| 1 | M | 38.4 | Very low | 45.8 | Very low | 248 Ų | 248 | 151.9 Ų | 151.9 | 100% | 1.222 | 84% | 0.843 | S | S | * | * | | | | 0 | 119.1 | 0 | -57.4 | -67.7 | -169.8 | 0 | 0 | 106.6 | | |
| 2 | A | 41.4 | Very low | 45.7 | Very low | 99 Ų | 99 | 145.9 Ų | 145.9 | 82% | 0.818 | 83% | 0.828 | S | S | * | * | | | cis | -152.2 | 151.5 | 5.2 | 0 | 0 | 0 | 0 | 0 | 108.1 | | |
| 3 | S | 41.1 | Very low | 45.7 | Very low | 102 Ų | 102 | 144.9 Ų | 144.9 | 71% | 0.713 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 139.9 | -178.9 | 46.7 | 0 | 0 | 0 | 0 | 112.3 | | |
| 4 | R | 48.2 | Very low | 46 | Very low | 246 Ų | 246 | 143.2 Ų | 143.2 | 93% | 0.928 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -82.7 | 118.9 | 164.9 | -71.9 | -173.6 | 177.5 | -156.7 | -0.5 | 108.6 | | |
| 5 | Q | 49.3 | Very low | 46.2 | Very low | 164 Ų | 164 | 137.3 Ų | 137.3 | 77% | 0.766 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 140.4 | 167.9 | -70 | -77 | -30 | 0 | 0 | 109.5 | | |
| 6 | P | 50.1 | Low | 46.7 | Very low | 113 Ų | 113 | 137.5 Ų | 137.5 | 73% | 0.734 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 117.4 | 163.5 | 30.5 | -26.6 | 0 | 0 | 0 | 109.3 | V8 | P6-V8 PolarHBondContact O-N 3.35Š|
| 7 | E | 43.8 | Very low | 47 | Very low | 191 Ų | 191 | 139.2 Ų | 139.2 | 89% | 0.893 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 118.8 | 175.5 | -171.3 | 172.7 | 177.9 | 0 | 0 | 110 | | |
| 8 | V | 49.6 | Very low | 47.1 | Very low | 125 Ų | 125 | 135 Ų | 135 | 76% | 0.758 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 129.6 | 175.8 | -179 | 0 | 0 | 0 | 0 | 108.4 | P6 A10 | P6-V8 PolarHBondContact O-N 3.35Å; V8-A10 PolarHBondContact O-N 2.91Å; V8-A10 VanDerWaalsContact O-N 3.1Å |
| 9 | P | 51.5 | Low | 47.5 | Very low | 114 Ų | 114 | 139 Ų | 139 | 74% | 0.74 | 82% | 0.819 | S | S | * | * | | | trans | -64.6 | 113.7 | 174.5 | -20.2 | 32 | 0 | 0 | 0 | 110.8 | L11 | P9-L11 PolarHBondContact O-N 2.83Š|
| 10 | A | 43.9 | Very low | 47.5 | Very low | 98 Ų | 98 | 140.9 Ų | 140.9 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | | | trans | -63.8 | 118.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 108.6 | V8 A12 | V8-A10 PolarHBondContact O-N 2.91Å; V8-A10 VanDerWaalsContact O-N 3.1Å; A10-A12 VanDerWaalsContact C-N 3.31Å; A10-A12 PolarHBondContact O-N 2.98Å |
| 11 | L | 46.3 | Very low | 48.1 | Very low | 171 Ų | 171 | 139.2 Ų | 139.2 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | | | trans | -64.4 | 92.4 | 171.1 | -69.3 | 166.3 | 0 | 0 | 0 | 108.7 | P9 P13 | P9-L11 PolarHBondContact O-N 2.83Å; L11-P13 WeakPolarHBondContact O-CD 3.36Å |
| 12 | A | 44.4 | Very low | 49.3 | Very low | 80 Ų | 80 | 134.6 Ų | 134.6 | 66% | 0.661 | 80% | 0.797 | S | S | * | * | | | trans | -66.5 | 125 | 165.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | A10 S14 | A10-A12 VanDerWaalsContact C-N 3.31Å; A10-A12 PolarHBondContact O-N 2.98Å; A12-S14 VanDerWaalsContact C-N 3.28Å; A12-S14 PolarHBondContact O-N 2.76Å |
| 13 | P | 46.5 | Very low | 49.9 | Very low | 133 Ų | 133 | 134.5 Ų | 134.5 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | | | trans | -77 | 82.4 | 173.4 | 30.7 | -32.3 | 0 | 0 | 0 | 109.3 | L11 G15 | L11-P13 WeakPolarHBondContact O-CD 3.36Å; P13-G15 PolarHBondContact O-N 2.96Å |
| 14 | S | 49.7 | Very low | 50.7 | Low | 121 Ų | 121 | 137.7 Ų | 137.7 | 85% | 0.846 | 80% | 0.796 | S | S | * | * | | | trans | -88 | 92.8 | 168.5 | 64.6 | 0 | 0 | 0 | 0 | 109.6 | A12 | A12-S14 VanDerWaalsContact C-N 3.28Å; A12-S14 PolarHBondContact O-N 2.76Å |
| 15 | G | 48 | Very low | 51.2 | Low | 55 Ų | 55 | 129.3 Ų | 129.3 | 57% | 0.567 | 79% | 0.786 | S | S | * | * | | | trans | -152.7 | 137.8 | 169.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | P13 L17 | P13-G15 PolarHBondContact O-N 2.96Å; G15-L17 PolarHBondContact O-N 3.48Å |
| 16 | P | 55.3 | Low | 51.3 | Low | 140 Ų | 140 | 128.2 Ų | 128.2 | 91% | 0.909 | 78% | 0.783 | S | S | * | * | | | trans | -81.2 | 67.3 | -180 | 35.6 | -32.4 | 0 | 0 | 0 | 108.6 | | |
| 17 | L | 52.2 | Low | 51.4 | Low | 167 Ų | 167 | 128.7 Ų | 128.7 | 87% | 0.874 | 79% | 0.787 | S | S | * | * | | | trans | -115.6 | 129.2 | 170.7 | -119.2 | 84.9 | 0 | 0 | 0 | 109.6 | G15 | G15-L17 PolarHBondContact O-N 3.48Š|
| 18 | G | 47.6 | Very low | 52 | Low | 63 Ų | 63 | 130.5 Ų | 130.5 | 65% | 0.649 | 79% | 0.786 | S | S | * | * | | | trans | -50.6 | 149 | -172.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | M20 | G18-M20 VanDerWaalsContact C-N 3.27Å; G18-M20 PolarHBondContact O-N 3.19Å |
| 19 | K | 54.4 | Low | 52.7 | Low | 211 Ų | 211 | 135.4 Ų | 135.4 | 92% | 0.917 | 79% | 0.791 | S | S | * | * | | | trans | -55.6 | 84.2 | 170.8 | -47.7 | 174.9 | -172.3 | -177.5 | 0 | 109.4 | S21 | K19-S21 PolarHBondContact O-N 3.36Š|
| 20 | M | 48 | Very low | 53.2 | Low | 177 Ų | 177 | 134.1 Ų | 134.1 | 87% | 0.872 | 79% | 0.79 | S | S | * | * | | | trans | -93.2 | 89.9 | 163.7 | -70.7 | 179.2 | 64.8 | 0 | 0 | 106.6 | G18 L22 | G18-M20 VanDerWaalsContact C-N 3.27Å; G18-M20 PolarHBondContact O-N 3.19Å; M20-L22 PolarHBondContact O-N 3.06Å |
| 21 | S | 60.2 | Low | 53.9 | Low | 106 Ų | 106 | 136.8 Ų | 136.8 | 74% | 0.741 | 78% | 0.783 | S | S | * | * | | | trans | -55.1 | 121.5 | 168.1 | 51.1 | 0 | 0 | 0 | 0 | 108.4 | K19 | K19-S21 PolarHBondContact O-N 3.36Š|
| 22 | L | 62.9 | Low | 54.8 | Low | 151 Ų | 151 | 130.7 Ų | 130.7 | 79% | 0.791 | 76% | 0.755 | S | S | * | * | | | trans | -54.7 | 139.1 | 163.6 | -66.7 | 166.4 | 0 | 0 | 0 | 107.7 | M20 I24 | M20-L22 PolarHBondContact O-N 3.06Å; L22-I24 PolarHBondContact O-N 2.97Å |
| 23 | P | 54.9 | Low | 55.4 | Low | 96 Ų | 96 | 136.8 Ų | 136.8 | 62% | 0.623 | 76% | 0.762 | S | S | * | * | | | trans | -61.3 | 107.2 | 176 | 24 | -31.2 | 0 | 0 | 0 | 109 | G25 M26 | P23-G25 PolarHBondContact O-N 2.86Å; P23-M26 HydrophobicContact CG-SD 4.36Å |
| 24 | I | 58.1 | Low | 56.5 | Low | 170 Ų | 170 | 136 Ų | 136 | 87% | 0.872 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | 117.3 | 164.1 | -82 | 94.1 | 0 | 0 | 0 | 106.2 | L22 | L22-I24 PolarHBondContact O-N 2.97Š|
| 25 | G | 57.9 | Low | 57.2 | Low | 70 Ų | 70 | 135.3 Ų | 135.3 | 72% | 0.722 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 136.4 | -12.8 | 174.5 | 0 | 0 | 0 | 0 | 0 | 115.8 | P23 C27 | P23-G25 PolarHBondContact O-N 2.86Å; G25-C27 PolarHBondContact O-N 2.8Å |
| 26 | M | 51.1 | Low | 57.8 | Low | 141 Ų | 141 | 135.1 Ų | 135.1 | 70% | 0.695 | 73% | 0.73 | S | S | * | * | | | trans | -88.3 | 90.6 | 170.8 | -68.3 | -179 | 70.8 | 0 | 0 | 109.4 | P23 R28 | P23-M26 HydrophobicContact CG-SD 4.36Å; M26-R28 VanDerWaalsContact C-N 3.29Å; M26-R28 PolarHBondContact O-N 3.29Å |
| 27 | C | 53.7 | Low | 58.3 | Low | 123 Ų | 123 | 135.3 Ų | 135.3 | 83% | 0.831 | 72% | 0.723 | S | S | * | * | | | trans | -56.3 | 97.5 | 164 | -73.5 | 0 | 0 | 0 | 0 | 108.1 | G25 R29 | G25-C27 PolarHBondContact O-N 2.8Å; C27-R29 PolarHBondContact O-N 3.22Å |
| 28 | R | 56.2 | Low | 58.9 | Low | 228 Ų | 228 | 134.6 Ų | 134.6 | 86% | 0.86 | 72% | 0.715 | S | S | * | * | | | trans | -67.5 | 84.4 | 161.1 | -67.4 | -169.2 | 179.8 | -90.5 | 0 | 105.8 | M26 A30 | M26-R28 VanDerWaalsContact C-N 3.29Å; M26-R28 PolarHBondContact O-N 3.29Å; R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 2.68Å |
| 29 | R | 63 | Low | 59.8 | Low | 229 Ų | 229 | 136.4 Ų | 136.4 | 86% | 0.864 | 71% | 0.71 | S | S | * | * | | | trans | -62.3 | 102.3 | 161 | -134.1 | -170 | -60.5 | -118.4 | 3.5 | 103.9 | C27 F31 | C27-R29 PolarHBondContact O-N 3.22Å; R29-F31 PolarHBondContact O-N 3.39Å |
| 30 | A | 62.9 | Low | 60 | Low | 87 Ų | 87 | 132.3 Ų | 132.3 | 72% | 0.719 | 71% | 0.705 | S | S | * | * | | | trans | -56.9 | 112.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 105.5 | R28 S32 | R28-A30 VanDerWaalsContact C-N 3.26Å; R28-A30 PolarHBondContact O-N 2.68Å; A30-S32 PolarHBondContact O-N 3.26Å |
| 31 | F | 58.9 | Low | 60.8 | Low | 153 Ų | 153 | 126.5 Ų | 126.5 | 67% | 0.671 | 69% | 0.685 | S | S | * | * | | | trans | -66.6 | 102.8 | 175.8 | -137.5 | -89.1 | 0 | 0 | 0 | 105.4 | R29 A36 M43 | R29-F31 PolarHBondContact O-N 3.39Å; F31-A36 HydrophobicContact CE1-CB 4.14Å; F31-M43 HydrophobicContact CE1-CE 4.2Å; F31-M43 HydrophobicContact CE1-SD 4.33Å; F31-M43 HydrophobicContact CE2-CE 4.36Å; F31-M43 HydrophobicContact CZ-CE 3.68Å; F31-M43 HydrophobicContact CZ-SD 4.19Å |
| 32 | S | 65.8 | Low | 60.6 | Low | 43 Ų | 43 | 126.6 Ų | 126.6 | 30% | 0.301 | 68% | 0.683 | S | S | . | * | | | trans | -80.8 | 138.9 | 175 | 83.8 | 0 | 0 | 0 | 0 | 107.6 | A30 D34 D35 | A30-S32 PolarHBondContact O-N 3.26Å; S32-D34 PolarHBondContact O-N 2.85Å; S32-D35 VanDerWaalsContact OG-CB 3.29Å; S32-D35 WeakPolarHBondContact OG-CB 3.27Å; S32-D35 PolarHBondContact OG-N 3.19Å; S32-D35 VanDerWaalsContact OG-N 3.1Å; S32-D35 PolarHBondContact OG-OD2 3.2Å |
| 33 | Y | 56.3 | Low | 60.8 | Low | 209 Ų | 209 | 126.2 Ų | 126.2 | 82% | 0.82 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -25.4 | 176.8 | -100.9 | -88.4 | 0 | 0 | 0 | 111.9 | L37 | Y33-L37 WeakPolarHBondContact O-CG 3.44Š|
| 34 | D | 68.9 | Low | 61.2 | Low | 115 Ų | 115 | 127.3 Ų | 127.3 | 62% | 0.615 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69 | -46.3 | 177.3 | -119.6 | 4.3 | 0 | 0 | 0 | 111.3 | S32 A36 L37 E38 | S32-D34 PolarHBondContact O-N 2.85Å; D34-A36 PolarHBondContact O-N 3.07Å; D34-L37 PolarHBondContact O-N 3.41Å; D34-L37 VanDerWaalsContact O-N 3.07Å; D34-E38 PolarHBondContact O-N 3.49Å |
| 35 | D | 64.9 | Low | 61.4 | Low | 108 Ų | 108 | 124 Ų | 124 | 58% | 0.578 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -61.3 | -29.9 | 177.7 | -76.3 | -41.7 | 0 | 0 | 0 | 112.6 | S32 L37 D39 | S32-D35 VanDerWaalsContact OG-CB 3.29Å; S32-D35 WeakPolarHBondContact OG-CB 3.27Å; S32-D35 PolarHBondContact OG-N 3.19Å; S32-D35 VanDerWaalsContact OG-N 3.1Å; S32-D35 PolarHBondContact OG-OD2 3.2Å; D35-L37 VanDerWaalsContact C-N 3.32Å; D35-D39 WeakPolarHBondContact O-CB 3.12Å; D35-D39 PolarHBondContact O-N 3.06Å |
| 36 | A | 61.5 | Low | 61.7 | Low | 50 Ų | 50 | 125.1 Ų | 125.1 | 41% | 0.413 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -76.5 | -17.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | F31 D34 | F31-A36 HydrophobicContact CE1-CB 4.14Å; D34-A36 PolarHBondContact O-N 3.07Å |
| 37 | L | 64.9 | Low | 62.6 | Low | 144 Ų | 144 | 122.7 Ų | 122.7 | 75% | 0.754 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -91.3 | -28.2 | 176.2 | -67.4 | 174.8 | 0 | 0 | 0 | 111.9 | Y33 D34 D35 | Y33-L37 WeakPolarHBondContact O-CG 3.44Å; D34-L37 PolarHBondContact O-N 3.41Å; D34-L37 VanDerWaalsContact O-N 3.07Å; D35-L37 VanDerWaalsContact C-N 3.32Å |
| 38 | E | 64.9 | Low | 62.9 | Low | 153 Ų | 153 | 123 Ų | 123 | 72% | 0.715 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -88.8 | -22.2 | -178.9 | -108.1 | 151.5 | -177.7 | 0 | 0 | 114.1 | D34 P40 | D34-E38 PolarHBondContact O-N 3.49Å; E38-P40 WeakPolarHBondContact O-CD 3.39Å |
| 39 | D | 65.3 | Low | 63.3 | Low | 100 Ų | 100 | 119.3 Ų | 119.3 | 54% | 0.535 | 66% | 0.664 | S | S | . | * | | | trans | -93 | 107.7 | 175 | -165.6 | 1.3 | 0 | 0 | 0 | 112 | D35 A41 | D35-D39 WeakPolarHBondContact O-CB 3.12Å; D35-D39 PolarHBondContact O-N 3.06Å; D39-A41 PolarHBondContact O-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CB 3.41Å; D39-A41 PolarHBondContact OD1-N 3.32Å |
| 40 | P | 60 | Low | 63.1 | Low | 125 Ų | 125 | 114.4 Ų | 114.4 | 81% | 0.812 | 65% | 0.652 | S | S | * | * | | | trans | -76 | 1.6 | 174.5 | 33.2 | -36.5 | 0 | 0 | 0 | 113 | E38 | E38-P40 WeakPolarHBondContact O-CD 3.39Š|
| 41 | A | 63.4 | Low | 62.7 | Low | 55 Ų | 55 | 112.8 Ų | 112.8 | 46% | 0.455 | 65% | 0.645 | S | S | . | * | S | Bend | trans | -67.2 | 127.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 110 | D39 M43 | D39-A41 PolarHBondContact O-N 3.33Å; D39-A41 WeakPolarHBondContact OD1-CB 3.41Å; D39-A41 PolarHBondContact OD1-N 3.32Å; A41-M43 PolarHBondContact O-N 2.84Å; A41-M43 VanDerWaalsContact O-N 3.1Å |
| 42 | P | 57.8 | Low | 62.9 | Low | 108 Ų | 108 | 110.9 Ų | 110.9 | 70% | 0.701 | 65% | 0.65 | S | S | * | * | | | trans | -59.2 | 122.8 | 175.7 | 23.8 | -31.3 | 0 | 0 | 0 | 108.6 | T44 | P42-T44 PolarHBondContact O-N 3.34Š|
| 43 | M | 66.6 | Low | 62.6 | Low | 143 Ų | 143 | 114.3 Ų | 114.3 | 70% | 0.704 | 66% | 0.664 | S | S | * | * | S | Bend | trans | -45.8 | 108.6 | 173.8 | -79.5 | -168.2 | 64 | 0 | 0 | 109.5 | F31 A41 | F31-M43 HydrophobicContact CE1-CE 4.2Å; F31-M43 HydrophobicContact CE1-SD 4.33Å; F31-M43 HydrophobicContact CE2-CE 4.36Å; F31-M43 HydrophobicContact CZ-CE 3.68Å; F31-M43 HydrophobicContact CZ-SD 4.19Å; A41-M43 PolarHBondContact O-N 2.84Å; A41-M43 VanDerWaalsContact O-N 3.1Å |
| 44 | T | 63.6 | Low | 62.9 | Low | 119 Ų | 119 | 108.9 Ų | 108.9 | 73% | 0.73 | 65% | 0.654 | S | S | * | * | S | Bend | trans | 49.6 | 108.1 | 176.7 | -30.3 | 0 | 0 | 0 | 0 | 114.1 | P42 | P42-T44 PolarHBondContact O-N 3.34Š|
| 45 | P | 60.9 | Low | 62 | Low | 101 Ų | 101 | 114.7 Ų | 114.7 | 66% | 0.656 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 140.5 | 172.2 | 25.3 | -32.8 | 0 | 0 | 0 | 109.5 | | |
| 46 | P | 65.8 | Low | 62 | Low | 93 Ų | 93 | 117.6 Ų | 117.6 | 60% | 0.604 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 144 | 176.2 | 23.3 | -32.9 | 0 | 0 | 0 | 109.2 | S48 M50 | P46-S48 PolarHBondContact O-N 3.31Å; P46-M50 HydrophobicContact CB-SD 4.28Å |
| 47 | P | 69.6 | Low | 62.1 | Low | 91 Ų | 91 | 120.4 Ų | 120.4 | 59% | 0.591 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 135.6 | -177.9 | 20.9 | -31.5 | 0 | 0 | 0 | 109.7 | D49 M50 | P47-D49 PolarHBondContact O-N 2.88Å; P47-M50 HydrophobicContact CG-CG 4.22Å; P47-M50 HydrophobicContact CG-SD 4.15Å; P47-M50 PolarHBondContact O-N 3.45Å |
| 48 | S | 60.6 | Low | 62.5 | Low | 130 Ų | 130 | 120 Ų | 120 | 91% | 0.909 | 69% | 0.692 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.6 | -6.6 | -173.6 | -53.5 | 0 | 0 | 0 | 0 | 114.7 | P46 M50 | P46-S48 PolarHBondContact O-N 3.31Å; S48-M50 VanDerWaalsContact C-N 3.33Å |
| 49 | D | 63.4 | Low | 62.9 | Low | 149 Ų | 149 | 118.8 Ų | 118.8 | 80% | 0.797 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.7 | -6.8 | 173.2 | -166 | 30 | 0 | 0 | 0 | 113.6 | P47 G51 | P47-D49 PolarHBondContact O-N 2.88Å; D49-G51 PolarHBondContact O-N 2.94Å |
| 50 | M | 58.1 | Low | 62.9 | Low | 126 Ų | 126 | 118.7 Ų | 118.7 | 62% | 0.621 | 69% | 0.694 | S | S | * | * | | | trans | -85.3 | 24.5 | 175.3 | -71.9 | -174.7 | 64.9 | 0 | 0 | 113.8 | P46 P47 S48 S52 | P46-M50 HydrophobicContact CB-SD 4.28Å; P47-M50 HydrophobicContact CG-CG 4.22Å; P47-M50 HydrophobicContact CG-SD 4.15Å; P47-M50 PolarHBondContact O-N 3.45Å; S48-M50 VanDerWaalsContact C-N 3.33Å; M50-S52 PolarHBondContact O-N 2.84Å; M50-S52 VanDerWaalsContact O-N 3.15Å |
| 51 | G | 55 | Low | 63.1 | Low | 54 Ų | 54 | 121.3 Ų | 121.3 | 56% | 0.557 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -63.6 | 112 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | D49 I53 | D49-G51 PolarHBondContact O-N 2.94Å; G51-I53 PolarHBondContact O-N 2.88Å |
| 52 | S | 62.5 | Low | 63 | Low | 112 Ų | 112 | 129.8 Ų | 129.8 | 78% | 0.783 | 72% | 0.716 | S | S | * | * | | | trans | 45.6 | 66.4 | 163.2 | 67.9 | 0 | 0 | 0 | 0 | 115.5 | M50 P54 | M50-S52 PolarHBondContact O-N 2.84Å; M50-S52 VanDerWaalsContact O-N 3.15Å; S52-P54 WeakPolarHBondContact O-CD 3.16Å |
| 53 | I | 59.9 | Low | 63.1 | Low | 116 Ų | 116 | 133 Ų | 133 | 60% | 0.595 | 72% | 0.719 | S | S | * | * | | | trans | -85.9 | 102.9 | 157.3 | -58.1 | 162.4 | 0 | 0 | 0 | 105.6 | G51 W55 | G51-I53 PolarHBondContact O-N 2.88Å; I53-W55 PolarHBondContact O-N 3.31Å |
| 54 | P | 62.3 | Low | 62.8 | Low | 94 Ų | 94 | 135.9 Ų | 135.9 | 61% | 0.61 | 72% | 0.723 | S | S | * | * | | | trans | -60.9 | 109.4 | 167.1 | 24 | -30.1 | 0 | 0 | 0 | 106.1 | S52 K56 | S52-P54 WeakPolarHBondContact O-CD 3.16Å; P54-K56 PolarHBondContact O-N 3.43Å |
| 55 | W | 51.2 | Low | 62.4 | Low | 237 Ų | 237 | 138.5 Ų | 138.5 | 90% | 0.898 | 73% | 0.727 | S | S | * | * | | | trans | -60.1 | 86.7 | 170.4 | -66.4 | 90.2 | 0 | 0 | 0 | 107.6 | I53 P57 | I53-W55 PolarHBondContact O-N 3.31Å; W55-P57 WeakPolarHBondContact O-CD 3.24Å |
| 56 | K | 65.1 | Low | 62.2 | Low | 169 Ų | 169 | 142 Ų | 142 | 74% | 0.735 | 74% | 0.735 | S | S | * | * | | | trans | -77.5 | 116.9 | 170.8 | -72.3 | -170.1 | 178.3 | -176.8 | 0 | 106.1 | P54 V58 | P54-K56 PolarHBondContact O-N 3.43Å; K56-V58 PolarHBondContact O-N 3.39Å |
| 57 | P | 62.5 | Low | 61.6 | Low | 109 Ų | 109 | 144.8 Ų | 144.8 | 71% | 0.708 | 74% | 0.743 | S | S | * | * | | | trans | -60.2 | 114.7 | 171.6 | 24.6 | -31.3 | 0 | 0 | 0 | 107.9 | W55 I59 | W55-P57 WeakPolarHBondContact O-CD 3.24Å; P57-I59 VanDerWaalsContact C-N 3.3Å; P57-I59 HydrophobicContact CB-CG1 4.43Å; P57-I59 PolarHBondContact O-N 2.85Å |
| 58 | V | 74 | Confident | 60.6 | Low | 135 Ų | 135 | 147.9 Ų | 147.9 | 82% | 0.818 | 76% | 0.755 | S | S | * | * | | | trans | -75.2 | 90.8 | 170.2 | 176.5 | 0 | 0 | 0 | 0 | 106.3 | K56 P60 | K56-V58 PolarHBondContact O-N 3.39Å; V58-P60 VanDerWaalsContact O-CD 3.27Å; V58-P60 WeakPolarHBondContact O-CD 3.49Å |
| 59 | I | 72.8 | Confident | 60 | Low | 129 Ų | 129 | 150.6 Ų | 150.6 | 66% | 0.662 | 75% | 0.751 | S | S | * | * | | | trans | -76.4 | 116.7 | 173.5 | -61.5 | 170.5 | 0 | 0 | 0 | 107.3 | P57 E61 | P57-I59 VanDerWaalsContact C-N 3.3Å; P57-I59 HydrophobicContact CB-CG1 4.43Å; P57-I59 PolarHBondContact O-N 2.85Å; I59-E61 PolarHBondContact O-N 2.82Å |
| 60 | P | 66 | Low | 59 | Low | 97 Ų | 97 | 150.5 Ų | 150.5 | 63% | 0.63 | 76% | 0.755 | S | S | * | * | | | trans | -69.2 | 114.8 | 177.4 | -18.8 | 33.4 | 0 | 0 | 0 | 110.5 | V58 R62 | V58-P60 VanDerWaalsContact O-CD 3.27Å; V58-P60 WeakPolarHBondContact O-CD 3.49Å; P60-R62 PolarHBondContact O-N 3.39Å |
| 61 | E | 63.4 | Low | 58.6 | Low | 181 Ų | 181 | 153.4 Ų | 153.4 | 85% | 0.846 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -68.2 | 17.9 | -178.5 | -63 | -172.7 | 161.8 | 0 | 0 | 115.2 | I59 | I59-E61 PolarHBondContact O-N 2.82Š|
| 62 | R | 62.2 | Low | 57.8 | Low | 232 Ų | 232 | 160.1 Ų | 160.1 | 88% | 0.875 | 78% | 0.784 | S | S | * | * | | | trans | -105.4 | 23.2 | -166.4 | -68.4 | -167.8 | -179.1 | 147.6 | 2.1 | 116.2 | P60 | P60-R62 PolarHBondContact O-N 3.39Š|
| 63 | K | 60.2 | Low | 56.4 | Low | 177 Ų | 177 | 158.2 Ų | 158.2 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -128.9 | -5.1 | -174.7 | -60 | -80.7 | -172.5 | 169 | 0 | 116.2 | | |
| 64 | Y | 58.8 | Low | 55.2 | Low | 203 Ų | 203 | 157.7 Ų | 157.7 | 80% | 0.796 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -122.5 | 13.2 | -170.8 | -61.2 | -73 | 0 | 0 | 0 | 116.3 | H66 | Y64-H66 PolarHBondContact O-N 2.89Š|
| 65 | Q | 56.4 | Low | 53.9 | Low | 173 Ų | 173 | 157.9 Ų | 157.9 | 81% | 0.808 | 81% | 0.805 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.3 | 7.1 | -179 | -78 | -173.8 | -0.7 | 0 | 0 | 115.7 | | |
| 66 | H | 56.2 | Low | 52.9 | Low | 176 Ų | 176 | 152 Ų | 152 | 82% | 0.815 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.2 | 9.5 | -171.2 | -88.9 | -70.6 | 0 | 0 | 0 | 116.5 | Y64 | Y64-H66 PolarHBondContact O-N 2.89Š|
| 67 | L | 54.2 | Low | 51.5 | Low | 151 Ų | 151 | 150.1 Ų | 150.1 | 79% | 0.791 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -93.9 | -11.7 | 179.7 | -66.4 | 177.5 | 0 | 0 | 0 | 115 | | |
| 68 | D | 47.9 | Very low | 50 | Low | 156 Ų | 156 | 150.2 Ų | 150.2 | 83% | 0.834 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -105.4 | 22.1 | -171.3 | -59.6 | -20.2 | 0 | 0 | 0 | 114.4 | | |
| 69 | K | 48.9 | Very low | 47.8 | Very low | 187 Ų | 187 | 149.6 Ų | 149.6 | 81% | 0.813 | 81% | 0.807 | S | S | * | * | | | trans | -129 | 67.7 | 174.8 | -65 | -172.5 | -178.8 | -175.5 | 0 | 111.3 | | |
| 70 | T | 42.3 | Very low | 45.8 | Very low | 146 Ų | 146 | 151.9 Ų | 151.9 | 90% | 0.896 | 82% | 0.82 | S | S | * | * | | | trans | -145.4 | 64.4 | 157 | -53.4 | 0 | 0 | 0 | 0 | 108.7 | | |
| 71 | E | 49.6 | Very low | 44.3 | Very low | 188 Ų | 188 | 151.2 Ų | 151.2 | 88% | 0.879 | 82% | 0.822 | S | S | * | * | | | trans | -140.6 | 133.7 | 157.9 | -171.4 | 178.7 | 169.6 | 0 | 0 | 107.3 | | |
| 72 | E | 37.4 | Very low | 43 | Very low | 194 Ų | 194 | 149 Ų | 149 | 91% | 0.907 | 82% | 0.821 | S | S | * | * | | | trans | 95.1 | 106.2 | 168.4 | -148.1 | -179 | -176.6 | 0 | 0 | 119.3 | | |
| 73 | G | 32.6 | Very low | 41.7 | Very low | 73 Ų | 73 | 144.2 Ų | 144.2 | 75% | 0.753 | 82% | 0.818 | S | S | * | * | | | | 111.1 | 73 | 126.9 | 0 | 0 | 0 | 0 | 0 | 121.4 | | |
| 74 | A | 35.9 | Very low | 40.7 | Very low | 104 Ų | 104 | 141.3 Ų | 141.3 | 86% | 0.86 | 82% | 0.817 | S | S | * | * | | | trans | 34.3 | 126.1 | 141.2 | 0 | 0 | 0 | 0 | 0 | 123.4 | | |
| 75 | A | 34.7 | Very low | 39.6 | Very low | 98 Ų | 98 | 135.3 Ų | 135.3 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | | | | 162.9 | 135 | 100.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | | |
| 76 | S | 30.5 | Very low | 38.5 | Very low | 115 Ų | 115 | 133.4 Ų | 133.4 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | | | trans | 73.1 | 121.5 | 160.6 | -139.9 | 0 | 0 | 0 | 0 | 117 | | |
| 77 | V | 34.5 | Very low | 37.5 | Very low | 129 Ų | 129 | 129.2 Ų | 129.2 | 78% | 0.782 | 81% | 0.806 | S | S | * | * | | | | -159.6 | 140.8 | 54.8 | -131.4 | 0 | 0 | 0 | 0 | 112.5 | | |
| 78 | S | 31.3 | Very low | 36.4 | Very low | 111 Ų | 111 | 128.5 Ų | 128.5 | 78% | 0.776 | 81% | 0.808 | S | S | * | * | | | trans | 59.1 | 98.7 | 155.5 | -76.1 | 0 | 0 | 0 | 0 | 123.8 | | |
| 79 | S | 29 | Very low | 36 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | | | | 19.2 | 121 | 126.5 | -51.3 | 0 | 0 | 0 | 0 | 121.4 | | |
| 80 | L | 30.7 | Very low | 35.4 | Very low | 177 Ų | 177 | 124.1 Ų | 124.1 | 93% | 0.927 | 80% | 0.8 | S | S | * | * | | | | -137.4 | 122.1 | 123.3 | -171.5 | 61.5 | 0 | 0 | 0 | 109.1 | | |
| 81 | A | 34.6 | Very low | 35.4 | Very low | 83 Ų | 83 | 121.6 Ų | 121.6 | 69% | 0.686 | 79% | 0.789 | S | S | * | * | | | trans | -73.2 | 138.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 82 | V | 35.7 | Very low | 34.7 | Very low | 136 Ų | 136 | 119.9 Ų | 119.9 | 82% | 0.824 | 79% | 0.786 | S | S | * | * | | | | -153.5 | 116.4 | 126.5 | 178.7 | 0 | 0 | 0 | 0 | 107.7 | | |
| 83 | T | 34.9 | Very low | 35.2 | Very low | 130 Ų | 130 | 119 Ų | 119 | 80% | 0.798 | 78% | 0.779 | S | S | * | * | | | trans | -132.1 | 147.2 | 153.7 | -12.1 | 0 | 0 | 0 | 0 | 107.4 | | |
| 84 | P | 38.5 | Very low | 35.5 | Very low | 116 Ų | 116 | 121 Ų | 121 | 75% | 0.753 | 78% | 0.777 | S | S | * | * | | | | -126.9 | 126.1 | 108.9 | 23.2 | -8 | 0 | 0 | 0 | 109.9 | | |
| 85 | A | 35.4 | Very low | 36.1 | Very low | 77 Ų | 77 | 121.2 Ų | 121.2 | 64% | 0.636 | 77% | 0.769 | S | S | * | * | | | | 56.8 | 135.5 | 93.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 86 | T | 33 | Very low | 37.1 | Very low | 133 Ų | 133 | 123 Ų | 123 | 82% | 0.816 | 77% | 0.769 | S | S | * | * | | | cis | -172.8 | 159 | -9.9 | 25.6 | 0 | 0 | 0 | 0 | 105.8 | | |
| 87 | A | 35.5 | Very low | 38.1 | Very low | 89 Ų | 89 | 122.6 Ų | 122.6 | 74% | 0.736 | 76% | 0.762 | S | S | * | * | | | trans | 72.6 | 111.3 | 158.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | | |
| 88 | T | 31.4 | Very low | 38.9 | Very low | 136 Ų | 136 | 125.2 Ų | 125.2 | 83% | 0.834 | 76% | 0.763 | S | S | * | * | | | | -166.5 | 139 | 93.9 | 18.4 | 0 | 0 | 0 | 0 | 110.6 | S90 | T88-S90 PolarHBondContact O-N 2.79Š|
| 89 | D | 38.6 | Very low | 40.1 | Very low | 162 Ų | 162 | 123.8 Ų | 123.8 | 87% | 0.866 | 76% | 0.758 | S | S | * | * | | | trans | -42 | 117.3 | 160.6 | -176.8 | 20.2 | 0 | 0 | 0 | 111.7 | | |
| 90 | S | 38.2 | Very low | 41.3 | Very low | 89 Ų | 89 | 126.9 Ų | 126.9 | 62% | 0.622 | 76% | 0.756 | S | S | * | * | | | trans | -150.8 | 117.8 | 153.9 | 72.7 | 0 | 0 | 0 | 0 | 108.8 | T88 D92 | T88-S90 PolarHBondContact O-N 2.79Å; S90-D92 PolarHBondContact O-N 2.68Å |
| 91 | S | 41.3 | Very low | 42.5 | Very low | 93 Ų | 93 | 121.1 Ų | 121.1 | 65% | 0.65 | 73% | 0.734 | S | S | * | * | | | trans | -36.7 | 102 | 167.4 | 59 | 0 | 0 | 0 | 0 | 112 | K93 | S91-K93 VanDerWaalsContact C-N 3.25Å; S91-K93 PolarHBondContact O-N 2.68Å |
| 92 | D | 35.4 | Very low | 43.9 | Very low | 152 Ų | 152 | 121.1 Ų | 121.1 | 81% | 0.813 | 73% | 0.725 | S | S | * | * | | | trans | -71.1 | 87.3 | 174 | -101.6 | -36.4 | 0 | 0 | 0 | 108.5 | S90 T94 | S90-D92 PolarHBondContact O-N 2.68Å; D92-T94 VanDerWaalsContact C-N 3.29Å; D92-T94 PolarHBondContact O-N 3.14Å |
| 93 | K | 47.1 | Very low | 45.2 | Very low | 176 Ų | 176 | 120.6 Ų | 120.6 | 77% | 0.765 | 71% | 0.714 | S | S | * | * | | | trans | -67.5 | 96.7 | 162.7 | -66.9 | -179 | -177.4 | 175.8 | 0 | 105.9 | S91 P95 | S91-K93 VanDerWaalsContact C-N 3.25Å; S91-K93 PolarHBondContact O-N 2.68Å; K93-P95 WeakPolarHBondContact O-CD 3.4Å; K93-P95 VanDerWaalsContact O-N 3.07Å |
| 94 | T | 38.3 | Very low | 47.2 | Very low | 115 Ų | 115 | 119.2 Ų | 119.2 | 71% | 0.706 | 71% | 0.705 | S | S | * | * | | | trans | -46.1 | 117.8 | 168.3 | 50.6 | 0 | 0 | 0 | 0 | 108.4 | D92 V96 | D92-T94 VanDerWaalsContact C-N 3.29Å; D92-T94 PolarHBondContact O-N 3.14Å; T94-V96 PolarHBondContact O-N 2.86Å |
| 95 | P | 49.5 | Very low | 49.2 | Very low | 108 Ų | 108 | 119.3 Ų | 119.3 | 70% | 0.701 | 70% | 0.698 | S | S | * | * | | | trans | -65.8 | 111.6 | 176.1 | 25.4 | -31.2 | 0 | 0 | 0 | 107.1 | K93 V97 | K93-P95 WeakPolarHBondContact O-CD 3.4Å; K93-P95 VanDerWaalsContact O-N 3.07Å; P95-V97 HydrophobicContact CB-CG2 4.01Å; P95-V97 HydrophobicContact CG-CG2 4.32Å; P95-V97 PolarHBondContact O-N 3.46Å |
| 96 | V | 54.8 | Low | 51.1 | Low | 134 Ų | 134 | 120.6 Ų | 120.6 | 81% | 0.812 | 69% | 0.692 | S | S | * | * | | | trans | -65.7 | 80.8 | 161.4 | 178.2 | 0 | 0 | 0 | 0 | 106 | T94 K98 | T94-V96 PolarHBondContact O-N 2.86Å; V96-K98 PolarHBondContact O-N 2.91Å |
| 97 | V | 51.8 | Low | 53.2 | Low | 107 Ų | 107 | 117.9 Ų | 117.9 | 65% | 0.648 | 67% | 0.673 | S | S | * | * | | | trans | -69.8 | 104.9 | 171 | -178.6 | 0 | 0 | 0 | 0 | 105.2 | P95 A99 | P95-V97 HydrophobicContact CB-CG2 4.01Å; P95-V97 HydrophobicContact CG-CG2 4.32Å; P95-V97 PolarHBondContact O-N 3.46Å; V97-A99 PolarHBondContact O-N 3.46Å |
| 98 | K | 52.3 | Low | 55.3 | Low | 184 Ų | 184 | 116.1 Ų | 116.1 | 80% | 0.8 | 66% | 0.655 | S | S | * | * | | | trans | -42.5 | 128.4 | 173.5 | -65.3 | -176.4 | -153.1 | 174.9 | 0 | 108.6 | V96 K100 | V96-K98 PolarHBondContact O-N 2.91Å; K98-K100 PolarHBondContact O-N 2.86Å |
| 99 | A | 55.5 | Low | 57.7 | Low | 81 Ų | 81 | 114.4 Ų | 114.4 | 67% | 0.669 | 64% | 0.64 | S | S | * | * | S | Bend | trans | -62 | 27.2 | -168.9 | 0 | 0 | 0 | 0 | 0 | 116.8 | V97 A101 T102 | V97-A99 PolarHBondContact O-N 3.46Å; A99-A101 VanDerWaalsContact C-N 3.32Å; A99-T102 PolarHBondContact O-OG1 3.26Å |
| 100 | K | 55 | Low | 59.8 | Low | 187 Ų | 187 | 111 Ų | 111 | 81% | 0.813 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | 0.5 | -179.8 | -160.3 | 164.5 | 177.2 | -177.9 | 0 | 113.6 | K98 | K98-K100 PolarHBondContact O-N 2.86Š|
| 101 | A | 56.3 | Low | 61.8 | Low | 56 Ų | 56 | 110 Ų | 110 | 46% | 0.463 | 61% | 0.611 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.1 | -21.4 | 175 | 0 | 0 | 0 | 0 | 0 | 113.6 | A99 I105 | A99-A101 VanDerWaalsContact C-N 3.32Å; A101-I105 WeakPolarHBondContact O-CD1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å |
| 102 | T | 63.4 | Low | 63.8 | Low | 82 Ų | 82 | 111.5 Ų | 111.5 | 50% | 0.503 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -75.7 | -31.4 | -180 | 57.2 | 0 | 0 | 0 | 0 | 112.3 | A99 V104 I105 M106 | A99-T102 PolarHBondContact O-OG1 3.26Å; T102-V104 PolarHBondContact O-N 2.87Å; T102-I105 PolarHBondContact O-N 3.4Å; T102-M106 VanDerWaalsContact O-CB 3.24Å; T102-M106 WeakPolarHBondContact O-CB 3.21Å; T102-M106 WeakPolarHBondContact O-CG 3.5Å; T102-M106 PolarHBondContact O-N 3.44Å |
| 103 | H | 63.7 | Low | 66.2 | Low | 125 Ų | 125 | 110.5 Ų | 110.5 | 58% | 0.579 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -61.3 | -40.9 | 178.9 | -177.7 | -83.7 | 0 | 0 | 0 | 112.5 | N107 | H103-N107 WeakPolarHBondContact O-CB 3.34Å; H103-N107 PolarHBondContact O-N 3.01Å |
| 104 | V | 76.3 | Confident | 68.1 | Low | 102 Ų | 102 | 105.4 Ų | 105.4 | 62% | 0.618 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -68.5 | -41.4 | 178.6 | 178.8 | 0 | 0 | 0 | 0 | 110.7 | T102 S108 | T102-V104 PolarHBondContact O-N 2.87Å; V104-S108 WeakPolarHBondContact O-CB 3.39Å; V104-S108 PolarHBondContact O-N 2.98Å |
| 105 | I | 80.7 | Confident | 70.4 | Confident | 118 Ų | 118 | 106.5 Ų | 106.5 | 61% | 0.605 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -67.2 | -43.9 | 178.8 | -61.4 | 168.3 | 0 | 0 | 0 | 110.6 | A101 T102 S108 L109 | A101-I105 WeakPolarHBondContact O-CD1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.17Å; T102-I105 PolarHBondContact O-N 3.4Å; I105-S108 PolarHBondContact O-N 3.17Å; I105-L109 WeakPolarHBondContact O-CB 3.33Å; I105-L109 PolarHBondContact O-N 3.17Å |
| 106 | M | 76 | Confident | 72 | Confident | 104 Ų | 104 | 105.7 Ų | 105.7 | 51% | 0.512 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -68.1 | -44 | 178.5 | -71.8 | -67.2 | -65.5 | 0 | 0 | 112.1 | T102 S108 L109 I110 | T102-M106 VanDerWaalsContact O-CB 3.24Å; T102-M106 WeakPolarHBondContact O-CB 3.21Å; T102-M106 WeakPolarHBondContact O-CG 3.5Å; T102-M106 PolarHBondContact O-N 3.44Å; M106-S108 VanDerWaalsContact C-N 3.33Å; M106-L109 PolarHBondContact O-N 3.33Å; M106-I110 WeakPolarHBondContact O-CB 3.12Å; M106-I110 WeakPolarHBondContact O-CD1 3.17Å; M106-I110 WeakPolarHBondContact O-CG1 3.22Å; M106-I110 PolarHBondContact O-N 2.86Å |
| 107 | N | 76.3 | Confident | 73.4 | Confident | 76 Ų | 76 | 102.8 Ų | 102.8 | 41% | 0.406 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -66.8 | -38.1 | 177.3 | -160.1 | -50.6 | 0 | 0 | 0 | 110.5 | H103 I110 T111 | H103-N107 WeakPolarHBondContact O-CB 3.34Å; H103-N107 PolarHBondContact O-N 3.01Å; N107-I110 PolarHBondContact O-N 2.95Å; N107-T111 VanDerWaalsContact O-CB 3.31Å; N107-T111 WeakPolarHBondContact O-CB 3.41Å; N107-T111 VanDerWaalsContact O-CG2 3.23Å; N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.09Å; N107-T111 PolarHBondContact O-OG1 3.3Å; N107-T111 WeakPolarHBondContact OD1-CG2 3.31Å |
| 108 | S | 79.1 | Confident | 74.9 | Confident | 51 Ų | 51 | 101.7 Ų | 101.7 | 36% | 0.357 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.7 | -43 | 170.7 | -178.1 | 0 | 0 | 0 | 0 | 112.4 | V104 I105 M106 T111 K112 | V104-S108 WeakPolarHBondContact O-CB 3.39Å; V104-S108 PolarHBondContact O-N 2.98Å; I105-S108 PolarHBondContact O-N 3.17Å; M106-S108 VanDerWaalsContact C-N 3.33Å; S108-T111 WeakPolarHBondContact CA-OG1 3.23Å; S108-T111 PolarHBondContact O-OG1 3.02Å; S108-K112 VanDerWaalsContact O-CB 3.22Å; S108-K112 WeakPolarHBondContact O-CB 3.1Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.42Å; S108-K112 PolarHBondContact O-N 3.29Å |
| 109 | L | 83.1 | Confident | 76.5 | Confident | 100 Ų | 100 | 97 Ų | 97 | 52% | 0.524 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.9 | -46.7 | 176.7 | -177.2 | 63.5 | 0 | 0 | 0 | 111.7 | I105 M106 Q113 | I105-L109 WeakPolarHBondContact O-CB 3.33Å; I105-L109 PolarHBondContact O-N 3.17Å; M106-L109 PolarHBondContact O-N 3.33Å; L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 PolarHBondContact O-N 2.82Å |
| 110 | I | 82.1 | Confident | 77.8 | Confident | 91 Ų | 91 | 100.6 Ų | 100.6 | 47% | 0.467 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.7 | -44.8 | 179.8 | -66.8 | 162.1 | 0 | 0 | 0 | 110.6 | M106 N107 T114 | M106-I110 WeakPolarHBondContact O-CB 3.12Å; M106-I110 WeakPolarHBondContact O-CD1 3.17Å; M106-I110 WeakPolarHBondContact O-CG1 3.22Å; M106-I110 PolarHBondContact O-N 2.86Å; N107-I110 PolarHBondContact O-N 2.95Å; I110-T114 WeakPolarHBondContact O-CB 3.08Å; I110-T114 PolarHBondContact O-N 3.43Å; I110-T114 PolarHBondContact O-OG1 3.19Å |
| 111 | T | 80.3 | Confident | 79 | Confident | 68 Ų | 68 | 98.6 Ų | 98.6 | 42% | 0.417 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -68.1 | -43.5 | 179.4 | 51.3 | 0 | 0 | 0 | 0 | 111.5 | N107 S108 T114 Q115 | N107-T111 VanDerWaalsContact O-CB 3.31Å; N107-T111 WeakPolarHBondContact O-CB 3.41Å; N107-T111 VanDerWaalsContact O-CG2 3.23Å; N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.09Å; N107-T111 PolarHBondContact O-OG1 3.3Å; N107-T111 WeakPolarHBondContact OD1-CG2 3.31Å; S108-T111 WeakPolarHBondContact CA-OG1 3.23Å; S108-T111 PolarHBondContact O-OG1 3.02Å; T111-T114 PolarHBondContact O-N 2.83Å; T111-Q115 WeakPolarHBondContact O-CB 3.45Å; T111-Q115 PolarHBondContact O-N 3.48Å |
| 112 | K | 83.8 | Confident | 80.3 | Confident | 125 Ų | 125 | 99.3 Ų | 99.3 | 54% | 0.543 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.8 | -46 | 174.5 | -76.4 | -170.4 | 172.9 | -166.1 | 0 | 112.2 | S108 T114 Q115 E116 | S108-K112 VanDerWaalsContact O-CB 3.22Å; S108-K112 WeakPolarHBondContact O-CB 3.1Å; S108-K112 VanDerWaalsContact O-CG 3.27Å; S108-K112 WeakPolarHBondContact O-CG 3.42Å; S108-K112 PolarHBondContact O-N 3.29Å; K112-T114 VanDerWaalsContact C-N 3.31Å; K112-T114 PolarHBondContact O-N 3.26Å; K112-Q115 PolarHBondContact O-N 3.48Å; K112-E116 WeakPolarHBondContact O-CB 3.11Å; K112-E116 WeakPolarHBondContact O-CG 3.46Å; K112-E116 PolarHBondContact O-N 3.17Å |
| 113 | Q | 85.4 | Confident | 81.1 | Confident | 130 Ų | 130 | 99.7 Ų | 99.7 | 61% | 0.607 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -61.5 | -42.3 | 177.5 | -176.4 | -178.6 | 0.4 | 0 | 0 | 111.2 | L109 S117 | L109-Q113 WeakPolarHBondContact O-CB 3.2Å; L109-Q113 PolarHBondContact O-N 2.82Å; Q113-S117 WeakPolarHBondContact O-CB 3.44Å; Q113-S117 PolarHBondContact O-N 2.87Å |
| 114 | T | 86.1 | Confident | 81.8 | Confident | 69 Ų | 69 | 102 Ų | 102 | 42% | 0.423 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.2 | -43.9 | 178.8 | -57.8 | 0 | 0 | 0 | 0 | 111 | I110 T111 K112 S117 I118 | I110-T114 WeakPolarHBondContact O-CB 3.08Å; I110-T114 PolarHBondContact O-N 3.43Å; I110-T114 PolarHBondContact O-OG1 3.19Å; T111-T114 PolarHBondContact O-N 2.83Å; K112-T114 VanDerWaalsContact C-N 3.31Å; K112-T114 PolarHBondContact O-N 3.26Å; T114-S117 PolarHBondContact O-N 2.99Å; T114-I118 HydrophobicContact CG2-CD1 3.71Å; T114-I118 HydrophobicContact CG2-CG1 4.37Å; T114-I118 WeakPolarHBondContact O-CB 3.27Å; T114-I118 VanDerWaalsContact O-CG1 3.25Å; T114-I118 WeakPolarHBondContact O-CG1 3.23Å; T114-I118 PolarHBondContact O-N 3.38Å |
| 115 | Q | 86.1 | Confident | 81.6 | Confident | 138 Ų | 138 | 100.2 Ų | 100.2 | 65% | 0.645 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.7 | -44.1 | 178.7 | -174.1 | 175.6 | 12.9 | 0 | 0 | 111.5 | T111 K112 Q119 | T111-Q115 WeakPolarHBondContact O-CB 3.45Å; T111-Q115 PolarHBondContact O-N 3.48Å; K112-Q115 PolarHBondContact O-N 3.48Å; Q115-Q119 WeakPolarHBondContact O-CB 3.46Å; Q115-Q119 PolarHBondContact O-N 2.82Å |
| 116 | E | 83.3 | Confident | 81.2 | Confident | 91 Ų | 91 | 97 Ų | 97 | 43% | 0.425 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -67.5 | -37.9 | 174.4 | -74.1 | -171.4 | -156.5 | 0 | 0 | 112 | K112 Q119 R120 | K112-E116 WeakPolarHBondContact O-CB 3.11Å; K112-E116 WeakPolarHBondContact O-CG 3.46Å; K112-E116 PolarHBondContact O-N 3.17Å; E116-Q119 PolarHBondContact O-N 2.84Å; E116-R120 WeakPolarHBondContact O-CB 3.39Å; E116-R120 WeakPolarHBondContact O-CG 3.37Å; E116-R120 PolarHBondContact O-N 3.25Å; E116-R120 IonicContact OE2-CZ 3.93Å; E116-R120 IonicContact OE2-NH2 2.97Å; E116-R120 PolarHBondContact OE2-NH2 3.01Å |
| 117 | S | 85 | Confident | 80.8 | Confident | 74 Ų | 74 | 97.6 Ų | 97.6 | 52% | 0.517 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.9 | -49 | 176.9 | -178.8 | 0 | 0 | 0 | 0 | 111.5 | Q113 T114 R120 F121 | Q113-S117 WeakPolarHBondContact O-CB 3.44Å; Q113-S117 PolarHBondContact O-N 2.87Å; T114-S117 PolarHBondContact O-N 2.99Å; S117-R120 PolarHBondContact O-N 2.86Å; S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.48Å |
| 118 | I | 84.1 | Confident | 80.6 | Confident | 83 Ų | 83 | 99.9 Ų | 99.9 | 43% | 0.426 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 176.6 | -68.5 | 168 | 0 | 0 | 0 | 109.9 | T114 R120 F121 E122 | T114-I118 HydrophobicContact CG2-CD1 3.71Å; T114-I118 HydrophobicContact CG2-CG1 4.37Å; T114-I118 WeakPolarHBondContact O-CB 3.27Å; T114-I118 VanDerWaalsContact O-CG1 3.25Å; T114-I118 WeakPolarHBondContact O-CG1 3.23Å; T114-I118 PolarHBondContact O-N 3.38Å; I118-R120 VanDerWaalsContact C-N 3.31Å; I118-R120 PolarHBondContact O-N 3.1Å; I118-F121 WeakPolarHBondContact O-CB 3.43Å; I118-F121 PolarHBondContact O-N 3.46Å; I118-F121 VanDerWaalsContact O-N 3.17Å; I118-E122 HydrophobicContact CG2-CG 4.31Å; I118-E122 WeakPolarHBondContact CG2-OE1 3.29Å; I118-E122 WeakPolarHBondContact O-CB 3.49Å; I118-E122 VanDerWaalsContact O-CG 3.29Å; I118-E122 WeakPolarHBondContact O-CG 3.47Å; I118-E122 PolarHBondContact O-N 3.35Å |
| 119 | Q | 84.1 | Confident | 79.5 | Confident | 87 Ų | 87 | 106 Ų | 106 | 41% | 0.407 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63 | -36.7 | 179.6 | -168.3 | -173.4 | 40.6 | 0 | 0 | 112.5 | Q115 E116 Q123 R128 | Q115-Q119 WeakPolarHBondContact O-CB 3.46Å; Q115-Q119 PolarHBondContact O-N 2.82Å; E116-Q119 PolarHBondContact O-N 2.84Å; Q119-Q123 WeakPolarHBondContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CG 3.36Å; Q119-Q123 PolarHBondContact O-N 3.43Å; Q119-R128 VanDerWaalsContact NE2-NH2 3.12Å |
| 120 | R | 82.8 | Confident | 78.4 | Confident | 156 Ų | 156 | 104.8 Ų | 104.8 | 59% | 0.589 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -71.1 | -40.3 | 174.3 | -72.6 | 174.9 | -161.4 | -159.3 | 9.5 | 111.6 | E116 S117 I118 E122 Q123 Q124 | E116-R120 WeakPolarHBondContact O-CB 3.39Å; E116-R120 WeakPolarHBondContact O-CG 3.37Å; E116-R120 PolarHBondContact O-N 3.25Å; E116-R120 IonicContact OE2-CZ 3.93Å; E116-R120 IonicContact OE2-NH2 2.97Å; E116-R120 PolarHBondContact OE2-NH2 3.01Å; S117-R120 PolarHBondContact O-N 2.86Å; I118-R120 VanDerWaalsContact C-N 3.31Å; I118-R120 PolarHBondContact O-N 3.1Å; R120-E122 VanDerWaalsContact C-N 3.34Å; R120-Q123 PolarHBondContact O-N 2.64Å; R120-Q124 VanDerWaalsContact O-CB 3.31Å; R120-Q124 WeakPolarHBondContact O-CB 3.42Å; R120-Q124 PolarHBondContact O-N 3.26Å |
| 121 | F | 81.1 | Confident | 77.3 | Confident | 144 Ų | 144 | 103.4 Ų | 103.4 | 63% | 0.632 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.1 | -45.6 | 174 | 172.6 | -98.2 | 0 | 0 | 0 | 111 | S117 I118 Q123 Q124 A125 | S117-F121 WeakPolarHBondContact O-CB 3.25Å; S117-F121 PolarHBondContact O-N 3.48Å; I118-F121 WeakPolarHBondContact O-CB 3.43Å; I118-F121 PolarHBondContact O-N 3.46Å; I118-F121 VanDerWaalsContact O-N 3.17Å; F121-Q123 PolarHBondContact O-N 3.47Å; F121-Q124 PolarHBondContact O-N 3.19Å; F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.39Å |
| 122 | E | 83.7 | Confident | 76 | Confident | 71 Ų | 71 | 107.2 Ų | 107.2 | 33% | 0.332 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -61 | -42.6 | 174.9 | -74.2 | 171.7 | 176.8 | 0 | 0 | 112 | I118 R120 A125 G126 L127 | I118-E122 HydrophobicContact CG2-CG 4.31Å; I118-E122 WeakPolarHBondContact CG2-OE1 3.29Å; I118-E122 WeakPolarHBondContact O-CB 3.49Å; I118-E122 VanDerWaalsContact O-CG 3.29Å; I118-E122 WeakPolarHBondContact O-CG 3.47Å; I118-E122 PolarHBondContact O-N 3.35Å; R120-E122 VanDerWaalsContact C-N 3.34Å; E122-A125 PolarHBondContact O-N 3.49Å; E122-G126 PolarHBondContact O-N 3.27Å; E122-G126 VanDerWaalsContact O-N 3.09Å; E122-L127 PolarHBondContact O-N 3Å |
| 123 | Q | 80.9 | Confident | 74.9 | Confident | 90 Ų | 90 | 107.1 Ų | 107.1 | 42% | 0.421 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.8 | -44.9 | 174.1 | -75.1 | 171 | 28.8 | 0 | 0 | 112.3 | Q119 R120 F121 A125 G126 R128 | Q119-Q123 WeakPolarHBondContact O-CB 3.26Å; Q119-Q123 WeakPolarHBondContact O-CG 3.36Å; Q119-Q123 PolarHBondContact O-N 3.43Å; R120-Q123 PolarHBondContact O-N 2.64Å; F121-Q123 PolarHBondContact O-N 3.47Å; Q123-A125 VanDerWaalsContact C-N 3.31Å; Q123-A125 PolarHBondContact O-N 3.38Å; Q123-G126 PolarHBondContact O-N 2.96Å; Q123-R128 HydrophobicContact CG-CG 4.35Å; Q123-R128 VanDerWaalsContact NE2-CZ 3.28Å |
| 124 | Q | 78.1 | Confident | 73.6 | Confident | 175 Ų | 175 | 103.3 Ų | 103.3 | 82% | 0.818 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -65.6 | -35.6 | 179 | -168.7 | 79.6 | 15.6 | 0 | 0 | 111.6 | R120 F121 G126 | R120-Q124 VanDerWaalsContact O-CB 3.31Å; R120-Q124 WeakPolarHBondContact O-CB 3.42Å; R120-Q124 PolarHBondContact O-N 3.26Å; F121-Q124 PolarHBondContact O-N 3.19Å; Q124-G126 VanDerWaalsContact C-N 3.28Å |
| 125 | A | 71.6 | Confident | 72.4 | Confident | 63 Ų | 63 | 106 Ų | 106 | 52% | 0.521 | 56% | 0.561 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -82.8 | -1.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | F121 E122 Q123 L127 | F121-A125 VanDerWaalsContact O-CB 3.23Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.39Å; E122-A125 PolarHBondContact O-N 3.49Å; Q123-A125 VanDerWaalsContact C-N 3.31Å; Q123-A125 PolarHBondContact O-N 3.38Å; A125-L127 PolarHBondContact O-N 3.02Å |
| 126 | G | 71.5 | Confident | 71.2 | Confident | 50 Ų | 50 | 110.1 Ų | 110.1 | 52% | 0.515 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 67 | 17.3 | -177.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | E122 Q123 Q124 R128 | E122-G126 PolarHBondContact O-N 3.27Å; E122-G126 VanDerWaalsContact O-N 3.09Å; Q123-G126 PolarHBondContact O-N 2.96Å; Q124-G126 VanDerWaalsContact C-N 3.28Å; G126-R128 PolarHBondContact O-N 2.93Å |
| 127 | L | 68.9 | Low | 70 | Confident | 118 Ų | 118 | 108.9 Ų | 108.9 | 62% | 0.618 | 59% | 0.589 | S | S | * | * | | | trans | -93.9 | 59 | -178.7 | -167.4 | 70.7 | 0 | 0 | 0 | 110.1 | E122 A125 | E122-L127 PolarHBondContact O-N 3Å; A125-L127 PolarHBondContact O-N 3.02Å |
| 128 | R | 71.8 | Confident | 68.3 | Low | 123 Ų | 123 | 110 Ų | 110 | 46% | 0.464 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -94 | 160.7 | 166 | -60.1 | -145.9 | 105.1 | 168 | 4.7 | 109.9 | Q119 Q123 G126 A130 | Q119-R128 VanDerWaalsContact NE2-NH2 3.12Å; Q123-R128 HydrophobicContact CG-CG 4.35Å; Q123-R128 VanDerWaalsContact NE2-CZ 3.28Å; G126-R128 PolarHBondContact O-N 2.93Å; R128-A130 CarbonylContact O-C 3.25Å; R128-A130 VanDerWaalsContact O-C 3.25Å; R128-A130 PolarHBondContact O-N 3.2Å |
| 129 | D | 55.8 | Low | 66.6 | Low | 180 Ų | 180 | 110.8 Ų | 110.8 | 96% | 0.963 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -56.4 | -4.8 | 176.5 | -150 | 24.7 | 0 | 0 | 0 | 114.3 | G131 | D129-G131 PolarHBondContact O-N 3.2Š|
| 130 | A | 59.6 | Low | 65.2 | Low | 75 Ų | 75 | 111.7 Ų | 111.7 | 62% | 0.62 | 61% | 0.609 | S | S | * | * | S | Bend | trans | -84.3 | 98.5 | 159.4 | 0 | 0 | 0 | 0 | 0 | 107.7 | R128 | R128-A130 CarbonylContact O-C 3.25Å; R128-A130 VanDerWaalsContact O-C 3.25Å; R128-A130 PolarHBondContact O-N 3.2Å |
| 131 | G | 60.3 | Low | 64 | Low | 61 Ų | 61 | 110.7 Ų | 110.7 | 63% | 0.629 | 61% | 0.611 | S | S | * | * | | | trans | -38.6 | 147.1 | -175.8 | 0 | 0 | 0 | 0 | 0 | 115.1 | D129 T133 | D129-G131 PolarHBondContact O-N 3.2Å; G131-T133 PolarHBondContact O-N 3.14Å |
| 132 | Y | 52.4 | Low | 62.8 | Low | 149 Ų | 149 | 111.4 Ų | 111.4 | 58% | 0.584 | 62% | 0.616 | S | S | * | * | | | trans | -30.4 | 106.3 | 179.5 | -171.3 | -99.8 | 0 | 0 | 0 | 112.1 | P134 H135 L138 | Y132-P134 HydrophobicContact CD1-CB 4.28Å; Y132-P134 HydrophobicContact CD1-CG 3.93Å; Y132-P134 HydrophobicContact CE1-CB 3.9Å; Y132-P134 HydrophobicContact CE1-CG 4.03Å; Y132-P134 VanDerWaalsContact O-CD 3.26Å; Y132-P134 WeakPolarHBondContact O-CD 3.45Å; Y132-H135 PolarHBondContact OH-CE1 2.96Å; Y132-L138 HydrophobicContact CE1-CD2 4.42Å |
| 133 | T | 60.2 | Low | 61.5 | Low | 122 Ų | 122 | 111.3 Ų | 111.3 | 75% | 0.748 | 62% | 0.62 | S | S | * | * | | | trans | -88.1 | 105.5 | 169.7 | -32.5 | 0 | 0 | 0 | 0 | 105.9 | G131 H135 | G131-T133 PolarHBondContact O-N 3.14Å; T133-H135 PolarHBondContact O-N 3.46Å |
| 134 | P | 58.7 | Low | 60.3 | Low | 51 Ų | 51 | 113.7 Ų | 113.7 | 33% | 0.331 | 63% | 0.629 | S | S | . | * | | | trans | -59.2 | 128.9 | -176.6 | -17 | 30 | 0 | 0 | 0 | 108.5 | Y132 K136 L138 | Y132-P134 HydrophobicContact CD1-CB 4.28Å; Y132-P134 HydrophobicContact CD1-CG 3.93Å; Y132-P134 HydrophobicContact CE1-CB 3.9Å; Y132-P134 HydrophobicContact CE1-CG 4.03Å; Y132-P134 VanDerWaalsContact O-CD 3.26Å; Y132-P134 WeakPolarHBondContact O-CD 3.45Å; P134-K136 PolarHBondContact O-N 3.46Å; P134-L138 HydrophobicContact CB-CB 4.28Å |
| 135 | H | 60 | Low | 59.1 | Low | 124 Ų | 124 | 114.8 Ų | 114.8 | 57% | 0.574 | 63% | 0.627 | S | S | * | * | | | trans | -53.3 | 139.8 | 164.4 | 52.6 | -77.2 | 0 | 0 | 0 | 107.8 | Y132 T133 G137 L138 | Y132-H135 PolarHBondContact OH-CE1 2.96Å; T133-H135 PolarHBondContact O-N 3.46Å; H135-G137 PolarHBondContact O-N 3.27Å; H135-L138 PolarHBondContact O-N 3.39Å |
| 136 | K | 61.2 | Low | 58.4 | Low | 225 Ų | 225 | 118.1 Ų | 118.1 | 98% | 0.978 | 64% | 0.636 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.9 | 69.4 | -167.2 | -63.2 | -166.7 | 178.4 | -164.3 | 0 | 114.1 | P134 | P134-K136 PolarHBondContact O-N 3.46Š|
| 137 | G | 58.1 | Low | 57.7 | Low | 66 Ų | 66 | 125.1 Ų | 125.1 | 68% | 0.68 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 179.8 | -12.3 | -175.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | H135 | H135-G137 PolarHBondContact O-N 3.27Š|
| 138 | L | 48.5 | Very low | 57.3 | Low | 96 Ų | 96 | 124.4 Ų | 124.4 | 50% | 0.503 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -92.2 | 116.5 | 176.5 | -145.2 | 69.7 | 0 | 0 | 0 | 110.6 | Y132 P134 H135 | Y132-L138 HydrophobicContact CE1-CD2 4.42Å; P134-L138 HydrophobicContact CB-CB 4.28Å; H135-L138 PolarHBondContact O-N 3.39Å |
| 139 | T | 48.9 | Very low | 56.7 | Low | 100 Ų | 100 | 120.8 Ų | 120.8 | 61% | 0.613 | 64% | 0.643 | S | S | * | * | | | trans | -61.5 | 134.2 | -173.9 | 51 | 0 | 0 | 0 | 0 | 111.5 | E141 | T139-E141 PolarHBondContact O-N 3.24Å; T139-E141 PolarHBondContact OG1-OE1 2.71Å |
| 140 | T | 55 | Low | 56.9 | Low | 106 Ų | 106 | 117.5 Ų | 117.5 | 65% | 0.65 | 62% | 0.622 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.5 | 27.2 | -167.5 | 51.9 | 0 | 0 | 0 | 0 | 114.7 | | |
| 141 | E | 58.1 | Low | 56.8 | Low | 135 Ų | 135 | 116.5 Ų | 116.5 | 63% | 0.631 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | -23.3 | -172.4 | 64.1 | -165.9 | 143.7 | 0 | 0 | 114.3 | T139 | T139-E141 PolarHBondContact O-N 3.24Å; T139-E141 PolarHBondContact OG1-OE1 2.71Å |
| 142 | E | 55.4 | Low | 56.7 | Low | 160 Ų | 160 | 119.2 Ų | 119.2 | 75% | 0.748 | 61% | 0.613 | S | S | * | * | S | Bend | trans | -95.7 | -16.1 | -175.6 | -58.6 | -175.9 | 157.2 | 0 | 0 | 114 | K144 | E142-K144 PolarHBondContact O-N 3.47Š|
| 143 | T | 56.6 | Low | 57.1 | Low | 68 Ų | 68 | 118.4 Ų | 118.4 | 42% | 0.417 | 62% | 0.615 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -84.5 | -1.5 | -174.7 | 55.2 | 0 | 0 | 0 | 0 | 115 | | |
| 144 | K | 55.4 | Low | 56.9 | Low | 141 Ų | 141 | 118.7 Ų | 118.7 | 61% | 0.613 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.6 | -31.4 | -175.5 | -65.2 | 179.6 | -174.8 | 173.7 | 0 | 113 | E142 | E142-K144 PolarHBondContact O-N 3.47Å |
| 145 | Y | 53.4 | Low | 56.9 | Low | 197 Ų | 197 | 122.2 Ų | 122.2 | 77% | 0.773 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -77.9 | -31.5 | -177.9 | -67.4 | -79.5 | 0 | 0 | 0 | 113.2 | | |
| 146 | L | 57.3 | Low | 56.7 | Low | 134 Ų | 134 | 124.5 Ų | 124.5 | 70% | 0.702 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -69.6 | -37 | 177.1 | -71.3 | 171.1 | 0 | 0 | 0 | 112.5 | V148 A149 E150 | L146-V148 PolarHBondContact O-N 3.33Å; L146-A149 PolarHBondContact O-N 3.38Å; L146-E150 PolarHBondContact O-N 3.32Å |
| 147 | R | 56.6 | Low | 56.6 | Low | 197 Ų | 197 | 120.9 Ų | 120.9 | 74% | 0.743 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -65 | -35.8 | 180 | -173.9 | 177.4 | -67.4 | -166.9 | -1.2 | 113.3 | A151 | R147-A151 PolarHBondContact O-N 3.46Å |
| 148 | V | 59.7 | Low | 56.4 | Low | 102 Ų | 102 | 126 Ų | 126 | 62% | 0.618 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72.6 | -37.3 | -179.6 | 178.1 | 0 | 0 | 0 | 0 | 111.2 | L146 L152 | L146-V148 PolarHBondContact O-N 3.33Å; V148-L152 PolarHBondContact O-N 3.46Å |
| 149 | A | 59.8 | Low | 56.6 | Low | 47 Ų | 47 | 126.5 Ų | 126.5 | 39% | 0.388 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -66.1 | -40.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | L146 L152 H153 | L146-A149 PolarHBondContact O-N 3.38Å; A149-L152 PolarHBondContact O-N 3.4Å; A149-H153 PolarHBondContact O-CD2 3.15Å; A149-H153 PolarHBondContact O-N 3.37Å |
| 150 | E | 58.8 | Low | 56.8 | Low | 112 Ų | 112 | 124.5 Ų | 124.5 | 52% | 0.523 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -68.9 | -36.5 | 179.1 | -149.8 | -167.8 | 152.1 | 0 | 0 | 112.7 | L146 L152 H153 K154 | L146-E150 PolarHBondContact O-N 3.32Å; E150-L152 VanDerWaalsContact C-N 3.34Å; E150-L152 PolarHBondContact O-N 3.01Å; E150-H153 PolarHBondContact O-N 3.29Å; E150-K154 WeakPolarHBondContact O-CG 3.45Å; E150-K154 PolarHBondContact O-N 3.18Å; E150-K154 WeakPolarHBondContact OE1-CE 3.34Å; E150-K154 IonicContact OE1-NZ 3.69Å |
| 151 | A | 59 | Low | 56.2 | Low | 53 Ų | 53 | 128.6 Ų | 128.6 | 44% | 0.438 | 65% | 0.648 | S | S | . | * | H | α-helix | trans | -63.7 | -38.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | R147 H153 K154 L155 | R147-A151 PolarHBondContact O-N 3.46Å; A151-H153 VanDerWaalsContact C-N 3.34Å; A151-K154 PolarHBondContact O-N 3.33Å; A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.15Å |
| 152 | L | 57.4 | Low | 55.4 | Low | 118 Ų | 118 | 128.6 Ų | 128.6 | 62% | 0.618 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -67.3 | -36.8 | 177.2 | -129.3 | 170.7 | 0 | 0 | 0 | 111.5 | V148 A149 E150 K156 | V148-L152 PolarHBondContact O-N 3.46Å; A149-L152 PolarHBondContact O-N 3.4Å; E150-L152 VanDerWaalsContact C-N 3.34Å; E150-L152 PolarHBondContact O-N 3.01Å; L152-K156 PolarHBondContact O-N 3.18Å |
| 153 | H | 60 | Low | 54.4 | Low | 133 Ų | 133 | 126.7 Ų | 126.7 | 62% | 0.616 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -72 | -35.6 | 177.5 | -66.6 | -177.4 | 0 | 0 | 0 | 112.3 | A149 E150 A151 K156 L157 | A149-H153 PolarHBondContact O-CD2 3.15Å; A149-H153 PolarHBondContact O-N 3.37Å; E150-H153 PolarHBondContact O-N 3.29Å; A151-H153 VanDerWaalsContact C-N 3.34Å; H153-K156 PolarHBondContact O-N 3.5Å; H153-L157 WeakPolarHBondContact O-CG 3.43Å; H153-L157 PolarHBondContact O-N 3.44Å |
| 154 | K | 57.7 | Low | 53.5 | Low | 127 Ų | 127 | 134.3 Ų | 134.3 | 55% | 0.552 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -68.7 | -39.8 | 175.9 | -73.3 | 177.5 | -171.3 | -87.1 | 0 | 112.9 | E150 A151 K156 L157 Q158 | E150-K154 WeakPolarHBondContact O-CG 3.45Å; E150-K154 PolarHBondContact O-N 3.18Å; E150-K154 WeakPolarHBondContact OE1-CE 3.34Å; E150-K154 IonicContact OE1-NZ 3.69Å; A151-K154 PolarHBondContact O-N 3.33Å; K154-K156 VanDerWaalsContact C-N 3.31Å; K154-K156 PolarHBondContact O-N 2.95Å; K154-L157 PolarHBondContact O-N 2.93Å; K154-Q158 PolarHBondContact O-N 3.41Å |
| 155 | L | 57.8 | Low | 52.7 | Low | 126 Ų | 126 | 135.1 Ų | 135.1 | 66% | 0.66 | 68% | 0.684 | S | S | * | * | H | α-helix | trans | -63.6 | -35.8 | 175.3 | -104.6 | 155.1 | 0 | 0 | 0 | 112.6 | A151 L157 Q158 S159 | A151-L155 PolarHBondContact O-N 3.21Å; A151-L155 VanDerWaalsContact O-N 3.15Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å; L155-Q158 PolarHBondContact O-N 3.44Å; L155-S159 PolarHBondContact O-N 2.75Å |
| 156 | K | 56.8 | Low | 52 | Low | 172 Ų | 172 | 133.7 Ų | 133.7 | 75% | 0.748 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -70.3 | -27.2 | 179.8 | -170.1 | 154.9 | 178.5 | 168 | 0 | 113.3 | L152 H153 K154 | L152-K156 PolarHBondContact O-N 3.18Å; H153-K156 PolarHBondContact O-N 3.5Å; K154-K156 VanDerWaalsContact C-N 3.31Å; K154-K156 PolarHBondContact O-N 2.95Å |
| 157 | L | 58.6 | Low | 51.3 | Low | 149 Ų | 149 | 136 Ų | 136 | 78% | 0.78 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -84.6 | -23.9 | 177.6 | -65.7 | 175 | 0 | 0 | 0 | 113.5 | H153 K154 L155 | H153-L157 WeakPolarHBondContact O-CG 3.43Å; H153-L157 PolarHBondContact O-N 3.44Å; K154-L157 PolarHBondContact O-N 2.93Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 3.49Å |
| 158 | Q | 54.2 | Low | 51.2 | Low | 173 Ų | 173 | 132 Ų | 132 | 81% | 0.808 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -85.1 | -11.2 | 174.9 | -88.2 | -178.1 | -27.5 | 0 | 0 | 114.1 | K154 L155 G160 | K154-Q158 PolarHBondContact O-N 3.41Å; L155-Q158 PolarHBondContact O-N 3.44Å; Q158-G160 VanDerWaalsContact C-N 3.27Å; Q158-G160 PolarHBondContact O-N 3.46Å |
| 159 | S | 52 | Low | 50.6 | Low | 107 Ų | 107 | 133 Ų | 133 | 75% | 0.748 | 70% | 0.698 | S | S | * | * | S | Bend | trans | -87.8 | 21.3 | -177.9 | -171.7 | 0 | 0 | 0 | 0 | 114.2 | L155 | L155-S159 PolarHBondContact O-N 2.75Š|
| 160 | G | 52.9 | Low | 49.3 | Very low | 58 Ų | 58 | 135.2 Ų | 135.2 | 60% | 0.598 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -121.3 | 95.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112 | Q158 | Q158-G160 VanDerWaalsContact C-N 3.27Å; Q158-G160 PolarHBondContact O-N 3.46Å |
| 161 | E | 43.3 | Very low | 48.6 | Very low | 191 Ų | 191 | 135.9 Ų | 135.9 | 89% | 0.893 | 73% | 0.732 | S | S | * | * | | | trans | 71.8 | 83.3 | 145.3 | -150.9 | 156.5 | 163.8 | 0 | 0 | 118.7 | | |
| 162 | T | 41.5 | Very low | 47.6 | Very low | 136 Ų | 136 | 137.9 Ų | 137.9 | 83% | 0.834 | 75% | 0.749 | S | S | * | * | | | trans | -127 | 84 | 155.7 | 58.2 | 0 | 0 | 0 | 0 | 110.1 | | |
| 163 | T | 33.3 | Very low | 47 | Very low | 120 Ų | 120 | 141 Ų | 141 | 74% | 0.736 | 76% | 0.761 | S | S | * | * | | | trans | -156.3 | 103.4 | 164.6 | -65.7 | 0 | 0 | 0 | 0 | 110.9 | | |
| 164 | R | 38.7 | Very low | 46 | Very low | 227 Ų | 227 | 140 Ų | 140 | 86% | 0.857 | 77% | 0.769 | S | S | * | * | | | trans | 67.7 | 144.4 | 149.9 | -49.7 | -91.8 | -177.9 | -179.4 | -0.7 | 115.9 | | |
| 165 | E | 39 | Very low | 45.5 | Very low | 158 Ų | 158 | 139.3 Ų | 139.3 | 74% | 0.738 | 78% | 0.775 | S | S | * | * | | | cis | -173 | 145.1 | -8.8 | 179.3 | -179.5 | -136.4 | 0 | 0 | 104.6 | | |
| 166 | E | 38.5 | Very low | 45 | Very low | 167 Ų | 167 | 139.4 Ų | 139.4 | 78% | 0.78 | 78% | 0.783 | S | S | * | * | | | trans | 31.3 | 117 | 153 | -160.1 | -176.7 | 139 | 0 | 0 | 121.7 | | |
| 167 | K | 41.4 | Very low | 44.5 | Very low | 183 Ų | 183 | 136.5 Ų | 136.5 | 80% | 0.796 | 79% | 0.785 | S | S | * | * | | | | 145.2 | 126.7 | 128.5 | -168.2 | 152.2 | -173.1 | 156.4 | 0 | 114.3 | | |
| 168 | P | 54.3 | Low | 43.6 | Very low | 113 Ų | 113 | 134.5 Ų | 134.5 | 73% | 0.734 | 78% | 0.783 | S | S | * | * | | | trans | -92.6 | 154.1 | 165.3 | 36.4 | -29.1 | 0 | 0 | 0 | 110.4 | | |
| 169 | P | 47.4 | Very low | 43.3 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 81% | 0.805 | 78% | 0.776 | S | S | * | * | | | | -151.5 | 178.2 | 64.2 | 39.4 | -17.9 | 0 | 0 | 0 | 117.5 | | |
| 170 | A | 32.9 | Very low | 43.4 | Very low | 93 Ų | 93 | 132.2 Ų | 132.2 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | | | trans | 85.3 | 109.1 | 149.4 | 0 | 0 | 0 | 0 | 0 | 120.8 | | |
| 171 | S | 44.8 | Very low | 43.2 | Very low | 125 Ų | 125 | 138.2 Ų | 138.2 | 87% | 0.874 | 79% | 0.791 | S | S | * | * | | | | 41.3 | 107.2 | 126.9 | -153.4 | 0 | 0 | 0 | 0 | 119.4 | | |
| 172 | A | 36.8 | Very low | 43.5 | Very low | 96 Ų | 96 | 134.5 Ų | 134.5 | 79% | 0.793 | 79% | 0.786 | S | S | * | * | | | trans | -152.7 | 119.6 | 140.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | S174 | A172-S174 PolarHBondContact O-N 3.31Š|
| 173 | Q | 45.4 | Very low | 43.8 | Very low | 184 Ų | 184 | 132.9 Ų | 132.9 | 86% | 0.86 | 78% | 0.78 | S | S | * | * | | | trans | -49.9 | 116.4 | 165 | 173.1 | -176.4 | -30.6 | 0 | 0 | 111.2 | | |
| 174 | S | 38.3 | Very low | 44.9 | Very low | 112 Ų | 112 | 133 Ų | 133 | 78% | 0.783 | 78% | 0.784 | S | S | * | * | | | trans | -108.3 | 106.9 | 170 | 61.2 | 0 | 0 | 0 | 0 | 110.6 | A172 | A172-S174 PolarHBondContact O-N 3.31Š|
| 175 | T | 46.7 | Very low | 45.3 | Very low | 112 Ų | 112 | 131.7 Ų | 131.7 | 69% | 0.687 | 78% | 0.784 | S | S | * | * | | | trans | -61 | 131.7 | 167.6 | -33.7 | 0 | 0 | 0 | 0 | 109.8 | S177 | T175-S177 PolarHBondContact O-N 3.43Š|
| 176 | P | 47.9 | Very low | 45.9 | Very low | 127 Ų | 127 | 133.5 Ų | 133.5 | 83% | 0.825 | 79% | 0.792 | S | S | * | * | | | trans | -76.1 | 91.5 | 168.9 | 30 | -31.4 | 0 | 0 | 0 | 109.2 | | |
| 177 | S | 46.3 | Very low | 46.6 | Very low | 112 Ų | 112 | 134.9 Ų | 134.9 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | | | trans | -90.1 | 93.9 | 161.7 | -174 | 0 | 0 | 0 | 0 | 108 | T175 | T175-S177 PolarHBondContact O-N 3.43Š|
| 178 | S | 39.3 | Very low | 47.1 | Very low | 106 Ų | 106 | 131.8 Ų | 131.8 | 74% | 0.741 | 80% | 0.797 | S | S | * | * | | | trans | -126.6 | 93.7 | 168.2 | 174.4 | 0 | 0 | 0 | 0 | 107.2 | | |
| 179 | T | 48.9 | Very low | 47.2 | Very low | 107 Ų | 107 | 136.6 Ų | 136.6 | 66% | 0.656 | 80% | 0.801 | S | S | * | * | | | trans | -59.6 | 128.1 | 162 | 24.7 | 0 | 0 | 0 | 0 | 108.5 | H181 | T179-H181 PolarHBondContact O-N 3.21Å; T179-H181 VanDerWaalsContact O-N 3.09Å |
| 180 | P | 54.5 | Low | 47.1 | Very low | 125 Ų | 125 | 134 Ų | 134 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | | | trans | -66.5 | 115.5 | 174.2 | 25 | -30.4 | 0 | 0 | 0 | 108.7 | S182 | P180-S182 PolarHBondContact O-N 3.22Š|
| 181 | H | 48 | Very low | 48.1 | Very low | 184 Ų | 184 | 139.8 Ų | 139.8 | 85% | 0.852 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 127.8 | 173.1 | -89.7 | -82.1 | 0 | 0 | 0 | 110.1 | T179 | T179-H181 PolarHBondContact O-N 3.21Å; T179-H181 VanDerWaalsContact O-N 3.09Å |
| 182 | S | 48.8 | Very low | 48.6 | Very low | 114 Ų | 114 | 143.4 Ų | 143.4 | 80% | 0.797 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 137.4 | 175.2 | -173.6 | 0 | 0 | 0 | 0 | 112.8 | P180 | P180-S182 PolarHBondContact O-N 3.22Š|
| 183 | S | 49.1 | Very low | 49.3 | Very low | 101 Ų | 101 | 144.9 Ų | 144.9 | 71% | 0.706 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 136.3 | 176.9 | -56.8 | 0 | 0 | 0 | 0 | 113 | K185 | S183-K185 PolarHBondContact O-N 3.41Š|
| 184 | P | 55.2 | Low | 48.9 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 121.2 | 172.2 | -19.5 | 31.2 | 0 | 0 | 0 | 110.6 | Q186 | P184-Q186 PolarHBondContact O-N 3.29Å; P184-Q186 VanDerWaalsContact O-N 3.1Å |
| 185 | K | 48.7 | Very low | 49 | Very low | 198 Ų | 198 | 140.6 Ų | 140.6 | 86% | 0.861 | 80% | 0.803 | S | S | * | * | | | trans | -54 | 115 | 172.5 | -69.2 | 178.2 | 177.7 | 179.5 | 0 | 109.3 | S183 K187 | S183-K185 PolarHBondContact O-N 3.41Å; K185-K187 PolarHBondContact O-N 3.43Å |
| 186 | Q | 51.4 | Low | 48.7 | Very low | 197 Ų | 197 | 141.3 Ų | 141.3 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | | | trans | -66.3 | 106.9 | 169.7 | -68.2 | -147.5 | -22.6 | 0 | 0 | 109 | P184 | P184-Q186 PolarHBondContact O-N 3.29Å; P184-Q186 VanDerWaalsContact O-N 3.1Å |
| 187 | K | 52.3 | Low | 48.3 | Very low | 196 Ų | 196 | 140.2 Ų | 140.2 | 85% | 0.852 | 81% | 0.808 | S | S | * | * | | | trans | -76.1 | 117.4 | 161.6 | -67.8 | 176.9 | 177 | -178.6 | 0 | 106.2 | K185 R189 | K185-K187 PolarHBondContact O-N 3.43Å; K187-R189 PolarHBondContact O-N 3.24Å |
| 188 | S | 51.1 | Low | 47.8 | Very low | 118 Ų | 118 | 141.8 Ų | 141.8 | 83% | 0.825 | 81% | 0.812 | S | S | * | * | | | trans | -61.3 | 113.8 | 172.1 | 59 | 0 | 0 | 0 | 0 | 108.3 | G190 | S188-G190 VanDerWaalsContact C-N 3.32Å; S188-G190 PolarHBondContact O-N 3.39Å |
| 189 | R | 56.3 | Low | 47.6 | Very low | 213 Ų | 213 | 140.7 Ų | 140.7 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | | | trans | -74.4 | 92.4 | 168.8 | 178.8 | -179.8 | -71.2 | -85.2 | 2.5 | 106.4 | K187 W191 | K187-R189 PolarHBondContact O-N 3.24Å; R189-W191 PolarHBondContact O-N 3.43Å |
| 190 | G | 47 | Very low | 47.3 | Very low | 69 Ų | 69 | 143.5 Ų | 143.5 | 71% | 0.711 | 82% | 0.82 | S | S | * | * | | | trans | -62.1 | 125.8 | 173 | 0 | 0 | 0 | 0 | 0 | 110.6 | S188 | S188-G190 VanDerWaalsContact C-N 3.32Å; S188-G190 PolarHBondContact O-N 3.39Å |
| 191 | W | 52.7 | Low | 46.9 | Very low | 215 Ų | 215 | 143.3 Ų | 143.3 | 81% | 0.814 | 82% | 0.819 | S | S | * | * | | | trans | -102.5 | 67.7 | 173.8 | -89.2 | 14.9 | 0 | 0 | 0 | 109.9 | R189 | R189-W191 PolarHBondContact O-N 3.43Š|
| 192 | F | 56.8 | Low | 46.2 | Very low | 201 Ų | 201 | 138.1 Ų | 138.1 | 88% | 0.882 | 82% | 0.815 | S | S | * | * | | | trans | -154.2 | 129.2 | 159.9 | -66.8 | -68.6 | 0 | 0 | 0 | 109.2 | | |
| 193 | P | 49.6 | Very low | 45.9 | Very low | 128 Ų | 128 | 138.8 Ų | 138.8 | 83% | 0.831 | 82% | 0.816 | S | S | * | * | | | trans | -78.4 | 127.7 | 168.6 | 30.5 | -28.1 | 0 | 0 | 0 | 109.7 | | |
| 194 | S | 38.5 | Very low | 45.4 | Very low | 131 Ų | 131 | 141.6 Ų | 141.6 | 92% | 0.916 | 82% | 0.824 | S | S | * | * | | | trans | -59.4 | 133.4 | 168.2 | -73.3 | 0 | 0 | 0 | 0 | 111.7 | | |
| 195 | G | 40.4 | Very low | 45.1 | Very low | 75 Ų | 75 | 140.6 Ų | 140.6 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | | | trans | -124.8 | 126.9 | 158.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 196 | S | 39.9 | Very low | 44.4 | Very low | 127 Ų | 127 | 140.8 Ų | 140.8 | 89% | 0.888 | 82% | 0.821 | S | S | * | * | | | trans | -47.2 | 167.1 | 167.5 | -79.2 | 0 | 0 | 0 | 0 | 114.7 | | |
| 197 | S | 39.5 | Very low | 43.9 | Very low | 104 Ų | 104 | 137 Ų | 137 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | | | cis | 170.2 | 131.9 | -19.2 | 173.4 | 0 | 0 | 0 | 0 | 105.8 | | |
| 198 | T | 36.7 | Very low | 43.7 | Very low | 144 Ų | 144 | 136.5 Ų | 136.5 | 88% | 0.883 | 81% | 0.814 | S | S | * | * | | | trans | 173.1 | 140.5 | 154.5 | 42.5 | 0 | 0 | 0 | 0 | 107.9 | | |
| 199 | A | 34.5 | Very low | 43 | Very low | 83 Ų | 83 | 137.5 Ų | 137.5 | 69% | 0.686 | 81% | 0.81 | S | S | * | * | | | cis | -169.3 | 126.6 | -12.5 | 0 | 0 | 0 | 0 | 0 | 108.4 | | |
| 200 | L | 41.7 | Very low | 42.2 | Very low | 167 Ų | 167 | 132.6 Ų | 132.6 | 87% | 0.874 | 81% | 0.809 | S | S | * | * | | | trans | 61.8 | 166.8 | 145.8 | -49 | 179.5 | 0 | 0 | 0 | 121.6 | | |
| 201 | P | 46.7 | Very low | 41.6 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 79% | 0.786 | 81% | 0.811 | S | S | * | * | | | | -135.8 | 149.7 | -69 | 38.7 | -21.5 | 0 | 0 | 0 | 116.4 | | |
| 202 | G | 33.4 | Very low | 41 | Very low | 75 Ų | 75 | 128.6 Ų | 128.6 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | | | trans | 76.3 | 168.4 | 144.5 | 0 | 0 | 0 | 0 | 0 | 120.6 | | |
| 203 | P | 43.1 | Very low | 40.2 | Very low | 127 Ų | 127 | 122.7 Ų | 122.7 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | | | cis | -129.3 | 155.7 | -13.4 | 37.4 | -19.8 | 0 | 0 | 0 | 114.8 | | |
| 204 | N | 38.8 | Very low | 39.7 | Very low | 160 Ų | 160 | 123 Ų | 123 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | | | trans | -95.9 | 179 | 155.5 | -77.3 | -37.5 | 0 | 0 | 0 | 108.2 | | |
| 205 | P | 47.5 | Very low | 40.2 | Very low | 103 Ų | 103 | 124.2 Ų | 124.2 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | | | cis | -131.2 | 169.7 | -13.3 | 29.8 | -8.9 | 0 | 0 | 0 | 113.1 | | |
| 206 | H | 34.2 | Very low | 40.7 | Very low | 202 Ų | 202 | 129 Ų | 129 | 94% | 0.935 | 80% | 0.8 | S | S | * | * | | | trans | -124 | 118 | 155.6 | -83.5 | -66.9 | 0 | 0 | 0 | 112.1 | | |
| 207 | T | 41.4 | Very low | 41 | Very low | 119 Ų | 119 | 128.9 Ų | 128.9 | 73% | 0.73 | 79% | 0.79 | S | S | * | * | | | trans | -64.9 | 134.3 | 167.7 | -57.6 | 0 | 0 | 0 | 0 | 112.5 | | |
| 208 | M | 47.4 | Very low | 41.5 | Very low | 184 Ų | 184 | 130.3 Ų | 130.3 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | | | trans | -169.2 | 97.5 | 134.7 | -74.6 | -144.3 | -174.1 | 0 | 0 | 104.9 | | |
| 209 | D | 38.1 | Very low | 42.3 | Very low | 139 Ų | 139 | 125.9 Ų | 125.9 | 74% | 0.743 | 78% | 0.778 | S | S | * | * | | | | 33.6 | 101.3 | 84.7 | -163.2 | 29.7 | 0 | 0 | 0 | 115.7 | | |
| 210 | S | 38.6 | Very low | 43.1 | Very low | 111 Ų | 111 | 128.7 Ų | 128.7 | 78% | 0.776 | 78% | 0.781 | S | S | * | * | | | | 166.5 | 128.1 | 118 | -84.4 | 0 | 0 | 0 | 0 | 110.8 | | |
| 211 | G | 33.6 | Very low | 43.9 | Very low | 74 Ų | 74 | 130.2 Ų | 130.2 | 76% | 0.763 | 78% | 0.781 | S | S | * | * | | | trans | 133.8 | 76.7 | 147.2 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 212 | S | 39.9 | Very low | 43.9 | Very low | 125 Ų | 125 | 135.3 Ų | 135.3 | 87% | 0.874 | 79% | 0.785 | S | S | * | * | | | trans | 69.2 | 100.9 | 130 | -160.5 | 0 | 0 | 0 | 0 | 119.2 | | |
| 213 | G | 40.7 | Very low | 45.1 | Very low | 77 Ų | 77 | 136.3 Ų | 136.3 | 79% | 0.794 | 78% | 0.78 | S | S | * | * | | | | 67.8 | 102.4 | 124.2 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 214 | N | 38.3 | Very low | 45.6 | Very low | 134 Ų | 134 | 137.1 Ų | 137.1 | 72% | 0.717 | 78% | 0.777 | S | S | * | * | | | | 173.8 | 120.1 | 105.5 | -165.7 | 18 | 0 | 0 | 0 | 108.3 | K216 | N214-K216 PolarHBondContact O-N 2.94Š|
| 215 | D | 50 | Low | 46.4 | Very low | 158 Ų | 158 | 139.1 Ų | 139.1 | 85% | 0.845 | 78% | 0.778 | S | S | * | * | | | trans | -61 | 107.1 | 162.7 | -74.8 | -46.8 | 0 | 0 | 0 | 108.9 | | |
| 216 | K | 49.8 | Very low | 46.3 | Very low | 174 Ų | 174 | 137.2 Ų | 137.2 | 76% | 0.757 | 78% | 0.777 | S | S | * | * | | | trans | -164.3 | 111.4 | 156.8 | -104.5 | 143.8 | -175 | 176.9 | 0 | 111.4 | N214 | N214-K216 PolarHBondContact O-N 2.94Š|
| 217 | N | 47.9 | Very low | 47 | Very low | 126 Ų | 126 | 132.6 Ų | 132.6 | 67% | 0.674 | 77% | 0.774 | S | S | * | * | | | trans | 77.2 | 95 | 135.1 | -149.5 | 31.8 | 0 | 0 | 0 | 117.1 | A219 | N217-A219 WeakPolarHBondContact ND2-CB 3.17Å; N217-A219 PolarHBondContact O-N 3.4Å |
| 218 | S | 50.2 | Low | 47.6 | Very low | 134 Ų | 134 | 138 Ų | 138 | 94% | 0.937 | 78% | 0.781 | S | S | * | * | S | Bend | trans | -62.3 | 54.4 | 158.2 | 46 | 0 | 0 | 0 | 0 | 113.1 | | |
| 219 | A | 51.9 | Low | 47.7 | Very low | 51 Ų | 51 | 135.4 Ų | 135.4 | 42% | 0.421 | 78% | 0.778 | S | S | . | * | | | trans | -122.4 | 5.6 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | N217 K221 | N217-A219 WeakPolarHBondContact ND2-CB 3.17Å; N217-A219 PolarHBondContact O-N 3.4Å; A219-K221 PolarHBondContact O-N 2.99Å |
| 220 | D | 52.4 | Low | 47.9 | Very low | 141 Ų | 141 | 136.9 Ų | 136.9 | 75% | 0.754 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -91.1 | 9.8 | -177.4 | -73.2 | -26.7 | 0 | 0 | 0 | 114.9 | W222 | D220-W222 VanDerWaalsContact C-N 3.28Å; D220-W222 PolarHBondContact O-N 3.32Å |
| 221 | K | 57.9 | Low | 48.3 | Very low | 199 Ų | 199 | 139.4 Ų | 139.4 | 87% | 0.865 | 79% | 0.785 | S | S | * | * | G | 310 helix | trans | -81 | 6.9 | 178.1 | -82.1 | -169.2 | 170.5 | -159.3 | 0 | 115.6 | A219 | A219-K221 PolarHBondContact O-N 2.99Š|
| 222 | W | 45.7 | Very low | 48.9 | Very low | 229 Ų | 229 | 147 Ų | 147 | 87% | 0.867 | 79% | 0.79 | S | S | * | * | G | 310 helix | trans | -122 | 14.6 | 178.5 | -71 | 98.7 | 0 | 0 | 0 | 115.2 | D220 L224 | D220-W222 VanDerWaalsContact C-N 3.28Å; D220-W222 PolarHBondContact O-N 3.32Å; W222-L224 VanDerWaalsContact C-N 3.35Å; W222-L224 PolarHBondContact O-N 3.26Å; W222-L224 VanDerWaalsContact O-N 3.12Å |
| 223 | S | 59.1 | Low | 48.9 | Very low | 96 Ų | 96 | 145.8 Ų | 145.8 | 67% | 0.671 | 78% | 0.781 | S | S | * | * | | | trans | -87 | 72.6 | 172.9 | -80.4 | 0 | 0 | 0 | 0 | 111.7 | F225 | S223-F225 VanDerWaalsContact C-N 3.28Š|
| 224 | L | 53.6 | Low | 49.3 | Very low | 144 Ų | 144 | 150.1 Ų | 150.1 | 75% | 0.754 | 79% | 0.786 | S | S | * | * | | | trans | -87.5 | 11.7 | 171.2 | -96.9 | 154.9 | 0 | 0 | 0 | 113.9 | W222 | W222-L224 VanDerWaalsContact C-N 3.35Å; W222-L224 PolarHBondContact O-N 3.26Å; W222-L224 VanDerWaalsContact O-N 3.12Å |
| 225 | F | 55.3 | Low | 49.8 | Very low | 201 Ų | 201 | 148 Ų | 148 | 88% | 0.882 | 78% | 0.782 | S | S | * | * | | | trans | -137.6 | 76.5 | 167.3 | -64.4 | -79.6 | 0 | 0 | 0 | 110.1 | S223 | S223-F225 VanDerWaalsContact C-N 3.28Š|
| 226 | G | 45.5 | Very low | 49.9 | Very low | 64 Ų | 64 | 144.4 Ų | 144.4 | 66% | 0.66 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 140.8 | 165.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | R228 | G226-R228 PolarHBondContact O-N 2.96Š|
| 227 | A | 50 | Low | 49.9 | Very low | 105 Ų | 105 | 144.7 Ų | 144.7 | 87% | 0.868 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 118.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 228 | R | 52.6 | Low | 50 | Low | 233 Ų | 233 | 143.9 Ų | 143.9 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 141.2 | 168.5 | -67.9 | -173.7 | -171.9 | -126 | 2.9 | 109.6 | G226 L230 | G226-R228 PolarHBondContact O-N 2.96Å; R228-L230 PolarHBondContact O-N 3.22Å |
| 229 | P | 49.6 | Very low | 50.2 | Low | 129 Ų | 129 | 143.9 Ų | 143.9 | 84% | 0.838 | 79% | 0.789 | S | S | * | * | | | trans | -67.1 | 114.3 | 170.6 | 25.9 | -29.9 | 0 | 0 | 0 | 109.3 | Q231 | P229-Q231 PolarHBondContact O-N 2.95Š|
| 230 | L | 44.1 | Very low | 50.4 | Low | 169 Ų | 169 | 149.9 Ų | 149.9 | 89% | 0.885 | 81% | 0.808 | S | S | * | * | | | trans | -75.6 | 113.3 | -179.5 | -174.6 | 63.6 | 0 | 0 | 0 | 110.2 | R228 R232 | R228-L230 PolarHBondContact O-N 3.22Å; L230-R232 PolarHBondContact O-N 3.15Å |
| 231 | Q | 46.5 | Very low | 50.3 | Low | 165 Ų | 165 | 147.4 Ų | 147.4 | 77% | 0.771 | 81% | 0.807 | S | S | * | * | | | trans | -55.6 | 121.8 | 167 | -178.6 | 178 | -24.4 | 0 | 0 | 109.8 | P229 S233 | P229-Q231 PolarHBondContact O-N 2.95Å; Q231-S233 PolarHBondContact O-N 3.36Å |
| 232 | R | 45.8 | Very low | 49.7 | Very low | 234 Ų | 234 | 144.4 Ų | 144.4 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | | | trans | -63 | 121.3 | 176.4 | -71.4 | -171.7 | -173.9 | 133.7 | 1.5 | 109.4 | L230 | L230-R232 PolarHBondContact O-N 3.15Š|
| 233 | S | 39.7 | Very low | 50.3 | Low | 98 Ų | 98 | 143.3 Ų | 143.3 | 69% | 0.685 | 79% | 0.792 | S | S | * | * | | | trans | -117.4 | 118.8 | 158.7 | -67.3 | 0 | 0 | 0 | 0 | 106.9 | Q231 S235 | Q231-S233 PolarHBondContact O-N 3.36Å; S233-S235 PolarHBondContact O-N 2.89Å |
| 234 | D | 49.4 | Very low | 50.2 | Low | 169 Ų | 169 | 142.3 Ų | 142.3 | 90% | 0.904 | 80% | 0.798 | S | S | * | * | | | trans | -70.5 | 91.6 | 178.6 | -66.8 | -42.1 | 0 | 0 | 0 | 109.4 | | |
| 235 | S | 47.7 | Very low | 50.7 | Low | 88 Ų | 88 | 137.8 Ų | 137.8 | 62% | 0.615 | 78% | 0.781 | S | S | * | * | | | trans | -126.8 | 118.9 | 165.6 | 76.2 | 0 | 0 | 0 | 0 | 108.7 | S233 F237 | S233-S235 PolarHBondContact O-N 2.89Å; S235-F237 VanDerWaalsContact C-N 3.32Å; S235-F237 PolarHBondContact O-N 3.31Å |
| 236 | G | 53.5 | Low | 51.3 | Low | 84 Ų | 84 | 133.9 Ų | 133.9 | 87% | 0.866 | 78% | 0.776 | S | S | * | * | | | trans | -67.2 | 72.7 | -167.2 | 0 | 0 | 0 | 0 | 0 | 116 | | |
| 237 | F | 49.3 | Very low | 52.5 | Low | 180 Ų | 180 | 139.5 Ų | 139.5 | 79% | 0.789 | 78% | 0.782 | S | S | * | * | | | trans | -117 | 109.1 | 152.6 | -67.2 | -80.4 | 0 | 0 | 0 | 107.2 | S235 V239 | S235-F237 VanDerWaalsContact C-N 3.32Å; S235-F237 PolarHBondContact O-N 3.31Å; F237-V239 PolarHBondContact O-N 3.26Å |
| 238 | A | 51 | Low | 53.4 | Low | 108 Ų | 108 | 137.8 Ų | 137.8 | 89% | 0.893 | 76% | 0.762 | S | S | * | * | | | trans | -66.3 | 84.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q240 | A238-Q240 PolarHBondContact O-N 3.32Š|
| 239 | V | 53.8 | Low | 54.6 | Low | 134 Ų | 134 | 129.2 Ų | 129.2 | 81% | 0.812 | 74% | 0.738 | S | S | * | * | | | trans | -72.5 | 91.8 | 161.9 | -175.2 | 0 | 0 | 0 | 0 | 105.5 | F237 A241 | F237-V239 PolarHBondContact O-N 3.26Å; V239-A241 PolarHBondContact O-N 2.69Å |
| 240 | Q | 55.1 | Low | 55.4 | Low | 178 Ų | 178 | 127.9 Ų | 127.9 | 83% | 0.832 | 73% | 0.729 | S | S | * | * | | | trans | -59 | 109.1 | 172.6 | -174.4 | 161.6 | 11.2 | 0 | 0 | 107.7 | A238 Y242 | A238-Q240 PolarHBondContact O-N 3.32Å; Q240-Y242 PolarHBondContact O-N 2.86Å |
| 241 | A | 51.5 | Low | 56.8 | Low | 88 Ų | 88 | 125 Ų | 125 | 73% | 0.727 | 71% | 0.712 | S | S | * | * | | | trans | -56.8 | 108.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 107.8 | V239 K243 | V239-A241 PolarHBondContact O-N 2.69Å; A241-K243 VanDerWaalsContact C-N 3.35Å; A241-K243 PolarHBondContact O-N 2.99Å |
| 242 | Y | 45.8 | Very low | 58.2 | Low | 137 Ų | 137 | 121.6 Ų | 121.6 | 54% | 0.537 | 70% | 0.696 | S | S | . | * | | | trans | -70.4 | 94.7 | -175.9 | -177.5 | -106.3 | 0 | 0 | 0 | 109.2 | Q240 G244 A245 P246 | Q240-Y242 PolarHBondContact O-N 2.86Å; Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.76Å; Y242-A245 HydrophobicContact CE1-CB 4.31Å; Y242-A245 WeakPolarHBondContact CE1-O 3.49Å; Y242-A245 HydrophobicContact CE2-CB 3.94Å; Y242-A245 WeakPolarHBondContact OH-CA 3.49Å; Y242-A245 WeakPolarHBondContact OH-CB 3.02Å; Y242-A245 PolarHBondContact OH-O 2.93Å; Y242-P246 PolarHBondContact OH-O 3.09Å |
| 243 | K | 57 | Low | 59.5 | Low | 205 Ų | 205 | 115 Ų | 115 | 89% | 0.891 | 68% | 0.679 | S | S | * | * | | | trans | -71.7 | 87.6 | 173.7 | -161.5 | -169.5 | -174.7 | -147.3 | 0 | 108.6 | A241 A245 | A241-K243 VanDerWaalsContact C-N 3.35Å; A241-K243 PolarHBondContact O-N 2.99Å; K243-A245 PolarHBondContact O-N 2.81Å; K243-A245 VanDerWaalsContact O-N 3.11Å |
| 244 | G | 57.5 | Low | 61 | Low | 76 Ų | 76 | 116.4 Ų | 116.4 | 78% | 0.784 | 68% | 0.676 | S | S | * | * | S | Bend | trans | 61.6 | 26.6 | 147.4 | 0 | 0 | 0 | 0 | 0 | 119.7 | Y242 | Y242-G244 VanDerWaalsContact C-N 3.32Å; Y242-G244 PolarHBondContact O-N 2.76Å |
| 245 | A | 65 | Low | 62 | Low | 49 Ų | 49 | 115 Ų | 115 | 41% | 0.405 | 66% | 0.657 | S | S | . | * | P | Polyproline II helix | trans | -85.8 | 144.8 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y242 K243 K247 | Y242-A245 HydrophobicContact CE1-CB 4.31Å; Y242-A245 WeakPolarHBondContact CE1-O 3.49Å; Y242-A245 HydrophobicContact CE2-CB 3.94Å; Y242-A245 WeakPolarHBondContact OH-CA 3.49Å; Y242-A245 WeakPolarHBondContact OH-CB 3.02Å; Y242-A245 PolarHBondContact OH-O 2.93Å; K243-A245 PolarHBondContact O-N 2.81Å; K243-A245 VanDerWaalsContact O-N 3.11Å; A245-K247 PolarHBondContact O-N 3.34Å |
| 246 | P | 67.4 | Low | 62.8 | Low | 118 Ų | 118 | 113.7 Ų | 113.7 | 77% | 0.766 | 65% | 0.652 | S | S | * | * | P | Polyproline II helix | trans | -59 | 128.9 | 174.3 | 23 | -30.7 | 0 | 0 | 0 | 109.3 | Y242 | Y242-P246 PolarHBondContact OH-O 3.09Š|
| 247 | K | 70.1 | Confident | 63.1 | Low | 183 Ų | 183 | 116.8 Ų | 116.8 | 80% | 0.796 | 64% | 0.644 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 123.4 | 174.6 | -72.7 | 176.8 | 178.1 | 174.4 | 0 | 107.4 | A245 S249 | A245-K247 PolarHBondContact O-N 3.34Å; K247-S249 PolarHBondContact O-N 3.4Å |
| 248 | P | 69.1 | Low | 63.5 | Low | 68 Ų | 68 | 111.8 Ų | 111.8 | 44% | 0.442 | 64% | 0.636 | S | S | . | * | P | Polyproline II helix | trans | -61.1 | 131 | 179.2 | 23.5 | -31.4 | 0 | 0 | 0 | 108.7 | E252 L253 | P248-E252 WeakPolarHBondContact CA-OE2 3.36Å; P248-E252 HydrophobicContact CB-CB 4.24Å; P248-L253 HydrophobicContact CG-CD2 4.46Å |
| 249 | S | 77 | Confident | 63.8 | Low | 54 Ų | 54 | 112.5 Ų | 112.5 | 38% | 0.378 | 63% | 0.63 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 145.2 | 177.9 | 170.8 | 0 | 0 | 0 | 0 | 108.8 | K247 M251 E252 L253 | K247-S249 PolarHBondContact O-N 3.4Å; S249-M251 PolarHBondContact O-N 2.88Å; S249-M251 PolarHBondContact OG-N 2.98Å; S249-E252 PolarHBondContact N-OE2 2.8Å; S249-E252 WeakPolarHBondContact O-CA 3.45Å; S249-E252 WeakPolarHBondContact O-CB 3.17Å; S249-E252 PolarHBondContact O-N 2.96Å; S249-L253 PolarHBondContact O-N 3.19Å |
| 250 | P | 67.5 | Low | 63.9 | Low | 100 Ų | 100 | 116.5 Ų | 116.5 | 65% | 0.649 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -47.7 | -31.8 | 174.1 | -29.7 | 35.7 | 0 | 0 | 0 | 113.5 | L253 M254 | P250-L253 PolarHBondContact O-N 3.49Å; P250-M254 WeakPolarHBondContact O-CG 2.92Å; P250-M254 PolarHBondContact O-N 2.87Å |
| 251 | M | 73.6 | Confident | 63.6 | Low | 109 Ų | 109 | 111.9 Ų | 111.9 | 54% | 0.537 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -65.2 | -34.5 | 173.9 | -72.6 | -63.4 | -60.3 | 0 | 0 | 114 | S249 R255 | S249-M251 PolarHBondContact O-N 2.88Å; S249-M251 PolarHBondContact OG-N 2.98Å; M251-R255 WeakPolarHBondContact O-CG 3.11Å; M251-R255 PolarHBondContact O-N 3.11Å |
| 252 | E | 74.9 | Confident | 63.4 | Low | 93 Ų | 93 | 111.4 Ų | 111.4 | 44% | 0.435 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -72.3 | -37.2 | 177.6 | -71.4 | 170.9 | 161.5 | 0 | 0 | 111.6 | P248 S249 M254 R255 A256 | P248-E252 WeakPolarHBondContact CA-OE2 3.36Å; P248-E252 HydrophobicContact CB-CB 4.24Å; S249-E252 PolarHBondContact N-OE2 2.8Å; S249-E252 WeakPolarHBondContact O-CA 3.45Å; S249-E252 WeakPolarHBondContact O-CB 3.17Å; S249-E252 PolarHBondContact O-N 2.96Å; E252-M254 VanDerWaalsContact C-N 3.34Å; E252-M254 PolarHBondContact O-N 2.99Å; E252-R255 VanDerWaalsContact CG-NH2 3.32Å; E252-R255 PolarHBondContact O-N 2.93Å; E252-A256 PolarHBondContact O-N 2.99Å |
| 253 | L | 74.4 | Confident | 63.4 | Low | 97 Ų | 97 | 112.3 Ų | 112.3 | 51% | 0.508 | 64% | 0.643 | S | S | . | * | H | α-helix | trans | -62.1 | -42.4 | 173.4 | -71.9 | 174.4 | 0 | 0 | 0 | 111.5 | P248 S249 P250 R255 A256 Q257 | P248-L253 HydrophobicContact CG-CD2 4.46Å; S249-L253 PolarHBondContact O-N 3.19Å; P250-L253 PolarHBondContact O-N 3.49Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.86Å; L253-A256 PolarHBondContact O-N 2.9Å; L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 3.18Å; L253-Q257 VanDerWaalsContact O-N 3.14Å |
| 254 | M | 70.2 | Confident | 62.8 | Low | 126 Ų | 126 | 107.4 Ų | 107.4 | 62% | 0.621 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -63.8 | -38.1 | 176.4 | -69.6 | -177.3 | 66.7 | 0 | 0 | 112.5 | P250 E252 A258 | P250-M254 WeakPolarHBondContact O-CG 2.92Å; P250-M254 PolarHBondContact O-N 2.87Å; E252-M254 VanDerWaalsContact C-N 3.34Å; E252-M254 PolarHBondContact O-N 2.99Å; M254-A258 PolarHBondContact O-N 3.1Å |
| 255 | R | 70.3 | Confident | 62.6 | Low | 139 Ų | 139 | 109.1 Ų | 109.1 | 53% | 0.525 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -70.1 | -39.8 | 176.8 | -71.6 | -166.6 | -60.8 | -101.8 | 5.1 | 112.7 | M251 E252 L253 Q257 A258 T259 | M251-R255 WeakPolarHBondContact O-CG 3.11Å; M251-R255 PolarHBondContact O-N 3.11Å; E252-R255 VanDerWaalsContact CG-NH2 3.32Å; E252-R255 PolarHBondContact O-N 2.93Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.86Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.81Å; R255-A258 WeakPolarHBondContact O-CB 3.46Å; R255-A258 PolarHBondContact O-N 3.26Å; R255-T259 PolarHBondContact O-N 3.1Å; R255-T259 PolarHBondContact O-OG1 3.21Å |
| 256 | A | 64.6 | Low | 62.1 | Low | 61 Ų | 61 | 110.5 Ų | 110.5 | 50% | 0.504 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66 | -35.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | E252 L253 | E252-A256 PolarHBondContact O-N 2.99Å; L253-A256 PolarHBondContact O-N 2.9Å |
| 257 | Q | 60.5 | Low | 61.2 | Low | 150 Ų | 150 | 109.9 Ų | 109.9 | 70% | 0.701 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -71.3 | -30.6 | 174 | -69.9 | -178.3 | -7.6 | 0 | 0 | 112.4 | L253 R255 T259 R260 | L253-Q257 WeakPolarHBondContact O-CG 3.46Å; L253-Q257 PolarHBondContact O-N 3.18Å; L253-Q257 VanDerWaalsContact O-N 3.14Å; R255-Q257 VanDerWaalsContact C-N 3.33Å; R255-Q257 PolarHBondContact O-N 2.81Å; Q257-T259 VanDerWaalsContact C-N 3.33Å; Q257-T259 PolarHBondContact O-N 2.83Å; Q257-R260 PolarHBondContact O-N 3.26Å |
| 258 | A | 56.4 | Low | 60.5 | Low | 75 Ų | 75 | 108.7 Ų | 108.7 | 62% | 0.62 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -69 | -27.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | M254 R255 R260 | M254-A258 PolarHBondContact O-N 3.1Å; R255-A258 WeakPolarHBondContact O-CB 3.46Å; R255-A258 PolarHBondContact O-N 3.26Å; A258-R260 VanDerWaalsContact C-N 3.34Å; A258-R260 PolarHBondContact O-N 3.27Å |
| 259 | T | 58.7 | Low | 60 | Low | 123 Ų | 123 | 114.1 Ų | 114.1 | 76% | 0.755 | 64% | 0.641 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.6 | -11.3 | -179.4 | -46.4 | 0 | 0 | 0 | 0 | 113.7 | R255 Q257 G261 | R255-T259 PolarHBondContact O-N 3.1Å; R255-T259 PolarHBondContact O-OG1 3.21Å; Q257-T259 VanDerWaalsContact C-N 3.33Å; Q257-T259 PolarHBondContact O-N 2.83Å; T259-G261 VanDerWaalsContact C-N 3.33Å |
| 260 | R | 55.6 | Low | 59 | Low | 218 Ų | 218 | 116.4 Ų | 116.4 | 82% | 0.823 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.7 | 0.4 | 177.9 | -70.4 | -164.9 | 173.9 | -156.7 | -2.4 | 114.6 | Q257 A258 G262 | Q257-R260 PolarHBondContact O-N 3.26Å; A258-R260 VanDerWaalsContact C-N 3.34Å; A258-R260 PolarHBondContact O-N 3.27Å; R260-G262 PolarHBondContact O-N 2.94Å |
| 261 | G | 47.8 | Very low | 58.2 | Low | 80 Ų | 80 | 116.9 Ų | 116.9 | 83% | 0.825 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.2 | 31.9 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | T259 | T259-G261 VanDerWaalsContact C-N 3.33Š|
| 262 | G | 47.4 | Very low | 56.7 | Low | 78 Ų | 78 | 121.9 Ų | 121.9 | 80% | 0.804 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -137.5 | 9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | R260 | R260-G262 PolarHBondContact O-N 2.94Š|
| 263 | E | 46 | Very low | 55.9 | Low | 157 Ų | 157 | 124.2 Ų | 124.2 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -105.6 | 126.1 | 180 | -156.6 | 166.4 | -179 | 0 | 0 | 111.1 | | |
| 264 | D | 43.8 | Very low | 54.8 | Low | 102 Ų | 102 | 127.3 Ų | 127.3 | 55% | 0.545 | 71% | 0.707 | S | S | . | * | | | trans | -55.8 | 124.4 | -173.5 | -179.7 | 7.1 | 0 | 0 | 0 | 112.1 | A266 T267 | D264-A266 PolarHBondContact O-N 3.19Å; D264-A266 VanDerWaalsContact O-N 3.07Å; D264-A266 PolarHBondContact OD1-N 3.1Å; D264-T267 PolarHBondContact O-OG1 2.75Å |
| 265 | P | 53.7 | Low | 53.8 | Low | 112 Ų | 112 | 126.3 Ų | 126.3 | 73% | 0.727 | 71% | 0.708 | S | S | * | * | G | 310 helix | trans | -66.4 | -6.2 | -179 | 27.3 | -35.8 | 0 | 0 | 0 | 114.5 | T267 | P265-T267 VanDerWaalsContact C-N 3.34Å; P265-T267 PolarHBondContact O-N 2.96Å |
| 266 | A | 55.7 | Low | 52.5 | Low | 77 Ų | 77 | 125.3 Ų | 125.3 | 64% | 0.636 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -73.5 | -15.8 | -177 | 0 | 0 | 0 | 0 | 0 | 115.3 | D264 | D264-A266 PolarHBondContact O-N 3.19Å; D264-A266 VanDerWaalsContact O-N 3.07Å; D264-A266 PolarHBondContact OD1-N 3.1Å |
| 267 | T | 48.4 | Very low | 51.6 | Low | 106 Ų | 106 | 129.1 Ų | 129.1 | 65% | 0.65 | 74% | 0.736 | S | S | * | * | G | 310 helix | trans | -96.6 | -6.6 | -173.1 | -3.3 | 0 | 0 | 0 | 0 | 114.8 | D264 P265 K269 | D264-T267 PolarHBondContact O-OG1 2.75Å; P265-T267 VanDerWaalsContact C-N 3.34Å; P265-T267 PolarHBondContact O-N 2.96Å; T267-K269 PolarHBondContact O-N 3.39Å |
| 268 | F | 54.6 | Low | 51.1 | Low | 158 Ų | 158 | 128.7 Ų | 128.7 | 69% | 0.693 | 74% | 0.743 | S | S | * | * | | | trans | -77.8 | 90 | 177.8 | -74.5 | -79.2 | 0 | 0 | 0 | 110.9 | P270 | F268-P270 WeakPolarHBondContact O-CD 3.29Š|
| 269 | K | 57.8 | Low | 50.4 | Low | 182 Ų | 182 | 133.7 Ų | 133.7 | 79% | 0.791 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 121.5 | 165.2 | -71.8 | -75.7 | 100.7 | 175.4 | 0 | 108.7 | T267 | T267-K269 PolarHBondContact O-N 3.39Š|
| 270 | P | 56.3 | Low | 49.9 | Very low | 101 Ų | 101 | 131 Ų | 131 | 66% | 0.656 | 75% | 0.751 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 145 | 176.8 | 26.5 | -32.7 | 0 | 0 | 0 | 110.7 | F268 K272 | F268-P270 WeakPolarHBondContact O-CD 3.29Å; P270-K272 PolarHBondContact O-N 3.28Å |
| 271 | P | 51.6 | Low | 49.4 | Very low | 111 Ų | 111 | 130.4 Ų | 130.4 | 72% | 0.721 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 126.7 | 175.7 | 23.9 | -30.5 | 0 | 0 | 0 | 110 | I273 | P271-I273 PolarHBondContact O-N 3.07Š|
| 272 | K | 42.3 | Very low | 49.8 | Very low | 213 Ų | 213 | 136.5 Ų | 136.5 | 93% | 0.926 | 76% | 0.758 | S | S | * | * | | | trans | -71.1 | 107.4 | 175.9 | -70.7 | 177.5 | 178.8 | 177.4 | 0 | 108.6 | P270 | P270-K272 PolarHBondContact O-N 3.28Š|
| 273 | I | 58.7 | Low | 50.2 | Low | 143 Ų | 143 | 138.1 Ų | 138.1 | 73% | 0.733 | 75% | 0.754 | S | S | * | * | | | trans | -100 | 112.1 | 172 | -48.9 | 173 | 0 | 0 | 0 | 105.9 | P271 V275 | P271-I273 PolarHBondContact O-N 3.07Å; I273-V275 HydrophobicContact CG2-CG2 4.38Å |
| 274 | D | 49.8 | Very low | 50.8 | Low | 161 Ų | 161 | 136 Ų | 136 | 86% | 0.861 | 75% | 0.754 | S | S | * | * | | | trans | -87.1 | 120.7 | 177.4 | -156.5 | 9.6 | 0 | 0 | 0 | 108.7 | | |
| 275 | V | 48.8 | Very low | 51.3 | Low | 105 Ų | 105 | 137.3 Ų | 137.3 | 64% | 0.636 | 77% | 0.768 | S | S | * | * | | | trans | -113.4 | 123.3 | -175.8 | -176.1 | 0 | 0 | 0 | 0 | 108.1 | I273 V277 | I273-V275 HydrophobicContact CG2-CG2 4.38Å; V275-V277 PolarHBondContact O-N 3.32Å |
| 276 | P | 44.8 | Very low | 51.7 | Low | 119 Ų | 119 | 143.1 Ų | 143.1 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | | | trans | -68.9 | 125.4 | 176.6 | 26.5 | -31.6 | 0 | 0 | 0 | 110.6 | V278 | P276-V278 PolarHBondContact O-N 3.48Š|
| 277 | V | 45 | Very low | 52 | Low | 141 Ų | 141 | 144.8 Ų | 144.8 | 86% | 0.855 | 78% | 0.778 | S | S | * | * | | | trans | -62.7 | 117.7 | 172.3 | 169.4 | 0 | 0 | 0 | 0 | 109.2 | V275 | V275-V277 PolarHBondContact O-N 3.32Š|
| 278 | V | 49.6 | Very low | 52.8 | Low | 140 Ų | 140 | 147 Ų | 147 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | | | trans | -99.7 | 113 | 162.4 | 135.8 | 0 | 0 | 0 | 0 | 108.2 | P276 | P276-V278 PolarHBondContact O-N 3.48Š|
| 279 | E | 42.3 | Very low | 53.2 | Low | 181 Ų | 181 | 146.3 Ų | 146.3 | 85% | 0.846 | 78% | 0.784 | S | S | * | * | | | trans | -65.2 | 134.7 | 177.5 | -169.5 | 179.4 | 179.5 | 0 | 0 | 110.8 | | |
| 280 | G | 47.8 | Very low | 53.9 | Low | 67 Ų | 67 | 142.4 Ų | 142.4 | 69% | 0.691 | 77% | 0.772 | S | S | * | * | | | trans | -83.7 | 143.8 | -171 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 281 | K | 45.1 | Very low | 55.1 | Low | 204 Ų | 204 | 144.6 Ų | 144.6 | 89% | 0.887 | 77% | 0.771 | S | S | * | * | | | trans | -137.6 | 111.5 | 147.3 | -72.5 | -170.1 | 177.7 | 176.7 | 0 | 109.5 | P283 | K281-P283 WeakPolarHBondContact O-CD 3.5Š|
| 282 | K | 55.7 | Low | 56 | Low | 209 Ų | 209 | 144.5 Ų | 144.5 | 91% | 0.909 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 125.5 | 173.5 | -103.3 | 173.5 | 176.9 | 165.9 | 0 | 109.8 | | |
| 283 | P | 55.6 | Low | 57.2 | Low | 111 Ų | 111 | 145 Ų | 145 | 72% | 0.721 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -76.2 | 149.3 | 160 | 29.8 | -30.6 | 0 | 0 | 0 | 110.6 | K281 | K281-P283 WeakPolarHBondContact O-CD 3.5Š|
| 284 | P | 59.2 | Low | 57.7 | Low | 113 Ų | 113 | 141.4 Ų | 141.4 | 73% | 0.734 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 156 | 179.5 | 26.3 | -33.4 | 0 | 0 | 0 | 112.3 | R286 | P284-R286 PolarHBondContact O-N 3.27Š|
| 285 | P | 54.8 | Low | 58.7 | Low | 129 Ų | 129 | 138.4 Ų | 138.4 | 84% | 0.838 | 73% | 0.732 | S | S | * | * | | | trans | -65.3 | 110 | -175.3 | 26.3 | -33.1 | 0 | 0 | 0 | 110.7 | T287 | P285-T287 PolarHBondContact O-N 3.19Š|
| 286 | R | 62.9 | Low | 59.4 | Low | 234 Ų | 234 | 139.3 Ų | 139.3 | 88% | 0.883 | 73% | 0.733 | S | S | * | * | | | trans | -75.6 | 115.6 | 175.3 | -169.4 | 164.4 | -175.4 | 84.9 | -1.5 | 109.1 | P284 H288 | P284-R286 PolarHBondContact O-N 3.27Å; R286-H288 PolarHBondContact O-N 3.12Å |
| 287 | T | 59.9 | Low | 60.2 | Low | 112 Ų | 112 | 139.5 Ų | 139.5 | 69% | 0.687 | 73% | 0.732 | S | S | * | * | | | trans | -67.6 | 114.8 | 171.2 | 55.3 | 0 | 0 | 0 | 0 | 108.5 | P285 N289 | P285-T287 PolarHBondContact O-N 3.19Å; T287-N289 PolarHBondContact O-N 3Å |
| 288 | H | 66.2 | Low | 61.1 | Low | 153 Ų | 153 | 138.8 Ų | 138.8 | 71% | 0.708 | 72% | 0.722 | S | S | * | * | | | trans | -80.1 | 113.2 | 176 | 61.1 | -87.3 | 0 | 0 | 0 | 108.5 | R286 L290 | R286-H288 PolarHBondContact O-N 3.12Å; H288-L290 PolarHBondContact O-N 3.21Å |
| 289 | N | 63.4 | Low | 62 | Low | 144 Ų | 144 | 136.1 Ų | 136.1 | 77% | 0.77 | 71% | 0.707 | S | S | * | * | | | trans | -91.2 | 93.9 | 172.1 | -71.7 | -70.4 | 0 | 0 | 0 | 107.9 | T287 | T287-N289 PolarHBondContact O-N 3Š|
| 290 | L | 72.1 | Confident | 63 | Low | 100 Ų | 100 | 133.4 Ų | 133.4 | 52% | 0.524 | 71% | 0.705 | S | S | . | * | | | trans | -75.4 | 128.8 | 170.4 | -71.8 | 167.2 | 0 | 0 | 0 | 108.7 | H288 D294 | H288-L290 PolarHBondContact O-N 3.21Å; L290-D294 HydrophobicContact CD2-CB 4.45Å |
| 291 | K | 82.6 | Confident | 63.6 | Low | 146 Ų | 146 | 136.5 Ų | 136.5 | 64% | 0.635 | 71% | 0.711 | S | S | * | * | | | trans | -75.3 | 152.5 | 178.3 | -66 | 176.5 | -179.9 | 173.3 | 0 | 109 | R293 D294 | K291-R293 PolarHBondContact O-N 3.33Å; K291-D294 WeakPolarHBondContact CB-OD2 3.18Å; K291-D294 PolarHBondContact N-OD2 3.19Å; K291-D294 VanDerWaalsContact N-OD2 3.17Å; K291-D294 WeakPolarHBondContact O-CB 3.49Å; K291-D294 PolarHBondContact O-N 3.42Å |
| 292 | P | 70.1 | Confident | 64.4 | Low | 109 Ų | 109 | 130.4 Ų | 130.4 | 71% | 0.708 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -54.6 | -25.7 | 177.4 | -27.3 | 34.5 | 0 | 0 | 0 | 114.4 | D294 | P292-D294 VanDerWaalsContact C-N 3.33Š|
| 293 | R | 67.8 | Low | 63.8 | Low | 224 Ų | 224 | 133.7 Ų | 133.7 | 85% | 0.845 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -74.1 | -21.1 | 176.3 | -65.3 | -173.8 | -179.9 | 162.9 | 0.8 | 113.8 | K291 L295 | K291-R293 PolarHBondContact O-N 3.33Å; R293-L295 VanDerWaalsContact C-N 3.33Å |
| 294 | D | 68.5 | Low | 64.3 | Low | 68 Ų | 68 | 134.8 Ų | 134.8 | 36% | 0.364 | 72% | 0.72 | S | S | . | * | G | 310 helix | trans | -87 | -8.5 | -176.7 | -52.2 | -26 | 0 | 0 | 0 | 111.7 | L290 K291 P292 N296 V297 | L290-D294 HydrophobicContact CD2-CB 4.45Å; K291-D294 WeakPolarHBondContact CB-OD2 3.18Å; K291-D294 PolarHBondContact N-OD2 3.19Å; K291-D294 VanDerWaalsContact N-OD2 3.17Å; K291-D294 WeakPolarHBondContact O-CB 3.49Å; K291-D294 PolarHBondContact O-N 3.42Å; P292-D294 VanDerWaalsContact C-N 3.33Å; D294-N296 VanDerWaalsContact C-N 3.26Å; D294-N296 PolarHBondContact O-N 3.07Å; D294-V297 WeakPolarHBondContact O-CB 3.17Å; D294-V297 PolarHBondContact O-N 3.4Å |
| 295 | L | 69.8 | Low | 64.5 | Low | 97 Ų | 97 | 135.9 Ų | 135.9 | 51% | 0.508 | 72% | 0.72 | S | S | . | * | G | 310 helix | trans | -66.3 | -27.4 | 177.1 | -68.2 | 173.1 | 0 | 0 | 0 | 112.7 | R293 V297 L298 | R293-L295 VanDerWaalsContact C-N 3.33Å; L295-V297 PolarHBondContact O-N 3.1Å; L295-L298 PolarHBondContact O-N 3.05Å; L295-L298 VanDerWaalsContact O-N 3.1Å |
| 296 | N | 64.3 | Low | 65.1 | Low | 125 Ų | 125 | 136.3 Ų | 136.3 | 67% | 0.668 | 71% | 0.713 | S | S | * | * | G | 310 helix | trans | -71.7 | -11.8 | 178.2 | -65.2 | -9 | 0 | 0 | 0 | 113.1 | D294 L298 T299 | D294-N296 VanDerWaalsContact C-N 3.26Å; D294-N296 PolarHBondContact O-N 3.07Å; N296-L298 VanDerWaalsContact C-N 3.3Å; N296-T299 PolarHBondContact O-OG1 3.42Å |
| 297 | V | 61.9 | Low | 65.2 | Low | 122 Ų | 122 | 130.6 Ų | 130.6 | 74% | 0.739 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -79.7 | -18.7 | 173.3 | -171 | 0 | 0 | 0 | 0 | 111 | D294 L295 | D294-V297 WeakPolarHBondContact O-CB 3.17Å; D294-V297 PolarHBondContact O-N 3.4Å; L295-V297 PolarHBondContact O-N 3.1Å |
| 298 | L | 64.4 | Low | 65.5 | Low | 126 Ų | 126 | 131.8 Ų | 131.8 | 66% | 0.66 | 70% | 0.704 | S | S | * | * | S | Bend | trans | -97.5 | -6.3 | -178 | -62.1 | 177.3 | 0 | 0 | 0 | 113.5 | L295 N296 P300 | L295-L298 PolarHBondContact O-N 3.05Å; L295-L298 VanDerWaalsContact O-N 3.1Å; N296-L298 VanDerWaalsContact C-N 3.3Å; L298-P300 WeakPolarHBondContact O-CD 3.21Å |
| 299 | T | 66.6 | Low | 65.5 | Low | 85 Ų | 85 | 130.3 Ų | 130.3 | 52% | 0.521 | 70% | 0.704 | S | S | . | * | S | Bend | trans | -75.9 | 118.1 | 170.1 | 42.1 | 0 | 0 | 0 | 0 | 108.8 | N296 T301 | N296-T299 PolarHBondContact O-OG1 3.42Å; T299-T301 PolarHBondContact O-N 2.82Å |
| 300 | P | 64.2 | Low | 65.6 | Low | 124 Ų | 124 | 129.4 Ų | 129.4 | 81% | 0.805 | 70% | 0.699 | S | S | * | * | | | trans | -60.6 | 115.5 | 173.4 | 23.7 | -29.9 | 0 | 0 | 0 | 107.8 | L298 G302 | L298-P300 WeakPolarHBondContact O-CD 3.21Å; P300-G302 PolarHBondContact O-N 3.05Å |
| 301 | T | 61.3 | Low | 65.1 | Low | 132 Ų | 132 | 131.6 Ų | 131.6 | 81% | 0.81 | 71% | 0.712 | S | S | * | * | | | trans | -63.5 | 101 | 170.7 | 47.7 | 0 | 0 | 0 | 0 | 107 | T299 F303 | T299-T301 PolarHBondContact O-N 2.82Å; T301-F303 PolarHBondContact O-N 3.07Å |
| 302 | G | 61.1 | Low | 63.7 | Low | 76 Ų | 76 | 130.4 Ų | 130.4 | 78% | 0.784 | 72% | 0.719 | S | S | * | * | | | trans | -64.9 | 111.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | P300 | P300-G302 PolarHBondContact O-N 3.05Š|
| 303 | F | 44.2 | Very low | 63.1 | Low | 277 Ų | 277 | 132.4 Ų | 132.4 | 100% | 1.215 | 72% | 0.72 | S | S | * | * | | | trans | -123.7 | 0 | 153.2 | -100.2 | -80.7 | 0 | 0 | 0 | 107 | T301 | T301-F303 PolarHBondContact O-N 3.07Š|