| 1 | M | 73.3 | Confident | 84.2 | Confident | 189 Ų | 189 | 112.6 Ų | 112.6 | 93% | 0.931 | 62% | 0.618 | S | S | * | * | | | | 0 | -54.9 | 0 | -116.5 | 173.9 | 78.4 | 0 | 0 | 112.4 | L3 I4 L5 | M1-L3 PolarHBondContact O-N 3.4Å; M1-I4 PolarHBondContact O-N 2.89Å; M1-I4 VanDerWaalsContact O-N 3.13Å; M1-L5 PolarHBondContact O-N 2.96Å; M1-L5 VanDerWaalsContact O-N 3.16Å |
| 2 | L | 85.5 | Confident | 83.3 | Confident | 147 Ų | 147 | 108.4 Ų | 108.4 | 77% | 0.77 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -54.7 | -42.2 | -179.7 | -86.6 | 162.9 | 0 | 0 | 0 | 114.7 | I4 L5 L6 | L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.84Å; L2-L5 PolarHBondContact O-N 3.21Å; L2-L6 WeakPolarHBondContact O-CB 3.07Å; L2-L6 PolarHBondContact O-N 3.09Å |
| 3 | L | 81.4 | Confident | 82.1 | Confident | 137 Ų | 137 | 109.2 Ų | 109.2 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.6 | -36.1 | 178.7 | -65.9 | 175.1 | 0 | 0 | 0 | 113 | M1 L6 S7 | M1-L3 PolarHBondContact O-N 3.4Å; L3-L6 PolarHBondContact O-N 2.92Å; L3-S7 PolarHBondContact O-N 3.05Å; L3-S7 PolarHBondContact O-OG 3.07Å; L3-S7 VanDerWaalsContact O-OG 3.1Å |
| 4 | I | 84.4 | Confident | 80.7 | Confident | 118 Ų | 118 | 107.3 Ų | 107.3 | 61% | 0.605 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -70 | -42.1 | 178.5 | -59.2 | 176.1 | 0 | 0 | 0 | 109.8 | M1 L2 L6 S7 V8 | M1-I4 PolarHBondContact O-N 2.89Å; M1-I4 VanDerWaalsContact O-N 3.13Å; L2-I4 VanDerWaalsContact C-N 3.31Å; L2-I4 PolarHBondContact O-N 2.84Å; I4-L6 VanDerWaalsContact C-N 3.31Å; I4-L6 PolarHBondContact O-N 3.17Å; I4-S7 PolarHBondContact O-N 2.84Å; I4-V8 HydrophobicContact CG2-CG2 4.49Å; I4-V8 VanDerWaalsContact O-CG2 3.29Å; I4-V8 WeakPolarHBondContact O-CG2 3.36Å; I4-V8 PolarHBondContact O-N 2.74Å |
| 5 | L | 89.3 | Confident | 79.1 | Confident | 104 Ų | 104 | 105.8 Ų | 105.8 | 55% | 0.545 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -64 | -38.1 | 176.2 | -64.4 | 175.2 | 0 | 0 | 0 | 111.6 | M1 L2 A9 | M1-L5 PolarHBondContact O-N 2.96Å; M1-L5 VanDerWaalsContact O-N 3.16Å; L2-L5 PolarHBondContact O-N 3.21Å; L5-A9 VanDerWaalsContact O-CB 3.26Å; L5-A9 WeakPolarHBondContact O-CB 3.27Å; L5-A9 PolarHBondContact O-N 3.15Å |
| 6 | L | 89.1 | Confident | 77.7 | Confident | 98 Ų | 98 | 103.8 Ų | 103.8 | 51% | 0.513 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -66.4 | -43.1 | 175.4 | -175.9 | 62.1 | 0 | 0 | 0 | 112 | L2 L3 I4 A9 L10 | L2-L6 WeakPolarHBondContact O-CB 3.07Å; L2-L6 PolarHBondContact O-N 3.09Å; L3-L6 PolarHBondContact O-N 2.92Å; I4-L6 VanDerWaalsContact C-N 3.31Å; I4-L6 PolarHBondContact O-N 3.17Å; L6-A9 PolarHBondContact O-N 3.39Å; L6-L10 HydrophobicContact CD1-CD1 4.22Å; L6-L10 HydrophobicContact CD1-CG 4.31Å; L6-L10 HydrophobicContact CG-CD1 4.07Å; L6-L10 WeakPolarHBondContact O-CB 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.44Å; L6-L10 PolarHBondContact O-N 2.74Å |
| 7 | S | 86.6 | Confident | 76.2 | Confident | 78 Ų | 78 | 104 Ų | 104 | 55% | 0.545 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -63.1 | -42.3 | 176.2 | -65.8 | 0 | 0 | 0 | 0 | 112.6 | L3 I4 L11 | L3-S7 PolarHBondContact O-N 3.05Å; L3-S7 PolarHBondContact O-OG 3.07Å; L3-S7 VanDerWaalsContact O-OG 3.1Å; I4-S7 PolarHBondContact O-N 2.84Å; S7-L11 VanDerWaalsContact O-CB 3.26Å; S7-L11 WeakPolarHBondContact O-CB 3.26Å; S7-L11 PolarHBondContact O-N 3.37Å |
| 8 | V | 88.1 | Confident | 74.9 | Confident | 90 Ų | 90 | 106.3 Ų | 106.3 | 55% | 0.545 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.1 | -39.3 | 177.7 | 174.4 | 0 | 0 | 0 | 0 | 110.9 | I4 L11 A12 | I4-V8 HydrophobicContact CG2-CG2 4.49Å; I4-V8 VanDerWaalsContact O-CG2 3.29Å; I4-V8 WeakPolarHBondContact O-CG2 3.36Å; I4-V8 PolarHBondContact O-N 2.74Å; V8-L11 PolarHBondContact O-N 2.95Å; V8-A12 WeakPolarHBondContact O-CB 3.29Å; V8-A12 PolarHBondContact O-N 2.86Å |
| 9 | A | 84.8 | Confident | 73.8 | Confident | 55 Ų | 55 | 108.9 Ų | 108.9 | 46% | 0.455 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.3 | -43.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | L5 L6 A12 F13 | L5-A9 VanDerWaalsContact O-CB 3.26Å; L5-A9 WeakPolarHBondContact O-CB 3.27Å; L5-A9 PolarHBondContact O-N 3.15Å; L6-A9 PolarHBondContact O-N 3.39Å; A9-A12 PolarHBondContact O-N 3.33Å; A9-F13 VanDerWaalsContact O-CB 3.27Å; A9-F13 WeakPolarHBondContact O-CB 3.44Å; A9-F13 PolarHBondContact O-N 3.27Å |
| 10 | L | 81.8 | Confident | 72.8 | Confident | 101 Ų | 101 | 111 Ų | 111 | 53% | 0.529 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -66.7 | -39.5 | 176.6 | -71.9 | 171.6 | 0 | 0 | 0 | 112.1 | L6 F13 S14 | L6-L10 HydrophobicContact CD1-CD1 4.22Å; L6-L10 HydrophobicContact CD1-CG 4.31Å; L6-L10 HydrophobicContact CG-CD1 4.07Å; L6-L10 WeakPolarHBondContact O-CB 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.44Å; L6-L10 PolarHBondContact O-N 2.74Å; L10-F13 PolarHBondContact O-N 2.86Å; L10-S14 PolarHBondContact O-N 2.88Å; L10-S14 PolarHBondContact O-OG 2.91Å |
| 11 | L | 81.9 | Confident | 71.7 | Confident | 122 Ų | 122 | 113.9 Ų | 113.9 | 64% | 0.639 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -65.5 | -39.9 | 177.3 | -175.7 | 62.2 | 0 | 0 | 0 | 112.2 | S7 V8 S15 | S7-L11 VanDerWaalsContact O-CB 3.26Å; S7-L11 WeakPolarHBondContact O-CB 3.26Å; S7-L11 PolarHBondContact O-N 3.37Å; V8-L11 PolarHBondContact O-N 2.95Å; L11-S15 PolarHBondContact O-N 3.01Å; L11-S15 PolarHBondContact O-OG 3.13Å |
| 12 | A | 73.6 | Confident | 70.5 | Confident | 62 Ų | 62 | 112.7 Ų | 112.7 | 51% | 0.512 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -69 | -34.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | V8 A9 S15 A16 | V8-A12 WeakPolarHBondContact O-CB 3.29Å; V8-A12 PolarHBondContact O-N 2.86Å; A9-A12 PolarHBondContact O-N 3.33Å; A12-S15 PolarHBondContact O-N 3.39Å; A12-A16 PolarHBondContact O-N 3.43Å |
| 13 | F | 67.7 | Low | 68.8 | Low | 119 Ų | 119 | 111.6 Ų | 111.6 | 52% | 0.522 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -72.6 | -41.1 | 178.4 | -167.1 | -101.2 | 0 | 0 | 0 | 112.2 | A9 L10 S15 A16 Q17 | A9-F13 VanDerWaalsContact O-CB 3.27Å; A9-F13 WeakPolarHBondContact O-CB 3.44Å; A9-F13 PolarHBondContact O-N 3.27Å; L10-F13 PolarHBondContact O-N 2.86Å; F13-S15 VanDerWaalsContact C-N 3.26Å; F13-S15 PolarHBondContact O-N 3.31Å; F13-A16 PolarHBondContact O-N 3.32Å; F13-A16 VanDerWaalsContact O-N 3.13Å; F13-Q17 VanDerWaalsContact CE1-CD 3.46Å; F13-Q17 HydrophobicContact CE1-CG 4.21Å; F13-Q17 HydrophobicContact CZ-CG 4.49Å; F13-Q17 VanDerWaalsContact CZ-NE2 3.28Å; F13-Q17 PolarHBondContact O-N 3.39Å |
| 14 | S | 62.5 | Low | 67.4 | Low | 82 Ų | 82 | 109 Ų | 109 | 57% | 0.573 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -62.4 | -31.8 | 171.2 | -73.7 | 0 | 0 | 0 | 0 | 112.8 | L10 A16 | L10-S14 PolarHBondContact O-N 2.88Å; L10-S14 PolarHBondContact O-OG 2.91Å; S14-A16 VanDerWaalsContact C-N 3.26Å; S14-A16 PolarHBondContact O-N 3.29Å |
| 15 | S | 57.2 | Low | 65.7 | Low | 85 Ų | 85 | 112.3 Ų | 112.3 | 59% | 0.594 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -73 | -17.5 | 176.3 | -58.7 | 0 | 0 | 0 | 0 | 113.5 | L11 A12 F13 | L11-S15 PolarHBondContact O-N 3.01Å; L11-S15 PolarHBondContact O-OG 3.13Å; A12-S15 PolarHBondContact O-N 3.39Å; F13-S15 VanDerWaalsContact C-N 3.26Å; F13-S15 PolarHBondContact O-N 3.31Å |
| 16 | A | 56.8 | Low | 63.6 | Low | 74 Ų | 74 | 116.6 Ų | 116.6 | 61% | 0.612 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -98.7 | -12.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | A12 F13 S14 | A12-A16 PolarHBondContact O-N 3.43Å; F13-A16 PolarHBondContact O-N 3.32Å; F13-A16 VanDerWaalsContact O-N 3.13Å; S14-A16 VanDerWaalsContact C-N 3.26Å; S14-A16 PolarHBondContact O-N 3.29Å |
| 17 | Q | 52.3 | Low | 61.7 | Low | 107 Ų | 107 | 118.3 Ų | 118.3 | 50% | 0.5 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -97.5 | -8.1 | 176.1 | -67 | -162.7 | -29.2 | 0 | 0 | 114.1 | F13 L19 | F13-Q17 VanDerWaalsContact CE1-CD 3.46Å; F13-Q17 HydrophobicContact CE1-CG 4.21Å; F13-Q17 HydrophobicContact CZ-CG 4.49Å; F13-Q17 VanDerWaalsContact CZ-NE2 3.28Å; F13-Q17 PolarHBondContact O-N 3.39Å; Q17-L19 PolarHBondContact O-N 3.46Å |
| 18 | D | 52.5 | Low | 59.7 | Low | 146 Ų | 146 | 120 Ų | 120 | 78% | 0.781 | 67% | 0.671 | S | S | * | * | S | Bend | trans | -73 | -1.7 | 176.3 | -165.1 | -115.8 | 0 | 0 | 0 | 113.7 | | |
| 19 | L | 53.3 | Low | 57.9 | Low | 155 Ų | 155 | 121 Ų | 121 | 81% | 0.812 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -110.8 | 101 | 169 | -81.3 | 146.4 | 0 | 0 | 0 | 108 | Q17 | Q17-L19 PolarHBondContact O-N 3.46Š|
| 20 | N | 53.2 | Low | 55.9 | Low | 150 Ų | 150 | 125.9 Ų | 125.9 | 80% | 0.802 | 70% | 0.696 | S | S | * | * | S | Bend | trans | 111.3 | 41.7 | 163.4 | -155.5 | 81.7 | 0 | 0 | 0 | 118.3 | | |
| 21 | E | 50.3 | Low | 53.9 | Low | 172 Ų | 172 | 126 Ų | 126 | 80% | 0.804 | 70% | 0.701 | S | S | * | * | | | trans | -136.9 | 68.8 | 153.8 | -72.3 | -170.9 | 95.8 | 0 | 0 | 111.4 | | |
| 22 | D | 47.5 | Very low | 52.5 | Low | 164 Ų | 164 | 128.4 Ų | 128.4 | 88% | 0.877 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -133.3 | 40.8 | 153 | -163.5 | -118.2 | 0 | 0 | 0 | 110.5 | | |
| 23 | V | 50.8 | Low | 51 | Low | 125 Ų | 125 | 130.4 Ų | 130.4 | 76% | 0.758 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -158.3 | 100.3 | 167.5 | 177.5 | 0 | 0 | 0 | 0 | 103.2 | | |
| 24 | S | 52.3 | Low | 50 | Low | 83 Ų | 83 | 132.2 Ų | 132.2 | 58% | 0.58 | 74% | 0.738 | S | S | * | * | | | cis | -162.3 | 148.9 | 29.5 | -56 | 0 | 0 | 0 | 0 | 108.3 | | |
| 25 | Q | 49 | Very low | 49 | Very low | 187 Ų | 187 | 131.5 Ų | 131.5 | 87% | 0.874 | 74% | 0.744 | S | S | * | * | S | Bend | | 170.7 | 76.7 | 129.8 | -92.4 | 162.7 | 96.5 | 0 | 0 | 112.6 | | |
| 26 | E | 43.6 | Very low | 48.4 | Very low | 193 Ų | 193 | 131 Ų | 131 | 90% | 0.902 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -132.5 | 37.8 | 130.8 | 54.7 | -160.7 | 87.2 | 0 | 0 | 109.9 | V28 | E26-V28 VanDerWaalsContact C-N 3.33Å; E26-V28 PolarHBondContact O-N 3.26Å |
| 27 | D | 51.2 | Low | 47.7 | Very low | 134 Ų | 134 | 134.5 Ų | 134.5 | 72% | 0.717 | 76% | 0.76 | S | S | * | * | | | trans | -92.5 | 78.7 | 154.4 | -165.6 | -105.2 | 0 | 0 | 0 | 106.7 | | |
| 28 | V | 43.8 | Very low | 47.5 | Very low | 115 Ų | 115 | 133.6 Ų | 133.6 | 70% | 0.697 | 77% | 0.766 | S | S | * | * | | | trans | -60.5 | 130.7 | 153.8 | -91.2 | 0 | 0 | 0 | 0 | 106.4 | E26 L30 | E26-V28 VanDerWaalsContact C-N 3.33Å; E26-V28 PolarHBondContact O-N 3.26Å; V28-L30 VanDerWaalsContact C-N 3.28Å; V28-L30 PolarHBondContact O-N 3.14Å |
| 29 | P | 50.9 | Low | 47.4 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 72% | 0.721 | 78% | 0.775 | S | S | * | * | | | trans | -73.9 | 87 | -172.3 | 30.8 | -33.3 | 0 | 0 | 0 | 108.4 | V31 | P29-V31 PolarHBondContact O-N 2.9Š|
| 30 | L | 41.9 | Very low | 47 | Very low | 157 Ų | 157 | 136.6 Ų | 136.6 | 82% | 0.822 | 77% | 0.771 | S | S | * | * | | | trans | -79.8 | 87.5 | 165.3 | -140 | 81.8 | 0 | 0 | 0 | 106.5 | V28 I32 | V28-L30 VanDerWaalsContact C-N 3.28Å; V28-L30 PolarHBondContact O-N 3.14Å; L30-I32 PolarHBondContact O-N 3.31Å |
| 31 | V | 40.8 | Very low | 46.6 | Very low | 103 Ų | 103 | 137.5 Ų | 137.5 | 62% | 0.624 | 77% | 0.768 | S | S | * | * | | | trans | 13.4 | 113.1 | 140.2 | -84.1 | 0 | 0 | 0 | 0 | 113.6 | P29 S33 | P29-V31 PolarHBondContact O-N 2.9Å; V31-S33 VanDerWaalsContact C-N 3.28Å; V31-S33 PolarHBondContact O-N 3.22Å |
| 32 | I | 50.7 | Low | 46.2 | Very low | 172 Ų | 172 | 136.7 Ų | 136.7 | 88% | 0.882 | 77% | 0.768 | S | S | * | * | | | trans | -17.3 | 95.1 | 135.7 | -9.5 | 174.3 | 0 | 0 | 0 | 109.9 | L30 | L30-I32 PolarHBondContact O-N 3.31Š|
| 33 | S | 42.6 | Very low | 46.2 | Very low | 104 Ų | 104 | 135.4 Ų | 135.4 | 73% | 0.727 | 76% | 0.762 | S | S | * | * | | | trans | -118.5 | 88.9 | 160.7 | -146.9 | 0 | 0 | 0 | 0 | 101.2 | V31 | V31-S33 VanDerWaalsContact C-N 3.28Å; V31-S33 PolarHBondContact O-N 3.22Å |
| 34 | D | 47.5 | Very low | 46 | Very low | 157 Ų | 157 | 134.6 Ų | 134.6 | 84% | 0.84 | 75% | 0.75 | S | S | * | * | | | | 19.1 | 94.1 | 77.1 | -153 | 68.8 | 0 | 0 | 0 | 111 | | |
| 35 | G | 40.9 | Very low | 45.4 | Very low | 67 Ų | 67 | 140.1 Ų | 140.1 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | | | trans | 160.1 | 86.3 | -169.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | | |
| 36 | G | 45.5 | Very low | 45.4 | Very low | 74 Ų | 74 | 139 Ų | 139 | 76% | 0.763 | 75% | 0.754 | S | S | * | * | | | trans | -66.6 | 166.8 | -165 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 37 | D | 41.6 | Very low | 45.7 | Very low | 148 Ų | 148 | 137.5 Ų | 137.5 | 79% | 0.791 | 75% | 0.747 | S | S | * | * | | | trans | -150.4 | 90.9 | 142.8 | -129.8 | -39.9 | 0 | 0 | 0 | 108.7 | E39 | D37-E39 PolarHBondContact O-N 3.06Š|
| 38 | S | 48.6 | Very low | 45.2 | Very low | 89 Ų | 89 | 134.3 Ų | 134.3 | 62% | 0.622 | 75% | 0.745 | S | S | * | * | | | | 32.8 | 79 | 128.1 | -42.2 | 0 | 0 | 0 | 0 | 116.6 | Q40 | S38-Q40 PolarHBondContact O-N 3.11Š|
| 39 | E | 49.4 | Very low | 45.4 | Very low | 206 Ų | 206 | 134.6 Ų | 134.6 | 96% | 0.963 | 75% | 0.75 | S | S | * | * | | | trans | -72.5 | 68.8 | 145.7 | -68.4 | -119.7 | 110.7 | 0 | 0 | 108.1 | D37 | D37-E39 PolarHBondContact O-N 3.06Š|
| 40 | Q | 44.4 | Very low | 45.3 | Very low | 157 Ų | 157 | 135.2 Ų | 135.2 | 73% | 0.734 | 75% | 0.754 | S | S | * | * | | | trans | -123.7 | 106 | 171.2 | -77.7 | -95.2 | 2 | 0 | 0 | 106.5 | S38 | S38-Q40 PolarHBondContact O-N 3.11Š|
| 41 | F | 45.2 | Very low | 45.7 | Very low | 169 Ų | 169 | 136.3 Ų | 136.3 | 74% | 0.741 | 76% | 0.759 | S | S | * | * | | | | 41 | 106.7 | 128.8 | -162.9 | -92.2 | 0 | 0 | 0 | 115.9 | D43 | F41-D43 HydrophobicContact CZ-CB 4.47Š|
| 42 | L | 42.1 | Very low | 46 | Very low | 155 Ų | 155 | 135.4 Ų | 135.4 | 81% | 0.812 | 77% | 0.771 | S | S | * | * | | | trans | -154.8 | 80.4 | 147.4 | -100.2 | 162.6 | 0 | 0 | 0 | 109.4 | E44 | L42-E44 HydrophobicContact CD2-CB 4.32Å; L42-E44 PolarHBondContact O-N 3.4Å |
| 43 | D | 47.8 | Very low | 46.1 | Very low | 138 Ų | 138 | 130.6 Ų | 130.6 | 74% | 0.738 | 76% | 0.764 | S | S | * | * | | | trans | -60.7 | 96.3 | 151.1 | -154.2 | -68.8 | 0 | 0 | 0 | 107.1 | F41 | F41-D43 HydrophobicContact CZ-CB 4.47Š|
| 44 | E | 45.9 | Very low | 46.6 | Very low | 107 Ų | 107 | 134.5 Ų | 134.5 | 50% | 0.5 | 77% | 0.771 | S | S | . | * | | | trans | -167.6 | 63.6 | 170.4 | -154.3 | 84.6 | 113.5 | 0 | 0 | 112.9 | L42 R46 | L42-E44 HydrophobicContact CD2-CB 4.32Å; L42-E44 PolarHBondContact O-N 3.4Å; E44-R46 VanDerWaalsContact C-N 3.28Å; E44-R46 VanDerWaalsContact CD-CG 3.41Å; E44-R46 HydrophobicContact CG-CB 4.43Å; E44-R46 HydrophobicContact CG-CG 3.53Å; E44-R46 PolarHBondContact O-N 2.95Å; E44-R46 IonicContact OE1-CZ 3.68Å; E44-R46 IonicContact OE1-NE 3.43Å; E44-R46 PolarHBondContact OE1-NE 3.14Å; E44-R46 IonicContact OE1-NH2 2.88Å; E44-R46 PolarHBondContact OE1-NH2 2.91Å; E44-R46 VanDerWaalsContact OE1-NH2 3.13Å; E44-R46 WeakPolarHBondContact OE2-CD 3.49Å; E44-R46 WeakPolarHBondContact OE2-CG 3.33Å; E44-R46 IonicContact OE2-CZ 3Å; E44-R46 IonicContact OE2-NE 3.01Å; E44-R46 PolarHBondContact OE2-NE 3.23Å; E44-R46 IonicContact OE2-NH1 3.79Å; E44-R46 IonicContact OE2-NH2 3.13Å; E44-R46 PolarHBondContact OE2-NH2 2.79Å |
| 45 | E | 40.1 | Very low | 46.6 | Very low | 200 Ų | 200 | 136.4 Ų | 136.4 | 94% | 0.935 | 78% | 0.775 | S | S | * | * | | | trans | -86 | 80.3 | 151.2 | -165.5 | -156.1 | 103.3 | 0 | 0 | 107.9 | Q47 | E45-Q47 PolarHBondContact O-N 3.1Š|
| 46 | R | 49.8 | Very low | 47.1 | Very low | 163 Ų | 163 | 138.4 Ų | 138.4 | 62% | 0.615 | 78% | 0.778 | S | S | * | * | | | trans | -72.3 | 112.2 | 171 | -75.4 | -101.9 | -159.2 | -124.1 | -16.1 | 110.5 | E44 | E44-R46 VanDerWaalsContact C-N 3.28Å; E44-R46 VanDerWaalsContact CD-CG 3.41Å; E44-R46 HydrophobicContact CG-CB 4.43Å; E44-R46 HydrophobicContact CG-CG 3.53Å; E44-R46 PolarHBondContact O-N 2.95Å; E44-R46 IonicContact OE1-CZ 3.68Å; E44-R46 IonicContact OE1-NE 3.43Å; E44-R46 PolarHBondContact OE1-NE 3.14Å; E44-R46 IonicContact OE1-NH2 2.88Å; E44-R46 PolarHBondContact OE1-NH2 2.91Å; E44-R46 VanDerWaalsContact OE1-NH2 3.13Å; E44-R46 WeakPolarHBondContact OE2-CD 3.49Å; E44-R46 WeakPolarHBondContact OE2-CG 3.33Å; E44-R46 IonicContact OE2-CZ 3Å; E44-R46 IonicContact OE2-NE 3.01Å; E44-R46 PolarHBondContact OE2-NE 3.23Å; E44-R46 IonicContact OE2-NH1 3.79Å; E44-R46 IonicContact OE2-NH2 3.13Å; E44-R46 PolarHBondContact OE2-NH2 2.79Å |
| 47 | Q | 49.5 | Very low | 47.4 | Very low | 162 Ų | 162 | 143.5 Ų | 143.5 | 76% | 0.757 | 78% | 0.782 | S | S | * | * | | | | 80.2 | 104.1 | 129.3 | -59.9 | 179 | 2.8 | 0 | 0 | 118.9 | E45 | E45-Q47 PolarHBondContact O-N 3.1Š|
| 48 | G | 40.6 | Very low | 47.6 | Very low | 66 Ų | 66 | 142.7 Ų | 142.7 | 68% | 0.68 | 79% | 0.785 | S | S | * | * | | | trans | -119 | 167.5 | 146.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 49 | P | 47.9 | Very low | 47.3 | Very low | 121 Ų | 121 | 144.1 Ų | 144.1 | 79% | 0.786 | 80% | 0.795 | S | S | * | * | | | trans | -67 | 163.2 | -132.4 | 30.5 | -37.4 | 0 | 0 | 0 | 116.4 | L51 | P49-L51 PolarHBondContact O-N 3.15Š|
| 50 | P | 49.3 | Very low | 47.4 | Very low | 125 Ų | 125 | 139.4 Ų | 139.4 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | | | trans | -58.5 | 134.9 | -171.3 | 25 | -35.1 | 0 | 0 | 0 | 111.1 | G52 | P50-G52 PolarHBondContact O-N 3.05Š|
| 51 | L | 50.1 | Low | 47 | Very low | 179 Ų | 179 | 135.5 Ų | 135.5 | 94% | 0.937 | 79% | 0.793 | S | S | * | * | | | trans | -61.2 | 86.7 | 168 | -69.5 | 170.1 | 0 | 0 | 0 | 108.6 | P49 G53 | P49-L51 PolarHBondContact O-N 3.15Å; L51-G53 PolarHBondContact O-N 2.97Å |
| 52 | G | 46.7 | Very low | 47.2 | Very low | 85 Ų | 85 | 135.9 Ų | 135.9 | 88% | 0.876 | 80% | 0.803 | S | S | * | * | | | trans | -61.6 | 104.4 | 167.3 | 0 | 0 | 0 | 0 | 0 | 108.4 | P50 | P50-G52 PolarHBondContact O-N 3.05Š|
| 53 | G | 51.6 | Low | 47 | Very low | 71 Ų | 71 | 131.5 Ų | 131.5 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | | | trans | -179 | 28.6 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | L51 | L51-G53 PolarHBondContact O-N 2.97Š|
| 54 | Q | 53.8 | Low | 47.3 | Very low | 186 Ų | 186 | 131.6 Ų | 131.6 | 87% | 0.869 | 80% | 0.796 | S | S | * | * | | | trans | -120.5 | 87.2 | 161.3 | -66.2 | -166.1 | 33.1 | 0 | 0 | 108.6 | | |
| 55 | Q | 48.1 | Very low | 47.5 | Very low | 197 Ų | 197 | 135.2 Ų | 135.2 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | | | trans | -126.7 | 87.4 | 156.6 | -71.2 | -168.7 | -65.8 | 0 | 0 | 107.3 | Q57 | Q55-Q57 PolarHBondContact O-N 3.02Š|
| 56 | S | 52.1 | Low | 47.8 | Very low | 109 Ų | 109 | 133.2 Ų | 133.2 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | | | trans | -58.4 | 113.5 | 162 | -58.6 | 0 | 0 | 0 | 0 | 108.8 | | |
| 57 | Q | 51.7 | Low | 47.8 | Very low | 180 Ų | 180 | 133.8 Ų | 133.8 | 84% | 0.841 | 82% | 0.824 | S | S | * | * | | | trans | 34.1 | 116.6 | 146.3 | -58.3 | -179 | -80.4 | 0 | 0 | 118.6 | Q55 | Q55-Q57 PolarHBondContact O-N 3.02Š|
| 58 | P | 44.8 | Very low | 48 | Very low | 131 Ų | 131 | 128.4 Ų | 128.4 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | | | trans | -79.6 | 134.1 | 149.8 | 31 | -27.4 | 0 | 0 | 0 | 111 | | |
| 59 | S | 43.4 | Very low | 48.7 | Very low | 119 Ų | 119 | 131.3 Ų | 131.3 | 83% | 0.832 | 82% | 0.819 | S | S | * | * | | | trans | -7.4 | 147.2 | 162.5 | -70.2 | 0 | 0 | 0 | 0 | 121.5 | | |
| 60 | A | 49.6 | Very low | 49 | Very low | 107 Ų | 107 | 134.6 Ų | 134.6 | 88% | 0.884 | 82% | 0.824 | S | S | * | * | | | trans | -24.9 | 133 | 155.2 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 61 | G | 37.6 | Very low | 49.2 | Very low | 75 Ų | 75 | 137.6 Ų | 137.6 | 77% | 0.773 | 83% | 0.827 | S | S | * | * | | | trans | -168.6 | 86.3 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | G63 | G61-G63 PolarHBondContact O-N 3.49Š|
| 62 | D | 47.8 | Very low | 49.4 | Very low | 177 Ų | 177 | 131.6 Ų | 131.6 | 95% | 0.947 | 81% | 0.809 | S | S | * | * | | | trans | -64.3 | 118.3 | 168 | -160 | -1.2 | 0 | 0 | 0 | 108.2 | | |
| 63 | G | 39.6 | Very low | 50.1 | Low | 64 Ų | 64 | 133.1 Ų | 133.1 | 66% | 0.66 | 80% | 0.803 | S | S | * | * | | | trans | -170.1 | 94.4 | -171.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | G61 | G61-G63 PolarHBondContact O-N 3.49Š|
| 64 | N | 53.7 | Low | 50.3 | Low | 140 Ų | 140 | 135.2 Ų | 135.2 | 75% | 0.749 | 80% | 0.804 | S | S | * | * | | | trans | -34.2 | 135.5 | 164.7 | -77.8 | -74.1 | 0 | 0 | 0 | 114.1 | | |
| 65 | Q | 49 | Very low | 50.6 | Low | 182 Ų | 182 | 135.5 Ų | 135.5 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | | | | -179 | 131 | 125.5 | -105.6 | 107.9 | 49.6 | 0 | 0 | 112.8 | | |
| 66 | D | 48.1 | Very low | 51.1 | Low | 158 Ų | 158 | 134.8 Ų | 134.8 | 85% | 0.845 | 80% | 0.802 | S | S | * | * | | | trans | 61.4 | 90.3 | 150.2 | -84 | -35.1 | 0 | 0 | 0 | 120.5 | G68 | D66-G68 VanDerWaalsContact C-N 3.34Å; D66-G68 PolarHBondContact O-N 2.92Å; D66-G68 VanDerWaalsContact O-N 3.09Å |
| 67 | D | 50.1 | Low | 50.9 | Low | 175 Ų | 175 | 133 Ų | 133 | 94% | 0.936 | 80% | 0.8 | S | S | * | * | | | trans | -75.2 | 78.4 | 158.2 | -74.1 | -60.6 | 0 | 0 | 0 | 111.4 | | |
| 68 | G | 51.6 | Low | 50.9 | Low | 50 Ų | 50 | 127.8 Ų | 127.8 | 52% | 0.515 | 80% | 0.795 | S | S | . | * | | | trans | -78 | 145 | 153.9 | 0 | 0 | 0 | 0 | 0 | 109.8 | D66 Q70 | D66-G68 VanDerWaalsContact C-N 3.34Å; D66-G68 PolarHBondContact O-N 2.92Å; D66-G68 VanDerWaalsContact O-N 3.09Å; G68-Q70 PolarHBondContact O-N 2.98Å |
| 69 | P | 56.3 | Low | 51.6 | Low | 126 Ų | 126 | 130.1 Ų | 130.1 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | | | trans | -66 | 102.2 | 176.1 | 26.9 | -31.7 | 0 | 0 | 0 | 108.7 | Q71 | P69-Q71 VanDerWaalsContact C-N 3.3Å; P69-Q71 PolarHBondContact O-N 3.45Å |
| 70 | Q | 53.4 | Low | 52.4 | Low | 191 Ų | 191 | 132.5 Ų | 132.5 | 89% | 0.893 | 79% | 0.793 | S | S | * | * | | | trans | -63.7 | 99.1 | 165.2 | -68.8 | -140.3 | -8.9 | 0 | 0 | 107 | G68 G72 | G68-Q70 PolarHBondContact O-N 2.98Å; Q70-G72 VanDerWaalsContact C-N 3.32Å; Q70-G72 PolarHBondContact O-N 2.92Å |
| 71 | Q | 54.9 | Low | 52.9 | Low | 187 Ų | 187 | 136.5 Ų | 136.5 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | | | trans | -59.4 | 103.9 | 163 | -66.2 | -172.3 | 15.8 | 0 | 0 | 106.1 | P69 | P69-Q71 VanDerWaalsContact C-N 3.3Å; P69-Q71 PolarHBondContact O-N 3.45Å |
| 72 | G | 54.5 | Low | 54.2 | Low | 54 Ų | 54 | 141.6 Ų | 141.6 | 56% | 0.557 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 153.9 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110 | Q70 | Q70-G72 VanDerWaalsContact C-N 3.32Å; Q70-G72 PolarHBondContact O-N 2.92Å |
| 73 | P | 60.7 | Low | 55 | Low | 116 Ų | 116 | 135.6 Ų | 135.6 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 143.2 | -179.6 | 23.8 | -33.2 | 0 | 0 | 0 | 109.8 | Q75 | P73-Q75 PolarHBondContact O-N 3Å; P73-Q75 VanDerWaalsContact O-N 3.07Å |
| 74 | P | 56.5 | Low | 56.6 | Low | 116 Ų | 116 | 138.4 Ų | 138.4 | 75% | 0.753 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 123.8 | 178.9 | 22.4 | -31.7 | 0 | 0 | 0 | 108.2 | Q76 | P74-Q76 PolarHBondContact O-N 3.2Š|
| 75 | Q | 59.6 | Low | 57.6 | Low | 191 Ų | 191 | 137.1 Ų | 137.1 | 89% | 0.893 | 78% | 0.782 | S | S | * | * | | | trans | -60.1 | 104.6 | 174 | -66.2 | -140.5 | 21 | 0 | 0 | 106.9 | P73 G77 | P73-Q75 PolarHBondContact O-N 3Å; P73-Q75 VanDerWaalsContact O-N 3.07Å; Q75-G77 PolarHBondContact O-N 3.09Å |
| 76 | Q | 58.6 | Low | 58.8 | Low | 183 Ų | 183 | 133.9 Ų | 133.9 | 86% | 0.855 | 78% | 0.777 | S | S | * | * | | | trans | -58.2 | 112.2 | 177.9 | -69.5 | -171.8 | 7.5 | 0 | 0 | 106.7 | P74 G78 | P74-Q76 PolarHBondContact O-N 3.2Å; Q76-G78 PolarHBondContact O-N 2.87Å |
| 77 | G | 47.7 | Very low | 60.1 | Low | 70 Ų | 70 | 132.2 Ų | 132.2 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | | | trans | -47.3 | 126.4 | 179.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q75 Q79 | Q75-G77 PolarHBondContact O-N 3.09Å; G77-Q79 PolarHBondContact O-N 3.25Å; G77-Q79 VanDerWaalsContact O-N 3.15Å |
| 78 | G | 52.4 | Low | 61.4 | Low | 71 Ų | 71 | 133.2 Ų | 133.2 | 73% | 0.732 | 77% | 0.774 | S | S | * | * | | | trans | -47.9 | 120.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | Q76 Q80 | Q76-G78 PolarHBondContact O-N 2.87Å; G78-Q80 PolarHBondContact O-N 3.46Å |
| 79 | Q | 59.3 | Low | 62.3 | Low | 180 Ų | 180 | 134 Ų | 134 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | | | trans | -59 | 108 | 162 | -61.5 | -127.6 | 40.6 | 0 | 0 | 105.8 | G77 Q81 | G77-Q79 PolarHBondContact O-N 3.25Å; G77-Q79 VanDerWaalsContact O-N 3.15Å; Q79-Q81 VanDerWaalsContact C-N 3.32Å; Q79-Q81 PolarHBondContact O-N 3.48Å |
| 80 | Q | 60 | Low | 63.3 | Low | 170 Ų | 170 | 137.5 Ų | 137.5 | 79% | 0.794 | 79% | 0.785 | S | S | * | * | | | trans | -54.8 | 107.9 | 166.1 | -69 | -176.5 | 12 | 0 | 0 | 105.1 | G78 Q82 | G78-Q80 PolarHBondContact O-N 3.46Å; Q80-Q82 PolarHBondContact O-N 3.28Å |
| 81 | Q | 59.8 | Low | 64.3 | Low | 191 Ų | 191 | 134.4 Ų | 134.4 | 89% | 0.893 | 78% | 0.781 | S | S | * | * | | | trans | -61 | 93.4 | 170.9 | -65.1 | -173.2 | 37.6 | 0 | 0 | 105.1 | Q79 G83 | Q79-Q81 VanDerWaalsContact C-N 3.32Å; Q79-Q81 PolarHBondContact O-N 3.48Å; Q81-G83 VanDerWaalsContact C-N 3.29Å; Q81-G83 PolarHBondContact O-N 2.79Å |
| 82 | Q | 64.3 | Low | 65.3 | Low | 181 Ų | 181 | 134.9 Ų | 134.9 | 85% | 0.846 | 78% | 0.783 | S | S | * | * | | | trans | -61.9 | 105.5 | 167.9 | -63.3 | -174 | 24.9 | 0 | 0 | 103.4 | Q80 | Q80-Q82 PolarHBondContact O-N 3.28Š|
| 83 | G | 65.4 | Low | 66.1 | Low | 51 Ų | 51 | 134.9 Ų | 134.9 | 53% | 0.526 | 78% | 0.783 | S | S | . | * | P | Polyproline II helix | trans | -52.6 | 161.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110 | Q81 | Q81-G83 VanDerWaalsContact C-N 3.29Å; Q81-G83 PolarHBondContact O-N 2.79Å |
| 84 | P | 73.8 | Confident | 66.9 | Low | 123 Ų | 123 | 135 Ų | 135 | 80% | 0.799 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -50.6 | 142.3 | 178.7 | 22.8 | -33.1 | 0 | 0 | 0 | 110.1 | | |
| 85 | P | 73.8 | Confident | 67.4 | Low | 113 Ų | 113 | 135.1 Ų | 135.1 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 146.1 | 179.8 | 23.5 | -33.2 | 0 | 0 | 0 | 109.8 | | |
| 86 | P | 74.9 | Confident | 67.8 | Low | 114 Ų | 114 | 135.1 Ų | 135.1 | 74% | 0.74 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 144 | -179.4 | 24.6 | -33.4 | 0 | 0 | 0 | 110 | Q88 | P86-Q88 PolarHBondContact O-N 2.8Š|
| 87 | P | 73.7 | Confident | 68 | Low | 123 Ų | 123 | 135.4 Ų | 135.4 | 80% | 0.799 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 137.2 | -179.8 | 22.9 | -32 | 0 | 0 | 0 | 109.9 | G89 | P87-G89 PolarHBondContact O-N 3.24Š|
| 88 | Q | 77.6 | Confident | 68.2 | Low | 196 Ų | 196 | 135.5 Ų | 135.5 | 92% | 0.916 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 130.2 | 175.1 | -72.3 | -175.9 | -16.6 | 0 | 0 | 108.9 | P86 | P86-Q88 PolarHBondContact O-N 2.8Š|
| 89 | G | 70.9 | Confident | 68.4 | Low | 68 Ų | 68 | 135.2 Ų | 135.2 | 70% | 0.701 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 158.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | P87 | P87-G89 PolarHBondContact O-N 3.24Š|
| 90 | K | 78.4 | Confident | 68.3 | Low | 199 Ų | 199 | 135.7 Ų | 135.7 | 87% | 0.865 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 141.7 | 179.5 | -45.4 | -174 | -172.5 | -167.3 | 0 | 109.7 | Q92 | K90-Q92 PolarHBondContact O-N 2.81Š|
| 91 | P | 73.1 | Confident | 68.4 | Low | 126 Ų | 126 | 136.3 Ų | 136.3 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 132.4 | 172.3 | -23.9 | 32.6 | 0 | 0 | 0 | 110.1 | G93 | P91-G93 PolarHBondContact O-N 3.39Š|
| 92 | Q | 77.2 | Confident | 68.4 | Low | 196 Ų | 196 | 136.1 Ų | 136.1 | 92% | 0.916 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -64 | 123.4 | 174.3 | -147.2 | 141.5 | 39.5 | 0 | 0 | 107.1 | K90 | K90-Q92 PolarHBondContact O-N 2.81Š|
| 93 | G | 69.8 | Low | 68.4 | Low | 54 Ų | 54 | 136.7 Ų | 136.7 | 56% | 0.557 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 161.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | P91 | P91-G93 PolarHBondContact O-N 3.39Š|
| 94 | P | 78.3 | Confident | 68.3 | Low | 120 Ų | 120 | 136.8 Ų | 136.8 | 78% | 0.779 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 144.1 | -179.8 | 23.9 | -33.8 | 0 | 0 | 0 | 110.3 | Q96 | P94-Q96 PolarHBondContact O-N 2.86Å; P94-Q96 VanDerWaalsContact O-N 3.15Å |
| 95 | P | 68.1 | Low | 68.2 | Low | 118 Ų | 118 | 136.8 Ų | 136.8 | 77% | 0.766 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 126.3 | 176.2 | 20.9 | -30.3 | 0 | 0 | 0 | 108.7 | Q97 | P95-Q97 PolarHBondContact O-N 3.29Š|
| 96 | Q | 67.6 | Low | 68 | Low | 190 Ų | 190 | 137 Ų | 137 | 89% | 0.888 | 79% | 0.794 | S | S | * | * | | | trans | -59.7 | 114.7 | 174.8 | -65.3 | -160.9 | 21.1 | 0 | 0 | 107.1 | P94 G98 | P94-Q96 PolarHBondContact O-N 2.86Å; P94-Q96 VanDerWaalsContact O-N 3.15Å; Q96-G98 PolarHBondContact O-N 3.01Å |
| 97 | Q | 61.8 | Low | 67.9 | Low | 189 Ų | 189 | 137 Ų | 137 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | | | trans | -59 | 110 | 175.3 | -68.7 | -173.4 | 6 | 0 | 0 | 106.5 | P95 G99 | P95-Q97 PolarHBondContact O-N 3.29Å; Q97-G99 PolarHBondContact O-N 3.46Å |
| 98 | G | 52.2 | Low | 67.8 | Low | 73 Ų | 73 | 137 Ų | 137 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | | | trans | -51.5 | 111.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | Q96 Q100 | Q96-G98 PolarHBondContact O-N 3.01Å; G98-Q100 PolarHBondContact O-N 2.76Å |
| 99 | G | 56 | Low | 67.8 | Low | 64 Ų | 64 | 137 Ų | 137 | 66% | 0.66 | 79% | 0.794 | S | S | * | * | | | trans | -51.8 | 130.6 | -178.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q97 Q101 | Q97-G99 PolarHBondContact O-N 3.46Å; G99-Q101 PolarHBondContact O-N 3.47Å |
| 100 | Q | 58.8 | Low | 67.9 | Low | 190 Ų | 190 | 137.1 Ų | 137.1 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | | | trans | -54.5 | 110.1 | 169.8 | -63.8 | -142.8 | 43.3 | 0 | 0 | 106.7 | G98 Q102 | G98-Q100 PolarHBondContact O-N 2.76Å; Q100-Q102 PolarHBondContact O-N 3.38Å |
| 101 | Q | 60.7 | Low | 67.8 | Low | 183 Ų | 183 | 137.3 Ų | 137.3 | 86% | 0.855 | 80% | 0.796 | S | S | * | * | | | trans | -61.6 | 101.1 | 170.7 | -65.7 | -171.3 | 28.3 | 0 | 0 | 104.7 | G99 Q103 | G99-Q101 PolarHBondContact O-N 3.47Å; Q101-Q103 VanDerWaalsContact C-N 3.32Å; Q101-Q103 PolarHBondContact O-N 3.18Å |
| 102 | Q | 61.3 | Low | 67.9 | Low | 187 Ų | 187 | 137.3 Ų | 137.3 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | | | trans | -52.6 | 109.9 | 165 | -65.6 | -170.5 | 43.3 | 0 | 0 | 104.3 | Q100 G104 | Q100-Q102 PolarHBondContact O-N 3.38Å; Q102-G104 VanDerWaalsContact C-N 3.26Å; Q102-G104 PolarHBondContact O-N 3.19Å |
| 103 | Q | 63.8 | Low | 67.9 | Low | 193 Ų | 193 | 137.3 Ų | 137.3 | 90% | 0.902 | 80% | 0.796 | S | S | * | * | | | trans | -60.5 | 103.6 | 173.2 | -65 | -174.9 | 12.8 | 0 | 0 | 104.2 | Q101 | Q101-Q103 VanDerWaalsContact C-N 3.32Å; Q101-Q103 PolarHBondContact O-N 3.18Å |
| 104 | G | 63.7 | Low | 67.8 | Low | 53 Ų | 53 | 137.2 Ų | 137.2 | 55% | 0.546 | 80% | 0.795 | S | S | . | * | P | Polyproline II helix | trans | -55 | 162.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | Q102 | Q102-G104 VanDerWaalsContact C-N 3.26Å; Q102-G104 PolarHBondContact O-N 3.19Å |
| 105 | P | 71.4 | Confident | 67.8 | Low | 123 Ų | 123 | 137.2 Ų | 137.2 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | S | Bend | trans | -50.8 | 143.5 | 177.5 | 23.1 | -33.3 | 0 | 0 | 0 | 110.2 | | |
| 106 | P | 69 | Low | 67.9 | Low | 117 Ų | 117 | 137 Ų | 137 | 76% | 0.76 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 144.4 | -179 | 22.9 | -33 | 0 | 0 | 0 | 110.2 | | |
| 107 | P | 72.2 | Confident | 67.8 | Low | 115 Ų | 115 | 137.3 Ų | 137.3 | 75% | 0.747 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -59 | 145.3 | -177 | 24.5 | -33.5 | 0 | 0 | 0 | 110.5 | Q109 | P107-Q109 PolarHBondContact O-N 3.13Š|
| 108 | P | 73.1 | Confident | 67.9 | Low | 123 Ų | 123 | 137.6 Ų | 137.6 | 80% | 0.799 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 136.1 | 178.5 | 23.7 | -32.2 | 0 | 0 | 0 | 109.8 | G110 | P108-G110 PolarHBondContact O-N 3.09Š|
| 109 | Q | 77.3 | Confident | 67.8 | Low | 195 Ų | 195 | 136.6 Ų | 136.6 | 91% | 0.911 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 127.5 | 175.2 | -74.9 | -177.8 | -19.3 | 0 | 0 | 109.1 | P107 | P107-Q109 PolarHBondContact O-N 3.13Š|
| 110 | G | 71.6 | Confident | 67.8 | Low | 71 Ų | 71 | 137.4 Ų | 137.4 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 154.9 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | P108 | P108-G110 PolarHBondContact O-N 3.09Š|
| 111 | K | 77.9 | Confident | 67.8 | Low | 203 Ų | 203 | 136.6 Ų | 136.6 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 144.6 | 177 | -62.5 | 179.8 | -177.8 | -179.4 | 0 | 110 | Q113 | K111-Q113 PolarHBondContact O-N 3.41Š|
| 112 | P | 74.5 | Confident | 68 | Low | 126 Ų | 126 | 133.2 Ų | 133.2 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 135.2 | 175 | -24.3 | 32.8 | 0 | 0 | 0 | 111.1 | G114 | P112-G114 PolarHBondContact O-N 3.37Š|
| 113 | Q | 76.9 | Confident | 68.2 | Low | 196 Ų | 196 | 129.8 Ų | 129.8 | 92% | 0.916 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 123.9 | 174.9 | -158.8 | 141.7 | 32.2 | 0 | 0 | 108.2 | K111 | K111-Q113 PolarHBondContact O-N 3.41Š|
| 114 | G | 67.6 | Low | 68 | Low | 53 Ų | 53 | 126 Ų | 126 | 55% | 0.546 | 77% | 0.77 | S | S | . | * | P | Polyproline II helix | trans | -57.9 | 163.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | P112 | P112-G114 PolarHBondContact O-N 3.37Š|
| 115 | P | 78.5 | Confident | 67.9 | Low | 119 Ų | 119 | 129.3 Ų | 129.3 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 146.3 | -179.6 | 24.7 | -34.2 | 0 | 0 | 0 | 110.9 | Q117 | P115-Q117 PolarHBondContact O-N 3.26Š|
| 116 | P | 69.1 | Low | 67.4 | Low | 115 Ų | 115 | 133 Ų | 133 | 75% | 0.747 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 125.2 | 178.5 | 22.6 | -31.6 | 0 | 0 | 0 | 109.7 | Q118 | P116-Q118 PolarHBondContact O-N 2.88Å; P116-Q118 VanDerWaalsContact O-N 3.09Å |
| 117 | Q | 66.6 | Low | 66.4 | Low | 195 Ų | 195 | 130.8 Ų | 130.8 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | | | trans | -68.6 | 109.1 | 174.8 | -65 | -148.5 | 54.4 | 0 | 0 | 108.6 | P115 G119 | P115-Q117 PolarHBondContact O-N 3.26Å; Q117-G119 VanDerWaalsContact C-N 3.27Å; Q117-G119 PolarHBondContact O-N 3.19Å |
| 118 | Q | 63.8 | Low | 65.9 | Low | 195 Ų | 195 | 136.6 Ų | 136.6 | 91% | 0.911 | 80% | 0.795 | S | S | * | * | | | trans | -77.4 | 82.8 | 171.8 | -65.1 | -172.5 | 17.5 | 0 | 0 | 108.8 | P116 | P116-Q118 PolarHBondContact O-N 2.88Å; P116-Q118 VanDerWaalsContact O-N 3.09Å |
| 119 | G | 49.5 | Very low | 65.1 | Low | 52 Ų | 52 | 137 Ų | 137 | 54% | 0.536 | 80% | 0.798 | S | S | . | * | | | trans | -114 | 95.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | Q117 H121 | Q117-G119 VanDerWaalsContact C-N 3.27Å; Q117-G119 PolarHBondContact O-N 3.19Å; G119-H121 PolarHBondContact O-N 3.17Å |
| 120 | G | 55.5 | Low | 64.4 | Low | 81 Ų | 81 | 137 Ų | 137 | 84% | 0.835 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -66.2 | 125.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 121 | H | 60.8 | Low | 63.5 | Low | 174 Ų | 174 | 136.6 Ų | 136.6 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -94.8 | 130.4 | 165.8 | -62.4 | -68.7 | 0 | 0 | 0 | 108.8 | G119 | G119-H121 PolarHBondContact O-N 3.17Š|
| 122 | P | 64.1 | Low | 62.7 | Low | 112 Ų | 112 | 132.5 Ų | 132.5 | 73% | 0.727 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 146.3 | 168.6 | 27.2 | -31.8 | 0 | 0 | 0 | 109.5 | | |
| 123 | P | 64.3 | Low | 61.8 | Low | 114 Ų | 114 | 132.2 Ų | 132.2 | 74% | 0.74 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -62.4 | 145.4 | 178.3 | 25.9 | -33.1 | 0 | 0 | 0 | 110.6 | | |
| 124 | P | 60.5 | Low | 60.9 | Low | 113 Ų | 113 | 132 Ų | 132 | 73% | 0.734 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 146.4 | 177.9 | 27.5 | -33.5 | 0 | 0 | 0 | 110.5 | Q126 | P124-Q126 PolarHBondContact O-N 3.11Š|
| 125 | P | 61.4 | Low | 60.2 | Low | 124 Ų | 124 | 138.8 Ų | 138.8 | 81% | 0.805 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 133.2 | 176 | 24.9 | -30.9 | 0 | 0 | 0 | 110 | G127 | P125-G127 PolarHBondContact O-N 3.28Å; P125-G127 VanDerWaalsContact O-N 3.11Å |
| 126 | Q | 60.6 | Low | 58.4 | Low | 199 Ų | 199 | 136.3 Ų | 136.3 | 93% | 0.93 | 80% | 0.798 | S | S | * | * | | | trans | -60.6 | 114.5 | 178.2 | -74.2 | 178.5 | -17.7 | 0 | 0 | 109.9 | P124 | P124-Q126 PolarHBondContact O-N 3.11Š|
| 127 | G | 48.7 | Very low | 57.7 | Low | 72 Ų | 72 | 134.4 Ų | 134.4 | 74% | 0.742 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 151.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | P125 | P125-G127 PolarHBondContact O-N 3.28Å; P125-G127 VanDerWaalsContact O-N 3.11Å |
| 128 | R | 61.9 | Low | 57.1 | Low | 236 Ų | 236 | 133.5 Ų | 133.5 | 89% | 0.891 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 155.7 | 177.6 | -58.5 | -177.8 | -167.6 | -142.7 | 2.6 | 111.5 | Q130 | R128-Q130 PolarHBondContact O-N 3.37Š|
| 129 | P | 56.4 | Low | 56.7 | Low | 132 Ų | 132 | 130 Ų | 130 | 86% | 0.857 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -61 | 134 | -177.9 | 21.6 | -31.2 | 0 | 0 | 0 | 112.4 | | |
| 130 | Q | 61.8 | Low | 57.2 | Low | 196 Ų | 196 | 139 Ų | 139 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 134.1 | 175.5 | -69.1 | 178.2 | 13.2 | 0 | 0 | 110 | R128 | R128-Q130 PolarHBondContact O-N 3.37Š|
| 131 | G | 52.7 | Low | 57.3 | Low | 62 Ų | 62 | 140.4 Ų | 140.4 | 64% | 0.639 | 80% | 0.801 | S | S | * | * | | | trans | -65.6 | 174.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | | |
| 132 | P | 61 | Low | 57.3 | Low | 117 Ų | 117 | 138 Ų | 138 | 76% | 0.76 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 146.9 | -171 | 26.3 | -34.1 | 0 | 0 | 0 | 112.5 | Q134 | P132-Q134 PolarHBondContact O-N 3.43Š|
| 133 | P | 56.1 | Low | 57.3 | Low | 120 Ų | 120 | 144.6 Ų | 144.6 | 78% | 0.779 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 125.8 | -179.7 | 26.9 | -32.5 | 0 | 0 | 0 | 111 | Q135 | P133-Q135 PolarHBondContact O-N 3Š|
| 134 | Q | 58 | Low | 56.9 | Low | 192 Ų | 192 | 142.1 Ų | 142.1 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 118.4 | 171.3 | -66.8 | -90.3 | 28.6 | 0 | 0 | 109 | P132 | P132-Q134 PolarHBondContact O-N 3.43Š|
| 135 | Q | 52.3 | Low | 57.1 | Low | 195 Ų | 195 | 147.9 Ų | 147.9 | 91% | 0.911 | 81% | 0.814 | S | S | * | * | | | trans | -82.5 | 113.9 | 170.3 | -63.9 | -176.2 | 26.2 | 0 | 0 | 108.7 | P133 | P133-Q135 PolarHBondContact O-N 3Š|
| 136 | G | 41.2 | Very low | 57.2 | Low | 66 Ų | 66 | 148 Ų | 148 | 68% | 0.68 | 82% | 0.815 | S | S | * | * | | | trans | -159.5 | 115.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | | |
| 137 | G | 54 | Low | 57.5 | Low | 75 Ų | 75 | 148 Ų | 148 | 77% | 0.773 | 82% | 0.815 | S | S | * | * | | | trans | -71.7 | 142.7 | -165.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 138 | H | 53.8 | Low | 57.9 | Low | 176 Ų | 176 | 147.2 Ų | 147.2 | 82% | 0.815 | 81% | 0.807 | S | S | * | * | | | trans | -136.4 | 137.4 | 156.7 | -62.8 | -59 | 0 | 0 | 0 | 108.8 | R140 | H138-R140 PolarHBondContact O-N 3.49Š|
| 139 | P | 56.3 | Low | 58.4 | Low | 123 Ų | 123 | 141.6 Ų | 141.6 | 80% | 0.799 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 132.1 | 169.1 | 25.9 | -30.7 | 0 | 0 | 0 | 108.7 | | |
| 140 | R | 59.7 | Low | 58.5 | Low | 240 Ų | 240 | 141 Ų | 141 | 91% | 0.906 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 127.1 | 173.5 | -77 | -176.6 | 179.5 | -141.6 | 0 | 108.2 | H138 | H138-R140 PolarHBondContact O-N 3.49Š|
| 141 | P | 57.9 | Low | 58.6 | Low | 110 Ų | 110 | 140.8 Ų | 140.8 | 71% | 0.714 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 150.8 | 171.1 | 25.6 | -31.2 | 0 | 0 | 0 | 109.4 | R143 | P141-R143 PolarHBondContact O-N 2.87Š|
| 142 | P | 60.6 | Low | 58.9 | Low | 124 Ų | 124 | 146.8 Ų | 146.8 | 81% | 0.805 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 134.8 | 178.6 | 22.2 | -30.9 | 0 | 0 | 0 | 109.3 | G144 | P142-G144 PolarHBondContact O-N 3.27Š|
| 143 | R | 63.2 | Low | 58.4 | Low | 250 Ų | 250 | 144.2 Ų | 144.2 | 94% | 0.943 | 80% | 0.803 | S | S | * | * | | | trans | -53.5 | 105 | -179.3 | -165.1 | 177 | -172.9 | 173.3 | 0.8 | 107.9 | P141 | P141-R143 PolarHBondContact O-N 2.87Š|
| 144 | G | 55.9 | Low | 58.4 | Low | 63 Ų | 63 | 141.9 Ų | 141.9 | 65% | 0.649 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 152.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111 | P142 | P142-G144 PolarHBondContact O-N 3.27Š|
| 145 | R | 65.8 | Low | 58.6 | Low | 234 Ų | 234 | 139.7 Ų | 139.7 | 88% | 0.883 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 148.9 | 172.3 | -70.8 | -179.2 | -178.3 | -117.8 | 0.9 | 109.5 | Q147 | R145-Q147 PolarHBondContact O-N 2.93Å; R145-Q147 VanDerWaalsContact O-N 3.14Å |
| 146 | P | 62.9 | Low | 59 | Low | 127 Ų | 127 | 139.6 Ų | 139.6 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 126 | 173.7 | -20.6 | 29.9 | 0 | 0 | 0 | 109 | G148 | P146-G148 PolarHBondContact O-N 3.48Å; P146-G148 VanDerWaalsContact O-N 3.14Å |
| 147 | Q | 66.8 | Low | 60 | Low | 198 Ų | 198 | 144.2 Ų | 144.2 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 122.1 | 167.3 | -87.6 | 166.9 | -0.1 | 0 | 0 | 106.6 | R145 | R145-Q147 PolarHBondContact O-N 2.93Å; R145-Q147 VanDerWaalsContact O-N 3.14Å |
| 148 | G | 58.3 | Low | 60.7 | Low | 56 Ų | 56 | 143.2 Ų | 143.2 | 58% | 0.577 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 164.7 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | P146 | P146-G148 PolarHBondContact O-N 3.48Å; P146-G148 VanDerWaalsContact O-N 3.14Å |
| 149 | P | 70.8 | Confident | 61.7 | Low | 118 Ų | 118 | 140.9 Ų | 140.9 | 77% | 0.766 | 78% | 0.783 | S | S | * | * | S | Bend | trans | -51.7 | 145.5 | 177.9 | 23.9 | -33.8 | 0 | 0 | 0 | 110.3 | Q151 | P149-Q151 PolarHBondContact O-N 2.96Š|
| 150 | P | 60.5 | Low | 62.7 | Low | 119 Ų | 119 | 140.6 Ų | 140.6 | 77% | 0.773 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 122 | 177.9 | 22.1 | -31.5 | 0 | 0 | 0 | 108.3 | Q152 | P150-Q152 PolarHBondContact O-N 3.42Š|
| 151 | Q | 62.8 | Low | 63.5 | Low | 192 Ų | 192 | 134.5 Ų | 134.5 | 90% | 0.897 | 77% | 0.773 | S | S | * | * | | | trans | -62 | 111.3 | 172.8 | -65.5 | -153.7 | 44.7 | 0 | 0 | 106.5 | P149 G153 | P149-Q151 PolarHBondContact O-N 2.96Å; Q151-G153 PolarHBondContact O-N 3.34Å |
| 152 | Q | 59.3 | Low | 64.7 | Low | 187 Ų | 187 | 134.8 Ų | 134.8 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | | | trans | -57.1 | 118.4 | 175.9 | -67.4 | -173.7 | 15.1 | 0 | 0 | 106.8 | P150 G154 | P150-Q152 PolarHBondContact O-N 3.42Å; Q152-G154 PolarHBondContact O-N 2.94Å; Q152-G154 VanDerWaalsContact O-N 3.1Å |
| 153 | G | 50.8 | Low | 65.8 | Low | 64 Ų | 64 | 134.3 Ų | 134.3 | 66% | 0.66 | 77% | 0.771 | S | S | * | * | | | trans | -48.1 | 121.1 | -174.5 | 0 | 0 | 0 | 0 | 0 | 110.2 | Q151 H155 | Q151-G153 PolarHBondContact O-N 3.34Å; G153-H155 PolarHBondContact O-N 3.37Å; G153-H155 PolarHBondContact O-ND1 2.91Å |
| 154 | G | 55.5 | Low | 66.8 | Low | 70 Ų | 70 | 128.5 Ų | 128.5 | 72% | 0.722 | 77% | 0.766 | S | S | * | * | | | trans | -56.7 | 106.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 107.8 | Q152 Q156 | Q152-G154 PolarHBondContact O-N 2.94Å; Q152-G154 VanDerWaalsContact O-N 3.1Å; G154-Q156 VanDerWaalsContact C-N 3.32Å; G154-Q156 PolarHBondContact O-N 2.97Å |
| 155 | H | 61.4 | Low | 68.2 | Low | 146 Ų | 146 | 128.9 Ų | 128.9 | 68% | 0.676 | 77% | 0.77 | S | S | * | * | | | trans | -63.2 | 104.2 | 165.2 | 26.7 | -77.2 | 0 | 0 | 0 | 104.8 | G153 Q157 | G153-H155 PolarHBondContact O-N 3.37Å; G153-H155 PolarHBondContact O-ND1 2.91Å; H155-Q157 PolarHBondContact O-N 3.46Å |
| 156 | Q | 61.5 | Low | 69.3 | Low | 194 Ų | 194 | 127.1 Ų | 127.1 | 91% | 0.907 | 77% | 0.769 | S | S | * | * | | | trans | -61.5 | 93.1 | 164.5 | -66.4 | -169.2 | 48.4 | 0 | 0 | 105.4 | G154 G158 | G154-Q156 VanDerWaalsContact C-N 3.32Å; G154-Q156 PolarHBondContact O-N 2.97Å; Q156-G158 PolarHBondContact O-N 3.34Å |
| 157 | Q | 61.4 | Low | 70.3 | Confident | 162 Ų | 162 | 126.9 Ų | 126.9 | 76% | 0.757 | 77% | 0.767 | S | S | * | * | | | trans | -60.9 | 111.8 | 168.7 | -59.2 | -166.5 | 18 | 0 | 0 | 104.5 | H155 | H155-Q157 PolarHBondContact O-N 3.46Š|
| 158 | G | 68.6 | Low | 71.2 | Confident | 54 Ų | 54 | 126.9 Ų | 126.9 | 56% | 0.557 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 167.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.3 | Q156 | Q156-G158 PolarHBondContact O-N 3.34Š|
| 159 | P | 76.1 | Confident | 72.2 | Confident | 127 Ų | 127 | 126.7 Ų | 126.7 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | S | Bend | trans | -51.6 | 142.3 | 178.4 | 23.5 | -33.2 | 0 | 0 | 0 | 110.2 | | |
| 160 | P | 75.9 | Confident | 72.9 | Confident | 117 Ų | 117 | 126.8 Ų | 126.8 | 76% | 0.76 | 77% | 0.766 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 149.2 | 179.9 | 24.6 | -33.9 | 0 | 0 | 0 | 110.3 | | |
| 161 | P | 77.9 | Confident | 73.8 | Confident | 113 Ų | 113 | 126.2 Ų | 126.2 | 73% | 0.734 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 149.9 | 176.7 | 26.1 | -33.8 | 0 | 0 | 0 | 110.5 | | |
| 162 | P | 82.2 | Confident | 74.5 | Confident | 115 Ų | 115 | 123.1 Ų | 123.1 | 75% | 0.747 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 151 | 178.1 | 26.2 | -34 | 0 | 0 | 0 | 110.9 | | |
| 163 | P | 83.7 | Confident | 75.3 | Confident | 114 Ų | 114 | 123.2 Ų | 123.2 | 74% | 0.74 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 151.6 | 179.1 | 25.9 | -33.8 | 0 | 0 | 0 | 111 | G165 | P163-G165 PolarHBondContact O-N 2.95Š|
| 164 | P | 84.8 | Confident | 76.1 | Confident | 128 Ų | 128 | 123.6 Ų | 123.6 | 83% | 0.831 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 140 | 173.9 | -21 | 31 | 0 | 0 | 0 | 111.1 | | |
| 165 | G | 85.6 | Confident | 76.6 | Confident | 71 Ų | 71 | 123.8 Ų | 123.8 | 73% | 0.732 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 150.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | P163 | P163-G165 PolarHBondContact O-N 2.95Š|
| 166 | K | 88.6 | Confident | 76.9 | Confident | 198 Ų | 198 | 128.2 Ų | 128.2 | 86% | 0.861 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 143.1 | 174.4 | 59.7 | -172.3 | 175 | -169.2 | 0 | 110.9 | Q168 | K166-Q168 PolarHBondContact O-N 3.41Š|
| 167 | P | 82.9 | Confident | 77 | Confident | 122 Ų | 122 | 124.8 Ų | 124.8 | 79% | 0.792 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 138 | 175 | -24.3 | 33.5 | 0 | 0 | 0 | 111.2 | G169 | P167-G169 PolarHBondContact O-N 3.1Š|
| 168 | Q | 86.1 | Confident | 77.2 | Confident | 198 Ų | 198 | 126.3 Ų | 126.3 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 125.7 | 170.9 | -170 | 151.6 | 22.8 | 0 | 0 | 108.3 | K166 | K166-Q168 PolarHBondContact O-N 3.41Š|
| 169 | G | 80.6 | Confident | 76.8 | Confident | 52 Ų | 52 | 126.4 Ų | 126.4 | 54% | 0.536 | 78% | 0.779 | S | S | . | * | P | Polyproline II helix | trans | -59 | 162.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | P167 | P167-G169 PolarHBondContact O-N 3.1Š|
| 170 | P | 84.3 | Confident | 76.5 | Confident | 119 Ų | 119 | 126 Ų | 126 | 77% | 0.773 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 147.5 | 177.6 | 25.2 | -34.1 | 0 | 0 | 0 | 110.6 | | |
| 171 | P | 79.8 | Confident | 75.9 | Confident | 108 Ų | 108 | 126.6 Ų | 126.6 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 145.9 | 175.9 | 25.4 | -33.7 | 0 | 0 | 0 | 110 | Q173 | P171-Q173 PolarHBondContact O-N 3.29Å; P171-Q173 VanDerWaalsContact O-N 3.09Å |
| 172 | P | 78 | Confident | 75.2 | Confident | 126 Ų | 126 | 130.6 Ų | 130.6 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 120.8 | 176.6 | 24 | -31.9 | 0 | 0 | 0 | 108.6 | G174 | P172-G174 PolarHBondContact O-N 3.16Š|
| 173 | Q | 76.3 | Confident | 74.2 | Confident | 189 Ų | 189 | 128.4 Ų | 128.4 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -66 | 120.2 | 174.1 | -63.9 | -173.1 | 16.6 | 0 | 0 | 107.3 | P171 | P171-Q173 PolarHBondContact O-N 3.29Å; P171-Q173 VanDerWaalsContact O-N 3.09Å |
| 174 | G | 66.4 | Low | 72.8 | Confident | 73 Ų | 73 | 132.2 Ų | 132.2 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -47.6 | 141.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P172 | P172-G174 PolarHBondContact O-N 3.16Š|
| 175 | G | 66.9 | Low | 71.5 | Confident | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 153.5 | -176 | 0 | 0 | 0 | 0 | 0 | 113.7 | | |
| 176 | R | 67.9 | Low | 70.6 | Confident | 238 Ų | 238 | 134 Ų | 134 | 90% | 0.898 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 139.7 | 177.6 | -61.7 | 178.3 | 178.8 | -152.2 | -1.6 | 110.2 | Q178 | R176-Q178 PolarHBondContact O-N 3.4Š|
| 177 | P | 63.8 | Low | 69 | Low | 123 Ų | 123 | 137.3 Ų | 137.3 | 80% | 0.799 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 131.3 | 172.6 | 23.1 | -30.9 | 0 | 0 | 0 | 109 | G179 | P177-G179 PolarHBondContact O-N 2.94Å; P177-G179 VanDerWaalsContact O-N 3.11Å |
| 178 | Q | 64.4 | Low | 68.3 | Low | 193 Ų | 193 | 138.1 Ų | 138.1 | 90% | 0.902 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 119.5 | 168.9 | -73.9 | -178.3 | 10.9 | 0 | 0 | 106.9 | R176 | R176-Q178 PolarHBondContact O-N 3.4Š|
| 179 | G | 60.6 | Low | 67.4 | Low | 57 Ų | 57 | 134.9 Ų | 134.9 | 59% | 0.588 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 160.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111 | P177 | P177-G179 PolarHBondContact O-N 2.94Å; P177-G179 VanDerWaalsContact O-N 3.11Å |
| 180 | P | 69.5 | Low | 66.7 | Low | 117 Ų | 117 | 139.5 Ų | 139.5 | 76% | 0.76 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -56 | 145.8 | -179.2 | 24.5 | -33.4 | 0 | 0 | 0 | 110.9 | Q182 | P180-Q182 PolarHBondContact O-N 3.13Š|
| 181 | P | 63.2 | Low | 65.6 | Low | 131 Ų | 131 | 140.7 Ų | 140.7 | 85% | 0.851 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -58 | 122.9 | 178.8 | 22.5 | -31.4 | 0 | 0 | 0 | 109.6 | G183 | P181-G183 PolarHBondContact O-N 3.31Š|
| 182 | Q | 64.4 | Low | 64.8 | Low | 197 Ų | 197 | 142.8 Ų | 142.8 | 92% | 0.921 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -71.1 | 120.8 | 176.3 | -69.4 | -168.8 | -7.6 | 0 | 0 | 109.7 | P180 | P180-Q182 PolarHBondContact O-N 3.13Š|
| 183 | G | 59.5 | Low | 63.9 | Low | 68 Ų | 68 | 143.9 Ų | 143.9 | 70% | 0.701 | 84% | 0.838 | S | S | * | * | | | trans | 69.6 | 101.8 | 151.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | P181 | P181-G183 PolarHBondContact O-N 3.31Š|
| 184 | Q | 56.2 | Low | 63 | Low | 195 Ų | 195 | 140.6 Ų | 140.6 | 91% | 0.911 | 83% | 0.834 | S | S | * | * | | | trans | -99.3 | 110.3 | 141.4 | -71.2 | -177 | 7 | 0 | 0 | 107.2 | | |
| 185 | S | 56.8 | Low | 62.7 | Low | 108 Ų | 108 | 145.8 Ų | 145.8 | 76% | 0.755 | 84% | 0.841 | S | S | * | * | | | trans | -72.1 | 126.3 | 168.7 | -59.6 | 0 | 0 | 0 | 0 | 108.5 | | |
| 186 | P | 66 | Low | 62.4 | Low | 129 Ų | 129 | 151.8 Ų | 151.8 | 84% | 0.838 | 85% | 0.847 | S | S | * | * | | | trans | -68.5 | 133.6 | 172.3 | 26.2 | -29.7 | 0 | 0 | 0 | 109.8 | | |
| 187 | Q | 56.3 | Low | 61.9 | Low | 266 Ų | 266 | 144 Ų | 144 | 100% | 1.243 | 84% | 0.842 | S | S | * | * | | | trans | -84.1 | 0 | 168.4 | -69.4 | -152.5 | -29.7 | 0 | 0 | 111.2 | | |