| 1 | P | 49.1 | Very low | 51.2 | Low | 191 Ų | 191 | 144.7 Ų | 144.7 | 100% | 1.24 | 83% | 0.828 | S | S | * | * | | | | 0 | 117.8 | 0 | 22.3 | -0.4 | 0 | 0 | 0 | 111.7 | | |
| 2 | A | 42.9 | Very low | 51.7 | Low | 95 Ų | 95 | 142.9 Ų | 142.9 | 79% | 0.785 | 82% | 0.822 | S | S | * | * | | | trans | -136.8 | 139.6 | 161.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | | |
| 3 | P | 52 | Low | 52.5 | Low | 126 Ų | 126 | 146.5 Ų | 146.5 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | | | trans | -79.6 | 155.5 | -171 | 32.1 | -35.3 | 0 | 0 | 0 | 112.9 | | |
| 4 | T | 60 | Low | 52.6 | Low | 130 Ų | 130 | 149.4 Ų | 149.4 | 80% | 0.798 | 83% | 0.825 | S | S | * | * | | | trans | -55.9 | 144.5 | 158.4 | 44.4 | 0 | 0 | 0 | 0 | 110.4 | | |
| 5 | S | 52.7 | Low | 53 | Low | 106 Ų | 106 | 144.5 Ų | 144.5 | 74% | 0.741 | 82% | 0.823 | S | S | * | * | | | | 147.1 | 162.3 | 107.6 | 61.7 | 0 | 0 | 0 | 0 | 108.6 | | |
| 6 | D | 49.9 | Very low | 52.7 | Low | 130 Ų | 130 | 143.9 Ų | 143.9 | 70% | 0.695 | 81% | 0.811 | S | S | * | * | | | cis | -156.8 | -174.3 | -4.8 | -134.2 | -36.3 | 0 | 0 | 0 | 113.2 | | |
| 7 | L | 55.7 | Low | 53 | Low | 143 Ų | 143 | 143 Ų | 143 | 75% | 0.749 | 81% | 0.809 | S | S | * | * | | | trans | 37.1 | 115 | 153.8 | -91.6 | 76.9 | 0 | 0 | 0 | 119.8 | | |
| 8 | W | 42 | Very low | 53.3 | Low | 243 Ų | 243 | 140.2 Ų | 140.2 | 92% | 0.92 | 81% | 0.807 | S | S | * | * | | | trans | -126.4 | 131.4 | 145.3 | -75.6 | 65.2 | 0 | 0 | 0 | 109 | | |
| 9 | P | 53.9 | Low | 53.5 | Low | 108 Ų | 108 | 140.1 Ų | 140.1 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | | | trans | -75.5 | 128.6 | -178.8 | 30.3 | -33.3 | 0 | 0 | 0 | 110.6 | V11 | P9-V11 PolarHBondContact O-N 3.1Å; P9-V11 VanDerWaalsContact O-N 3.17Å |
| 10 | Q | 56.3 | Low | 53.8 | Low | 200 Ų | 200 | 141.5 Ų | 141.5 | 94% | 0.935 | 80% | 0.802 | S | S | * | * | | | trans | -74.1 | 105.8 | 168.5 | -73.2 | -177.8 | 0 | 0 | 0 | 109.2 | | |
| 11 | V | 48.7 | Very low | 53.8 | Low | 120 Ų | 120 | 140.4 Ų | 140.4 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | | | trans | -101.8 | 101.7 | 172.4 | -178.8 | 0 | 0 | 0 | 0 | 108.1 | P9 | P9-V11 PolarHBondContact O-N 3.1Å; P9-V11 VanDerWaalsContact O-N 3.17Å |
| 12 | T | 57.3 | Low | 54.5 | Low | 123 Ų | 123 | 137 Ų | 137 | 76% | 0.755 | 78% | 0.775 | S | S | * | * | | | trans | -61.7 | 136.4 | 166.4 | 33 | 0 | 0 | 0 | 0 | 109.4 | L14 | T12-L14 PolarHBondContact O-N 3.18Š|
| 13 | R | 61.8 | Low | 55.3 | Low | 190 Ų | 190 | 140.3 Ų | 140.3 | 72% | 0.717 | 78% | 0.776 | S | S | * | * | | | trans | -72.9 | 131.4 | -172 | -68 | 178.7 | 64.5 | -106.6 | -1.2 | 110 | G15 E16 | R13-G15 PolarHBondContact O-N 3.25Å; R13-E16 PolarHBondContact O-N 3.18Å |
| 14 | L | 54 | Low | 55.6 | Low | 186 Ų | 186 | 137.2 Ų | 137.2 | 97% | 0.974 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.2 | 114.8 | 174.5 | -169.5 | 76.6 | 0 | 0 | 0 | 109.6 | T12 | T12-L14 PolarHBondContact O-N 3.18Š|
| 15 | G | 59.1 | Low | 55.6 | Low | 77 Ų | 77 | 136.9 Ų | 136.9 | 79% | 0.794 | 76% | 0.764 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 109.2 | -1.5 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | R13 V17 | R13-G15 PolarHBondContact O-N 3.25Å; G15-V17 PolarHBondContact O-N 2.88Å |
| 16 | E | 48.4 | Very low | 55.8 | Low | 134 Ų | 134 | 136 Ų | 136 | 63% | 0.626 | 76% | 0.763 | S | S | * | * | | | trans | -76.8 | 114.3 | 165.9 | -168.6 | 162.8 | -170.8 | 0 | 0 | 109.4 | R13 A18 | R13-E16 PolarHBondContact O-N 3.18Å; E16-A18 PolarHBondContact O-N 3.13Å; E16-A18 VanDerWaalsContact O-N 3.17Å |
| 17 | V | 56.5 | Low | 56.2 | Low | 129 Ų | 129 | 132.8 Ų | 132.8 | 78% | 0.782 | 76% | 0.755 | S | S | * | * | | | trans | -63.5 | 116.9 | 174.9 | 175.4 | 0 | 0 | 0 | 0 | 107.6 | G15 N19 | G15-V17 PolarHBondContact O-N 2.88Å; V17-N19 PolarHBondContact O-N 3.42Å |
| 18 | A | 58.6 | Low | 56.1 | Low | 93 Ų | 93 | 132 Ų | 132 | 77% | 0.769 | 76% | 0.761 | S | S | * | * | | | trans | -58.6 | 108.8 | 171.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | E16 E20 | E16-A18 PolarHBondContact O-N 3.13Å; E16-A18 VanDerWaalsContact O-N 3.17Å; A18-E20 PolarHBondContact O-N 3.25Å |
| 19 | N | 58.6 | Low | 56.3 | Low | 138 Ų | 138 | 123.7 Ų | 123.7 | 74% | 0.738 | 74% | 0.74 | S | S | * | * | | | trans | -61.7 | 113.6 | 177.7 | -175.4 | 51.7 | 0 | 0 | 0 | 108.2 | V17 V21 | V17-N19 PolarHBondContact O-N 3.42Å; N19-V21 PolarHBondContact O-N 3.11Å |
| 20 | E | 59 | Low | 56 | Low | 168 Ų | 168 | 125.3 Ų | 125.3 | 79% | 0.785 | 75% | 0.75 | S | S | * | * | | | trans | -67.9 | 97.6 | -179.1 | -173 | 175.8 | 179.7 | 0 | 0 | 108.9 | A18 T22 | A18-E20 PolarHBondContact O-N 3.25Å; E20-T22 VanDerWaalsContact C-N 3.31Å; E20-T22 PolarHBondContact O-N 3.29Å |
| 21 | V | 54.3 | Low | 56 | Low | 118 Ų | 118 | 119.4 Ų | 119.4 | 72% | 0.715 | 74% | 0.736 | S | S | * | * | | | trans | -76.2 | 89.1 | 175.2 | -177 | 0 | 0 | 0 | 0 | 107.7 | N19 M23 | N19-V21 PolarHBondContact O-N 3.11Å; V21-M23 VanDerWaalsContact C-N 3.28Å; V21-M23 PolarHBondContact O-N 3.31Å |
| 22 | T | 62.1 | Low | 55.8 | Low | 121 Ų | 121 | 120.6 Ų | 120.6 | 74% | 0.742 | 74% | 0.737 | S | S | * | * | | | trans | -63.4 | 94.3 | 164.8 | -57 | 0 | 0 | 0 | 0 | 108.5 | E20 G24 | E20-T22 VanDerWaalsContact C-N 3.31Å; E20-T22 PolarHBondContact O-N 3.29Å; T22-G24 VanDerWaalsContact C-N 3.33Å; T22-G24 PolarHBondContact O-N 3.13Å |
| 23 | M | 59.7 | Low | 55.8 | Low | 164 Ų | 164 | 123.7 Ų | 123.7 | 81% | 0.808 | 74% | 0.743 | S | S | * | * | | | trans | -68.6 | 90.6 | 175.6 | -179.9 | 170.3 | 56.5 | 0 | 0 | 109.3 | V21 V25 | V21-M23 VanDerWaalsContact C-N 3.28Å; V21-M23 PolarHBondContact O-N 3.31Å; M23-V25 PolarHBondContact O-N 3.37Å |
| 24 | G | 58.5 | Low | 55.6 | Low | 61 Ų | 61 | 120.6 Ų | 120.6 | 63% | 0.629 | 74% | 0.741 | S | S | * | * | | | trans | -63.5 | 116.7 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | T22 A26 | T22-G24 VanDerWaalsContact C-N 3.33Å; T22-G24 PolarHBondContact O-N 3.13Å; G24-A26 VanDerWaalsContact C-N 3.28Å; G24-A26 PolarHBondContact O-N 3.18Å |
| 25 | V | 60.3 | Low | 55.7 | Low | 123 Ų | 123 | 116.5 Ų | 116.5 | 75% | 0.745 | 73% | 0.725 | S | S | * | * | | | trans | -69.2 | 91 | 168.1 | -179.6 | 0 | 0 | 0 | 0 | 107.7 | M23 A27 | M23-V25 PolarHBondContact O-N 3.37Å; V25-A27 VanDerWaalsContact C-N 3.32Å; V25-A27 PolarHBondContact O-N 3.13Å |
| 26 | A | 57.3 | Low | 55.7 | Low | 86 Ų | 86 | 118 Ų | 118 | 71% | 0.711 | 72% | 0.715 | S | S | * | * | | | trans | -68.5 | 93.7 | 168.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | G24 S28 | G24-A26 VanDerWaalsContact C-N 3.28Å; G24-A26 PolarHBondContact O-N 3.18Å; A26-S28 PolarHBondContact O-N 3.32Å |
| 27 | A | 58.6 | Low | 55.8 | Low | 64 Ų | 64 | 117.2 Ų | 117.2 | 53% | 0.529 | 71% | 0.714 | S | S | . | * | | | trans | -69.6 | 75.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | V25 S29 | V25-A27 VanDerWaalsContact C-N 3.32Å; V25-A27 PolarHBondContact O-N 3.13Å; A27-S29 PolarHBondContact O-N 2.96Å |
| 28 | S | 54 | Low | 55.7 | Low | 126 Ų | 126 | 116.8 Ų | 116.8 | 88% | 0.881 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -74.5 | 32.1 | 172.9 | 57 | 0 | 0 | 0 | 0 | 113.1 | A26 | A26-S28 PolarHBondContact O-N 3.32Š|
| 29 | S | 44.4 | Very low | 55.6 | Low | 69 Ų | 69 | 119.4 Ų | 119.4 | 48% | 0.483 | 71% | 0.707 | S | S | . | * | S | Bend | trans | -169.2 | 126.5 | 161.6 | -175.3 | 0 | 0 | 0 | 0 | 108.1 | A27 A31 | A27-S29 PolarHBondContact O-N 2.96Å; S29-A31 PolarHBondContact O-N 3.4Å |
| 30 | P | 49.3 | Very low | 55.3 | Low | 141 Ų | 141 | 119.9 Ų | 119.9 | 92% | 0.916 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -79.6 | 48.7 | 176.4 | 35.5 | -36.2 | 0 | 0 | 0 | 111.3 | | |
| 31 | A | 54.9 | Low | 55.2 | Low | 76 Ų | 76 | 113.2 Ų | 113.2 | 63% | 0.628 | 68% | 0.683 | S | S | * | * | | | trans | -136.4 | 63.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | S29 E33 | S29-A31 PolarHBondContact O-N 3.4Å; A31-E33 VanDerWaalsContact C-N 3.28Å; A31-E33 PolarHBondContact O-N 3.14Å |
| 32 | L | 45.8 | Very low | 55.2 | Low | 145 Ų | 145 | 110.3 Ų | 110.3 | 76% | 0.759 | 68% | 0.676 | S | S | * | * | | | trans | -67.2 | 92.9 | 166.2 | -73.7 | 167.8 | 0 | 0 | 0 | 107.7 | L34 | L32-L34 PolarHBondContact O-N 3.06Å; L32-L34 VanDerWaalsContact O-N 3.15Å |
| 33 | E | 57 | Low | 54.8 | Low | 188 Ų | 188 | 110.4 Ų | 110.4 | 88% | 0.879 | 68% | 0.679 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 116.2 | 158.3 | -171.4 | 170.4 | 99.6 | 0 | 0 | 106.7 | A31 | A31-E33 VanDerWaalsContact C-N 3.28Å; A31-E33 PolarHBondContact O-N 3.14Å |
| 34 | L | 56.4 | Low | 54.5 | Low | 126 Ų | 126 | 104.6 Ų | 104.6 | 66% | 0.66 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 128.7 | -174.4 | -165.5 | 76.7 | 0 | 0 | 0 | 108.1 | L32 D36 L37 | L32-L34 PolarHBondContact O-N 3.06Å; L32-L34 VanDerWaalsContact O-N 3.15Å; L34-D36 PolarHBondContact O-N 3.42Å; L34-L37 HydrophobicContact CD2-CD1 4.08Å; L34-L37 HydrophobicContact CD2-CG 4.27Å |
| 35 | P | 57.7 | Low | 54.4 | Low | 100 Ų | 100 | 112.3 Ų | 112.3 | 65% | 0.649 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 135.4 | 176.6 | 25.2 | -34 | 0 | 0 | 0 | 109 | L37 | P35-L37 PolarHBondContact O-N 3.03Š|
| 36 | D | 57.4 | Low | 54.3 | Low | 109 Ų | 109 | 113.3 Ų | 113.3 | 58% | 0.583 | 67% | 0.67 | S | S | * | * | | | trans | -48.9 | 113.9 | -174.3 | -80.3 | -44.4 | 0 | 0 | 0 | 111.1 | L34 L38 L39 | L34-D36 PolarHBondContact O-N 3.42Å; D36-L38 HydrophobicContact CB-CB 4.41Å; D36-L38 PolarHBondContact O-N 3.47Å; D36-L39 HydrophobicContact CB-CD1 4.26Å; D36-L39 HydrophobicContact CB-CG 4.46Å; D36-L39 WeakPolarHBondContact O-CB 3.5Å; D36-L39 PolarHBondContact O-N 3.46Å |
| 37 | L | 52.2 | Low | 54.2 | Low | 117 Ų | 117 | 115.9 Ų | 115.9 | 61% | 0.613 | 67% | 0.672 | S | S | * | * | G | 310 helix | trans | -59.9 | -16.7 | 174.3 | -70.1 | 168.2 | 0 | 0 | 0 | 111.9 | L34 P35 L39 L40 | L34-L37 HydrophobicContact CD2-CD1 4.08Å; L34-L37 HydrophobicContact CD2-CG 4.27Å; P35-L37 PolarHBondContact O-N 3.03Å; L37-L39 VanDerWaalsContact C-N 3.26Å; L37-L39 PolarHBondContact O-N 3.17Å; L37-L40 PolarHBondContact O-N 3.03Å |
| 38 | L | 54.7 | Low | 54 | Low | 120 Ų | 120 | 116.6 Ų | 116.6 | 63% | 0.628 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -65.9 | -22.5 | 171.1 | -58 | 175.6 | 0 | 0 | 0 | 113.3 | D36 A41 L50 | D36-L38 HydrophobicContact CB-CB 4.41Å; D36-L38 PolarHBondContact O-N 3.47Å; L38-A41 PolarHBondContact O-N 2.9Å; L38-L50 HydrophobicContact CD2-CD1 3.77Å |
| 39 | L | 54.8 | Low | 53.8 | Low | 147 Ų | 147 | 117.3 Ų | 117.3 | 77% | 0.77 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -78 | -20.5 | 173.8 | -80.4 | 162.3 | 0 | 0 | 0 | 113.4 | D36 L37 | D36-L39 HydrophobicContact CB-CD1 4.26Å; D36-L39 HydrophobicContact CB-CG 4.46Å; D36-L39 WeakPolarHBondContact O-CB 3.5Å; D36-L39 PolarHBondContact O-N 3.46Å; L37-L39 VanDerWaalsContact C-N 3.26Å; L37-L39 PolarHBondContact O-N 3.17Å |
| 40 | L | 53.8 | Low | 54.2 | Low | 148 Ų | 148 | 118.4 Ų | 118.4 | 78% | 0.775 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.6 | -20.5 | 170.6 | -86.8 | 106.4 | 0 | 0 | 0 | 112.9 | L37 G42 | L37-L40 PolarHBondContact O-N 3.03Å; L40-G42 PolarHBondContact O-N 2.97Å; L40-G42 VanDerWaalsContact O-N 3.11Å |
| 41 | A | 55.5 | Low | 54.4 | Low | 28 Ų | 28 | 118 Ų | 118 | 23% | 0.231 | 66% | 0.661 | C | S | . | * | | | trans | -86.1 | 76.3 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | L38 L50 | L38-A41 PolarHBondContact O-N 2.9Å; A41-L50 HydrophobicContact CB-CB 4.21Å; A41-L50 HydrophobicContact CB-CD1 4.31Å; A41-L50 HydrophobicContact CB-CD2 3.91Å; A41-L50 HydrophobicContact CB-CG 4.36Å |
| 42 | G | 55.8 | Low | 54.4 | Low | 57 Ų | 57 | 122 Ų | 122 | 59% | 0.588 | 67% | 0.671 | S | S | * | * | | | trans | -54.9 | 142 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111 | L40 A44 | L40-G42 PolarHBondContact O-N 2.97Å; L40-G42 VanDerWaalsContact O-N 3.11Å; G42-A44 PolarHBondContact O-N 3.07Å |
| 43 | P | 52.7 | Low | 54.7 | Low | 123 Ų | 123 | 124.4 Ų | 124.4 | 80% | 0.799 | 68% | 0.676 | S | S | * | * | | | trans | -63.9 | 113.6 | -172.8 | 24.8 | -33.8 | 0 | 0 | 0 | 111.1 | K45 | P43-K45 PolarHBondContact O-N 2.96Š|
| 44 | A | 53 | Low | 54.5 | Low | 43 Ų | 43 | 118.8 Ų | 118.8 | 36% | 0.355 | 67% | 0.668 | S | S | . | * | | | trans | -61.3 | 131.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | G42 E46 | G42-A44 PolarHBondContact O-N 3.07Å; A44-E46 PolarHBondContact O-N 3.17Å |
| 45 | K | 56.4 | Low | 53.6 | Low | 222 Ų | 222 | 119.1 Ų | 119.1 | 97% | 0.965 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 9.1 | -169.7 | -144.2 | -173.6 | -178.2 | -175.5 | 0 | 114.6 | P43 | P43-K45 PolarHBondContact O-N 2.96Š|
| 46 | E | 58.9 | Low | 52.8 | Low | 144 Ų | 144 | 117.9 Ų | 117.9 | 67% | 0.673 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -140.4 | 118 | -179.6 | -176.7 | 168 | 177.1 | 0 | 0 | 108.9 | A44 G48 | A44-E46 PolarHBondContact O-N 3.17Å; E46-G48 PolarHBondContact O-N 2.85Å |
| 47 | N | 55.3 | Low | 52.2 | Low | 140 Ų | 140 | 118.9 Ų | 118.9 | 75% | 0.749 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 66.6 | 28.8 | 161 | -47.6 | -18.2 | 0 | 0 | 0 | 118.5 | H49 | N47-H49 PolarHBondContact O-N 2.9Š|
| 48 | G | 54.6 | Low | 51.3 | Low | 80 Ų | 80 | 122.3 Ų | 122.3 | 83% | 0.825 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 63.7 | 8.2 | 155.1 | 0 | 0 | 0 | 0 | 0 | 117.9 | E46 | E46-G48 PolarHBondContact O-N 2.85Š|
| 49 | H | 49.7 | Very low | 50.6 | Low | 140 Ų | 140 | 120.9 Ų | 120.9 | 65% | 0.648 | 71% | 0.71 | S | S | * | * | | | trans | -101.1 | 124.3 | -179.2 | -169.9 | -75.5 | 0 | 0 | 0 | 110.2 | N47 Q51 | N47-H49 PolarHBondContact O-N 2.9Å; H49-Q51 PolarHBondContact O-N 3.21Å |
| 50 | L | 51.7 | Low | 49.7 | Very low | 92 Ų | 92 | 125.2 Ų | 125.2 | 48% | 0.482 | 72% | 0.716 | S | S | . | * | | | trans | -69.7 | 114 | 176.5 | -55.9 | 178 | 0 | 0 | 0 | 109.1 | L38 A41 | L38-L50 HydrophobicContact CD2-CD1 3.77Å; A41-L50 HydrophobicContact CB-CB 4.21Å; A41-L50 HydrophobicContact CB-CD1 4.31Å; A41-L50 HydrophobicContact CB-CD2 3.91Å; A41-L50 HydrophobicContact CB-CG 4.36Å |
| 51 | Q | 55 | Low | 49.5 | Very low | 132 Ų | 132 | 123.3 Ų | 123.3 | 62% | 0.617 | 71% | 0.712 | S | S | * | * | | | trans | -93.8 | 109.3 | 175.2 | -71.3 | -170.5 | 61.6 | 0 | 0 | 109.8 | H49 F53 | H49-Q51 PolarHBondContact O-N 3.21Å; Q51-F53 PolarHBondContact O-N 2.89Å |
| 52 | L | 54.8 | Low | 48.5 | Very low | 161 Ų | 161 | 130.4 Ų | 130.4 | 84% | 0.843 | 74% | 0.741 | S | S | * | * | | | trans | -83 | 111.1 | 172 | -173.6 | 66.9 | 0 | 0 | 0 | 109.2 | G54 | L52-G54 PolarHBondContact O-N 3.47Š|
| 53 | F | 51.9 | Low | 47.6 | Very low | 196 Ų | 196 | 132.9 Ų | 132.9 | 86% | 0.86 | 75% | 0.745 | S | S | * | * | | | trans | -70.3 | 109.6 | 175.7 | -76.4 | -87.1 | 0 | 0 | 0 | 110.6 | Q51 | Q51-F53 PolarHBondContact O-N 2.89Š|
| 54 | G | 52.1 | Low | 47 | Very low | 69 Ų | 69 | 135.7 Ų | 135.7 | 71% | 0.711 | 75% | 0.747 | S | S | * | * | | | trans | 136 | 62.4 | 163.7 | 0 | 0 | 0 | 0 | 0 | 117.5 | L52 | L52-G54 PolarHBondContact O-N 3.47Š|
| 55 | C | 38.4 | Very low | 46.2 | Very low | 133 Ų | 133 | 138.7 Ų | 138.7 | 90% | 0.899 | 77% | 0.765 | S | S | * | * | | | trans | -159.4 | 129.2 | 143.6 | -97.6 | 0 | 0 | 0 | 0 | 108.9 | | |
| 56 | G | 41.2 | Very low | 45.6 | Very low | 74 Ų | 74 | 133.4 Ų | 133.4 | 76% | 0.763 | 76% | 0.756 | S | S | * | * | | | trans | -74.7 | 152 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | | |
| 57 | P | 43.4 | Very low | 44.6 | Very low | 130 Ų | 130 | 131.2 Ų | 131.2 | 84% | 0.844 | 76% | 0.763 | S | S | * | * | | | trans | -80.4 | 123.5 | 178.8 | 31.9 | -32.2 | 0 | 0 | 0 | 110.9 | | |
| 58 | H | 33.6 | Very low | 44.5 | Very low | 189 Ų | 189 | 130.8 Ų | 130.8 | 88% | 0.875 | 77% | 0.771 | S | S | * | * | | | trans | -105.6 | 112.6 | 154.2 | -156 | 72.9 | 0 | 0 | 0 | 109.1 | | |
| 59 | S | 40.8 | Very low | 43.6 | Very low | 90 Ų | 90 | 130.7 Ų | 130.7 | 63% | 0.629 | 77% | 0.77 | S | S | * | * | | | trans | -78.3 | 143.7 | 179.9 | 47.7 | 0 | 0 | 0 | 0 | 111.6 | | |
| 60 | R | 34.4 | Very low | 43.1 | Very low | 238 Ų | 238 | 129.4 Ų | 129.4 | 90% | 0.898 | 78% | 0.775 | S | S | * | * | | | | -172.3 | 147.9 | 116.7 | -106 | 175.2 | 156 | 149.4 | -5.4 | 112.6 | | |
| 61 | P | 50.6 | Low | 42.7 | Very low | 108 Ų | 108 | 128.7 Ų | 128.7 | 70% | 0.701 | 79% | 0.79 | S | S | * | * | | | trans | -87.4 | -178.9 | 169.1 | 36.9 | -32.1 | 0 | 0 | 0 | 111.3 | | |
| 62 | E | 34.6 | Very low | 41.8 | Very low | 178 Ų | 178 | 127.7 Ų | 127.7 | 83% | 0.832 | 80% | 0.797 | S | S | * | * | | | trans | 76.9 | 136.2 | 171.9 | -52.4 | -162.5 | 154.7 | 0 | 0 | 113.6 | | |
| 63 | T | 36.9 | Very low | 41.4 | Very low | 109 Ų | 109 | 125.1 Ų | 125.1 | 67% | 0.669 | 79% | 0.792 | S | S | * | * | | | cis | -165.3 | 150.5 | 2.5 | -117.7 | 0 | 0 | 0 | 0 | 111.2 | | |
| 64 | E | 39.4 | Very low | 41.2 | Very low | 182 Ų | 182 | 122.4 Ų | 122.4 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | | | trans | 70 | 152.9 | 169.1 | -23.7 | -166.3 | 126.6 | 0 | 0 | 123 | | |
| 65 | S | 35.9 | Very low | 40.6 | Very low | 105 Ų | 105 | 123.3 Ų | 123.3 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | | | trans | 79.8 | 97.3 | 156.6 | -145.6 | 0 | 0 | 0 | 0 | 121 | | |
| 66 | S | 44.8 | Very low | 40.3 | Very low | 111 Ų | 111 | 122.8 Ų | 122.8 | 78% | 0.776 | 79% | 0.789 | S | S | * | * | | | | 61.8 | 89.4 | 123.2 | -44.3 | 0 | 0 | 0 | 0 | 120.2 | | |
| 67 | A | 38.4 | Very low | 40.3 | Very low | 98 Ų | 98 | 123.8 Ų | 123.8 | 81% | 0.81 | 79% | 0.79 | S | S | * | * | | | | -172.8 | 119.2 | 122 | 0 | 0 | 0 | 0 | 0 | 113.9 | | |
| 68 | S | 52.5 | Low | 40 | Very low | 131 Ų | 131 | 122.9 Ų | 122.9 | 92% | 0.916 | 79% | 0.787 | S | S | * | * | | | trans | 29 | 104.1 | 141.4 | -161.4 | 0 | 0 | 0 | 0 | 119.5 | | |
| 69 | G | 35 | Very low | 40.5 | Very low | 78 Ų | 78 | 119.1 Ų | 119.1 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | | | trans | -165.7 | 54.2 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | G71 | G69-G71 PolarHBondContact O-N 3.21Š|
| 70 | C | 38.9 | Very low | 40.3 | Very low | 114 Ų | 114 | 122.1 Ų | 122.1 | 77% | 0.77 | 79% | 0.79 | S | S | * | * | | | trans | -67.7 | 104.3 | -174.3 | -171.8 | 0 | 0 | 0 | 0 | 111.9 | C72 | C70-C72 PolarHBondContact O-N 2.89Š|
| 71 | G | 44.4 | Very low | 40.8 | Very low | 77 Ų | 77 | 117.9 Ų | 117.9 | 79% | 0.794 | 78% | 0.784 | S | S | * | * | | | trans | -77.6 | 94.3 | 161.6 | 0 | 0 | 0 | 0 | 0 | 110.1 | G69 S73 | G69-G71 PolarHBondContact O-N 3.21Å; G71-S73 PolarHBondContact O-N 3.4Å |
| 72 | C | 36.7 | Very low | 40.4 | Very low | 111 Ų | 111 | 120.3 Ų | 120.3 | 75% | 0.75 | 79% | 0.79 | S | S | * | * | | | trans | -92.6 | 88.5 | 173.5 | 42.4 | 0 | 0 | 0 | 0 | 111.3 | C70 | C70-C72 PolarHBondContact O-N 2.89Š|
| 73 | S | 44.8 | Very low | 40.5 | Very low | 106 Ų | 106 | 119 Ų | 119 | 74% | 0.741 | 79% | 0.788 | S | S | * | * | | | trans | -73.6 | 135.2 | 156.4 | -79 | 0 | 0 | 0 | 0 | 110.1 | G71 | G71-S73 PolarHBondContact O-N 3.4Š|
| 74 | T | 47.9 | Very low | 40.4 | Very low | 139 Ų | 139 | 119.7 Ų | 119.7 | 85% | 0.853 | 80% | 0.796 | S | S | * | * | | | trans | 75.1 | 141.5 | 166 | 64 | 0 | 0 | 0 | 0 | 120.4 | | |
| 75 | A | 39 | Very low | 40.5 | Very low | 89 Ų | 89 | 116.9 Ų | 116.9 | 74% | 0.736 | 79% | 0.794 | S | S | * | * | | | trans | 88.8 | 106.1 | 156.5 | 0 | 0 | 0 | 0 | 0 | 120.1 | | |
| 76 | C | 33.4 | Very low | 41.1 | Very low | 122 Ų | 122 | 117.1 Ų | 117.1 | 82% | 0.824 | 80% | 0.795 | S | S | * | * | | | | 62.7 | 103.1 | 128.3 | -65 | 0 | 0 | 0 | 0 | 121.2 | | |
| 77 | A | 39.9 | Very low | 41 | Very low | 95 Ų | 95 | 123 Ų | 123 | 79% | 0.785 | 80% | 0.801 | S | S | * | * | | | | 73.1 | 147.3 | 118.3 | 0 | 0 | 0 | 0 | 0 | 121.2 | | |
| 78 | S | 38.6 | Very low | 41.7 | Very low | 110 Ų | 110 | 128.9 Ų | 128.9 | 77% | 0.769 | 80% | 0.802 | S | S | * | * | | | trans | 79.9 | 81.8 | 163.4 | -56.5 | 0 | 0 | 0 | 0 | 118 | | |
| 79 | S | 43.3 | Very low | 41.4 | Very low | 110 Ų | 110 | 127.5 Ų | 127.5 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | | | | 53.2 | 113.4 | 120.9 | -54.8 | 0 | 0 | 0 | 0 | 120.5 | | |
| 80 | L | 36.3 | Very low | 42.4 | Very low | 154 Ų | 154 | 132.9 Ų | 132.9 | 81% | 0.806 | 79% | 0.793 | S | S | * | * | | | | 155.2 | 82.9 | 126.3 | -81.5 | 167.8 | 0 | 0 | 0 | 107.4 | | |
| 81 | L | 46.1 | Very low | 43.3 | Very low | 148 Ų | 148 | 132.2 Ų | 132.2 | 78% | 0.775 | 79% | 0.79 | S | S | * | * | | | | 83.1 | 133.7 | 92.7 | -86.5 | -174.1 | 0 | 0 | 0 | 114 | | |
| 82 | L | 41.7 | Very low | 43.7 | Very low | 159 Ų | 159 | 134.5 Ų | 134.5 | 83% | 0.832 | 79% | 0.791 | S | S | * | * | | | trans | 76.1 | 129.5 | 173.2 | -49.3 | 162.6 | 0 | 0 | 0 | 114 | | |
| 83 | L | 36.7 | Very low | 45 | Very low | 150 Ų | 150 | 138.8 Ų | 138.8 | 79% | 0.785 | 80% | 0.797 | S | S | * | * | | | cis | -150.1 | 120.6 | 13.2 | -171.5 | 69.7 | 0 | 0 | 0 | 111.2 | | |
| 84 | C | 35.7 | Very low | 45.9 | Very low | 124 Ų | 124 | 137.7 Ų | 137.7 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | | | trans | -91.1 | 121.9 | 172.5 | -63.1 | 0 | 0 | 0 | 0 | 111.1 | S86 | C84-S86 PolarHBondContact O-N 3.18Š|
| 85 | P | 40 | Very low | 46.5 | Very low | 123 Ų | 123 | 142.3 Ų | 142.3 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | | | trans | -74.5 | 116.4 | 159.2 | -6.6 | 24.1 | 0 | 0 | 0 | 108.6 | R87 | P85-R87 PolarHBondContact O-N 2.95Å; P85-R87 VanDerWaalsContact O-N 3.1Å |
| 86 | S | 48.7 | Very low | 47.8 | Very low | 110 Ų | 110 | 146.5 Ų | 146.5 | 77% | 0.769 | 80% | 0.798 | S | S | * | * | | | trans | -53.5 | 113.8 | 177.5 | -178.6 | 0 | 0 | 0 | 0 | 112 | C84 | C84-S86 PolarHBondContact O-N 3.18Š|
| 87 | R | 44.2 | Very low | 48.5 | Very low | 235 Ų | 235 | 145 Ų | 145 | 89% | 0.887 | 79% | 0.786 | S | S | * | * | | | trans | -117.8 | 86.7 | 159.5 | -133.2 | -173.3 | -63.3 | -100.5 | 5.7 | 108.2 | P85 S89 | P85-R87 PolarHBondContact O-N 2.95Å; P85-R87 VanDerWaalsContact O-N 3.1Å; R87-S89 PolarHBondContact O-N 3.49Å |
| 88 | R | 52 | Low | 49.8 | Very low | 222 Ų | 222 | 145.7 Ų | 145.7 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | | | trans | -68 | 77 | 169.9 | -172.8 | -170.7 | -67.6 | -107.1 | 2.1 | 108.7 | K90 | R88-K90 PolarHBondContact O-N 2.8Š|
| 89 | S | 46.5 | Very low | 51.2 | Low | 102 Ų | 102 | 147.6 Ų | 147.6 | 71% | 0.713 | 78% | 0.778 | S | S | * | * | | | trans | -60.4 | 119.5 | 162.5 | 52.7 | 0 | 0 | 0 | 0 | 106.9 | R87 S91 | R87-S89 PolarHBondContact O-N 3.49Å; S89-S91 PolarHBondContact O-N 2.94Å; S89-S91 VanDerWaalsContact O-N 3.15Å |
| 90 | K | 56.1 | Low | 52.5 | Low | 190 Ų | 190 | 146.7 Ų | 146.7 | 83% | 0.826 | 77% | 0.768 | S | S | * | * | | | trans | -64.6 | 114.8 | 162.1 | -69.1 | 175.4 | 179.9 | 174.8 | 0 | 104.5 | R88 | R88-K90 PolarHBondContact O-N 2.8Š|
| 91 | S | 58.3 | Low | 53.4 | Low | 101 Ų | 101 | 145.2 Ų | 145.2 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | | | trans | -53.6 | 125.4 | 175.6 | 44.1 | 0 | 0 | 0 | 0 | 108.2 | S89 K93 | S89-S91 PolarHBondContact O-N 2.94Å; S89-S91 VanDerWaalsContact O-N 3.15Å; S91-K93 PolarHBondContact O-N 3.05Å; S91-K93 VanDerWaalsContact O-N 3.09Å |
| 92 | P | 52.9 | Low | 54.4 | Low | 125 Ų | 125 | 147.9 Ų | 147.9 | 81% | 0.812 | 77% | 0.768 | S | S | * | * | | | trans | -58.2 | 123.1 | 171.1 | 24.1 | -31.2 | 0 | 0 | 0 | 106.7 | A94 | P92-A94 PolarHBondContact O-N 3.11Š|
| 93 | K | 62.9 | Low | 55.5 | Low | 200 Ų | 200 | 146.4 Ų | 146.4 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | | | trans | -63.1 | 113.2 | -175.6 | -176.1 | 171.9 | -179.2 | 178 | 0 | 107.4 | S91 W95 | S91-K93 PolarHBondContact O-N 3.05Å; S91-K93 VanDerWaalsContact O-N 3.09Å; K93-W95 PolarHBondContact O-N 3.49Å; K93-W95 VanDerWaalsContact O-N 3.09Å |
| 94 | A | 64.8 | Low | 56.3 | Low | 84 Ų | 84 | 147.2 Ų | 147.2 | 69% | 0.694 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -51.5 | 120.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | P92 K96 | P92-A94 PolarHBondContact O-N 3.11Å; A94-K96 PolarHBondContact O-N 3.44Å |
| 95 | W | 59.8 | Low | 57 | Low | 235 Ų | 235 | 148.2 Ų | 148.2 | 89% | 0.89 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 118.5 | 177.2 | 178.4 | 3.5 | 0 | 0 | 0 | 107.9 | K93 | K93-W95 PolarHBondContact O-N 3.49Å; K93-W95 VanDerWaalsContact O-N 3.09Å |
| 96 | K | 66.1 | Low | 57.8 | Low | 178 Ų | 178 | 148.3 Ų | 148.3 | 77% | 0.774 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 123.3 | 165.2 | -68.2 | -176.1 | 171.7 | -172 | 0 | 108 | A94 D98 | A94-K96 PolarHBondContact O-N 3.44Å; K96-D98 PolarHBondContact O-N 2.86Å |
| 97 | P | 47.8 | Very low | 58.2 | Low | 89 Ų | 89 | 144.4 Ų | 144.4 | 58% | 0.578 | 75% | 0.75 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 135.7 | 170.4 | 26.6 | -32.9 | 0 | 0 | 0 | 108.8 | L99 | P97-L99 HydrophobicContact CB-CD2 4.4Å; P97-L99 HydrophobicContact CG-CD2 4.47Å; P97-L99 PolarHBondContact O-N 3.28Å |
| 98 | D | 68.3 | Low | 58.8 | Low | 110 Ų | 110 | 140.2 Ų | 140.2 | 59% | 0.588 | 74% | 0.744 | S | S | * | * | | | trans | -76.1 | 106.2 | 173.6 | -176.6 | 3.4 | 0 | 0 | 0 | 108.3 | K96 T100 | K96-D98 PolarHBondContact O-N 2.86Å; D98-T100 VanDerWaalsContact C-N 3.31Å; D98-T100 VanDerWaalsContact CG-OG1 3.25Å; D98-T100 VanDerWaalsContact OD1-CB 3.3Å; D98-T100 WeakPolarHBondContact OD1-CB 3.45Å; D98-T100 VanDerWaalsContact OD1-CG2 3.29Å; D98-T100 WeakPolarHBondContact OD1-CG2 3.46Å; D98-T100 PolarHBondContact OD1-N 3.33Å; D98-T100 PolarHBondContact OD1-OG1 3Å; D98-T100 PolarHBondContact OD2-OG1 2.99Å |
| 99 | L | 66.9 | Low | 58.9 | Low | 150 Ų | 150 | 135.3 Ų | 135.3 | 79% | 0.785 | 75% | 0.745 | S | S | * | * | | | trans | -92.3 | 13.1 | 178.6 | -59.3 | -180 | 0 | 0 | 0 | 112.2 | P97 P101 | P97-L99 HydrophobicContact CB-CD2 4.4Å; P97-L99 HydrophobicContact CG-CD2 4.47Å; P97-L99 PolarHBondContact O-N 3.28Å; L99-P101 WeakPolarHBondContact O-CD 3.49Å |
| 100 | T | 70.6 | Confident | 59.7 | Low | 91 Ų | 91 | 139.3 Ų | 139.3 | 56% | 0.558 | 75% | 0.752 | S | S | * | * | | | trans | -67.5 | 121.1 | 176.8 | 55.9 | 0 | 0 | 0 | 0 | 110.5 | D98 R102 | D98-T100 VanDerWaalsContact C-N 3.31Å; D98-T100 VanDerWaalsContact CG-OG1 3.25Å; D98-T100 VanDerWaalsContact OD1-CB 3.3Å; D98-T100 WeakPolarHBondContact OD1-CB 3.45Å; D98-T100 VanDerWaalsContact OD1-CG2 3.29Å; D98-T100 WeakPolarHBondContact OD1-CG2 3.46Å; D98-T100 PolarHBondContact OD1-N 3.33Å; D98-T100 PolarHBondContact OD1-OG1 3Å; D98-T100 PolarHBondContact OD2-OG1 2.99Å; T100-R102 PolarHBondContact O-N 3.15Å; T100-R102 VanDerWaalsContact O-N 3.08Å |
| 101 | P | 56.4 | Low | 59.5 | Low | 124 Ų | 124 | 135.5 Ų | 135.5 | 81% | 0.805 | 75% | 0.749 | S | S | * | * | | | trans | -68.8 | 111 | 171.9 | -7.6 | 22.8 | 0 | 0 | 0 | 107.5 | L99 | L99-P101 WeakPolarHBondContact O-CD 3.49Š|
| 102 | R | 66.9 | Low | 59.4 | Low | 204 Ų | 204 | 136.7 Ų | 136.7 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | | | trans | -69 | 133.2 | 172 | -63.1 | -160.7 | -175.3 | -149.4 | 3.2 | 108.8 | T100 L104 | T100-R102 PolarHBondContact O-N 3.15Å; T100-R102 VanDerWaalsContact O-N 3.08Å; R102-L104 PolarHBondContact O-N 2.95Å |
| 103 | P | 64.3 | Low | 59.6 | Low | 127 Ų | 127 | 135.5 Ų | 135.5 | 83% | 0.825 | 75% | 0.752 | S | S | * | * | | | trans | -56.5 | 125.9 | 169.8 | -21.7 | 32.5 | 0 | 0 | 0 | 109.2 | N105 | P103-N105 PolarHBondContact O-N 2.88Š|
| 104 | L | 53.3 | Low | 59.2 | Low | 168 Ų | 168 | 133.8 Ų | 133.8 | 88% | 0.88 | 75% | 0.751 | S | S | * | * | | | trans | -69.4 | 113.9 | 171.4 | -67.1 | 171.1 | 0 | 0 | 0 | 107.3 | R102 S106 | R102-L104 PolarHBondContact O-N 2.95Å; L104-S106 PolarHBondContact O-N 3.02Å; L104-S106 VanDerWaalsContact O-N 3.08Å |
| 105 | N | 49.9 | Very low | 58.7 | Low | 145 Ų | 145 | 138.2 Ų | 138.2 | 78% | 0.775 | 76% | 0.762 | S | S | * | * | | | trans | -66.1 | 109.3 | 176.6 | -173.8 | 25.2 | 0 | 0 | 0 | 109.3 | P103 G107 | P103-N105 PolarHBondContact O-N 2.88Å; N105-G107 PolarHBondContact ND2-O 2.95Å; N105-G107 PolarHBondContact O-N 3.39Å |
| 106 | S | 57.1 | Low | 58.6 | Low | 124 Ų | 124 | 136.3 Ų | 136.3 | 87% | 0.867 | 76% | 0.763 | S | S | * | * | | | trans | -89.5 | 78 | 177.3 | 57.6 | 0 | 0 | 0 | 0 | 110.1 | L104 | L104-S106 PolarHBondContact O-N 3.02Å; L104-S106 VanDerWaalsContact O-N 3.08Å |
| 107 | G | 57.3 | Low | 57.9 | Low | 29 Ų | 29 | 131 Ų | 131 | 30% | 0.299 | 76% | 0.759 | S | S | . | * | | | trans | 158.6 | 131.4 | -177 | 0 | 0 | 0 | 0 | 0 | 107.9 | N105 | N105-G107 PolarHBondContact ND2-O 2.95Å; N105-G107 PolarHBondContact O-N 3.39Å |
| 108 | D | 57.8 | Low | 58.2 | Low | 146 Ų | 146 | 134.4 Ų | 134.4 | 78% | 0.781 | 77% | 0.767 | S | S | * | * | | | cis | -138.3 | 146.2 | 15 | -50 | -57.5 | 0 | 0 | 0 | 109.6 | | |
| 109 | S | 53.4 | Low | 57.8 | Low | 120 Ų | 120 | 141 Ų | 141 | 84% | 0.839 | 78% | 0.784 | S | S | * | * | | | trans | -140.3 | 74 | 176.9 | -72.7 | 0 | 0 | 0 | 0 | 111.1 | S111 | S109-S111 PolarHBondContact O-N 3.42Š|
| 110 | E | 63 | Low | 57 | Low | 185 Ų | 185 | 140.6 Ų | 140.6 | 86% | 0.864 | 78% | 0.78 | S | S | * | * | | | trans | -74.6 | 97.9 | 164.6 | 52.9 | -168.3 | 94.6 | 0 | 0 | 110 | | |
| 111 | S | 51.5 | Low | 56.4 | Low | 110 Ų | 110 | 141.9 Ų | 141.9 | 77% | 0.769 | 79% | 0.787 | S | S | * | * | | | trans | -142.6 | 62.5 | 177.8 | -72.7 | 0 | 0 | 0 | 0 | 110.9 | S109 | S109-S111 PolarHBondContact O-N 3.42Š|
| 112 | S | 56.3 | Low | 56.2 | Low | 127 Ų | 127 | 147.6 Ų | 147.6 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | | | trans | -119.1 | 90.3 | 179.2 | -71 | 0 | 0 | 0 | 0 | 111.5 | | |
| 113 | S | 56.6 | Low | 55.6 | Low | 100 Ų | 100 | 144.2 Ų | 144.2 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | | | trans | -158.4 | -21.7 | 164 | 63.5 | 0 | 0 | 0 | 0 | 115.6 | L115 | S113-L115 PolarHBondContact O-N 3.21Š|
| 114 | I | 56.3 | Low | 55.1 | Low | 163 Ų | 163 | 147.2 Ų | 147.2 | 84% | 0.836 | 79% | 0.793 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81 | 18.1 | -164.4 | -47.3 | 173.3 | 0 | 0 | 0 | 114.1 | | |
| 115 | L | 52.4 | Low | 54.9 | Low | 177 Ų | 177 | 144.7 Ų | 144.7 | 93% | 0.927 | 79% | 0.79 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -135.1 | 23.6 | -177.3 | -73.7 | 178.2 | 0 | 0 | 0 | 116.1 | S113 | S113-L115 PolarHBondContact O-N 3.21Š|
| 116 | Q | 57.5 | Low | 55.3 | Low | 195 Ų | 195 | 144 Ų | 144 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -102.3 | 7.2 | 177 | -139.7 | 171.5 | 22.7 | 0 | 0 | 115 | | |
| 117 | G | 52.2 | Low | 55.2 | Low | 68 Ų | 68 | 144 Ų | 144 | 70% | 0.701 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -106.2 | -14.7 | -165.6 | 0 | 0 | 0 | 0 | 0 | 118.8 | | |
| 118 | H | 53.7 | Low | 54.9 | Low | 159 Ų | 159 | 147.2 Ų | 147.2 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | | | trans | -130.7 | 73.1 | -168.7 | -108.6 | -94.9 | 0 | 0 | 0 | 114.7 | M120 | H118-M120 WeakPolarHBondContact ND1-CG 3.5Å; H118-M120 PolarHBondContact O-N 2.87Å |
| 119 | R | 60.3 | Low | 54.9 | Low | 249 Ų | 249 | 148.6 Ų | 148.6 | 94% | 0.94 | 80% | 0.798 | S | S | * | * | | | trans | -89.6 | 81.7 | 162.5 | -169.5 | -177.6 | -176.3 | -166 | 0.4 | 109.3 | | |
| 120 | M | 50.9 | Low | 55.1 | Low | 142 Ų | 142 | 145.5 Ų | 145.5 | 70% | 0.7 | 79% | 0.785 | S | S | * | * | | | trans | -98.1 | 120.8 | 172.8 | -70.1 | -65.7 | 177 | 0 | 0 | 110.2 | H118 R122 | H118-M120 WeakPolarHBondContact ND1-CG 3.5Å; H118-M120 PolarHBondContact O-N 2.87Å; M120-R122 PolarHBondContact O-N 3.23Å |
| 121 | T | 57.8 | Low | 54.8 | Low | 118 Ų | 118 | 144.1 Ų | 144.1 | 72% | 0.724 | 77% | 0.772 | S | S | * | * | | | trans | -62.6 | 127.3 | 174 | 22.9 | 0 | 0 | 0 | 0 | 110.7 | D123 | T121-D123 PolarHBondContact O-N 3.42Š|
| 122 | R | 51.7 | Low | 55.3 | Low | 244 Ų | 244 | 141.4 Ų | 141.4 | 92% | 0.921 | 76% | 0.755 | S | S | * | * | | | trans | -86.4 | 86 | 178.1 | -176.8 | -173.2 | 172.9 | 103.5 | -1.3 | 109.7 | M120 | M120-R122 PolarHBondContact O-N 3.23Š|
| 123 | D | 53.2 | Low | 55.5 | Low | 132 Ų | 132 | 140.1 Ų | 140.1 | 71% | 0.706 | 74% | 0.739 | S | S | * | * | | | trans | -77.1 | 136.3 | 178.5 | -68.9 | -35.6 | 0 | 0 | 0 | 113.1 | T121 S125 | T121-D123 PolarHBondContact O-N 3.42Å; D123-S125 PolarHBondContact O-N 3.27Å |
| 124 | Q | 53.8 | Low | 55.9 | Low | 191 Ų | 191 | 141 Ų | 141 | 89% | 0.893 | 73% | 0.732 | S | S | * | * | | | trans | -40.8 | 79.2 | 169.4 | 66.3 | 157.4 | 14.6 | 0 | 0 | 116.9 | T126 | Q124-T126 PolarHBondContact O-N 3.03Š|
| 125 | S | 50.5 | Low | 56.2 | Low | 115 Ų | 115 | 137.8 Ų | 137.8 | 80% | 0.804 | 72% | 0.715 | S | S | * | * | | | trans | -79.1 | 82.3 | 171 | -166 | 0 | 0 | 0 | 0 | 112.1 | D123 L127 | D123-S125 PolarHBondContact O-N 3.27Å; S125-L127 PolarHBondContact O-N 3.22Å |
| 126 | T | 59 | Low | 56.7 | Low | 130 Ų | 130 | 134.7 Ų | 134.7 | 80% | 0.798 | 70% | 0.699 | S | S | * | * | | | trans | -76.6 | 111.9 | 162.8 | 28.8 | 0 | 0 | 0 | 0 | 109.7 | Q124 | Q124-T126 PolarHBondContact O-N 3.03Š|
| 127 | L | 53.1 | Low | 57.1 | Low | 124 Ų | 124 | 133.6 Ų | 133.6 | 65% | 0.649 | 69% | 0.691 | S | S | * | * | | | trans | -71.3 | 125.6 | -177.6 | -152.6 | 158.3 | 0 | 0 | 0 | 109.7 | S125 Q129 R131 | S125-L127 PolarHBondContact O-N 3.22Å; L127-Q129 PolarHBondContact O-N 3.08Å; L127-R131 HydrophobicContact CD2-CB 4.09Å |
| 128 | P | 52.5 | Low | 57.8 | Low | 96 Ų | 96 | 137.4 Ų | 137.4 | 62% | 0.623 | 70% | 0.695 | S | S | * | * | | | trans | -69.2 | 129.2 | -175.3 | 25.9 | -33.7 | 0 | 0 | 0 | 111.6 | G130 R131 | P128-G130 PolarHBondContact O-N 3.02Å; P128-R131 PolarHBondContact O-N 3.09Å; P128-R131 VanDerWaalsContact O-N 3.14Å |
| 129 | Q | 57.8 | Low | 58.6 | Low | 176 Ų | 176 | 134.6 Ų | 134.6 | 82% | 0.822 | 68% | 0.684 | S | S | * | * | G | 310 helix | trans | -49.3 | -31 | -171 | -161.3 | 76.3 | 2.9 | 0 | 0 | 114.8 | L127 R131 | L127-Q129 PolarHBondContact O-N 3.08Å; Q129-R131 VanDerWaalsContact C-N 3.3Å; Q129-R131 PolarHBondContact O-N 3.22Å |
| 130 | G | 58 | Low | 59.1 | Low | 55 Ų | 55 | 132 Ų | 132 | 57% | 0.567 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -73.2 | -8.6 | -176.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | P128 | P128-G130 PolarHBondContact O-N 3.02Š|
| 131 | R | 56.2 | Low | 60.2 | Low | 156 Ų | 156 | 130.9 Ų | 130.9 | 59% | 0.589 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -83.5 | -15.2 | -179.7 | -152.3 | -179 | -173.9 | -151.8 | 1.4 | 113.8 | L127 P128 Q129 D133 I135 | L127-R131 HydrophobicContact CD2-CB 4.09Å; P128-R131 PolarHBondContact O-N 3.09Å; P128-R131 VanDerWaalsContact O-N 3.14Å; Q129-R131 VanDerWaalsContact C-N 3.3Å; Q129-R131 PolarHBondContact O-N 3.22Å; R131-D133 VanDerWaalsContact C-N 3.35Å; R131-I135 WeakPolarHBondContact O-CG1 3.45Å |
| 132 | A | 61.2 | Low | 60.3 | Low | 52 Ų | 52 | 129.4 Ų | 129.4 | 43% | 0.43 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -64.7 | -39.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | E134 I135 L136 | A132-E134 VanDerWaalsContact C-N 3.31Å; A132-E134 PolarHBondContact O-N 3.44Å; A132-I135 WeakPolarHBondContact O-CB 3.41Å; A132-I135 PolarHBondContact O-N 3.18Å; A132-I135 VanDerWaalsContact O-N 3.13Å; A132-L136 PolarHBondContact O-N 3.21Å; A132-L136 VanDerWaalsContact O-N 3.13Å |
| 133 | D | 61 | Low | 61.2 | Low | 100 Ų | 100 | 123.5 Ų | 123.5 | 54% | 0.535 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -69.1 | -28.6 | -175.5 | -55.9 | -37.9 | 0 | 0 | 0 | 112.8 | R131 K137 | R131-D133 VanDerWaalsContact C-N 3.35Å; D133-K137 WeakPolarHBondContact O-CG 3.3Å; D133-K137 PolarHBondContact O-N 3.09Å |
| 134 | E | 64.1 | Low | 61.5 | Low | 118 Ų | 118 | 125 Ų | 125 | 55% | 0.551 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -70.3 | -36.7 | 172.4 | -63.4 | -169.3 | 145.1 | 0 | 0 | 112.3 | A132 L136 K137 | A132-E134 VanDerWaalsContact C-N 3.31Å; A132-E134 PolarHBondContact O-N 3.44Å; E134-L136 VanDerWaalsContact C-N 3.33Å; E134-K137 WeakPolarHBondContact O-CB 3.29Å; E134-K137 PolarHBondContact O-N 3.04Å |
| 135 | I | 63.3 | Low | 62.1 | Low | 97 Ų | 97 | 127.8 Ų | 127.8 | 50% | 0.497 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -65.7 | -40.6 | 176.6 | -63 | 166.6 | 0 | 0 | 0 | 109.7 | R131 A132 K137 L138 | R131-I135 WeakPolarHBondContact O-CG1 3.45Å; A132-I135 WeakPolarHBondContact O-CB 3.41Å; A132-I135 PolarHBondContact O-N 3.18Å; A132-I135 VanDerWaalsContact O-N 3.13Å; I135-K137 VanDerWaalsContact C-N 3.32Å; I135-K137 PolarHBondContact O-N 2.98Å; I135-L138 WeakPolarHBondContact O-CB 3.33Å; I135-L138 PolarHBondContact O-N 3.25Å |
| 136 | L | 63.6 | Low | 62.9 | Low | 111 Ų | 111 | 128.5 Ų | 128.5 | 58% | 0.581 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -65.2 | -31.7 | 176.4 | -63.6 | 179.1 | 0 | 0 | 0 | 113 | A132 E134 L138 I139 | A132-L136 PolarHBondContact O-N 3.21Å; A132-L136 VanDerWaalsContact O-N 3.13Å; E134-L136 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 3.23Å; L136-I139 HydrophobicContact CD2-CD1 3.96Å; L136-I139 PolarHBondContact O-N 3.08Å; L136-I139 VanDerWaalsContact O-N 3.11Å |
| 137 | K | 66.1 | Low | 62.7 | Low | 172 Ų | 172 | 133.2 Ų | 133.2 | 75% | 0.748 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -63.9 | -24.6 | 173.7 | -73.5 | 171.6 | -174.2 | 168.5 | 0 | 113.8 | D133 E134 I135 I139 | D133-K137 WeakPolarHBondContact O-CG 3.3Å; D133-K137 PolarHBondContact O-N 3.09Å; E134-K137 WeakPolarHBondContact O-CB 3.29Å; E134-K137 PolarHBondContact O-N 3.04Å; I135-K137 VanDerWaalsContact C-N 3.32Å; I135-K137 PolarHBondContact O-N 2.98Å; K137-I139 VanDerWaalsContact C-N 3.32Å |
| 138 | L | 65.3 | Low | 63.2 | Low | 149 Ų | 149 | 133.7 Ų | 133.7 | 78% | 0.78 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -78.3 | -17.8 | 175.7 | -64.3 | 172.1 | 0 | 0 | 0 | 112.5 | I135 L136 K140 | I135-L138 WeakPolarHBondContact O-CB 3.33Å; I135-L138 PolarHBondContact O-N 3.25Å; L136-L138 PolarHBondContact O-N 3.23Å; L138-K140 PolarHBondContact O-N 2.65Å; L138-K140 VanDerWaalsContact O-N 3.13Å |
| 139 | I | 70.4 | Confident | 63.7 | Low | 100 Ų | 100 | 135.6 Ų | 135.6 | 51% | 0.513 | 70% | 0.704 | S | S | . | * | | | trans | -85.5 | 89.4 | -179 | -50.7 | 175.9 | 0 | 0 | 0 | 109.2 | L136 K137 V141 | L136-I139 HydrophobicContact CD2-CD1 3.96Å; L136-I139 PolarHBondContact O-N 3.08Å; L136-I139 VanDerWaalsContact O-N 3.11Å; K137-I139 VanDerWaalsContact C-N 3.32Å; I139-V141 VanDerWaalsContact C-N 3.3Å; I139-V141 HydrophobicContact CG2-CG2 3.77Å; I139-V141 PolarHBondContact O-N 2.81Å |
| 140 | K | 71.4 | Confident | 64.1 | Low | 195 Ų | 195 | 133.4 Ų | 133.4 | 85% | 0.848 | 70% | 0.698 | S | S | * | * | | | trans | -69.9 | 82.8 | 172.3 | -174.5 | 109.6 | 178.7 | -176.7 | 0 | 110.7 | L138 S142 | L138-K140 PolarHBondContact O-N 2.65Å; L138-K140 VanDerWaalsContact O-N 3.13Å; K140-S142 PolarHBondContact O-N 3.15Å |
| 141 | V | 73.6 | Confident | 64.4 | Low | 117 Ų | 117 | 138 Ų | 138 | 71% | 0.709 | 71% | 0.705 | S | S | * | * | | | trans | -74.8 | 107 | 172.8 | -173.2 | 0 | 0 | 0 | 0 | 109.7 | I139 | I139-V141 VanDerWaalsContact C-N 3.3Å; I139-V141 HydrophobicContact CG2-CG2 3.77Å; I139-V141 PolarHBondContact O-N 2.81Å |
| 142 | S | 61.3 | Low | 64.9 | Low | 87 Ų | 87 | 136.9 Ų | 136.9 | 61% | 0.608 | 71% | 0.713 | S | S | * | * | | | trans | -77.6 | 127.1 | 166.5 | -64.6 | 0 | 0 | 0 | 0 | 109.5 | K140 L144 | K140-S142 PolarHBondContact O-N 3.15Å; S142-L144 PolarHBondContact O-N 3.38Å |
| 143 | P | 69.5 | Low | 65.2 | Low | 120 Ų | 120 | 142.5 Ų | 142.5 | 78% | 0.779 | 73% | 0.732 | S | S | * | * | | | trans | -62.8 | 119.5 | 174.3 | -21 | 32.7 | 0 | 0 | 0 | 110.5 | R145 | P143-R145 PolarHBondContact O-N 3.1Š|
| 144 | L | 60.9 | Low | 65.5 | Low | 165 Ų | 165 | 145.6 Ų | 145.6 | 86% | 0.864 | 75% | 0.746 | S | S | * | * | | | trans | -68.2 | 111.9 | 168.2 | -67.2 | 174.3 | 0 | 0 | 0 | 107.9 | S142 T146 | S142-L144 PolarHBondContact O-N 3.38Å; L144-T146 PolarHBondContact O-N 3.18Å; L144-T146 VanDerWaalsContact O-N 3.1Å |
| 145 | R | 66.3 | Low | 65.6 | Low | 248 Ų | 248 | 147.7 Ų | 147.7 | 94% | 0.936 | 76% | 0.761 | S | S | * | * | | | trans | -68.9 | 106.1 | 169.4 | -81.2 | -169.1 | 165 | -157.1 | -5 | 108.7 | P143 | P143-R145 PolarHBondContact O-N 3.1Š|
| 146 | T | 66.2 | Low | 65.8 | Low | 131 Ų | 131 | 151.9 Ų | 151.9 | 80% | 0.804 | 78% | 0.782 | S | S | * | * | | | trans | -67.8 | 132.9 | 162.6 | 52.5 | 0 | 0 | 0 | 0 | 108.6 | L144 | L144-T146 PolarHBondContact O-N 3.18Å; L144-T146 VanDerWaalsContact O-N 3.1Å |
| 147 | N | 54.8 | Low | 66 | Low | 228 Ų | 228 | 155.6 Ų | 155.6 | 100% | 1.219 | 80% | 0.801 | S | S | * | * | | | trans | -77.7 | 0 | 172.3 | 179.4 | -150.8 | 0 | 0 | 0 | 111.2 | | |