| 1 | Q | 41.4 | Very low | 41.2 | Very low | 243 Ų | 243 | 175.4 Ų | 175.4 | 100% | 1.136 | 85% | 0.848 | S | S | * | * | | | | 0 | 139.2 | 0 | -48.4 | -175.8 | 15.2 | 0 | 0 | 105.6 | | |
| 2 | I | 40.3 | Very low | 40.9 | Very low | 156 Ų | 156 | 172.3 Ų | 172.3 | 80% | 0.8 | 84% | 0.838 | S | S | * | * | | | cis | -138.7 | 163.7 | 34.5 | -73.3 | 167.1 | 0 | 0 | 0 | 111.7 | | |
| 3 | Q | 37.2 | Very low | 40.6 | Very low | 168 Ų | 168 | 168.6 Ų | 168.6 | 79% | 0.785 | 82% | 0.824 | S | S | * | * | | | trans | -35.8 | 149.3 | -179.4 | -104 | 64.6 | 12.3 | 0 | 0 | 121.1 | | |
| 4 | K | 42.2 | Very low | 40.1 | Very low | 173 Ų | 173 | 168.7 Ų | 168.7 | 75% | 0.752 | 83% | 0.829 | S | S | * | * | | | trans | -64.9 | 166.6 | 152 | -69.1 | 168.6 | 174.7 | 159.1 | 0 | 111.2 | | |
| 5 | P | 45.9 | Very low | 40 | Very low | 131 Ų | 131 | 166.3 Ų | 166.3 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | | | | -132.7 | 159 | 112.5 | 22.4 | -5.3 | 0 | 0 | 0 | 114.9 | | |
| 6 | K | 40.5 | Very low | 40 | Very low | 177 Ų | 177 | 166.7 Ų | 166.7 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | | | trans | -108 | 148.1 | 166.3 | -66.3 | 176.2 | 173.6 | -179.5 | 0 | 108.2 | | |
| 7 | K | 37.8 | Very low | 39.6 | Very low | 206 Ų | 206 | 162.7 Ų | 162.7 | 90% | 0.896 | 81% | 0.812 | S | S | * | * | | | | 157.9 | 140.7 | 121.9 | -86 | 168.6 | -178.3 | -177.6 | 0 | 112.6 | | |
| 8 | K | 35.8 | Very low | 39.4 | Very low | 202 Ų | 202 | 159.4 Ų | 159.4 | 88% | 0.878 | 81% | 0.814 | S | S | * | * | | | trans | -79.6 | -179.4 | 157.8 | -53.1 | 178.2 | -179.7 | -178.6 | 0 | 108.3 | | |
| 9 | P | 50.6 | Low | 39.3 | Very low | 110 Ų | 110 | 154.7 Ų | 154.7 | 71% | 0.714 | 81% | 0.809 | S | S | * | * | | | cis | -132.5 | -174.8 | -0.4 | 43.1 | -27.2 | 0 | 0 | 0 | 113.6 | | |
| 10 | D | 40.1 | Very low | 39.2 | Very low | 173 Ų | 173 | 157.5 Ų | 157.5 | 93% | 0.925 | 82% | 0.815 | S | S | * | * | | | trans | -152.3 | 154.9 | 142.1 | -97.2 | -39.5 | 0 | 0 | 0 | 110.6 | | |
| 11 | K | 41.3 | Very low | 39.2 | Very low | 190 Ų | 190 | 155.8 Ų | 155.8 | 83% | 0.826 | 82% | 0.817 | S | S | * | * | | | trans | -150.2 | 147 | -168 | -150.6 | 179.1 | -175 | 178.9 | 0 | 111.1 | | |
| 12 | L | 37.5 | Very low | 39.2 | Very low | 138 Ų | 138 | 152.2 Ų | 152.2 | 72% | 0.723 | 80% | 0.8 | S | S | * | * | | | trans | 87.5 | 118.5 | 159.9 | -113.1 | 70.3 | 0 | 0 | 0 | 120.6 | | |
| 13 | L | 37 | Very low | 39.3 | Very low | 125 Ų | 125 | 150.6 Ų | 150.6 | 65% | 0.654 | 79% | 0.792 | S | S | * | * | | | trans | 60 | 118.8 | 136.2 | -76.7 | 168.4 | 0 | 0 | 0 | 122 | F15 | L13-F15 HydrophobicContact CD2-CD2 4.11Å; L13-F15 HydrophobicContact CD2-CE2 3.94Å |
| 14 | L | 33.9 | Very low | 39.6 | Very low | 170 Ų | 170 | 148.9 Ų | 148.9 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | | | | -146.1 | 151.2 | 111.8 | -147.8 | 65.6 | 0 | 0 | 0 | 113.5 | | |
| 15 | F | 38.6 | Very low | 40.1 | Very low | 133 Ų | 133 | 149 Ų | 149 | 58% | 0.583 | 80% | 0.796 | S | S | * | * | | | trans | -67 | 150.4 | -164.8 | -81.7 | -122.8 | 0 | 0 | 0 | 118.1 | L13 | L13-F15 HydrophobicContact CD2-CD2 4.11Å; L13-F15 HydrophobicContact CD2-CE2 3.94Å |
| 16 | Q | 39.1 | Very low | 40.5 | Very low | 172 Ų | 172 | 151.8 Ų | 151.8 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | | | | 46.1 | 152.5 | 127.9 | -57.1 | 177.9 | 0 | 0 | 0 | 120.6 | | |
| 17 | A | 33.9 | Very low | 41 | Very low | 99 Ų | 99 | 147.1 Ų | 147.1 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | | | cis | -144.9 | -172.9 | 7.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | | |
| 18 | A | 36.7 | Very low | 41.8 | Very low | 103 Ų | 103 | 142.6 Ų | 142.6 | 85% | 0.851 | 78% | 0.782 | S | S | * | * | | | cis | -149.6 | 156.8 | 4.3 | 0 | 0 | 0 | 0 | 0 | 107.3 | | |
| 19 | G | 36 | Very low | 42.8 | Very low | 70 Ų | 70 | 138.1 Ų | 138.1 | 72% | 0.722 | 77% | 0.773 | S | S | * | * | | | | 161.4 | 163.9 | 66.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 20 | F | 37.6 | Very low | 43 | Very low | 211 Ų | 211 | 138.9 Ų | 138.9 | 93% | 0.925 | 78% | 0.778 | S | S | * | * | | | trans | -98.7 | 152.5 | -155.8 | -66.7 | -105.5 | 0 | 0 | 0 | 116.3 | | |
| 21 | S | 39.1 | Very low | 43.4 | Very low | 121 Ų | 121 | 135.6 Ų | 135.6 | 85% | 0.846 | 77% | 0.765 | S | S | * | * | | | trans | -177.9 | 99 | 141 | -77.4 | 0 | 0 | 0 | 0 | 108.8 | | |
| 22 | H | 42.5 | Very low | 44 | Very low | 168 Ų | 168 | 132.4 Ų | 132.4 | 78% | 0.778 | 76% | 0.763 | S | S | * | * | | | | 85.3 | 95.8 | 74.3 | -165 | -84.9 | 0 | 0 | 0 | 115 | | |
| 23 | L | 42.9 | Very low | 44.3 | Very low | 122 Ų | 122 | 132.1 Ų | 132.1 | 64% | 0.639 | 76% | 0.76 | S | S | * | * | | | trans | 53.3 | 99.5 | 152.2 | -78.3 | 160.2 | 0 | 0 | 0 | 120.4 | E25 | L23-E25 HydrophobicContact CD2-CB 4.22Š|
| 24 | T | 42.3 | Very low | 45 | Very low | 133 Ų | 133 | 131.2 Ų | 131.2 | 82% | 0.816 | 76% | 0.759 | S | S | * | * | | | trans | -136.1 | 63.9 | 135.5 | -51.3 | 0 | 0 | 0 | 0 | 108.9 | F26 | T24-F26 HydrophobicContact CG2-CB 4.04Å; T24-F26 PolarHBondContact O-N 3.4Å |
| 25 | E | 51.9 | Low | 45.8 | Very low | 174 Ų | 174 | 127.9 Ų | 127.9 | 81% | 0.813 | 74% | 0.742 | S | S | * | * | | | trans | -75.3 | 80.8 | 169 | -179.2 | 150.4 | 67.6 | 0 | 0 | 108.7 | L23 | L23-E25 HydrophobicContact CD2-CB 4.22Š|
| 26 | F | 55 | Low | 46.6 | Very low | 190 Ų | 190 | 128.9 Ų | 128.9 | 83% | 0.833 | 75% | 0.748 | S | S | * | * | | | trans | -115.5 | 62.4 | -176.7 | -149.1 | -85.5 | 0 | 0 | 0 | 111 | T24 | T24-F26 HydrophobicContact CG2-CB 4.04Å; T24-F26 PolarHBondContact O-N 3.4Å |
| 27 | A | 51.9 | Low | 47.3 | Very low | 79 Ų | 79 | 128 Ų | 128 | 65% | 0.653 | 75% | 0.748 | S | S | * | * | | | trans | -125.4 | 119 | 159.7 | 0 | 0 | 0 | 0 | 0 | 107.1 | | |
| 28 | P | 54.5 | Low | 48.5 | Very low | 111 Ų | 111 | 128 Ų | 128 | 72% | 0.721 | 74% | 0.738 | S | S | * | * | | | trans | -60.7 | 144.4 | 172.8 | 26.9 | -33.2 | 0 | 0 | 0 | 109 | | |
| 29 | P | 56.8 | Low | 49.2 | Very low | 109 Ų | 109 | 127.7 Ų | 127.7 | 71% | 0.708 | 74% | 0.736 | S | S | * | * | | | trans | -58.4 | 140.9 | 177.5 | 25.9 | -34.3 | 0 | 0 | 0 | 109.2 | T31 | P29-T31 PolarHBondContact O-N 3.5Š|
| 30 | P | 53.5 | Low | 49.8 | Very low | 125 Ų | 125 | 128.7 Ų | 128.7 | 81% | 0.812 | 73% | 0.732 | S | S | * | * | | | trans | -60.1 | 110.8 | 172.9 | 25.7 | -32.6 | 0 | 0 | 0 | 107.7 | P32 | P30-P32 VanDerWaalsContact O-CD 3.29Å; P30-P32 WeakPolarHBondContact O-CD 3.3Å |
| 31 | T | 48.5 | Very low | 50.7 | Low | 105 Ų | 105 | 123.7 Ų | 123.7 | 64% | 0.644 | 72% | 0.715 | S | S | * | * | | | trans | -60.9 | 121.2 | 175.7 | 44 | 0 | 0 | 0 | 0 | 108.1 | P29 M33 | P29-T31 PolarHBondContact O-N 3.5Å; T31-M33 PolarHBondContact O-N 2.98Å |
| 32 | P | 54.9 | Low | 51.9 | Low | 123 Ų | 123 | 123 Ų | 123 | 80% | 0.799 | 71% | 0.707 | S | S | * | * | | | trans | -74.7 | 67.9 | 168.1 | 33.4 | -34 | 0 | 0 | 0 | 108 | P30 V34 | P30-P32 VanDerWaalsContact O-CD 3.29Å; P30-P32 WeakPolarHBondContact O-CD 3.3Å; P32-V34 PolarHBondContact O-N 3.41Å |
| 33 | M | 44.4 | Very low | 52.4 | Low | 132 Ų | 132 | 123.4 Ų | 123.4 | 65% | 0.65 | 71% | 0.707 | S | S | * | * | | | trans | -69.2 | 92.8 | 159.3 | 56.3 | -172 | -70.1 | 0 | 0 | 106.2 | T31 D35 | T31-M33 PolarHBondContact O-N 2.98Å; M33-D35 WeakPolarHBondContact CE-OD2 3.34Å; M33-D35 PolarHBondContact O-N 3.37Å |
| 34 | V | 50.9 | Low | 52.9 | Low | 105 Ų | 105 | 124.2 Ų | 124.2 | 64% | 0.636 | 71% | 0.712 | S | S | * | * | | | trans | -61.2 | 89.2 | 154.5 | -179.2 | 0 | 0 | 0 | 0 | 104.8 | P32 H36 | P32-V34 PolarHBondContact O-N 3.41Å; V34-H36 PolarHBondContact O-N 3.14Å |
| 35 | D | 50.1 | Low | 53.7 | Low | 101 Ų | 101 | 124.2 Ų | 124.2 | 54% | 0.54 | 71% | 0.707 | S | S | . | * | | | trans | -66.8 | 95.1 | 167.6 | -140.2 | -71 | 0 | 0 | 0 | 105.4 | M33 L37 | M33-D35 WeakPolarHBondContact CE-OD2 3.34Å; M33-D35 PolarHBondContact O-N 3.37Å; D35-L37 PolarHBondContact O-N 2.85Å |
| 36 | H | 56.3 | Low | 53.8 | Low | 153 Ų | 153 | 122.9 Ų | 122.9 | 71% | 0.708 | 71% | 0.706 | S | S | * | * | | | trans | -67.9 | 76.8 | 170.1 | -82.9 | -85.8 | 0 | 0 | 0 | 107.3 | V34 V38 | V34-H36 PolarHBondContact O-N 3.14Å; H36-V38 HydrophobicContact CB-CG2 4.41Å; H36-V38 PolarHBondContact O-N 3.29Å |
| 37 | L | 54.5 | Low | 53.8 | Low | 153 Ų | 153 | 123.9 Ų | 123.9 | 80% | 0.801 | 71% | 0.71 | S | S | * | * | | | trans | -68.7 | 61.2 | 159.2 | -71.6 | 174.8 | 0 | 0 | 0 | 108.8 | D35 A39 | D35-L37 PolarHBondContact O-N 2.85Å; L37-A39 VanDerWaalsContact C-N 3.26Å; L37-A39 PolarHBondContact O-N 3.32Å |
| 38 | V | 57.2 | Low | 54 | Low | 100 Ų | 100 | 122.1 Ų | 122.1 | 61% | 0.606 | 70% | 0.699 | S | S | * | * | | | trans | -63.3 | 101.1 | 151.7 | 176.2 | 0 | 0 | 0 | 0 | 104.2 | H36 S40 | H36-V38 HydrophobicContact CB-CG2 4.41Å; H36-V38 PolarHBondContact O-N 3.29Å; V38-S40 PolarHBondContact O-N 2.69Å |
| 39 | A | 51.6 | Low | 53.7 | Low | 97 Ų | 97 | 122.1 Ų | 122.1 | 80% | 0.802 | 70% | 0.699 | S | S | * | * | | | trans | -66 | 83.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 106.7 | L37 N41 | L37-A39 VanDerWaalsContact C-N 3.26Å; L37-A39 PolarHBondContact O-N 3.32Å; A39-N41 PolarHBondContact O-N 3.33Å |
| 40 | S | 49.5 | Very low | 53.2 | Low | 91 Ų | 91 | 122.9 Ų | 122.9 | 64% | 0.636 | 71% | 0.705 | S | S | * | * | | | trans | -56.5 | 110.2 | 169.3 | -64.2 | 0 | 0 | 0 | 0 | 106.6 | V38 | V38-S40 PolarHBondContact O-N 2.69Š|
| 41 | N | 56.4 | Low | 52.9 | Low | 106 Ų | 106 | 122.7 Ų | 122.7 | 57% | 0.567 | 71% | 0.706 | S | S | * | * | | | trans | -60 | 127.7 | 178.4 | -160.5 | 12.3 | 0 | 0 | 0 | 106.5 | A39 F43 D44 | A39-N41 PolarHBondContact O-N 3.33Å; N41-F43 PolarHBondContact O-N 3.26Å; N41-D44 PolarHBondContact O-N 3.4Å |
| 42 | P | 63.3 | Low | 52.8 | Low | 107 Ų | 107 | 128.5 Ų | 128.5 | 70% | 0.695 | 72% | 0.716 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.3 | 19.9 | -170.4 | 27 | -37.1 | 0 | 0 | 0 | 115.2 | | |
| 43 | F | 53.2 | Low | 52.6 | Low | 175 Ų | 175 | 128.8 Ų | 128.8 | 77% | 0.768 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116 | -2.9 | 175.8 | -62.2 | -80 | 0 | 0 | 0 | 112.9 | N41 | N41-F43 PolarHBondContact O-N 3.26Š|
| 44 | D | 54.2 | Low | 52.4 | Low | 140 Ų | 140 | 127.8 Ų | 127.8 | 75% | 0.749 | 72% | 0.724 | S | S | * | * | | | trans | -100.3 | 1.8 | -175.5 | -145.9 | -118.4 | 0 | 0 | 0 | 113.9 | N41 D46 | N41-D44 PolarHBondContact O-N 3.4Å; D44-D46 VanDerWaalsContact C-N 3.34Å; D44-D46 PolarHBondContact O-N 2.93Å |
| 45 | D | 59.8 | Low | 51.7 | Low | 132 Ų | 132 | 126.6 Ų | 126.6 | 71% | 0.706 | 73% | 0.733 | S | S | * | * | | | trans | -69.6 | 90.7 | 168.3 | -89.7 | -73.8 | 0 | 0 | 0 | 110 | F47 | D45-F47 PolarHBondContact O-N 2.92Å; D45-F47 VanDerWaalsContact O-N 3.1Å |
| 46 | D | 54.3 | Low | 51.2 | Low | 147 Ų | 147 | 127.1 Ų | 127.1 | 79% | 0.786 | 75% | 0.751 | S | S | * | * | | | trans | -54.4 | 110.3 | 173.9 | -175.4 | -99.5 | 0 | 0 | 0 | 110.8 | D44 G48 | D44-D46 VanDerWaalsContact C-N 3.34Å; D44-D46 PolarHBondContact O-N 2.93Å; D46-G48 PolarHBondContact O-N 2.63Å; D46-G48 WeakPolarHBondContact OD1-CA 3.44Å; D46-G48 PolarHBondContact OD1-N 3.11Å; D46-G48 VanDerWaalsContact OD1-N 3.11Å |
| 47 | F | 54.7 | Low | 50.1 | Low | 210 Ų | 210 | 123.8 Ų | 123.8 | 92% | 0.921 | 76% | 0.759 | S | S | * | * | | | trans | -73.9 | 49.5 | 171.2 | -93.6 | -92.8 | 0 | 0 | 0 | 111.8 | D45 | D45-F47 PolarHBondContact O-N 2.92Å; D45-F47 VanDerWaalsContact O-N 3.1Å |
| 48 | G | 56 | Low | 49.2 | Very low | 42 Ų | 42 | 120.2 Ų | 120.2 | 43% | 0.433 | 76% | 0.759 | S | S | . | * | | | trans | -67.5 | 124.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 111 | D46 | D46-G48 PolarHBondContact O-N 2.63Å; D46-G48 WeakPolarHBondContact OD1-CA 3.44Å; D46-G48 PolarHBondContact OD1-N 3.11Å; D46-G48 VanDerWaalsContact OD1-N 3.11Å |
| 49 | P | 47.3 | Very low | 48.8 | Very low | 111 Ų | 111 | 122 Ų | 122 | 72% | 0.721 | 77% | 0.772 | S | S | * | * | | | trans | -66.2 | 144.4 | 177.8 | 27.4 | -34 | 0 | 0 | 0 | 110.9 | S51 | P49-S51 PolarHBondContact O-N 3.01Š|
| 50 | P | 46.9 | Very low | 48.5 | Very low | 126 Ų | 126 | 121.5 Ų | 121.5 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | | | trans | -67 | 109.1 | -167.2 | 25.1 | -34.6 | 0 | 0 | 0 | 112.5 | R52 | P50-R52 PolarHBondContact O-N 2.99Š|
| 51 | S | 48 | Very low | 47.9 | Very low | 121 Ų | 121 | 121 Ų | 121 | 85% | 0.846 | 79% | 0.785 | S | S | * | * | | | trans | -69.4 | 113.8 | 168.2 | -71 | 0 | 0 | 0 | 0 | 110 | P49 | P49-S51 PolarHBondContact O-N 3.01Š|
| 52 | R | 46.5 | Very low | 47.4 | Very low | 227 Ų | 227 | 120.5 Ų | 120.5 | 86% | 0.857 | 80% | 0.796 | S | S | * | * | | | trans | -66.6 | 134.4 | -178.9 | -68.3 | 175.1 | 171.7 | 169.1 | -3.7 | 111.7 | P50 | P50-R52 PolarHBondContact O-N 2.99Š|
| 53 | P | 50.3 | Low | 46.7 | Very low | 129 Ų | 129 | 120.9 Ų | 120.9 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | | | trans | -77.8 | 120.7 | 161.7 | 31.4 | -30.3 | 0 | 0 | 0 | 109.2 | | |
| 54 | S | 39.8 | Very low | 46.4 | Very low | 111 Ų | 111 | 122.7 Ų | 122.7 | 78% | 0.776 | 81% | 0.806 | S | S | * | * | | | trans | -150.9 | 90 | 174.4 | -71.4 | 0 | 0 | 0 | 0 | 112.2 | | |
| 55 | G | 36.7 | Very low | 45.8 | Very low | 79 Ų | 79 | 123.3 Ų | 123.3 | 81% | 0.814 | 81% | 0.809 | S | S | * | * | | | trans | -114.3 | 144.6 | 144.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | | |
| 56 | A | 38.1 | Very low | 44.9 | Very low | 113 Ų | 113 | 123.2 Ų | 123.2 | 93% | 0.934 | 82% | 0.815 | S | S | * | * | | | cis | -153.4 | 155.4 | 3.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 57 | G | 33.3 | Very low | 44.2 | Very low | 83 Ų | 83 | 121.5 Ų | 121.5 | 86% | 0.856 | 82% | 0.815 | S | S | * | * | | | trans | 161.9 | 108.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 58 | G | 35.8 | Very low | 43.9 | Very low | 78 Ų | 78 | 117.6 Ų | 117.6 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | | | trans | 104.1 | 131.7 | 160.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 59 | P | 49.9 | Very low | 43.1 | Very low | 138 Ų | 138 | 119.6 Ų | 119.6 | 90% | 0.896 | 83% | 0.831 | S | S | * | * | | | trans | -90.6 | 142.8 | 176 | 35.2 | -32.6 | 0 | 0 | 0 | 112.9 | | |
| 60 | G | 44 | Very low | 42.7 | Very low | 86 Ų | 86 | 119.6 Ų | 119.6 | 89% | 0.887 | 84% | 0.841 | S | S | * | * | | | trans | 106 | 125.7 | 165.5 | 0 | 0 | 0 | 0 | 0 | 115 | | |
| 61 | G | 36.7 | Very low | 42.2 | Very low | 80 Ų | 80 | 117.5 Ų | 117.5 | 83% | 0.825 | 84% | 0.842 | S | S | * | * | | | trans | 136.3 | 68.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 62 | A | 46.9 | Very low | 41.6 | Very low | 95 Ų | 95 | 115.9 Ų | 115.9 | 79% | 0.785 | 85% | 0.845 | S | S | * | * | | | trans | -72.7 | 151.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 63 | P | 48.4 | Very low | 41.1 | Very low | 115 Ų | 115 | 109.2 Ų | 109.2 | 75% | 0.747 | 85% | 0.846 | S | S | * | * | | | trans | -76.9 | 159.3 | -172 | 31.7 | -36.5 | 0 | 0 | 0 | 113.7 | L65 | P63-L65 PolarHBondContact O-N 2.97Š|
| 64 | F | 47.7 | Very low | 40.3 | Very low | 214 Ų | 214 | 107.2 Ų | 107.2 | 94% | 0.939 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -69.2 | 87.1 | -177.9 | -81.2 | -99.3 | 0 | 0 | 0 | 113.5 | | |
| 65 | L | 41.4 | Very low | 40.2 | Very low | 153 Ų | 153 | 104.7 Ų | 104.7 | 80% | 0.801 | 84% | 0.841 | S | S | * | * | | | trans | -146.2 | 112.7 | 160.3 | -79.4 | 174.2 | 0 | 0 | 0 | 109.8 | P63 | P63-L65 PolarHBondContact O-N 2.97Š|
| 66 | P | 41.1 | Very low | 40.5 | Very low | 129 Ų | 129 | 112 Ų | 112 | 84% | 0.838 | 85% | 0.845 | S | S | * | * | | | trans | -90.7 | 112 | 170.3 | 32.8 | -28.8 | 0 | 0 | 0 | 111.3 | | |
| 67 | S | 39.7 | Very low | 40.6 | Very low | 111 Ų | 111 | 110.8 Ų | 110.8 | 78% | 0.776 | 84% | 0.844 | S | S | * | * | | | trans | -141.8 | 168.2 | 165.9 | -67.4 | 0 | 0 | 0 | 0 | 108.1 | | |
| 68 | P | 46.5 | Very low | 40.7 | Very low | 129 Ų | 129 | 110.7 Ų | 110.7 | 84% | 0.838 | 84% | 0.843 | S | S | * | * | | | | -118.5 | 151.2 | -85.4 | 26.3 | -7.8 | 0 | 0 | 0 | 113.6 | | |
| 69 | G | 40.4 | Very low | 40.9 | Very low | 84 Ų | 84 | 111.1 Ų | 111.1 | 87% | 0.866 | 85% | 0.847 | S | S | * | * | | | trans | 82.4 | 78.7 | 148.9 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 70 | A | 39.3 | Very low | 40.4 | Very low | 111 Ų | 111 | 107.8 Ų | 107.8 | 92% | 0.917 | 84% | 0.838 | S | S | * | * | | | trans | -163 | 139.3 | 146 | 0 | 0 | 0 | 0 | 0 | 108 | | |
| 71 | G | 36 | Very low | 40.4 | Very low | 82 Ų | 82 | 114.3 Ų | 114.3 | 85% | 0.845 | 84% | 0.836 | S | S | * | * | | | cis | 160.3 | 113.5 | -3.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 72 | G | 35.2 | Very low | 40.8 | Very low | 87 Ų | 87 | 119.1 Ų | 119.1 | 90% | 0.897 | 84% | 0.839 | S | S | * | * | | | trans | 102.1 | 142.2 | 168.2 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 73 | G | 35.1 | Very low | 40.4 | Very low | 87 Ų | 87 | 117.9 Ų | 117.9 | 90% | 0.897 | 84% | 0.836 | S | S | * | * | | | trans | 112.6 | 95.7 | 170.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 74 | G | 35.2 | Very low | 40.5 | Very low | 86 Ų | 86 | 119.2 Ų | 119.2 | 89% | 0.887 | 84% | 0.844 | S | S | * | * | | | trans | -103.3 | 167.8 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.3 | | |
| 75 | G | 36.5 | Very low | 40.1 | Very low | 59 Ų | 59 | 112.5 Ų | 112.5 | 61% | 0.608 | 84% | 0.836 | S | S | * | * | | | trans | 178.4 | 83.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 76 | Y | 43.2 | Very low | 40.6 | Very low | 232 Ų | 232 | 112.9 Ų | 112.9 | 91% | 0.91 | 84% | 0.837 | S | S | * | * | | | trans | 37.9 | 129.3 | 150.7 | 63.2 | -90.7 | 0 | 0 | 0 | 124.4 | | |
| 77 | G | 39.7 | Very low | 40.6 | Very low | 87 Ų | 87 | 113.9 Ų | 113.9 | 90% | 0.897 | 84% | 0.835 | S | S | * | * | | | trans | 90.4 | 136.8 | 150 | 0 | 0 | 0 | 0 | 0 | 117.8 | | |
| 78 | G | 36 | Very low | 40.3 | Very low | 81 Ų | 81 | 117.2 Ų | 117.2 | 84% | 0.835 | 84% | 0.836 | S | S | * | * | | | cis | 174.1 | 138.7 | -8.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | | |
| 79 | G | 40 | Very low | 40.1 | Very low | 88 Ų | 88 | 119.7 Ų | 119.7 | 91% | 0.907 | 84% | 0.839 | S | S | * | * | | | trans | 84.6 | 149.3 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 80 | G | 39.2 | Very low | 39.8 | Very low | 68 Ų | 68 | 119.7 Ų | 119.7 | 70% | 0.701 | 84% | 0.839 | S | S | * | * | | | cis | 172.6 | 60 | 1.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 81 | R | 44.9 | Very low | 39.6 | Very low | 222 Ų | 222 | 118 Ų | 118 | 84% | 0.838 | 83% | 0.832 | S | S | * | * | | | trans | 11.4 | 151.9 | 151.2 | 52.1 | -176.9 | 158.8 | -101.2 | -2.5 | 123 | | |
| 82 | M | 45.3 | Very low | 40.4 | Very low | 181 Ų | 181 | 120 Ų | 120 | 89% | 0.892 | 83% | 0.83 | S | S | * | * | | | trans | 89.8 | 144.8 | 167.9 | -49.1 | 174.3 | -156.5 | 0 | 0 | 115.6 | | |
| 83 | G | 38.6 | Very low | 40.6 | Very low | 70 Ų | 70 | 121.7 Ų | 121.7 | 72% | 0.722 | 83% | 0.828 | S | S | * | * | | | cis | 174.9 | 159.5 | -4.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | | |
| 84 | P | 49.9 | Very low | 40.6 | Very low | 142 Ų | 142 | 121.1 Ų | 121.1 | 92% | 0.922 | 82% | 0.822 | S | S | * | * | | | trans | -87.4 | 155.1 | -174 | 35 | -35.5 | 0 | 0 | 0 | 114.2 | | |
| 85 | G | 39.4 | Very low | 41 | Very low | 73 Ų | 73 | 123.3 Ų | 123.3 | 75% | 0.753 | 82% | 0.821 | S | S | * | * | | | trans | -144.2 | 145.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | | |
| 86 | I | 50.8 | Low | 41 | Very low | 161 Ų | 161 | 124.1 Ų | 124.1 | 83% | 0.826 | 83% | 0.829 | S | S | * | * | | | trans | -139.4 | 114.9 | -173.9 | 24.3 | 166.6 | 0 | 0 | 0 | 110.7 | | |
| 87 | N | 41.4 | Very low | 40.7 | Very low | 151 Ų | 151 | 119.1 Ų | 119.1 | 81% | 0.807 | 83% | 0.828 | S | S | * | * | | | trans | -146.2 | 111.2 | 171.2 | -70.9 | 95.3 | 0 | 0 | 0 | 109 | | |
| 88 | F | 34.6 | Very low | 40.7 | Very low | 180 Ų | 180 | 118.3 Ų | 118.3 | 79% | 0.789 | 82% | 0.819 | S | S | * | * | | | | 92.2 | 100 | 81.8 | -100.4 | -84.2 | 0 | 0 | 0 | 114.6 | | |
| 89 | M | 41.5 | Very low | 40.9 | Very low | 182 Ų | 182 | 123.3 Ų | 123.3 | 90% | 0.897 | 82% | 0.821 | S | S | * | * | | | trans | 65.7 | 115.1 | 132 | -148.9 | 164.2 | -161.4 | 0 | 0 | 121.4 | | |
| 90 | G | 34.3 | Very low | 41.2 | Very low | 84 Ų | 84 | 124.5 Ų | 124.5 | 87% | 0.866 | 81% | 0.813 | S | S | * | * | | | trans | 158.5 | 122.2 | 160.9 | 0 | 0 | 0 | 0 | 0 | 115.5 | | |
| 91 | G | 35.4 | Very low | 41.2 | Very low | 75 Ų | 75 | 124.8 Ų | 124.8 | 77% | 0.773 | 82% | 0.816 | S | S | * | * | | | trans | -123.6 | -163.2 | 160.6 | 0 | 0 | 0 | 0 | 0 | 109.5 | | |
| 92 | P | 53.1 | Low | 40.9 | Very low | 123 Ų | 123 | 126.4 Ų | 126.4 | 80% | 0.799 | 82% | 0.822 | S | S | * | * | | | cis | -126 | -171.5 | -9.6 | 41.4 | -26.5 | 0 | 0 | 0 | 113.1 | | |
| 93 | S | 38.3 | Very low | 40.9 | Very low | 123 Ų | 123 | 129.1 Ų | 129.1 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | | | trans | 114.3 | 136.8 | 157.8 | -49 | 0 | 0 | 0 | 0 | 117.6 | | |
| 94 | G | 34.7 | Very low | 41.8 | Very low | 75 Ų | 75 | 130.9 Ų | 130.9 | 77% | 0.773 | 82% | 0.821 | S | S | * | * | | | trans | 128.4 | 129.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 116.1 | | |
| 95 | P | 45 | Very low | 42 | Very low | 132 Ų | 132 | 128.7 Ų | 128.7 | 86% | 0.857 | 81% | 0.807 | S | S | * | * | | | trans | -112.4 | 159.4 | -167.4 | 40.4 | -33.1 | 0 | 0 | 0 | 116.2 | | |
| 96 | G | 35.8 | Very low | 41.9 | Very low | 76 Ų | 76 | 135.3 Ų | 135.3 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | | | trans | 100.6 | 109.9 | 145.2 | 0 | 0 | 0 | 0 | 0 | 118 | | |
| 97 | S | 37.8 | Very low | 41.5 | Very low | 128 Ų | 128 | 130.7 Ų | 130.7 | 90% | 0.895 | 81% | 0.807 | S | S | * | * | | | trans | -169.7 | 127 | 139.3 | 36.1 | 0 | 0 | 0 | 0 | 109.9 | | |
| 98 | G | 38.5 | Very low | 41.8 | Very low | 69 Ų | 69 | 129.4 Ų | 129.4 | 71% | 0.711 | 81% | 0.808 | S | S | * | * | | | trans | -96.8 | 141.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | | |
| 99 | Q | 39.6 | Very low | 42.5 | Very low | 186 Ų | 186 | 126.9 Ų | 126.9 | 87% | 0.869 | 81% | 0.809 | S | S | * | * | | | trans | -136.7 | 139.9 | 162.3 | -84.7 | -63.4 | -72.4 | 0 | 0 | 110.2 | | |
| 100 | P | 46.6 | Very low | 42.6 | Very low | 113 Ų | 113 | 123.8 Ų | 123.8 | 73% | 0.734 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -86.6 | 131.7 | -169.3 | 33.1 | -34.2 | 0 | 0 | 0 | 113.4 | | |
| 101 | G | 39.3 | Very low | 43.1 | Very low | 75 Ų | 75 | 127.4 Ų | 127.4 | 77% | 0.773 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 150 | 173.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 102 | R | 39.9 | Very low | 43.1 | Very low | 256 Ų | 256 | 128.5 Ų | 128.5 | 97% | 0.966 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 159 | 174 | -66.1 | -171.8 | -178.4 | -99.2 | 5.1 | 112 | | |
| 103 | R | 44.9 | Very low | 42.3 | Very low | 237 Ų | 237 | 125.7 Ų | 125.7 | 89% | 0.894 | 80% | 0.8 | S | S | * | * | | | trans | -111.4 | 176.3 | -179.7 | -93.8 | 179.5 | 162.2 | -115.4 | -1 | 110.6 | | |
| 104 | P | 57.4 | Low | 42.9 | Very low | 107 Ų | 107 | 125.2 Ų | 125.2 | 70% | 0.695 | 79% | 0.794 | S | S | * | * | | | cis | -125.5 | -135.3 | -32.8 | 40.5 | -21.7 | 0 | 0 | 0 | 107.8 | | |
| 105 | P | 54.3 | Low | 43.2 | Very low | 96 Ų | 96 | 130 Ų | 130 | 62% | 0.623 | 80% | 0.796 | S | S | * | * | | | cis | -124.2 | 166.3 | -36.9 | 38.9 | -24.9 | 0 | 0 | 0 | 114.4 | | |
| 106 | F | 37.6 | Very low | 42.8 | Very low | 212 Ų | 212 | 131.9 Ų | 131.9 | 93% | 0.93 | 79% | 0.793 | S | S | * | * | | | trans | 160.1 | 114.8 | 133.7 | -92.6 | -65 | 0 | 0 | 0 | 109.7 | | |
| 107 | G | 41.2 | Very low | 42.9 | Very low | 64 Ų | 64 | 136.2 Ų | 136.2 | 66% | 0.66 | 79% | 0.793 | S | S | * | * | | | trans | 167 | 133 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 108 | P | 48.1 | Very low | 43 | Very low | 125 Ų | 125 | 137.9 Ų | 137.9 | 81% | 0.812 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -75.8 | 141.7 | -175.4 | 30.9 | -34.4 | 0 | 0 | 0 | 111.4 | | |
| 109 | P | 49.2 | Very low | 42.7 | Very low | 126 Ų | 126 | 138.3 Ų | 138.3 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -80.6 | 123.1 | 176.3 | 31.2 | -32.1 | 0 | 0 | 0 | 111.3 | | |
| 110 | S | 44.3 | Very low | 42.6 | Very low | 118 Ų | 118 | 140.2 Ų | 140.2 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -71.4 | 126.8 | 167 | -64.9 | 0 | 0 | 0 | 0 | 111.3 | | |
| 111 | N | 44.8 | Very low | 42.1 | Very low | 160 Ų | 160 | 138.5 Ų | 138.5 | 86% | 0.856 | 80% | 0.804 | S | S | * | * | | | trans | 28.3 | 105 | 146.4 | -168.4 | 23.8 | 0 | 0 | 0 | 119 | | |
| 112 | A | 35.3 | Very low | 41.8 | Very low | 97 Ų | 97 | 138.3 Ų | 138.3 | 80% | 0.802 | 80% | 0.802 | S | S | * | * | | | trans | -149.1 | 115.1 | 151.2 | 0 | 0 | 0 | 0 | 0 | 110.3 | | |
| 113 | G | 34.8 | Very low | 41.8 | Very low | 65 Ų | 65 | 135 Ų | 135 | 67% | 0.67 | 80% | 0.8 | S | S | * | * | | | trans | -73.7 | -176.2 | 155.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 114 | P | 52.8 | Low | 41.8 | Very low | 112 Ų | 112 | 129.3 Ų | 129.3 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | | | cis | -148.8 | 173.5 | 37.8 | 43 | -24.1 | 0 | 0 | 0 | 117.7 | | |
| 115 | H | 39 | Very low | 40.7 | Very low | 177 Ų | 177 | 127.1 Ų | 127.1 | 82% | 0.819 | 79% | 0.791 | S | S | * | * | | | trans | 62 | 150.7 | 168.3 | -62.5 | -75.5 | 0 | 0 | 0 | 116.1 | | |
| 116 | H | 38.4 | Very low | 40 | Very low | 170 Ų | 170 | 132.5 Ų | 132.5 | 79% | 0.787 | 81% | 0.805 | S | S | * | * | | | cis | -151.6 | 155 | 19.7 | 39.7 | 72.7 | 0 | 0 | 0 | 113.6 | | |
| 117 | Q | 36.5 | Very low | 40.9 | Very low | 167 Ų | 167 | 127.7 Ų | 127.7 | 78% | 0.78 | 80% | 0.795 | S | S | * | * | | | trans | -28.4 | 142.8 | 167.2 | -154.7 | -171.7 | 89.5 | 0 | 0 | 118.3 | | |
| 118 | L | 40.2 | Very low | 41.4 | Very low | 163 Ų | 163 | 130.6 Ų | 130.6 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | | | | 163.5 | 140.3 | 125.4 | -86.5 | 167 | 0 | 0 | 0 | 112.6 | | |
| 119 | G | 31.7 | Very low | 40.7 | Very low | 79 Ų | 79 | 128.5 Ų | 128.5 | 81% | 0.814 | 80% | 0.803 | S | S | * | * | | | trans | 109.9 | 77.2 | 159.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | | |
| 120 | F | 38.7 | Very low | 40 | Very low | 226 Ų | 226 | 126.1 Ų | 126.1 | 99% | 0.991 | 80% | 0.802 | S | S | * | * | | | trans | -110.4 | 132.9 | 164.3 | -136.4 | -86.7 | 0 | 0 | 0 | 109.7 | | |
| 121 | G | 35 | Very low | 40.6 | Very low | 76 Ų | 76 | 126.3 Ų | 126.3 | 78% | 0.784 | 80% | 0.8 | S | S | * | * | | | trans | 155.6 | 141.6 | 176 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 122 | G | 33.7 | Very low | 40.3 | Very low | 72 Ų | 72 | 123.3 Ų | 123.3 | 74% | 0.742 | 79% | 0.792 | S | S | * | * | | | cis | 146.8 | 105.3 | 1.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | | |
| 123 | M | 39.7 | Very low | 40.2 | Very low | 187 Ų | 187 | 126 Ų | 126 | 92% | 0.921 | 79% | 0.787 | S | S | * | * | | | trans | -143.7 | 128.9 | 176.4 | -91.4 | -69.2 | 144.7 | 0 | 0 | 110.5 | | |
| 124 | P | 45.4 | Very low | 40.3 | Very low | 116 Ų | 116 | 132.4 Ų | 132.4 | 75% | 0.753 | 80% | 0.797 | S | S | * | * | | | trans | -120.9 | 148.9 | -168.8 | 40.3 | -30.1 | 0 | 0 | 0 | 117.1 | | |
| 125 | G | 34.9 | Very low | 39.6 | Very low | 62 Ų | 62 | 133.2 Ų | 133.2 | 64% | 0.639 | 80% | 0.796 | S | S | * | * | | | trans | 69.7 | 160.1 | 153.4 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 126 | F | 38.6 | Very low | 39.6 | Very low | 209 Ų | 209 | 132.2 Ų | 132.2 | 92% | 0.917 | 79% | 0.793 | S | S | * | * | | | cis | -163.5 | -179.6 | -9.6 | -98.7 | -57.7 | 0 | 0 | 0 | 108.2 | | |
| 127 | P | 56.1 | Low | 39.8 | Very low | 111 Ų | 111 | 132.7 Ų | 132.7 | 72% | 0.721 | 80% | 0.796 | S | S | * | * | | | trans | -120 | -134.6 | -150.6 | 44.8 | -27.6 | 0 | 0 | 0 | 112.5 | | |
| 128 | P | 53.2 | Low | 40.5 | Very low | 124 Ų | 124 | 130.1 Ų | 130.1 | 81% | 0.805 | 79% | 0.794 | S | S | * | * | | | cis | -127.1 | 175 | -42.3 | 37.9 | -22.7 | 0 | 0 | 0 | 114.2 | | |
| 129 | G | 32.7 | Very low | 40.3 | Very low | 81 Ų | 81 | 129.7 Ų | 129.7 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | | | trans | 161.1 | 129.6 | 159.5 | 0 | 0 | 0 | 0 | 0 | 117.7 | | |
| 130 | G | 33.6 | Very low | 40.5 | Very low | 77 Ų | 77 | 134.7 Ų | 134.7 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | | | trans | -104.9 | -145.1 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | | |
| 131 | P | 57.2 | Low | 40.4 | Very low | 121 Ų | 121 | 129.3 Ų | 129.3 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | | | cis | -133.6 | -174.2 | -13.4 | 41.9 | -25.5 | 0 | 0 | 0 | 113.5 | | |
| 132 | S | 38.2 | Very low | 41.6 | Very low | 98 Ų | 98 | 131.5 Ų | 131.5 | 69% | 0.685 | 78% | 0.783 | S | S | * | * | | | trans | 146.4 | 128 | 133.6 | -70 | 0 | 0 | 0 | 0 | 116.6 | | |
| 133 | Q | 34.1 | Very low | 42.4 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 71% | 0.71 | 79% | 0.787 | S | S | * | * | | | trans | 45.8 | 136.4 | 142 | -41.3 | -58.3 | -4.4 | 0 | 0 | 119.4 | | |
| 134 | F | 37.6 | Very low | 42.7 | Very low | 200 Ų | 200 | 133.8 Ų | 133.8 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | | | | -151.9 | 168.7 | 53.4 | -85.7 | -86.2 | 0 | 0 | 0 | 115 | | |
| 135 | N | 37.3 | Very low | 43 | Very low | 130 Ų | 130 | 136.7 Ų | 136.7 | 70% | 0.695 | 79% | 0.788 | S | S | * | * | | | trans | -92.2 | 179.5 | -178.2 | 179.1 | 21.8 | 0 | 0 | 0 | 112 | | |
| 136 | M | 39.7 | Very low | 43.4 | Very low | 156 Ų | 156 | 139.6 Ų | 139.6 | 77% | 0.768 | 80% | 0.796 | S | S | * | * | | | trans | 103.5 | 141.1 | 164.5 | -65.5 | 86.8 | -178 | 0 | 0 | 120.1 | | |
| 137 | Q | 41.3 | Very low | 43.6 | Very low | 180 Ų | 180 | 132.6 Ų | 132.6 | 84% | 0.841 | 78% | 0.783 | S | S | * | * | | | trans | -79.4 | 161.9 | -158.7 | -55.3 | 165.1 | -27 | 0 | 0 | 116.1 | | |
| 138 | P | 52.2 | Low | 43.2 | Very low | 113 Ų | 113 | 133.8 Ų | 133.8 | 73% | 0.734 | 79% | 0.791 | S | S | * | * | | | trans | -97.8 | 118.6 | 155.7 | 34.5 | -25.1 | 0 | 0 | 0 | 111.5 | F140 | P138-F140 HydrophobicContact CB-CD2 4.47Å; P138-F140 HydrophobicContact CB-CE2 4.48Å |
| 139 | N | 35.2 | Very low | 42.2 | Very low | 154 Ų | 154 | 131.2 Ų | 131.2 | 82% | 0.824 | 79% | 0.787 | S | S | * | * | | | trans | -107.7 | 113.7 | 165.4 | -174.4 | 22.4 | 0 | 0 | 0 | 109.5 | | |
| 140 | F | 36.4 | Very low | 42.4 | Very low | 184 Ų | 184 | 136.7 Ų | 136.7 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | | | trans | -102.2 | 116.6 | 177.1 | -90.2 | -93.4 | 0 | 0 | 0 | 110.6 | P138 | P138-F140 HydrophobicContact CB-CD2 4.47Å; P138-F140 HydrophobicContact CB-CE2 4.48Å |
| 141 | S | 37.2 | Very low | 42.7 | Very low | 112 Ų | 112 | 140.1 Ų | 140.1 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | | | trans | -168.9 | 139 | 144.7 | -83.3 | 0 | 0 | 0 | 0 | 111.2 | | |
| 142 | P | 59.3 | Low | 41.9 | Very low | 123 Ų | 123 | 140.1 Ų | 140.1 | 80% | 0.799 | 79% | 0.79 | S | S | * | * | | | trans | -96 | 165.1 | -177.1 | 38.2 | -35.8 | 0 | 0 | 0 | 113.2 | | |
| 143 | P | 51.7 | Low | 42.1 | Very low | 129 Ų | 129 | 143.4 Ų | 143.4 | 84% | 0.838 | 80% | 0.797 | S | S | * | * | | | trans | -140.7 | 162.6 | 142.2 | 34.3 | -17.9 | 0 | 0 | 0 | 116.4 | | |
| 144 | M | 44.4 | Very low | 42.4 | Very low | 178 Ų | 178 | 144.3 Ų | 144.3 | 88% | 0.877 | 81% | 0.806 | S | S | * | * | | | trans | -60.2 | 153.5 | -175.4 | -56.1 | -72.8 | 179.9 | 0 | 0 | 117.2 | | |
| 145 | H | 51.2 | Low | 42.5 | Very low | 177 Ų | 177 | 140.1 Ų | 140.1 | 82% | 0.819 | 80% | 0.802 | S | S | * | * | | | trans | 6.6 | 148.1 | 148.5 | -94 | -61.5 | 0 | 0 | 0 | 121.8 | | |
| 146 | P | 45.2 | Very low | 43.1 | Very low | 122 Ų | 122 | 140 Ų | 140 | 79% | 0.792 | 81% | 0.808 | S | S | * | * | | | | -147.2 | 174.5 | 68.1 | 37.9 | -17.8 | 0 | 0 | 0 | 117.6 | | |
| 147 | G | 41 | Very low | 42.9 | Very low | 63 Ų | 63 | 136.7 Ų | 136.7 | 65% | 0.649 | 81% | 0.813 | S | S | * | * | | | trans | -83.4 | -163.5 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 148 | P | 48.3 | Very low | 42.6 | Very low | 136 Ų | 136 | 131.4 Ų | 131.4 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | | | cis | -141.5 | -175.9 | 16.7 | 43.6 | -24.8 | 0 | 0 | 0 | 117 | | |
| 149 | G | 33.2 | Very low | 42.2 | Very low | 70 Ų | 70 | 135.6 Ų | 135.6 | 72% | 0.722 | 82% | 0.82 | S | S | * | * | | | trans | 91.8 | 146.2 | 170.2 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 150 | F | 35.5 | Very low | 42.2 | Very low | 196 Ų | 196 | 132.3 Ų | 132.3 | 86% | 0.86 | 82% | 0.822 | S | S | * | * | | | cis | -151.4 | 158.8 | 17.9 | 43.8 | -90.7 | 0 | 0 | 0 | 110.8 | | |
| 151 | N | 40.8 | Very low | 42.2 | Very low | 149 Ų | 149 | 127.3 Ų | 127.3 | 80% | 0.797 | 82% | 0.822 | S | S | * | * | | | trans | -82 | 149 | -180 | -69.3 | -76.1 | 0 | 0 | 0 | 112.8 | | |
| 152 | S | 39.2 | Very low | 42.8 | Very low | 120 Ų | 120 | 128.4 Ų | 128.4 | 84% | 0.839 | 83% | 0.826 | S | S | * | * | | | trans | -155.9 | 112.3 | 145.9 | -80 | 0 | 0 | 0 | 0 | 111 | | |
| 153 | M | 44.1 | Very low | 41.7 | Very low | 168 Ų | 168 | 126.5 Ų | 126.5 | 83% | 0.828 | 83% | 0.829 | S | S | * | * | | | trans | -71.2 | 155.5 | 159 | -49.5 | 173.2 | -162.9 | 0 | 0 | 108.4 | | |
| 154 | L | 40.2 | Very low | 41.2 | Very low | 170 Ų | 170 | 124.1 Ų | 124.1 | 89% | 0.89 | 83% | 0.828 | S | S | * | * | | | trans | 165 | 116.7 | 137.5 | -107.5 | 77.2 | 0 | 0 | 0 | 110.3 | | |
| 155 | S | 39.3 | Very low | 40.8 | Very low | 113 Ų | 113 | 119.7 Ų | 119.7 | 79% | 0.79 | 83% | 0.828 | S | S | * | * | | | trans | -96.3 | 168.7 | 138.1 | -67.9 | 0 | 0 | 0 | 0 | 106.9 | | |
| 156 | P | 50.6 | Low | 40.3 | Very low | 128 Ų | 128 | 114.6 Ų | 114.6 | 83% | 0.831 | 82% | 0.823 | S | S | * | * | | | cis | -141 | 174.4 | 12.9 | 41.8 | -23.7 | 0 | 0 | 0 | 117 | | |
| 157 | G | 34.8 | Very low | 40.5 | Very low | 85 Ų | 85 | 114.5 Ų | 114.5 | 88% | 0.876 | 82% | 0.823 | S | S | * | * | | | trans | 104.7 | 136.7 | 139.3 | 0 | 0 | 0 | 0 | 0 | 119.3 | | |
| 158 | G | 34.9 | Very low | 41.3 | Very low | 69 Ų | 69 | 117.5 Ų | 117.5 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | | | trans | 143.7 | 105.3 | 159.5 | 0 | 0 | 0 | 0 | 0 | 116.3 | | |
| 159 | M | 42.8 | Very low | 41.7 | Very low | 202 Ų | 202 | 119.4 Ų | 119.4 | 100% | 0.995 | 83% | 0.828 | S | S | * | * | | | trans | 57.4 | 132 | 149.7 | -56.1 | 156.5 | 84.4 | 0 | 0 | 117.4 | | |
| 160 | G | 36.4 | Very low | 42.6 | Very low | 85 Ų | 85 | 122.3 Ų | 122.3 | 88% | 0.876 | 83% | 0.834 | S | S | * | * | | | cis | 129.2 | 102.4 | 18.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | | |
| 161 | G | 36.1 | Very low | 43.1 | Very low | 78 Ų | 78 | 124.4 Ų | 124.4 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | | | trans | 166.5 | 149.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 162 | P | 49 | Very low | 43.1 | Very low | 135 Ų | 135 | 127.4 Ų | 127.4 | 88% | 0.877 | 84% | 0.842 | S | S | * | * | | | trans | -110.6 | 158 | -162 | 40.1 | -33.2 | 0 | 0 | 0 | 116.4 | | |
| 163 | G | 38 | Very low | 42.8 | Very low | 83 Ų | 83 | 125.3 Ų | 125.3 | 86% | 0.856 | 84% | 0.84 | S | S | * | * | | | trans | 88.5 | 144.5 | 173 | 0 | 0 | 0 | 0 | 0 | 113.6 | | |
| 164 | G | 39.5 | Very low | 43.2 | Very low | 80 Ų | 80 | 125.8 Ų | 125.8 | 83% | 0.825 | 84% | 0.842 | S | S | * | * | | | cis | 172 | 145.6 | -5.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | | |
| 165 | G | 37.8 | Very low | 43.9 | Very low | 85 Ų | 85 | 123.1 Ų | 123.1 | 88% | 0.876 | 84% | 0.835 | S | S | * | * | | | trans | 89.2 | 88.3 | 173.7 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 166 | G | 38.8 | Very low | 44.7 | Very low | 69 Ų | 69 | 123.9 Ų | 123.9 | 71% | 0.711 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 146 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 167 | P | 51 | Low | 44.3 | Very low | 121 Ų | 121 | 126.3 Ų | 126.3 | 79% | 0.786 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 145.8 | 178.2 | -16 | 30.8 | 0 | 0 | 0 | 112.6 | | |
| 168 | P | 57 | Low | 44.6 | Very low | 125 Ų | 125 | 131.2 Ų | 131.2 | 81% | 0.812 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 143.3 | -176.7 | 33 | -34.5 | 0 | 0 | 0 | 113.7 | | |
| 169 | H | 56.9 | Low | 44.7 | Very low | 177 Ų | 177 | 135.8 Ų | 135.8 | 82% | 0.819 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 149.9 | 170.6 | -65.7 | -98 | 0 | 0 | 0 | 111.9 | R171 | H169-R171 PolarHBondContact O-N 3.15Š|
| 170 | P | 51.2 | Low | 44.5 | Very low | 131 Ų | 131 | 135.5 Ų | 135.5 | 85% | 0.851 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 119.5 | 179.7 | 29.8 | -33.5 | 0 | 0 | 0 | 111.8 | | |
| 171 | R | 46.7 | Very low | 44.3 | Very low | 239 Ų | 239 | 134.9 Ų | 134.9 | 90% | 0.902 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -98.6 | 118.9 | 172.7 | -173.8 | 126.6 | 84 | 117.4 | -3.3 | 110.4 | H169 G173 | H169-R171 PolarHBondContact O-N 3.15Å; R171-G173 PolarHBondContact O-N 3.15Å |
| 172 | F | 40.3 | Very low | 44.2 | Very low | 212 Ų | 212 | 140.8 Ų | 140.8 | 93% | 0.93 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -56 | 134.6 | 168.8 | -107 | -103.1 | 0 | 0 | 0 | 110.7 | | |
| 173 | G | 34.6 | Very low | 43.4 | Very low | 76 Ų | 76 | 138.4 Ų | 138.4 | 78% | 0.784 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -90.8 | 136.3 | -174.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | R171 | R171-G173 PolarHBondContact O-N 3.15Š|
| 174 | M | 52.3 | Low | 43.3 | Very low | 179 Ų | 179 | 138 Ų | 138 | 88% | 0.882 | 83% | 0.832 | S | S | * | * | | | trans | -121.2 | 134.9 | 169.6 | -167.5 | 74 | 141.8 | 0 | 0 | 107.3 | | |
| 175 | P | 55.2 | Low | 43.7 | Very low | 113 Ų | 113 | 142.8 Ų | 142.8 | 73% | 0.734 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 150.2 | -175 | 29.3 | -34.5 | 0 | 0 | 0 | 112.7 | | |
| 176 | P | 54.4 | Low | 44.5 | Very low | 129 Ų | 129 | 143.6 Ų | 143.6 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 151.2 | -174.2 | 32.9 | -35.6 | 0 | 0 | 0 | 114.1 | | |
| 177 | Q | 42.8 | Very low | 44.7 | Very low | 179 Ų | 179 | 149.5 Ų | 149.5 | 84% | 0.836 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 136.4 | -179.5 | -173.6 | -179.4 | 36.6 | 0 | 0 | 112.2 | | |
| 178 | Q | 41.2 | Very low | 44 | Very low | 189 Ų | 189 | 151.3 Ų | 151.3 | 88% | 0.883 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -99.1 | 134.1 | 158.6 | -78.7 | -172.5 | 2.2 | 0 | 0 | 110 | | |
| 179 | Q | 37.9 | Very low | 43.6 | Very low | 164 Ų | 164 | 149.7 Ų | 149.7 | 77% | 0.766 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -86 | 146.3 | -179.1 | -57.3 | 172 | -8.7 | 0 | 0 | 110.7 | | |
| 180 | H | 36.7 | Very low | 43.3 | Very low | 197 Ų | 197 | 146.8 Ų | 146.8 | 91% | 0.912 | 82% | 0.821 | S | S | * | * | | | trans | -163.3 | 118.8 | 142 | -85 | 112.1 | 0 | 0 | 0 | 111.3 | | |
| 181 | G | 34 | Very low | 43.2 | Very low | 71 Ų | 71 | 146.3 Ų | 146.3 | 73% | 0.732 | 82% | 0.818 | S | S | * | * | | | trans | 81 | 108.9 | 137.7 | 0 | 0 | 0 | 0 | 0 | 122.2 | | |
| 182 | Q | 32.9 | Very low | 43.5 | Very low | 202 Ų | 202 | 143.1 Ų | 143.1 | 94% | 0.944 | 82% | 0.818 | S | S | * | * | | | trans | 75.7 | 104.9 | 136 | -52.5 | -172.8 | 48.9 | 0 | 0 | 121.4 | | |
| 183 | G | 33.2 | Very low | 43.7 | Very low | 85 Ų | 85 | 139 Ų | 139 | 88% | 0.876 | 81% | 0.812 | S | S | * | * | | | | 79.9 | 122 | 114.6 | 0 | 0 | 0 | 0 | 0 | 121 | | |
| 184 | G | 35.7 | Very low | 43.8 | Very low | 76 Ų | 76 | 139.1 Ų | 139.1 | 78% | 0.784 | 81% | 0.813 | S | S | * | * | | | trans | 117 | 135.3 | 154.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | | |
| 185 | H | 48.3 | Very low | 43 | Very low | 180 Ų | 180 | 134.8 Ų | 134.8 | 83% | 0.833 | 81% | 0.814 | S | S | * | * | | | trans | -135.4 | 177.4 | 179.7 | 32 | -116.9 | 0 | 0 | 0 | 108.2 | | |
| 186 | P | 54.4 | Low | 42 | Very low | 102 Ų | 102 | 133.4 Ų | 133.4 | 66% | 0.662 | 82% | 0.82 | S | S | * | * | | | cis | -128.3 | -166.4 | -48.2 | 38.6 | -22.8 | 0 | 0 | 0 | 110.8 | | |
| 187 | F | 41.8 | Very low | 41.1 | Very low | 193 Ų | 193 | 130.8 Ų | 130.8 | 85% | 0.846 | 82% | 0.817 | S | S | * | * | | | trans | 57.4 | 120.7 | 164.9 | -87 | -95.5 | 0 | 0 | 0 | 118.8 | | |
| 188 | N | 37.1 | Very low | 41.8 | Very low | 159 Ų | 159 | 128.2 Ų | 128.2 | 85% | 0.85 | 82% | 0.816 | S | S | * | * | | | trans | -142.8 | 104 | 159.6 | -158.9 | -28.4 | 0 | 0 | 0 | 110.9 | | |
| 189 | S | 47.2 | Very low | 41.8 | Very low | 90 Ų | 90 | 131.5 Ų | 131.5 | 63% | 0.629 | 82% | 0.82 | S | S | * | * | | | trans | -104.9 | 133.8 | 172 | -55.5 | 0 | 0 | 0 | 0 | 108.9 | | |
| 190 | P | 52.3 | Low | 41.7 | Very low | 117 Ų | 117 | 127.1 Ų | 127.1 | 76% | 0.76 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -74.1 | 154.9 | 173.3 | 29 | -31.3 | 0 | 0 | 0 | 111.9 | | |
| 191 | P | 49.4 | Very low | 43 | Very low | 121 Ų | 121 | 123.9 Ų | 123.9 | 79% | 0.786 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -89.7 | 154.7 | -160.6 | 34.8 | -37.2 | 0 | 0 | 0 | 115.2 | | |
| 192 | L | 51.8 | Low | 43.5 | Very low | 172 Ų | 172 | 128.5 Ų | 128.5 | 90% | 0.901 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -80.9 | 142.9 | 164.6 | -69.7 | 91.5 | 0 | 0 | 0 | 111.8 | | |
| 193 | P | 45.2 | Very low | 44.6 | Very low | 126 Ų | 126 | 124.3 Ų | 124.3 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | | | trans | -112.5 | 143.6 | 136 | 33.7 | -24.2 | 0 | 0 | 0 | 109.4 | | |
| 194 | G | 35.2 | Very low | 45.7 | Very low | 78 Ų | 78 | 126.2 Ų | 126.2 | 80% | 0.804 | 81% | 0.81 | S | S | * | * | | | cis | 146.9 | 79.9 | 8 | 0 | 0 | 0 | 0 | 0 | 110.7 | | |
| 195 | G | 37.3 | Very low | 46.1 | Very low | 87 Ų | 87 | 131.9 Ų | 131.9 | 90% | 0.897 | 82% | 0.818 | S | S | * | * | | | trans | 78.9 | 127.8 | 159.9 | 0 | 0 | 0 | 0 | 0 | 119 | | |
| 196 | G | 33.9 | Very low | 45.4 | Very low | 84 Ų | 84 | 126.7 Ų | 126.7 | 87% | 0.866 | 81% | 0.813 | S | S | * | * | | | trans | 152.4 | 83.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 197 | G | 35.3 | Very low | 44.6 | Very low | 74 Ų | 74 | 125.8 Ų | 125.8 | 76% | 0.763 | 82% | 0.823 | S | S | * | * | | | trans | -94.2 | -158.7 | 162.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | | |
| 198 | P | 58 | Low | 44.6 | Very low | 126 Ų | 126 | 120.1 Ų | 120.1 | 82% | 0.818 | 82% | 0.819 | S | S | * | * | | | | -129.8 | 140.3 | -57.3 | 35.9 | -24.9 | 0 | 0 | 0 | 111.1 | | |
| 199 | R | 40.2 | Very low | 44.9 | Very low | 258 Ų | 258 | 121.9 Ų | 121.9 | 97% | 0.974 | 82% | 0.824 | S | S | * | * | | | trans | -141.7 | 141.2 | 168.3 | -60.3 | -165.8 | 94.8 | 143.3 | 4.6 | 112.2 | | |
| 200 | G | 36 | Very low | 44.6 | Very low | 72 Ų | 72 | 120.8 Ų | 120.8 | 74% | 0.742 | 83% | 0.827 | S | S | * | * | | | trans | -94.6 | -158.3 | -170 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 201 | P | 63.6 | Low | 44.8 | Very low | 128 Ų | 128 | 121.7 Ų | 121.7 | 83% | 0.831 | 83% | 0.832 | S | S | * | * | | | trans | -94.4 | 172.2 | -156.3 | 38.7 | -38.9 | 0 | 0 | 0 | 114.9 | | |
| 202 | L | 43.9 | Very low | 44.3 | Very low | 169 Ų | 169 | 119.3 Ų | 119.3 | 89% | 0.885 | 83% | 0.83 | S | S | * | * | | | trans | -176.5 | 164.7 | 151.9 | -94.9 | 158.9 | 0 | 0 | 0 | 109.5 | | |
| 203 | P | 57.4 | Low | 44 | Very low | 113 Ų | 113 | 119.6 Ų | 119.6 | 73% | 0.734 | 83% | 0.829 | S | S | * | * | | | trans | -132.7 | -133.3 | -133.1 | 40.7 | -16.1 | 0 | 0 | 0 | 114.6 | | |
| 204 | P | 55.5 | Low | 43.9 | Very low | 126 Ų | 126 | 121.7 Ų | 121.7 | 82% | 0.818 | 83% | 0.833 | S | S | * | * | | | trans | -116.2 | 168.2 | -131.8 | 37.4 | -17.5 | 0 | 0 | 0 | 116.7 | | |
| 205 | M | 44 | Very low | 44.3 | Very low | 194 Ų | 194 | 125.9 Ų | 125.9 | 96% | 0.956 | 83% | 0.834 | S | S | * | * | | | trans | -149.7 | 139 | 169 | -163.7 | 175.2 | 83.5 | 0 | 0 | 108.4 | | |
| 206 | G | 34.7 | Very low | 44.5 | Very low | 71 Ų | 71 | 130.9 Ų | 130.9 | 73% | 0.732 | 84% | 0.837 | S | S | * | * | | | cis | 146.4 | 97.2 | -2.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 207 | G | 37 | Very low | 44.6 | Very low | 84 Ų | 84 | 130.2 Ų | 130.2 | 87% | 0.866 | 83% | 0.83 | S | S | * | * | | | trans | 83.5 | 150.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | | |
| 208 | G | 41 | Very low | 44.7 | Very low | 74 Ų | 74 | 130 Ų | 130 | 76% | 0.763 | 83% | 0.827 | S | S | * | * | | | cis | 123 | 89.6 | -1.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 209 | M | 43.1 | Very low | 43.8 | Very low | 196 Ų | 196 | 133.5 Ų | 133.5 | 97% | 0.966 | 84% | 0.835 | S | S | * | * | | | trans | -158.5 | 144.3 | 163 | -156.5 | 65.7 | 90.2 | 0 | 0 | 111.7 | | |
| 210 | G | 40.8 | Very low | 43.5 | Very low | 66 Ų | 66 | 125.1 Ų | 125.1 | 68% | 0.68 | 83% | 0.829 | S | S | * | * | | | trans | -91.1 | -169.5 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 211 | P | 57.1 | Low | 43.5 | Very low | 136 Ų | 136 | 125.7 Ų | 125.7 | 88% | 0.883 | 84% | 0.835 | S | S | * | * | | | trans | -100.3 | 158 | -160.7 | 37.9 | -35.9 | 0 | 0 | 0 | 115.7 | | |
| 212 | G | 40.2 | Very low | 42.2 | Very low | 72 Ų | 72 | 123.3 Ų | 123.3 | 74% | 0.742 | 83% | 0.833 | S | S | * | * | | | trans | 112.5 | 115.6 | 153.6 | 0 | 0 | 0 | 0 | 0 | 115.9 | | |
| 213 | M | 44.6 | Very low | 42.6 | Very low | 177 Ų | 177 | 121.9 Ų | 121.9 | 87% | 0.872 | 83% | 0.834 | S | S | * | * | | | trans | -158.8 | 105.8 | 158.3 | -104.8 | 158.2 | -151.2 | 0 | 0 | 109.7 | | |
| 214 | N | 43.7 | Very low | 41.5 | Very low | 170 Ų | 170 | 120.4 Ų | 120.4 | 91% | 0.909 | 84% | 0.839 | S | S | * | * | | | trans | -88.9 | 128 | 170 | -60.5 | -34.9 | 0 | 0 | 0 | 108.4 | | |
| 215 | M | 43.6 | Very low | 40.5 | Very low | 167 Ų | 167 | 117.9 Ų | 117.9 | 82% | 0.823 | 84% | 0.837 | S | S | * | * | | | trans | -134.8 | 136.9 | 170.3 | -76.2 | -162.5 | -178.4 | 0 | 0 | 111.6 | | |
| 216 | M | 41.1 | Very low | 40.2 | Very low | 192 Ų | 192 | 116.2 Ų | 116.2 | 95% | 0.946 | 83% | 0.831 | S | S | * | * | | | trans | 68.5 | 133.7 | 162.7 | -152 | 167.6 | -75.5 | 0 | 0 | 116.3 | | |
| 217 | G | 35.3 | Very low | 40.2 | Very low | 70 Ų | 70 | 121.7 Ų | 121.7 | 72% | 0.722 | 84% | 0.84 | S | S | * | * | | | cis | 140.6 | 66.1 | -2 | 0 | 0 | 0 | 0 | 0 | 113.4 | | |
| 218 | G | 38.2 | Very low | 41 | Very low | 69 Ų | 69 | 123.2 Ų | 123.2 | 71% | 0.711 | 84% | 0.835 | S | S | * | * | | | trans | 71.6 | 125.6 | 160.4 | 0 | 0 | 0 | 0 | 0 | 118.5 | | |
| 219 | M | 37.8 | Very low | 41 | Very low | 200 Ų | 200 | 127.1 Ų | 127.1 | 99% | 0.985 | 84% | 0.838 | S | S | * | * | | | | 172.8 | 128.5 | 127.8 | -94 | 162.6 | 81.4 | 0 | 0 | 111.8 | | |
| 220 | G | 35.8 | Very low | 41.4 | Very low | 82 Ų | 82 | 122.5 Ų | 122.5 | 85% | 0.845 | 82% | 0.823 | S | S | * | * | | | trans | 83.6 | 117.8 | 141.4 | 0 | 0 | 0 | 0 | 0 | 120.6 | | |
| 221 | G | 36 | Very low | 41.4 | Very low | 84 Ų | 84 | 126.4 Ų | 126.4 | 87% | 0.866 | 83% | 0.829 | S | S | * | * | | | trans | 93.1 | 116.4 | 146.1 | 0 | 0 | 0 | 0 | 0 | 117.6 | | |
| 222 | G | 35.2 | Very low | 40.3 | Very low | 77 Ų | 77 | 125.1 Ų | 125.1 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | | | trans | -92 | -157.3 | 156.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | | |
| 223 | P | 52.6 | Low | 40.4 | Very low | 139 Ų | 139 | 127.4 Ų | 127.4 | 90% | 0.903 | 83% | 0.827 | S | S | * | * | | | cis | -126.4 | 166.5 | -7.4 | 40.2 | -26.6 | 0 | 0 | 0 | 113.4 | | |
| 224 | G | 33.9 | Very low | 40.6 | Very low | 82 Ų | 82 | 124 Ų | 124 | 85% | 0.845 | 82% | 0.818 | S | S | * | * | | | trans | 163.1 | 129.6 | 161.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | | |
| 225 | G | 34.8 | Very low | 40.3 | Very low | 74 Ų | 74 | 122.5 Ų | 122.5 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | | | trans | 106.8 | 105.8 | 154.9 | 0 | 0 | 0 | 0 | 0 | 117.5 | | |
| 226 | N | 36.9 | Very low | 39.7 | Very low | 158 Ų | 158 | 118.1 Ų | 118.1 | 85% | 0.845 | 81% | 0.813 | S | S | * | * | | | trans | 42.1 | 119.7 | 147.8 | -72.1 | 11.2 | 0 | 0 | 0 | 121.6 | | |
| 227 | M | 35.2 | Very low | 40 | Very low | 186 Ų | 186 | 114.4 Ų | 114.4 | 92% | 0.916 | 80% | 0.803 | S | S | * | * | | | | -127.8 | 139.9 | 120.8 | -68.9 | -172.4 | -150.9 | 0 | 0 | 109.5 | | |
| 228 | P | 55 | Low | 40.3 | Very low | 117 Ų | 117 | 118.9 Ų | 118.9 | 76% | 0.76 | 81% | 0.81 | S | S | * | * | | | trans | -90.6 | -175.1 | 169.4 | 38 | -34.8 | 0 | 0 | 0 | 111.8 | | |
| 229 | N | 39.8 | Very low | 40.2 | Very low | 155 Ų | 155 | 122.8 Ų | 122.8 | 83% | 0.829 | 82% | 0.815 | S | S | * | * | | | trans | 93.6 | 158.3 | 168.5 | -129.7 | 28.6 | 0 | 0 | 0 | 115.6 | | |
| 230 | P | 52.8 | Low | 39.9 | Very low | 99 Ų | 99 | 116.2 Ų | 116.2 | 64% | 0.643 | 80% | 0.798 | S | S | * | * | | | | -131.5 | 173 | -89.6 | 40.8 | -25.9 | 0 | 0 | 0 | 113.9 | | |
| 231 | N | 39.6 | Very low | 39.7 | Very low | 149 Ų | 149 | 118.5 Ų | 118.5 | 80% | 0.797 | 80% | 0.801 | S | S | * | * | | | trans | 40.5 | 100.2 | 148 | -173.2 | 33.5 | 0 | 0 | 0 | 118.6 | | |
| 232 | S | 33.8 | Very low | 39.5 | Very low | 109 Ų | 109 | 118.5 Ų | 118.5 | 76% | 0.762 | 80% | 0.801 | S | S | * | * | | | trans | -178.4 | 119.4 | 135 | -81 | 0 | 0 | 0 | 0 | 111.5 | | |
| 233 | S | 42.6 | Very low | 39.5 | Very low | 120 Ų | 120 | 122.6 Ų | 122.6 | 84% | 0.839 | 80% | 0.799 | S | S | * | * | | | trans | -86.9 | 143.8 | 151.9 | -59.4 | 0 | 0 | 0 | 0 | 107.6 | | |
| 234 | P | 49.2 | Very low | 39.3 | Very low | 104 Ų | 104 | 121 Ų | 121 | 68% | 0.675 | 79% | 0.789 | S | S | * | * | | | | -149.9 | 161.8 | 97.7 | 38 | -21.3 | 0 | 0 | 0 | 116.2 | | |
| 235 | T | 36.3 | Very low | 39.3 | Very low | 139 Ų | 139 | 124.4 Ų | 124.4 | 85% | 0.853 | 78% | 0.783 | S | S | * | * | | | trans | 50.9 | 113.9 | 148.3 | 53.6 | 0 | 0 | 0 | 0 | 120.4 | | |
| 236 | G | 32.1 | Very low | 39.5 | Very low | 75 Ų | 75 | 128.9 Ų | 128.9 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | | | trans | -123.5 | 143.7 | 156.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 237 | P | 47.7 | Very low | 40.1 | Very low | 114 Ų | 114 | 125.4 Ų | 125.4 | 74% | 0.74 | 77% | 0.77 | S | S | * | * | | | trans | -101.6 | 151.3 | 176.1 | 37.1 | -32.1 | 0 | 0 | 0 | 113.9 | | |
| 238 | L | 40.5 | Very low | 40.1 | Very low | 165 Ų | 165 | 124.9 Ų | 124.9 | 86% | 0.864 | 77% | 0.765 | S | S | * | * | | | trans | 40.6 | 143.9 | 137.3 | -61.6 | 168.4 | 0 | 0 | 0 | 120.6 | | |
| 239 | N | 37.5 | Very low | 39 | Very low | 151 Ų | 151 | 124.5 Ų | 124.5 | 81% | 0.807 | 77% | 0.765 | S | S | * | * | | | cis | -174.2 | 147.2 | -4.8 | 174.2 | -10.2 | 0 | 0 | 0 | 108.2 | | |
| 240 | G | 30.8 | Very low | 38.6 | Very low | 62 Ų | 62 | 122.1 Ų | 122.1 | 64% | 0.639 | 77% | 0.767 | S | S | * | * | | | trans | 122.6 | 140.8 | 153.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | | |
| 241 | S | 30.6 | Very low | 37.9 | Very low | 130 Ų | 130 | 123.9 Ų | 123.9 | 91% | 0.909 | 77% | 0.771 | S | S | * | * | | | cis | -164.4 | 149.6 | -9.5 | 47.3 | 0 | 0 | 0 | 0 | 109.2 | | |
| 242 | G | 31.8 | Very low | 37.6 | Very low | 83 Ų | 83 | 123.2 Ų | 123.2 | 86% | 0.856 | 77% | 0.767 | S | S | * | * | | | trans | 134 | 73.1 | 174.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | | |
| 243 | Q | 36.8 | Very low | 37.5 | Very low | 163 Ų | 163 | 125.9 Ų | 125.9 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | | | trans | -95.1 | 174.9 | 160.3 | -141.2 | -146.1 | -14.5 | 0 | 0 | 108.3 | | |
| 244 | P | 47.1 | Very low | 36.9 | Very low | 106 Ų | 106 | 123.7 Ų | 123.7 | 69% | 0.688 | 77% | 0.769 | S | S | * | * | | | | -155.2 | 146.6 | 62.3 | 45.8 | -24.5 | 0 | 0 | 0 | 119.3 | | |
| 245 | Q | 35.1 | Very low | 35.9 | Very low | 154 Ų | 154 | 122.1 Ų | 122.1 | 72% | 0.72 | 77% | 0.772 | S | S | * | * | | | trans | 66 | 149.7 | 154 | -19.8 | -159.8 | -46.9 | 0 | 0 | 118.2 | | |
| 246 | H | 38.1 | Very low | 35.9 | Very low | 168 Ų | 168 | 123 Ų | 123 | 78% | 0.778 | 77% | 0.771 | S | S | * | * | | | cis | -151.9 | -179.5 | 14.1 | -152.7 | -141.2 | 0 | 0 | 0 | 109 | | |
| 247 | P | 50.2 | Low | 36.1 | Very low | 85 Ų | 85 | 126.4 Ų | 126.4 | 55% | 0.552 | 78% | 0.777 | S | S | * | * | | | | -127.5 | 176.7 | -92.7 | 43.4 | -27.8 | 0 | 0 | 0 | 116.9 | | |
| 248 | Q | 34.4 | Very low | 35.8 | Very low | 174 Ų | 174 | 127 Ų | 127 | 81% | 0.813 | 78% | 0.781 | S | S | * | * | | | trans | -17.6 | 158.3 | 146.3 | -73.3 | 143.2 | -44.3 | 0 | 0 | 117.7 | | |
| 249 | S | 32 | Very low | 35.4 | Very low | 109 Ų | 109 | 122.5 Ų | 122.5 | 76% | 0.762 | 77% | 0.774 | S | S | * | * | | | cis | -173 | 176.5 | 9.2 | -115.5 | 0 | 0 | 0 | 0 | 111.9 | | |
| 250 | A | 30.8 | Very low | 35.3 | Very low | 105 Ų | 105 | 121.2 Ų | 121.2 | 87% | 0.868 | 78% | 0.778 | S | S | * | * | | | trans | 87.2 | 146.7 | 145.4 | 0 | 0 | 0 | 0 | 0 | 121.7 | | |
| 251 | N | 39 | Very low | 35.5 | Very low | 137 Ų | 137 | 124.9 Ų | 124.9 | 73% | 0.733 | 78% | 0.782 | S | S | * | * | | | trans | -88.8 | 170.1 | -167.5 | -169 | 16.5 | 0 | 0 | 0 | 113.4 | | |
| 252 | N | 32.6 | Very low | 36.1 | Very low | 134 Ų | 134 | 124.3 Ų | 124.3 | 72% | 0.717 | 78% | 0.775 | S | S | * | * | | | trans | 80.3 | 115.3 | 159.5 | -68.2 | -35.5 | 0 | 0 | 0 | 122 | | |
| 253 | N | 33 | Very low | 36.6 | Very low | 166 Ų | 166 | 127.2 Ų | 127.2 | 89% | 0.888 | 77% | 0.771 | S | S | * | * | | | | 76 | 120.1 | 126.6 | -156.8 | 20.5 | 0 | 0 | 0 | 121.6 | | |
| 254 | G | 28.6 | Very low | 36.9 | Very low | 74 Ų | 74 | 124.4 Ų | 124.4 | 76% | 0.763 | 77% | 0.768 | S | S | * | * | | | trans | 107.7 | 123 | 143.9 | 0 | 0 | 0 | 0 | 0 | 118.6 | | |
| 255 | G | 29.6 | Very low | 36.9 | Very low | 70 Ų | 70 | 125.5 Ų | 125.5 | 72% | 0.722 | 78% | 0.775 | S | S | * | * | | | trans | 121.4 | 84.7 | 144.7 | 0 | 0 | 0 | 0 | 0 | 120.2 | | |
| 256 | N | 36 | Very low | 37 | Very low | 158 Ų | 158 | 123.9 Ų | 123.9 | 85% | 0.845 | 78% | 0.78 | S | S | * | * | | | trans | 50 | 120 | 137.7 | -56.9 | -20.1 | 0 | 0 | 0 | 122.4 | | |
| 257 | T | 36.1 | Very low | 36.7 | Very low | 146 Ų | 146 | 122.9 Ų | 122.9 | 90% | 0.896 | 78% | 0.781 | S | S | * | * | | | | -165.2 | 161.5 | 119.4 | 14.9 | 0 | 0 | 0 | 0 | 110.4 | | |
| 258 | P | 41.4 | Very low | 35.9 | Very low | 127 Ų | 127 | 123.9 Ų | 123.9 | 83% | 0.825 | 79% | 0.789 | S | S | * | * | | | trans | -106.8 | 167.7 | -151.1 | 40.5 | -37.7 | 0 | 0 | 0 | 115.8 | | |
| 259 | G | 31.4 | Very low | 36 | Very low | 70 Ų | 70 | 122.2 Ų | 122.2 | 72% | 0.722 | 79% | 0.791 | S | S | * | * | | | trans | 150.1 | 87.5 | 154.2 | 0 | 0 | 0 | 0 | 0 | 118.5 | | |
| 260 | S | 35.2 | Very low | 36.2 | Very low | 125 Ų | 125 | 121.5 Ų | 121.5 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | | | trans | 43.3 | 107.7 | 139.6 | -52.2 | 0 | 0 | 0 | 0 | 121.6 | | |
| 261 | N | 35.8 | Very low | 36.5 | Very low | 138 Ų | 138 | 123 Ų | 123 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -68.4 | 137.1 | 166.1 | 177.7 | 59.2 | 0 | 0 | 0 | 113.8 | | |
| 262 | P | 42.7 | Very low | 36.8 | Very low | 118 Ų | 118 | 121.3 Ų | 121.3 | 77% | 0.766 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -96.1 | 116.6 | 167.7 | 33.9 | -27.3 | 0 | 0 | 0 | 112 | | |
| 263 | N | 42.6 | Very low | 36.8 | Very low | 144 Ų | 144 | 121.6 Ų | 121.6 | 77% | 0.77 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 151.9 | 169.1 | -135.6 | 15.8 | 0 | 0 | 0 | 109.7 | | |
| 264 | P | 43.3 | Very low | 37 | Very low | 105 Ų | 105 | 119.3 Ų | 119.3 | 68% | 0.682 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 161 | -178 | 32.6 | -34 | 0 | 0 | 0 | 112.5 | | |
| 265 | P | 46.7 | Very low | 37.3 | Very low | 129 Ų | 129 | 125.1 Ų | 125.1 | 84% | 0.838 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 133.3 | -169.2 | 31.9 | -34.7 | 0 | 0 | 0 | 113.7 | | |
| 266 | S | 36.6 | Very low | 37.6 | Very low | 120 Ų | 120 | 127 Ų | 127 | 84% | 0.839 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 135.6 | 154.6 | -64.9 | 0 | 0 | 0 | 0 | 108.9 | | |
| 267 | N | 33 | Very low | 38.2 | Very low | 147 Ų | 147 | 125 Ų | 125 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | | | trans | -119.2 | 119.6 | 166.1 | -174.4 | 12.3 | 0 | 0 | 0 | 109.5 | | |
| 268 | S | 32.9 | Very low | 38.6 | Very low | 105 Ų | 105 | 125.1 Ų | 125.1 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | | | trans | -119.8 | 131.9 | 173.9 | -63.4 | 0 | 0 | 0 | 0 | 108.8 | | |
| 269 | T | 36.1 | Very low | 38.9 | Very low | 139 Ų | 139 | 124.9 Ų | 124.9 | 85% | 0.853 | 77% | 0.773 | S | S | * | * | | | trans | -110.9 | 141.7 | 170.9 | -57.4 | 0 | 0 | 0 | 0 | 109.4 | | |
| 270 | S | 36.6 | Very low | 39.5 | Very low | 94 Ų | 94 | 127.6 Ų | 127.6 | 66% | 0.657 | 78% | 0.778 | S | S | * | * | | | trans | -107.4 | 129.9 | -155.7 | -47.6 | 0 | 0 | 0 | 0 | 115.7 | | |
| 271 | T | 37.5 | Very low | 39.7 | Very low | 136 Ų | 136 | 124.7 Ų | 124.7 | 83% | 0.834 | 77% | 0.768 | S | S | * | * | | | trans | 57.6 | 165.7 | 136.5 | 57.3 | 0 | 0 | 0 | 0 | 120.4 | | |
| 272 | P | 45.7 | Very low | 40.5 | Very low | 103 Ų | 103 | 124.6 Ų | 124.6 | 67% | 0.669 | 78% | 0.775 | S | S | * | * | | | cis | -138.1 | 176.8 | 10.8 | 42.5 | -24.5 | 0 | 0 | 0 | 118.9 | | |
| 273 | N | 32 | Very low | 40 | Very low | 139 Ų | 139 | 125.7 Ų | 125.7 | 74% | 0.743 | 78% | 0.779 | S | S | * | * | | | trans | 113.5 | 102.4 | 146.4 | -71.8 | -24 | 0 | 0 | 0 | 122.1 | | |
| 274 | T | 37.1 | Very low | 40 | Very low | 118 Ų | 118 | 123.4 Ų | 123.4 | 72% | 0.724 | 78% | 0.781 | S | S | * | * | | | trans | 57.8 | 102.2 | 133.1 | 61.9 | 0 | 0 | 0 | 0 | 121.7 | | |
| 275 | Q | 34.8 | Very low | 40 | Very low | 197 Ų | 197 | 124.2 Ų | 124.2 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | | | | 177.6 | 154.7 | 100.6 | -91.2 | 178.1 | 10 | 0 | 0 | 112.1 | | |
| 276 | S | 37 | Very low | 39.4 | Very low | 108 Ų | 108 | 124.6 Ų | 124.6 | 76% | 0.755 | 79% | 0.786 | S | S | * | * | | | trans | -85.8 | 175.8 | 177.8 | -116.8 | 0 | 0 | 0 | 0 | 111.9 | | |
| 277 | P | 48.7 | Very low | 39.3 | Very low | 117 Ų | 117 | 126 Ų | 126 | 76% | 0.76 | 79% | 0.79 | S | S | * | * | | | cis | -135.6 | -168.8 | 19.1 | 37.9 | -15.9 | 0 | 0 | 0 | 116.5 | | |
| 278 | L | 42.9 | Very low | 39.3 | Very low | 148 Ų | 148 | 122.3 Ų | 122.3 | 78% | 0.775 | 79% | 0.786 | S | S | * | * | | | trans | -69.9 | 155.6 | -172 | -60.4 | 74.1 | 0 | 0 | 0 | 115.3 | | |
| 279 | P | 48.1 | Very low | 40 | Very low | 123 Ų | 123 | 123.7 Ų | 123.7 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | | | trans | -84.6 | 136.1 | 162.1 | 33.1 | -31.6 | 0 | 0 | 0 | 113 | | |
| 280 | P | 44.7 | Very low | 40.1 | Very low | 126 Ų | 126 | 123 Ų | 123 | 82% | 0.818 | 79% | 0.794 | S | S | * | * | | | trans | -78.8 | 174.3 | 171.1 | -15.4 | 31.7 | 0 | 0 | 0 | 114.9 | | |
| 281 | G | 39.4 | Very low | 40.3 | Very low | 65 Ų | 65 | 124.7 Ų | 124.7 | 67% | 0.67 | 81% | 0.806 | S | S | * | * | | | trans | -75.2 | -164.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | | |
| 282 | P | 51.6 | Low | 40.2 | Very low | 136 Ų | 136 | 121.3 Ų | 121.3 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | | | trans | -84.3 | 156.7 | -146.2 | 33.3 | -38.7 | 0 | 0 | 0 | 116.1 | | |
| 283 | T | 31.9 | Very low | 40 | Very low | 140 Ų | 140 | 122.9 Ų | 122.9 | 86% | 0.859 | 81% | 0.808 | S | S | * | * | | | trans | -134.1 | 136.7 | 172.5 | 45.3 | 0 | 0 | 0 | 0 | 112.2 | | |
| 284 | A | 43.9 | Very low | 40.7 | Very low | 96 Ų | 96 | 119.8 Ų | 119.8 | 79% | 0.793 | 81% | 0.808 | S | S | * | * | | | trans | -91.2 | 151.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | | |
| 285 | P | 42.3 | Very low | 41 | Very low | 122 Ų | 122 | 121.8 Ų | 121.8 | 79% | 0.792 | 81% | 0.807 | S | S | * | * | | | trans | -94 | 109.3 | 176.7 | 32.7 | -28.7 | 0 | 0 | 0 | 113.5 | | |
| 286 | T | 33.6 | Very low | 41.6 | Very low | 137 Ų | 137 | 120.5 Ų | 120.5 | 84% | 0.84 | 81% | 0.806 | S | S | * | * | | | trans | 2.8 | 133.9 | 144.1 | 49.6 | 0 | 0 | 0 | 0 | 120.7 | | |
| 287 | T | 35.3 | Very low | 41.7 | Very low | 150 Ų | 150 | 117.8 Ų | 117.8 | 92% | 0.92 | 80% | 0.795 | S | S | * | * | | | trans | -77.3 | 155.7 | 164.4 | 44.3 | 0 | 0 | 0 | 0 | 113.4 | | |
| 288 | G | 33.4 | Very low | 41.5 | Very low | 69 Ų | 69 | 114.3 Ų | 114.3 | 71% | 0.711 | 78% | 0.781 | S | S | * | * | | | trans | -134.1 | 148.3 | 166.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | | |
| 289 | P | 46.9 | Very low | 41.9 | Very low | 135 Ų | 135 | 114.4 Ų | 114.4 | 88% | 0.877 | 79% | 0.79 | S | S | * | * | | | trans | -89.4 | 132.7 | -174 | 33.9 | -32.3 | 0 | 0 | 0 | 112.1 | | |
| 290 | S | 38.4 | Very low | 42.2 | Very low | 124 Ų | 124 | 112 Ų | 112 | 87% | 0.867 | 79% | 0.788 | S | S | * | * | | | trans | -142 | 124.1 | 163.4 | -160.1 | 0 | 0 | 0 | 0 | 109.8 | | |
| 291 | S | 41.8 | Very low | 43.7 | Very low | 130 Ų | 130 | 111.1 Ų | 111.1 | 91% | 0.909 | 77% | 0.774 | S | S | * | * | | | trans | -87.8 | 119.5 | -170.2 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | | |
| 292 | G | 33.9 | Very low | 45.9 | Very low | 64 Ų | 64 | 112 Ų | 112 | 66% | 0.66 | 77% | 0.766 | S | S | * | * | | | trans | -158.1 | 154.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | G294 | G292-G294 PolarHBondContact O-N 3.14Š|
| 293 | P | 42.8 | Very low | 47.9 | Very low | 137 Ų | 137 | 109.5 Ų | 109.5 | 89% | 0.89 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -78.3 | 119.1 | -172.6 | -7.9 | 25.2 | 0 | 0 | 0 | 111.8 | | |
| 294 | G | 45.7 | Very low | 50.9 | Low | 73 Ų | 73 | 106.3 Ų | 106.3 | 75% | 0.753 | 72% | 0.723 | S | S | * | * | | | trans | 77.3 | 34.4 | 144.4 | 0 | 0 | 0 | 0 | 0 | 119.6 | G292 L296 | G292-G294 PolarHBondContact O-N 3.14Å; G294-L296 PolarHBondContact O-N 3.4Å |
| 295 | K | 43.6 | Very low | 53.5 | Low | 160 Ų | 160 | 101.7 Ų | 101.7 | 70% | 0.696 | 69% | 0.685 | S | S | * | * | | | trans | -78.4 | 109.5 | 157.3 | -77.6 | -154.5 | 171.5 | -155.6 | 0 | 110.1 | G297 D314 | K295-G297 PolarHBondContact O-N 2.74Å; K295-G297 VanDerWaalsContact O-N 3.14Å; K295-D314 IonicContact NZ-OD2 3.63Å; K295-D314 PolarHBondContact NZ-OD2 3.08Å |
| 296 | L | 48.5 | Very low | 56 | Low | 170 Ų | 170 | 97 Ų | 97 | 89% | 0.89 | 66% | 0.658 | S | S | * | * | | | trans | -77.9 | 22.9 | 169.8 | -71.6 | 173.4 | 0 | 0 | 0 | 113.1 | G294 M301 | G294-L296 PolarHBondContact O-N 3.4Å; L296-M301 VanDerWaalsContact O-CE 3.3Å; L296-M301 WeakPolarHBondContact O-CE 3.42Å |
| 297 | G | 39.1 | Very low | 58.9 | Low | 51 Ų | 51 | 96.5 Ų | 96.5 | 53% | 0.526 | 65% | 0.648 | S | S | . | * | | | trans | -106.7 | 95.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | K295 | K295-G297 PolarHBondContact O-N 2.74Å; K295-G297 VanDerWaalsContact O-N 3.14Å |
| 298 | G | 43.7 | Very low | 61.8 | Low | 45 Ų | 45 | 92.3 Ų | 92.3 | 46% | 0.464 | 62% | 0.624 | S | S | . | * | | | trans | -69.3 | 156.2 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | G300 | G298-G300 PolarHBondContact O-N 3.47Š|
| 299 | P | 50.8 | Low | 64.8 | Low | 149 Ų | 149 | 95.6 Ų | 95.6 | 97% | 0.968 | 63% | 0.625 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | 107.9 | -178.1 | 27.3 | -34.1 | 0 | 0 | 0 | 110.7 | | |
| 300 | G | 55.7 | Low | 67.1 | Low | 73 Ų | 73 | 91.6 Ų | 91.6 | 75% | 0.753 | 60% | 0.603 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 130 | -1.5 | 172.3 | 0 | 0 | 0 | 0 | 0 | 117 | G298 V302 | G298-G300 PolarHBondContact O-N 3.47Å; G300-V302 PolarHBondContact O-N 3.44Å |
| 301 | M | 74.5 | Confident | 69.9 | Low | 107 Ų | 107 | 89.6 Ų | 89.6 | 53% | 0.527 | 58% | 0.58 | S | S | . | * | | | trans | -84.8 | 86.2 | 173.2 | -64.9 | -164.7 | -61.3 | 0 | 0 | 111.2 | L296 F303 | L296-M301 VanDerWaalsContact O-CE 3.3Å; L296-M301 WeakPolarHBondContact O-CE 3.42Å; M301-F303 HydrophobicContact CB-CE2 3.78Å; M301-F303 HydrophobicContact CB-CZ 3.76Å; M301-F303 HydrophobicContact CE-CZ 4.13Å; M301-F303 VanDerWaalsContact O-CD2 3.3Å; M301-F303 WeakPolarHBondContact O-CD2 3.21Å; M301-F303 WeakPolarHBondContact O-CE2 3.1Å; M301-F303 HydrophobicContact SD-CZ 4.24Å |
| 302 | V | 86.2 | Confident | 72.5 | Confident | 83 Ų | 83 | 84.1 Ų | 84.1 | 50% | 0.503 | 54% | 0.541 | S | S | . | . | | | trans | -72.6 | 123.8 | 167.5 | 170.3 | 0 | 0 | 0 | 0 | 108.8 | G300 P304 E311 | G300-V302 PolarHBondContact O-N 3.44Å; V302-P304 WeakPolarHBondContact O-CD 3.41Å; V302-E311 HydrophobicContact CG1-CB 4.15Å; V302-E311 HydrophobicContact CG1-CG 3.83Å |
| 303 | F | 93.1 | Very high | 75.3 | Confident | 85 Ų | 85 | 85 Ų | 85 | 37% | 0.373 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105 | 103.6 | 178 | -66.5 | -73.4 | 0 | 0 | 0 | 110.4 | M301 V312 W328 | M301-F303 HydrophobicContact CB-CE2 3.78Å; M301-F303 HydrophobicContact CB-CZ 3.76Å; M301-F303 HydrophobicContact CE-CZ 4.13Å; M301-F303 VanDerWaalsContact O-CD2 3.3Å; M301-F303 WeakPolarHBondContact O-CD2 3.21Å; M301-F303 WeakPolarHBondContact O-CE2 3.1Å; M301-F303 HydrophobicContact SD-CZ 4.24Å; F303-V312 WeakPolarHBondContact O-CB 3.3Å; F303-V312 PolarHBondContact O-N 2.78Å; F303-W328 HydrophobicContact CB-CB 4.41Å; F303-W328 HydrophobicContact CB-CG 4.29Å; F303-W328 AromaticContact CD1-CD1 3.67Å; F303-W328 AromaticContact CG-CD1 3.64Å |
| 304 | P | 95.6 | Very high | 77.6 | Confident | 72 Ų | 72 | 85.2 Ų | 85.2 | 47% | 0.468 | 52% | 0.521 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.7 | 135 | 178.1 | 29.7 | -34 | 0 | 0 | 0 | 111.1 | V302 G306 | V302-P304 WeakPolarHBondContact O-CD 3.41Å; P304-G306 PolarHBondContact O-N 3.03Å |
| 305 | C | 97.5 | Very high | 79.9 | Confident | 0 Ų | 0 | 88.4 Ų | 88.4 | 0% | 0 | 52% | 0.521 | C | S | . | . | | | trans | -59.9 | 127.1 | 174.6 | 176.1 | 0 | 0 | 0 | 0 | 110.7 | M307 C308 L309 A310 V312 W328 H330 | C305-M307 PolarHBondContact O-N 3.4Å; C305-C308 WeakPolarHBondContact CB-SG 3.45Å; C305-C308 PolarHBondContact SG-SG 2.97Å; C305-L309 VanDerWaalsContact O-CA 3.23Å; C305-L309 WeakPolarHBondContact O-CA 3.43Å; C305-L309 PolarHBondContact O-N 3.38Å; C305-A310 WeakPolarHBondContact CB-O 3.36Å; C305-A310 PolarHBondContact N-O 2.99Å; C305-V312 HydrophobicContact CB-CG2 3.73Å; C305-W328 CarbonylContact C-O 3.57Å; C305-W328 WeakPolarHBondContact CA-O 3.46Å; C305-H330 WeakPolarHBondContact CB-ND1 3.39Å; C305-H330 PolarHBondContact SG-ND1 2.78Å; C305-H330 VanDerWaalsContact SG-ND1 3.43Å |
| 306 | G | 95.1 | Very high | 82.4 | Confident | 22 Ų | 22 | 84.3 Ų | 84.3 | 23% | 0.227 | 51% | 0.505 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.4 | -4.3 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | P304 W328 | P304-G306 PolarHBondContact O-N 3.03Å; G306-W328 PolarHBondContact N-O 3.03Å |
| 307 | M | 94.5 | Very high | 84.6 | Confident | 127 Ų | 127 | 79.5 Ų | 79.5 | 63% | 0.626 | 48% | 0.48 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -110.4 | -58.2 | 175.3 | -70.5 | -69.2 | -79.6 | 0 | 0 | 112.5 | C305 F329 C333 | C305-M307 PolarHBondContact O-N 3.4Å; M307-F329 HydrophobicContact CB-CD1 4.36Å; M307-F329 HydrophobicContact CG-CD1 3.64Å; M307-F329 HydrophobicContact CG-CE1 3.79Å; M307-C333 HydrophobicContact CB-CB 4.06Å |
| 308 | C | 97.1 | Very high | 87.4 | Confident | 63 Ų | 63 | 77.5 Ų | 77.5 | 43% | 0.426 | 46% | 0.458 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.7 | -5.6 | -174.7 | 70.1 | 0 | 0 | 0 | 0 | 114.4 | C305 A310 C333 | C305-C308 WeakPolarHBondContact CB-SG 3.45Å; C305-C308 PolarHBondContact SG-SG 2.97Å; C308-A310 PolarHBondContact O-N 2.99Å; C308-C333 VanDerWaalsContact SG-SG 3.68Å |
| 309 | L | 95.7 | Very high | 89.9 | Confident | 137 Ų | 137 | 76 Ų | 76 | 72% | 0.717 | 44% | 0.439 | S | S | * | . | | | trans | 61.3 | -4.9 | -177.5 | -52.9 | 177.2 | 0 | 0 | 0 | 116.2 | C305 | C305-L309 VanDerWaalsContact O-CA 3.23Å; C305-L309 WeakPolarHBondContact O-CA 3.43Å; C305-L309 PolarHBondContact O-N 3.38Å |
| 310 | A | 96.3 | Very high | 92.1 | Very high | 51 Ų | 51 | 70.5 Ų | 70.5 | 42% | 0.421 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -66 | 155.2 | 171.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | C305 C308 | C305-A310 WeakPolarHBondContact CB-O 3.36Å; C305-A310 PolarHBondContact N-O 2.99Å; C308-A310 PolarHBondContact O-N 2.99Å |
| 311 | E | 96.1 | Very high | 94 | Very high | 83 Ų | 83 | 67 Ų | 67 | 39% | 0.388 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.5 | 137.3 | 175.1 | -178.3 | 167.2 | 174.2 | 0 | 0 | 111.5 | V302 H313 H330 | V302-E311 HydrophobicContact CG1-CB 4.15Å; V302-E311 HydrophobicContact CG1-CG 3.83Å; E311-H313 VanDerWaalsContact CG-CE1 3.5Å; E311-H313 WeakPolarHBondContact CG-CE1 3.29Å; E311-H313 IonicContact OE1-CE1 2.7Å; E311-H313 PolarHBondContact OE1-CE1 3.18Å; E311-H313 VanDerWaalsContact OE1-CE1 3.23Å; E311-H313 IonicContact OE1-ND1 3.36Å; E311-H313 PolarHBondContact OE1-ND1 2.91Å; E311-H313 IonicContact OE2-CE1 3.63Å; E311-H330 PolarHBondContact O-CE1 3.45Å; E311-H330 VanDerWaalsContact O-CE1 3.32Å; E311-H330 PolarHBondContact O-NE2 2.87Å |
| 312 | V | 97 | Very high | 94.9 | Very high | 14 Ų | 14 | 66.6 Ų | 66.6 | 9% | 0.085 | 36% | 0.363 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 121.9 | 169 | -179.3 | 0 | 0 | 0 | 0 | 107.7 | F303 C305 A318 W328 | F303-V312 WeakPolarHBondContact O-CB 3.3Å; F303-V312 PolarHBondContact O-N 2.78Å; C305-V312 HydrophobicContact CB-CG2 3.73Å; V312-A318 HydrophobicContact CG1-CB 3.32Å; V312-W328 HydrophobicContact CB-CB 4.3Å; V312-W328 HydrophobicContact CG1-CB 4.33Å; V312-W328 HydrophobicContact CG2-CB 4.05Å |
| 313 | H | 93.5 | Very high | 94.9 | Very high | 83 Ų | 83 | 64.3 Ų | 64.3 | 38% | 0.384 | 35% | 0.352 | S | S | . | . | P | Polyproline II helix | trans | -101.8 | 157.8 | 176.9 | -59.3 | -62.4 | 0 | 0 | 0 | 112 | E311 D315 Q316 | E311-H313 VanDerWaalsContact CG-CE1 3.5Å; E311-H313 WeakPolarHBondContact CG-CE1 3.29Å; E311-H313 IonicContact OE1-CE1 2.7Å; E311-H313 PolarHBondContact OE1-CE1 3.18Å; E311-H313 VanDerWaalsContact OE1-CE1 3.23Å; E311-H313 IonicContact OE1-ND1 3.36Å; E311-H313 PolarHBondContact OE1-ND1 2.91Å; E311-H313 IonicContact OE2-CE1 3.63Å; H313-D315 WeakPolarHBondContact CB-OD1 3.43Å; H313-D315 PolarHBondContact O-N 2.95Å; H313-D315 VanDerWaalsContact O-N 3.15Å; H313-Q316 HydrophobicContact CB-CG 4.27Å; H313-Q316 PolarHBondContact O-N 3.45Å; H313-Q316 VanDerWaalsContact O-N 3.13Å |
| 314 | D | 90.8 | Very high | 94.7 | Very high | 141 Ų | 141 | 63 Ų | 63 | 75% | 0.754 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.5 | -21.4 | -179.8 | -78.9 | -16.1 | 0 | 0 | 0 | 114.3 | K295 | K295-D314 IonicContact NZ-OD2 3.63Å; K295-D314 PolarHBondContact NZ-OD2 3.08Å |
| 315 | D | 93.9 | Very high | 94.6 | Very high | 140 Ų | 140 | 61.4 Ų | 61.4 | 75% | 0.749 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95.3 | 3.2 | -178.6 | 65.5 | -40.4 | 0 | 0 | 0 | 113.6 | H313 | H313-D315 WeakPolarHBondContact CB-OD1 3.43Å; H313-D315 PolarHBondContact O-N 2.95Å; H313-D315 VanDerWaalsContact O-N 3.15Å |
| 316 | Q | 94.8 | Very high | 94.5 | Very high | 75 Ų | 75 | 67 Ų | 67 | 35% | 0.35 | 37% | 0.368 | S | S | . | . | S | Bend | trans | -105.3 | 140 | 179 | -63.1 | 175.8 | -27.5 | 0 | 0 | 110.7 | H313 A318 H330 | H313-Q316 HydrophobicContact CB-CG 4.27Å; H313-Q316 PolarHBondContact O-N 3.45Å; H313-Q316 VanDerWaalsContact O-N 3.13Å; Q316-A318 PolarHBondContact O-N 3.27Å; Q316-H330 PolarHBondContact OE1-CD2 3.17Å; Q316-H330 VanDerWaalsContact OE1-CD2 3.31Å; Q316-H330 PolarHBondContact OE1-NE2 3.23Å |
| 317 | D | 96.6 | Very high | 94.5 | Very high | 68 Ų | 68 | 73.2 Ų | 73.2 | 36% | 0.364 | 38% | 0.384 | S | S | . | . | | | trans | -60.5 | 111.2 | 171.3 | -80.5 | -5.2 | 0 | 0 | 0 | 109.8 | H330 R331 Y341 | D317-H330 WeakPolarHBondContact O-CA 3.38Å; D317-R331 HydrophobicContact CB-CB 3.73Å; D317-R331 HydrophobicContact CB-CG 4.44Å; D317-R331 WeakPolarHBondContact O-CB 3.5Å; D317-R331 PolarHBondContact O-N 3.21Å; D317-R331 IonicContact OD2-CZ 3.23Å; D317-R331 IonicContact OD2-NE 3.26Å; D317-R331 IonicContact OD2-NH1 2.63Å; D317-R331 PolarHBondContact OD2-NH1 2.9Å; D317-Y341 HydrophobicContact CB-CD1 4.32Å; D317-Y341 HydrophobicContact CB-CE1 3.79Å; D317-Y341 VanDerWaalsContact CG-CE1 3.46Å; D317-Y341 WeakPolarHBondContact OD1-CE1 3.34Å |
| 318 | A | 96.8 | Very high | 94.6 | Very high | 10 Ų | 10 | 71.3 Ų | 71.3 | 8% | 0.083 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.6 | 146.4 | -174 | 0 | 0 | 0 | 0 | 0 | 112.1 | V312 Q316 W328 F329 Y341 | V312-A318 HydrophobicContact CG1-CB 3.32Å; Q316-A318 PolarHBondContact O-N 3.27Å; A318-W328 HydrophobicContact CB-CE3 4.12Å; A318-F329 CarbonylContact C-O 3.53Å; A318-F329 WeakPolarHBondContact CA-O 3.3Å; A318-Y341 PolarHBondContact N-OH 3.45Å; A318-Y341 VanDerWaalsContact N-OH 3.14Å; A318-Y341 WeakPolarHBondContact O-CE2 3.46Å; A318-Y341 PolarHBondContact O-OH 3.39Å |
| 319 | I | 96.6 | Very high | 94.6 | Very high | 12 Ų | 12 | 68.7 Ų | 68.7 | 6% | 0.062 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.5 | 142.5 | -176.3 | -163.6 | 160 | 0 | 0 | 0 | 110.8 | F329 T334 L336 Y341 L344 W352 | I319-F329 HydrophobicContact CG2-CB 4.45Å; I319-F329 PolarHBondContact N-O 2.77Å; I319-F329 PolarHBondContact O-N 2.82Å; I319-T334 HydrophobicContact CG2-CG2 4.2Å; I319-L336 HydrophobicContact CD1-CD1 3.86Å; I319-L336 HydrophobicContact CG2-CD1 4.02Å; I319-Y341 HydrophobicContact CB-CD2 4.46Å; I319-Y341 HydrophobicContact CB-CE2 4.21Å; I319-Y341 HydrophobicContact CD1-CD2 4.44Å; I319-L344 HydrophobicContact CD1-CB 4.19Å; I319-L344 HydrophobicContact CD1-CD1 4.19Å; I319-W352 HydrophobicContact CB-CE3 4.39Å; I319-W352 HydrophobicContact CD1-CB 3.48Å; I319-W352 VanDerWaalsContact CD1-CB 3.48Å; I319-W352 HydrophobicContact CD1-CD2 4.06Å; I319-W352 HydrophobicContact CD1-CG 3.58Å; I319-W352 HydrophobicContact CG1-CB 3.87Å; I319-W352 HydrophobicContact CG1-CD2 4.08Å; I319-W352 HydrophobicContact CG1-CE3 4.04Å; I319-W352 HydrophobicContact CG1-CG 4.03Å; I319-W352 HydrophobicContact CG2-CD2 3.85Å; I319-W352 HydrophobicContact CG2-CE3 3.66Å; I319-W352 HydrophobicContact CG2-CH2 4.07Å; I319-W352 HydrophobicContact CG2-CZ2 4.26Å; I319-W352 HydrophobicContact CG2-CZ3 3.78Å |
| 320 | L | 96.3 | Very high | 94.7 | Very high | 34 Ų | 34 | 63.2 Ų | 63.2 | 18% | 0.178 | 32% | 0.322 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.8 | 131 | -180 | -179.6 | 61.1 | 0 | 0 | 0 | 109.7 | E322 W328 | L320-E322 HydrophobicContact CB-CG 4.23Å; L320-E322 HydrophobicContact CD2-CG 3.97Å; L320-E322 HydrophobicContact CG-CG 3.96Å; L320-E322 PolarHBondContact O-N 2.7Å; L320-W328 HydrophobicContact CB-CD2 4.18Å; L320-W328 HydrophobicContact CB-CE3 4.02Å; L320-W328 HydrophobicContact CB-CH2 4Å; L320-W328 HydrophobicContact CB-CZ2 4.15Å; L320-W328 HydrophobicContact CB-CZ3 3.93Å; L320-W328 HydrophobicContact CD1-CD2 4.22Å; L320-W328 HydrophobicContact CD1-CG 4.31Å; L320-W328 HydrophobicContact CD2-CZ2 4.3Å |
| 321 | C | 95.6 | Very high | 94.8 | Very high | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 31% | 0.31 | C | S | . | . | | | trans | -75.7 | 80.5 | 169 | -179.6 | 0 | 0 | 0 | 0 | 110.1 | A323 C325 Q326 R327 F329 W352 C354 | C321-A323 VanDerWaalsContact C-N 3.28Å; C321-A323 PolarHBondContact O-N 3.43Å; C321-C325 VanDerWaalsContact CB-SG 3.53Å; C321-C325 PolarHBondContact SG-SG 3.13Å; C321-Q326 WeakPolarHBondContact O-CA 3.46Å; C321-Q326 PolarHBondContact O-N 2.99Å; C321-R327 PolarHBondContact N-O 3.04Å; C321-F329 HydrophobicContact CB-CD2 4.34Å; C321-F329 HydrophobicContact CB-CE2 3.72Å; C321-W352 HydrophobicContact CB-CE3 4.11Å; C321-W352 HydrophobicContact CB-CZ3 3.78Å; C321-C354 HydrophobicContact CB-CB 4.17Å; C321-C354 PolarHBondContact SG-N 3.49Å |
| 322 | E | 93.3 | Very high | 94.8 | Very high | 98 Ų | 98 | 64.5 Ų | 64.5 | 46% | 0.458 | 32% | 0.322 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -33.3 | -178.6 | -67.4 | -170.8 | 118.4 | 0 | 0 | 112.2 | L320 T324 Q326 W352 | L320-E322 HydrophobicContact CB-CG 4.23Å; L320-E322 HydrophobicContact CD2-CG 3.97Å; L320-E322 HydrophobicContact CG-CG 3.96Å; L320-E322 PolarHBondContact O-N 2.7Å; E322-T324 VanDerWaalsContact C-N 3.26Å; E322-T324 PolarHBondContact O-N 3.49Å; E322-T324 VanDerWaalsContact O-N 3.17Å; E322-Q326 PolarHBondContact O-NE2 3.01Å; E322-Q326 VanDerWaalsContact O-NE2 3.08Å; E322-W352 PolarHBondContact N-O 2.93Å |
| 323 | A | 87.1 | Confident | 94.8 | Very high | 35 Ų | 35 | 65.9 Ų | 65.9 | 29% | 0.289 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.6 | -27.2 | -173.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | C321 A353 I363 | C321-A323 VanDerWaalsContact C-N 3.28Å; C321-A323 PolarHBondContact O-N 3.43Å; A323-A353 HydrophobicContact CB-CB 3.55Å; A323-I363 HydrophobicContact CB-CD1 3.92Å; A323-I363 HydrophobicContact CB-CG2 4.37Å |
| 324 | T | 87.9 | Confident | 95 | Very high | 59 Ų | 59 | 63.8 Ų | 63.8 | 36% | 0.362 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -164.6 | -41.6 | 163 | -10.4 | 0 | 0 | 0 | 0 | 118.4 | E322 K361 | E322-T324 VanDerWaalsContact C-N 3.26Å; E322-T324 PolarHBondContact O-N 3.49Å; E322-T324 VanDerWaalsContact O-N 3.17Å; T324-K361 HydrophobicContact CG2-CD 3.76Å; T324-K361 VanDerWaalsContact CG2-NZ 3.26Å; T324-K361 WeakPolarHBondContact OG1-CD 3.46Å |
| 325 | C | 93.6 | Very high | 95.2 | Very high | 37 Ų | 37 | 60.1 Ų | 60.1 | 25% | 0.25 | 32% | 0.32 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -10.4 | -167.8 | 70.4 | 0 | 0 | 0 | 0 | 114.5 | C321 R327 C354 C357 | C321-C325 VanDerWaalsContact CB-SG 3.53Å; C321-C325 PolarHBondContact SG-SG 3.13Å; C325-R327 PolarHBondContact O-N 2.92Å; C325-R327 VanDerWaalsContact O-N 3.15Å; C325-C354 VanDerWaalsContact SG-SG 3.62Å; C325-C357 VanDerWaalsContact CB-SG 3.52Å; C325-C357 VanDerWaalsContact SG-SG 3.69Å |
| 326 | Q | 95.3 | Very high | 95.2 | Very high | 117 Ų | 117 | 55.1 Ų | 55.1 | 55% | 0.547 | 29% | 0.293 | S | S | . | . | | | trans | 52.8 | 38.5 | 173.4 | -65.7 | -73.3 | -34.5 | 0 | 0 | 112.1 | C321 E322 | C321-Q326 WeakPolarHBondContact O-CA 3.46Å; C321-Q326 PolarHBondContact O-N 2.99Å; E322-Q326 PolarHBondContact O-NE2 3.01Å; E322-Q326 VanDerWaalsContact O-NE2 3.08Å |
| 327 | R | 95.4 | Very high | 95.3 | Very high | 154 Ų | 154 | 55.6 Ų | 55.6 | 58% | 0.581 | 30% | 0.301 | S | S | * | . | | | trans | -109.6 | 143.4 | 174.2 | -72.6 | 179.6 | 179.5 | 169.9 | -1.2 | 109.9 | C321 C325 F329 | C321-R327 PolarHBondContact N-O 3.04Å; C325-R327 PolarHBondContact O-N 2.92Å; C325-R327 VanDerWaalsContact O-N 3.15Å; R327-F329 HydrophobicContact CB-CD2 4.49Å; R327-F329 HydrophobicContact CB-CE2 3.73Å; R327-F329 HydrophobicContact CB-CZ 4.13Å; R327-F329 WeakPolarHBondContact O-CD2 3.42Å; R327-F329 WeakPolarHBondContact O-CE2 3.31Å |
| 328 | W | 97 | Very high | 95.3 | Very high | 87 Ų | 87 | 58.7 Ų | 58.7 | 33% | 0.33 | 31% | 0.314 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.4 | 152 | 170.4 | -72.6 | 99.6 | 0 | 0 | 0 | 111.1 | F303 C305 G306 V312 A318 L320 | F303-W328 HydrophobicContact CB-CB 4.41Å; F303-W328 HydrophobicContact CB-CG 4.29Å; F303-W328 AromaticContact CD1-CD1 3.67Å; F303-W328 AromaticContact CG-CD1 3.64Å; C305-W328 CarbonylContact C-O 3.57Å; C305-W328 WeakPolarHBondContact CA-O 3.46Å; G306-W328 PolarHBondContact N-O 3.03Å; V312-W328 HydrophobicContact CB-CB 4.3Å; V312-W328 HydrophobicContact CG1-CB 4.33Å; V312-W328 HydrophobicContact CG2-CB 4.05Å; A318-W328 HydrophobicContact CB-CE3 4.12Å; L320-W328 HydrophobicContact CB-CD2 4.18Å; L320-W328 HydrophobicContact CB-CE3 4.02Å; L320-W328 HydrophobicContact CB-CH2 4Å; L320-W328 HydrophobicContact CB-CZ2 4.15Å; L320-W328 HydrophobicContact CB-CZ3 3.93Å; L320-W328 HydrophobicContact CD1-CD2 4.22Å; L320-W328 HydrophobicContact CD1-CG 4.31Å; L320-W328 HydrophobicContact CD2-CZ2 4.3Å |
| 329 | F | 97.7 | Very high | 95.2 | Very high | 7 Ų | 7 | 62.8 Ų | 62.8 | 3% | 0.031 | 34% | 0.339 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 131.4 | 178.2 | -63.3 | -100.7 | 0 | 0 | 0 | 109.1 | M307 A318 I319 C321 R327 T334 W352 C354 | M307-F329 HydrophobicContact CB-CD1 4.36Å; M307-F329 HydrophobicContact CG-CD1 3.64Å; M307-F329 HydrophobicContact CG-CE1 3.79Å; A318-F329 CarbonylContact C-O 3.53Å; A318-F329 WeakPolarHBondContact CA-O 3.3Å; I319-F329 HydrophobicContact CG2-CB 4.45Å; I319-F329 PolarHBondContact N-O 2.77Å; I319-F329 PolarHBondContact O-N 2.82Å; C321-F329 HydrophobicContact CB-CD2 4.34Å; C321-F329 HydrophobicContact CB-CE2 3.72Å; R327-F329 HydrophobicContact CB-CD2 4.49Å; R327-F329 HydrophobicContact CB-CE2 3.73Å; R327-F329 HydrophobicContact CB-CZ 4.13Å; R327-F329 WeakPolarHBondContact O-CD2 3.42Å; R327-F329 WeakPolarHBondContact O-CE2 3.31Å; F329-T334 HydrophobicContact CB-CG2 3.48Å; F329-T334 VanDerWaalsContact CB-CG2 3.48Å; F329-T334 HydrophobicContact CD1-CG2 4.41Å; F329-T334 HydrophobicContact CG-CG2 4.17Å; F329-W352 HydrophobicContact CB-CH2 4.12Å; F329-W352 HydrophobicContact CB-CZ3 4.35Å; F329-W352 HydrophobicContact CD1-CH2 4.35Å; F329-W352 AromaticContact CD2-CH2 3.71Å; F329-W352 HydrophobicContact CD2-CH2 3.71Å; F329-W352 AromaticContact CD2-CZ3 3.47Å; F329-W352 HydrophobicContact CD2-CZ3 3.47Å; F329-W352 VanDerWaalsContact CD2-CZ3 3.47Å; F329-W352 HydrophobicContact CE2-CH2 4.19Å; F329-W352 AromaticContact CE2-CZ3 3.95Å; F329-W352 HydrophobicContact CE2-CZ3 3.95Å; F329-W352 AromaticContact CG-CH2 3.82Å; F329-W352 HydrophobicContact CG-CH2 3.82Å; F329-W352 HydrophobicContact CG-CZ3 4.02Å; F329-C354 HydrophobicContact CE1-CB 4.15Å; F329-C354 HydrophobicContact CE2-CB 3.92Å; F329-C354 HydrophobicContact CZ-CB 3.67Å |
| 330 | H | 98.1 | Very high | 95.1 | Very high | 23 Ų | 23 | 63.7 Ų | 63.7 | 11% | 0.106 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -60.3 | 137.4 | 167.5 | -58 | 104.7 | 0 | 0 | 0 | 110 | C305 E311 Q316 D317 D332 C333 T334 | C305-H330 WeakPolarHBondContact CB-ND1 3.39Å; C305-H330 PolarHBondContact SG-ND1 2.78Å; C305-H330 VanDerWaalsContact SG-ND1 3.43Å; E311-H330 PolarHBondContact O-CE1 3.45Å; E311-H330 VanDerWaalsContact O-CE1 3.32Å; E311-H330 PolarHBondContact O-NE2 2.87Å; Q316-H330 PolarHBondContact OE1-CD2 3.17Å; Q316-H330 VanDerWaalsContact OE1-CD2 3.31Å; Q316-H330 PolarHBondContact OE1-NE2 3.23Å; D317-H330 WeakPolarHBondContact O-CA 3.38Å; H330-D332 PolarHBondContact O-N 2.93Å; H330-C333 HydrophobicContact CB-CB 4.1Å; H330-C333 WeakPolarHBondContact O-CA 3.49Å; H330-C333 WeakPolarHBondContact O-CB 3.38Å; H330-C333 PolarHBondContact O-N 3.23Å; H330-T334 PolarHBondContact O-N 2.83Å |
| 331 | R | 96.9 | Very high | 95.1 | Very high | 42 Ų | 42 | 63.8 Ų | 63.8 | 16% | 0.158 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -47.3 | -49.5 | 175.1 | 179.5 | -160.3 | 70.6 | 179.1 | 9.5 | 111.3 | D317 C333 T334 G335 L336 E338 Y341 | D317-R331 HydrophobicContact CB-CB 3.73Å; D317-R331 HydrophobicContact CB-CG 4.44Å; D317-R331 WeakPolarHBondContact O-CB 3.5Å; D317-R331 PolarHBondContact O-N 3.21Å; D317-R331 IonicContact OD2-CZ 3.23Å; D317-R331 IonicContact OD2-NE 3.26Å; D317-R331 IonicContact OD2-NH1 2.63Å; D317-R331 PolarHBondContact OD2-NH1 2.9Å; R331-C333 VanDerWaalsContact C-N 3.25Å; R331-C333 PolarHBondContact O-N 3.26Å; R331-T334 PolarHBondContact O-N 3.31Å; R331-T334 PolarHBondContact O-OG1 3.2Å; R331-G335 PolarHBondContact O-N 2.83Å; R331-G335 VanDerWaalsContact O-N 3.14Å; R331-L336 HydrophobicContact CG-CB 4.07Å; R331-L336 WeakPolarHBondContact CG-O 3.21Å; R331-E338 IonicContact NH1-OE2 3.68Å; R331-Y341 HydrophobicContact CG-CD2 4.43Å; R331-Y341 HydrophobicContact CG-CG 4.18Å |
| 332 | D | 97 | Very high | 95.1 | Very high | 119 Ų | 119 | 65.3 Ų | 65.3 | 64% | 0.636 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -65.5 | -25.6 | -178.5 | -56 | -23.6 | 0 | 0 | 0 | 113.2 | H330 | H330-D332 PolarHBondContact O-N 2.93Å |
| 333 | C | 97.5 | Very high | 95.2 | Very high | 43 Ų | 43 | 66.5 Ų | 66.5 | 29% | 0.291 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -82 | -15.5 | 174 | -72.1 | 0 | 0 | 0 | 0 | 113.6 | M307 C308 H330 R331 | M307-C333 HydrophobicContact CB-CB 4.06Å; C308-C333 VanDerWaalsContact SG-SG 3.68Å; H330-C333 HydrophobicContact CB-CB 4.1Å; H330-C333 WeakPolarHBondContact O-CA 3.49Å; H330-C333 WeakPolarHBondContact O-CB 3.38Å; H330-C333 PolarHBondContact O-N 3.23Å; R331-C333 VanDerWaalsContact C-N 3.25Å; R331-C333 PolarHBondContact O-N 3.26Å |
| 334 | T | 95.9 | Very high | 95.5 | Very high | 38 Ų | 38 | 67.4 Ų | 67.4 | 23% | 0.233 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -95.2 | -16.8 | 174.8 | 65.3 | 0 | 0 | 0 | 0 | 113.2 | I319 F329 H330 R331 L336 W352 | I319-T334 HydrophobicContact CG2-CG2 4.2Å; F329-T334 HydrophobicContact CB-CG2 3.48Å; F329-T334 VanDerWaalsContact CB-CG2 3.48Å; F329-T334 HydrophobicContact CD1-CG2 4.41Å; F329-T334 HydrophobicContact CG-CG2 4.17Å; H330-T334 PolarHBondContact O-N 2.83Å; R331-T334 PolarHBondContact O-N 3.31Å; R331-T334 PolarHBondContact O-OG1 3.2Å; T334-L336 VanDerWaalsContact C-N 3.26Å; T334-L336 PolarHBondContact O-N 2.86Å; T334-L336 WeakPolarHBondContact OG1-CG 3.43Å; T334-L336 PolarHBondContact OG1-N 3.32Å; T334-W352 HydrophobicContact CG2-CH2 3.54Å; T334-W352 HydrophobicContact CG2-CZ2 3.52Å |
| 335 | G | 95.5 | Very high | 95.8 | Very high | 64 Ų | 64 | 68.2 Ų | 68.2 | 66% | 0.66 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.8 | 11.3 | -172.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | R331 T337 | R331-G335 PolarHBondContact O-N 2.83Å; R331-G335 VanDerWaalsContact O-N 3.14Å; G335-T337 PolarHBondContact O-N 2.86Å |
| 336 | L | 95.3 | Very high | 95.8 | Very high | 35 Ų | 35 | 71.9 Ų | 71.9 | 18% | 0.183 | 40% | 0.397 | C | S | . | . | | | trans | -63.6 | 131.5 | 172 | -77.5 | 172.8 | 0 | 0 | 0 | 110.5 | I319 R331 T334 A340 L344 | I319-L336 HydrophobicContact CD1-CD1 3.86Å; I319-L336 HydrophobicContact CG2-CD1 4.02Å; R331-L336 HydrophobicContact CG-CB 4.07Å; R331-L336 WeakPolarHBondContact CG-O 3.21Å; T334-L336 VanDerWaalsContact C-N 3.26Å; T334-L336 PolarHBondContact O-N 2.86Å; T334-L336 WeakPolarHBondContact OG1-CG 3.43Å; T334-L336 PolarHBondContact OG1-N 3.32Å; L336-A340 HydrophobicContact CD2-CB 4.27Å; L336-L344 HydrophobicContact CD1-CD1 4.3Å; L336-L344 HydrophobicContact CD2-CD1 4Å |
| 337 | T | 96.6 | Very high | 95.8 | Very high | 85 Ų | 85 | 71.1 Ų | 71.1 | 52% | 0.521 | 39% | 0.393 | S | S | . | . | | | trans | -71.7 | 150.9 | 169.6 | 63.2 | 0 | 0 | 0 | 0 | 110.1 | G335 A340 Y341 | G335-T337 PolarHBondContact O-N 2.86Å; T337-A340 PolarHBondContact O-N 2.91Å; T337-A340 WeakPolarHBondContact OG1-CB 3.33Å; T337-Y341 PolarHBondContact O-N 3.15Å |
| 338 | E | 95.1 | Very high | 95.5 | Very high | 134 Ų | 134 | 69.5 Ų | 69.5 | 63% | 0.626 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -54.6 | -41.5 | 179.8 | -171.6 | 176 | 149.8 | 0 | 0 | 113.4 | R331 A340 Y341 G342 | R331-E338 IonicContact NH1-OE2 3.68Å; E338-A340 PolarHBondContact O-N 2.89Å; E338-Y341 PolarHBondContact O-N 3.38Å; E338-G342 PolarHBondContact O-N 2.95Å |
| 339 | P | 95.8 | Very high | 95.1 | Very high | 95 Ų | 95 | 69.5 Ų | 69.5 | 62% | 0.617 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.6 | -38.6 | 173.3 | -22.3 | 35.1 | 0 | 0 | 0 | 113.6 | G342 L343 | P339-G342 PolarHBondContact O-N 3.31Å; P339-L343 WeakPolarHBondContact O-CG 3.4Å; P339-L343 PolarHBondContact O-N 2.91Å |
| 340 | A | 94.6 | Very high | 94.7 | Very high | 31 Ų | 31 | 70.8 Ų | 70.8 | 26% | 0.256 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -67.8 | -40 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L336 T337 E338 L343 L344 | L336-A340 HydrophobicContact CD2-CB 4.27Å; T337-A340 PolarHBondContact O-N 2.91Å; T337-A340 WeakPolarHBondContact OG1-CB 3.33Å; E338-A340 PolarHBondContact O-N 2.89Å; A340-L343 PolarHBondContact O-N 2.71Å; A340-L344 WeakPolarHBondContact O-CB 3.15Å; A340-L344 VanDerWaalsContact O-CG 3.31Å; A340-L344 WeakPolarHBondContact O-CG 3.48Å; A340-L344 PolarHBondContact O-N 3.14Å |
| 341 | Y | 96.6 | Very high | 94.4 | Very high | 37 Ų | 37 | 74.3 Ų | 74.3 | 15% | 0.145 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.4 | -45.3 | 173.1 | 176.2 | -110.2 | 0 | 0 | 0 | 111.8 | D317 A318 I319 R331 T337 E338 L343 L344 T345 | D317-Y341 HydrophobicContact CB-CD1 4.32Å; D317-Y341 HydrophobicContact CB-CE1 3.79Å; D317-Y341 VanDerWaalsContact CG-CE1 3.46Å; D317-Y341 WeakPolarHBondContact OD1-CE1 3.34Å; A318-Y341 PolarHBondContact N-OH 3.45Å; A318-Y341 VanDerWaalsContact N-OH 3.14Å; A318-Y341 WeakPolarHBondContact O-CE2 3.46Å; A318-Y341 PolarHBondContact O-OH 3.39Å; I319-Y341 HydrophobicContact CB-CD2 4.46Å; I319-Y341 HydrophobicContact CB-CE2 4.21Å; I319-Y341 HydrophobicContact CD1-CD2 4.44Å; R331-Y341 HydrophobicContact CG-CD2 4.43Å; R331-Y341 HydrophobicContact CG-CG 4.18Å; T337-Y341 PolarHBondContact O-N 3.15Å; E338-Y341 PolarHBondContact O-N 3.38Å; Y341-L343 PolarHBondContact O-N 3.46Å; Y341-L344 PolarHBondContact O-N 3.49Å; Y341-T345 HydrophobicContact CD2-CG2 3.88Å; Y341-T345 HydrophobicContact CE1-CG2 4.44Å; Y341-T345 HydrophobicContact CE2-CG2 3.47Å; Y341-T345 VanDerWaalsContact CE2-CG2 3.47Å; Y341-T345 WeakPolarHBondContact O-CB 3.37Å; Y341-T345 WeakPolarHBondContact O-CG2 3.17Å; Y341-T345 PolarHBondContact O-N 3.3Å; Y341-T345 PolarHBondContact O-OG1 2.72Å |
| 342 | G | 95.5 | Very high | 94.3 | Very high | 31 Ų | 31 | 73.9 Ų | 73.9 | 32% | 0.32 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.7 | -42 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | E338 P339 T345 T346 | E338-G342 PolarHBondContact O-N 2.95Å; P339-G342 PolarHBondContact O-N 3.31Å; G342-T345 PolarHBondContact O-OG1 3.35Å; G342-T346 WeakPolarHBondContact O-CB 3.38Å; G342-T346 WeakPolarHBondContact O-CG2 3.47Å; G342-T346 PolarHBondContact O-N 2.98Å; G342-T346 PolarHBondContact O-OG1 2.93Å |
| 343 | L | 94.6 | Very high | 94.2 | Very high | 123 Ų | 123 | 68.9 Ų | 68.9 | 64% | 0.644 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -66.2 | -46.7 | 175.8 | -69.8 | 171.3 | 0 | 0 | 0 | 112.1 | P339 A340 Y341 T345 T346 E347 | P339-L343 WeakPolarHBondContact O-CG 3.4Å; P339-L343 PolarHBondContact O-N 2.91Å; A340-L343 PolarHBondContact O-N 2.71Å; Y341-L343 PolarHBondContact O-N 3.46Å; L343-T345 PolarHBondContact O-N 2.96Å; L343-T346 PolarHBondContact O-N 3.2Å; L343-T346 PolarHBondContact O-OG1 3.23Å; L343-E347 VanDerWaalsContact O-CB 3.3Å; L343-E347 WeakPolarHBondContact O-CB 3.37Å; L343-E347 PolarHBondContact O-N 3.43Å |
| 344 | L | 93.8 | Very high | 94.1 | Very high | 54 Ų | 54 | 67.1 Ų | 67.1 | 28% | 0.283 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -66.7 | -33.4 | -178.9 | -73.1 | 170.2 | 0 | 0 | 0 | 113.5 | I319 L336 A340 Y341 A350 | I319-L344 HydrophobicContact CD1-CB 4.19Å; I319-L344 HydrophobicContact CD1-CD1 4.19Å; L336-L344 HydrophobicContact CD1-CD1 4.3Å; L336-L344 HydrophobicContact CD2-CD1 4Å; A340-L344 WeakPolarHBondContact O-CB 3.15Å; A340-L344 VanDerWaalsContact O-CG 3.31Å; A340-L344 WeakPolarHBondContact O-CG 3.48Å; A340-L344 PolarHBondContact O-N 3.14Å; Y341-L344 PolarHBondContact O-N 3.49Å; L344-A350 HydrophobicContact CD2-CB 4.04Å |
| 345 | T | 92.9 | Very high | 93.9 | Very high | 76 Ų | 76 | 70 Ų | 70 | 47% | 0.466 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -83.8 | -16.2 | -180 | 51.4 | 0 | 0 | 0 | 0 | 113.8 | Y341 G342 L343 | Y341-T345 HydrophobicContact CD2-CG2 3.88Å; Y341-T345 HydrophobicContact CE1-CG2 4.44Å; Y341-T345 HydrophobicContact CE2-CG2 3.47Å; Y341-T345 VanDerWaalsContact CE2-CG2 3.47Å; Y341-T345 WeakPolarHBondContact O-CB 3.37Å; Y341-T345 WeakPolarHBondContact O-CG2 3.17Å; Y341-T345 PolarHBondContact O-N 3.3Å; Y341-T345 PolarHBondContact O-OG1 2.72Å; G342-T345 PolarHBondContact O-OG1 3.35Å; L343-T345 PolarHBondContact O-N 2.96Å |
| 346 | T | 94.9 | Very high | 93.7 | Very high | 114 Ų | 114 | 73.8 Ų | 73.8 | 70% | 0.699 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -99.2 | -26.7 | 176.5 | 54 | 0 | 0 | 0 | 0 | 113.4 | G342 L343 S348 | G342-T346 WeakPolarHBondContact O-CB 3.38Å; G342-T346 WeakPolarHBondContact O-CG2 3.47Å; G342-T346 PolarHBondContact O-N 2.98Å; G342-T346 PolarHBondContact O-OG1 2.93Å; L343-T346 PolarHBondContact O-N 3.2Å; L343-T346 PolarHBondContact O-OG1 3.23Å; T346-S348 PolarHBondContact O-N 3.25Å |
| 347 | E | 94.4 | Very high | 93.6 | Very high | 101 Ų | 101 | 72.1 Ų | 72.1 | 47% | 0.472 | 43% | 0.425 | S | S | . | . | | | trans | -84.8 | 100.5 | 179.3 | -177.8 | 48 | -92.7 | 0 | 0 | 112.3 | L343 A349 A350 | L343-E347 VanDerWaalsContact O-CB 3.3Å; L343-E347 WeakPolarHBondContact O-CB 3.37Å; L343-E347 PolarHBondContact O-N 3.43Å; E347-A349 HydrophobicContact CG-CB 4.36Å; E347-A349 PolarHBondContact O-N 2.81Å; E347-A349 VanDerWaalsContact O-N 3.11Å; E347-A349 WeakPolarHBondContact OE1-CB 3.37Å; E347-A349 PolarHBondContact OE1-N 2.96Å; E347-A350 HydrophobicContact CB-CB 4.04Å; E347-A350 HydrophobicContact CG-CB 3.89Å; E347-A350 PolarHBondContact O-N 3.49Å |
| 348 | S | 90 | Very high | 93.3 | Very high | 121 Ų | 121 | 72.1 Ų | 72.1 | 85% | 0.846 | 42% | 0.42 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.1 | -17.7 | 178.4 | 65.1 | 0 | 0 | 0 | 0 | 115.6 | T346 | T346-S348 PolarHBondContact O-N 3.25Š|
| 349 | A | 87.7 | Confident | 93 | Very high | 87 Ų | 87 | 73.2 Ų | 73.2 | 72% | 0.719 | 42% | 0.423 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -14.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | E347 | E347-A349 HydrophobicContact CG-CB 4.36Å; E347-A349 PolarHBondContact O-N 2.81Å; E347-A349 VanDerWaalsContact O-N 3.11Å; E347-A349 WeakPolarHBondContact OE1-CB 3.37Å; E347-A349 PolarHBondContact OE1-N 2.96Å |
| 350 | A | 89.8 | Confident | 92.6 | Very high | 33 Ų | 33 | 72.4 Ų | 72.4 | 27% | 0.273 | 42% | 0.416 | S | S | . | . | | | trans | -89.5 | 147.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | L344 E347 | L344-A350 HydrophobicContact CD2-CB 4.04Å; E347-A350 HydrophobicContact CB-CB 4.04Å; E347-A350 HydrophobicContact CG-CB 3.89Å; E347-A350 PolarHBondContact O-N 3.49Å |
| 351 | V | 91.8 | Very high | 91.9 | Very high | 97 Ų | 97 | 76.1 Ų | 76.1 | 59% | 0.588 | 43% | 0.427 | S | S | * | . | | | trans | -133.5 | 143.4 | 171 | -65.3 | 0 | 0 | 0 | 0 | 108.5 | | |
| 352 | W | 94.8 | Very high | 91 | Very high | 33 Ų | 33 | 81.4 Ų | 81.4 | 13% | 0.125 | 46% | 0.458 | C | S | . | . | | | trans | -99.3 | 144.4 | 176.8 | -178 | 81.8 | 0 | 0 | 0 | 112.1 | I319 C321 E322 F329 T334 C354 | I319-W352 HydrophobicContact CB-CE3 4.39Å; I319-W352 HydrophobicContact CD1-CB 3.48Å; I319-W352 VanDerWaalsContact CD1-CB 3.48Å; I319-W352 HydrophobicContact CD1-CD2 4.06Å; I319-W352 HydrophobicContact CD1-CG 3.58Å; I319-W352 HydrophobicContact CG1-CB 3.87Å; I319-W352 HydrophobicContact CG1-CD2 4.08Å; I319-W352 HydrophobicContact CG1-CE3 4.04Å; I319-W352 HydrophobicContact CG1-CG 4.03Å; I319-W352 HydrophobicContact CG2-CD2 3.85Å; I319-W352 HydrophobicContact CG2-CE3 3.66Å; I319-W352 HydrophobicContact CG2-CH2 4.07Å; I319-W352 HydrophobicContact CG2-CZ2 4.26Å; I319-W352 HydrophobicContact CG2-CZ3 3.78Å; C321-W352 HydrophobicContact CB-CE3 4.11Å; C321-W352 HydrophobicContact CB-CZ3 3.78Å; E322-W352 PolarHBondContact N-O 2.93Å; F329-W352 HydrophobicContact CB-CH2 4.12Å; F329-W352 HydrophobicContact CB-CZ3 4.35Å; F329-W352 HydrophobicContact CD1-CH2 4.35Å; F329-W352 AromaticContact CD2-CH2 3.71Å; F329-W352 HydrophobicContact CD2-CH2 3.71Å; F329-W352 AromaticContact CD2-CZ3 3.47Å; F329-W352 HydrophobicContact CD2-CZ3 3.47Å; F329-W352 VanDerWaalsContact CD2-CZ3 3.47Å; F329-W352 HydrophobicContact CE2-CH2 4.19Å; F329-W352 AromaticContact CE2-CZ3 3.95Å; F329-W352 HydrophobicContact CE2-CZ3 3.95Å; F329-W352 AromaticContact CG-CH2 3.82Å; F329-W352 HydrophobicContact CG-CH2 3.82Å; F329-W352 HydrophobicContact CG-CZ3 4.02Å; T334-W352 HydrophobicContact CG2-CH2 3.54Å; T334-W352 HydrophobicContact CG2-CZ2 3.52Å; W352-C354 HydrophobicContact CH2-CB 3.43Å; W352-C354 VanDerWaalsContact CH2-CB 3.43Å; W352-C354 HydrophobicContact CZ2-CB 4.07Å; W352-C354 HydrophobicContact CZ3-CB 3.85Å |
| 353 | A | 94.8 | Very high | 90.3 | Very high | 14 Ų | 14 | 82.3 Ų | 82.3 | 12% | 0.116 | 46% | 0.455 | C | S | . | . | | | trans | -128.6 | 130.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | A323 I358 I363 | A323-A353 HydrophobicContact CB-CB 3.55Å; A353-I358 HydrophobicContact CB-CD1 4.03Å; A353-I358 HydrophobicContact CB-CG1 3.68Å; A353-I358 WeakPolarHBondContact O-CD1 3.47Å; A353-I363 HydrophobicContact CB-CD1 4.04Å; A353-I363 HydrophobicContact CB-CG2 4.48Å |
| 354 | C | 95.2 | Very high | 89.6 | Confident | 7 Ų | 7 | 82.9 Ų | 82.9 | 5% | 0.047 | 45% | 0.454 | C | S | . | . | | | trans | -73.8 | 150.5 | 174.9 | 73.3 | 0 | 0 | 0 | 0 | 111.6 | C321 C325 F329 W352 F356 C357 I358 | C321-C354 HydrophobicContact CB-CB 4.17Å; C321-C354 PolarHBondContact SG-N 3.49Å; C325-C354 VanDerWaalsContact SG-SG 3.62Å; F329-C354 HydrophobicContact CE1-CB 4.15Å; F329-C354 HydrophobicContact CE2-CB 3.92Å; F329-C354 HydrophobicContact CZ-CB 3.67Å; W352-C354 HydrophobicContact CH2-CB 3.43Å; W352-C354 VanDerWaalsContact CH2-CB 3.43Å; W352-C354 HydrophobicContact CZ2-CB 4.07Å; W352-C354 HydrophobicContact CZ3-CB 3.85Å; C354-F356 PolarHBondContact O-N 3.03Å; C354-C357 WeakPolarHBondContact O-CA 3.23Å; C354-C357 PolarHBondContact O-N 2.99Å; C354-I358 PolarHBondContact O-N 3.06Å |
| 355 | D | 92.1 | Very high | 88.8 | Confident | 97 Ų | 97 | 85.6 Ų | 85.6 | 52% | 0.519 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -38.6 | -47.6 | 175.9 | -91.4 | 39.9 | 0 | 0 | 0 | 114.9 | C357 I358 K359 | D355-C357 VanDerWaalsContact C-N 3.34Å; D355-C357 PolarHBondContact O-N 3.48Å; D355-I358 PolarHBondContact O-N 2.95Å; D355-K359 VanDerWaalsContact O-CB 3.31Å; D355-K359 WeakPolarHBondContact O-CB 3.37Å; D355-K359 WeakPolarHBondContact O-CD 3.31Å; D355-K359 VanDerWaalsContact O-CG 3.23Å; D355-K359 WeakPolarHBondContact O-CG 3.23Å; D355-K359 PolarHBondContact O-N 3.44Å; D355-K359 IonicContact OD2-NZ 2.83Å; D355-K359 PolarHBondContact OD2-NZ 2.87Å |
| 356 | F | 92.3 | Very high | 88 | Confident | 144 Ų | 144 | 87.2 Ų | 87.2 | 63% | 0.632 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -63.9 | -41.2 | -178.2 | -178.1 | -95.2 | 0 | 0 | 0 | 111.5 | C354 T360 | C354-F356 PolarHBondContact O-N 3.03Å; F356-T360 HydrophobicContact CD2-CG2 4.36Å; F356-T360 HydrophobicContact CE1-CG2 4.26Å; F356-T360 HydrophobicContact CE2-CG2 4Å; F356-T360 HydrophobicContact CZ-CG2 3.95Å; F356-T360 WeakPolarHBondContact O-CB 3.49Å; F356-T360 WeakPolarHBondContact O-CG2 3.33Å; F356-T360 PolarHBondContact O-N 2.62Å; F356-T360 VanDerWaalsContact O-N 3.13Å; F356-T360 PolarHBondContact O-OG1 3.32Å |
| 357 | C | 93.3 | Very high | 86.6 | Confident | 1 Ų | 1 | 90.7 Ų | 90.7 | 1% | 0.007 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -71.5 | -41.5 | 178 | -72.2 | 0 | 0 | 0 | 0 | 111.7 | C325 C354 D355 K359 T360 K361 I363 | C325-C357 VanDerWaalsContact CB-SG 3.52Å; C325-C357 VanDerWaalsContact SG-SG 3.69Å; C354-C357 WeakPolarHBondContact O-CA 3.23Å; C354-C357 PolarHBondContact O-N 2.99Å; D355-C357 VanDerWaalsContact C-N 3.34Å; D355-C357 PolarHBondContact O-N 3.48Å; C357-K359 PolarHBondContact O-N 3.13Å; C357-T360 PolarHBondContact O-N 2.96Å; C357-K361 WeakPolarHBondContact O-CB 3.36Å; C357-K361 PolarHBondContact O-N 3.45Å; C357-I363 VanDerWaalsContact C-CD1 3.48Å; C357-I363 HydrophobicContact CB-CD1 3.71Å; C357-I363 WeakPolarHBondContact O-CD1 3.34Å |
| 358 | I | 90 | Very high | 85.1 | Confident | 84 Ų | 84 | 91 Ų | 91 | 43% | 0.431 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -57.1 | -50.8 | 175 | -65.2 | 175.3 | 0 | 0 | 0 | 110 | A353 C354 D355 T360 I363 | A353-I358 HydrophobicContact CB-CD1 4.03Å; A353-I358 HydrophobicContact CB-CG1 3.68Å; A353-I358 WeakPolarHBondContact O-CD1 3.47Å; C354-I358 PolarHBondContact O-N 3.06Å; D355-I358 PolarHBondContact O-N 2.95Å; I358-T360 VanDerWaalsContact C-N 3.32Å; I358-T360 PolarHBondContact O-N 3.34Å; I358-I363 HydrophobicContact CG1-CD1 4.49Å |
| 359 | K | 88.3 | Confident | 83.5 | Confident | 158 Ų | 158 | 95.9 Ų | 95.9 | 69% | 0.687 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -67.2 | -24.6 | -177.7 | -70.7 | 163.5 | -179.1 | 158 | 0 | 114.5 | D355 C357 | D355-K359 VanDerWaalsContact O-CB 3.31Å; D355-K359 WeakPolarHBondContact O-CB 3.37Å; D355-K359 WeakPolarHBondContact O-CD 3.31Å; D355-K359 VanDerWaalsContact O-CG 3.23Å; D355-K359 WeakPolarHBondContact O-CG 3.23Å; D355-K359 PolarHBondContact O-N 3.44Å; D355-K359 IonicContact OD2-NZ 2.83Å; D355-K359 PolarHBondContact OD2-NZ 2.87Å; C357-K359 PolarHBondContact O-N 3.13Å |
| 360 | T | 87.6 | Confident | 81.6 | Confident | 77 Ų | 77 | 96.4 Ų | 96.4 | 47% | 0.472 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -110 | -13.4 | -173.2 | 58 | 0 | 0 | 0 | 0 | 115.2 | F356 C357 I358 | F356-T360 HydrophobicContact CD2-CG2 4.36Å; F356-T360 HydrophobicContact CE1-CG2 4.26Å; F356-T360 HydrophobicContact CE2-CG2 4Å; F356-T360 HydrophobicContact CZ-CG2 3.95Å; F356-T360 WeakPolarHBondContact O-CB 3.49Å; F356-T360 WeakPolarHBondContact O-CG2 3.33Å; F356-T360 PolarHBondContact O-N 2.62Å; F356-T360 VanDerWaalsContact O-N 3.13Å; F356-T360 PolarHBondContact O-OG1 3.32Å; C357-T360 PolarHBondContact O-N 2.96Å; I358-T360 VanDerWaalsContact C-N 3.32Å; I358-T360 PolarHBondContact O-N 3.34Å |
| 361 | K | 80.3 | Confident | 79.6 | Confident | 109 Ų | 109 | 98 Ų | 98 | 47% | 0.474 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -128.8 | 11.3 | -170.7 | -59 | -173.2 | 175.1 | -176.6 | 0 | 114.9 | T324 C357 I363 | T324-K361 HydrophobicContact CG2-CD 3.76Å; T324-K361 VanDerWaalsContact CG2-NZ 3.26Å; T324-K361 WeakPolarHBondContact OG1-CD 3.46Å; C357-K361 WeakPolarHBondContact O-CB 3.36Å; C357-K361 PolarHBondContact O-N 3.45Å; K361-I363 HydrophobicContact CB-CD1 4.45Å; K361-I363 HydrophobicContact CB-CG1 4.1Å; K361-I363 PolarHBondContact O-N 2.93Å |
| 362 | D | 76.4 | Confident | 77.6 | Confident | 148 Ų | 148 | 102 Ų | 102 | 79% | 0.791 | 53% | 0.528 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.7 | 56.4 | 176.5 | -162.7 | 14 | 0 | 0 | 0 | 112.1 | Q364 | D362-Q364 PolarHBondContact O-N 3.03Š|
| 363 | I | 81.8 | Confident | 75.6 | Confident | 50 Ų | 50 | 103.2 Ų | 103.2 | 26% | 0.256 | 55% | 0.55 | S | S | . | * | | | trans | -79.2 | 112.9 | -173.5 | -57.1 | -178.8 | 0 | 0 | 0 | 108.7 | A323 A353 C357 I358 K361 A365 | A323-I363 HydrophobicContact CB-CD1 3.92Å; A323-I363 HydrophobicContact CB-CG2 4.37Å; A353-I363 HydrophobicContact CB-CD1 4.04Å; A353-I363 HydrophobicContact CB-CG2 4.48Å; C357-I363 VanDerWaalsContact C-CD1 3.48Å; C357-I363 HydrophobicContact CB-CD1 3.71Å; C357-I363 WeakPolarHBondContact O-CD1 3.34Å; I358-I363 HydrophobicContact CG1-CD1 4.49Å; K361-I363 HydrophobicContact CB-CD1 4.45Å; K361-I363 HydrophobicContact CB-CG1 4.1Å; K361-I363 PolarHBondContact O-N 2.93Å; I363-A365 PolarHBondContact O-N 2.83Å |
| 364 | Q | 78.9 | Confident | 73.3 | Confident | 136 Ų | 136 | 110.8 Ų | 110.8 | 64% | 0.636 | 58% | 0.584 | S | S | * | * | | | trans | -64.6 | 129.7 | 175.1 | -64 | -178.7 | -0.9 | 0 | 0 | 110.7 | D362 V366 | D362-Q364 PolarHBondContact O-N 3.03Å; Q364-V366 PolarHBondContact O-N 3.1Å |
| 365 | A | 76.9 | Confident | 71.2 | Confident | 111 Ų | 111 | 116.2 Ų | 116.2 | 92% | 0.917 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -66.7 | -18.3 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | I363 | I363-A365 PolarHBondContact O-N 2.83Š|
| 366 | V | 76.3 | Confident | 69.1 | Low | 110 Ų | 110 | 117.9 Ų | 117.9 | 67% | 0.667 | 63% | 0.625 | S | S | * | * | | | trans | -134.2 | 124.8 | 176.8 | -178.9 | 0 | 0 | 0 | 0 | 109 | Q364 V368 | Q364-V366 PolarHBondContact O-N 3.1Å; V366-V368 HydrophobicContact CG1-CG2 4.2Å |
| 367 | Y | 66.1 | Low | 67 | Low | 186 Ų | 186 | 114.9 Ų | 114.9 | 73% | 0.729 | 63% | 0.626 | S | S | * | * | | | trans | -115.7 | 100.4 | 172.7 | -174.5 | -95.9 | 0 | 0 | 0 | 110.6 | R369 | Y367-R369 HydrophobicContact CD1-CG 4.27Å; Y367-R369 HydrophobicContact CE1-CG 4.09Å; Y367-R369 PolarHBondContact O-N 3.02Å |
| 368 | V | 63.4 | Low | 64.9 | Low | 107 Ų | 107 | 119.2 Ų | 119.2 | 65% | 0.648 | 66% | 0.663 | S | S | * | * | | | trans | -76.7 | 111.9 | 172.9 | -176.4 | 0 | 0 | 0 | 0 | 108.6 | V366 Q370 | V366-V368 HydrophobicContact CG1-CG2 4.2Å; V368-Q370 PolarHBondContact O-N 2.84Å |
| 369 | R | 55.3 | Low | 63 | Low | 224 Ų | 224 | 122.7 Ų | 122.7 | 85% | 0.845 | 68% | 0.682 | S | S | * | * | | | trans | -59.5 | 106.8 | 171.9 | -78.8 | -178.7 | 172.3 | -113.7 | 1.4 | 109.3 | Y367 G371 | Y367-R369 HydrophobicContact CD1-CG 4.27Å; Y367-R369 HydrophobicContact CE1-CG 4.09Å; Y367-R369 PolarHBondContact O-N 3.02Å; R369-G371 VanDerWaalsContact C-N 3.34Å; R369-G371 PolarHBondContact O-N 3.28Å |
| 370 | Q | 48.7 | Very low | 60.8 | Low | 99 Ų | 99 | 123.1 Ų | 123.1 | 46% | 0.463 | 69% | 0.686 | S | S | . | * | | | trans | -76.9 | 80.6 | -170.6 | -160.2 | -169.7 | 12.9 | 0 | 0 | 113 | V368 L375 | V368-Q370 PolarHBondContact O-N 2.84Å; Q370-L375 HydrophobicContact CB-CD2 4.18Å; Q370-L375 VanDerWaalsContact CD-CD2 3.41Å; Q370-L375 VanDerWaalsContact CD-CG 3.47Å; Q370-L375 HydrophobicContact CG-CD2 3.82Å; Q370-L375 HydrophobicContact CG-CG 4.41Å |
| 371 | G | 48.4 | Very low | 58.5 | Low | 65 Ų | 65 | 128.8 Ų | 128.8 | 67% | 0.67 | 73% | 0.729 | S | S | * | * | | | trans | -96.9 | 116.2 | 156.3 | 0 | 0 | 0 | 0 | 0 | 109.6 | R369 | R369-G371 VanDerWaalsContact C-N 3.34Å; R369-G371 PolarHBondContact O-N 3.28Å |
| 372 | L | 48.9 | Very low | 57.4 | Low | 182 Ų | 182 | 129.8 Ų | 129.8 | 95% | 0.953 | 74% | 0.742 | S | S | * | * | S | Bend | trans | 78.6 | 73.8 | 177.4 | -52.6 | 168.4 | 0 | 0 | 0 | 117.3 | | |
| 373 | G | 52.1 | Low | 56.4 | Low | 58 Ų | 58 | 128.8 Ų | 128.8 | 60% | 0.598 | 74% | 0.74 | S | S | * | * | S | Bend | trans | 92.8 | 126.4 | 141.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | | |
| 374 | Q | 46.6 | Very low | 55 | Low | 174 Ų | 174 | 133.2 Ų | 133.2 | 81% | 0.813 | 77% | 0.766 | S | S | * | * | | | trans | 57.1 | 103.2 | 166.1 | -125.3 | 68.5 | 9.3 | 0 | 0 | 118.2 | | |
| 375 | L | 50.8 | Low | 53.6 | Low | 121 Ų | 121 | 133.1 Ų | 133.1 | 63% | 0.634 | 77% | 0.774 | S | S | * | * | | | trans | -86.5 | 137.6 | 159.5 | -57.4 | 179.9 | 0 | 0 | 0 | 109.3 | Q370 | Q370-L375 HydrophobicContact CB-CD2 4.18Å; Q370-L375 VanDerWaalsContact CD-CD2 3.41Å; Q370-L375 VanDerWaalsContact CD-CG 3.47Å; Q370-L375 HydrophobicContact CG-CD2 3.82Å; Q370-L375 HydrophobicContact CG-CG 4.41Å |
| 376 | V | 48.7 | Very low | 52.1 | Low | 132 Ų | 132 | 134.4 Ų | 134.4 | 80% | 0.8 | 77% | 0.765 | S | S | * | * | | | trans | -129.4 | 127.1 | 147.8 | 179.6 | 0 | 0 | 0 | 0 | 105.6 | A378 | V376-A378 PolarHBondContact O-N 3.11Š|
| 377 | A | 48.6 | Very low | 50.5 | Low | 80 Ų | 80 | 136.1 Ų | 136.1 | 66% | 0.661 | 77% | 0.772 | S | S | * | * | | | trans | -69.1 | 114.3 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.1 | N379 | A377-N379 PolarHBondContact O-N 2.94Š|
| 378 | A | 49.5 | Very low | 49.4 | Very low | 93 Ų | 93 | 132.5 Ų | 132.5 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | | | trans | -75.4 | 74.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 108.9 | V376 | V376-A378 PolarHBondContact O-N 3.11Š|
| 379 | N | 50.4 | Low | 48.4 | Very low | 156 Ų | 156 | 134.5 Ų | 134.5 | 83% | 0.834 | 78% | 0.784 | S | S | * | * | | | trans | -115.4 | 92.9 | 161.4 | -170.3 | 31.7 | 0 | 0 | 0 | 106.6 | A377 | A377-N379 PolarHBondContact O-N 2.94Š|
| 380 | E | 41.7 | Very low | 47.8 | Very low | 167 Ų | 167 | 127 Ų | 127 | 78% | 0.78 | 78% | 0.779 | S | S | * | * | | | trans | -104.6 | 112.5 | -173.6 | 52.9 | -169.2 | 89.6 | 0 | 0 | 112.3 | | |
| 381 | S | 38.9 | Very low | 47.7 | Very low | 197 Ų | 197 | 129.5 Ų | 129.5 | 100% | 1.378 | 81% | 0.808 | S | S | * | * | | | trans | 73.1 | 0 | 160.7 | -47.8 | 0 | 0 | 0 | 0 | 118.8 | | |