| 1 | M | 42.3 | Very low | 47.7 | Very low | 248 Ų | 248 | 155.7 Ų | 155.7 | 100% | 1.222 | 84% | 0.838 | S | S | * | * | | | | 0 | 99.2 | 0 | -157 | 153.8 | 88.8 | 0 | 0 | 106.4 | | |
| 2 | L | 43.7 | Very low | 47.9 | Very low | 155 Ų | 155 | 155.6 Ų | 155.6 | 81% | 0.812 | 83% | 0.828 | S | S | * | * | | | trans | -100.4 | 121.6 | -175.4 | -81 | 162.9 | 0 | 0 | 0 | 108.9 | F4 | L2-F4 HydrophobicContact CB-CE2 4.2Š|
| 3 | L | 44.5 | Very low | 48 | Very low | 170 Ų | 170 | 153.1 Ų | 153.1 | 89% | 0.89 | 83% | 0.826 | S | S | * | * | | | trans | -86.2 | 119.7 | 177.9 | -178.8 | 67.7 | 0 | 0 | 0 | 108.7 | | |
| 4 | F | 46.5 | Very low | 47.5 | Very low | 173 Ų | 173 | 155.1 Ų | 155.1 | 76% | 0.759 | 83% | 0.831 | S | S | * | * | | | trans | -111.3 | 138 | 168.3 | -71.9 | -76.9 | 0 | 0 | 0 | 109.8 | L2 | L2-F4 HydrophobicContact CB-CE2 4.2Š|
| 5 | P | 50.2 | Low | 47.1 | Very low | 116 Ų | 116 | 152.1 Ų | 152.1 | 75% | 0.753 | 83% | 0.827 | S | S | * | * | | | trans | -78.9 | 142.7 | -173 | 31.9 | -33.6 | 0 | 0 | 0 | 112.1 | V7 | P5-V7 PolarHBondContact O-N 3.3Š|
| 6 | Q | 46.7 | Very low | 46.7 | Very low | 196 Ų | 196 | 149.4 Ų | 149.4 | 92% | 0.916 | 82% | 0.823 | S | S | * | * | | | trans | -72.2 | 113 | -179.8 | -170.5 | 136.5 | -48.8 | 0 | 0 | 110.9 | A8 | Q6-A8 PolarHBondContact O-N 2.74Š|
| 7 | V | 51.1 | Low | 46.5 | Very low | 125 Ų | 125 | 146.9 Ų | 146.9 | 76% | 0.758 | 82% | 0.818 | S | S | * | * | | | trans | -68.4 | 123.5 | 168.5 | 170.1 | 0 | 0 | 0 | 0 | 108.6 | P5 V9 | P5-V7 PolarHBondContact O-N 3.3Å; V7-V9 PolarHBondContact O-N 3.24Å |
| 8 | A | 53.8 | Low | 46.5 | Very low | 97 Ų | 97 | 149.5 Ų | 149.5 | 80% | 0.802 | 82% | 0.823 | S | S | * | * | | | trans | -68.3 | 113.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q6 | Q6-A8 PolarHBondContact O-N 2.74Š|
| 9 | V | 44.9 | Very low | 46.5 | Very low | 120 Ų | 120 | 149.7 Ų | 149.7 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | | | trans | -86.4 | 119.8 | 168.3 | 177.7 | 0 | 0 | 0 | 0 | 107.6 | V7 T11 | V7-V9 PolarHBondContact O-N 3.24Å; V9-T11 PolarHBondContact O-N 3.13Å |
| 10 | K | 45.9 | Very low | 46.4 | Very low | 188 Ų | 188 | 146.9 Ų | 146.9 | 82% | 0.817 | 82% | 0.819 | S | S | * | * | | | trans | -69.8 | 96.2 | 175.4 | -178.5 | -174.8 | 170.8 | -169.1 | 0 | 109 | | |
| 11 | T | 55.2 | Low | 46.5 | Very low | 125 Ų | 125 | 145.3 Ų | 145.3 | 77% | 0.767 | 82% | 0.818 | S | S | * | * | | | trans | -86.1 | 107.7 | 173.1 | -43.9 | 0 | 0 | 0 | 0 | 108.7 | V9 | V9-T11 PolarHBondContact O-N 3.13Š|
| 12 | E | 50.1 | Low | 46.6 | Very low | 154 Ų | 154 | 140 Ų | 140 | 72% | 0.72 | 80% | 0.8 | S | S | * | * | | | trans | -67.8 | 140.7 | 164.9 | -88 | -176.9 | 131 | 0 | 0 | 109.9 | M14 | E12-M14 PolarHBondContact O-N 3.19Š|
| 13 | P | 49.2 | Very low | 46.5 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | | | trans | -71.9 | 118.4 | 179 | 28.4 | -32.3 | 0 | 0 | 0 | 110.4 | S15 | P13-S15 PolarHBondContact O-N 3.02Š|
| 14 | M | 40.5 | Very low | 46.8 | Very low | 181 Ų | 181 | 134.2 Ų | 134.2 | 89% | 0.892 | 80% | 0.799 | S | S | * | * | | | trans | -64.7 | 114.2 | 162.8 | -78.5 | -177.9 | -73 | 0 | 0 | 108.5 | E12 S16 | E12-M14 PolarHBondContact O-N 3.19Å; M14-S16 PolarHBondContact O-N 3.25Å |
| 15 | S | 41.2 | Very low | 46.7 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 78% | 0.776 | 80% | 0.804 | S | S | * | * | | | trans | -69.2 | 94.7 | 175.1 | 179.3 | 0 | 0 | 0 | 0 | 110.3 | P13 | P13-S15 PolarHBondContact O-N 3.02Š|
| 16 | S | 40.8 | Very low | 46.4 | Very low | 109 Ų | 109 | 132 Ų | 132 | 76% | 0.762 | 81% | 0.807 | S | S | * | * | | | trans | -86.7 | 102.8 | 167.5 | 52.1 | 0 | 0 | 0 | 0 | 109.5 | M14 E18 | M14-S16 PolarHBondContact O-N 3.25Å; S16-E18 PolarHBondContact O-N 3.1Å |
| 17 | S | 44.5 | Very low | 46.5 | Very low | 106 Ų | 106 | 127.9 Ų | 127.9 | 74% | 0.741 | 80% | 0.8 | S | S | * | * | | | trans | -75.7 | 104.8 | 173.6 | -60 | 0 | 0 | 0 | 0 | 110.4 | | |
| 18 | E | 45.3 | Very low | 46.8 | Very low | 194 Ų | 194 | 129.9 Ų | 129.9 | 91% | 0.907 | 81% | 0.806 | S | S | * | * | | | trans | -83.4 | 122.9 | 161.8 | -116 | 175.3 | 112.3 | 0 | 0 | 108.9 | S16 | S16-E18 PolarHBondContact O-N 3.1Š|
| 19 | I | 47.7 | Very low | 46.3 | Very low | 153 Ų | 153 | 132 Ų | 132 | 79% | 0.785 | 80% | 0.803 | S | S | * | * | | | trans | -94.7 | 102 | 174.2 | -57.1 | 171.4 | 0 | 0 | 0 | 107.4 | S21 | I19-S21 PolarHBondContact O-N 3Š|
| 20 | A | 43.4 | Very low | 46.8 | Very low | 93 Ų | 93 | 131.7 Ų | 131.7 | 77% | 0.769 | 81% | 0.806 | S | S | * | * | | | trans | -81 | 109.6 | 167.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | | |
| 21 | S | 48.2 | Very low | 46.5 | Very low | 115 Ų | 115 | 132.2 Ų | 132.2 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | | | trans | -80.2 | 111.8 | 168.9 | -58 | 0 | 0 | 0 | 0 | 109.4 | I19 | I19-S21 PolarHBondContact O-N 3Š|
| 22 | T | 44.5 | Very low | 46.5 | Very low | 137 Ų | 137 | 132.6 Ų | 132.6 | 84% | 0.84 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 122.1 | 168.5 | -54.6 | 0 | 0 | 0 | 0 | 109.5 | | |
| 23 | A | 43.1 | Very low | 46.5 | Very low | 95 Ų | 95 | 128 Ų | 128 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 147.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | | |
| 24 | A | 50.6 | Low | 46.6 | Very low | 108 Ų | 108 | 128.5 Ų | 128.5 | 89% | 0.893 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -85.6 | 128.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 25 | D | 44.4 | Very low | 47.1 | Very low | 162 Ų | 162 | 124.2 Ų | 124.2 | 87% | 0.866 | 81% | 0.81 | S | S | * | * | | | trans | -140.9 | 131.3 | 153.3 | 77.2 | -26 | 0 | 0 | 0 | 109.6 | | |
| 26 | G | 42.5 | Very low | 47.3 | Very low | 79 Ų | 79 | 127.4 Ų | 127.4 | 81% | 0.814 | 82% | 0.818 | S | S | * | * | | | trans | 159 | 106.5 | -178.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | | |
| 27 | S | 49.3 | Very low | 47.5 | Very low | 111 Ų | 111 | 125.4 Ų | 125.4 | 78% | 0.776 | 82% | 0.815 | S | S | * | * | | | trans | -56 | 142.8 | -175.9 | -172.1 | 0 | 0 | 0 | 0 | 114.7 | D29 | S27-D29 PolarHBondContact O-N 3.17Š|
| 28 | L | 57.3 | Low | 47.7 | Very low | 167 Ų | 167 | 126 Ų | 126 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | | | trans | -58.6 | 118.6 | 168 | -76.6 | 156.5 | 0 | 0 | 0 | 110.7 | | |
| 29 | D | 43.5 | Very low | 48 | Very low | 141 Ų | 141 | 122.6 Ų | 122.6 | 75% | 0.754 | 82% | 0.816 | S | S | * | * | | | trans | -161.4 | 106.4 | 151 | -77.4 | -52.2 | 0 | 0 | 0 | 110.6 | S27 F31 | S27-D29 PolarHBondContact O-N 3.17Å; D29-F31 PolarHBondContact O-N 3.24Å |
| 30 | S | 54.9 | Low | 48.4 | Very low | 113 Ų | 113 | 120.5 Ų | 120.5 | 79% | 0.79 | 82% | 0.815 | S | S | * | * | | | trans | 14.4 | 97.2 | 156 | -57.8 | 0 | 0 | 0 | 0 | 119.4 | | |
| 31 | F | 40.7 | Very low | 48.9 | Very low | 200 Ų | 200 | 124.7 Ų | 124.7 | 88% | 0.877 | 82% | 0.816 | S | S | * | * | | | trans | -128.6 | 95.5 | 142.9 | -76.4 | -79.2 | 0 | 0 | 0 | 110.1 | D29 G33 | D29-F31 PolarHBondContact O-N 3.24Å; F31-G33 PolarHBondContact O-N 3.39Å; F31-G33 VanDerWaalsContact O-N 3.1Å |
| 32 | S | 55.8 | Low | 49.2 | Very low | 133 Ų | 133 | 124.2 Ų | 124.2 | 93% | 0.93 | 81% | 0.813 | S | S | * | * | | | trans | -57.6 | 101.8 | 153 | -67 | 0 | 0 | 0 | 0 | 108.5 | | |
| 33 | G | 48.6 | Very low | 49.5 | Very low | 58 Ų | 58 | 123 Ų | 123 | 60% | 0.598 | 81% | 0.808 | S | S | * | * | | | trans | 170.3 | 84.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | F31 A35 | F31-G33 PolarHBondContact O-N 3.39Å; F31-G33 VanDerWaalsContact O-N 3.1Å; G33-A35 PolarHBondContact O-N 2.97Å |
| 34 | S | 51.9 | Low | 50.1 | Low | 133 Ų | 133 | 126.2 Ų | 126.2 | 93% | 0.93 | 80% | 0.799 | S | S | * | * | | | trans | 36.4 | 80.3 | 142.4 | -49.3 | 0 | 0 | 0 | 0 | 118.1 | | |
| 35 | A | 50.5 | Low | 50.4 | Low | 90 Ų | 90 | 125.3 Ų | 125.3 | 74% | 0.744 | 78% | 0.784 | S | S | * | * | | | trans | -167.7 | 77.8 | 154.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | G33 | G33-A35 PolarHBondContact O-N 2.97Š|
| 36 | L | 46.1 | Very low | 50.9 | Low | 179 Ų | 179 | 121.9 Ų | 121.9 | 94% | 0.937 | 78% | 0.779 | S | S | * | * | | | trans | -138.5 | 116.3 | 162.7 | -70.1 | 176.7 | 0 | 0 | 0 | 109.1 | | |
| 37 | G | 45.4 | Very low | 51.6 | Low | 67 Ų | 67 | 123.7 Ų | 123.7 | 69% | 0.691 | 77% | 0.766 | S | S | * | * | S | Bend | trans | 55.9 | 105.2 | 142.6 | 0 | 0 | 0 | 0 | 0 | 118.2 | S39 | G37-S39 PolarHBondContact O-N 3.15Š|
| 38 | S | 48.2 | Very low | 51.9 | Low | 117 Ų | 117 | 123.4 Ų | 123.4 | 82% | 0.818 | 76% | 0.761 | S | S | * | * | | | trans | 43.3 | 76 | 141.2 | 60.3 | 0 | 0 | 0 | 0 | 116.2 | S40 | S38-S40 PolarHBondContact O-N 2.88Š|
| 39 | S | 50.7 | Low | 51.8 | Low | 124 Ų | 124 | 124.5 Ų | 124.5 | 87% | 0.867 | 76% | 0.759 | S | S | * | * | | | trans | -73.6 | 97.1 | 158.8 | 58.5 | 0 | 0 | 0 | 0 | 109.9 | G37 | G37-S39 PolarHBondContact O-N 3.15Š|
| 40 | S | 56.6 | Low | 52.5 | Low | 109 Ų | 109 | 122.1 Ų | 122.1 | 76% | 0.762 | 75% | 0.754 | S | S | * | * | | | trans | -165.3 | 36.3 | 152.1 | 54.7 | 0 | 0 | 0 | 0 | 114.5 | S38 | S38-S40 PolarHBondContact O-N 2.88Š|
| 41 | F | 53.8 | Low | 53.1 | Low | 180 Ų | 180 | 121.7 Ų | 121.7 | 79% | 0.789 | 75% | 0.749 | S | S | * | * | | | trans | -158 | 97.7 | 152 | -148.6 | -108.5 | 0 | 0 | 0 | 110 | | |
| 42 | S | 55.2 | Low | 54 | Low | 105 Ų | 105 | 117.1 Ų | 117.1 | 73% | 0.734 | 74% | 0.739 | S | S | * | * | | | trans | -55.8 | 130 | 154.6 | -59.8 | 0 | 0 | 0 | 0 | 106.6 | R44 | S42-R44 PolarHBondContact O-N 3.34Š|
| 43 | P | 51.1 | Low | 54.3 | Low | 113 Ų | 113 | 118.4 Ų | 118.4 | 73% | 0.734 | 73% | 0.73 | S | S | * | * | | | trans | -66 | 93.5 | 167.2 | 27.9 | -29.6 | 0 | 0 | 0 | 105 | P45 | P43-P45 WeakPolarHBondContact O-CD 3.38Å; P43-P45 VanDerWaalsContact O-N 3.09Å |
| 44 | R | 55.3 | Low | 54.9 | Low | 161 Ų | 161 | 122.7 Ų | 122.7 | 61% | 0.608 | 74% | 0.738 | S | S | * | * | | | trans | -49.9 | 122.5 | 168 | -178.3 | 174.7 | 179.4 | -114.1 | -0 | 104.7 | S42 A46 | S42-R44 PolarHBondContact O-N 3.34Å; R44-A46 PolarHBondContact O-N 3.27Å |
| 45 | P | 57.1 | Low | 54.8 | Low | 89 Ų | 89 | 125.8 Ų | 125.8 | 58% | 0.578 | 73% | 0.731 | S | S | * | * | | | trans | -51.5 | 121 | 165.3 | -20.3 | 30.9 | 0 | 0 | 0 | 104.9 | P43 H47 | P43-P45 WeakPolarHBondContact O-CD 3.38Å; P43-P45 VanDerWaalsContact O-N 3.09Å; P45-H47 PolarHBondContact O-CD2 3.09Å; P45-H47 PolarHBondContact O-N 2.88Å |
| 46 | A | 54.6 | Low | 55 | Low | 90 Ų | 90 | 126.5 Ų | 126.5 | 74% | 0.744 | 73% | 0.727 | S | S | * | * | | | trans | -64.1 | 87.3 | 167.3 | 0 | 0 | 0 | 0 | 0 | 104.6 | R44 P48 | R44-A46 PolarHBondContact O-N 3.27Å; A46-P48 WeakPolarHBondContact O-CD 3.39Å |
| 47 | H | 56.8 | Low | 55.6 | Low | 117 Ų | 117 | 122.3 Ų | 122.3 | 54% | 0.542 | 71% | 0.713 | S | S | . | * | | | trans | -60.7 | 108.5 | 166.6 | -55.9 | -82.7 | 0 | 0 | 0 | 103.2 | P45 F49 | P45-H47 PolarHBondContact O-CD2 3.09Å; P45-H47 PolarHBondContact O-N 2.88Å; H47-F49 PolarHBondContact O-N 3.37Å |
| 48 | P | 56.8 | Low | 56.2 | Low | 106 Ų | 106 | 126.3 Ų | 126.3 | 69% | 0.688 | 72% | 0.719 | S | S | * | * | | | trans | -58.7 | 120.8 | 162.8 | 27.7 | -30.4 | 0 | 0 | 0 | 104 | A46 S50 | A46-P48 WeakPolarHBondContact O-CD 3.39Å; P48-S50 PolarHBondContact O-N 3.09Å |
| 49 | F | 53.7 | Low | 56.9 | Low | 189 Ų | 189 | 131.5 Ų | 131.5 | 83% | 0.829 | 72% | 0.72 | S | S | * | * | | | trans | -64.6 | 78 | 165.9 | -93.8 | -90.4 | 0 | 0 | 0 | 107 | H47 P51 | H47-F49 PolarHBondContact O-N 3.37Å; F49-P51 WeakPolarHBondContact O-CD 3.41Å |
| 50 | S | 60 | Low | 57.5 | Low | 92 Ų | 92 | 131 Ų | 131 | 64% | 0.643 | 72% | 0.716 | S | S | * | * | | | trans | -89.7 | 107.9 | 159.7 | -64.6 | 0 | 0 | 0 | 0 | 104.8 | P48 | P48-S50 PolarHBondContact O-N 3.09Š|
| 51 | P | 67.3 | Low | 57.4 | Low | 104 Ų | 104 | 135.2 Ų | 135.2 | 68% | 0.675 | 72% | 0.717 | S | S | * | * | | | trans | -53.6 | 142.2 | 164 | 23.8 | -31 | 0 | 0 | 0 | 107.4 | F49 Q53 | F49-P51 WeakPolarHBondContact O-CD 3.41Å; P51-Q53 PolarHBondContact O-N 3.46Å |
| 52 | P | 59.2 | Low | 57.9 | Low | 104 Ų | 104 | 132 Ų | 132 | 68% | 0.675 | 72% | 0.715 | S | S | * | * | | | trans | -54.8 | 118.3 | 170.6 | 23.3 | -30.3 | 0 | 0 | 0 | 106.2 | I54 | P52-I54 HydrophobicContact CB-CG1 4.31Å; P52-I54 HydrophobicContact CG-CD1 4.34Å; P52-I54 HydrophobicContact CG-CG1 4.21Å; P52-I54 WeakPolarHBondContact O-CG1 2.99Å; P52-I54 PolarHBondContact O-N 3.05Å |
| 53 | Q | 62.3 | Low | 58.3 | Low | 160 Ų | 160 | 134.3 Ų | 134.3 | 75% | 0.748 | 71% | 0.713 | S | S | * | * | | | trans | -65.1 | 91.6 | 170.8 | -89 | -162.9 | -22.4 | 0 | 0 | 106.7 | P51 Y55 | P51-Q53 PolarHBondContact O-N 3.46Å; Q53-Y55 PolarHBondContact O-N 3.31Å |
| 54 | I | 60.8 | Low | 59 | Low | 147 Ų | 147 | 136.6 Ų | 136.6 | 75% | 0.754 | 72% | 0.718 | S | S | * | * | | | trans | -79.4 | 9.8 | 176.7 | -28.4 | -174.8 | 0 | 0 | 0 | 110.9 | P52 | P52-I54 HydrophobicContact CB-CG1 4.31Å; P52-I54 HydrophobicContact CG-CD1 4.34Å; P52-I54 HydrophobicContact CG-CG1 4.21Å; P52-I54 WeakPolarHBondContact O-CG1 2.99Å; P52-I54 PolarHBondContact O-N 3.05Å |
| 55 | Y | 49 | Very low | 59.8 | Low | 199 Ų | 199 | 135 Ų | 135 | 78% | 0.78 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -119.6 | 123.5 | 176.1 | -95.7 | -89.8 | 0 | 0 | 0 | 109.8 | Q53 S57 | Q53-Y55 PolarHBondContact O-N 3.31Å; Y55-S57 PolarHBondContact O-N 2.94Å |
| 56 | P | 54.6 | Low | 60.3 | Low | 104 Ų | 104 | 136.5 Ų | 136.5 | 68% | 0.675 | 73% | 0.73 | S | S | * | * | | | trans | -57.5 | 115.3 | 165 | -15.3 | 27.4 | 0 | 0 | 0 | 107.7 | N58 | P56-N58 PolarHBondContact O-N 3.1Š|
| 57 | S | 58.6 | Low | 61.2 | Low | 91 Ų | 91 | 138.5 Ų | 138.5 | 64% | 0.636 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -72.3 | 28.4 | 177 | -157.6 | 0 | 0 | 0 | 0 | 112.6 | Y55 | Y55-S57 PolarHBondContact O-N 2.94Š|
| 58 | N | 59.7 | Low | 61.7 | Low | 152 Ų | 152 | 138.6 Ų | 138.6 | 81% | 0.813 | 74% | 0.744 | S | S | * | * | | | trans | -98.2 | 11.3 | -177.2 | -86.4 | 77.4 | 0 | 0 | 0 | 113.4 | P56 S60 | P56-N58 PolarHBondContact O-N 3.1Å; N58-S60 PolarHBondContact O-N 3.45Å |
| 59 | R | 62.8 | Low | 62.2 | Low | 226 Ų | 226 | 138.9 Ų | 138.9 | 85% | 0.853 | 75% | 0.749 | S | S | * | * | S | Bend | trans | -83.3 | 113.9 | 166.3 | -90.7 | -169.6 | -168.7 | -153.1 | 3.1 | 109.4 | Y61 | R59-Y61 PolarHBondContact O-N 3.27Š|
| 60 | S | 62.8 | Low | 62.5 | Low | 112 Ų | 112 | 135.4 Ų | 135.4 | 78% | 0.783 | 75% | 0.748 | S | S | * | * | | | trans | -46.1 | 111.9 | 160.5 | -48.6 | 0 | 0 | 0 | 0 | 108.5 | N58 | N58-S60 PolarHBondContact O-N 3.45Š|
| 61 | Y | 53.1 | Low | 62.4 | Low | 199 Ų | 199 | 139.7 Ų | 139.7 | 78% | 0.78 | 76% | 0.758 | S | S | * | * | | | trans | -54.9 | 134.9 | 168.3 | -84.4 | -96.4 | 0 | 0 | 0 | 108.1 | R59 H63 | R59-Y61 PolarHBondContact O-N 3.27Å; Y61-H63 PolarHBondContact O-N 2.73Å |
| 62 | P | 64.9 | Low | 62 | Low | 113 Ų | 113 | 141.1 Ų | 141.1 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | | | trans | -65.1 | 107.2 | 173.2 | 26.9 | -31.4 | 0 | 0 | 0 | 107.5 | I64 | P62-I64 PolarHBondContact O-N 3.14Å; P62-I64 VanDerWaalsContact O-N 3.12Å |
| 63 | H | 63.3 | Low | 61.9 | Low | 153 Ų | 153 | 144.7 Ų | 144.7 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | | | trans | -68.9 | 106.7 | 164.6 | 42.4 | -82.3 | 0 | 0 | 0 | 105.8 | Y61 L65 | Y61-H63 PolarHBondContact O-N 2.73Å; H63-L65 PolarHBondContact O-N 3.42Å |
| 64 | I | 66.2 | Low | 61.8 | Low | 161 Ų | 161 | 141.2 Ų | 141.2 | 83% | 0.826 | 77% | 0.774 | S | S | * | * | | | trans | -64.8 | 107 | 172.7 | -55.6 | 173.1 | 0 | 0 | 0 | 105.2 | P62 | P62-I64 PolarHBondContact O-N 3.14Å; P62-I64 VanDerWaalsContact O-N 3.12Å |
| 65 | L | 73 | Confident | 61.3 | Low | 128 Ų | 128 | 137.6 Ų | 137.6 | 67% | 0.67 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 133.4 | 169.9 | -98.6 | 71.2 | 0 | 0 | 0 | 107.2 | H63 T67 | H63-L65 PolarHBondContact O-N 3.42Å; L65-T67 PolarHBondContact O-N 2.89Å |
| 66 | P | 66.5 | Low | 61.2 | Low | 119 Ų | 119 | 140 Ų | 140 | 77% | 0.773 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -49.7 | 130.7 | 169 | -23.5 | 32.2 | 0 | 0 | 0 | 108.6 | | |
| 67 | T | 73.2 | Confident | 61.2 | Low | 132 Ų | 132 | 138.6 Ų | 138.6 | 81% | 0.81 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -51.9 | 124.9 | 174 | 8.8 | 0 | 0 | 0 | 0 | 108.1 | L65 S69 | L65-T67 PolarHBondContact O-N 2.89Å; T67-S69 PolarHBondContact O-N 3.32Å |
| 68 | P | 68.4 | Low | 60.4 | Low | 119 Ų | 119 | 141.9 Ų | 141.9 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 130.5 | 176.7 | 23.2 | -31.5 | 0 | 0 | 0 | 108 | S70 | P68-S70 PolarHBondContact O-N 3.21Å; P68-S70 VanDerWaalsContact O-N 3.09Å |
| 69 | S | 67.3 | Low | 60.1 | Low | 112 Ų | 112 | 139.4 Ų | 139.4 | 78% | 0.783 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 118.8 | 176.9 | 45.2 | 0 | 0 | 0 | 0 | 108.9 | T67 Q71 | T67-S69 PolarHBondContact O-N 3.32Å; S69-Q71 PolarHBondContact O-N 3.42Å; S69-Q71 VanDerWaalsContact O-N 3.16Å |
| 70 | S | 59 | Low | 59.4 | Low | 117 Ų | 117 | 138 Ų | 138 | 82% | 0.818 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 119 | 177.6 | -165.3 | 0 | 0 | 0 | 0 | 108.3 | P68 T72 | P68-S70 PolarHBondContact O-N 3.21Å; P68-S70 VanDerWaalsContact O-N 3.09Å; S70-T72 PolarHBondContact O-N 2.81Å; S70-T72 VanDerWaalsContact O-N 3.16Å |
| 71 | Q | 58.8 | Low | 58.8 | Low | 181 Ų | 181 | 141.4 Ų | 141.4 | 85% | 0.846 | 78% | 0.779 | S | S | * | * | | | trans | -66.9 | 115.4 | 173.3 | -67 | -170.7 | 2.9 | 0 | 0 | 107.5 | S69 M73 | S69-Q71 PolarHBondContact O-N 3.42Å; S69-Q71 VanDerWaalsContact O-N 3.16Å; Q71-M73 PolarHBondContact O-N 3.37Å |
| 72 | T | 59.3 | Low | 58.7 | Low | 135 Ų | 135 | 138 Ų | 138 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | | | trans | -58.1 | 107 | 169.7 | -60.2 | 0 | 0 | 0 | 0 | 107.8 | S70 A74 | S70-T72 PolarHBondContact O-N 2.81Å; S70-T72 VanDerWaalsContact O-N 3.16Å; T72-A74 PolarHBondContact O-N 3.34Å |
| 73 | M | 57.1 | Low | 58.1 | Low | 179 Ų | 179 | 139.7 Ų | 139.7 | 88% | 0.882 | 79% | 0.787 | S | S | * | * | | | trans | -58.3 | 113.5 | 171.3 | -170.4 | 164.7 | 112.3 | 0 | 0 | 107.3 | Q71 A75 | Q71-M73 PolarHBondContact O-N 3.37Å; M73-A75 PolarHBondContact O-N 3.05Å |
| 74 | A | 59.4 | Low | 57.7 | Low | 87 Ų | 87 | 135 Ų | 135 | 72% | 0.719 | 78% | 0.78 | S | S | * | * | | | trans | -58.9 | 117.2 | 177 | 0 | 0 | 0 | 0 | 0 | 108.1 | T72 Y76 | T72-A74 PolarHBondContact O-N 3.34Å; A74-Y76 PolarHBondContact O-N 3.12Å |
| 75 | A | 50 | Low | 56.9 | Low | 70 Ų | 70 | 136 Ų | 136 | 58% | 0.579 | 78% | 0.784 | S | S | * | * | | | trans | -60.3 | 109.9 | 170.9 | 0 | 0 | 0 | 0 | 0 | 107.5 | M73 G77 Q78 | M73-A75 PolarHBondContact O-N 3.05Å; A75-G77 PolarHBondContact O-N 3.33Å; A75-Q78 HydrophobicContact CB-CG 4.28Å; A75-Q78 PolarHBondContact O-N 3.29Å |
| 76 | Y | 46.2 | Very low | 55.9 | Low | 251 Ų | 251 | 139.2 Ų | 139.2 | 98% | 0.984 | 80% | 0.796 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.6 | 102.6 | 174.7 | -144.6 | -95.9 | 0 | 0 | 0 | 107.3 | A74 | A74-Y76 PolarHBondContact O-N 3.12Š|
| 77 | G | 56.3 | Low | 55 | Low | 73 Ų | 73 | 142.9 Ų | 142.9 | 75% | 0.753 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 127.3 | 8.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 117.6 | A75 | A75-G77 PolarHBondContact O-N 3.33Š|
| 78 | Q | 41.3 | Very low | 53.8 | Low | 160 Ų | 160 | 141.2 Ų | 141.2 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | | | trans | -96.1 | 108 | 171.9 | -73 | -69.7 | -10.2 | 0 | 0 | 111.3 | A75 Q80 | A75-Q78 HydrophobicContact CB-CG 4.28Å; A75-Q78 PolarHBondContact O-N 3.29Å; Q78-Q80 PolarHBondContact O-N 3Å |
| 79 | T | 52.4 | Low | 53.2 | Low | 101 Ų | 101 | 141.8 Ų | 141.8 | 62% | 0.62 | 80% | 0.803 | S | S | * | * | | | trans | -63.3 | 122.4 | 169.2 | 37.4 | 0 | 0 | 0 | 0 | 110.5 | F81 | T79-F81 PolarHBondContact O-N 2.89Š|
| 80 | Q | 48.1 | Very low | 52.5 | Low | 197 Ų | 197 | 140.6 Ų | 140.6 | 92% | 0.921 | 80% | 0.8 | S | S | * | * | | | trans | -72.4 | 103.2 | 174.9 | -155.6 | 172.6 | 22.5 | 0 | 0 | 108.5 | Q78 T82 | Q78-Q80 PolarHBondContact O-N 3Å; Q80-T82 PolarHBondContact O-N 3.07Å |
| 81 | F | 50.9 | Low | 51.7 | Low | 182 Ų | 182 | 146.1 Ų | 146.1 | 80% | 0.798 | 81% | 0.805 | S | S | * | * | | | trans | -75 | 124.5 | 174.5 | -71.9 | -76.1 | 0 | 0 | 0 | 110.1 | T79 | T79-F81 PolarHBondContact O-N 2.89Š|
| 82 | T | 50.3 | Low | 51.5 | Low | 127 Ų | 127 | 142.2 Ų | 142.2 | 78% | 0.779 | 80% | 0.803 | S | S | * | * | | | trans | -50.1 | 138 | 178 | -115.5 | 0 | 0 | 0 | 0 | 112.2 | Q80 G84 | Q80-T82 PolarHBondContact O-N 3.07Å; T82-G84 PolarHBondContact O-N 3.17Å; T82-G84 VanDerWaalsContact O-N 3.1Å |
| 83 | T | 52.7 | Low | 51.2 | Low | 149 Ų | 149 | 142.1 Ų | 142.1 | 91% | 0.914 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -65.3 | 101.7 | 164.7 | 39.3 | 0 | 0 | 0 | 0 | 109.7 | | |
| 84 | G | 55.4 | Low | 50.4 | Low | 55 Ų | 55 | 143 Ų | 143 | 57% | 0.567 | 80% | 0.798 | S | S | * | * | | | trans | 167.9 | 101.2 | 171.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | T82 | T82-G84 PolarHBondContact O-N 3.17Å; T82-G84 VanDerWaalsContact O-N 3.1Å |
| 85 | M | 50.3 | Low | 50.3 | Low | 182 Ų | 182 | 143.9 Ų | 143.9 | 90% | 0.897 | 80% | 0.796 | S | S | * | * | | | trans | 53.6 | 100.4 | 154.7 | -59.3 | -72.8 | -75.8 | 0 | 0 | 117.6 | | |
| 86 | Q | 50.2 | Low | 50.3 | Low | 196 Ų | 196 | 149.2 Ų | 149.2 | 92% | 0.916 | 81% | 0.809 | S | S | * | * | | | | -158.1 | 117.9 | 122.3 | -67.7 | -156.4 | -16.5 | 0 | 0 | 108.7 | A88 | Q86-A88 PolarHBondContact O-N 3.2Š|
| 87 | Q | 48.2 | Very low | 50.6 | Low | 196 Ų | 196 | 141.9 Ų | 141.9 | 92% | 0.916 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 132 | 164 | -88 | 179.8 | -6.7 | 0 | 0 | 108.2 | T89 | Q87-T89 PolarHBondContact O-N 3.38Š|
| 88 | A | 49.1 | Very low | 50.5 | Low | 97 Ų | 97 | 141.9 Ų | 141.9 | 80% | 0.802 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 128.7 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q86 A90 | Q86-A88 PolarHBondContact O-N 3.2Å; A88-A90 PolarHBondContact O-N 3.04Å; A88-A90 VanDerWaalsContact O-N 3.09Å |
| 89 | T | 55.6 | Low | 51 | Low | 131 Ų | 131 | 141.9 Ų | 141.9 | 80% | 0.804 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 116.7 | 170.9 | -68 | 0 | 0 | 0 | 0 | 109.3 | Q87 Y91 | Q87-T89 PolarHBondContact O-N 3.38Å; T89-Y91 PolarHBondContact O-N 3.3Å |
| 90 | A | 52.6 | Low | 51.2 | Low | 87 Ų | 87 | 142.2 Ų | 142.2 | 72% | 0.719 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 125.2 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | A88 A92 | A88-A90 PolarHBondContact O-N 3.04Å; A88-A90 VanDerWaalsContact O-N 3.09Å; A90-A92 PolarHBondContact O-N 3.22Å; A90-A92 VanDerWaalsContact O-N 3.15Å |
| 91 | Y | 40.6 | Very low | 51.5 | Low | 233 Ų | 233 | 143.2 Ų | 143.2 | 91% | 0.914 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 121.7 | 172.7 | -79.7 | -90.3 | 0 | 0 | 0 | 108.8 | T89 T93 | T89-Y91 PolarHBondContact O-N 3.3Å; Y91-T93 PolarHBondContact O-N 3.06Å |
| 92 | A | 55 | Low | 51.5 | Low | 98 Ų | 98 | 137.8 Ų | 137.8 | 81% | 0.81 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 124.3 | 175 | 0 | 0 | 0 | 0 | 0 | 108.9 | A90 Y94 | A90-A92 PolarHBondContact O-N 3.22Å; A90-A92 VanDerWaalsContact O-N 3.15Å; A92-Y94 PolarHBondContact O-N 3.16Å |
| 93 | T | 53.2 | Low | 51.7 | Low | 133 Ų | 133 | 139.8 Ų | 139.8 | 82% | 0.816 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 132.7 | 171.9 | -128.9 | 0 | 0 | 0 | 0 | 108.4 | Y91 | Y91-T93 PolarHBondContact O-N 3.06Š|
| 94 | Y | 40.3 | Very low | 51.9 | Low | 199 Ų | 199 | 138.1 Ų | 138.1 | 78% | 0.78 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 125.3 | 177.2 | -158.6 | -94.3 | 0 | 0 | 0 | 108.9 | A92 Q96 | A92-Y94 PolarHBondContact O-N 3.16Å; Y94-Q96 PolarHBondContact O-N 2.94Å |
| 95 | P | 57.7 | Low | 51.5 | Low | 105 Ų | 105 | 140.6 Ų | 140.6 | 68% | 0.682 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 121.6 | 175.7 | 25.5 | -30.3 | 0 | 0 | 0 | 108.1 | | |
| 96 | Q | 50.6 | Low | 51.4 | Low | 181 Ų | 181 | 142.8 Ų | 142.8 | 85% | 0.846 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60 | 131.6 | 174.7 | -74.5 | -173.2 | 40.9 | 0 | 0 | 108.8 | Y94 G98 | Y94-Q96 PolarHBondContact O-N 2.94Å; Q96-G98 PolarHBondContact O-N 3.13Å; Q96-G98 VanDerWaalsContact O-N 3.1Å |
| 97 | P | 52.8 | Low | 51.6 | Low | 97 Ų | 97 | 136 Ų | 136 | 63% | 0.63 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 119.4 | 172 | 22.6 | -30 | 0 | 0 | 0 | 108.4 | Q99 | P97-Q99 PolarHBondContact O-N 3.36Š|
| 98 | G | 54.1 | Low | 51.8 | Low | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 77% | 0.773 | S | S | * | * | | | trans | -58.7 | 109.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | Q96 P100 | Q96-G98 PolarHBondContact O-N 3.13Å; Q96-G98 VanDerWaalsContact O-N 3.1Å; G98-P100 WeakPolarHBondContact O-CD 3.34Å |
| 99 | Q | 50.4 | Low | 52 | Low | 159 Ų | 159 | 134 Ų | 134 | 74% | 0.743 | 77% | 0.773 | S | S | * | * | | | trans | -68 | 121.4 | 171.9 | -64.3 | -64.1 | -40.7 | 0 | 0 | 107.8 | P97 Y101 | P97-Q99 PolarHBondContact O-N 3.36Å; Q99-Y101 PolarHBondContact O-N 2.96Å |
| 100 | P | 57.5 | Low | 51.7 | Low | 108 Ų | 108 | 139.2 Ų | 139.2 | 70% | 0.701 | 78% | 0.778 | S | S | * | * | S | Bend | trans | -75.7 | -1.1 | -172 | 26.7 | -31.3 | 0 | 0 | 0 | 114.5 | G98 | G98-P100 WeakPolarHBondContact O-CD 3.34Š|
| 101 | Y | 53.8 | Low | 51.6 | Low | 219 Ų | 219 | 140.1 Ų | 140.1 | 86% | 0.859 | 79% | 0.786 | S | S | * | * | | | trans | -144.4 | 110.2 | 178.4 | -73 | -86.1 | 0 | 0 | 0 | 110.9 | Q99 | Q99-Y101 PolarHBondContact O-N 2.96Š|
| 102 | G | 51.6 | Low | 51.8 | Low | 67 Ų | 67 | 132.5 Ų | 132.5 | 69% | 0.691 | 78% | 0.777 | S | S | * | * | | | trans | 177.5 | 85.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | | |
| 103 | I | 53.3 | Low | 51.6 | Low | 169 Ų | 169 | 135.7 Ų | 135.7 | 87% | 0.867 | 78% | 0.779 | S | S | * | * | | | trans | 37.5 | 114.2 | 156.7 | 25.9 | 176.2 | 0 | 0 | 0 | 118.4 | S105 | I103-S105 PolarHBondContact O-N 2.84Å; I103-S105 VanDerWaalsContact O-N 3.13Å |
| 104 | S | 57 | Low | 51.1 | Low | 114 Ų | 114 | 137.8 Ų | 137.8 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | | | trans | -49 | 119.4 | 167.8 | -57.7 | 0 | 0 | 0 | 0 | 110.8 | Y106 | S104-Y106 PolarHBondContact O-N 2.84Š|
| 105 | S | 48.6 | Very low | 51.9 | Low | 108 Ų | 108 | 135.2 Ų | 135.2 | 76% | 0.755 | 78% | 0.782 | S | S | * | * | | | trans | -55.6 | 125 | 170 | -174.9 | 0 | 0 | 0 | 0 | 108.5 | I103 G107 | I103-S105 PolarHBondContact O-N 2.84Å; I103-S105 VanDerWaalsContact O-N 3.13Å; S105-G107 PolarHBondContact O-N 3.12Å |
| 106 | Y | 48 | Very low | 51.6 | Low | 227 Ų | 227 | 137.4 Ų | 137.4 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.4 | 33 | 178.4 | -88.3 | -95.1 | 0 | 0 | 0 | 113.4 | S104 | S104-Y106 PolarHBondContact O-N 2.84Š|
| 107 | G | 53 | Low | 51.6 | Low | 54 Ų | 54 | 134.3 Ų | 134.3 | 56% | 0.557 | 78% | 0.781 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -91.7 | -10.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | S105 L109 | S105-G107 PolarHBondContact O-N 3.12Å; G107-L109 VanDerWaalsContact C-N 3.31Å; G107-L109 PolarHBondContact O-N 2.83Å |
| 108 | A | 52.4 | Low | 51.5 | Low | 97 Ų | 97 | 132.7 Ų | 132.7 | 80% | 0.802 | 78% | 0.782 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -2.2 | -171.1 | 0 | 0 | 0 | 0 | 0 | 115.7 | | |
| 109 | L | 53.6 | Low | 51.3 | Low | 155 Ų | 155 | 137.5 Ų | 137.5 | 81% | 0.812 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.5 | 1.7 | -177.7 | -70.5 | 179 | 0 | 0 | 0 | 115.5 | G107 | G107-L109 VanDerWaalsContact C-N 3.31Å; G107-L109 PolarHBondContact O-N 2.83Å |
| 110 | W | 49.6 | Very low | 51.2 | Low | 240 Ų | 240 | 135.6 Ų | 135.6 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | S | Bend | trans | -113.2 | 108.9 | 169.6 | -74.5 | 95.3 | 0 | 0 | 0 | 109.4 | | |
| 111 | A | 49.9 | Very low | 50.6 | Low | 106 Ų | 106 | 138.5 Ų | 138.5 | 88% | 0.876 | 80% | 0.798 | S | S | * | * | | | trans | -48.6 | 140.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | | |
| 112 | G | 45.9 | Very low | 50.3 | Low | 72 Ų | 72 | 133.5 Ų | 133.5 | 74% | 0.742 | 80% | 0.795 | S | S | * | * | | | trans | 108.3 | 70.7 | 157.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | K114 | G112-K114 PolarHBondContact O-N 3.14Š|
| 113 | I | 49.3 | Very low | 50 | Low | 165 Ų | 165 | 138.3 Ų | 138.3 | 85% | 0.846 | 80% | 0.8 | S | S | * | * | | | trans | -49.6 | 118 | 148.3 | 39.6 | 161.7 | 0 | 0 | 0 | 110.9 | | |
| 114 | K | 43.5 | Very low | 49.2 | Very low | 178 Ų | 178 | 134.2 Ų | 134.2 | 77% | 0.774 | 79% | 0.786 | S | S | * | * | | | trans | -138.8 | 98.2 | 141.5 | -69.6 | -159.4 | -178.8 | -149.4 | 0 | 108.3 | G112 E116 | G112-K114 PolarHBondContact O-N 3.14Å; K114-E116 PolarHBondContact O-N 2.99Å |
| 115 | T | 57.9 | Low | 48.7 | Very low | 144 Ų | 144 | 135.3 Ų | 135.3 | 88% | 0.883 | 79% | 0.791 | S | S | * | * | | | trans | -67.7 | 88.4 | 161.8 | -55.1 | 0 | 0 | 0 | 0 | 107.4 | | |
| 116 | E | 51.6 | Low | 49 | Very low | 152 Ų | 152 | 133.6 Ų | 133.6 | 71% | 0.71 | 79% | 0.79 | S | S | * | * | | | trans | -113.5 | 94.9 | 160.1 | 60.8 | -161.4 | 156 | 0 | 0 | 106 | K114 | K114-E116 PolarHBondContact O-N 2.99Š|
| 117 | S | 49 | Very low | 48.9 | Very low | 115 Ų | 115 | 131.1 Ų | 131.1 | 80% | 0.804 | 79% | 0.786 | S | S | * | * | | | | 54.1 | 92.9 | 94.7 | -173.8 | 0 | 0 | 0 | 0 | 111 | | |
| 118 | G | 52.6 | Low | 48.9 | Very low | 63 Ų | 63 | 134.7 Ų | 134.7 | 65% | 0.649 | 80% | 0.797 | S | S | * | * | | | trans | 78.1 | 81.6 | 143.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | | |
| 119 | L | 48.6 | Very low | 48.8 | Very low | 176 Ų | 176 | 132.5 Ų | 132.5 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | | | trans | -117.5 | 73.7 | 139.6 | -70.3 | 173.6 | 0 | 0 | 0 | 107.7 | Q121 | L119-Q121 VanDerWaalsContact C-N 3.31Å; L119-Q121 PolarHBondContact O-N 3.33Å |
| 120 | S | 47.8 | Very low | 49 | Very low | 119 Ų | 119 | 134.6 Ų | 134.6 | 83% | 0.832 | 79% | 0.788 | S | S | * | * | | | trans | -58 | 105.6 | 154.7 | -75.1 | 0 | 0 | 0 | 0 | 106.2 | S122 | S120-S122 PolarHBondContact O-N 2.68Š|
| 121 | Q | 44.7 | Very low | 49.4 | Very low | 169 Ų | 169 | 129.9 Ų | 129.9 | 79% | 0.79 | 78% | 0.779 | S | S | * | * | | | trans | -54.5 | 106 | 169.2 | -172.7 | 176.6 | -3.9 | 0 | 0 | 106.8 | L119 Q123 | L119-Q121 VanDerWaalsContact C-N 3.31Å; L119-Q121 PolarHBondContact O-N 3.33Å; Q121-Q123 PolarHBondContact O-N 3.13Å |
| 122 | S | 49.4 | Very low | 49.2 | Very low | 113 Ų | 113 | 130.3 Ų | 130.3 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | | | trans | -59.1 | 101.6 | 172.9 | -178.5 | 0 | 0 | 0 | 0 | 107.1 | S120 S124 | S120-S122 PolarHBondContact O-N 2.68Å; S122-S124 PolarHBondContact O-N 3.16Å; S122-S124 VanDerWaalsContact O-N 3.09Å |
| 123 | Q | 45.4 | Very low | 49.1 | Very low | 168 Ų | 168 | 137.2 Ų | 137.2 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | | | trans | -73 | 100.2 | 164.8 | -72.4 | -152.7 | -26.1 | 0 | 0 | 106.5 | Q121 | Q121-Q123 PolarHBondContact O-N 3.13Š|
| 124 | S | 36.3 | Very low | 49.2 | Very low | 84 Ų | 84 | 132.1 Ų | 132.1 | 59% | 0.587 | 77% | 0.769 | S | S | * | * | | | trans | -52.2 | 130.9 | 168 | 178.9 | 0 | 0 | 0 | 0 | 108.9 | S122 G126 | S122-S124 PolarHBondContact O-N 3.16Å; S122-S124 VanDerWaalsContact O-N 3.09Å; S124-G126 PolarHBondContact O-N 3.22Å |
| 125 | P | 46.4 | Very low | 49.5 | Very low | 137 Ų | 137 | 130.1 Ų | 130.1 | 89% | 0.89 | 77% | 0.772 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | 78.7 | 175.9 | -17.7 | 31 | 0 | 0 | 0 | 110.6 | | |
| 126 | G | 53.1 | Low | 48.8 | Very low | 71 Ų | 71 | 128.6 Ų | 128.6 | 73% | 0.732 | 77% | 0.768 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 165.7 | 4.4 | -177.1 | 0 | 0 | 0 | 0 | 0 | 118.2 | S124 | S124-G126 PolarHBondContact O-N 3.22Š|
| 127 | Q | 46.8 | Very low | 48.9 | Very low | 176 Ų | 176 | 131.7 Ų | 131.7 | 82% | 0.822 | 78% | 0.779 | S | S | * | * | | | trans | -118.2 | 104.1 | 172.7 | -95.4 | -165.3 | 11.5 | 0 | 0 | 112.2 | G129 | Q127-G129 VanDerWaalsContact C-N 3.34Å; Q127-G129 PolarHBondContact O-N 3.28Å; Q127-G129 VanDerWaalsContact O-N 3.14Å |
| 128 | T | 53.4 | Low | 49 | Very low | 128 Ų | 128 | 129.2 Ų | 129.2 | 79% | 0.785 | 77% | 0.772 | S | S | * | * | | | trans | -74.9 | 90.2 | 157.5 | 54.8 | 0 | 0 | 0 | 0 | 108 | F130 | T128-F130 PolarHBondContact O-N 3.09Š|
| 129 | G | 50.5 | Low | 48.9 | Very low | 52 Ų | 52 | 132.7 Ų | 132.7 | 54% | 0.536 | 78% | 0.781 | S | S | . | * | | | trans | -68.7 | 121.8 | 171.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q127 L131 | Q127-G129 VanDerWaalsContact C-N 3.34Å; Q127-G129 PolarHBondContact O-N 3.28Å; Q127-G129 VanDerWaalsContact O-N 3.14Å; G129-L131 PolarHBondContact O-N 2.87Å |
| 130 | F | 57.8 | Low | 48.8 | Very low | 199 Ų | 199 | 130.1 Ų | 130.1 | 87% | 0.873 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -64.8 | 10.4 | -172.2 | -83.1 | -94.9 | 0 | 0 | 0 | 116.4 | T128 | T128-F130 PolarHBondContact O-N 3.09Š|
| 131 | L | 56.9 | Low | 48.8 | Very low | 140 Ų | 140 | 133 Ų | 133 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | | | trans | -146.6 | 81.1 | -179.7 | -66.3 | 173.1 | 0 | 0 | 0 | 111.1 | G129 | G129-L131 PolarHBondContact O-N 2.87Š|
| 132 | S | 45.3 | Very low | 49.1 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 80% | 0.804 | 78% | 0.775 | S | S | * | * | | | trans | -104.1 | 103.9 | 162.9 | -80.8 | 0 | 0 | 0 | 0 | 108.8 | G134 | S132-G134 VanDerWaalsContact C-N 3.26Å; S132-G134 PolarHBondContact O-N 3.16Å |
| 133 | Y | 45.5 | Very low | 48.9 | Very low | 217 Ų | 217 | 128.7 Ų | 128.7 | 85% | 0.851 | 77% | 0.772 | S | S | * | * | | | trans | -77.7 | 83.5 | 163.6 | -69.2 | -81.9 | 0 | 0 | 0 | 108.2 | | |
| 134 | G | 51.6 | Low | 48.8 | Very low | 58 Ų | 58 | 129.9 Ų | 129.9 | 60% | 0.598 | 78% | 0.777 | S | S | * | * | | | trans | -77 | 121.3 | 168.6 | 0 | 0 | 0 | 0 | 0 | 109.4 | S132 S136 | S132-G134 VanDerWaalsContact C-N 3.26Å; S132-G134 PolarHBondContact O-N 3.16Å; G134-S136 PolarHBondContact O-N 3.38Å |
| 135 | T | 48.9 | Very low | 49.6 | Very low | 136 Ų | 136 | 129.6 Ų | 129.6 | 83% | 0.834 | 78% | 0.779 | S | S | * | * | | | trans | -63.7 | 96.1 | 168.6 | 47.7 | 0 | 0 | 0 | 0 | 109.3 | F137 | T135-F137 PolarHBondContact O-N 3.32Š|
| 136 | S | 43.8 | Very low | 49.8 | Very low | 113 Ų | 113 | 129 Ų | 129 | 79% | 0.79 | 78% | 0.776 | S | S | * | * | | | trans | -91 | 87.7 | -178.6 | 44 | 0 | 0 | 0 | 0 | 111.4 | G134 | G134-S136 PolarHBondContact O-N 3.38Š|
| 137 | F | 54.1 | Low | 49.3 | Very low | 216 Ų | 216 | 136.2 Ų | 136.2 | 95% | 0.947 | 78% | 0.782 | S | S | * | * | | | trans | -106 | 82.8 | 154.3 | -71 | -77.7 | 0 | 0 | 0 | 108 | T135 | T135-F137 PolarHBondContact O-N 3.32Š|
| 138 | G | 50.4 | Low | 49.2 | Very low | 64 Ų | 64 | 133.2 Ų | 133.2 | 66% | 0.66 | 78% | 0.781 | S | S | * | * | | | trans | -144.5 | 120.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | | |
| 139 | T | 49.8 | Very low | 48.6 | Very low | 136 Ų | 136 | 137 Ų | 137 | 83% | 0.834 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -59.6 | 132.2 | 174.4 | 49.3 | 0 | 0 | 0 | 0 | 109.4 | Q141 | T139-Q141 PolarHBondContact O-N 3.26Š|
| 140 | P | 46.4 | Very low | 48.6 | Very low | 121 Ų | 121 | 143.4 Ų | 143.4 | 79% | 0.786 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 131.7 | 172.3 | 23.7 | -29.9 | 0 | 0 | 0 | 109.3 | | |
| 141 | Q | 47.1 | Very low | 48.3 | Very low | 179 Ų | 179 | 142.5 Ų | 142.5 | 84% | 0.836 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 132 | 176.5 | -173.5 | 174.6 | -17.8 | 0 | 0 | 109.2 | T139 G143 | T139-Q141 PolarHBondContact O-N 3.26Å; Q141-G143 PolarHBondContact O-N 3.21Å |
| 142 | P | 52 | Low | 48.1 | Very low | 124 Ų | 124 | 145.4 Ų | 145.4 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | | | trans | -60.3 | 100.5 | 173.5 | -19.7 | 30.6 | 0 | 0 | 0 | 108.8 | Q144 | P142-Q144 PolarHBondContact O-N 3.26Š|
| 143 | G | 45.8 | Very low | 48.1 | Very low | 69 Ų | 69 | 142.7 Ų | 142.7 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -66 | 123.4 | 173.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | Q141 A145 | Q141-G143 PolarHBondContact O-N 3.21Å; G143-A145 PolarHBondContact O-N 3.17Å; G143-A145 VanDerWaalsContact O-N 3.12Å |
| 144 | Q | 43.6 | Very low | 48 | Very low | 193 Ų | 193 | 138.1 Ų | 138.1 | 90% | 0.902 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 118.2 | 171.7 | -67.2 | -173.2 | -10.2 | 0 | 0 | 108.6 | P142 | P142-Q144 PolarHBondContact O-N 3.26Š|
| 145 | A | 51.8 | Low | 47.7 | Very low | 77 Ų | 77 | 140 Ų | 140 | 64% | 0.636 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64 | 137 | 173 | 0 | 0 | 0 | 0 | 0 | 108.9 | G143 Y147 | G143-A145 PolarHBondContact O-N 3.17Å; G143-A145 VanDerWaalsContact O-N 3.12Å; A145-Y147 PolarHBondContact O-N 3.46Å; A145-Y147 VanDerWaalsContact O-N 3.17Å |
| 146 | P | 52 | Low | 47.6 | Very low | 125 Ų | 125 | 142.5 Ų | 142.5 | 81% | 0.812 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64 | 119.6 | 177 | 24.2 | -30.9 | 0 | 0 | 0 | 109.6 | S148 | P146-S148 PolarHBondContact O-N 3Å; P146-S148 VanDerWaalsContact O-N 3.13Å |
| 147 | Y | 42.7 | Very low | 47.5 | Very low | 222 Ų | 222 | 144 Ų | 144 | 87% | 0.871 | 81% | 0.807 | S | S | * | * | | | trans | -68.2 | 105.5 | 169.6 | -81.5 | -88.1 | 0 | 0 | 0 | 109.1 | A145 Y149 | A145-Y147 PolarHBondContact O-N 3.46Å; A145-Y147 VanDerWaalsContact O-N 3.17Å; Y147-Y149 PolarHBondContact O-N 3.12Å |
| 148 | S | 44.8 | Very low | 47.6 | Very low | 114 Ų | 114 | 140.6 Ų | 140.6 | 80% | 0.797 | 80% | 0.804 | S | S | * | * | | | trans | -79.2 | 107.3 | 168.5 | 43.3 | 0 | 0 | 0 | 0 | 109.7 | P146 | P146-S148 PolarHBondContact O-N 3Å; P146-S148 VanDerWaalsContact O-N 3.13Å |
| 149 | Y | 40.2 | Very low | 47 | Very low | 208 Ų | 208 | 142.6 Ų | 142.6 | 82% | 0.816 | 81% | 0.808 | S | S | * | * | | | trans | -66.7 | 129.9 | 167.8 | -97.1 | -96.3 | 0 | 0 | 0 | 110 | Y147 M151 | Y147-Y149 PolarHBondContact O-N 3.12Å; Y149-M151 PolarHBondContact O-N 2.79Å |
| 150 | Q | 50.9 | Low | 46.7 | Very low | 185 Ų | 185 | 141.9 Ų | 141.9 | 86% | 0.864 | 81% | 0.809 | S | S | * | * | | | trans | -70.3 | 111.6 | 165.2 | -70.8 | -88.8 | -78.9 | 0 | 0 | 108 | Q152 | Q150-Q152 PolarHBondContact O-N 2.93Å; Q150-Q152 VanDerWaalsContact O-N 3.17Å |
| 151 | M | 51.5 | Low | 46.5 | Very low | 180 Ų | 180 | 139.2 Ų | 139.2 | 89% | 0.887 | 80% | 0.803 | S | S | * | * | | | trans | -73.8 | 103.4 | 168 | -77.2 | -93.5 | 151.4 | 0 | 0 | 107.9 | Y149 G153 | Y149-M151 PolarHBondContact O-N 2.79Å; M151-G153 PolarHBondContact O-N 2.78Å |
| 152 | Q | 52.7 | Low | 46.7 | Very low | 201 Ų | 201 | 139.1 Ų | 139.1 | 94% | 0.939 | 81% | 0.807 | S | S | * | * | | | trans | -71.2 | 108.2 | 170.9 | -176.1 | 174.6 | 17.1 | 0 | 0 | 108.9 | Q150 | Q150-Q152 PolarHBondContact O-N 2.93Å; Q150-Q152 VanDerWaalsContact O-N 3.17Å |
| 153 | G | 45.4 | Very low | 46.1 | Very low | 59 Ų | 59 | 143.5 Ų | 143.5 | 61% | 0.608 | 81% | 0.809 | S | S | * | * | | | trans | 123 | 112.3 | 161.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | M151 | M151-G153 PolarHBondContact O-N 2.78Š|
| 154 | S | 43.1 | Very low | 46.2 | Very low | 120 Ų | 120 | 146.4 Ų | 146.4 | 84% | 0.839 | 82% | 0.819 | S | S | * | * | | | | 159.2 | 95 | 112 | -66.2 | 0 | 0 | 0 | 0 | 111 | | |
| 155 | S | 43.8 | Very low | 46.1 | Very low | 97 Ų | 97 | 140.4 Ų | 140.4 | 68% | 0.678 | 81% | 0.809 | S | S | * | * | | | | 41.8 | 119 | 123.3 | -82.3 | 0 | 0 | 0 | 0 | 121.5 | | |
| 156 | F | 47.5 | Very low | 46.1 | Very low | 190 Ų | 190 | 143.8 Ų | 143.8 | 83% | 0.833 | 82% | 0.816 | S | S | * | * | | | trans | 57.1 | 108.2 | 146.3 | -56.3 | -77.9 | 0 | 0 | 0 | 119 | | |
| 157 | T | 42.7 | Very low | 45.8 | Very low | 144 Ų | 144 | 143.8 Ų | 143.8 | 88% | 0.883 | 81% | 0.81 | S | S | * | * | | | | -174.9 | 129.2 | 118 | 27.8 | 0 | 0 | 0 | 0 | 110.9 | | |
| 158 | T | 54.6 | Low | 45.8 | Very low | 144 Ų | 144 | 137.4 Ų | 137.4 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | | | trans | -68.7 | 119.4 | 172.2 | 46.1 | 0 | 0 | 0 | 0 | 111.1 | | |
| 159 | S | 39.4 | Very low | 45.9 | Very low | 107 Ų | 107 | 138.8 Ų | 138.8 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | | | trans | -168.6 | 102 | 154 | -158.7 | 0 | 0 | 0 | 0 | 109.4 | | |
| 160 | S | 42.5 | Very low | 46.4 | Very low | 121 Ų | 121 | 134.8 Ų | 134.8 | 85% | 0.846 | 79% | 0.792 | S | S | * | * | | | | 93 | 122.1 | 100.5 | -77.6 | 0 | 0 | 0 | 0 | 112.7 | | |
| 161 | G | 42.2 | Very low | 46.1 | Very low | 65 Ų | 65 | 132.3 Ų | 132.3 | 67% | 0.67 | 79% | 0.785 | S | S | * | * | | | trans | 157.1 | 89.1 | 163.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y163 | G161-Y163 PolarHBondContact O-N 3.02Š|
| 162 | L | 50.9 | Low | 45.9 | Very low | 176 Ų | 176 | 129.4 Ų | 129.4 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | | | trans | -65.6 | 63.3 | 172 | -66.8 | 160.2 | 0 | 0 | 0 | 111.8 | | |
| 163 | Y | 39.5 | Very low | 45.7 | Very low | 217 Ų | 217 | 123.3 Ų | 123.3 | 85% | 0.851 | 76% | 0.762 | S | S | * | * | | | trans | -127.9 | 95 | 158.4 | -68 | -75.8 | 0 | 0 | 0 | 106.7 | G161 G165 | G161-Y163 PolarHBondContact O-N 3.02Å; Y163-G165 PolarHBondContact O-N 3.39Å |
| 164 | S | 48.1 | Very low | 46.1 | Very low | 129 Ų | 129 | 123.9 Ų | 123.9 | 90% | 0.902 | 77% | 0.768 | S | S | * | * | | | trans | -64.8 | 78.9 | 162.1 | -172.3 | 0 | 0 | 0 | 0 | 107.5 | N166 | S164-N166 PolarHBondContact O-N 2.97Å; S164-N166 VanDerWaalsContact O-N 3.16Å |
| 165 | G | 42 | Very low | 46.1 | Very low | 68 Ų | 68 | 127.5 Ų | 127.5 | 70% | 0.701 | 77% | 0.769 | S | S | * | * | | | trans | -77.3 | 94.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 107.7 | Y163 N167 | Y163-G165 PolarHBondContact O-N 3.39Å; G165-N167 PolarHBondContact O-N 3.43Å |
| 166 | N | 51.7 | Low | 46 | Very low | 148 Ų | 148 | 129.3 Ų | 129.3 | 79% | 0.791 | 77% | 0.771 | S | S | * | * | | | trans | -50.3 | 94.3 | 176.7 | -167.3 | 32 | 0 | 0 | 0 | 111.4 | S164 | S164-N166 PolarHBondContact O-N 2.97Å; S164-N166 VanDerWaalsContact O-N 3.16Å |
| 167 | N | 46 | Very low | 46.1 | Very low | 125 Ų | 125 | 125.6 Ų | 125.6 | 67% | 0.668 | 77% | 0.768 | S | S | * | * | | | trans | -137.3 | 53 | 154.8 | -154.2 | 21.5 | 0 | 0 | 0 | 109.3 | G165 L169 | G165-N167 PolarHBondContact O-N 3.43Å; N167-L169 PolarHBondContact O-N 2.73Å; N167-L169 WeakPolarHBondContact OD1-CG 3.09Å |
| 168 | S | 42.6 | Very low | 46.2 | Very low | 88 Ų | 88 | 123 Ų | 123 | 62% | 0.615 | 76% | 0.757 | S | S | * | * | | | trans | -71.3 | 81 | 156.7 | -161.3 | 0 | 0 | 0 | 0 | 106.2 | T170 | S168-T170 PolarHBondContact O-N 3.2Š|
| 169 | L | 46 | Very low | 46 | Very low | 142 Ų | 142 | 124 Ų | 124 | 74% | 0.743 | 75% | 0.751 | S | S | * | * | | | trans | -68 | 84.2 | 157.3 | -75.2 | 164.1 | 0 | 0 | 0 | 105.1 | N167 N171 | N167-L169 PolarHBondContact O-N 2.73Å; N167-L169 WeakPolarHBondContact OD1-CG 3.09Å; L169-N171 PolarHBondContact O-N 3.09Å |
| 170 | T | 51.9 | Low | 46.5 | Very low | 125 Ų | 125 | 126 Ų | 126 | 77% | 0.767 | 75% | 0.748 | S | S | * | * | | | trans | -53.9 | 94.3 | 162.2 | 44.2 | 0 | 0 | 0 | 0 | 107.3 | S168 | S168-T170 PolarHBondContact O-N 3.2Š|
| 171 | N | 44.1 | Very low | 47.3 | Very low | 133 Ų | 133 | 126.8 Ų | 126.8 | 71% | 0.711 | 74% | 0.743 | S | S | * | * | | | trans | -125.9 | 67 | 153.8 | -163.1 | 5.3 | 0 | 0 | 0 | 108.4 | L169 S173 | L169-N171 PolarHBondContact O-N 3.09Å; N171-S173 VanDerWaalsContact C-N 3.26Å; N171-S173 PolarHBondContact OD1-N 2.68Å; N171-S173 PolarHBondContact OD1-OG 3.02Å |
| 172 | S | 47.6 | Very low | 47.4 | Very low | 118 Ų | 118 | 132.8 Ų | 132.8 | 83% | 0.825 | 75% | 0.747 | S | S | * | * | | | trans | -92.8 | 69.9 | 154.8 | 177.6 | 0 | 0 | 0 | 0 | 106.8 | | |
| 173 | S | 48.2 | Very low | 47.5 | Very low | 74 Ų | 74 | 129 Ų | 129 | 52% | 0.517 | 73% | 0.733 | S | S | . | * | | | trans | -77.3 | 115.2 | 155.2 | 59.7 | 0 | 0 | 0 | 0 | 106.3 | N171 F175 | N171-S173 VanDerWaalsContact C-N 3.26Å; N171-S173 PolarHBondContact OD1-N 2.68Å; N171-S173 PolarHBondContact OD1-OG 3.02Å; S173-F175 PolarHBondContact O-N 2.71Å |
| 174 | G | 53.1 | Low | 47.8 | Very low | 71 Ų | 71 | 124.6 Ų | 124.6 | 73% | 0.732 | 73% | 0.734 | S | S | * | * | | | trans | -41.2 | 119.1 | -166 | 0 | 0 | 0 | 0 | 0 | 115.6 | | |
| 175 | F | 43.3 | Very low | 48.1 | Very low | 196 Ų | 196 | 132.2 Ų | 132.2 | 86% | 0.86 | 75% | 0.745 | S | S | * | * | | | trans | -90.9 | 111.7 | 153.3 | -73.6 | -80.4 | 0 | 0 | 0 | 107.5 | S173 S177 | S173-F175 PolarHBondContact O-N 2.71Å; F175-S177 PolarHBondContact O-N 2.94Å; F175-S177 VanDerWaalsContact O-N 3.12Å |
| 176 | N | 43.3 | Very low | 48.5 | Very low | 135 Ų | 135 | 135.4 Ų | 135.4 | 72% | 0.722 | 75% | 0.747 | S | S | * | * | | | trans | -57.8 | 108.8 | 168.2 | -175 | -74.4 | 0 | 0 | 0 | 107.8 | S178 | N176-S178 PolarHBondContact O-N 3.25Å; N176-S178 PolarHBondContact OD1-N 3.05Å; N176-S178 VanDerWaalsContact OD1-N 3.14Å; N176-S178 PolarHBondContact OD1-OG 3.42Å |
| 177 | S | 48.7 | Very low | 48.3 | Very low | 111 Ų | 111 | 134.7 Ų | 134.7 | 78% | 0.776 | 75% | 0.745 | S | S | * | * | | | trans | -69.3 | 75.8 | 164.3 | -79 | 0 | 0 | 0 | 0 | 108.6 | F175 Q179 | F175-S177 PolarHBondContact O-N 2.94Å; F175-S177 VanDerWaalsContact O-N 3.12Å; S177-Q179 VanDerWaalsContact C-N 3.27Å; S177-Q179 PolarHBondContact O-N 2.84Å; S177-Q179 VanDerWaalsContact O-N 3.13Å |
| 178 | S | 44.7 | Very low | 48.4 | Very low | 91 Ų | 91 | 135.3 Ų | 135.3 | 64% | 0.636 | 75% | 0.749 | S | S | * | * | | | trans | -71.2 | 96.4 | 152.2 | -71.4 | 0 | 0 | 0 | 0 | 105.6 | N176 Q180 | N176-S178 PolarHBondContact O-N 3.25Å; N176-S178 PolarHBondContact OD1-N 3.05Å; N176-S178 VanDerWaalsContact OD1-N 3.14Å; N176-S178 PolarHBondContact OD1-OG 3.42Å; S178-Q180 PolarHBondContact O-N 3.41Å |
| 179 | Q | 51.3 | Low | 48.8 | Very low | 163 Ų | 163 | 138.1 Ų | 138.1 | 76% | 0.762 | 76% | 0.757 | S | S | * | * | | | trans | -54.2 | 107.9 | 167.2 | -72.6 | 171 | -15.1 | 0 | 0 | 107.2 | S177 D181 | S177-Q179 VanDerWaalsContact C-N 3.27Å; S177-Q179 PolarHBondContact O-N 2.84Å; S177-Q179 VanDerWaalsContact O-N 3.13Å; Q179-D181 PolarHBondContact O-N 2.79Å |
| 180 | Q | 49.5 | Very low | 48.9 | Very low | 149 Ų | 149 | 137.8 Ų | 137.8 | 70% | 0.696 | 76% | 0.758 | S | S | * | * | | | trans | -84.2 | 91.3 | 163.6 | -79.8 | -163.9 | -22.6 | 0 | 0 | 107.1 | S178 Y182 | S178-Q180 PolarHBondContact O-N 3.41Å; Q180-Y182 HydrophobicContact CB-CD2 4.46Å; Q180-Y182 HydrophobicContact CB-CE2 4.22Å; Q180-Y182 PolarHBondContact O-N 3.1Å |
| 181 | D | 57.7 | Low | 48.7 | Very low | 139 Ų | 139 | 138.7 Ų | 138.7 | 74% | 0.743 | 76% | 0.757 | S | S | * | * | | | trans | -69.1 | 111.7 | 163.1 | -62.2 | -67.2 | 0 | 0 | 0 | 108.1 | Q179 | Q179-D181 PolarHBondContact O-N 2.79Š|
| 182 | Y | 44.8 | Very low | 49.1 | Very low | 190 Ų | 190 | 139.1 Ų | 139.1 | 75% | 0.745 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -88.3 | 128.8 | 169.7 | -84.8 | -84.3 | 0 | 0 | 0 | 109.7 | Q180 | Q180-Y182 HydrophobicContact CB-CD2 4.46Å; Q180-Y182 HydrophobicContact CB-CE2 4.22Å; Q180-Y182 PolarHBondContact O-N 3.1Å |
| 183 | P | 52.6 | Low | 49.2 | Very low | 98 Ų | 98 | 140.7 Ų | 140.7 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 127.2 | 169.3 | 29.5 | -28.7 | 0 | 0 | 0 | 109.2 | Y185 | P183-Y185 PolarHBondContact O-N 3.48Š|
| 184 | S | 45.7 | Very low | 49.3 | Very low | 124 Ų | 124 | 146.3 Ų | 146.3 | 87% | 0.867 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -70.4 | 120.7 | 172.5 | -160.6 | 0 | 0 | 0 | 0 | 109 | | |
| 185 | Y | 56.3 | Low | 48.9 | Very low | 288 Ų | 288 | 153.1 Ų | 153.1 | 100% | 1.129 | 78% | 0.779 | S | S | * | * | | | trans | -75.9 | 0 | 162.3 | -74.8 | -84.2 | 0 | 0 | 0 | 110.5 | P183 | P183-Y185 PolarHBondContact O-N 3.48Š|