| 1 | M | 54.6 | Low | 62.2 | Low | 204 Ų | 204 | 136.8 Ų | 136.8 | 100% | 1.005 | 75% | 0.75 | S | S | * | * | | | | 0 | 9 | 0 | -74.1 | -82 | -88.8 | 0 | 0 | 114.2 | | |
| 2 | A | 59.3 | Low | 61.7 | Low | 75 Ų | 75 | 137.6 Ų | 137.6 | 62% | 0.62 | 75% | 0.752 | S | S | * | * | G | 310 helix | trans | -86 | -12.7 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | Q4 L5 | A2-Q4 PolarHBondContact O-N 3.11Å; A2-L5 PolarHBondContact O-N 3.49Å |
| 3 | S | 59.4 | Low | 61.2 | Low | 102 Ų | 102 | 132.2 Ų | 132.2 | 71% | 0.713 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -72.4 | -11.6 | -177.4 | 58.5 | 0 | 0 | 0 | 0 | 114.2 | | |
| 4 | Q | 59.7 | Low | 60.6 | Low | 144 Ų | 144 | 133.4 Ų | 133.4 | 67% | 0.673 | 75% | 0.75 | S | S | * | * | G | 310 helix | trans | -83.7 | -18.9 | 179.5 | -61.6 | -170.6 | 32.6 | 0 | 0 | 113 | A2 L6 | A2-Q4 PolarHBondContact O-N 3.11Å; Q4-L6 VanDerWaalsContact C-N 3.33Å; Q4-L6 PolarHBondContact O-N 3.42Å |
| 5 | L | 62.2 | Low | 60.1 | Low | 156 Ų | 156 | 133.2 Ų | 133.2 | 82% | 0.817 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -80.5 | -12.8 | -178.3 | -70.3 | 168.9 | 0 | 0 | 0 | 113.7 | A2 | A2-L5 PolarHBondContact O-N 3.49Š|
| 6 | L | 65 | Low | 59.9 | Low | 154 Ų | 154 | 129.8 Ų | 129.8 | 81% | 0.806 | 74% | 0.736 | S | S | * | * | S | Bend | trans | -112.7 | 0.2 | -179 | -64.8 | 175.3 | 0 | 0 | 0 | 113.6 | Q4 K8 | Q4-L6 VanDerWaalsContact C-N 3.33Å; Q4-L6 PolarHBondContact O-N 3.42Å; L6-K8 PolarHBondContact O-N 3.21Å; L6-K8 VanDerWaalsContact O-N 3.16Å |
| 7 | K | 65.2 | Low | 59.5 | Low | 174 Ų | 174 | 129.8 Ų | 129.8 | 76% | 0.757 | 74% | 0.742 | S | S | * | * | | | trans | -79.5 | 105.7 | -179.1 | -164.9 | 161.6 | -178 | -171.6 | 0 | 109.4 | | |
| 8 | K | 69.3 | Low | 59.4 | Low | 188 Ų | 188 | 127.1 Ų | 127.1 | 82% | 0.817 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 144 | 165 | -64.6 | -66.7 | -177.2 | 179.4 | 0 | 108.7 | L6 S10 | L6-K8 PolarHBondContact O-N 3.21Å; L6-K8 VanDerWaalsContact O-N 3.16Å; K8-S10 PolarHBondContact O-N 2.91Å |
| 9 | A | 65.7 | Low | 59.2 | Low | 88 Ų | 88 | 126.8 Ų | 126.8 | 73% | 0.727 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 128.9 | 172 | 0 | 0 | 0 | 0 | 0 | 108.3 | D11 | A9-D11 PolarHBondContact O-N 2.69Š|
| 10 | S | 61.5 | Low | 59.4 | Low | 81 Ų | 81 | 126.5 Ų | 126.5 | 57% | 0.566 | 74% | 0.741 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 121.2 | 175.1 | -171.2 | 0 | 0 | 0 | 0 | 107.6 | K8 N12 | K8-S10 PolarHBondContact O-N 2.91Å; S10-N12 PolarHBondContact O-N 3.42Å; S10-N12 PolarHBondContact OG-OD1 3.46Å; S10-N12 VanDerWaalsContact OG-OD1 3.08Å |
| 11 | D | 62.1 | Low | 59.7 | Low | 139 Ų | 139 | 128.2 Ų | 128.2 | 74% | 0.743 | 74% | 0.742 | S | S | * | * | | | trans | -69.6 | 18.4 | 176.2 | -67.5 | -43.5 | 0 | 0 | 0 | 113.5 | A9 G13 | A9-D11 PolarHBondContact O-N 2.69Å; D11-G13 PolarHBondContact O-N 3.18Å |
| 12 | N | 56.2 | Low | 60.3 | Low | 146 Ų | 146 | 123.9 Ų | 123.9 | 78% | 0.781 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.5 | 18.7 | -172.4 | -71.3 | 27.7 | 0 | 0 | 0 | 113.7 | S10 | S10-N12 PolarHBondContact O-N 3.42Å; S10-N12 PolarHBondContact OG-OD1 3.46Å; S10-N12 VanDerWaalsContact OG-OD1 3.08Å |
| 13 | G | 54.9 | Low | 60.8 | Low | 68 Ų | 68 | 124.2 Ų | 124.2 | 70% | 0.701 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -130.2 | -1.9 | -172.5 | 0 | 0 | 0 | 0 | 0 | 116.5 | D11 | D11-G13 PolarHBondContact O-N 3.18Š|
| 14 | L | 53.7 | Low | 61.2 | Low | 148 Ų | 148 | 125.9 Ų | 125.9 | 78% | 0.775 | 72% | 0.723 | S | S | * | * | | | trans | -115 | 27.3 | -177 | -72.3 | 172.6 | 0 | 0 | 0 | 113.6 | V16 | L14-V16 PolarHBondContact O-N 2.94Š|
| 15 | T | 52.8 | Low | 61.7 | Low | 131 Ų | 131 | 125.9 Ų | 125.9 | 80% | 0.804 | 73% | 0.727 | S | S | * | * | | | trans | -75.8 | 78.2 | 163.9 | 47.9 | 0 | 0 | 0 | 0 | 109.2 | | |
| 16 | V | 57.1 | Low | 62.4 | Low | 78 Ų | 78 | 123.1 Ų | 123.1 | 47% | 0.473 | 71% | 0.712 | S | S | . | * | | | trans | -68.5 | 121.5 | 161.6 | 178.8 | 0 | 0 | 0 | 0 | 106.7 | L14 G18 I19 | L14-V16 PolarHBondContact O-N 2.94Å; V16-G18 PolarHBondContact O-N 2.77Å; V16-I19 HydrophobicContact CB-CD1 3.57Å; V16-I19 HydrophobicContact CB-CG1 3.85Å; V16-I19 HydrophobicContact CG1-CD1 3.87Å; V16-I19 HydrophobicContact CG1-CG1 4Å; V16-I19 HydrophobicContact CG2-CD1 3.99Å; V16-I19 PolarHBondContact O-N 3.34Å |
| 17 | P | 52.4 | Low | 63 | Low | 130 Ų | 130 | 124.5 Ų | 124.5 | 84% | 0.844 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.2 | 116.6 | 178.5 | 24.8 | -31.2 | 0 | 0 | 0 | 108.7 | | |
| 18 | G | 58.6 | Low | 63.8 | Low | 82 Ų | 82 | 124.7 Ų | 124.7 | 85% | 0.845 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 115.2 | -6.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | V16 | V16-G18 PolarHBondContact O-N 2.77Š|
| 19 | I | 55.3 | Low | 64.5 | Low | 121 Ų | 121 | 126.8 Ų | 126.8 | 62% | 0.621 | 72% | 0.718 | S | S | * | * | | | trans | -102.8 | 99.4 | 174.4 | -41.7 | -177.7 | 0 | 0 | 0 | 109.1 | V16 H21 | V16-I19 HydrophobicContact CB-CD1 3.57Å; V16-I19 HydrophobicContact CB-CG1 3.85Å; V16-I19 HydrophobicContact CG1-CD1 3.87Å; V16-I19 HydrophobicContact CG1-CG1 4Å; V16-I19 HydrophobicContact CG2-CD1 3.99Å; V16-I19 PolarHBondContact O-N 3.34Å; I19-H21 PolarHBondContact O-N 3.14Å |
| 20 | T | 63.1 | Low | 65.2 | Low | 120 Ų | 120 | 127.7 Ų | 127.7 | 74% | 0.736 | 72% | 0.716 | S | S | * | * | | | trans | -62.7 | 117.4 | 168.8 | -57.6 | 0 | 0 | 0 | 0 | 108.4 | V22 | T20-V22 VanDerWaalsContact C-N 3.31Å; T20-V22 HydrophobicContact CG2-CG2 4.32Å; T20-V22 PolarHBondContact O-N 3.16Å |
| 21 | H | 65.8 | Low | 66.1 | Low | 164 Ų | 164 | 129.4 Ų | 129.4 | 76% | 0.759 | 73% | 0.725 | S | S | * | * | | | trans | -66.2 | 92.8 | 170.9 | 179.1 | -75.9 | 0 | 0 | 0 | 108.7 | I19 P23 | I19-H21 PolarHBondContact O-N 3.14Å; H21-P23 WeakPolarHBondContact O-CD 3.24Å |
| 22 | V | 67.6 | Low | 66.9 | Low | 113 Ų | 113 | 127.6 Ų | 127.6 | 69% | 0.685 | 72% | 0.723 | S | S | * | * | | | trans | -79.9 | 113.4 | 170 | -177.3 | 0 | 0 | 0 | 0 | 106.7 | T20 N24 | T20-V22 VanDerWaalsContact C-N 3.31Å; T20-V22 HydrophobicContact CG2-CG2 4.32Å; T20-V22 PolarHBondContact O-N 3.16Å; V22-N24 PolarHBondContact O-N 2.95Å |
| 23 | P | 70.3 | Confident | 67.6 | Low | 82 Ų | 82 | 128.6 Ų | 128.6 | 53% | 0.532 | 73% | 0.728 | S | S | . | * | | | trans | -59 | 119.9 | 175.8 | 24.1 | -30.7 | 0 | 0 | 0 | 107.7 | H21 I25 | H21-P23 WeakPolarHBondContact O-CD 3.24Å; P23-I25 VanDerWaalsContact C-N 3.34Å; P23-I25 PolarHBondContact O-N 2.88Å |
| 24 | N | 67.6 | Low | 68.3 | Low | 136 Ų | 136 | 130.7 Ų | 130.7 | 73% | 0.727 | 73% | 0.727 | S | S | * | * | | | trans | -71.4 | 93.8 | 179.2 | -164.8 | -5.4 | 0 | 0 | 0 | 108.2 | V22 I26 | V22-N24 PolarHBondContact O-N 2.95Å; N24-I26 HydrophobicContact CB-CG1 4.41Å; N24-I26 PolarHBondContact O-N 2.89Å; N24-I26 VanDerWaalsContact OD1-CG1 3.27Å; N24-I26 WeakPolarHBondContact OD1-CG1 3.15Å |
| 25 | I | 69.6 | Low | 68.6 | Low | 145 Ų | 145 | 131.4 Ų | 131.4 | 74% | 0.744 | 73% | 0.726 | S | S | * | * | | | trans | -77.1 | 73.1 | 176.7 | -53.6 | 168.7 | 0 | 0 | 0 | 107.5 | P23 Q27 | P23-I25 VanDerWaalsContact C-N 3.34Å; P23-I25 PolarHBondContact O-N 2.88Å; I25-Q27 PolarHBondContact O-N 2.9Å |
| 26 | I | 76.9 | Confident | 69 | Low | 98 Ų | 98 | 131.3 Ų | 131.3 | 50% | 0.503 | 73% | 0.726 | S | S | . | * | | | trans | -73 | 108.8 | 171.5 | -57.2 | 179.2 | 0 | 0 | 0 | 107.5 | N24 K28 | N24-I26 HydrophobicContact CB-CG1 4.41Å; N24-I26 PolarHBondContact O-N 2.89Å; N24-I26 VanDerWaalsContact OD1-CG1 3.27Å; N24-I26 WeakPolarHBondContact OD1-CG1 3.15Å; I26-K28 HydrophobicContact CG2-CD 4.27Å; I26-K28 PolarHBondContact O-N 2.99Å; I26-K28 VanDerWaalsContact O-N 3.12Å |
| 27 | Q | 77.4 | Confident | 69 | Low | 183 Ų | 183 | 132.6 Ų | 132.6 | 86% | 0.855 | 74% | 0.738 | S | S | * | * | | | trans | -68.6 | 107.9 | 170.3 | -66.5 | -173.3 | -5.2 | 0 | 0 | 109.3 | I25 | I25-Q27 PolarHBondContact O-N 2.9Š|
| 28 | K | 81.9 | Confident | 69.4 | Low | 178 Ų | 178 | 133.3 Ų | 133.3 | 77% | 0.774 | 73% | 0.73 | S | S | * | * | P | Polyproline II helix | trans | -76.5 | 128.6 | 173 | -61.8 | -65.2 | -175.8 | 179.1 | 0 | 108.9 | I26 | I26-K28 HydrophobicContact CG2-CD 4.27Å; I26-K28 PolarHBondContact O-N 2.99Å; I26-K28 VanDerWaalsContact O-N 3.12Å |
| 29 | R | 83.5 | Confident | 69.4 | Low | 232 Ų | 232 | 133.4 Ų | 133.4 | 88% | 0.875 | 72% | 0.716 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 139.3 | 171.5 | -159.5 | 177.4 | -174.4 | 106.6 | -0.6 | 109 | | |
| 30 | P | 80.5 | Confident | 69.5 | Low | 106 Ų | 106 | 134.7 Ų | 134.7 | 69% | 0.688 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 148.8 | 171.9 | 24.4 | -33.5 | 0 | 0 | 0 | 110.6 | | |
| 31 | P | 80.8 | Confident | 69.2 | Low | 118 Ų | 118 | 134 Ų | 134 | 77% | 0.766 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 143.6 | 175.6 | 26.4 | -33.3 | 0 | 0 | 0 | 110.1 | L33 | P31-L33 PolarHBondContact O-N 3.16Š|
| 32 | S | 79.3 | Confident | 68.6 | Low | 100 Ų | 100 | 136.6 Ų | 136.6 | 70% | 0.699 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 129.4 | 174.5 | -175.8 | 0 | 0 | 0 | 0 | 109.5 | V34 | S32-V34 PolarHBondContact O-N 2.79Š|
| 33 | L | 71 | Confident | 68.2 | Low | 167 Ų | 167 | 137.2 Ų | 137.2 | 87% | 0.874 | 72% | 0.723 | S | S | * | * | | | trans | -73.3 | 70.1 | 160.6 | -61.2 | 176 | 0 | 0 | 0 | 107.2 | P31 E35 | P31-L33 PolarHBondContact O-N 3.16Å; L33-E35 VanDerWaalsContact C-N 3.31Å; L33-E35 PolarHBondContact O-N 3.35Å |
| 34 | V | 68.6 | Low | 67.8 | Low | 113 Ų | 113 | 144.5 Ų | 144.5 | 69% | 0.685 | 74% | 0.74 | S | S | * | * | | | trans | -62.7 | 108.5 | 160.8 | 176.6 | 0 | 0 | 0 | 0 | 103.8 | S32 T36 | S32-V34 PolarHBondContact O-N 2.79Å; V34-T36 PolarHBondContact O-N 3.25Å |
| 35 | E | 61.7 | Low | 67.6 | Low | 163 Ų | 163 | 147.8 Ų | 147.8 | 76% | 0.762 | 74% | 0.743 | S | S | * | * | | | trans | -43.6 | 118.1 | 176.6 | -66.1 | -174.1 | 166.9 | 0 | 0 | 106.7 | L33 S37 | L33-E35 VanDerWaalsContact C-N 3.31Å; L33-E35 PolarHBondContact O-N 3.35Å; E35-S37 PolarHBondContact O-N 3.43Å |
| 36 | T | 59.6 | Low | 67.3 | Low | 129 Ų | 129 | 146.6 Ų | 146.6 | 79% | 0.791 | 74% | 0.742 | S | S | * | * | | | trans | -70.2 | 75.2 | 168.7 | 55.7 | 0 | 0 | 0 | 0 | 105.5 | V34 Q38 | V34-T36 PolarHBondContact O-N 3.25Å; T36-Q38 PolarHBondContact O-N 3.18Å |
| 37 | S | 57 | Low | 66.5 | Low | 105 Ų | 105 | 146.7 Ų | 146.7 | 73% | 0.734 | 74% | 0.743 | S | S | * | * | | | trans | -72.3 | 45.5 | 167.2 | 67.8 | 0 | 0 | 0 | 0 | 108.6 | E35 | E35-S37 PolarHBondContact O-N 3.43Š|
| 38 | Q | 60.9 | Low | 65.5 | Low | 144 Ų | 144 | 145 Ų | 145 | 67% | 0.673 | 74% | 0.739 | S | S | * | * | | | trans | -71.2 | 119.7 | 153.6 | -72.9 | -83 | -12.1 | 0 | 0 | 103.8 | T36 I40 | T36-Q38 PolarHBondContact O-N 3.18Å; Q38-I40 PolarHBondContact O-N 3.07Å |
| 39 | P | 59.9 | Low | 64.2 | Low | 84 Ų | 84 | 143.9 Ų | 143.9 | 55% | 0.545 | 74% | 0.737 | S | S | . | * | | | trans | -56.3 | 131.5 | 176.1 | 25 | -33 | 0 | 0 | 0 | 107.8 | S41 R42 | P39-S41 WeakPolarHBondContact CB-OG 3.43Å; P39-S41 PolarHBondContact O-N 3.05Å; P39-R42 PolarHBondContact O-N 3.48Å |
| 40 | I | 57.4 | Low | 63 | Low | 149 Ų | 149 | 134.9 Ų | 134.9 | 76% | 0.764 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -57.7 | -4.2 | 177.7 | -62.2 | 168.2 | 0 | 0 | 0 | 111.3 | Q38 R42 | Q38-I40 PolarHBondContact O-N 3.07Å; I40-R42 PolarHBondContact O-N 3.16Å; I40-R42 VanDerWaalsContact O-N 3.16Å |
| 41 | S | 57 | Low | 61.7 | Low | 104 Ų | 104 | 136.6 Ų | 136.6 | 73% | 0.727 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -66.6 | -4.7 | 174.4 | 64.2 | 0 | 0 | 0 | 0 | 115.8 | P39 | P39-S41 WeakPolarHBondContact CB-OG 3.43Å; P39-S41 PolarHBondContact O-N 3.05Å |
| 42 | R | 52.8 | Low | 60.3 | Low | 220 Ų | 220 | 136.1 Ų | 136.1 | 83% | 0.83 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -121.4 | 8.9 | 179.3 | -121 | 179.3 | -144.3 | 162.5 | 5.9 | 116.8 | P39 I40 R44 | P39-R42 PolarHBondContact O-N 3.48Å; I40-R42 PolarHBondContact O-N 3.16Å; I40-R42 VanDerWaalsContact O-N 3.16Å; R42-R44 VanDerWaalsContact C-N 3.29Å; R42-R44 PolarHBondContact O-N 2.84Å |
| 43 | I | 58.9 | Low | 59 | Low | 125 Ų | 125 | 137 Ų | 137 | 64% | 0.641 | 72% | 0.719 | S | S | * | * | | | trans | -80.7 | 83.2 | 169.6 | -51.6 | 176.7 | 0 | 0 | 0 | 107.8 | R45 | I43-R45 VanDerWaalsContact C-N 3.27Å; I43-R45 PolarHBondContact O-N 2.69Å |
| 44 | R | 61.2 | Low | 58.2 | Low | 235 Ų | 235 | 137.5 Ų | 137.5 | 89% | 0.887 | 71% | 0.714 | S | S | * | * | | | trans | -63.1 | 97.2 | 160.4 | -90.2 | -173.2 | 172.1 | -144.1 | -0.7 | 106.5 | R42 V46 | R42-R44 VanDerWaalsContact C-N 3.29Å; R42-R44 PolarHBondContact O-N 2.84Å; R44-V46 PolarHBondContact O-N 2.97Å |
| 45 | R | 64.3 | Low | 57.6 | Low | 206 Ų | 206 | 138.2 Ų | 138.2 | 78% | 0.777 | 71% | 0.714 | S | S | * | * | | | trans | -55.6 | 108.2 | 164 | -76.6 | -176 | -78.3 | 169.2 | -4.1 | 106.3 | I43 L47 | I43-R45 VanDerWaalsContact C-N 3.27Å; I43-R45 PolarHBondContact O-N 2.69Å; R45-L47 HydrophobicContact CB-CD1 4.24Å; R45-L47 PolarHBondContact O-N 3.23Å |
| 46 | V | 62.3 | Low | 57.2 | Low | 120 Ų | 120 | 134 Ų | 134 | 73% | 0.727 | 70% | 0.699 | S | S | * | * | | | trans | -70.5 | 84.8 | 164 | -177.1 | 0 | 0 | 0 | 0 | 104.8 | R44 N48 | R44-V46 PolarHBondContact O-N 2.97Å; V46-N48 PolarHBondContact O-N 2.97Å; V46-N48 VanDerWaalsContact O-N 3.16Å |
| 47 | L | 59.8 | Low | 56.8 | Low | 99 Ų | 99 | 131.7 Ų | 131.7 | 52% | 0.518 | 69% | 0.688 | S | S | . | * | | | trans | -66.3 | 111 | 161.3 | -97.1 | 113.2 | 0 | 0 | 0 | 105.4 | R45 H49 | R45-L47 HydrophobicContact CB-CD1 4.24Å; R45-L47 PolarHBondContact O-N 3.23Å; L47-H49 WeakPolarHBondContact CB-NE2 3.45Å; L47-H49 PolarHBondContact O-CD2 3.07Å; L47-H49 PolarHBondContact O-N 2.9Å |
| 48 | N | 56.3 | Low | 56.6 | Low | 147 Ų | 147 | 134 Ų | 134 | 79% | 0.786 | 69% | 0.687 | S | S | * | * | | | trans | -62.6 | 82.1 | 161.4 | -73.8 | -26.1 | 0 | 0 | 0 | 107.3 | V46 G50 | V46-N48 PolarHBondContact O-N 2.97Å; V46-N48 VanDerWaalsContact O-N 3.16Å; N48-G50 PolarHBondContact O-N 3.08Å |
| 49 | H | 56.2 | Low | 56.1 | Low | 156 Ų | 156 | 134.6 Ų | 134.6 | 72% | 0.722 | 69% | 0.69 | S | S | * | * | | | trans | -74.8 | 72.3 | 167.6 | -62.3 | -70.3 | 0 | 0 | 0 | 107.7 | L47 | L47-H49 WeakPolarHBondContact CB-NE2 3.45Å; L47-H49 PolarHBondContact O-CD2 3.07Å; L47-H49 PolarHBondContact O-N 2.9Å |
| 50 | G | 56.4 | Low | 55.9 | Low | 43 Ų | 43 | 136.4 Ų | 136.4 | 44% | 0.443 | 69% | 0.694 | S | S | . | * | | | trans | -59.5 | 159.1 | 147.8 | 0 | 0 | 0 | 0 | 0 | 108.3 | N48 V52 | N48-G50 PolarHBondContact O-N 3.08Å; G50-V52 PolarHBondContact O-N 3.33Å |
| 51 | P | 53.8 | Low | 55.5 | Low | 142 Ų | 142 | 140 Ų | 140 | 92% | 0.922 | 70% | 0.698 | S | S | * | * | | | trans | -62.4 | 89.1 | 174.4 | 26 | -31.6 | 0 | 0 | 0 | 108.7 | D53 | P51-D53 PolarHBondContact O-N 2.9Š|
| 52 | V | 52.5 | Low | 55.3 | Low | 107 Ų | 107 | 139.8 Ų | 139.8 | 65% | 0.648 | 70% | 0.696 | S | S | * | * | | | trans | -75.2 | 120.2 | 169.9 | 176.8 | 0 | 0 | 0 | 0 | 105.4 | G50 K54 V56 | G50-V52 PolarHBondContact O-N 3.33Å; V52-K54 PolarHBondContact O-N 3.41Å; V52-V56 HydrophobicContact CG1-CB 4.38Å; V52-V56 HydrophobicContact CG1-CG2 4.34Å |
| 53 | D | 51.4 | Low | 55.3 | Low | 119 Ų | 119 | 138.3 Ų | 138.3 | 64% | 0.636 | 70% | 0.696 | S | S | * | * | | | trans | -40.1 | 134.5 | -178.8 | -125.7 | -31 | 0 | 0 | 0 | 111.9 | P51 D55 V56 | P51-D53 PolarHBondContact O-N 2.9Å; D53-D55 PolarHBondContact O-N 2.71Å; D53-V56 PolarHBondContact O-N 3.16Å |
| 54 | K | 54.8 | Low | 54.5 | Low | 177 Ų | 177 | 138 Ų | 138 | 77% | 0.77 | 71% | 0.705 | S | S | * | * | G | 310 helix | trans | -58.6 | -15.4 | -174.7 | -72.5 | -179.5 | 175.9 | 177.9 | 0 | 112.7 | V52 V56 S57 | V52-K54 PolarHBondContact O-N 3.41Å; K54-V56 VanDerWaalsContact C-N 3.35Å; K54-V56 PolarHBondContact O-N 2.99Å; K54-S57 PolarHBondContact O-N 3.05Å |
| 55 | D | 54.2 | Low | 53.7 | Low | 129 Ų | 129 | 129.4 Ų | 129.4 | 69% | 0.69 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -73.6 | -17 | -178.1 | -67.4 | -25.3 | 0 | 0 | 0 | 114.7 | D53 | D53-D55 PolarHBondContact O-N 2.71Š|
| 56 | V | 54 | Low | 52.7 | Low | 73 Ų | 73 | 126.5 Ų | 126.5 | 44% | 0.442 | 69% | 0.694 | S | S | . | * | G | 310 helix | trans | -88.5 | -14.6 | 178.6 | -170 | 0 | 0 | 0 | 0 | 112.5 | V52 D53 K54 H58 Q59 | V52-V56 HydrophobicContact CG1-CB 4.38Å; V52-V56 HydrophobicContact CG1-CG2 4.34Å; D53-V56 PolarHBondContact O-N 3.16Å; K54-V56 VanDerWaalsContact C-N 3.35Å; K54-V56 PolarHBondContact O-N 2.99Å; V56-H58 PolarHBondContact O-N 3Å; V56-H58 VanDerWaalsContact O-N 3.11Å; V56-Q59 PolarHBondContact O-N 3.12Å |
| 57 | S | 51.3 | Low | 51.9 | Low | 81 Ų | 81 | 127.4 Ų | 127.4 | 57% | 0.566 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -17.8 | -177.5 | -64.6 | 0 | 0 | 0 | 0 | 113.8 | K54 | K54-S57 PolarHBondContact O-N 3.05Š|
| 58 | H | 52.2 | Low | 51.5 | Low | 153 Ų | 153 | 128.5 Ų | 128.5 | 71% | 0.708 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -14.2 | 179.7 | -60.4 | -60.2 | 0 | 0 | 0 | 113.7 | V56 | V56-H58 PolarHBondContact O-N 3Å; V56-H58 VanDerWaalsContact O-N 3.11Å |
| 59 | Q | 52 | Low | 51.2 | Low | 158 Ų | 158 | 127.1 Ų | 127.1 | 74% | 0.738 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.1 | -16.7 | -177.3 | -148.8 | 174.3 | 69.4 | 0 | 0 | 113.4 | V56 | V56-Q59 PolarHBondContact O-N 3.12Š|
| 60 | I | 54.3 | Low | 51.1 | Low | 122 Ų | 122 | 125 Ų | 125 | 63% | 0.626 | 70% | 0.703 | S | S | * | * | G | 310 helix | trans | -88.7 | -10.8 | -175 | -56.9 | 174.6 | 0 | 0 | 0 | 112 | S62 | I60-S62 PolarHBondContact O-N 2.89Å; I60-S62 VanDerWaalsContact O-N 3.14Å |
| 61 | R | 49.5 | Very low | 50.7 | Low | 225 Ų | 225 | 129.1 Ų | 129.1 | 85% | 0.849 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -74.8 | -2 | -174.2 | -151 | 172.9 | -161.4 | 176.2 | 5.5 | 114.8 | | |
| 62 | S | 52.3 | Low | 50.1 | Low | 99 Ų | 99 | 129.2 Ų | 129.2 | 69% | 0.692 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -84.6 | -4 | -177.1 | -41.3 | 0 | 0 | 0 | 0 | 114.7 | I60 | I60-S62 PolarHBondContact O-N 2.89Å; I60-S62 VanDerWaalsContact O-N 3.14Å |
| 63 | F | 52.5 | Low | 49.9 | Very low | 189 Ų | 189 | 128.4 Ų | 128.4 | 83% | 0.829 | 71% | 0.711 | S | S | * | * | | | trans | -100.4 | 30.8 | -177.6 | -65 | -77.1 | 0 | 0 | 0 | 113.8 | | |
| 64 | S | 44.1 | Very low | 49.5 | Very low | 119 Ų | 119 | 127.4 Ų | 127.4 | 83% | 0.832 | 71% | 0.713 | S | S | * | * | | | trans | -106.6 | 59 | 171.2 | 177.6 | 0 | 0 | 0 | 0 | 109.8 | | |
| 65 | G | 43.7 | Very low | 49.3 | Very low | 53 Ų | 53 | 128.7 Ų | 128.7 | 55% | 0.546 | 72% | 0.719 | S | S | . | * | | | trans | -128.2 | 101.6 | 171.5 | 0 | 0 | 0 | 0 | 0 | 107.6 | D67 | G65-D67 PolarHBondContact O-N 2.94Š|
| 66 | V | 43.2 | Very low | 49.2 | Very low | 146 Ų | 146 | 128 Ų | 128 | 89% | 0.885 | 72% | 0.723 | S | S | * | * | | | trans | -66.5 | 76.1 | 173.6 | -80.6 | 0 | 0 | 0 | 0 | 109.7 | | |
| 67 | D | 46.3 | Very low | 48.9 | Very low | 139 Ų | 139 | 135.2 Ų | 135.2 | 74% | 0.743 | 74% | 0.744 | S | S | * | * | | | trans | -130.2 | 93.3 | 177.8 | -78.1 | -48.9 | 0 | 0 | 0 | 110.6 | G65 | G65-D67 PolarHBondContact O-N 2.94Š|
| 68 | T | 51.3 | Low | 49 | Very low | 121 Ų | 121 | 140.6 Ų | 140.6 | 74% | 0.742 | 76% | 0.76 | S | S | * | * | | | trans | 33.4 | 100.3 | 131.3 | -38.2 | 0 | 0 | 0 | 0 | 115.5 | P70 | T68-P70 WeakPolarHBondContact O-CD 3.34Å; T68-P70 VanDerWaalsContact O-N 3.16Å |
| 69 | V | 49.8 | Very low | 49.3 | Very low | 119 Ų | 119 | 137.1 Ų | 137.1 | 72% | 0.721 | 76% | 0.758 | S | S | * | * | | | trans | -58 | 116 | 166.4 | 177.8 | 0 | 0 | 0 | 0 | 108.5 | T71 | V69-T71 HydrophobicContact CG1-CG2 4.08Å; V69-T71 PolarHBondContact O-N 3.05Å |
| 70 | P | 54.4 | Low | 49.6 | Very low | 112 Ų | 112 | 134.6 Ų | 134.6 | 73% | 0.727 | 76% | 0.755 | S | S | * | * | | | trans | -75.4 | 100.1 | 171.6 | -5.3 | 23.3 | 0 | 0 | 0 | 107.7 | T68 N72 | T68-P70 WeakPolarHBondContact O-CD 3.34Å; T68-P70 VanDerWaalsContact O-N 3.16Å; P70-N72 PolarHBondContact O-N 2.88Å |
| 71 | T | 47 | Very low | 49.7 | Very low | 128 Ų | 128 | 136.5 Ų | 136.5 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | | | trans | -80.9 | 65.5 | 168.9 | 53 | 0 | 0 | 0 | 0 | 109.8 | V69 | V69-T71 HydrophobicContact CG1-CG2 4.08Å; V69-T71 PolarHBondContact O-N 3.05Å |
| 72 | N | 42.4 | Very low | 49.9 | Very low | 145 Ų | 145 | 131.8 Ų | 131.8 | 78% | 0.775 | 76% | 0.762 | S | S | * | * | | | trans | -167.3 | 133.9 | 168 | -131 | -25.4 | 0 | 0 | 0 | 106.5 | P70 | P70-N72 PolarHBondContact O-N 2.88Š|
| 73 | S | 46.6 | Very low | 50.4 | Low | 90 Ų | 90 | 131.9 Ų | 131.9 | 63% | 0.629 | 76% | 0.763 | S | S | * | * | | | cis | -167.2 | 148.4 | 27.6 | 53.5 | 0 | 0 | 0 | 0 | 109.2 | | |
| 74 | S | 43.5 | Very low | 50.9 | Low | 97 Ų | 97 | 133.8 Ų | 133.8 | 68% | 0.678 | 77% | 0.765 | S | S | * | * | | | trans | 38.6 | 106.3 | 147 | 55.9 | 0 | 0 | 0 | 0 | 119.5 | | |
| 75 | K | 51.7 | Low | 51.7 | Low | 204 Ų | 204 | 133.3 Ų | 133.3 | 89% | 0.887 | 76% | 0.758 | S | S | * | * | | | trans | 174 | -9.2 | 134.2 | -97.3 | 165.5 | -169.8 | -165.9 | 0 | 116.1 | | |
| 76 | C | 51 | Low | 52.7 | Low | 114 Ų | 114 | 136.2 Ų | 136.2 | 77% | 0.77 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -105.7 | 3.7 | -164 | -54.3 | 0 | 0 | 0 | 0 | 116.6 | | |
| 77 | Y | 48.7 | Very low | 53.5 | Low | 225 Ų | 225 | 134.3 Ų | 134.3 | 88% | 0.882 | 76% | 0.759 | S | S | * | * | | | trans | -133.2 | 84.2 | 175.9 | -66.1 | -78.7 | 0 | 0 | 0 | 110.1 | A79 | Y77-A79 VanDerWaalsContact C-N 3.29Å; Y77-A79 PolarHBondContact O-N 3.2Å |
| 78 | E | 52.5 | Low | 54.3 | Low | 195 Ų | 195 | 130.6 Ų | 130.6 | 91% | 0.911 | 74% | 0.743 | S | S | * | * | | | trans | -70.5 | 94.6 | 158.7 | -165.7 | 174 | -175 | 0 | 0 | 106.6 | | |
| 79 | A | 58.3 | Low | 54.9 | Low | 80 Ų | 80 | 131.5 Ų | 131.5 | 66% | 0.661 | 75% | 0.748 | S | S | * | * | | | trans | -63.8 | 127.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 108 | Y77 N81 | Y77-A79 VanDerWaalsContact C-N 3.29Å; Y77-A79 PolarHBondContact O-N 3.2Å; A79-N81 PolarHBondContact O-N 3.05Å; A79-N81 VanDerWaalsContact O-N 3.16Å |
| 80 | P | 59.3 | Low | 55.5 | Low | 105 Ų | 105 | 133.2 Ų | 133.2 | 68% | 0.682 | 75% | 0.748 | S | S | * | * | | | trans | -59.3 | 127.5 | 175 | 23.7 | -30.7 | 0 | 0 | 0 | 107.8 | V82 | P80-V82 WeakPolarHBondContact O-CG2 3.27Å; P80-V82 PolarHBondContact O-N 3.2Å |
| 81 | N | 55 | Low | 55.5 | Low | 161 Ų | 161 | 131.9 Ų | 131.9 | 86% | 0.861 | 74% | 0.74 | S | S | * | * | | | trans | -64.1 | 73.5 | 169.9 | -111 | -36.6 | 0 | 0 | 0 | 108.7 | A79 S83 | A79-N81 PolarHBondContact O-N 3.05Å; A79-N81 VanDerWaalsContact O-N 3.16Å; N81-S83 PolarHBondContact O-N 3.22Å |
| 82 | V | 53.6 | Low | 55.9 | Low | 126 Ų | 126 | 131 Ų | 131 | 76% | 0.764 | 73% | 0.734 | S | S | * | * | | | trans | -80.6 | 82.2 | 167.3 | -87.8 | 0 | 0 | 0 | 0 | 107.2 | P80 R84 | P80-V82 WeakPolarHBondContact O-CG2 3.27Å; P80-V82 PolarHBondContact O-N 3.2Å; V82-R84 PolarHBondContact O-N 3.07Å |
| 83 | S | 63.8 | Low | 56.7 | Low | 101 Ų | 101 | 135.3 Ų | 135.3 | 71% | 0.706 | 74% | 0.74 | S | S | * | * | | | trans | -47.3 | 111.4 | 162.5 | -48.4 | 0 | 0 | 0 | 0 | 108 | N81 | N81-S83 PolarHBondContact O-N 3.22Š|
| 84 | R | 63.3 | Low | 57.6 | Low | 230 Ų | 230 | 136.2 Ų | 136.2 | 87% | 0.868 | 74% | 0.741 | S | S | * | * | | | trans | -55.9 | 127.2 | 173.7 | -169.8 | -179.5 | -178.1 | -162.4 | 0.9 | 107.4 | V82 S86 | V82-R84 PolarHBondContact O-N 3.07Å; R84-S86 PolarHBondContact O-N 2.86Å |
| 85 | P | 60.7 | Low | 58.5 | Low | 108 Ų | 108 | 136.4 Ų | 136.4 | 70% | 0.701 | 74% | 0.74 | S | S | * | * | | | trans | -57.2 | 119.8 | 171.8 | -19.1 | 29.7 | 0 | 0 | 0 | 107.9 | V87 | P85-V87 PolarHBondContact O-N 3.02Š|
| 86 | S | 64.2 | Low | 58.9 | Low | 114 Ų | 114 | 131.4 Ų | 131.4 | 80% | 0.797 | 73% | 0.731 | S | S | * | * | | | trans | -65.8 | 103.6 | 168.7 | 41.4 | 0 | 0 | 0 | 0 | 107.1 | R84 | R84-S86 PolarHBondContact O-N 2.86Š|
| 87 | V | 60.8 | Low | 59.3 | Low | 106 Ų | 106 | 134.4 Ų | 134.4 | 64% | 0.642 | 73% | 0.733 | S | S | * | * | | | trans | -68 | 128.5 | 170.6 | -172.3 | 0 | 0 | 0 | 0 | 106.6 | P85 T89 | P85-V87 PolarHBondContact O-N 3.02Å; V87-T89 PolarHBondContact O-N 3.07Å |
| 88 | P | 62.6 | Low | 59.2 | Low | 62 Ų | 62 | 133.2 Ų | 133.2 | 40% | 0.403 | 75% | 0.749 | S | S | . | * | | | trans | -58.5 | 131.5 | 178.5 | -20.6 | 30.3 | 0 | 0 | 0 | 111 | H90 C91 | P88-H90 WeakPolarHBondContact CB-CE1 3.01Å; P88-H90 WeakPolarHBondContact CB-ND1 3.21Å; P88-H90 PolarHBondContact O-N 3.3Å; P88-C91 PolarHBondContact O-N 2.95Å; P88-C91 VanDerWaalsContact O-N 3.07Å |
| 89 | T | 63.4 | Low | 59.6 | Low | 139 Ų | 139 | 130.1 Ų | 130.1 | 85% | 0.853 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -60.7 | -9.4 | -180 | 43.6 | 0 | 0 | 0 | 0 | 113.7 | V87 | V87-T89 PolarHBondContact O-N 3.07Š|
| 90 | H | 63 | Low | 59.6 | Low | 156 Ų | 156 | 132.7 Ų | 132.7 | 72% | 0.722 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -85.2 | -5.4 | 176.3 | 62.4 | -103.5 | 0 | 0 | 0 | 114.5 | P88 | P88-H90 WeakPolarHBondContact CB-CE1 3.01Å; P88-H90 WeakPolarHBondContact CB-ND1 3.21Å; P88-H90 PolarHBondContact O-N 3.3Å |
| 91 | C | 54.7 | Low | 59.6 | Low | 83 Ų | 83 | 134.3 Ų | 134.3 | 56% | 0.561 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -96.7 | -2.3 | -179 | -67.4 | 0 | 0 | 0 | 0 | 114.5 | P88 R93 | P88-C91 PolarHBondContact O-N 2.95Å; P88-C91 VanDerWaalsContact O-N 3.07Å; C91-R93 PolarHBondContact O-N 3.13Å; C91-R93 VanDerWaalsContact O-N 3.13Å |
| 92 | V | 55.2 | Low | 59.9 | Low | 109 Ų | 109 | 132.7 Ų | 132.7 | 66% | 0.661 | 74% | 0.743 | S | S | * | * | | | trans | -88.7 | 76.6 | 178 | -164.1 | 0 | 0 | 0 | 0 | 109.2 | V94 | V92-V94 VanDerWaalsContact C-N 3.34Å; V92-V94 HydrophobicContact CG1-CG2 4.01Å; V92-V94 PolarHBondContact O-N 3.1Å; V92-V94 VanDerWaalsContact O-N 3.1Å |
| 93 | R | 59.5 | Low | 60.3 | Low | 237 Ų | 237 | 133.1 Ų | 133.1 | 89% | 0.894 | 74% | 0.741 | S | S | * | * | | | trans | -77.5 | 91 | 166.2 | -164.1 | 175.5 | -158.4 | 146.4 | 3.9 | 107.9 | C91 P95 | C91-R93 PolarHBondContact O-N 3.13Å; C91-R93 VanDerWaalsContact O-N 3.13Å; R93-P95 WeakPolarHBondContact O-CD 3.39Å |
| 94 | V | 64.1 | Low | 60.1 | Low | 109 Ų | 109 | 135.3 Ų | 135.3 | 66% | 0.661 | 74% | 0.744 | S | S | * | * | | | trans | -63.9 | 123.3 | 167.3 | -174.3 | 0 | 0 | 0 | 0 | 107.2 | V92 S96 | V92-V94 VanDerWaalsContact C-N 3.34Å; V92-V94 HydrophobicContact CG1-CG2 4.01Å; V92-V94 PolarHBondContact O-N 3.1Å; V92-V94 VanDerWaalsContact O-N 3.1Å; V94-S96 PolarHBondContact O-N 3.39Å |
| 95 | P | 63.5 | Low | 59.8 | Low | 100 Ų | 100 | 128.5 Ų | 128.5 | 65% | 0.649 | 74% | 0.735 | S | S | * | * | | | trans | -65.4 | 107.6 | 168 | -14.3 | 29.1 | 0 | 0 | 0 | 107.9 | R93 H97 | R93-P95 WeakPolarHBondContact O-CD 3.39Å; P95-H97 PolarHBondContact O-N 3.03Å |
| 96 | S | 59.5 | Low | 59.8 | Low | 100 Ų | 100 | 130.1 Ų | 130.1 | 70% | 0.699 | 74% | 0.737 | S | S | * | * | | | trans | -72.3 | 113.1 | 168.6 | 56.7 | 0 | 0 | 0 | 0 | 108.5 | V94 | V94-S96 PolarHBondContact O-N 3.39Š|
| 97 | H | 58.9 | Low | 59.4 | Low | 176 Ų | 176 | 131.4 Ų | 131.4 | 82% | 0.815 | 73% | 0.732 | S | S | * | * | | | trans | -105.9 | 92.3 | 160.7 | -66.6 | -69.6 | 0 | 0 | 0 | 107.2 | P95 | P95-H97 PolarHBondContact O-N 3.03Š|
| 98 | T | 47.8 | Very low | 59.3 | Low | 200 Ų | 200 | 133.7 Ų | 133.7 | 100% | 1.227 | 74% | 0.74 | S | S | * | * | | | trans | -62.5 | 0 | 145.4 | 46.7 | 0 | 0 | 0 | 0 | 109.7 | | |