| 1 | S | 57.5 | Low | 61.9 | Low | 183 Ų | 183 | 125.4 Ų | 125.4 | 100% | 1.28 | 82% | 0.821 | S | S | * | * | | | | 0 | 113.1 | 0 | -69.4 | 0 | 0 | 0 | 0 | 111.1 | | |
| 2 | S | 67.9 | Low | 62 | Low | 123 Ų | 123 | 124.4 Ų | 124.4 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | | | trans | -134.5 | 119.9 | 161.8 | -169.1 | 0 | 0 | 0 | 0 | 106.4 | L4 | S2-L4 PolarHBondContact O-N 3.17Š|
| 3 | T | 64.9 | Low | 61.6 | Low | 130 Ų | 130 | 127.5 Ų | 127.5 | 80% | 0.798 | 80% | 0.8 | S | S | * | * | | | trans | -69.7 | 125.1 | -176.1 | 51.4 | 0 | 0 | 0 | 0 | 109.1 | S5 | T3-S5 PolarHBondContact O-N 3.39Š|
| 4 | L | 59 | Low | 61.5 | Low | 153 Ų | 153 | 124.4 Ų | 124.4 | 80% | 0.801 | 79% | 0.793 | S | S | * | * | | | trans | -22.3 | 101.8 | 165.3 | -130.1 | 84.6 | 0 | 0 | 0 | 111.2 | S2 L6 | S2-L4 PolarHBondContact O-N 3.17Å; L4-L6 PolarHBondContact O-N 3.34Å; L4-L6 VanDerWaalsContact C-N 3.32Å |
| 5 | S | 64.4 | Low | 61.6 | Low | 117 Ų | 117 | 128.5 Ų | 128.5 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | | | trans | -70.2 | 99.6 | 172.4 | 54 | 0 | 0 | 0 | 0 | 106.2 | T3 S7 | T3-S5 PolarHBondContact O-N 3.39Å; S5-S7 PolarHBondContact O-N 3.38Å |
| 6 | L | 63.6 | Low | 61.5 | Low | 139 Ų | 139 | 127.1 Ų | 127.1 | 73% | 0.728 | 79% | 0.785 | S | S | * | * | | | trans | -52.9 | 131.8 | 175.8 | -62.7 | 173.6 | 0 | 0 | 0 | 108.1 | L4 | L4-L6 PolarHBondContact O-N 3.34Å; L4-L6 VanDerWaalsContact C-N 3.32Å |
| 7 | S | 59 | Low | 61.5 | Low | 101 Ų | 101 | 131.2 Ų | 131.2 | 71% | 0.706 | 79% | 0.789 | S | S | * | * | | | trans | -43.6 | 141.3 | 168.5 | -52.8 | 0 | 0 | 0 | 0 | 109.3 | S5 V9 | S5-S7 PolarHBondContact O-N 3.38Å; S7-V9 PolarHBondContact O-N 3.2Å |
| 8 | P | 61.6 | Low | 61.3 | Low | 118 Ų | 118 | 131.6 Ų | 131.6 | 77% | 0.766 | 79% | 0.786 | S | S | * | * | | | trans | -49.2 | 119.3 | -174.5 | -26.7 | 33.3 | 0 | 0 | 0 | 110.5 | G10 | P8-G10 PolarHBondContact O-N 3.19Å; P8-G10 VanDerWaalsContact O-N 3.12Å |
| 9 | V | 59.5 | Low | 61 | Low | 146 Ų | 146 | 137.5 Ų | 137.5 | 89% | 0.885 | 79% | 0.793 | S | S | * | * | S | Bend | trans | -60 | 116.9 | 168.2 | 161.2 | 0 | 0 | 0 | 0 | 106.4 | S7 | S7-V9 PolarHBondContact O-N 3.2Š|
| 10 | G | 63 | Low | 60.7 | Low | 63 Ų | 63 | 134.1 Ų | 134.1 | 65% | 0.649 | 78% | 0.778 | S | S | * | * | | | trans | 95.3 | 56.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | P8 D12 | P8-G10 PolarHBondContact O-N 3.19Å; P8-G10 VanDerWaalsContact O-N 3.12Å; G10-D12 PolarHBondContact O-N 2.87Å |
| 11 | S | 60.1 | Low | 60.4 | Low | 106 Ų | 106 | 133.1 Ų | 133.1 | 74% | 0.741 | 78% | 0.776 | S | S | * | * | | | trans | -68.6 | 78.3 | 152.4 | -159.1 | 0 | 0 | 0 | 0 | 108.7 | H13 | S11-H13 PolarHBondContact O-N 2.71Š|
| 12 | D | 63.3 | Low | 59.7 | Low | 114 Ų | 114 | 130.1 Ų | 130.1 | 61% | 0.61 | 75% | 0.749 | S | S | * | * | | | trans | -91 | 82.6 | 173.6 | -165.2 | -81.6 | 0 | 0 | 0 | 108.1 | G10 | G10-D12 PolarHBondContact O-N 2.87Š|
| 13 | H | 57.2 | Low | 58.9 | Low | 164 Ų | 164 | 128.7 Ų | 128.7 | 76% | 0.759 | 75% | 0.745 | S | S | * | * | | | trans | -110.7 | 38.2 | 166.1 | -72.6 | -76.1 | 0 | 0 | 0 | 110.9 | S11 K15 | S11-H13 PolarHBondContact O-N 2.71Å; H13-K15 VanDerWaalsContact C-N 3.27Å; H13-K15 PolarHBondContact O-N 2.93Å |
| 14 | A | 60 | Low | 58 | Low | 84 Ų | 84 | 130.7 Ų | 130.7 | 69% | 0.694 | 75% | 0.746 | S | S | * | * | | | trans | -92.9 | 53.3 | 166 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 15 | K | 62.4 | Low | 57.3 | Low | 186 Ų | 186 | 128.9 Ų | 128.9 | 81% | 0.809 | 75% | 0.746 | S | S | * | * | | | trans | -125.8 | 54.6 | 161.7 | -68.6 | -175.5 | -172.6 | 158.4 | 0 | 110.1 | H13 | H13-K15 VanDerWaalsContact C-N 3.27Å; H13-K15 PolarHBondContact O-N 2.93Å |
| 16 | V | 60.9 | Low | 56.3 | Low | 107 Ų | 107 | 127.7 Ų | 127.7 | 65% | 0.648 | 74% | 0.743 | S | S | * | * | S | Bend | trans | -126.1 | 28.5 | 166.3 | -61.7 | 0 | 0 | 0 | 0 | 111.6 | | |
| 17 | F | 60.5 | Low | 55.3 | Low | 196 Ų | 196 | 126.6 Ų | 126.6 | 86% | 0.86 | 74% | 0.744 | S | S | * | * | S | Bend | trans | -143.2 | 59.7 | 170.1 | -65 | -73.9 | 0 | 0 | 0 | 110.9 | | |
| 18 | D | 58.8 | Low | 55 | Low | 138 Ų | 138 | 127.4 Ų | 127.4 | 74% | 0.738 | 75% | 0.75 | S | S | * | * | | | trans | -154.1 | 50.4 | 142.8 | -153 | 3.6 | 0 | 0 | 0 | 112.4 | S20 | D18-S20 WeakPolarHBondContact OD1-CB 3.2Å; D18-S20 PolarHBondContact OD1-N 2.81Å; D18-S20 PolarHBondContact O-N 2.91Å |
| 19 | R | 55.3 | Low | 54.4 | Low | 245 Ų | 245 | 127.5 Ų | 127.5 | 93% | 0.925 | 75% | 0.748 | S | S | * | * | | | trans | -83.2 | 65.2 | 140.2 | -73.3 | -173.6 | 179.6 | -156.4 | 0.7 | 106.7 | | |
| 20 | S | 55.9 | Low | 54 | Low | 69 Ų | 69 | 126.1 Ų | 126.1 | 48% | 0.483 | 74% | 0.742 | S | S | . | * | | | trans | -44 | 125.6 | 141.7 | 171 | 0 | 0 | 0 | 0 | 105.8 | D18 V22 | D18-S20 WeakPolarHBondContact OD1-CB 3.2Å; D18-S20 PolarHBondContact OD1-N 2.81Å; D18-S20 PolarHBondContact O-N 2.91Å; S20-V22 VanDerWaalsContact C-N 3.25Å; S20-V22 PolarHBondContact O-N 2.93Å |
| 21 | P | 53.4 | Low | 53.5 | Low | 114 Ų | 114 | 127.6 Ų | 127.6 | 74% | 0.74 | 75% | 0.748 | S | S | * | * | | | trans | -57.2 | 108.2 | 161 | 25.5 | -28.5 | 0 | 0 | 0 | 104 | A23 | P21-A23 PolarHBondContact O-N 3.49Š|
| 22 | V | 43.8 | Very low | 53 | Low | 119 Ų | 119 | 128.2 Ų | 128.2 | 72% | 0.721 | 75% | 0.75 | S | S | * | * | | | trans | -48.5 | 107.5 | 162.6 | 161.9 | 0 | 0 | 0 | 0 | 103.6 | S20 Q24 | S20-V22 VanDerWaalsContact C-N 3.25Å; S20-V22 PolarHBondContact O-N 2.93Å; V22-Q24 PolarHBondContact O-N 2.66Å |
| 23 | A | 50.5 | Low | 52.7 | Low | 93 Ų | 93 | 127.2 Ų | 127.2 | 77% | 0.769 | 76% | 0.757 | S | S | * | * | | | trans | -61.6 | 92.9 | 167.7 | 0 | 0 | 0 | 0 | 0 | 103.9 | P21 S25 | P21-A23 PolarHBondContact O-N 3.49Å; A23-S25 PolarHBondContact O-N 2.75Å |
| 24 | Q | 46.2 | Very low | 52.6 | Low | 173 Ų | 173 | 124.5 Ų | 124.5 | 81% | 0.808 | 75% | 0.754 | S | S | * | * | | | trans | -50.2 | 127.5 | 165.1 | -79.3 | 179.9 | -42.9 | 0 | 0 | 105.8 | V22 A26 | V22-Q24 PolarHBondContact O-N 2.66Å; Q24-A26 PolarHBondContact O-N 2.83Å |
| 25 | S | 43.1 | Very low | 52.5 | Low | 115 Ų | 115 | 129 Ų | 129 | 80% | 0.804 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -28.4 | 119.3 | 174.8 | 48.9 | 0 | 0 | 0 | 0 | 113 | A23 | A23-S25 PolarHBondContact O-N 2.75Š|
| 26 | A | 43.5 | Very low | 52.1 | Low | 91 Ų | 91 | 125.4 Ų | 125.4 | 75% | 0.752 | 76% | 0.759 | S | S | * | * | | | trans | 11.3 | 139.9 | 162.3 | 0 | 0 | 0 | 0 | 0 | 119.2 | Q24 | Q24-A26 PolarHBondContact O-N 2.83Š|
| 27 | P | 43.6 | Very low | 51.9 | Low | 117 Ų | 117 | 127.2 Ų | 127.2 | 76% | 0.76 | 77% | 0.77 | S | S | * | * | | | | -120.4 | 145.3 | 99.7 | 34.8 | -31 | 0 | 0 | 0 | 111.5 | V29 | P27-V29 PolarHBondContact O-N 3.12Å; P27-V29 VanDerWaalsContact O-N 3.15Å |
| 28 | S | 51.6 | Low | 51.6 | Low | 118 Ų | 118 | 123.7 Ų | 123.7 | 83% | 0.825 | 77% | 0.765 | S | S | * | * | | | trans | -49.2 | 110.5 | 177.6 | 52 | 0 | 0 | 0 | 0 | 113.1 | | |
| 29 | V | 50.4 | Low | 51.2 | Low | 120 Ų | 120 | 120.9 Ų | 120.9 | 73% | 0.727 | 76% | 0.757 | S | S | * | * | | | trans | -141.1 | 127 | 163.6 | -170.4 | 0 | 0 | 0 | 0 | 108 | P27 | P27-V29 PolarHBondContact O-N 3.12Å; P27-V29 VanDerWaalsContact O-N 3.15Å |
| 30 | P | 50.3 | Low | 51.5 | Low | 116 Ų | 116 | 114.8 Ų | 114.8 | 75% | 0.753 | 75% | 0.749 | S | S | * | * | | | trans | -72.3 | 137.7 | -176.9 | 30.1 | -32.3 | 0 | 0 | 0 | 110.4 | | |
| 31 | A | 51.5 | Low | 51.5 | Low | 95 Ų | 95 | 118.8 Ų | 118.8 | 79% | 0.785 | 76% | 0.764 | S | S | * | * | | | trans | -59.1 | 154.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | | |
| 32 | P | 51.2 | Low | 51.7 | Low | 119 Ų | 119 | 118.7 Ų | 118.7 | 77% | 0.773 | 76% | 0.763 | S | S | * | * | | | | -124.4 | 127.6 | 125 | 33.6 | -25.5 | 0 | 0 | 0 | 109.8 | P34 | P32-P34 WeakPolarHBondContact O-CD 3.35Š|
| 33 | A | 57 | Low | 52.6 | Low | 93 Ų | 93 | 117 Ų | 117 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | | | trans | -74.7 | 130.7 | 162.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | | |
| 34 | P | 55.2 | Low | 53.2 | Low | 106 Ų | 106 | 118.9 Ų | 118.9 | 69% | 0.688 | 77% | 0.766 | S | S | * | * | | | trans | -98.6 | 115 | 147.8 | 32 | -24.8 | 0 | 0 | 0 | 108.5 | P32 T36 | P32-P34 WeakPolarHBondContact O-CD 3.35Å; P34-T36 PolarHBondContact O-N 2.99Å; P34-T36 VanDerWaalsContact O-N 3.12Å |
| 35 | L | 56.6 | Low | 54.1 | Low | 180 Ų | 180 | 113.6 Ų | 113.6 | 94% | 0.942 | 76% | 0.758 | S | S | * | * | | | trans | -59.7 | 105.7 | 160.4 | -70.1 | 157.6 | 0 | 0 | 0 | 108 | | |
| 36 | T | 54.6 | Low | 55.1 | Low | 109 Ų | 109 | 115.5 Ų | 115.5 | 67% | 0.669 | 76% | 0.758 | S | S | * | * | | | trans | -120.7 | 102.7 | 165.5 | 53.1 | 0 | 0 | 0 | 0 | 109.5 | P34 T38 | P34-T36 PolarHBondContact O-N 2.99Å; P34-T36 VanDerWaalsContact O-N 3.12Å; T36-T38 VanDerWaalsContact C-N 3.27Å; T36-T38 PolarHBondContact O-N 3.34Å |
| 37 | T | 56.8 | Low | 56.3 | Low | 145 Ų | 145 | 119 Ų | 119 | 89% | 0.89 | 76% | 0.763 | S | S | * | * | | | trans | -68.5 | 84 | 164.7 | 163.5 | 0 | 0 | 0 | 0 | 108.7 | | |
| 38 | T | 54.7 | Low | 57.5 | Low | 123 Ų | 123 | 120.7 Ų | 120.7 | 76% | 0.755 | 76% | 0.763 | S | S | * | * | | | trans | -103.3 | 91.1 | 171.5 | -52.1 | 0 | 0 | 0 | 0 | 108.5 | T36 | T36-T38 VanDerWaalsContact C-N 3.27Å; T36-T38 PolarHBondContact O-N 3.34Å |
| 39 | S | 50.4 | Low | 57.9 | Low | 79 Ų | 79 | 120.3 Ų | 120.3 | 55% | 0.552 | 76% | 0.758 | S | S | * | * | | | trans | -38.4 | 138.1 | 162.6 | 176.2 | 0 | 0 | 0 | 0 | 111 | L41 | S39-L41 PolarHBondContact O-N 3.41Š|
| 40 | P | 60.2 | Low | 58.5 | Low | 117 Ų | 117 | 120.2 Ų | 120.2 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | | | trans | -67.8 | 103.3 | 171.8 | 29.4 | -31.4 | 0 | 0 | 0 | 107.4 | P42 | P40-P42 VanDerWaalsContact O-CD 3.26Å; P40-P42 WeakPolarHBondContact O-CD 3.26Å |
| 41 | L | 57.1 | Low | 59.1 | Low | 152 Ų | 152 | 118.9 Ų | 118.9 | 80% | 0.796 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 120.4 | 168.4 | -118.7 | 72.1 | 0 | 0 | 0 | 107.2 | S39 A43 | S39-L41 PolarHBondContact O-N 3.41Å; L41-A43 PolarHBondContact O-N 3.15Å |
| 42 | P | 57.7 | Low | 59.6 | Low | 113 Ų | 113 | 124.1 Ų | 124.1 | 73% | 0.734 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 117.5 | 167.5 | 28 | -30.2 | 0 | 0 | 0 | 106.9 | P40 P44 | P40-P42 VanDerWaalsContact O-CD 3.26Å; P40-P42 WeakPolarHBondContact O-CD 3.26Å; P42-P44 VanDerWaalsContact O-CD 3.26Å; P42-P44 WeakPolarHBondContact O-CD 3.05Å; P42-P44 VanDerWaalsContact O-N 3.13Å |
| 43 | A | 63.3 | Low | 60 | Low | 82 Ų | 82 | 128.9 Ų | 128.9 | 68% | 0.678 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 119 | 175.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | L41 G45 | L41-A43 PolarHBondContact O-N 3.15Å; A43-G45 PolarHBondContact O-N 3.42Å; A43-G45 VanDerWaalsContact O-N 3.16Å |
| 44 | P | 61.4 | Low | 59.9 | Low | 133 Ų | 133 | 129.9 Ų | 129.9 | 86% | 0.864 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -78 | 103.3 | 176.6 | 29.9 | -29.1 | 0 | 0 | 0 | 108.4 | P42 | P42-P44 VanDerWaalsContact O-CD 3.26Å; P42-P44 WeakPolarHBondContact O-CD 3.05Å; P42-P44 VanDerWaalsContact O-N 3.13Å |
| 45 | G | 65 | Low | 60.1 | Low | 62 Ų | 62 | 129.5 Ų | 129.5 | 64% | 0.639 | 77% | 0.773 | S | S | * | * | | | trans | 116.3 | 64.3 | 160.7 | 0 | 0 | 0 | 0 | 0 | 117 | A43 | A43-G45 PolarHBondContact O-N 3.42Å; A43-G45 VanDerWaalsContact O-N 3.16Å |
| 46 | L | 64.8 | Low | 60.3 | Low | 156 Ų | 156 | 125.1 Ų | 125.1 | 82% | 0.817 | 76% | 0.758 | S | S | * | * | | | trans | -120.2 | 32.9 | 156.1 | -67.5 | 177 | 0 | 0 | 0 | 112.1 | M48 | L46-M48 VanDerWaalsContact C-N 3.25Å; L46-M48 PolarHBondContact O-N 2.6Å |
| 47 | L | 68.9 | Low | 60.6 | Low | 164 Ų | 164 | 127.1 Ų | 127.1 | 86% | 0.859 | 76% | 0.764 | S | S | * | * | | | trans | -72.3 | 84.6 | 162.6 | -178.4 | 64.1 | 0 | 0 | 0 | 108.3 | | |
| 48 | M | 68.4 | Low | 60.7 | Low | 152 Ų | 152 | 129.1 Ų | 129.1 | 75% | 0.749 | 77% | 0.766 | S | S | * | * | | | trans | -75.3 | 128.1 | 166.5 | -68.2 | -59.4 | -65.3 | 0 | 0 | 108.7 | L46 S50 | L46-M48 VanDerWaalsContact C-N 3.25Å; L46-M48 PolarHBondContact O-N 2.6Å; M48-S50 PolarHBondContact O-N 2.76Å |
| 49 | P | 61.3 | Low | 60.8 | Low | 111 Ų | 111 | 127 Ų | 127 | 72% | 0.721 | 76% | 0.756 | S | S | * | * | | | trans | -57.3 | 132.2 | 177.6 | -24.4 | 33.2 | 0 | 0 | 0 | 111.8 | A51 | P49-A51 PolarHBondContact O-N 3.04Š|
| 50 | S | 62.1 | Low | 61.7 | Low | 117 Ų | 117 | 127.8 Ų | 127.8 | 82% | 0.818 | 76% | 0.759 | S | S | * | * | | | trans | -48.9 | 100.3 | 177.5 | 172.7 | 0 | 0 | 0 | 0 | 112.2 | M48 | M48-S50 PolarHBondContact O-N 2.76Š|
| 51 | A | 62.8 | Low | 61.8 | Low | 89 Ų | 89 | 127 Ų | 127 | 74% | 0.736 | 75% | 0.754 | S | S | * | * | | | trans | -79.5 | 126.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | P49 R53 | P49-A51 PolarHBondContact O-N 3.04Å; A51-R53 PolarHBondContact O-N 3.37Å |
| 52 | K | 62.8 | Low | 62 | Low | 205 Ų | 205 | 125 Ų | 125 | 89% | 0.891 | 75% | 0.75 | S | S | * | * | | | trans | -38.2 | 103.4 | -177.7 | -66.2 | 171.8 | 178.1 | 176.6 | 0 | 112.3 | P54 | K52-P54 WeakPolarHBondContact O-CD 3.26Š|
| 53 | R | 58.3 | Low | 61.9 | Low | 219 Ų | 219 | 124.6 Ų | 124.6 | 83% | 0.826 | 75% | 0.746 | S | S | * | * | | | trans | -64.9 | 127.3 | 160.8 | -66.2 | -174.8 | -73.7 | 163.8 | -2.9 | 106.9 | A51 A55 | A51-R53 PolarHBondContact O-N 3.37Å; R53-A55 PolarHBondContact O-N 3.16Å |
| 54 | P | 56 | Low | 61.6 | Low | 113 Ų | 113 | 126 Ų | 126 | 73% | 0.734 | 75% | 0.746 | S | S | * | * | | | trans | -61.7 | 91 | 161.6 | -16.3 | 30.3 | 0 | 0 | 0 | 107.1 | K52 S56 | K52-P54 WeakPolarHBondContact O-CD 3.26Å; P54-S56 PolarHBondContact O-N 3.21Å |
| 55 | A | 59.8 | Low | 61.4 | Low | 98 Ų | 98 | 123.6 Ų | 123.6 | 81% | 0.81 | 73% | 0.729 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | 62.9 | 176.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | R53 | R53-A55 PolarHBondContact O-N 3.16Š|
| 56 | S | 60.6 | Low | 61 | Low | 88 Ų | 88 | 126.1 Ų | 126.1 | 62% | 0.615 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -159.8 | 4.1 | 173.7 | 76.2 | 0 | 0 | 0 | 0 | 117.2 | P54 M58 | P54-S56 PolarHBondContact O-N 3.21Å; S56-M58 VanDerWaalsContact C-N 3.31Å |
| 57 | D | 59.9 | Low | 60.6 | Low | 151 Ų | 151 | 124.6 Ų | 124.6 | 81% | 0.807 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.8 | -3.3 | 176.3 | -116.3 | -42.2 | 0 | 0 | 0 | 113.8 | | |
| 58 | M | 58.4 | Low | 60.3 | Low | 188 Ų | 188 | 120.7 Ų | 120.7 | 93% | 0.926 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -134.5 | 27.9 | 174.9 | -72.4 | -68.2 | 171.9 | 0 | 0 | 111.7 | S56 | S56-M58 VanDerWaalsContact C-N 3.31Š|
| 59 | S | 58.4 | Low | 59.9 | Low | 78 Ų | 78 | 120.5 Ų | 120.5 | 55% | 0.545 | 71% | 0.712 | S | S | . | * | P | Polyproline II helix | trans | -88.3 | 119 | 161.4 | -174.7 | 0 | 0 | 0 | 0 | 106.2 | | |
| 60 | P | 67.7 | Low | 60.8 | Low | 96 Ų | 96 | 120.7 Ų | 120.7 | 62% | 0.623 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 144.5 | 156.9 | 25.2 | -31.3 | 0 | 0 | 0 | 106.8 | | |
| 61 | P | 64.1 | Low | 61.8 | Low | 101 Ų | 101 | 124 Ų | 124 | 66% | 0.656 | 71% | 0.713 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 139.1 | 173.9 | 22.5 | -32.4 | 0 | 0 | 0 | 106.7 | T63 | P61-T63 PolarHBondContact O-N 3.12Å; P61-T63 PolarHBondContact O-OG1 2.95Å |
| 62 | P | 60.2 | Low | 62.7 | Low | 108 Ų | 108 | 124.8 Ų | 124.8 | 70% | 0.701 | 71% | 0.71 | S | S | * | * | | | trans | -54.6 | 100.6 | 173.2 | 24 | -31.4 | 0 | 0 | 0 | 104.3 | T64 | P62-T64 PolarHBondContact O-N 2.78Š|
| 63 | T | 56.4 | Low | 63.7 | Low | 106 Ų | 106 | 124.7 Ų | 124.7 | 65% | 0.65 | 71% | 0.71 | S | S | * | * | | | trans | -74.8 | 89.4 | 171.2 | -35.9 | 0 | 0 | 0 | 0 | 97.9 | P61 T65 | P61-T63 PolarHBondContact O-N 3.12Å; P61-T63 PolarHBondContact O-OG1 2.95Å; T63-T65 PolarHBondContact O-N 2.94Å; T63-T65 PolarHBondContact O-OG1 2.99Å; T63-T65 WeakPolarHBondContact CG2-OG1 3.36Å |
| 64 | T | 57 | Low | 65 | Low | 112 Ų | 112 | 122 Ų | 122 | 69% | 0.687 | 71% | 0.711 | S | S | * | * | | | trans | -62.7 | 73.2 | 158.6 | -56.8 | 0 | 0 | 0 | 0 | 103.1 | P62 V66 | P62-T64 PolarHBondContact O-N 2.78Å; T64-V66 HydrophobicContact CG2-CG2 3.51Å; T64-V66 PolarHBondContact O-N 2.75Å |
| 65 | T | 55.6 | Low | 66.6 | Low | 82 Ų | 82 | 123.4 Ų | 123.4 | 50% | 0.503 | 71% | 0.705 | S | S | . | * | | | trans | -66.8 | 81.9 | 164 | -65.4 | 0 | 0 | 0 | 0 | 101.5 | T63 I67 | T63-T65 PolarHBondContact O-N 2.94Å; T63-T65 PolarHBondContact O-OG1 2.99Å; T63-T65 WeakPolarHBondContact CG2-OG1 3.36Å; T65-I67 HydrophobicContact CG2-CB 3.71Å; T65-I67 HydrophobicContact CG2-CD1 3.09Å; T65-I67 HydrophobicContact CG2-CG1 3.16Å; T65-I67 PolarHBondContact O-N 2.82Å |
| 66 | V | 57.8 | Low | 67.9 | Low | 114 Ų | 114 | 127.1 Ų | 127.1 | 69% | 0.691 | 70% | 0.703 | S | S | * | * | | | trans | -65.8 | 57.8 | 149.2 | -165.5 | 0 | 0 | 0 | 0 | 105.3 | T64 A68 | T64-V66 HydrophobicContact CG2-CG2 3.51Å; T64-V66 PolarHBondContact O-N 2.75Å; V66-A68 PolarHBondContact O-N 3.33Å; V66-A68 HydrophobicContact CG1-CB 4.34Å |
| 67 | I | 56.2 | Low | 69.3 | Low | 125 Ų | 125 | 128 Ų | 128 | 64% | 0.641 | 71% | 0.707 | S | S | * | * | | | trans | -66.7 | 91.1 | 142.9 | -70.6 | 163.4 | 0 | 0 | 0 | 100.4 | T65 E69 | T65-I67 HydrophobicContact CG2-CB 3.71Å; T65-I67 HydrophobicContact CG2-CD1 3.09Å; T65-I67 HydrophobicContact CG2-CG1 3.16Å; T65-I67 PolarHBondContact O-N 2.82Å; I67-E69 HydrophobicContact CG2-CB 3.95Å; I67-E69 PolarHBondContact O-N 2.99Å |
| 68 | A | 62 | Low | 70.6 | Confident | 81 Ų | 81 | 129.8 Ų | 129.8 | 67% | 0.669 | 70% | 0.704 | S | S | * | * | | | trans | -61.3 | 74.6 | 155.9 | 0 | 0 | 0 | 0 | 0 | 104.8 | V66 P70 | V66-A68 PolarHBondContact O-N 3.33Å; V66-A68 HydrophobicContact CG1-CB 4.34Å; A68-P70 WeakPolarHBondContact O-CD 3.43Å |
| 69 | E | 60.9 | Low | 71.9 | Confident | 149 Ų | 149 | 131 Ų | 131 | 70% | 0.696 | 70% | 0.704 | S | S | * | * | | | trans | -57.2 | 117.7 | 172.5 | -167.2 | 176.6 | 177.1 | 0 | 0 | 103.3 | I67 K71 | I67-E69 HydrophobicContact CG2-CB 3.95Å; I67-E69 PolarHBondContact O-N 2.99Å; E69-K71 PolarHBondContact O-N 3.37Å |
| 70 | P | 79.7 | Confident | 72.8 | Confident | 115 Ų | 115 | 133.5 Ų | 133.5 | 75% | 0.747 | 72% | 0.716 | S | S | * | * | | | trans | -53.2 | 115.4 | -179.1 | -25.7 | 34.4 | 0 | 0 | 0 | 107.2 | A68 | A68-P70 WeakPolarHBondContact O-CD 3.43Š|
| 71 | K | 83 | Confident | 73.2 | Confident | 187 Ų | 187 | 138.3 Ų | 138.3 | 81% | 0.813 | 73% | 0.73 | S | S | * | * | | | trans | -47.4 | 121.1 | -174.4 | 176.4 | -174.7 | 171.8 | 72.5 | 0 | 108 | E69 K73 | E69-K71 PolarHBondContact O-N 3.37Å; K71-K73 PolarHBondContact O-N 2.93Å |
| 72 | P | 82.7 | Confident | 73.4 | Confident | 104 Ų | 104 | 141.2 Ų | 141.2 | 68% | 0.675 | 76% | 0.763 | S | S | * | * | | | trans | -59.8 | 128.7 | -176.9 | 21 | -31 | 0 | 0 | 0 | 108.9 | L74 | P72-L74 PolarHBondContact O-N 3.01Š|
| 73 | K | 83.3 | Confident | 74 | Confident | 204 Ų | 204 | 142.9 Ų | 142.9 | 89% | 0.887 | 77% | 0.766 | S | S | * | * | | | trans | -69.2 | 115.1 | 176.4 | -71.3 | 175.5 | -178 | 166.4 | 0 | 107.7 | K71 F75 | K71-K73 PolarHBondContact O-N 2.93Å; K73-F75 PolarHBondContact O-N 3.24Å |
| 74 | L | 85.9 | Confident | 75 | Confident | 161 Ų | 161 | 144.8 Ų | 144.8 | 84% | 0.843 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -64.1 | 128.8 | 172.1 | -171.2 | 62.7 | 0 | 0 | 0 | 108.6 | P72 K76 | P72-L74 PolarHBondContact O-N 3.01Å; L74-K76 PolarHBondContact O-N 3.15Å |
| 75 | F | 89.9 | Confident | 75.9 | Confident | 143 Ų | 143 | 146.6 Ų | 146.6 | 63% | 0.627 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 130.3 | 178.8 | -176.6 | -101.6 | 0 | 0 | 0 | 109.9 | K73 Y78 | K73-F75 PolarHBondContact O-N 3.24Å; F75-Y78 AromaticContact CE2-CE2 3.91Å; F75-Y78 VanDerWaalsContact CZ-CE2 3.47Å; F75-Y78 HydrophobicContact CZ-CE2 3.47Å; F75-Y78 AromaticContact CZ-CE2 3.47Å; F75-Y78 HydrophobicContact CZ-CD2 3.88Å; F75-Y78 AromaticContact CZ-CD2 3.88Å; F75-Y78 HydrophobicContact CE2-CE2 3.91Å |
| 76 | K | 87.3 | Confident | 77.1 | Confident | 176 Ų | 176 | 150.4 Ų | 150.4 | 77% | 0.765 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -93.2 | 122.4 | 171.7 | -68 | -177.8 | -179.7 | 178 | 0 | 107.3 | L74 Y78 | L74-K76 PolarHBondContact O-N 3.15Å; K76-Y78 PolarHBondContact O-N 2.74Å |
| 77 | P | 89.6 | Confident | 78.4 | Confident | 107 Ų | 107 | 152.7 Ų | 152.7 | 70% | 0.695 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 136.3 | 175.6 | 24.3 | -31.9 | 0 | 0 | 0 | 109.6 | | |
| 78 | Y | 86 | Confident | 79.8 | Confident | 188 Ų | 188 | 154.5 Ų | 154.5 | 74% | 0.737 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 141.2 | 170.2 | -58.9 | -70.6 | 0 | 0 | 0 | 108.7 | F75 K76 T80 | F75-Y78 AromaticContact CE2-CE2 3.91Å; F75-Y78 VanDerWaalsContact CZ-CE2 3.47Å; F75-Y78 HydrophobicContact CZ-CE2 3.47Å; F75-Y78 AromaticContact CZ-CE2 3.47Å; F75-Y78 HydrophobicContact CZ-CD2 3.88Å; F75-Y78 AromaticContact CZ-CD2 3.88Å; F75-Y78 HydrophobicContact CE2-CE2 3.91Å; K76-Y78 PolarHBondContact O-N 2.74Å; Y78-T80 PolarHBondContact O-N 3.22Å; Y78-T80 VanDerWaalsContact O-N 3.17Å |
| 79 | K | 85.5 | Confident | 81.1 | Confident | 213 Ų | 213 | 159.8 Ų | 159.8 | 93% | 0.926 | 82% | 0.82 | S | S | * | * | | | trans | -66.7 | 115.9 | 172.7 | -64.4 | 177.3 | 74.4 | 178.4 | 0 | 107.4 | | |
| 80 | T | 77.4 | Confident | 82.7 | Confident | 132 Ų | 132 | 160.6 Ų | 160.6 | 81% | 0.81 | 83% | 0.829 | S | S | * | * | | | trans | -82.5 | 112.7 | 163.7 | -53.2 | 0 | 0 | 0 | 0 | 106.6 | Y78 | Y78-T80 PolarHBondContact O-N 3.22Å; Y78-T80 VanDerWaalsContact O-N 3.17Å |
| 81 | E | 75.8 | Confident | 82.9 | Confident | 196 Ų | 196 | 164.4 Ų | 164.4 | 92% | 0.916 | 84% | 0.836 | S | S | * | * | | | trans | -75.9 | 129.7 | 163.4 | -168.1 | -172.1 | -173 | 0 | 0 | 107.1 | | |
| 82 | A | 68.5 | Low | 82.9 | Confident | 162 Ų | 162 | 162.4 Ų | 162.4 | 100% | 1.339 | 84% | 0.838 | S | S | * | * | | | trans | -129.4 | 0 | 176.6 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |