-N 2.88Å; I71-I73 PolarHBondContact O-N 2.86Å; I71-L74 PolarHBondContact O-N 2.7Å; I71-L75 HydrophobicContact CG2-CD1 3.98Å; I71-L75 HydrophobicContact CG2-CG 4.29Å; I71-L75 WeakPolarHBondContact O-CB 3.46Å; I71-L75 WeakPolarHBondContact O-CG 3.47Å; I71-L75 PolarHBondContact O-N 2.96Å |
| 72 | G | 85.7 | Confident | 82.3 | Confident | 23 Ų | 23 | 90.6 Ų | 90.6 | 24% | 0.237 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -59.3 | -44.1 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | V68 L69 L75 T76 | V68-G72 PolarHBondContact O-N 3.31Å; L69-G72 PolarHBondContact O-N 2.98Å; G72-L75 PolarHBondContact O-N 2.86Å; G72-T76 WeakPolarHBondContact O-CB 3.32Å; G72-T76 PolarHBondContact O-N 3.28Å; G72-T76 PolarHBondContact O-OG1 3.42Å |
| 73 | I | 85 | Confident | 81.6 | Confident | 104 Ų | 104 | 87 Ų | 87 | 53% | 0.533 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.6 | -44.9 | 175.5 | -65.3 | 163.7 | 0 | 0 | 0 | 110.6 | L69 S70 I71 L75 T76 L77 | L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.46Å; L69-I73 PolarHBondContact O-N 3.25Å; S70-I73 PolarHBondContact O-N 3.01Å; I71-I73 PolarHBondContact O-N 2.86Å; I73-L75 PolarHBondContact O-N 3.23Å; I73-T76 PolarHBondContact O-N 3.49Å; I73-L77 HydrophobicContact CG2-CD1 3.98Å; I73-L77 HydrophobicContact CG2-CG 4.37Å; I73-L77 WeakPolarHBondContact O-CB 3.36Å; I73-L77 WeakPolarHBondContact O-CG 3.4Å; I73-L77 PolarHBondContact O-N 3.48Å |
| 74 | L | 85.5 | Confident | 80.7 | Confident | 114 Ų | 114 | 90.5 Ų | 90.5 | 60% | 0.597 | 48% | 0.476 | S | S | * | . | H | α-helix | trans | -60.9 | -42.7 | 177.6 | -75.2 | 170.1 | 0 | 0 | 0 | 112.3 | S70 I71 L77 F78 | S70-L74 WeakPolarHBondContact O-CB 3.4Å; S70-L74 VanDerWaalsContact O-CG 3.27Å; S70-L74 WeakPolarHBondContact O-CG 3.32Å; S70-L74 PolarHBondContact O-N 3.42Å; I71-L74 PolarHBondContact O-N 2.7Å; L74-L77 PolarHBondContact O-N 3.48Å; L74-F78 VanDerWaalsContact O-CB 3.28Å; L74-F78 WeakPolarHBondContact O-CB 3.27Å; L74-F78 PolarHBondContact O-N 3.23Å |
| 75 | L | 85.5 | Confident | 79.7 | Confident | 88 Ų | 88 | 93.6 Ų | 93.6 | 46% | 0.461 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.4 | -41.6 | 176.1 | -72.1 | 174.2 | 0 | 0 | 0 | 111.6 | I71 G72 I73 F78 Q79 | I71-L75 HydrophobicContact CG2-CD1 3.98Å; I71-L75 HydrophobicContact CG2-CG 4.29Å; I71-L75 WeakPolarHBondContact O-CB 3.46Å; I71-L75 WeakPolarHBondContact O-CG 3.47Å; I71-L75 PolarHBondContact O-N 2.96Å; G72-L75 PolarHBondContact O-N 2.86Å; I73-L75 PolarHBondContact O-N 3.23Å; L75-F78 WeakPolarHBondContact O-CB 3.44Å; L75-F78 PolarHBondContact O-N 3.32Å; L75-Q79 WeakPolarHBondContact O-CG 3.31Å; L75-Q79 PolarHBondContact O-N 3.45Å |
| 76 | T | 83.8 | Confident | 78.6 | Confident | 88 Ų | 88 | 99.4 Ų | 99.4 | 54% | 0.54 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.8 | -47 | 177.1 | -56 | 0 | 0 | 0 | 0 | 110.9 | G72 I73 F78 Q79 V80 | G72-T76 WeakPolarHBondContact O-CB 3.32Å; G72-T76 PolarHBondContact O-N 3.28Å; G72-T76 PolarHBondContact O-OG1 3.42Å; I73-T76 PolarHBondContact O-N 3.49Å; T76-F78 VanDerWaalsContact C-N 3.31Å; T76-F78 PolarHBondContact O-N 3.42Å; T76-Q79 PolarHBondContact O-N 2.87Å; T76-V80 WeakPolarHBondContact O-CG2 3.41Å; T76-V80 PolarHBondContact O-N 3.46Å |
| 77 | L | 82.6 | Confident | 77.5 | Confident | 97 Ų | 97 | 105.4 Ų | 105.4 | 51% | 0.508 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.1 | -40.2 | 174.1 | -72 | 173.7 | 0 | 0 | 0 | 111.7 | I73 L74 V80 M81 | I73-L77 HydrophobicContact CG2-CD1 3.98Å; I73-L77 HydrophobicContact CG2-CG 4.37Å; I73-L77 WeakPolarHBondContact O-CB 3.36Å; I73-L77 WeakPolarHBondContact O-CG 3.4Å; I73-L77 PolarHBondContact O-N 3.48Å; L74-L77 PolarHBondContact O-N 3.48Å; L77-V80 PolarHBondContact O-N 2.69Å; L77-M81 WeakPolarHBondContact O-CB 3.19Å; L77-M81 WeakPolarHBondContact O-CG 3.25Å; L77-M81 PolarHBondContact O-N 3.47Å |
| 78 | F | 82.9 | Confident | 76.3 | Confident | 107 Ų | 107 | 111.7 Ų | 111.7 | 47% | 0.469 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 176.3 | -175.6 | -100.3 | 0 | 0 | 0 | 112 | L74 L75 T76 M81 R82 | L74-F78 VanDerWaalsContact O-CB 3.28Å; L74-F78 WeakPolarHBondContact O-CB 3.27Å; L74-F78 PolarHBondContact O-N 3.23Å; L75-F78 WeakPolarHBondContact O-CB 3.44Å; L75-F78 PolarHBondContact O-N 3.32Å; T76-F78 VanDerWaalsContact C-N 3.31Å; T76-F78 PolarHBondContact O-N 3.42Å; F78-M81 PolarHBondContact O-N 3.49Å; F78-R82 VanDerWaalsContact O-CB 3.27Å; F78-R82 WeakPolarHBondContact O-CB 3.35Å; F78-R82 PolarHBondContact O-N 2.96Å |
| 79 | Q | 79 | Confident | 75 | Confident | 133 Ų | 133 | 111.5 Ų | 111.5 | 62% | 0.621 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -62.9 | -42.8 | 174.7 | -70.9 | -168.4 | 40.7 | 0 | 0 | 111.8 | L75 T76 M81 R82 G83 | L75-Q79 WeakPolarHBondContact O-CG 3.31Å; L75-Q79 PolarHBondContact O-N 3.45Å; T76-Q79 PolarHBondContact O-N 2.87Å; Q79-M81 PolarHBondContact O-N 2.76Å; Q79-R82 PolarHBondContact O-N 3.17Å; Q79-G83 PolarHBondContact O-N 2.97Å |
| 80 | V | 78.1 | Confident | 73.7 | Confident | 68 Ų | 68 | 111.2 Ų | 111.2 | 41% | 0.412 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -61.7 | -44.4 | 175.6 | 173.2 | 0 | 0 | 0 | 0 | 111 | T76 L77 G83 R84 | T76-V80 WeakPolarHBondContact O-CG2 3.41Å; T76-V80 PolarHBondContact O-N 3.46Å; L77-V80 PolarHBondContact O-N 2.69Å; V80-G83 PolarHBondContact O-N 2.92Å; V80-R84 WeakPolarHBondContact O-CB 3.28Å; V80-R84 WeakPolarHBondContact O-CG 3.38Å; V80-R84 PolarHBondContact O-N 2.93Å |
| 81 | M | 76.8 | Confident | 72.5 | Confident | 112 Ų | 112 | 117.6 Ų | 117.6 | 55% | 0.552 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.2 | -42.7 | 176.7 | -73.7 | -164.4 | -66.6 | 0 | 0 | 112.4 | L77 F78 Q79 R84 K85 | L77-M81 WeakPolarHBondContact O-CB 3.19Å; L77-M81 WeakPolarHBondContact O-CG 3.25Å; L77-M81 PolarHBondContact O-N 3.47Å; F78-M81 PolarHBondContact O-N 3.49Å; Q79-M81 PolarHBondContact O-N 2.76Å; M81-R84 PolarHBondContact O-N 3.15Å; M81-K85 PolarHBondContact O-N 3.46Å |
| 82 | R | 72.6 | Confident | 71.1 | Confident | 176 Ų | 176 | 122.8 Ų | 122.8 | 66% | 0.664 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -66.2 | -39.7 | 178.5 | -164.7 | 171.7 | 179.3 | 157.4 | -0.7 | 111.3 | F78 Q79 K85 R86 | F78-R82 VanDerWaalsContact O-CB 3.27Å; F78-R82 WeakPolarHBondContact O-CB 3.35Å; F78-R82 PolarHBondContact O-N 2.96Å; Q79-R82 PolarHBondContact O-N 3.17Å; R82-K85 PolarHBondContact O-N 3.45Å; R82-R86 PolarHBondContact O-N 3.1Å |
| 83 | G | 65.5 | Low | 69.8 | Low | 34 Ų | 34 | 128.1 Ų | 128.1 | 35% | 0.351 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.1 | -41.6 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q79 V80 R86 R87 | Q79-G83 PolarHBondContact O-N 2.97Å; V80-G83 PolarHBondContact O-N 2.92Å; G83-R86 PolarHBondContact O-N 3.28Å; G83-R87 WeakPolarHBondContact O-CG 3.36Å; G83-R87 PolarHBondContact O-N 3.42Å; G83-R87 VanDerWaalsContact O-N 3.08Å |
| 84 | R | 62 | Low | 68.5 | Low | 167 Ų | 167 | 129.7 Ų | 129.7 | 63% | 0.63 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65.3 | -39.4 | 176.6 | -76.6 | 178.4 | 177.3 | -179.5 | 0.6 | 112.6 | V80 M81 R87 R88 | V80-R84 WeakPolarHBondContact O-CB 3.28Å; V80-R84 WeakPolarHBondContact O-CG 3.38Å; V80-R84 PolarHBondContact O-N 2.93Å; M81-R84 PolarHBondContact O-N 3.15Å; R84-R87 PolarHBondContact O-N 3.33Å; R84-R88 PolarHBondContact O-N 2.93Å; R84-R88 VanDerWaalsContact O-N 3.12Å |
| 85 | K | 60.1 | Low | 67 | Low | 166 Ų | 166 | 132.1 Ų | 132.1 | 72% | 0.722 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -64.2 | -41.9 | 175.5 | -75.9 | -174.5 | 179.2 | -179.3 | 0 | 112 | M81 R82 R88 A89 | M81-K85 PolarHBondContact O-N 3.46Å; R82-K85 PolarHBondContact O-N 3.45Å; K85-R88 PolarHBondContact O-N 3.48Å; K85-A89 PolarHBondContact O-N 2.9Å; K85-A89 VanDerWaalsContact O-N 3.1Å |
| 86 | R | 58.2 | Low | 65.5 | Low | 189 Ų | 189 | 132 Ų | 132 | 71% | 0.713 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -66.3 | -39.7 | 178.3 | -158.9 | 175 | -176.1 | -174.8 | 0.6 | 112.4 | R82 G83 R88 A89 L90 | R82-R86 PolarHBondContact O-N 3.1Å; G83-R86 PolarHBondContact O-N 3.28Å; R86-R88 PolarHBondContact O-N 3.42Å; R86-A89 PolarHBondContact O-N 3.48Å; R86-L90 HydrophobicContact CG-CD1 4.28Å; R86-L90 WeakPolarHBondContact O-CG 3.33Å; R86-L90 PolarHBondContact O-N 3Å |
| 87 | R | 59 | Low | 64.2 | Low | 191 Ų | 191 | 132.2 Ų | 132.2 | 72% | 0.721 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -66.1 | -35.5 | 175.7 | -71.7 | -176.6 | -177.4 | -171.8 | 1.8 | 112.9 | G83 R84 R91 | G83-R87 WeakPolarHBondContact O-CG 3.36Å; G83-R87 PolarHBondContact O-N 3.42Å; G83-R87 VanDerWaalsContact O-N 3.08Å; R84-R87 PolarHBondContact O-N 3.33Å; R87-R91 WeakPolarHBondContact O-CG 3.36Å; R87-R91 PolarHBondContact O-N 3.32Å |
| 88 | R | 58.2 | Low | 62.6 | Low | 194 Ų | 194 | 131.5 Ų | 131.5 | 73% | 0.732 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -69.7 | -35.8 | 174.8 | -74 | -177.5 | -179.5 | 177.9 | 0.4 | 112.6 | R84 K85 R86 R92 | R84-R88 PolarHBondContact O-N 2.93Å; R84-R88 VanDerWaalsContact O-N 3.12Å; K85-R88 PolarHBondContact O-N 3.48Å; R86-R88 PolarHBondContact O-N 3.42Å; R88-R92 PolarHBondContact O-N 2.94Å |
| 89 | A | 57.6 | Low | 61.1 | Low | 53 Ų | 53 | 132.5 Ų | 132.5 | 44% | 0.438 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -70.6 | -42 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | K85 R86 R91 R92 Q93 | K85-A89 PolarHBondContact O-N 2.9Å; K85-A89 VanDerWaalsContact O-N 3.1Å; R86-A89 PolarHBondContact O-N 3.48Å; A89-R91 PolarHBondContact O-N 3.37Å; A89-R92 PolarHBondContact O-N 3.21Å; A89-R92 VanDerWaalsContact O-N 3.15Å; A89-Q93 PolarHBondContact O-N 3.5Å |
| 90 | L | 58.6 | Low | 59.8 | Low | 85 Ų | 85 | 129.8 Ų | 129.8 | 45% | 0.445 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -64 | -38.6 | 177.6 | -73 | 167.2 | 0 | 0 | 0 | 112.5 | R86 R92 Q93 Q94 | R86-L90 HydrophobicContact CG-CD1 4.28Å; R86-L90 WeakPolarHBondContact O-CG 3.33Å; R86-L90 PolarHBondContact O-N 3Å; L90-R92 VanDerWaalsContact C-N 3.3Å; L90-R92 PolarHBondContact O-N 3.42Å; L90-Q93 PolarHBondContact O-N 3.27Å; L90-Q94 PolarHBondContact O-N 3.4Å |
| 91 | R | 58.4 | Low | 58.3 | Low | 190 Ų | 190 | 132.2 Ų | 132.2 | 72% | 0.717 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -64.2 | -33 | 173.8 | -75.8 | -176.4 | 177.2 | -172.8 | -1.1 | 112.9 | R87 A89 Q95 | R87-R91 WeakPolarHBondContact O-CG 3.36Å; R87-R91 PolarHBondContact O-N 3.32Å; A89-R91 PolarHBondContact O-N 3.37Å; R91-Q95 PolarHBondContact O-N 3.5Å |
| 92 | R | 59.1 | Low | 56.7 | Low | 199 Ų | 199 | 130.2 Ų | 130.2 | 75% | 0.751 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -72.5 | -37.1 | 174.9 | -73.9 | -177.6 | 175.9 | 179.6 | -2.3 | 112.3 | R88 A89 L90 Q95 A96 | R88-R92 PolarHBondContact O-N 2.94Å; A89-R92 PolarHBondContact O-N 3.21Å; A89-R92 VanDerWaalsContact O-N 3.15Å; L90-R92 VanDerWaalsContact C-N 3.3Å; L90-R92 PolarHBondContact O-N 3.42Å; R92-Q95 PolarHBondContact O-N 3.4Å; R92-A96 PolarHBondContact O-N 2.92Å |
| 93 | Q | 57.7 | Low | 55.2 | Low | 136 Ų | 136 | 125.6 Ų | 125.6 | 64% | 0.636 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -67.6 | -39.3 | 175.5 | -88.8 | -178.7 | -26.1 | 0 | 0 | 112.7 | A89 L90 Q95 A96 S97 | A89-Q93 PolarHBondContact O-N 3.5Å; L90-Q93 PolarHBondContact O-N 3.27Å; Q93-Q95 VanDerWaalsContact C-N 3.28Å; Q93-Q95 PolarHBondContact O-N 2.94Å; Q93-A96 PolarHBondContact O-N 3.47Å; Q93-A96 VanDerWaalsContact O-N 3.16Å; Q93-S97 PolarHBondContact O-N 3.02Å; Q93-S97 PolarHBondContact O-OG 2.91Å |
| 94 | Q | 57.1 | Low | 54.5 | Low | 137 Ų | 137 | 128.7 Ų | 128.7 | 64% | 0.64 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -66.1 | -28 | 177.1 | -74.5 | 179 | -15.7 | 0 | 0 | 113.5 | L90 S97 | L90-Q94 PolarHBondContact O-N 3.4Å; Q94-S97 PolarHBondContact O-OG 2.86Å |
| 95 | Q | 54 | Low | 53.8 | Low | 164 Ų | 164 | 125.7 Ų | 125.7 | 77% | 0.766 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -78.1 | -26.1 | 173.1 | -80.9 | 179.7 | -9.3 | 0 | 0 | 113.3 | R91 R92 Q93 | R91-Q95 PolarHBondContact O-N 3.5Å; R92-Q95 PolarHBondContact O-N 3.4Å; Q93-Q95 VanDerWaalsContact C-N 3.28Å; Q93-Q95 PolarHBondContact O-N 2.94Å |
| 96 | A | 55.5 | Low | 53.5 | Low | 87 Ų | 87 | 124 Ų | 124 | 72% | 0.719 | 71% | 0.708 | S | S | * | * | H | α-helix | trans | -82.7 | -20.3 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | R92 Q93 | R92-A96 PolarHBondContact O-N 2.92Å; Q93-A96 PolarHBondContact O-N 3.47Å; Q93-A96 VanDerWaalsContact O-N 3.16Å |
| 97 | S | 55.7 | Low | 53.3 | Low | 92 Ų | 92 | 119.2 Ų | 119.2 | 64% | 0.643 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -87.7 | -2.1 | -178.9 | 53.4 | 0 | 0 | 0 | 0 | 114.9 | Q93 Q94 | Q93-S97 PolarHBondContact O-N 3.02Å; Q93-S97 PolarHBondContact O-OG 2.91Å; Q94-S97 PolarHBondContact O-OG 2.86Å |
| 98 | S | 49.6 | Very low | 52.8 | Low | 82 Ų | 82 | 120.9 Ų | 120.9 | 57% | 0.573 | 72% | 0.715 | S | S | * | * | S | Bend | trans | -96.4 | 120.8 | 170.9 | -69.2 | 0 | 0 | 0 | 0 | 109.1 | G100 | S98-G100 PolarHBondContact O-N 3.47Š|
| 99 | P | 51.3 | Low | 52.7 | Low | 127 Ų | 127 | 121 Ų | 121 | 83% | 0.825 | 72% | 0.721 | S | S | * | * | trans | -62.2 | 107.8 | 173.6 | 25.3 | -30 | 0 | 0 | 0 | 107.6 | S101 | P99-S101 VanDerWaalsContact C-N 3.26Å; P99-S101 PolarHBondContact O-N 3.46Å | ||
| 100 | G | 50.1 | Low | 52.9 | Low | 76 Ų | 76 | 123.1 Ų | 123.1 | 78% | 0.784 | 73% | 0.728 | S | S | * | * | trans | -62.4 | 90.8 | 172.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | S98 G102 | S98-G100 PolarHBondContact O-N 3.47Å; G100-G102 PolarHBondContact O-N 2.94Å | ||
| 101 | S | 46.7 | Very low | 53.3 | Low | 120 Ų | 120 | 128.4 Ų | 128.4 | 84% | 0.839 | 74% | 0.742 | S | S | * | * | trans | -46.9 | 123.6 | 160.1 | 174.5 | 0 | 0 | 0 | 0 | 107.9 | P99 | P99-S101 VanDerWaalsContact C-N 3.26Å; P99-S101 PolarHBondContact O-N 3.46Å | ||
| 102 | G | 44.1 | Very low | 53.7 | Low | 69 Ų | 69 | 126.2 Ų | 126.2 | 71% | 0.711 | 75% | 0.745 | S | S | * | * | trans | -60.2 | 165.4 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114 | G100 | G100-G102 PolarHBondContact O-N 2.94Š| ||
| 103 | G | 40.5 | Very low | 53.8 | Low | 80 Ų | 80 | 124.9 Ų | 124.9 | 83% | 0.825 | 74% | 0.741 | S | S | * | * | trans | 96.4 | 78.9 | 159.7 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 104 | A | 50.7 | Low | 54.3 | Low | 99 Ų | 99 | 123.3 Ų | 123.3 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | 168.5 | 124.3 | 126.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | |||||
| 105 | S | 48.4 | Very low | 54.8 | Low | 104 Ų | 104 | 119.5 Ų | 119.5 | 73% | 0.727 | 74% | 0.74 | S | S | * | * | trans | -42.2 | 142.4 | 167.9 | -174.4 | 0 | 0 | 0 | 0 | 111.7 | A107 | S105-A107 PolarHBondContact O-N 2.92Š| ||
| 106 | P | 52.2 | Low | 55.4 | Low | 129 Ų | 129 | 116.4 Ų | 116.4 | 84% | 0.838 | 74% | 0.735 | S | S | * | * | trans | -73.8 | 71 | 179 | 32.3 | -33.3 | 0 | 0 | 0 | 110 | R108 | P106-R108 PolarHBondContact O-N 2.99Å; P106-R108 VanDerWaalsContact O-N 3.13Å | ||
| 107 | A | 54 | Low | 55.7 | Low | 89 Ų | 89 | 117.1 Ų | 117.1 | 74% | 0.736 | 73% | 0.732 | S | S | * | * | trans | -70.9 | 103.5 | 162.9 | 0 | 0 | 0 | 0 | 0 | 107.2 | S105 K109 | S105-A107 PolarHBondContact O-N 2.92Å; A107-K109 PolarHBondContact O-N 3.03Å | ||
| 108 | R | 48.9 | Very low | 55.7 | Low | 226 Ų | 226 | 116.9 Ų | 116.9 | 85% | 0.853 | 73% | 0.73 | S | S | * | * | trans | 20.1 | 99 | 157.5 | -70.9 | 179 | 172.3 | -149.4 | -2.1 | 114.8 | P106 V110 | P106-R108 PolarHBondContact O-N 2.99Å; P106-R108 VanDerWaalsContact O-N 3.13Å; R108-V110 HydrophobicContact CB-CG2 4.2Å; R108-V110 PolarHBondContact O-N 3.41Å | ||
| 109 | K | 56.1 | Low | 56 | Low | 196 Ų | 196 | 123 Ų | 123 | 85% | 0.852 | 75% | 0.746 | S | S | * | * | trans | -64.8 | 84.5 | 151.4 | -120.3 | -179.6 | -178.9 | -178.1 | 0 | 107 | A107 W111 | A107-K109 PolarHBondContact O-N 3.03Å; K109-W111 PolarHBondContact O-N 3.36Å | ||
| 110 | V | 61.7 | Low | 56.1 | Low | 99 Ų | 99 | 126.5 Ų | 126.5 | 60% | 0.6 | 75% | 0.749 | S | S | * | * | trans | -63.7 | 112.9 | 159.8 | 178.7 | 0 | 0 | 0 | 0 | 104.1 | R108 D112 | R108-V110 HydrophobicContact CB-CG2 4.2Å; R108-V110 PolarHBondContact O-N 3.41Å; V110-D112 PolarHBondContact O-N 3.27Å; V110-D112 VanDerWaalsContact O-N 3.08Å | ||
| 111 | W | 67.4 | Low | 56.4 | Low | 195 Ų | 195 | 131.4 Ų | 131.4 | 74% | 0.739 | 75% | 0.751 | S | S | * | * | trans | -70.3 | 103.1 | 169.1 | -151.2 | -84.6 | 0 | 0 | 0 | 104.7 | K109 Y113 | K109-W111 PolarHBondContact O-N 3.36Å; W111-Y113 PolarHBondContact O-N 3.16Å | ||
| 112 | D | 67.9 | Low | 56.6 | Low | 145 Ų | 145 | 131 Ų | 131 | 78% | 0.775 | 74% | 0.744 | S | S | * | * | trans | -64.7 | 82.1 | 164.1 | -70.2 | -36.2 | 0 | 0 | 0 | 106 | V110 P114 | V110-D112 PolarHBondContact O-N 3.27Å; V110-D112 VanDerWaalsContact O-N 3.08Å; D112-P114 VanDerWaalsContact O-CD 3.27Å; D112-P114 WeakPolarHBondContact O-CD 3.44Å | ||
| 113 | Y | 61.2 | Low | 57 | Low | 171 Ų | 171 | 134.7 Ų | 134.7 | 67% | 0.671 | 75% | 0.746 | S | S | * | * | trans | -67 | 115.4 | 176.1 | -165.3 | -93.7 | 0 | 0 | 0 | 105.7 | W111 G115 | W111-Y113 PolarHBondContact O-N 3.16Å; Y113-G115 PolarHBondContact O-N 2.74Å | ||
| 114 | P | 67.9 | Low | 57.6 | Low | 103 Ų | 103 | 138.8 Ų | 138.8 | 67% | 0.669 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 121.5 | 168.8 | 25.6 | -30.8 | 0 | 0 | 0 | 105.5 | D112 | D112-P114 VanDerWaalsContact O-CD 3.27Å; D112-P114 WeakPolarHBondContact O-CD 3.44Å |
| 115 | G | 67.8 | Low | 57.7 | Low | 57 Ų | 57 | 139.4 Ų | 139.4 | 59% | 0.588 | 74% | 0.742 | S | S | * | * | P | Polyproline II helix | trans | -47.3 | 150.4 | -174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y113 | Y113-G115 PolarHBondContact O-N 2.74Š|
| 116 | P | 66.4 | Low | 58 | Low | 99 Ų | 99 | 138.8 Ų | 138.8 | 64% | 0.643 | 74% | 0.736 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 133 | -179.1 | 21.1 | -31.9 | 0 | 0 | 0 | 109.1 | S118 | P116-S118 PolarHBondContact O-N 3.42Š|
| 117 | P | 61.2 | Low | 58 | Low | 102 Ų | 102 | 136 Ų | 136 | 66% | 0.662 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 124.5 | -180 | 21.2 | -31.4 | 0 | 0 | 0 | 107.6 | F119 | P117-F119 PolarHBondContact O-N 3.48Š|
| 118 | S | 56.3 | Low | 58.1 | Low | 86 Ų | 86 | 136.6 Ų | 136.6 | 60% | 0.601 | 72% | 0.718 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 135.7 | -179.1 | 76.5 | 0 | 0 | 0 | 0 | 108.2 | P116 K120 | P116-S118 PolarHBondContact O-N 3.42Å; S118-K120 PolarHBondContact O-N 3.21Å |
| 119 | F | 54.4 | Low | 58.5 | Low | 210 Ų | 210 | 129.3 Ų | 129.3 | 92% | 0.921 | 70% | 0.702 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61 | 18.9 | -175.7 | -82.9 | -90.7 | 0 | 0 | 0 | 115.1 | P117 | P117-F119 PolarHBondContact O-N 3.48Š|
| 120 | K | 54.7 | Low | 58.3 | Low | 201 Ų | 201 | 125.8 Ų | 125.8 | 87% | 0.874 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101 | 1 | 179.5 | -81.7 | -172.7 | 172.2 | -174.8 | 0 | 114.9 | S118 | S118-K120 PolarHBondContact O-N 3.21Š|
| 121 | E | 55.4 | Low | 57.9 | Low | 179 Ų | 179 | 123.6 Ų | 123.6 | 84% | 0.836 | 68% | 0.681 | S | S | * | * | S | Bend | trans | -130.2 | 16.9 | -175.1 | -140.9 | 171.4 | -158 | 0 | 0 | 115.3 | ||
| 122 | V | 51 | Low | 57.3 | Low | 113 Ų | 113 | 121.4 Ų | 121.4 | 69% | 0.685 | 68% | 0.679 | S | S | * | * | trans | -127.1 | 63.1 | -177.2 | -160.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 123 | I | 52.5 | Low | 56.9 | Low | 145 Ų | 145 | 120.3 Ų | 120.3 | 74% | 0.744 | 67% | 0.672 | S | S | * | * | trans | -140.4 | 62 | 158.8 | -43.7 | 175 | 0 | 0 | 0 | 109 | V125 | I123-V125 HydrophobicContact CG2-CG2 4.04Š| ||
| 124 | N | 53.9 | Low | 56.8 | Low | 166 Ų | 166 | 117 Ų | 117 | 89% | 0.888 | 67% | 0.666 | S | S | * | * | trans | -103.9 | 68.8 | 145.5 | -83.8 | -7.4 | 0 | 0 | 0 | 106.2 | P126 | N124-P126 WeakPolarHBondContact O-CD 3.39Š| ||
| 125 | V | 53 | Low | 56.4 | Low | 112 Ų | 112 | 117.6 Ų | 117.6 | 68% | 0.679 | 66% | 0.663 | S | S | * | * | P | Polyproline II helix | trans | -66.4 | 119.6 | 165.4 | 178.6 | 0 | 0 | 0 | 0 | 105.3 | I123 S127 | I123-V125 HydrophobicContact CG2-CG2 4.04Å; V125-S127 PolarHBondContact O-N 3.48Å; V125-S127 VanDerWaalsContact O-N 3.09Å |
| 126 | P | 55 | Low | 56.1 | Low | 92 Ų | 92 | 117 Ų | 117 | 60% | 0.597 | 66% | 0.657 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 122.2 | 171.5 | -14.6 | 27.1 | 0 | 0 | 0 | 106.8 | N124 S128 | N124-P126 WeakPolarHBondContact O-CD 3.39Å; P126-S128 PolarHBondContact O-N 3.49Å |
| 127 | S | 52.4 | Low | 56.3 | Low | 71 Ų | 71 | 119.1 Ų | 119.1 | 50% | 0.497 | 66% | 0.658 | S | S | . | * | P | Polyproline II helix | trans | -46.3 | 134.4 | 172.9 | 173.4 | 0 | 0 | 0 | 0 | 108.5 | V125 S129 Q130 | V125-S127 PolarHBondContact O-N 3.48Å; V125-S127 VanDerWaalsContact O-N 3.09Å; S127-S129 WeakPolarHBondContact CB-OG 3.39Å; S127-S129 PolarHBondContact O-N 3.13Å; S127-S129 PolarHBondContact OG-OG 3.34Å; S127-Q130 PolarHBondContact O-N 3.46Å |
| 128 | S | 55.9 | Low | 56.6 | Low | 101 Ų | 101 | 120.2 Ų | 120.2 | 71% | 0.706 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -52.2 | -14 | 179.6 | 45.9 | 0 | 0 | 0 | 0 | 114.1 | P126 Q130 | P126-S128 PolarHBondContact O-N 3.49Å; S128-Q130 VanDerWaalsContact C-N 3.33Å |
| 129 | S | 57.4 | Low | 57.3 | Low | 73 Ų | 73 | 121.4 Ų | 121.4 | 51% | 0.51 | 66% | 0.658 | S | S | . | * | H | α-helix | trans | -74 | -11.5 | 172.3 | 57.8 | 0 | 0 | 0 | 0 | 115.6 | S127 | S127-S129 WeakPolarHBondContact CB-OG 3.39Å; S127-S129 PolarHBondContact O-N 3.13Å; S127-S129 PolarHBondContact OG-OG 3.34Å |
| 130 | Q | 51.2 | Low | 58.3 | Low | 122 Ų | 122 | 114.2 Ų | 114.2 | 57% | 0.57 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -96 | -26.7 | 177.5 | -152.8 | 165.5 | -0.8 | 0 | 0 | 112.1 | S127 S128 E132 N133 D134 | S127-Q130 PolarHBondContact O-N 3.46Å; S128-Q130 VanDerWaalsContact C-N 3.33Å; Q130-E132 PolarHBondContact O-N 3.15Å; Q130-N133 PolarHBondContact O-N 3.42Å; Q130-D134 PolarHBondContact O-N 3.49Å |
| 131 | A | 52.3 | Low | 59.3 | Low | 53 Ų | 53 | 109.5 Ų | 109.5 | 44% | 0.438 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -69.4 | -29.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | I135 | A131-I135 VanDerWaalsContact O-CD1 3.31Å; A131-I135 WeakPolarHBondContact O-CD1 3.43Å; A131-I135 WeakPolarHBondContact O-CG1 3.31Å; A131-I135 PolarHBondContact O-N 3.25Å; A131-I135 VanDerWaalsContact O-N 3.15Å |
| 132 | E | 55.6 | Low | 60 | Low | 149 Ų | 149 | 103.1 Ų | 103.1 | 70% | 0.696 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71.6 | -31.9 | 177.9 | -74.5 | -176.9 | 155.6 | 0 | 0 | 113 | Q130 G136 | Q130-E132 PolarHBondContact O-N 3.15Å; E132-G136 PolarHBondContact O-N 3.42Å |
| 133 | N | 58.6 | Low | 61.1 | Low | 121 Ų | 121 | 101 Ų | 101 | 65% | 0.647 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -70.9 | -40 | 174.6 | -82.8 | -24.3 | 0 | 0 | 0 | 111.8 | Q130 I135 G136 E137 | Q130-N133 PolarHBondContact O-N 3.42Å; N133-I135 VanDerWaalsContact C-N 3.34Å; N133-I135 PolarHBondContact O-N 3.37Å; N133-G136 PolarHBondContact O-N 3.3Å; N133-E137 PolarHBondContact O-N 3.04Å; N133-E137 VanDerWaalsContact O-N 3.1Å |
| 134 | D | 60.2 | Low | 62.2 | Low | 101 Ų | 101 | 98.5 Ų | 98.5 | 54% | 0.54 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69.9 | -30.9 | 179.2 | -71.9 | -5.6 | 0 | 0 | 0 | 112.1 | Q130 L138 | Q130-D134 PolarHBondContact O-N 3.49Å; D134-L138 WeakPolarHBondContact O-CB 3.37Å; D134-L138 PolarHBondContact O-N 3.27Å |
| 135 | I | 58.6 | Low | 63.2 | Low | 116 Ų | 116 | 94.5 Ų | 94.5 | 60% | 0.595 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -69.5 | -37.2 | 174.4 | -68.6 | 163.1 | 0 | 0 | 0 | 111 | A131 N133 N139 | A131-I135 VanDerWaalsContact O-CD1 3.31Å; A131-I135 WeakPolarHBondContact O-CD1 3.43Å; A131-I135 WeakPolarHBondContact O-CG1 3.31Å; A131-I135 PolarHBondContact O-N 3.25Å; A131-I135 VanDerWaalsContact O-N 3.15Å; N133-I135 VanDerWaalsContact C-N 3.34Å; N133-I135 PolarHBondContact O-N 3.37Å; I135-N139 VanDerWaalsContact O-CB 3.31Å; I135-N139 WeakPolarHBondContact O-CB 3.45Å; I135-N139 PolarHBondContact O-N 3.24Å |
| 136 | G | 62.9 | Low | 64.4 | Low | 45 Ų | 45 | 93.8 Ų | 93.8 | 46% | 0.464 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -64.2 | -44.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | E132 N133 N139 A140 | E132-G136 PolarHBondContact O-N 3.42Å; N133-G136 PolarHBondContact O-N 3.3Å; G136-N139 PolarHBondContact O-N 3.28Å; G136-A140 WeakPolarHBondContact O-CB 3.29Å; G136-A140 PolarHBondContact O-N 2.89Å |
| 137 | E | 69.3 | Low | 65.3 | Low | 143 Ų | 143 | 93.9 Ų | 93.9 | 67% | 0.668 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -66.6 | -40.2 | 175.7 | -81.2 | -169.9 | 165.1 | 0 | 0 | 112.5 | N133 N139 A140 L141 | N133-E137 PolarHBondContact O-N 3.04Å; N133-E137 VanDerWaalsContact O-N 3.1Å; E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.49Å; E137-A140 PolarHBondContact O-N 3.35Å; E137-L141 WeakPolarHBondContact O-CB 3.35Å; E137-L141 PolarHBondContact O-N 3.05Å |
| 138 | L | 67.4 | Low | 66 | Low | 125 Ų | 125 | 97.7 Ų | 97.7 | 65% | 0.654 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -66.4 | -38 | 178.3 | -150.7 | 86.6 | 0 | 0 | 0 | 111.6 | D134 L141 A142 | D134-L138 WeakPolarHBondContact O-CB 3.37Å; D134-L138 PolarHBondContact O-N 3.27Å; L138-L141 PolarHBondContact O-N 3.35Å; L138-A142 WeakPolarHBondContact O-CB 3.39Å; L138-A142 PolarHBondContact O-N 2.83Å |
| 139 | N | 72.1 | Confident | 66.5 | Low | 112 Ų | 112 | 97.6 Ų | 97.6 | 60% | 0.599 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.9 | -38.4 | 178.8 | -156.7 | 21.8 | 0 | 0 | 0 | 111.5 | I135 G136 E137 A142 T143 | I135-N139 VanDerWaalsContact O-CB 3.31Å; I135-N139 WeakPolarHBondContact O-CB 3.45Å; I135-N139 PolarHBondContact O-N 3.24Å; G136-N139 PolarHBondContact O-N 3.28Å; E137-N139 VanDerWaalsContact C-N 3.33Å; E137-N139 PolarHBondContact O-N 3.49Å; N139-A142 PolarHBondContact O-N 3.48Å; N139-T143 PolarHBondContact O-N 3.21Å; N139-T143 PolarHBondContact O-OG1 3.32Å |
| 140 | A | 75.4 | Confident | 66.7 | Low | 59 Ų | 59 | 98.1 Ų | 98.1 | 49% | 0.488 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | G136 E137 T143 E144 | G136-A140 WeakPolarHBondContact O-CB 3.29Å; G136-A140 PolarHBondContact O-N 2.89Å; E137-A140 PolarHBondContact O-N 3.35Å; A140-T143 WeakPolarHBondContact CA-OG1 3.34Å; A140-T143 PolarHBondContact O-N 3.18Å; A140-T143 PolarHBondContact O-OG1 2.91Å; A140-E144 PolarHBondContact O-N 2.91Å |
| 141 | L | 74.6 | Confident | 67.3 | Low | 101 Ų | 101 | 98.5 Ų | 98.5 | 53% | 0.529 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.7 | -42.5 | 175.6 | -170.3 | 73.6 | 0 | 0 | 0 | 111.4 | E137 L138 E144 V145 | E137-L141 WeakPolarHBondContact O-CB 3.35Å; E137-L141 PolarHBondContact O-N 3.05Å; L138-L141 PolarHBondContact O-N 3.35Å; L141-E144 PolarHBondContact O-N 2.95Å; L141-V145 VanDerWaalsContact O-CG2 3.32Å; L141-V145 WeakPolarHBondContact O-CG2 3.26Å; L141-V145 PolarHBondContact O-N 3.41Å |
| 142 | A | 71.4 | Confident | 67.8 | Low | 45 Ų | 45 | 101.3 Ų | 101.3 | 37% | 0.372 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63.1 | -42.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | L138 N139 V145 I146 | L138-A142 WeakPolarHBondContact O-CB 3.39Å; L138-A142 PolarHBondContact O-N 2.83Å; N139-A142 PolarHBondContact O-N 3.48Å; A142-V145 PolarHBondContact O-N 3.29Å; A142-I146 WeakPolarHBondContact O-CD1 3.41Å; A142-I146 VanDerWaalsContact O-CG1 3.27Å; A142-I146 WeakPolarHBondContact O-CG1 3.39Å; A142-I146 PolarHBondContact O-N 3.44Å |
| 143 | T | 73.8 | Confident | 67.8 | Low | 69 Ų | 69 | 100.9 Ų | 100.9 | 42% | 0.423 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.2 | -34.8 | 176.1 | 23.9 | 0 | 0 | 0 | 0 | 112.7 | N139 A140 I146 N147 | N139-T143 PolarHBondContact O-N 3.21Å; N139-T143 PolarHBondContact O-OG1 3.32Å; A140-T143 WeakPolarHBondContact CA-OG1 3.34Å; A140-T143 PolarHBondContact O-N 3.18Å; A140-T143 PolarHBondContact O-OG1 2.91Å; T143-I146 PolarHBondContact O-N 3.47Å; T143-N147 WeakPolarHBondContact O-CB 3.45Å; T143-N147 PolarHBondContact O-N 3.38Å; T143-N147 PolarHBondContact O-ND2 3.04Å |
| 144 | E | 75.5 | Confident | 67.6 | Low | 93 Ų | 93 | 101 Ų | 101 | 44% | 0.435 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.1 | -42.7 | 173.2 | -167.3 | -169 | 155.5 | 0 | 0 | 111.7 | A140 L141 N147 R148 | A140-E144 PolarHBondContact O-N 2.91Å; L141-E144 PolarHBondContact O-N 2.95Å; E144-N147 PolarHBondContact O-N 3.01Å; E144-R148 PolarHBondContact O-N 3.48Å; E144-R148 IonicContact OE1-CZ 3.95Å; E144-R148 IonicContact OE1-NE 3.43Å; E144-R148 PolarHBondContact OE1-NE 3.02Å; E144-R148 IonicContact OE1-NH2 2.73Å; E144-R148 PolarHBondContact OE1-NH2 3.34Å |
| 145 | V | 75.7 | Confident | 67 | Low | 82 Ų | 82 | 106 Ų | 106 | 50% | 0.497 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 178.1 | 172.7 | 0 | 0 | 0 | 0 | 111 | L141 A142 R148 E149 | L141-V145 VanDerWaalsContact O-CG2 3.32Å; L141-V145 WeakPolarHBondContact O-CG2 3.26Å; L141-V145 PolarHBondContact O-N 3.41Å; A142-V145 PolarHBondContact O-N 3.29Å; V145-R148 PolarHBondContact O-N 3.39Å; V145-E149 WeakPolarHBondContact O-CG 3.37Å; V145-E149 PolarHBondContact O-N 2.94Å |
| 146 | I | 76.4 | Confident | 66.5 | Low | 97 Ų | 97 | 106.7 Ų | 106.7 | 50% | 0.497 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.5 | -45.7 | 176.6 | -68.3 | 163.9 | 0 | 0 | 0 | 110.8 | A142 T143 R148 E149 L150 | A142-I146 WeakPolarHBondContact O-CD1 3.41Å; A142-I146 VanDerWaalsContact O-CG1 3.27Å; A142-I146 WeakPolarHBondContact O-CG1 3.39Å; A142-I146 PolarHBondContact O-N 3.44Å; T143-I146 PolarHBondContact O-N 3.47Å; I146-R148 VanDerWaalsContact C-N 3.33Å; I146-R148 PolarHBondContact O-N 2.94Å; I146-E149 PolarHBondContact O-N 3.27Å; I146-L150 HydrophobicContact CG2-CD1 3.86Å; I146-L150 HydrophobicContact CG2-CG 4.42Å; I146-L150 WeakPolarHBondContact O-CG 3.42Å; I146-L150 PolarHBondContact O-N 3.41Å |
| 147 | N | 74.3 | Confident | 65.8 | Low | 93 Ų | 93 | 113.1 Ų | 113.1 | 50% | 0.497 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -64.4 | -36.5 | 178.1 | -76.4 | -21.6 | 0 | 0 | 0 | 112.3 | T143 E144 L151 | T143-N147 WeakPolarHBondContact O-CB 3.45Å; T143-N147 PolarHBondContact O-N 3.38Å; T143-N147 PolarHBondContact O-ND2 3.04Å; E144-N147 PolarHBondContact O-N 3.01Å; N147-L151 WeakPolarHBondContact O-CB 3.46Å; N147-L151 WeakPolarHBondContact O-CD1 3.46Å; N147-L151 PolarHBondContact O-N 2.97Å |
| 148 | R | 67.6 | Low | 64.6 | Low | 152 Ų | 152 | 110.7 Ų | 110.7 | 57% | 0.574 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.6 | -37.7 | 174.5 | -82.9 | -170.5 | -171.6 | -158.6 | 6.6 | 113 | E144 V145 I146 K152 | E144-R148 PolarHBondContact O-N 3.48Å; E144-R148 IonicContact OE1-CZ 3.95Å; E144-R148 IonicContact OE1-NE 3.43Å; E144-R148 PolarHBondContact OE1-NE 3.02Å; E144-R148 IonicContact OE1-NH2 2.73Å; E144-R148 PolarHBondContact OE1-NH2 3.34Å; V145-R148 PolarHBondContact O-N 3.39Å; I146-R148 VanDerWaalsContact C-N 3.33Å; I146-R148 PolarHBondContact O-N 2.94Å; R148-K152 WeakPolarHBondContact O-CG 3.27Å; R148-K152 PolarHBondContact O-N 2.85Å |
| 149 | E | 66 | Low | 63.5 | Low | 99 Ų | 99 | 111.9 Ų | 111.9 | 46% | 0.463 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -73 | -39.8 | 177.8 | -68.4 | -57 | 137.8 | 0 | 0 | 111.3 | V145 I146 L151 K152 E153 | V145-E149 WeakPolarHBondContact O-CG 3.37Å; V145-E149 PolarHBondContact O-N 2.94Å; I146-E149 PolarHBondContact O-N 3.27Å; E149-L151 VanDerWaalsContact C-N 3.3Å; E149-L151 PolarHBondContact O-N 2.67Å; E149-K152 PolarHBondContact O-N 3.43Å; E149-K152 VanDerWaalsContact O-N 3.09Å; E149-K152 IonicContact OE1-NZ 3.22Å; E149-K152 PolarHBondContact OE1-NZ 2.99Å; E149-K152 IonicContact OE2-NZ 2.89Å; E149-E153 PolarHBondContact O-N 3.05Å |
| 150 | L | 63 | Low | 62.2 | Low | 84 Ų | 84 | 111.4 Ų | 111.4 | 44% | 0.44 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63 | -32.7 | 173.8 | -73.2 | 170.5 | 0 | 0 | 0 | 113.5 | I146 N154 | I146-L150 HydrophobicContact CG2-CD1 3.86Å; I146-L150 HydrophobicContact CG2-CG 4.42Å; I146-L150 WeakPolarHBondContact O-CG 3.42Å; I146-L150 PolarHBondContact O-N 3.41Å; L150-N154 PolarHBondContact O-N 3.34Å; L150-N154 PolarHBondContact O-ND2 2.93Å |
| 151 | L | 63.4 | Low | 60.7 | Low | 129 Ų | 129 | 113.9 Ų | 113.9 | 68% | 0.675 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -74.5 | -25.9 | 174.4 | -90.4 | 155.4 | 0 | 0 | 0 | 113.3 | N147 E149 | N147-L151 WeakPolarHBondContact O-CB 3.46Å; N147-L151 WeakPolarHBondContact O-CD1 3.46Å; N147-L151 PolarHBondContact O-N 2.97Å; E149-L151 VanDerWaalsContact C-N 3.3Å; E149-L151 PolarHBondContact O-N 2.67Å |
| 152 | K | 61.4 | Low | 59 | Low | 113 Ų | 113 | 118 Ų | 118 | 49% | 0.491 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -77.4 | -36.9 | 173.7 | -73 | 172.1 | -170.3 | 169.3 | 0 | 111.4 | R148 E149 R155 | R148-K152 WeakPolarHBondContact O-CG 3.27Å; R148-K152 PolarHBondContact O-N 2.85Å; E149-K152 PolarHBondContact O-N 3.43Å; E149-K152 VanDerWaalsContact O-N 3.09Å; E149-K152 IonicContact OE1-NZ 3.22Å; E149-K152 PolarHBondContact OE1-NZ 2.99Å; E149-K152 IonicContact OE2-NZ 2.89Å; K152-R155 PolarHBondContact O-N 3.3Å |
| 153 | E | 55.8 | Low | 57.5 | Low | 139 Ų | 139 | 120.6 Ų | 120.6 | 65% | 0.65 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.4 | -40.2 | 179.5 | -158.9 | 164.9 | -158.8 | 0 | 0 | 111.6 | E149 R155 I156 | E149-E153 PolarHBondContact O-N 3.05Å; E153-R155 PolarHBondContact O-N 3.39Å; E153-R155 VanDerWaalsContact O-N 3.16Å; E153-I156 PolarHBondContact O-N 3.44Å |
| 154 | N | 54.1 | Low | 56 | Low | 124 Ų | 124 | 122.5 Ų | 122.5 | 66% | 0.663 | 64% | 0.638 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.8 | -7.3 | 174 | -82.5 | -62 | 0 | 0 | 0 | 115.1 | L150 | L150-N154 PolarHBondContact O-N 3.34Å; L150-N154 PolarHBondContact O-ND2 2.93Å |
| 155 | R | 48.9 | Very low | 54.3 | Low | 205 Ų | 205 | 127.8 Ų | 127.8 | 77% | 0.774 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -6 | 179.4 | -142.7 | -179.6 | -172.4 | -169.3 | 2.6 | 113.4 | K152 E153 | K152-R155 PolarHBondContact O-N 3.3Å; E153-R155 PolarHBondContact O-N 3.39Å; E153-R155 VanDerWaalsContact O-N 3.16Å |
| 156 | I | 47.9 | Very low | 52.9 | Low | 131 Ų | 131 | 132.7 Ų | 132.7 | 67% | 0.672 | 67% | 0.67 | S | S | * | * | S | Bend | trans | -93.3 | -13.9 | -173.1 | -60.3 | 174.3 | 0 | 0 | 0 | 112.4 | E153 A158 | E153-I156 PolarHBondContact O-N 3.44Å; I156-A158 VanDerWaalsContact C-N 3.26Å; I156-A158 PolarHBondContact O-N 3.42Å |
| 157 | E | 48.7 | Very low | 51.4 | Low | 181 Ų | 181 | 137 Ų | 137 | 85% | 0.846 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.3 | 0.2 | 178.3 | -67.8 | -167.1 | 156.4 | 0 | 0 | 115 | ||
| 158 | A | 43.2 | Very low | 50 | Low | 91 Ų | 91 | 141.6 Ų | 141.6 | 75% | 0.752 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -109.9 | 4.9 | -175 | 0 | 0 | 0 | 0 | 0 | 116.1 | I156 S160 | I156-A158 VanDerWaalsContact C-N 3.26Å; I156-A158 PolarHBondContact O-N 3.42Å; A158-S160 PolarHBondContact O-N 3Å |
| 159 | L | 44.9 | Very low | 49 | Very low | 150 Ų | 150 | 140.3 Ų | 140.3 | 79% | 0.785 | 72% | 0.715 | S | S | * | * | trans | -100.8 | 90.2 | -179.8 | -84.1 | 110.7 | 0 | 0 | 0 | 113 | ||||
| 160 | S | 43.5 | Very low | 48.3 | Very low | 102 Ų | 102 | 139.7 Ų | 139.7 | 71% | 0.713 | 73% | 0.726 | S | S | * | * | trans | -47.3 | 129.1 | 165.5 | 179.8 | 0 | 0 | 0 | 0 | 112.7 | A158 Q162 | A158-S160 PolarHBondContact O-N 3Å; S160-Q162 PolarHBondContact O-N 3.47Å; S160-Q162 VanDerWaalsContact O-N 3.16Å | ||
| 161 | P | 43.7 | Very low | 47.6 | Very low | 112 Ų | 112 | 141.5 Ų | 141.5 | 73% | 0.727 | 74% | 0.744 | S | S | * | * | trans | -83.8 | 92.7 | 179.8 | 32 | -30 | 0 | 0 | 0 | 110.4 | V163 | P161-V163 PolarHBondContact O-N 2.99Š| ||
| 162 | Q | 39.9 | Very low | 47 | Very low | 186 Ų | 186 | 141.2 Ų | 141.2 | 87% | 0.869 | 75% | 0.747 | S | S | * | * | trans | -77 | 100.6 | 159.2 | -88.5 | -153.2 | 10.9 | 0 | 0 | 109.7 | S160 S164 | S160-Q162 PolarHBondContact O-N 3.47Å; S160-Q162 VanDerWaalsContact O-N 3.16Å; Q162-S164 PolarHBondContact O-N 3.44Å | ||
| 163 | V | 39.6 | Very low | 46.1 | Very low | 100 Ų | 100 | 142.8 Ų | 142.8 | 61% | 0.606 | 77% | 0.767 | S | S | * | * | trans | -75.2 | 111.4 | 170.4 | -174.2 | 0 | 0 | 0 | 0 | 108.7 | P161 Y165 | P161-V163 PolarHBondContact O-N 2.99Å; V163-Y165 HydrophobicContact CB-CE2 4.33Å; V163-Y165 HydrophobicContact CG1-CD2 3.78Å; V163-Y165 HydrophobicContact CG1-CE1 4.15Å; V163-Y165 HydrophobicContact CG1-CE2 3.27Å; V163-Y165 HydrophobicContact CG1-CG 4.4Å; V163-Y165 VanDerWaalsContact CG1-CZ 3.48Å | ||
| 164 | S | 42.8 | Very low | 45.5 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 77% | 0.769 | 77% | 0.772 | S | S | * | * | trans | -112.8 | 108.5 | 168 | -174.5 | 0 | 0 | 0 | 0 | 109.3 | Q162 | Q162-S164 PolarHBondContact O-N 3.44Š| ||
| 165 | Y | 39.3 | Very low | 44.9 | Very low | 203 Ų | 203 | 138.6 Ų | 138.6 | 80% | 0.796 | 76% | 0.764 | S | S | * | * | trans | -80.8 | 110.2 | 174.8 | -64 | -87.7 | 0 | 0 | 0 | 109.6 | V163 | V163-Y165 HydrophobicContact CB-CE2 4.33Å; V163-Y165 HydrophobicContact CG1-CD2 3.78Å; V163-Y165 HydrophobicContact CG1-CE1 4.15Å; V163-Y165 HydrophobicContact CG1-CE2 3.27Å; V163-Y165 HydrophobicContact CG1-CG 4.4Å; V163-Y165 VanDerWaalsContact CG1-CZ 3.48Å | ||
| 166 | K | 46.5 | Very low | 44.6 | Very low | 186 Ų | 186 | 137 Ų | 137 | 81% | 0.809 | 77% | 0.767 | S | S | * | * | trans | -147 | 105.1 | 154.4 | -82.3 | -151 | 175.6 | -170.5 | 0 | 112.5 | ||||
| 167 | E | 45 | Very low | 44.2 | Very low | 186 Ų | 186 | 141.2 Ų | 141.2 | 87% | 0.869 | 78% | 0.776 | S | S | * | * | 69.9 | 127.3 | 126.6 | -136.2 | 166 | 178.3 | 0 | 0 | 121.1 | |||||
| 168 | K | 45.4 | Very low | 44.1 | Very low | 190 Ų | 190 | 136.9 Ų | 136.9 | 83% | 0.826 | 76% | 0.762 | S | S | * | * | trans | -75.6 | 161.9 | -174.7 | -123.2 | 172.8 | -175.7 | 176.1 | 0 | 112.3 | ||||
| 169 | P | 46 | Very low | 44.1 | Very low | 125 Ų | 125 | 137.9 Ų | 137.9 | 81% | 0.812 | 75% | 0.751 | S | S | * | * | -145 | 147.3 | 98.3 | 31.6 | -12.8 | 0 | 0 | 0 | 117.7 | |||||
| 170 | A | 50.1 | Low | 44.2 | Very low | 86 Ų | 86 | 135.2 Ų | 135.2 | 71% | 0.711 | 74% | 0.741 | S | S | * | * | trans | 37.6 | 127.8 | 152.5 | 0 | 0 | 0 | 0 | 0 | 123.4 | ||||
| 171 | P | 49.8 | Very low | 44.3 | Very low | 123 Ų | 123 | 133.3 Ų | 133.3 | 80% | 0.799 | 73% | 0.732 | S | S | * | * | trans | -98.8 | 126 | 175.5 | 36.1 | -27.1 | 0 | 0 | 0 | 113.5 | T173 | P171-T173 PolarHBondContact O-N 3.4Š| ||
| 172 | T | 50.7 | Low | 44.3 | Very low | 123 Ų | 123 | 135.6 Ų | 135.6 | 76% | 0.755 | 73% | 0.727 | S | S | * | * | trans | -81.1 | 98.4 | 167.6 | 13.2 | 0 | 0 | 0 | 0 | 110.9 | A174 | T172-A174 VanDerWaalsContact C-N 3.28Å; T172-A174 PolarHBondContact O-N 2.95Å | ||
| 173 | T | 42.3 | Very low | 44.6 | Very low | 146 Ų | 146 | 135.2 Ų | 135.2 | 90% | 0.896 | 72% | 0.717 | S | S | * | * | S | Bend | trans | 26 | 13.7 | 138.9 | 44.3 | 0 | 0 | 0 | 0 | 124.5 | P171 | P171-T173 PolarHBondContact O-N 3.4Š|
| 174 | A | 42.8 | Very low | 44.9 | Very low | 92 Ų | 92 | 137.8 Ų | 137.8 | 76% | 0.76 | 72% | 0.721 | S | S | * | * | trans | -121.4 | 0.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | T172 | T172-A174 VanDerWaalsContact C-N 3.28Å; T172-A174 PolarHBondContact O-N 2.95Å | ||
| 175 | V | 42.8 | Very low | 45.2 | Very low | 82 Ų | 82 | 137 Ų | 137 | 50% | 0.497 | 71% | 0.711 | S | S | . | * | trans | -102.7 | 4.1 | -169 | -166.8 | 0 | 0 | 0 | 0 | 113.7 | Y177 T178 H179 | V175-Y177 VanDerWaalsContact C-N 3.3Å; V175-Y177 PolarHBondContact O-N 3.41Å; V175-Y177 VanDerWaalsContact O-N 3.16Å; V175-T178 PolarHBondContact O-N 3.26Å; V175-T178 PolarHBondContact O-OG1 2.87Å; V175-H179 PolarHBondContact O-N 3.18Å | ||
| 176 | M | 40.9 | Very low | 45.6 | Very low | 172 Ų | 172 | 132 Ų | 132 | 85% | 0.847 | 70% | 0.698 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.9 | -17 | -169.6 | -102 | -167.4 | 175.3 | 0 | 0 | 116 | ||
| 177 | Y | 41 | Very low | 45.8 | Very low | 219 Ų | 219 | 128.1 Ų | 128.1 | 86% | 0.859 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -15.5 | 179.1 | -73.6 | -77.8 | 0 | 0 | 0 | 115.1 | V175 | V175-Y177 VanDerWaalsContact C-N 3.3Å; V175-Y177 PolarHBondContact O-N 3.41Å; V175-Y177 VanDerWaalsContact O-N 3.16Å |
| 178 | T | 46.5 | Very low | 46.1 | Very low | 90 Ų | 90 | 124.2 Ų | 124.2 | 55% | 0.552 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -86.9 | -24.9 | 175.4 | 43.9 | 0 | 0 | 0 | 0 | 112.3 | V175 V180 A181 Y182 | V175-T178 PolarHBondContact O-N 3.26Å; V175-T178 PolarHBondContact O-OG1 2.87Å; T178-V180 PolarHBondContact O-N 3.45Å; T178-A181 PolarHBondContact O-N 3.02Å; T178-Y182 PolarHBondContact O-N 3.5Å; T178-Y182 VanDerWaalsContact O-N 3.13Å |
| 179 | H | 42.4 | Very low | 46.3 | Very low | 113 Ų | 113 | 118.2 Ų | 118.2 | 52% | 0.523 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -73.9 | -22.7 | -176.5 | -141 | -66.8 | 0 | 0 | 0 | 114.2 | V175 R183 | V175-H179 PolarHBondContact O-N 3.18Å; H179-R183 VanDerWaalsContact O-CG 3.29Å; H179-R183 WeakPolarHBondContact O-CG 3.32Å; H179-R183 PolarHBondContact O-N 3.11Å |
| 180 | V | 47.2 | Very low | 46.7 | Very low | 94 Ų | 94 | 116.9 Ų | 116.9 | 57% | 0.57 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -79.2 | -34.7 | 175.9 | -176.8 | 0 | 0 | 0 | 0 | 111.3 | T178 R183 | T178-V180 PolarHBondContact O-N 3.45Å; V180-R183 PolarHBondContact O-N 3.23Å |
| 181 | A | 45.7 | Very low | 46.7 | Very low | 62 Ų | 62 | 117.8 Ų | 117.8 | 51% | 0.512 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -72 | -34.3 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112 | T178 F184 V185 | T178-A181 PolarHBondContact O-N 3.02Å; A181-F184 PolarHBondContact O-N 2.73Å; A181-V185 WeakPolarHBondContact O-CG2 3.46Å; A181-V185 PolarHBondContact O-N 2.91Å |
| 182 | Y | 44.1 | Very low | 46.8 | Very low | 159 Ų | 159 | 117.2 Ų | 117.2 | 62% | 0.624 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -70.2 | -30.7 | 175.2 | -128.4 | -95.8 | 0 | 0 | 0 | 112.8 | T178 F184 N186 | T178-Y182 PolarHBondContact O-N 3.5Å; T178-Y182 VanDerWaalsContact O-N 3.13Å; Y182-F184 VanDerWaalsContact C-N 3.34Å; Y182-F184 PolarHBondContact O-N 3.02Å; Y182-N186 VanDerWaalsContact CD1-ND2 3.35Å; Y182-N186 WeakPolarHBondContact CD1-ND2 3.34Å; Y182-N186 WeakPolarHBondContact O-CB 3.49Å; Y182-N186 PolarHBondContact O-N 2.95Å; Y182-N186 VanDerWaalsContact O-N 3.15Å |
| 183 | R | 45.6 | Very low | 46.9 | Very low | 179 Ų | 179 | 119.9 Ų | 119.9 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -69 | -27.2 | 174.9 | -80.3 | -114.7 | -179 | 166.6 | -1.2 | 113.7 | H179 V180 | H179-R183 VanDerWaalsContact O-CG 3.29Å; H179-R183 WeakPolarHBondContact O-CG 3.32Å; H179-R183 PolarHBondContact O-N 3.11Å; V180-R183 PolarHBondContact O-N 3.23Å |
| 184 | F | 46.2 | Very low | 47.5 | Very low | 154 Ų | 154 | 118.2 Ų | 118.2 | 68% | 0.675 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -87.9 | -29.2 | 177.8 | -95.9 | -83.9 | 0 | 0 | 0 | 113.7 | A181 Y182 | A181-F184 PolarHBondContact O-N 2.73Å; Y182-F184 VanDerWaalsContact C-N 3.34Å; Y182-F184 PolarHBondContact O-N 3.02Å |
| 185 | V | 49.3 | Very low | 47.9 | Very low | 93 Ų | 93 | 118.5 Ų | 118.5 | 56% | 0.564 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -80.6 | -25.6 | 177 | 179.6 | 0 | 0 | 0 | 0 | 111.5 | A181 Q187 L188 | A181-V185 WeakPolarHBondContact O-CG2 3.46Å; A181-V185 PolarHBondContact O-N 2.91Å; V185-Q187 VanDerWaalsContact C-N 3.33Å; V185-Q187 PolarHBondContact O-N 3.25Å; V185-L188 HydrophobicContact CG1-CD1 4.47Å; V185-L188 WeakPolarHBondContact O-CD1 3.45Å |
| 186 | N | 48.2 | Very low | 48.5 | Very low | 97 Ų | 97 | 116.7 Ų | 116.7 | 52% | 0.519 | 57% | 0.572 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.6 | 11.3 | 174 | -72.5 | -7.4 | 0 | 0 | 0 | 114.5 | Y182 P189 | Y182-N186 VanDerWaalsContact CD1-ND2 3.35Å; Y182-N186 WeakPolarHBondContact CD1-ND2 3.34Å; Y182-N186 WeakPolarHBondContact O-CB 3.49Å; Y182-N186 PolarHBondContact O-N 2.95Å; Y182-N186 VanDerWaalsContact O-N 3.15Å; N186-P189 WeakPolarHBondContact O-CD 3.3Å; N186-P189 WeakPolarHBondContact O-CG 3.35Å |
| 187 | Q | 50 | Low | 49 | Very low | 106 Ų | 106 | 115.4 Ų | 115.4 | 50% | 0.495 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -93.5 | -0.8 | 166.8 | -78 | -166.4 | 11.2 | 0 | 0 | 113.4 | V185 P189 L190 | V185-Q187 VanDerWaalsContact C-N 3.33Å; V185-Q187 PolarHBondContact O-N 3.25Å; Q187-P189 VanDerWaalsContact C-CD 3.42Å; Q187-P189 VanDerWaalsContact C-N 3.31Å; Q187-L190 HydrophobicContact CB-CD1 4.3Å; Q187-L190 HydrophobicContact CG-CD1 3.94Å; Q187-L190 WeakPolarHBondContact O-CB 3.47Å; Q187-L190 PolarHBondContact O-N 3.42Å |
| 188 | L | 50.2 | Low | 49.6 | Very low | 104 Ų | 104 | 108 Ų | 108 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -52.3 | -38.1 | 168.3 | -90.1 | 137.8 | 0 | 0 | 0 | 114.4 | V185 L190 F191 D192 | V185-L188 HydrophobicContact CG1-CD1 4.47Å; V185-L188 WeakPolarHBondContact O-CD1 3.45Å; L188-L190 VanDerWaalsContact C-N 3.26Å; L188-L190 PolarHBondContact O-N 3.32Å; L188-F191 WeakPolarHBondContact O-CB 3.06Å; L188-F191 PolarHBondContact O-N 2.92Å; L188-D192 PolarHBondContact O-N 3.22Å |
| 189 | P | 51.5 | Low | 49.9 | Very low | 63 Ų | 63 | 107.5 Ų | 107.5 | 41% | 0.409 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -66.1 | -23.7 | 175.3 | 23 | -33.3 | 0 | 0 | 0 | 113.7 | N186 Q187 F191 D192 Y193 | N186-P189 WeakPolarHBondContact O-CD 3.3Å; N186-P189 WeakPolarHBondContact O-CG 3.35Å; Q187-P189 VanDerWaalsContact C-CD 3.42Å; Q187-P189 VanDerWaalsContact C-N 3.31Å; P189-F191 PolarHBondContact O-N 3.39Å; P189-D192 PolarHBondContact O-N 3.41Å; P189-Y193 HydrophobicContact CB-CD2 4.49Å; P189-Y193 WeakPolarHBondContact O-CB 3.35Å; P189-Y193 WeakPolarHBondContact O-CD2 3.17Å; P189-Y193 PolarHBondContact O-N 3.31Å |
| 190 | L | 53.1 | Low | 50.3 | Low | 97 Ų | 97 | 107.2 Ų | 107.2 | 51% | 0.508 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -65.3 | -28.9 | 173.4 | -88.8 | 150.8 | 0 | 0 | 0 | 111.7 | Q187 L188 L194 | Q187-L190 HydrophobicContact CB-CD1 4.3Å; Q187-L190 HydrophobicContact CG-CD1 3.94Å; Q187-L190 WeakPolarHBondContact O-CB 3.47Å; Q187-L190 PolarHBondContact O-N 3.42Å; L188-L190 VanDerWaalsContact C-N 3.26Å; L188-L190 PolarHBondContact O-N 3.32Å; L190-L194 WeakPolarHBondContact O-CB 3.49Å; L190-L194 WeakPolarHBondContact O-CD1 3.28Å; L190-L194 PolarHBondContact O-N 3.05Å |
| 191 | F | 49.6 | Very low | 50.2 | Low | 106 Ų | 106 | 108.5 Ų | 108.5 | 47% | 0.465 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -73.7 | -39.5 | 174.9 | -133.6 | -90 | 0 | 0 | 0 | 111.2 | V68 L188 P189 L194 F195 | V68-F191 HydrophobicContact CG1-CE1 4.36Å; L188-F191 WeakPolarHBondContact O-CB 3.06Å; L188-F191 PolarHBondContact O-N 2.92Å; P189-F191 PolarHBondContact O-N 3.39Å; F191-L194 PolarHBondContact O-N 2.97Å; F191-F195 VanDerWaalsContact O-CB 3.26Å; F191-F195 WeakPolarHBondContact O-CB 3.48Å; F191-F195 PolarHBondContact O-N 2.89Å |
| 192 | D | 53.2 | Low | 50.1 | Low | 111 Ų | 111 | 110.3 Ų | 110.3 | 59% | 0.594 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.9 | -38.2 | 174.2 | -64.6 | -30.5 | 0 | 0 | 0 | 111.8 | L188 P189 F195 A196 | L188-D192 PolarHBondContact O-N 3.22Å; P189-D192 PolarHBondContact O-N 3.41Å; D192-F195 PolarHBondContact O-N 3.06Å; D192-A196 VanDerWaalsContact O-CB 3.28Å; D192-A196 WeakPolarHBondContact O-CB 3.4Å; D192-A196 PolarHBondContact O-N 3.27Å |
| 193 | Y | 53.2 | Low | 50.2 | Low | 179 Ų | 179 | 107.4 Ų | 107.4 | 70% | 0.702 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -67.3 | -40.9 | 173.7 | -87.4 | -73.5 | 0 | 0 | 0 | 112.5 | P189 F197 | P189-Y193 HydrophobicContact CB-CD2 4.49Å; P189-Y193 WeakPolarHBondContact O-CB 3.35Å; P189-Y193 WeakPolarHBondContact O-CD2 3.17Å; P189-Y193 PolarHBondContact O-N 3.31Å; Y193-F197 VanDerWaalsContact O-CB 3.3Å; Y193-F197 WeakPolarHBondContact O-CB 3.4Å; Y193-F197 PolarHBondContact O-N 3.23Å |
| 194 | L | 54.8 | Low | 49.9 | Very low | 111 Ų | 111 | 107.9 Ų | 107.9 | 58% | 0.581 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -65.7 | -39 | 173.9 | -92.6 | 152.6 | 0 | 0 | 0 | 111.6 | L190 F191 F197 T198 | L190-L194 WeakPolarHBondContact O-CB 3.49Å; L190-L194 WeakPolarHBondContact O-CD1 3.28Å; L190-L194 PolarHBondContact O-N 3.05Å; F191-L194 PolarHBondContact O-N 2.97Å; L194-F197 PolarHBondContact O-N 3.25Å; L194-T198 PolarHBondContact O-N 3.25Å; L194-T198 PolarHBondContact O-OG1 2.99Å |
| 195 | F | 51.2 | Low | 49.7 | Very low | 97 Ų | 97 | 106.5 Ų | 106.5 | 43% | 0.425 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -67.5 | -43 | 177.9 | -157.8 | -100.7 | 0 | 0 | 0 | 111.7 | F191 D192 T198 L199 | F191-F195 VanDerWaalsContact O-CB 3.26Å; F191-F195 WeakPolarHBondContact O-CB 3.48Å; F191-F195 PolarHBondContact O-N 2.89Å; D192-F195 PolarHBondContact O-N 3.06Å; F195-T198 WeakPolarHBondContact CA-OG1 3.47Å; F195-T198 PolarHBondContact O-N 3.38Å; F195-T198 PolarHBondContact O-OG1 2.9Å; F195-L199 HydrophobicContact CD1-CD1 3.67Å; F195-L199 HydrophobicContact CD1-CG 4.48Å; F195-L199 HydrophobicContact CE1-CD1 3.57Å; F195-L199 HydrophobicContact CE1-CG 4.45Å; F195-L199 HydrophobicContact CZ-CD1 4.47Å; F195-L199 WeakPolarHBondContact O-CB 3.49Å; F195-L199 WeakPolarHBondContact O-CG 3.48Å; F195-L199 PolarHBondContact O-N 2.97Å |
| 196 | A | 55.1 | Low | 49.1 | Very low | 44 Ų | 44 | 105.2 Ų | 105.2 | 36% | 0.364 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66.3 | -37 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | D192 L199 N200 | D192-A196 VanDerWaalsContact O-CB 3.28Å; D192-A196 WeakPolarHBondContact O-CB 3.4Å; D192-A196 PolarHBondContact O-N 3.27Å; A196-L199 PolarHBondContact O-N 3.13Å; A196-N200 WeakPolarHBondContact O-CB 3.4Å; A196-N200 PolarHBondContact O-N 3.09Å; A196-N200 PolarHBondContact O-ND2 3.34Å |
| 197 | F | 51.4 | Low | 48.8 | Very low | 145 Ų | 145 | 109.7 Ų | 109.7 | 64% | 0.636 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -67.4 | -43.5 | 176.2 | -153.5 | -85.6 | 0 | 0 | 0 | 111.4 | Y193 L194 L199 N200 D201 | Y193-F197 VanDerWaalsContact O-CB 3.3Å; Y193-F197 WeakPolarHBondContact O-CB 3.4Å; Y193-F197 PolarHBondContact O-N 3.23Å; L194-F197 PolarHBondContact O-N 3.25Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 3.07Å; F197-N200 PolarHBondContact O-N 2.91Å; F197-D201 PolarHBondContact O-N 2.94Å |
| 198 | T | 53 | Low | 48.6 | Very low | 65 Ų | 65 | 113.7 Ų | 113.7 | 40% | 0.399 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.4 | -32.3 | 175.2 | 43.3 | 0 | 0 | 0 | 0 | 113.3 | L194 F195 L202 | L194-T198 PolarHBondContact O-N 3.25Å; L194-T198 PolarHBondContact O-OG1 2.99Å; F195-T198 WeakPolarHBondContact CA-OG1 3.47Å; F195-T198 PolarHBondContact O-N 3.38Å; F195-T198 PolarHBondContact O-OG1 2.9Å; T198-L202 WeakPolarHBondContact O-CB 3.41Å; T198-L202 WeakPolarHBondContact O-CD1 3.36Å; T198-L202 PolarHBondContact O-N 3.16Å |
| 199 | L | 51.9 | Low | 48.4 | Very low | 79 Ų | 79 | 116.3 Ų | 116.3 | 41% | 0.414 | 61% | 0.607 | S | S | . | * | H | α-helix | trans | -76.2 | -34.3 | 176.7 | -75.2 | 172.7 | 0 | 0 | 0 | 112.5 | F195 A196 F197 L202 T203 | F195-L199 HydrophobicContact CD1-CD1 3.67Å; F195-L199 HydrophobicContact CD1-CG 4.48Å; F195-L199 HydrophobicContact CE1-CD1 3.57Å; F195-L199 HydrophobicContact CE1-CG 4.45Å; F195-L199 HydrophobicContact CZ-CD1 4.47Å; F195-L199 WeakPolarHBondContact O-CB 3.49Å; F195-L199 WeakPolarHBondContact O-CG 3.48Å; F195-L199 PolarHBondContact O-N 2.97Å; A196-L199 PolarHBondContact O-N 3.13Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 3.07Å; L199-L202 PolarHBondContact O-N 2.84Å; L199-T203 WeakPolarHBondContact O-CG2 3.4Å; L199-T203 PolarHBondContact O-N 3.19Å; L199-T203 VanDerWaalsContact O-N 3.11Å; L199-T203 PolarHBondContact O-OG1 2.91Å |
| 200 | N | 50.7 | Low | 48.2 | Very low | 106 Ų | 106 | 118.3 Ų | 118.3 | 57% | 0.567 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -73 | -31.8 | 176.8 | -76.2 | -21.4 | 0 | 0 | 0 | 113.2 | A196 F197 L202 T203 | A196-N200 WeakPolarHBondContact O-CB 3.4Å; A196-N200 PolarHBondContact O-N 3.09Å; A196-N200 PolarHBondContact O-ND2 3.34Å; F197-N200 PolarHBondContact O-N 2.91Å; N200-L202 VanDerWaalsContact C-N 3.28Å; N200-T203 WeakPolarHBondContact CA-OG1 3.28Å; N200-T203 PolarHBondContact O-N 3.25Å; N200-T203 PolarHBondContact O-OG1 2.77Å |
| 201 | D | 45.1 | Very low | 47.6 | Very low | 121 Ų | 121 | 123.6 Ų | 123.6 | 65% | 0.647 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -73.4 | -19.9 | 169.4 | -96.3 | -13.2 | 0 | 0 | 0 | 112.7 | F197 | F197-D201 PolarHBondContact O-N 2.94Å |
| 202 | L | 45.1 | Very low | 47.7 | Very low | 100 Ų | 100 | 127.4 Ų | 127.4 | 52% | 0.524 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -86.9 | -15.3 | 173.9 | -99 | 116.1 | 0 | 0 | 0 | 113.5 | T198 L199 N200 | T198-L202 WeakPolarHBondContact O-CB 3.41Å; T198-L202 WeakPolarHBondContact O-CD1 3.36Å; T198-L202 PolarHBondContact O-N 3.16Å; L199-L202 PolarHBondContact O-N 2.84Å; N200-L202 VanDerWaalsContact C-N 3.28Å |
| 203 | T | 45.8 | Very low | 47.6 | Very low | 99 Ų | 99 | 129.8 Ų | 129.8 | 61% | 0.607 | 66% | 0.663 | S | S | * | * | S | Bend | trans | -101.9 | 4.2 | 179.8 | 48.3 | 0 | 0 | 0 | 0 | 114.5 | L199 N200 | L199-T203 WeakPolarHBondContact O-CG2 3.4Å; L199-T203 PolarHBondContact O-N 3.19Å; L199-T203 VanDerWaalsContact O-N 3.11Å; L199-T203 PolarHBondContact O-OG1 2.91Å; N200-T203 WeakPolarHBondContact CA-OG1 3.28Å; N200-T203 PolarHBondContact O-N 3.25Å; N200-T203 PolarHBondContact O-OG1 2.77Å |
| 204 | F | 40 | Very low | 47.4 | Very low | 188 Ų | 188 | 130.8 Ų | 130.8 | 83% | 0.825 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -125.4 | 70.2 | 178.1 | -104.1 | -91.5 | 0 | 0 | 0 | 112.4 | ||
| 205 | S | 40.8 | Very low | 47.1 | Very low | 125 Ų | 125 | 130.4 Ų | 130.4 | 87% | 0.874 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -160.2 | 35.8 | 159.8 | -179.6 | 0 | 0 | 0 | 0 | 111.4 | ||
| 206 | G | 37.3 | Very low | 46.9 | Very low | 66 Ų | 66 | 130.1 Ų | 130.1 | 68% | 0.68 | 69% | 0.689 | S | S | * | * | trans | -129 | 69.4 | 167.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | E208 | G206-E208 PolarHBondContact O-N 2.89Š| ||
| 207 | E | 42.2 | Very low | 46.7 | Very low | 192 Ų | 192 | 133.9 Ų | 133.9 | 90% | 0.897 | 71% | 0.707 | S | S | * | * | trans | -60.8 | 97.6 | 159.8 | -79.2 | -164.5 | 145.5 | 0 | 0 | 106.8 | E209 | E207-E209 PolarHBondContact O-N 2.88Š| ||
| 208 | E | 45.6 | Very low | 46.9 | Very low | 189 Ų | 189 | 133 Ų | 133 | 88% | 0.883 | 71% | 0.714 | S | S | * | * | trans | -62.6 | 90.4 | 155.6 | -77.9 | -170.9 | 155.1 | 0 | 0 | 106.8 | G206 | G206-E208 PolarHBondContact O-N 2.89Š| ||
| 209 | E | 46.6 | Very low | 46.3 | Very low | 159 Ų | 159 | 137.7 Ų | 137.7 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | trans | -41.2 | 123.7 | 157.4 | -97.9 | -96.7 | 154.7 | 0 | 0 | 108.5 | E207 F211 | E207-E209 PolarHBondContact O-N 2.88Å; E209-F211 PolarHBondContact O-N 2.95Å | ||
| 210 | P | 46.1 | Very low | 46.1 | Very low | 105 Ų | 105 | 149.1 Ų | 149.1 | 68% | 0.682 | 77% | 0.773 | S | S | * | * | trans | -62.7 | 113.3 | 175.3 | 24.9 | -31.3 | 0 | 0 | 0 | 107.9 | K212 | P210-K212 VanDerWaalsContact C-N 3.35Å; P210-K212 PolarHBondContact O-N 2.97Å | ||
| 211 | F | 40.8 | Very low | 45.9 | Very low | 208 Ų | 208 | 151.3 Ų | 151.3 | 91% | 0.912 | 78% | 0.784 | S | S | * | * | trans | -49.1 | 97.3 | 173.1 | -130.7 | -96.6 | 0 | 0 | 0 | 108.8 | E209 E213 | E209-F211 PolarHBondContact O-N 2.95Å; F211-E213 VanDerWaalsContact C-N 3.27Å; F211-E213 PolarHBondContact O-N 3.22Å | ||
| 212 | K | 51.3 | Low | 45.9 | Very low | 186 Ų | 186 | 152.8 Ų | 152.8 | 81% | 0.809 | 79% | 0.791 | S | S | * | * | trans | -67.5 | 93.3 | 168.9 | -80.6 | -179.3 | -179.8 | 169.5 | 0 | 107.1 | P210 K214 | P210-K212 VanDerWaalsContact C-N 3.35Å; P210-K212 PolarHBondContact O-N 2.97Å; K212-K214 PolarHBondContact O-N 3.42Å | ||
| 213 | E | 51.7 | Low | 46 | Very low | 161 Ų | 161 | 155.8 Ų | 155.8 | 75% | 0.752 | 81% | 0.806 | S | S | * | * | trans | -51.8 | 98.5 | 164.8 | -170.5 | 174.7 | -179.9 | 0 | 0 | 108.6 | F211 T215 | F211-E213 VanDerWaalsContact C-N 3.27Å; F211-E213 PolarHBondContact O-N 3.22Å; E213-T215 PolarHBondContact O-N 3.49Å | ||
| 214 | K | 49.7 | Very low | 46 | Very low | 200 Ų | 200 | 159.1 Ų | 159.1 | 87% | 0.87 | 82% | 0.817 | S | S | * | * | trans | -72.1 | 88 | 166.4 | -77.3 | -179.4 | 178.4 | 175.8 | 0 | 107.1 | K212 A216 | K212-K214 PolarHBondContact O-N 3.42Å; K214-A216 VanDerWaalsContact C-N 3.35Å; K214-A216 PolarHBondContact O-N 3.16Å | ||
| 215 | T | 46.7 | Very low | 46.4 | Very low | 104 Ų | 104 | 157.3 Ų | 157.3 | 64% | 0.638 | 82% | 0.817 | S | S | * | * | trans | -62.4 | 97.6 | 165.2 | -29.2 | 0 | 0 | 0 | 0 | 107.9 | E213 V217 | E213-T215 PolarHBondContact O-N 3.49Å; T215-V217 HydrophobicContact CG2-CG2 4.18Å; T215-V217 PolarHBondContact O-N 3.11Å; T215-V217 VanDerWaalsContact O-N 3.11Å | ||
| 216 | A | 48.9 | Very low | 46.7 | Very low | 91 Ų | 91 | 159.5 Ų | 159.5 | 75% | 0.752 | 81% | 0.813 | S | S | * | * | trans | -74.1 | 92 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.2 | K214 T218 | K214-A216 VanDerWaalsContact C-N 3.35Å; K214-A216 PolarHBondContact O-N 3.16Å; A216-T218 PolarHBondContact O-N 3.36Å | ||
| 217 | V | 49.7 | Very low | 47.4 | Very low | 123 Ų | 123 | 166.1 Ų | 166.1 | 75% | 0.745 | 82% | 0.823 | S | S | * | * | trans | -82.4 | 101.1 | 165.3 | 178.5 | 0 | 0 | 0 | 0 | 107.4 | T215 L219 | T215-V217 HydrophobicContact CG2-CG2 4.18Å; T215-V217 PolarHBondContact O-N 3.11Å; T215-V217 VanDerWaalsContact O-N 3.11Å; V217-L219 PolarHBondContact O-N 3.36Å | ||
| 218 | T | 55.6 | Low | 47.8 | Very low | 126 Ų | 126 | 164.2 Ų | 164.2 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | trans | -68.2 | 114.9 | 169.9 | -57.1 | 0 | 0 | 0 | 0 | 109.2 | A216 | A216-T218 PolarHBondContact O-N 3.36Š| ||
| 219 | L | 41.4 | Very low | 48 | Very low | 164 Ų | 164 | 162.1 Ų | 162.1 | 86% | 0.859 | 81% | 0.811 | S | S | * | * | trans | -67.2 | 125.3 | 167 | -85.7 | 151.3 | 0 | 0 | 0 | 110.3 | V217 | V217-L219 PolarHBondContact O-N 3.36Š| ||
| 220 | R | 47.6 | Very low | 48.1 | Very low | 318 Ų | 318 | 162.4 Ų | 162.4 | 100% | 1.2 | 82% | 0.817 | S | S | * | * | trans | -138.3 | 0 | 151 | -120.1 | -171.4 | -171.6 | 174 | 3.9 | 108.8 |
Retrieved 220 of 220 residues in 107.8 ms
(Link to these results)