| 1 | M | 61.5 | Low | 72.4 | Confident | 235 Ų | 235 | 126.9 Ų | 126.9 | 100% | 1.158 | 68% | 0.676 | S | S | * | * | | | | 0 | 133.9 | 0 | -67.3 | 175.1 | 67.1 | 0 | 0 | 108.4 | | |
| 2 | P | 64.2 | Low | 72 | Confident | 125 Ų | 125 | 123.3 Ų | 123.3 | 81% | 0.812 | 68% | 0.677 | S | S | * | * | P | Polyproline II helix | trans | -69.1 | 132.9 | 177.7 | 26.5 | -31.2 | 0 | 0 | 0 | 110.8 | K4 | P2-K4 PolarHBondContact O-N 3.1Š|
| 3 | A | 73.2 | Confident | 71.3 | Confident | 101 Ų | 101 | 125 Ų | 125 | 84% | 0.835 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 121.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110 | | |
| 4 | K | 80.8 | Confident | 70.7 | Confident | 205 Ų | 205 | 120.1 Ų | 120.1 | 89% | 0.891 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -75.3 | 126.8 | 175.6 | -79.4 | 172 | 174 | 172.6 | 0 | 108.9 | P2 | P2-K4 PolarHBondContact O-N 3.1Š|
| 5 | T | 74.6 | Confident | 70.5 | Confident | 106 Ų | 106 | 126.3 Ų | 126.3 | 65% | 0.65 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 144.5 | 169.9 | 48.3 | 0 | 0 | 0 | 0 | 109.9 | | |
| 6 | P | 77.2 | Confident | 70.1 | Confident | 48 Ų | 48 | 130.6 Ų | 130.6 | 31% | 0.312 | 69% | 0.686 | S | S | . | * | P | Polyproline II helix | trans | -58.9 | 140.6 | 176.2 | -13.5 | 22.5 | 0 | 0 | 0 | 111 | Y8 L9 K10 | P6-Y8 HydrophobicContact CB-CD1 3.68Å; P6-Y8 HydrophobicContact CB-CD2 4.19Å; P6-Y8 HydrophobicContact CB-CE1 3.16Å; P6-Y8 HydrophobicContact CB-CE2 3.74Å; P6-Y8 HydrophobicContact CB-CG 4.16Å; P6-Y8 WeakPolarHBondContact CB-OH 3.19Å; P6-Y8 HydrophobicContact CG-CE1 4.11Å; P6-Y8 HydrophobicContact CG-CE2 4.12Å; P6-Y8 WeakPolarHBondContact CG-OH 3.47Å; P6-Y8 PolarHBondContact O-N 2.88Å; P6-Y8 VanDerWaalsContact O-N 3.16Å; P6-L9 HydrophobicContact CB-CG 4.42Å; P6-L9 HydrophobicContact CG-CD1 3.98Å; P6-L9 HydrophobicContact CG-CG 4.31Å; P6-L9 PolarHBondContact O-N 3.15Å; P6-K10 PolarHBondContact O-N 3.05Å |
| 7 | I | 75.9 | Confident | 70.1 | Confident | 153 Ų | 153 | 126.9 Ų | 126.9 | 79% | 0.785 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -57.4 | -35 | -175 | -61.2 | 170.6 | 0 | 0 | 0 | 111.3 | L9 K10 | I7-L9 PolarHBondContact O-N 3.27Å; I7-K10 WeakPolarHBondContact O-CB 3.35Å; I7-K10 PolarHBondContact O-N 3.13Å; I7-K10 VanDerWaalsContact O-N 3.08Å |
| 8 | Y | 70.9 | Confident | 70.3 | Confident | 168 Ų | 168 | 128.6 Ų | 128.6 | 66% | 0.659 | 69% | 0.687 | S | S | * | * | G | 310 helix | trans | -70.3 | -15.5 | 178.1 | 56.7 | -97.4 | 0 | 0 | 0 | 114.2 | P6 | P6-Y8 HydrophobicContact CB-CD1 3.68Å; P6-Y8 HydrophobicContact CB-CD2 4.19Å; P6-Y8 HydrophobicContact CB-CE1 3.16Å; P6-Y8 HydrophobicContact CB-CE2 3.74Å; P6-Y8 HydrophobicContact CB-CG 4.16Å; P6-Y8 WeakPolarHBondContact CB-OH 3.19Å; P6-Y8 HydrophobicContact CG-CE1 4.11Å; P6-Y8 HydrophobicContact CG-CE2 4.12Å; P6-Y8 WeakPolarHBondContact CG-OH 3.47Å; P6-Y8 PolarHBondContact O-N 2.88Å; P6-Y8 VanDerWaalsContact O-N 3.16Å |
| 9 | L | 74.5 | Confident | 70.5 | Confident | 45 Ų | 45 | 131.9 Ų | 131.9 | 24% | 0.236 | 70% | 0.695 | C | S | . | * | G | 310 helix | trans | -97.9 | 0.4 | 172 | -58.8 | -175.3 | 0 | 0 | 0 | 112.5 | P6 I7 A11 L22 L26 | P6-L9 HydrophobicContact CB-CG 4.42Å; P6-L9 HydrophobicContact CG-CD1 3.98Å; P6-L9 HydrophobicContact CG-CG 4.31Å; P6-L9 PolarHBondContact O-N 3.15Å; I7-L9 PolarHBondContact O-N 3.27Å; L9-A11 VanDerWaalsContact C-N 3.32Å; L9-A11 PolarHBondContact O-N 2.8Å; L9-L22 HydrophobicContact CD1-CD2 4.3Å; L9-L22 HydrophobicContact CD2-CD2 4.08Å; L9-L26 HydrophobicContact CD2-CD1 4.14Å; L9-L26 HydrophobicContact CD2-CD2 3.82Å; L9-L26 HydrophobicContact CD2-CG 4.1Å |
| 10 | K | 72.9 | Confident | 70.6 | Confident | 162 Ų | 162 | 130.8 Ų | 130.8 | 70% | 0.704 | 68% | 0.684 | S | S | * | * | | | trans | -74.1 | 90.2 | 177.4 | -170.3 | 174.7 | 177.7 | 178.4 | 0 | 108.7 | P6 I7 A12 | P6-K10 PolarHBondContact O-N 3.05Å; I7-K10 WeakPolarHBondContact O-CB 3.35Å; I7-K10 PolarHBondContact O-N 3.13Å; I7-K10 VanDerWaalsContact O-N 3.08Å; K10-A12 PolarHBondContact O-N 3Å; K10-A12 VanDerWaalsContact O-N 3.15Å |
| 11 | A | 70.5 | Confident | 71.1 | Confident | 48 Ų | 48 | 130.4 Ų | 130.4 | 40% | 0.397 | 68% | 0.677 | S | S | . | * | | | trans | -54.5 | 121.6 | 167.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | L9 N13 I25 | L9-A11 VanDerWaalsContact C-N 3.32Å; L9-A11 PolarHBondContact O-N 2.8Å; A11-N13 PolarHBondContact O-N 3.13Å; A11-I25 HydrophobicContact CB-CD1 3.9Å |
| 12 | A | 67.6 | Low | 72.2 | Confident | 83 Ų | 83 | 124 Ų | 124 | 69% | 0.686 | 65% | 0.647 | S | S | * | * | | | trans | -55.5 | 126.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 107.7 | K10 N14 | K10-A12 PolarHBondContact O-N 3Å; K10-A12 VanDerWaalsContact O-N 3.15Å; A12-N14 PolarHBondContact O-N 3.08Å |
| 13 | N | 63.2 | Low | 73.1 | Confident | 146 Ų | 146 | 127.2 Ų | 127.2 | 78% | 0.781 | 64% | 0.643 | S | S | * | * | | | trans | -55.8 | 99.3 | -176.5 | 51.6 | 6.8 | 0 | 0 | 0 | 110.8 | A11 K15 | A11-N13 PolarHBondContact O-N 3.13Å; N13-K15 PolarHBondContact O-N 3.05Å |
| 14 | N | 63.2 | Low | 73.6 | Confident | 57 Ų | 57 | 127 Ų | 127 | 31% | 0.305 | 63% | 0.628 | S | S | . | * | | | trans | -74 | 119.7 | 175.7 | 62 | -22.1 | 0 | 0 | 0 | 108.9 | A12 K16 G17 K18 F20 | A12-N14 PolarHBondContact O-N 3.08Å; N14-K16 PolarHBondContact O-N 3.18Å; N14-G17 PolarHBondContact O-N 3.19Å; N14-K18 PolarHBondContact ND2-O 2.98Å; N14-K18 PolarHBondContact OD1-O 3.25Å; N14-F20 HydrophobicContact CB-CE2 4.05Å; N14-F20 VanDerWaalsContact ND2-CE2 3.35Å; N14-F20 WeakPolarHBondContact ND2-CE2 3.48Å |
| 15 | K | 67.3 | Low | 73.8 | Confident | 212 Ų | 212 | 119.6 Ų | 119.6 | 92% | 0.922 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | 11.2 | 178.7 | -58.6 | -178.3 | 179.9 | 177.3 | 0 | 114.2 | N13 | N13-K15 PolarHBondContact O-N 3.05Š|
| 16 | K | 64.5 | Low | 74.3 | Confident | 196 Ų | 196 | 117 Ų | 117 | 85% | 0.852 | 58% | 0.579 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119.9 | 14.3 | -175.1 | -80.4 | -172.6 | 174.8 | -179.7 | 0 | 114.8 | N14 K18 | N14-K16 PolarHBondContact O-N 3.18Å; K16-K18 PolarHBondContact O-N 2.98Å |
| 17 | G | 70 | Confident | 74.8 | Confident | 68 Ų | 68 | 117.9 Ų | 117.9 | 70% | 0.701 | 59% | 0.587 | S | S | * | * | | | trans | 67.9 | 3.9 | 167.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | N14 K19 | N14-G17 PolarHBondContact O-N 3.19Å; G17-K19 PolarHBondContact O-N 2.89Å |
| 18 | K | 74 | Confident | 75.4 | Confident | 156 Ų | 156 | 116 Ų | 116 | 68% | 0.678 | 58% | 0.584 | S | S | * | * | | | trans | -84.6 | 110.5 | 178.6 | -168.7 | 89.2 | 173.4 | -171.2 | 0 | 109.3 | N14 K16 F20 | N14-K18 PolarHBondContact ND2-O 2.98Å; N14-K18 PolarHBondContact OD1-O 3.25Å; K16-K18 PolarHBondContact O-N 2.98Å; K18-F20 PolarHBondContact O-N 3.36Å; K18-F20 VanDerWaalsContact O-N 3.16Å |
| 19 | K | 73.9 | Confident | 76.3 | Confident | 192 Ų | 192 | 115.6 Ų | 115.6 | 84% | 0.835 | 59% | 0.593 | S | S | * | * | | | trans | -71.5 | 112.1 | 177.4 | -47.3 | -162.1 | -176.3 | -177.7 | 0 | 108.8 | G17 K21 | G17-K19 PolarHBondContact O-N 2.89Å; K19-K21 PolarHBondContact O-N 2.94Å |
| 20 | F | 72.4 | Confident | 77.2 | Confident | 109 Ų | 109 | 119.2 Ų | 119.2 | 48% | 0.478 | 61% | 0.61 | S | S | . | * | | | trans | -65.8 | 127.4 | 170.9 | -75.5 | -79.4 | 0 | 0 | 0 | 108.5 | N14 K18 D24 I25 | N14-F20 HydrophobicContact CB-CE2 4.05Å; N14-F20 VanDerWaalsContact ND2-CE2 3.35Å; N14-F20 WeakPolarHBondContact ND2-CE2 3.48Å; K18-F20 PolarHBondContact O-N 3.36Å; K18-F20 VanDerWaalsContact O-N 3.16Å; F20-D24 HydrophobicContact CD1-CB 4.02Å; F20-I25 HydrophobicContact CB-CD1 4.11Å; F20-I25 HydrophobicContact CB-CG1 4.14Å |
| 21 | K | 81.8 | Confident | 77.9 | Confident | 123 Ų | 123 | 116.8 Ų | 116.8 | 54% | 0.535 | 60% | 0.604 | S | S | . | * | | | trans | -76 | 154 | 173.9 | -67.3 | 177.6 | 179.6 | 177.4 | 0 | 107.8 | K19 R23 D24 | K19-K21 PolarHBondContact O-N 2.94Å; K21-R23 HydrophobicContact CB-CG 3.82Å; K21-R23 PolarHBondContact O-N 3.49Å; K21-R23 VanDerWaalsContact O-N 3.1Å; K21-D24 PolarHBondContact N-OD2 3.15Å; K21-D24 WeakPolarHBondContact O-CA 3.43Å; K21-D24 WeakPolarHBondContact O-CB 3.45Å; K21-D24 PolarHBondContact O-N 3.16Å |
| 22 | L | 82.9 | Confident | 78.8 | Confident | 102 Ų | 102 | 118.3 Ų | 118.3 | 53% | 0.534 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -54.3 | -33.4 | 176.4 | -71.9 | 173.2 | 0 | 0 | 0 | 112.5 | L9 D24 I25 L26 | L9-L22 HydrophobicContact CD1-CD2 4.3Å; L9-L22 HydrophobicContact CD2-CD2 4.08Å; L22-D24 PolarHBondContact O-N 3.41Å; L22-I25 PolarHBondContact O-N 3.08Å; L22-I25 VanDerWaalsContact O-N 3.1Å; L22-L26 WeakPolarHBondContact O-CB 3.35Å; L22-L26 PolarHBondContact O-N 3.33Å |
| 23 | R | 84.5 | Confident | 79.9 | Confident | 191 Ų | 191 | 119.2 Ų | 119.2 | 72% | 0.721 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.1 | -21.7 | 174.2 | 74.2 | -176.5 | 74.7 | -179.1 | -1.2 | 114.6 | K21 | K21-R23 HydrophobicContact CB-CG 3.82Å; K21-R23 PolarHBondContact O-N 3.49Å; K21-R23 VanDerWaalsContact O-N 3.1Å |
| 24 | D | 83.8 | Confident | 81.1 | Confident | 97 Ų | 97 | 117.9 Ų | 117.9 | 52% | 0.519 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -87.5 | -16.3 | 177.5 | -50.8 | -28.7 | 0 | 0 | 0 | 111.1 | F20 K21 L22 | F20-D24 HydrophobicContact CD1-CB 4.02Å; K21-D24 PolarHBondContact N-OD2 3.15Å; K21-D24 WeakPolarHBondContact O-CA 3.43Å; K21-D24 WeakPolarHBondContact O-CB 3.45Å; K21-D24 PolarHBondContact O-N 3.16Å; L22-D24 PolarHBondContact O-N 3.41Å |
| 25 | I | 85.4 | Confident | 82.2 | Confident | 50 Ų | 50 | 122 Ų | 122 | 26% | 0.256 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -102.3 | -40.4 | -177.2 | -56.8 | 171 | 0 | 0 | 0 | 110.5 | A11 F20 L22 | A11-I25 HydrophobicContact CB-CD1 3.9Å; F20-I25 HydrophobicContact CB-CD1 4.11Å; F20-I25 HydrophobicContact CB-CG1 4.14Å; L22-I25 PolarHBondContact O-N 3.08Å; L22-I25 VanDerWaalsContact O-N 3.1Å |
| 26 | L | 84.8 | Confident | 83.1 | Confident | 51 Ų | 51 | 114.1 Ų | 114.1 | 27% | 0.267 | 61% | 0.61 | S | S | . | * | S | Bend | trans | -94.7 | 115.1 | 178.4 | -62.5 | 176.5 | 0 | 0 | 0 | 109.6 | L9 L22 M30 | L9-L26 HydrophobicContact CD2-CD1 4.14Å; L9-L26 HydrophobicContact CD2-CD2 3.82Å; L9-L26 HydrophobicContact CD2-CG 4.1Å; L22-L26 WeakPolarHBondContact O-CB 3.35Å; L22-L26 PolarHBondContact O-N 3.33Å; L26-M30 HydrophobicContact CD2-CE 4.16Å |
| 27 | S | 87.7 | Confident | 84.2 | Confident | 67 Ų | 67 | 110.3 Ų | 110.3 | 47% | 0.469 | 60% | 0.599 | S | S | . | * | | | trans | -81.7 | 147.8 | 169 | -64.8 | 0 | 0 | 0 | 0 | 110.1 | D29 M30 | S27-D29 PolarHBondContact O-N 3.24Å; S27-M30 WeakPolarHBondContact O-CB 3.36Å; S27-M30 PolarHBondContact O-N 3.22Å |
| 28 | P | 87.8 | Confident | 84.8 | Confident | 112 Ų | 112 | 115.4 Ų | 115.4 | 73% | 0.727 | 60% | 0.603 | S | S | * | * | G | 310 helix | trans | -55.4 | -33.6 | 178.9 | -26.6 | 34.8 | 0 | 0 | 0 | 113.8 | M30 I31 | P28-M30 PolarHBondContact O-N 3.16Å; P28-I31 WeakPolarHBondContact O-CB 3.49Å; P28-I31 PolarHBondContact O-N 2.99Å; P28-I31 VanDerWaalsContact O-O 3.11Å |
| 29 | D | 90.3 | Very high | 85.3 | Confident | 160 Ų | 160 | 117.1 Ų | 117.1 | 86% | 0.856 | 61% | 0.605 | S | S | * | * | G | 310 helix | trans | -66.1 | -21.3 | 177.6 | -169.2 | 51.5 | 0 | 0 | 0 | 113.4 | S27 I31 | S27-D29 PolarHBondContact O-N 3.24Å; D29-I31 PolarHBondContact O-N 3.18Å |
| 30 | M | 92.7 | Very high | 85.7 | Confident | 121 Ų | 121 | 116.8 Ų | 116.8 | 60% | 0.596 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -80.4 | -8.2 | 172.9 | -60.9 | 176.5 | 55.9 | 0 | 0 | 112.8 | L26 S27 P28 | L26-M30 HydrophobicContact CD2-CE 4.16Å; S27-M30 WeakPolarHBondContact O-CB 3.36Å; S27-M30 PolarHBondContact O-N 3.22Å; P28-M30 PolarHBondContact O-N 3.16Å |
| 31 | I | 88.5 | Confident | 85.9 | Confident | 112 Ų | 112 | 117.3 Ų | 117.3 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | S | Bend | trans | -105.3 | 108.8 | 179.2 | -55.1 | 174.4 | 0 | 0 | 0 | 106.7 | P28 D29 | P28-I31 WeakPolarHBondContact O-CB 3.49Å; P28-I31 PolarHBondContact O-N 2.99Å; P28-I31 VanDerWaalsContact O-O 3.11Å; D29-I31 PolarHBondContact O-N 3.18Å |
| 32 | S | 88.4 | Confident | 85.3 | Confident | 80 Ų | 80 | 115.5 Ų | 115.5 | 56% | 0.559 | 61% | 0.613 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 146.6 | 176.9 | 58.1 | 0 | 0 | 0 | 0 | 111 | | |
| 33 | P | 90.5 | Very high | 84.7 | Confident | 102 Ų | 102 | 117.9 Ų | 117.9 | 66% | 0.662 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 161.4 | 168 | 27.2 | -34.4 | 0 | 0 | 0 | 110.5 | L35 | P33-L35 PolarHBondContact O-N 3.29Å; P33-L35 VanDerWaalsContact O-N 3.16Å |
| 34 | P | 88.4 | Confident | 84 | Confident | 118 Ų | 118 | 113.5 Ų | 113.5 | 77% | 0.766 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 126.4 | 174.4 | 23.1 | -33.6 | 0 | 0 | 0 | 109.4 | G36 | P34-G36 PolarHBondContact O-N 3.17Š|
| 35 | L | 86.9 | Confident | 82.9 | Confident | 143 Ų | 143 | 109.4 Ų | 109.4 | 75% | 0.749 | 59% | 0.592 | S | S | * | * | | | trans | -71.6 | 3.6 | -171.4 | -75.7 | 154.3 | 0 | 0 | 0 | 113.4 | P33 D37 | P33-L35 PolarHBondContact O-N 3.29Å; P33-L35 VanDerWaalsContact O-N 3.16Å; L35-D37 PolarHBondContact O-N 2.96Å |
| 36 | G | 86.4 | Confident | 81.9 | Confident | 47 Ų | 47 | 115.2 Ų | 115.2 | 49% | 0.485 | 62% | 0.616 | S | S | . | * | | | trans | 66.6 | 15.6 | -177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | P34 F38 | P34-G36 PolarHBondContact O-N 3.17Å; G36-F38 PolarHBondContact O-N 2.83Å |
| 37 | D | 87.4 | Confident | 80.7 | Confident | 115 Ų | 115 | 120.2 Ų | 120.2 | 62% | 0.615 | 64% | 0.638 | S | S | * | * | | | trans | -76.1 | 58.8 | 171.4 | 67.8 | -37 | 0 | 0 | 0 | 110.1 | L35 R39 | L35-D37 PolarHBondContact O-N 2.96Å; D37-R39 VanDerWaalsContact C-N 3.28Å; D37-R39 PolarHBondContact O-N 3.1Å |
| 38 | F | 82.6 | Confident | 79.9 | Confident | 176 Ų | 176 | 118.1 Ų | 118.1 | 77% | 0.772 | 63% | 0.627 | S | S | * | * | | | trans | -68.5 | 90.8 | 175 | -69.1 | -77.7 | 0 | 0 | 0 | 109.3 | G36 | G36-F38 PolarHBondContact O-N 2.83Š|
| 39 | R | 84.9 | Confident | 78.4 | Confident | 192 Ų | 192 | 122.2 Ų | 122.2 | 73% | 0.725 | 64% | 0.636 | S | S | * | * | | | trans | -89.2 | 119.5 | 168.9 | -65.8 | -179.7 | 55 | -124 | -9.3 | 107.4 | D37 T41 | D37-R39 VanDerWaalsContact C-N 3.28Å; D37-R39 PolarHBondContact O-N 3.1Å; R39-T41 PolarHBondContact O-N 2.91Å |
| 40 | H | 81.2 | Confident | 76.9 | Confident | 185 Ų | 185 | 122 Ų | 122 | 86% | 0.856 | 63% | 0.629 | S | S | * | * | | | trans | -65 | 104 | 167.9 | -65.9 | 79.2 | 0 | 0 | 0 | 107 | | |
| 41 | T | 76.4 | Confident | 75.7 | Confident | 120 Ų | 120 | 118.6 Ų | 118.6 | 74% | 0.736 | 61% | 0.614 | S | S | * | * | | | trans | -85.4 | -19.9 | -178.9 | 50.2 | 0 | 0 | 0 | 0 | 112.3 | R39 | R39-T41 PolarHBondContact O-N 2.91Š|
| 42 | I | 70.4 | Confident | 74.2 | Confident | 85 Ų | 85 | 119 Ų | 119 | 44% | 0.436 | 62% | 0.621 | S | S | . | * | | | trans | -151.8 | 140.7 | -174.6 | -168.3 | 160.1 | 0 | 0 | 0 | 109.7 | I44 F53 | I42-I44 HydrophobicContact CG2-CG1 4.48Å; I42-F53 HydrophobicContact CD1-CB 3.98Å; I42-F53 HydrophobicContact CD1-CD1 4.21Å; I42-F53 HydrophobicContact CG1-CB 3.98Å; I42-F53 HydrophobicContact CG1-CD1 4.48Å |
| 43 | H | 69.2 | Low | 72.8 | Confident | 151 Ų | 151 | 121.1 Ų | 121.1 | 70% | 0.699 | 62% | 0.621 | S | S | * | * | | | trans | -92.4 | 119.7 | 165.7 | 179.8 | 75.1 | 0 | 0 | 0 | 106.6 | | |
| 44 | I | 69.9 | Low | 71.7 | Confident | 99 Ų | 99 | 118.1 Ų | 118.1 | 51% | 0.508 | 61% | 0.608 | S | S | . | * | | | trans | -90.8 | 107 | 169.1 | -56.3 | 173.3 | 0 | 0 | 0 | 105.4 | I42 I56 | I42-I44 HydrophobicContact CG2-CG1 4.48Å; I44-I56 HydrophobicContact CG2-CG2 3.98Å |
| 45 | G | 62.1 | Low | 71 | Confident | 12 Ų | 12 | 118.3 Ų | 118.3 | 12% | 0.124 | 60% | 0.603 | C | S | . | * | | | trans | -66.7 | 141.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | E47 D51 | G45-E47 PolarHBondContact O-N 2.9Å; G45-D51 WeakPolarHBondContact CA-OD2 3.14Å; G45-D51 PolarHBondContact N-OD2 3.45Å |
| 46 | K | 63.8 | Low | 70.4 | Confident | 172 Ų | 172 | 113.6 Ų | 113.6 | 75% | 0.748 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | -10.7 | 178.6 | -177 | 175.2 | 161.1 | 175.7 | 0 | 112.9 | G48 G68 | K46-G48 VanDerWaalsContact C-N 3.29Å; K46-G48 PolarHBondContact O-N 3.2Å; K46-G68 VanDerWaalsContact CE-O 3.25Å; K46-G68 WeakPolarHBondContact CE-O 3.23Å; K46-G68 PolarHBondContact NZ-O 3.22Å |
| 47 | E | 59.3 | Low | 69.9 | Low | 156 Ų | 156 | 115.1 Ų | 115.1 | 73% | 0.729 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | 11.3 | -170.1 | -163.2 | 148.8 | 178.2 | 0 | 0 | 114.8 | G45 Q49 | G45-E47 PolarHBondContact O-N 2.9Å; E47-Q49 PolarHBondContact O-N 2.76Å |
| 48 | G | 70.4 | Confident | 69.4 | Low | 23 Ų | 23 | 116.5 Ų | 116.5 | 24% | 0.237 | 58% | 0.582 | C | S | . | * | G | 310 helix | trans | 55.3 | -129.8 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | K46 H50 D51 | K46-G48 VanDerWaalsContact C-N 3.29Å; K46-G48 PolarHBondContact O-N 3.2Å; G48-H50 PolarHBondContact O-N 2.73Å; G48-D51 PolarHBondContact O-N 2.85Å |
| 49 | Q | 57.1 | Low | 69.3 | Low | 197 Ų | 197 | 109.3 Ų | 109.3 | 92% | 0.921 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -53 | -10.3 | -169.5 | -71.7 | -165.1 | -4.8 | 0 | 0 | 117 | E47 | E47-Q49 PolarHBondContact O-N 2.76Š|
| 50 | H | 58.8 | Low | 69 | Low | 156 Ų | 156 | 108.4 Ų | 108.4 | 72% | 0.722 | 56% | 0.555 | S | S | * | * | G | 310 helix | trans | -107.3 | -0.2 | 176.9 | -64.7 | -68 | 0 | 0 | 0 | 114.5 | G48 | G48-H50 PolarHBondContact O-N 2.73Š|
| 51 | D | 66.9 | Low | 68.7 | Low | 49 Ų | 49 | 102.1 Ų | 102.1 | 26% | 0.262 | 54% | 0.541 | S | S | . | . | | | trans | -79.7 | 129.3 | 177.1 | -171.2 | 20.7 | 0 | 0 | 0 | 111.7 | G45 G48 F53 | G45-D51 WeakPolarHBondContact CA-OD2 3.14Å; G45-D51 PolarHBondContact N-OD2 3.45Å; G48-D51 PolarHBondContact O-N 2.85Å; D51-F53 PolarHBondContact O-N 3.35Å; D51-F53 PolarHBondContact OD1-N 2.85Å |
| 52 | V | 58.1 | Low | 68.6 | Low | 122 Ų | 122 | 100.7 Ų | 100.7 | 74% | 0.739 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -72.9 | -14 | -177.5 | 178.4 | 0 | 0 | 0 | 0 | 111.3 | | |
| 53 | F | 58.6 | Low | 68.8 | Low | 124 Ų | 124 | 102 Ų | 102 | 54% | 0.544 | 53% | 0.529 | S | S | . | . | S | Bend | trans | -125.9 | 76.6 | -171.7 | -71.4 | -79.3 | 0 | 0 | 0 | 113.8 | I42 D51 | I42-F53 HydrophobicContact CD1-CB 3.98Å; I42-F53 HydrophobicContact CD1-CD1 4.21Å; I42-F53 HydrophobicContact CG1-CB 3.98Å; I42-F53 HydrophobicContact CG1-CD1 4.48Å; D51-F53 PolarHBondContact O-N 3.35Å; D51-F53 PolarHBondContact OD1-N 2.85Å |
| 54 | G | 67.9 | Low | 69.1 | Low | 39 Ų | 39 | 102 Ų | 102 | 40% | 0.402 | 53% | 0.529 | S | S | . | . | | | trans | 120.2 | 104 | 159.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | I56 | G54-I56 PolarHBondContact O-N 3.1Š|
| 55 | D | 73.4 | Confident | 69.4 | Low | 122 Ų | 122 | 103.7 Ų | 103.7 | 65% | 0.652 | 54% | 0.539 | S | S | * | . | | | trans | -60.4 | 111.6 | 172.1 | -178.5 | 16 | 0 | 0 | 0 | 110.1 | S57 F58 | D55-S57 VanDerWaalsContact CG-OG 3.29Å; D55-S57 PolarHBondContact O-N 3.28Å; D55-S57 WeakPolarHBondContact OD1-CA 3.49Å; D55-S57 WeakPolarHBondContact OD1-CB 3.43Å; D55-S57 PolarHBondContact OD1-N 2.83Å; D55-S57 PolarHBondContact OD1-OG 2.99Å; D55-S57 WeakPolarHBondContact OD2-CB 3.47Å; D55-S57 PolarHBondContact OD2-OG 2.8Å; D55-F58 WeakPolarHBondContact O-CD1 3.25Å |
| 56 | I | 73 | Confident | 69.9 | Low | 43 Ų | 43 | 105.9 Ų | 105.9 | 22% | 0.221 | 55% | 0.547 | C | S | . | . | G | 310 helix | trans | -82.1 | 8.5 | 173.6 | 59.7 | 167.4 | 0 | 0 | 0 | 112.5 | I44 G54 F58 L59 L66 | I44-I56 HydrophobicContact CG2-CG2 3.98Å; G54-I56 PolarHBondContact O-N 3.1Å; I56-F58 HydrophobicContact CB-CE1 4.47Å; I56-F58 HydrophobicContact CG2-CE1 4.45Å; I56-F58 PolarHBondContact O-N 2.94Å; I56-L59 HydrophobicContact CB-CD1 4.06Å; I56-L59 VanDerWaalsContact O-CB 3.31Å; I56-L59 WeakPolarHBondContact O-CB 3.14Å; I56-L59 PolarHBondContact O-N 3.43Å; I56-L66 HydrophobicContact CD1-CD1 4.19Å |
| 57 | S | 76.1 | Confident | 70 | Confident | 80 Ų | 80 | 103.9 Ų | 103.9 | 56% | 0.559 | 55% | 0.551 | S | S | * | * | G | 310 helix | trans | -58.5 | -21.3 | 178.5 | -64.7 | 0 | 0 | 0 | 0 | 113.5 | D55 L59 Q60 | D55-S57 VanDerWaalsContact CG-OG 3.29Å; D55-S57 PolarHBondContact O-N 3.28Å; D55-S57 WeakPolarHBondContact OD1-CA 3.49Å; D55-S57 WeakPolarHBondContact OD1-CB 3.43Å; D55-S57 PolarHBondContact OD1-N 2.83Å; D55-S57 PolarHBondContact OD1-OG 2.99Å; D55-S57 WeakPolarHBondContact OD2-CB 3.47Å; D55-S57 PolarHBondContact OD2-OG 2.8Å; S57-L59 PolarHBondContact O-N 3.16Å; S57-L59 VanDerWaalsContact O-N 3.14Å; S57-Q60 PolarHBondContact O-N 3.19Å |
| 58 | F | 77.9 | Confident | 70 | Confident | 144 Ų | 144 | 98.8 Ų | 98.8 | 63% | 0.632 | 54% | 0.541 | S | S | * | . | G | 310 helix | trans | -58.7 | -24.1 | 172.2 | 73.4 | -92.6 | 0 | 0 | 0 | 112.9 | D55 I56 Q60 | D55-F58 WeakPolarHBondContact O-CD1 3.25Å; I56-F58 HydrophobicContact CB-CE1 4.47Å; I56-F58 HydrophobicContact CG2-CE1 4.45Å; I56-F58 PolarHBondContact O-N 2.94Å; F58-Q60 PolarHBondContact O-N 2.98Å |
| 59 | L | 80.6 | Confident | 69.6 | Low | 24 Ų | 24 | 100.3 Ų | 100.3 | 13% | 0.126 | 54% | 0.544 | C | S | . | . | G | 310 helix | trans | -72.6 | -15.5 | 175.5 | -63.2 | 171.9 | 0 | 0 | 0 | 112.3 | I56 S57 G61 N62 L66 | I56-L59 HydrophobicContact CB-CD1 4.06Å; I56-L59 VanDerWaalsContact O-CB 3.31Å; I56-L59 WeakPolarHBondContact O-CB 3.14Å; I56-L59 PolarHBondContact O-N 3.43Å; S57-L59 PolarHBondContact O-N 3.16Å; S57-L59 VanDerWaalsContact O-N 3.14Å; L59-G61 PolarHBondContact O-N 3.45Å; L59-N62 VanDerWaalsContact O-CB 3.28Å; L59-N62 WeakPolarHBondContact O-CB 3.42Å; L59-N62 PolarHBondContact O-N 2.98Å; L59-N62 PolarHBondContact O-ND2 3.44Å; L59-L66 HydrophobicContact CD1-CD1 3.6Å; L59-L66 HydrophobicContact CD1-CD2 3.66Å; L59-L66 HydrophobicContact CD1-CG 3.62Å |
| 60 | Q | 78.1 | Confident | 69.6 | Low | 173 Ų | 173 | 100.2 Ų | 100.2 | 81% | 0.808 | 54% | 0.544 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.1 | 39 | 176.2 | -59 | 176.5 | 26.8 | 0 | 0 | 113.1 | S57 F58 | S57-Q60 PolarHBondContact O-N 3.19Å; F58-Q60 PolarHBondContact O-N 2.98Å |
| 61 | G | 74.3 | Confident | 69.6 | Low | 53 Ų | 53 | 99.4 Ų | 99.4 | 55% | 0.546 | 54% | 0.54 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.6 | -3.8 | -177.4 | 0 | 0 | 0 | 0 | 0 | 115.9 | L59 Y63 | L59-G61 PolarHBondContact O-N 3.45Å; G61-Y63 WeakPolarHBondContact O-CD1 3.22Å; G61-Y63 WeakPolarHBondContact O-CE1 3.09Å; G61-Y63 PolarHBondContact O-N 2.9Å |
| 62 | N | 74.4 | Confident | 69.2 | Low | 91 Ų | 91 | 106.3 Ų | 106.3 | 49% | 0.487 | 57% | 0.568 | S | S | . | * | | | trans | -82.4 | 50.8 | 174.3 | -60.5 | -77 | 0 | 0 | 0 | 112.3 | L59 E64 L65 | L59-N62 VanDerWaalsContact O-CB 3.28Å; L59-N62 WeakPolarHBondContact O-CB 3.42Å; L59-N62 PolarHBondContact O-N 2.98Å; L59-N62 PolarHBondContact O-ND2 3.44Å; N62-E64 PolarHBondContact O-N 3.19Å; N62-L65 HydrophobicContact CB-CD1 4.07Å; N62-L65 HydrophobicContact CB-CG 4.42Å; N62-L65 PolarHBondContact O-N 3.35Å |
| 63 | Y | 75 | Confident | 68.8 | Low | 112 Ų | 112 | 104 Ų | 104 | 44% | 0.439 | 56% | 0.562 | S | S | . | * | G | 310 helix | trans | -71.6 | -15 | 178.9 | 57.2 | -101 | 0 | 0 | 0 | 113 | G61 L65 L66 N69 | G61-Y63 WeakPolarHBondContact O-CD1 3.22Å; G61-Y63 WeakPolarHBondContact O-CE1 3.09Å; G61-Y63 PolarHBondContact O-N 2.9Å; Y63-L65 PolarHBondContact O-N 2.98Å; Y63-L66 WeakPolarHBondContact O-CB 3.27Å; Y63-L66 PolarHBondContact O-N 3.2Å; Y63-L66 VanDerWaalsContact O-N 3.08Å; Y63-N69 WeakPolarHBondContact CD2-ND2 3.41Å |
| 64 | E | 74.9 | Confident | 68.1 | Low | 152 Ų | 152 | 106.2 Ų | 106.2 | 71% | 0.71 | 57% | 0.573 | S | S | * | * | G | 310 helix | trans | -61.2 | -25.9 | 175.6 | -53.7 | 176.2 | -162.8 | 0 | 0 | 112.6 | N62 L66 | N62-E64 PolarHBondContact O-N 3.19Å; E64-L66 VanDerWaalsContact C-N 3.25Å; E64-L66 PolarHBondContact O-N 2.98Å |
| 65 | L | 76.3 | Confident | 67.2 | Low | 134 Ų | 134 | 113.4 Ų | 113.4 | 70% | 0.702 | 60% | 0.602 | S | S | * | * | G | 310 helix | trans | -79.2 | -11.1 | 178.8 | -57.4 | 179.2 | 0 | 0 | 0 | 112.4 | N62 Y63 | N62-L65 HydrophobicContact CB-CD1 4.07Å; N62-L65 HydrophobicContact CB-CG 4.42Å; N62-L65 PolarHBondContact O-N 3.35Å; Y63-L65 PolarHBondContact O-N 2.98Å |
| 66 | L | 73.7 | Confident | 65.7 | Low | 57 Ų | 57 | 110.6 Ų | 110.6 | 30% | 0.298 | 60% | 0.601 | S | S | . | * | S | Bend | trans | -76.6 | 129.5 | 177.7 | -66.7 | 178.9 | 0 | 0 | 0 | 110.4 | I56 L59 Y63 E64 G68 N69 | I56-L66 HydrophobicContact CD1-CD1 4.19Å; L59-L66 HydrophobicContact CD1-CD1 3.6Å; L59-L66 HydrophobicContact CD1-CD2 3.66Å; L59-L66 HydrophobicContact CD1-CG 3.62Å; Y63-L66 WeakPolarHBondContact O-CB 3.27Å; Y63-L66 PolarHBondContact O-N 3.2Å; Y63-L66 VanDerWaalsContact O-N 3.08Å; E64-L66 VanDerWaalsContact C-N 3.25Å; E64-L66 PolarHBondContact O-N 2.98Å; L66-G68 PolarHBondContact O-N 2.9Å; L66-N69 PolarHBondContact O-N 3.08Å |
| 67 | P | 64.4 | Low | 64.6 | Low | 130 Ų | 130 | 117.4 Ų | 117.4 | 84% | 0.844 | 63% | 0.632 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.7 | 115.5 | 174.1 | -22.8 | 32.7 | 0 | 0 | 0 | 110.8 | | |
| 68 | G | 60.9 | Low | 62.7 | Low | 50 Ų | 50 | 123.3 Ų | 123.3 | 52% | 0.515 | 65% | 0.648 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 101.6 | 5.4 | 173 | 0 | 0 | 0 | 0 | 0 | 116.8 | K46 L66 Q70 | K46-G68 VanDerWaalsContact CE-O 3.25Å; K46-G68 WeakPolarHBondContact CE-O 3.23Å; K46-G68 PolarHBondContact NZ-O 3.22Å; L66-G68 PolarHBondContact O-N 2.9Å; G68-Q70 PolarHBondContact O-N 2.87Å |
| 69 | N | 60.3 | Low | 61.2 | Low | 55 Ų | 55 | 122.8 Ų | 122.8 | 29% | 0.294 | 66% | 0.659 | S | S | . | * | | | trans | -95 | 59.2 | 171.3 | -161.4 | -5.1 | 0 | 0 | 0 | 112.5 | Y63 L66 E71 | Y63-N69 WeakPolarHBondContact CD2-ND2 3.41Å; L66-N69 PolarHBondContact O-N 3.08Å; N69-E71 VanDerWaalsContact C-N 3.32Å; N69-E71 PolarHBondContact O-N 3.36Å |
| 70 | Q | 58.3 | Low | 59.5 | Low | 195 Ų | 195 | 124.7 Ų | 124.7 | 91% | 0.911 | 68% | 0.684 | S | S | * | * | | | trans | -86.3 | 77.6 | 162.2 | -87.9 | -165.1 | 47.8 | 0 | 0 | 108.8 | G68 K72 | G68-Q70 PolarHBondContact O-N 2.87Å; Q70-K72 PolarHBondContact O-N 3.08Å |
| 71 | E | 57.7 | Low | 58.3 | Low | 139 Ų | 139 | 123.7 Ų | 123.7 | 65% | 0.65 | 68% | 0.679 | S | S | * | * | | | trans | -81.1 | 101.5 | 161.7 | -169.5 | 170.1 | -174.7 | 0 | 0 | 108.9 | N69 A73 | N69-E71 VanDerWaalsContact C-N 3.32Å; N69-E71 PolarHBondContact O-N 3.36Å; E71-A73 PolarHBondContact O-N 3.33Å |
| 72 | K | 58.1 | Low | 56.9 | Low | 194 Ų | 194 | 127.9 Ų | 127.9 | 84% | 0.843 | 69% | 0.689 | S | S | * | * | | | trans | 39.5 | 69.7 | 154.2 | -60.6 | 171.4 | -176 | 164.9 | 0 | 116 | Q70 | Q70-K72 PolarHBondContact O-N 3.08Š|
| 73 | A | 51 | Low | 55.8 | Low | 74 Ų | 74 | 129.8 Ų | 129.8 | 61% | 0.612 | 70% | 0.695 | S | S | * | * | | | trans | -123.8 | 110.9 | 164.4 | 0 | 0 | 0 | 0 | 0 | 110 | E71 | E71-A73 PolarHBondContact O-N 3.33Š|
| 74 | H | 44.1 | Very low | 54.6 | Low | 170 Ų | 170 | 133.7 Ų | 133.7 | 79% | 0.787 | 72% | 0.715 | S | S | * | * | | | trans | 94.1 | 90.2 | 157.1 | -48.9 | -66 | 0 | 0 | 0 | 118.6 | G76 | H74-G76 PolarHBondContact O-N 3.49Å; H74-G76 VanDerWaalsContact O-N 3.12Å |
| 75 | L | 48.7 | Very low | 53.2 | Low | 190 Ų | 190 | 134.4 Ų | 134.4 | 100% | 0.995 | 72% | 0.716 | S | S | * | * | | | | -42.6 | 107.4 | 128.1 | -124.6 | 86.8 | 0 | 0 | 0 | 108.2 | | |
| 76 | G | 41 | Very low | 51.7 | Low | 62 Ų | 62 | 139.8 Ų | 139.8 | 64% | 0.639 | 73% | 0.727 | S | S | * | * | | | trans | 162.1 | 92.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | H74 F78 | H74-G76 PolarHBondContact O-N 3.49Å; H74-G76 VanDerWaalsContact O-N 3.12Å; G76-F78 PolarHBondContact O-N 3.24Å |
| 77 | Q | 50.6 | Low | 50.3 | Low | 186 Ų | 186 | 140.6 Ų | 140.6 | 87% | 0.869 | 74% | 0.742 | S | S | * | * | | | trans | -52.6 | 119 | 170.3 | -67.2 | 165.8 | 14.8 | 0 | 0 | 111.1 | | |
| 78 | F | 37 | Very low | 49.7 | Very low | 204 Ų | 204 | 142 Ų | 142 | 90% | 0.895 | 74% | 0.743 | S | S | * | * | | | trans | -146.7 | 126.5 | 143.6 | -85.8 | -72.6 | 0 | 0 | 0 | 109.4 | G76 | G76-F78 PolarHBondContact O-N 3.24Š|
| 79 | P | 46.7 | Very low | 49.3 | Very low | 133 Ų | 133 | 145.3 Ų | 145.3 | 86% | 0.864 | 76% | 0.757 | S | S | * | * | | | trans | -88 | 114.7 | -178.3 | 15.2 | 1 | 0 | 0 | 0 | 110.2 | | |
| 80 | G | 44.7 | Very low | 48.3 | Very low | 64 Ų | 64 | 148.5 Ų | 148.5 | 66% | 0.66 | 78% | 0.779 | S | S | * | * | | | trans | -161.2 | 87.6 | 177 | 0 | 0 | 0 | 0 | 0 | 111.3 | | |
| 81 | H | 52.3 | Low | 47.9 | Very low | 153 Ų | 153 | 144.7 Ų | 144.7 | 71% | 0.708 | 77% | 0.774 | S | S | * | * | | | trans | 32.3 | 100.9 | 150.1 | 170.9 | -63.7 | 0 | 0 | 0 | 115.7 | | |
| 82 | N | 45 | Very low | 47.5 | Very low | 140 Ų | 140 | 145.9 Ų | 145.9 | 75% | 0.749 | 79% | 0.785 | S | S | * | * | | | trans | -138.9 | 75.2 | 145.4 | -81.9 | -54.8 | 0 | 0 | 0 | 106.7 | F84 | N82-F84 PolarHBondContact O-N 2.98Š|
| 83 | E | 51.1 | Low | 46.5 | Very low | 132 Ų | 132 | 142.1 Ų | 142.1 | 62% | 0.617 | 78% | 0.783 | S | S | * | * | | | trans | -76.1 | 77 | 175.2 | -60.7 | -166.5 | 142.2 | 0 | 0 | 109.9 | F85 | E83-F85 HydrophobicContact CB-CD2 3.79Å; E83-F85 HydrophobicContact CB-CE2 4.12Å; E83-F85 HydrophobicContact CG-CD2 3.88Å; E83-F85 HydrophobicContact CG-CE2 3.7Å |
| 84 | F | 49.4 | Very low | 46 | Very low | 193 Ų | 193 | 145 Ų | 145 | 85% | 0.846 | 79% | 0.793 | S | S | * | * | | | trans | -98.4 | 60.1 | 149.7 | -64.4 | -72.8 | 0 | 0 | 0 | 108.1 | N82 R86 | N82-F84 PolarHBondContact O-N 2.98Å; F84-R86 VanDerWaalsContact C-N 3.35Å; F84-R86 PolarHBondContact O-N 3.47Å |
| 85 | F | 44.9 | Very low | 46.3 | Very low | 168 Ų | 168 | 146.3 Ų | 146.3 | 74% | 0.737 | 80% | 0.797 | S | S | * | * | | | trans | -66.5 | 99.3 | 165 | -72.1 | -71.2 | 0 | 0 | 0 | 107.8 | E83 A87 | E83-F85 HydrophobicContact CB-CD2 3.79Å; E83-F85 HydrophobicContact CB-CE2 4.12Å; E83-F85 HydrophobicContact CG-CD2 3.88Å; E83-F85 HydrophobicContact CG-CE2 3.7Å; F85-A87 PolarHBondContact O-N 3.2Å |
| 86 | R | 45.8 | Very low | 45.9 | Very low | 246 Ų | 246 | 143.3 Ų | 143.3 | 93% | 0.928 | 79% | 0.786 | S | S | * | * | | | trans | -67.1 | 83.9 | 147 | -166.3 | 176.7 | -157 | -138.1 | 4.1 | 106 | F84 N88 | F84-R86 VanDerWaalsContact C-N 3.35Å; F84-R86 PolarHBondContact O-N 3.47Å; R86-N88 PolarHBondContact O-N 3.28Å |
| 87 | A | 43.9 | Very low | 46.5 | Very low | 75 Ų | 75 | 149.2 Ų | 149.2 | 62% | 0.62 | 80% | 0.797 | S | S | * | * | | | trans | -54.5 | 122.1 | 163.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | F85 | F85-A87 PolarHBondContact O-N 3.2Š|
| 88 | N | 52.6 | Low | 46.3 | Very low | 160 Ų | 160 | 145.6 Ų | 145.6 | 86% | 0.856 | 79% | 0.788 | S | S | * | * | | | trans | 175.4 | 63.1 | 145.5 | -82.2 | 5.5 | 0 | 0 | 0 | 107.3 | R86 | R86-N88 PolarHBondContact O-N 3.28Š|
| 89 | S | 52 | Low | 47 | Very low | 118 Ų | 118 | 142 Ų | 142 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | | | trans | -144.7 | 77.7 | 161.5 | -169.6 | 0 | 0 | 0 | 0 | 107.7 | | |
| 90 | T | 40 | Very low | 46.8 | Very low | 122 Ų | 122 | 140.1 Ų | 140.1 | 75% | 0.748 | 78% | 0.775 | S | S | * | * | | | trans | -150.6 | 103.9 | 156.8 | 46.3 | 0 | 0 | 0 | 0 | 106.6 | | |
| 91 | S | 49.8 | Very low | 47.3 | Very low | 116 Ų | 116 | 142.8 Ų | 142.8 | 81% | 0.811 | 78% | 0.781 | S | S | * | * | | | trans | -47.6 | 144.5 | 146.7 | 46.6 | 0 | 0 | 0 | 0 | 109.9 | | |
| 92 | D | 48 | Very low | 47.5 | Very low | 164 Ų | 164 | 140.9 Ų | 140.9 | 88% | 0.877 | 78% | 0.78 | S | S | * | * | | | trans | 71.6 | 90.6 | -175.7 | -84.7 | -26.4 | 0 | 0 | 0 | 116.2 | | |
| 93 | S | 37.5 | Very low | 48 | Very low | 114 Ų | 114 | 140.5 Ų | 140.5 | 80% | 0.797 | 78% | 0.777 | S | S | * | * | | | trans | -140.5 | 128.4 | 145.3 | 72 | 0 | 0 | 0 | 0 | 111.4 | | |
| 94 | V | 41 | Very low | 48.4 | Very low | 135 Ų | 135 | 144 Ų | 144 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | | | trans | -62.7 | 136.8 | -179.3 | 179.9 | 0 | 0 | 0 | 0 | 109.4 | T96 | V94-T96 PolarHBondContact O-N 3.32Š|
| 95 | F | 51 | Low | 48.8 | Very low | 198 Ų | 198 | 142.7 Ų | 142.7 | 87% | 0.868 | 79% | 0.792 | S | S | * | * | | | trans | -32.7 | 112.2 | 171.2 | -110.8 | -106.9 | 0 | 0 | 0 | 113.5 | | |
| 96 | T | 39.3 | Very low | 49.5 | Very low | 126 Ų | 126 | 137.4 Ų | 137.4 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | | | trans | -132.7 | 103.2 | 151.2 | 54 | 0 | 0 | 0 | 0 | 109.5 | V94 T98 | V94-T96 PolarHBondContact O-N 3.32Å; T96-T98 PolarHBondContact O-N 3.39Å |
| 97 | E | 53.5 | Low | 50.2 | Low | 186 Ų | 186 | 133.2 Ų | 133.2 | 87% | 0.869 | 77% | 0.774 | S | S | * | * | | | trans | -45.9 | 107.1 | 167.3 | -176.4 | 177.5 | 175.5 | 0 | 0 | 111.5 | | |
| 98 | T | 46.3 | Very low | 50.7 | Low | 110 Ų | 110 | 134.8 Ų | 134.8 | 68% | 0.675 | 78% | 0.78 | S | S | * | * | | | trans | -132.9 | 124.2 | 160.3 | 55 | 0 | 0 | 0 | 0 | 108 | T96 S100 | T96-T98 PolarHBondContact O-N 3.39Å; T98-S100 PolarHBondContact O-N 3.49Å |
| 99 | P | 52.2 | Low | 51 | Low | 128 Ų | 128 | 134 Ų | 134 | 83% | 0.831 | 78% | 0.775 | S | S | * | * | | | trans | -76.3 | 95 | -177.2 | 29.7 | -32.8 | 0 | 0 | 0 | 109.3 | | |
| 100 | S | 42.5 | Very low | 51.2 | Low | 95 Ų | 95 | 134.2 Ų | 134.2 | 66% | 0.664 | 77% | 0.774 | S | S | * | * | | | trans | -65.8 | 128.7 | 171.1 | -74.3 | 0 | 0 | 0 | 0 | 109.9 | T98 V102 | T98-S100 PolarHBondContact O-N 3.49Å; S100-V102 PolarHBondContact O-N 3.2Å |
| 101 | P | 54.3 | Low | 52.1 | Low | 119 Ų | 119 | 135.2 Ų | 135.2 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | S | Bend | trans | -83.9 | 58 | -177.2 | 35.9 | -36.2 | 0 | 0 | 0 | 110.6 | | |
| 102 | V | 57.6 | Low | 52.2 | Low | 114 Ų | 114 | 136.2 Ų | 136.2 | 69% | 0.691 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -138.3 | 121.9 | 173 | -169.3 | 0 | 0 | 0 | 0 | 107.3 | S100 | S100-V102 PolarHBondContact O-N 3.2Š|
| 103 | L | 55 | Low | 52.2 | Low | 132 Ų | 132 | 131.8 Ų | 131.8 | 69% | 0.691 | 77% | 0.768 | S | S | * | * | | | trans | 89.9 | 56.4 | -178.9 | -42.9 | 179.9 | 0 | 0 | 0 | 116.3 | N105 A106 | L103-N105 PolarHBondContact O-N 2.96Å; L103-A106 HydrophobicContact CB-CB 3.84Å; L103-A106 HydrophobicContact CD1-CB 4.45Å; L103-A106 PolarHBondContact O-N 2.84Å |
| 104 | K | 59.5 | Low | 52.9 | Low | 205 Ų | 205 | 129.2 Ų | 129.2 | 89% | 0.891 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.8 | -6 | 160.8 | -64.4 | -174.5 | 179.9 | -174.6 | 0 | 114 | | |
| 105 | N | 57.7 | Low | 53.6 | Low | 165 Ų | 165 | 129.2 Ų | 129.2 | 88% | 0.882 | 77% | 0.765 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107 | 6.4 | 175.5 | -80.8 | -25.4 | 0 | 0 | 0 | 113.5 | L103 | L103-N105 PolarHBondContact O-N 2.96Š|
| 106 | A | 60.4 | Low | 53.6 | Low | 58 Ų | 58 | 127.5 Ų | 127.5 | 48% | 0.479 | 76% | 0.76 | S | S | . | * | S | Bend | trans | -87.4 | 116.1 | 167.2 | 0 | 0 | 0 | 0 | 0 | 107.6 | L103 S108 | L103-A106 HydrophobicContact CB-CB 3.84Å; L103-A106 HydrophobicContact CD1-CB 4.45Å; L103-A106 PolarHBondContact O-N 2.84Å; A106-S108 PolarHBondContact O-N 3.35Å |
| 107 | I | 60.5 | Low | 54.4 | Low | 157 Ų | 157 | 125.6 Ų | 125.6 | 81% | 0.805 | 76% | 0.757 | S | S | * | * | | | trans | -57.4 | 109.6 | 165.3 | -54.5 | 162.7 | 0 | 0 | 0 | 105.4 | L109 | I107-L109 PolarHBondContact O-N 3.44Å; I107-L109 VanDerWaalsContact O-N 3.08Å |
| 108 | S | 54.7 | Low | 54.4 | Low | 108 Ų | 108 | 124.3 Ų | 124.3 | 76% | 0.755 | 76% | 0.755 | S | S | * | * | | | trans | -65 | 111.4 | 177.4 | 50.6 | 0 | 0 | 0 | 0 | 108.2 | A106 | A106-S108 PolarHBondContact O-N 3.35Š|
| 109 | L | 59.1 | Low | 54.5 | Low | 145 Ų | 145 | 127.5 Ų | 127.5 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | | | trans | -70 | 134.7 | 167.3 | -61.7 | 177.2 | 0 | 0 | 0 | 107.7 | I107 T111 | I107-L109 PolarHBondContact O-N 3.44Å; I107-L109 VanDerWaalsContact O-N 3.08Å; L109-T111 PolarHBondContact O-N 3.48Å; L109-T111 VanDerWaalsContact O-N 3.13Å |
| 110 | P | 55.8 | Low | 54.7 | Low | 122 Ų | 122 | 128.2 Ų | 128.2 | 79% | 0.792 | 76% | 0.761 | S | S | * | * | | | trans | -61.2 | 119.6 | 169.8 | 24.9 | -31 | 0 | 0 | 0 | 108.6 | I112 | P110-I112 PolarHBondContact O-N 3.04Š|
| 111 | T | 57.7 | Low | 55.3 | Low | 143 Ų | 143 | 128.9 Ų | 128.9 | 88% | 0.877 | 76% | 0.763 | S | S | * | * | | | trans | -71.4 | 99 | 173.1 | -54.7 | 0 | 0 | 0 | 0 | 108.3 | L109 G113 | L109-T111 PolarHBondContact O-N 3.48Å; L109-T111 VanDerWaalsContact O-N 3.13Å; T111-G113 PolarHBondContact O-N 3.08Å |
| 112 | I | 52.1 | Low | 55.3 | Low | 137 Ų | 137 | 131.6 Ų | 131.6 | 70% | 0.703 | 77% | 0.77 | S | S | * | * | | | trans | -78.2 | 109.1 | 169.5 | -163.6 | 85.7 | 0 | 0 | 0 | 107.7 | P110 | P110-I112 PolarHBondContact O-N 3.04Š|
| 113 | G | 49.4 | Very low | 54.9 | Low | 71 Ų | 71 | 134 Ų | 134 | 73% | 0.732 | 78% | 0.778 | S | S | * | * | | | trans | -73.3 | 127.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | T111 | T111-G113 PolarHBondContact O-N 3.08Š|
| 114 | G | 51 | Low | 54.9 | Low | 60 Ų | 60 | 132.2 Ų | 132.2 | 62% | 0.619 | 78% | 0.777 | S | S | * | * | S | Bend | trans | 83.7 | 141.3 | 169.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | Q116 | G114-Q116 PolarHBondContact O-N 3.2Š|
| 115 | S | 56.1 | Low | 54.3 | Low | 134 Ų | 134 | 128.2 Ų | 128.2 | 94% | 0.937 | 77% | 0.771 | S | S | * | * | | | trans | -60.1 | 94 | 174.3 | 51.1 | 0 | 0 | 0 | 0 | 111 | | |
| 116 | Q | 50.5 | Low | 53.6 | Low | 162 Ų | 162 | 126.6 Ų | 126.6 | 76% | 0.757 | 77% | 0.767 | S | S | * | * | | | trans | -122.9 | 113.6 | 164.9 | -166.5 | 171.9 | 15 | 0 | 0 | 107.5 | G114 L118 | G114-Q116 PolarHBondContact O-N 3.2Å; Q116-L118 PolarHBondContact O-N 2.66Å |
| 117 | A | 56.3 | Low | 52.8 | Low | 86 Ų | 86 | 128.6 Ų | 128.6 | 71% | 0.711 | 77% | 0.773 | S | S | * | * | | | trans | -54.7 | 134.8 | 175 | 0 | 0 | 0 | 0 | 0 | 109.6 | M119 | A117-M119 VanDerWaalsContact C-N 3.32Å; A117-M119 PolarHBondContact O-N 3.41Å |
| 118 | L | 54 | Low | 51.6 | Low | 159 Ų | 159 | 129.7 Ų | 129.7 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | | | trans | -62.8 | 93.5 | 176.2 | -64.3 | 175.9 | 0 | 0 | 0 | 108.8 | Q116 L120 | Q116-L118 PolarHBondContact O-N 2.66Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.3Å |
| 119 | M | 47.8 | Very low | 50.8 | Low | 177 Ų | 177 | 131.5 Ų | 131.5 | 87% | 0.872 | 77% | 0.774 | S | S | * | * | | | trans | -70 | 98.7 | 166 | -70.2 | -156.9 | 71.2 | 0 | 0 | 107.1 | A117 | A117-M119 VanDerWaalsContact C-N 3.32Å; A117-M119 PolarHBondContact O-N 3.41Å |
| 120 | L | 55.9 | Low | 50 | Low | 144 Ų | 144 | 129.4 Ų | 129.4 | 75% | 0.754 | 77% | 0.772 | S | S | * | * | | | trans | -59.4 | 136.1 | 173.6 | -65.9 | 174.6 | 0 | 0 | 0 | 108.9 | L118 L122 | L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.3Å; L120-L122 PolarHBondContact O-N 2.85Å; L120-L122 VanDerWaalsContact O-N 3.15Å |
| 121 | P | 55 | Low | 49.1 | Very low | 108 Ų | 108 | 133.5 Ų | 133.5 | 70% | 0.701 | 78% | 0.777 | S | S | * | * | | | trans | -56 | 122.7 | 170.1 | -21.5 | 31.7 | 0 | 0 | 0 | 109.3 | L123 | P121-L123 VanDerWaalsContact C-N 3.35Å; P121-L123 PolarHBondContact O-N 3.47Å |
| 122 | L | 54.3 | Low | 48.3 | Very low | 177 Ų | 177 | 135.9 Ų | 135.9 | 93% | 0.927 | 78% | 0.778 | S | S | * | * | | | trans | -61.8 | 98.5 | 170.9 | -69.6 | 167.6 | 0 | 0 | 0 | 107.6 | L120 S124 | L120-L122 PolarHBondContact O-N 2.85Å; L120-L122 VanDerWaalsContact O-N 3.15Å; L122-S124 PolarHBondContact O-N 3.36Å; L122-S124 VanDerWaalsContact O-N 3.13Å |
| 123 | L | 50.2 | Low | 47.2 | Very low | 165 Ų | 165 | 138.1 Ų | 138.1 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | | | trans | -66.1 | 112 | 173.5 | -68.4 | 171.5 | 0 | 0 | 0 | 108 | P121 | P121-L123 VanDerWaalsContact C-N 3.35Å; P121-L123 PolarHBondContact O-N 3.47Å |
| 124 | S | 54.2 | Low | 46.9 | Very low | 94 Ų | 94 | 139 Ų | 139 | 66% | 0.657 | 78% | 0.781 | S | S | * | * | | | trans | -60.6 | 130.1 | 169.9 | 51.9 | 0 | 0 | 0 | 0 | 109.7 | L122 V126 | L122-S124 PolarHBondContact O-N 3.36Å; L122-S124 VanDerWaalsContact O-N 3.13Å; S124-V126 PolarHBondContact O-N 3.49Å; S124-V126 VanDerWaalsContact O-N 3.1Å |
| 125 | P | 47.2 | Very low | 46.2 | Very low | 120 Ų | 120 | 145.1 Ų | 145.1 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | | | trans | -74.5 | 106 | 176.6 | 29.3 | -29.8 | 0 | 0 | 0 | 108.7 | | |
| 126 | V | 42.6 | Very low | 45.3 | Very low | 132 Ų | 132 | 142.2 Ų | 142.2 | 80% | 0.8 | 78% | 0.782 | S | S | * | * | | | trans | -92.1 | 115.1 | 164 | 173.9 | 0 | 0 | 0 | 0 | 107.9 | S124 | S124-V126 PolarHBondContact O-N 3.49Å; S124-V126 VanDerWaalsContact O-N 3.1Å |
| 127 | T | 45.3 | Very low | 44.8 | Very low | 99 Ų | 99 | 140.8 Ų | 140.8 | 61% | 0.607 | 79% | 0.787 | S | S | * | * | | | trans | -91 | 148.8 | 176.7 | 51.5 | 0 | 0 | 0 | 0 | 111.8 | | |
| 128 | F | 35.3 | Very low | 44.1 | Very low | 181 Ų | 181 | 141.4 Ų | 141.4 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | | | trans | 75.2 | 142.5 | 165.5 | -57.9 | -77.2 | 0 | 0 | 0 | 116.6 | | |
| 129 | N | 36.8 | Very low | 43.4 | Very low | 145 Ų | 145 | 143.6 Ų | 143.6 | 78% | 0.775 | 80% | 0.795 | S | S | * | * | | | cis | -159.7 | 164.4 | 22.8 | -134.7 | -13.3 | 0 | 0 | 0 | 112.7 | | |
| 130 | S | 43.6 | Very low | 43.5 | Very low | 102 Ų | 102 | 142.6 Ų | 142.6 | 71% | 0.713 | 79% | 0.792 | S | S | * | * | | | trans | -68.9 | 147.5 | 177.3 | 65.8 | 0 | 0 | 0 | 0 | 113.9 | | |
| 131 | K | 35 | Very low | 42.7 | Very low | 207 Ų | 207 | 141.8 Ų | 141.8 | 90% | 0.9 | 80% | 0.795 | S | S | * | * | | | trans | -170.3 | 124.8 | 135.5 | -104.2 | -179.6 | -174.9 | -167.2 | 0 | 111.4 | | |
| 132 | Q | 41.5 | Very low | 41.9 | Very low | 194 Ų | 194 | 148 Ų | 148 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | | | trans | -61.2 | 137.5 | 166.9 | -81.8 | 164.7 | -97.6 | 0 | 0 | 110.9 | | |
| 133 | E | 30.2 | Very low | 40.9 | Very low | 183 Ų | 183 | 147.8 Ų | 147.8 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | | | trans | -156.8 | 135.5 | 141.9 | -157.1 | 131.6 | -170.2 | 0 | 0 | 111.4 | | |
| 134 | S | 41.8 | Very low | 40.1 | Very low | 90 Ų | 90 | 144.5 Ų | 144.5 | 63% | 0.629 | 80% | 0.795 | S | S | * | * | | | trans | -68.9 | 155.8 | 178.3 | 151.3 | 0 | 0 | 0 | 0 | 111.9 | | |
| 135 | F | 37.7 | Very low | 39.1 | Very low | 188 Ų | 188 | 146.2 Ų | 146.2 | 83% | 0.825 | 81% | 0.805 | S | S | * | * | | | | 168.1 | 119.7 | 128.2 | -78.5 | -58.3 | 0 | 0 | 0 | 112.5 | | |
| 136 | G | 35.6 | Very low | 38.4 | Very low | 74 Ų | 74 | 148 Ų | 148 | 76% | 0.763 | 80% | 0.803 | S | S | * | * | | | trans | 96.2 | 128 | 145.2 | 0 | 0 | 0 | 0 | 0 | 119.5 | | |
| 137 | P | 40.3 | Very low | 38 | Very low | 132 Ų | 132 | 147.1 Ų | 147.1 | 86% | 0.857 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 119.9 | 176.4 | 33.8 | -28.4 | 0 | 0 | 0 | 111.4 | | |
| 138 | A | 42.9 | Very low | 37.5 | Very low | 99 Ų | 99 | 148.7 Ų | 148.7 | 82% | 0.818 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 129 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 139 | K | 37.7 | Very low | 37.5 | Very low | 205 Ų | 205 | 148.2 Ų | 148.2 | 89% | 0.891 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 131.2 | -179.5 | -73 | 167.8 | 172 | 172.2 | 0 | 112.4 | | |
| 140 | L | 50.6 | Low | 37.5 | Very low | 155 Ų | 155 | 150.8 Ų | 150.8 | 81% | 0.812 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 133.7 | 157.8 | -66.8 | 173.7 | 0 | 0 | 0 | 108.6 | R142 | L140-R142 PolarHBondContact O-N 3.1Š|
| 141 | P | 39.2 | Very low | 37.1 | Very low | 127 Ų | 127 | 155 Ų | 155 | 83% | 0.825 | 83% | 0.827 | S | S | * | * | | | trans | -72.3 | 101.1 | 175 | -6.9 | 22.9 | 0 | 0 | 0 | 109.6 | | |
| 142 | R | 37.6 | Very low | 36.7 | Very low | 238 Ų | 238 | 154.3 Ų | 154.3 | 90% | 0.898 | 82% | 0.824 | S | S | * | * | | | trans | -86 | 110.9 | 163.6 | -70.6 | -133.1 | -140.3 | 151.3 | 3.7 | 108.5 | L140 S144 | L140-R142 PolarHBondContact O-N 3.1Å; R142-S144 PolarHBondContact O-N 2.91Å |
| 143 | L | 34.7 | Very low | 36.2 | Very low | 174 Ų | 174 | 149 Ų | 149 | 91% | 0.911 | 81% | 0.814 | S | S | * | * | | | trans | -76.9 | 105.4 | 164.9 | -66.1 | 176.5 | 0 | 0 | 0 | 108.1 | | |
| 144 | S | 31.9 | Very low | 36.2 | Very low | 96 Ų | 96 | 148.5 Ų | 148.5 | 67% | 0.671 | 81% | 0.812 | S | S | * | * | | | trans | -84.7 | 132.4 | 168.1 | 161.4 | 0 | 0 | 0 | 0 | 108.4 | R142 | R142-S144 PolarHBondContact O-N 2.91Š|
| 145 | C | 33.3 | Very low | 35.6 | Very low | 130 Ų | 130 | 152.7 Ų | 152.7 | 88% | 0.878 | 82% | 0.821 | S | S | * | * | | | trans | -133.3 | 106.7 | 157.6 | -76.8 | 0 | 0 | 0 | 0 | 108.4 | | |
| 146 | E | 33.6 | Very low | 35.4 | Very low | 156 Ų | 156 | 152.8 Ų | 152.8 | 73% | 0.729 | 82% | 0.821 | S | S | * | * | | | trans | -65.8 | 143.9 | 166.6 | -84.3 | -81 | 151.4 | 0 | 0 | 111.2 | | |
| 147 | P | 33.8 | Very low | 35.2 | Very low | 115 Ų | 115 | 155 Ų | 155 | 75% | 0.747 | 83% | 0.825 | S | S | * | * | | | trans | -85 | 114.8 | 168.7 | 31.6 | -28.2 | 0 | 0 | 0 | 110.7 | | |
| 148 | V | 33.8 | Very low | 34.9 | Very low | 132 Ų | 132 | 154.4 Ų | 154.4 | 80% | 0.8 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -93.5 | 131 | 171.3 | 169.2 | 0 | 0 | 0 | 0 | 110.9 | | |
| 149 | M | 36.4 | Very low | 34.2 | Very low | 171 Ų | 171 | 157.3 Ų | 157.3 | 84% | 0.842 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -48.4 | 159.4 | 179.4 | 46.9 | -168.2 | 62.8 | 0 | 0 | 119.5 | | |
| 150 | E | 37.4 | Very low | 34.1 | Very low | 198 Ų | 198 | 155.6 Ų | 155.6 | 93% | 0.925 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -58 | 134.9 | 173.8 | -172.7 | 175.8 | -163.3 | 0 | 0 | 114.3 | | |
| 151 | E | 33.2 | Very low | 33.1 | Very low | 191 Ų | 191 | 155 Ų | 155 | 89% | 0.893 | 82% | 0.818 | S | S | * | * | | | trans | -144.3 | 138.1 | 164.9 | -166.6 | 174.9 | 150.2 | 0 | 0 | 112.5 | | |
| 152 | K | 28.5 | Very low | 32.7 | Very low | 192 Ų | 192 | 156 Ų | 156 | 84% | 0.835 | 82% | 0.816 | S | S | * | * | | | trans | -87 | 147.5 | -173.6 | -115.4 | -167.5 | -178.4 | -179.4 | 0 | 112.8 | | |
| 153 | A | 29.9 | Very low | 32.4 | Very low | 84 Ų | 84 | 148.5 Ų | 148.5 | 69% | 0.694 | 81% | 0.813 | S | S | * | * | | | trans | 62.3 | 125.5 | 145.6 | 0 | 0 | 0 | 0 | 0 | 120.1 | | |
| 154 | Q | 29.8 | Very low | 32.3 | Very low | 172 Ų | 172 | 146.6 Ų | 146.6 | 80% | 0.804 | 81% | 0.809 | S | S | * | * | | | | -178.6 | 133.2 | 101.9 | -122.3 | 169.6 | -82.3 | 0 | 0 | 113.1 | | |
| 155 | E | 30.4 | Very low | 32.3 | Very low | 178 Ų | 178 | 147.3 Ų | 147.3 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | | | trans | -42.5 | 128.2 | 156 | 172.5 | -173.6 | -171.3 | 0 | 0 | 113.8 | | |
| 156 | K | 32.9 | Very low | 32.4 | Very low | 190 Ų | 190 | 150.2 Ų | 150.2 | 83% | 0.826 | 81% | 0.809 | S | S | * | * | | | trans | -151 | 130.6 | 148.1 | -62 | -166.9 | -177.6 | 177.9 | 0 | 111.4 | | |
| 157 | S | 31 | Very low | 32.4 | Very low | 119 Ų | 119 | 151 Ų | 151 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | | | trans | -73.3 | 149.9 | 174.6 | 46.5 | 0 | 0 | 0 | 0 | 112.5 | | |
| 158 | S | 34.2 | Very low | 32.4 | Very low | 121 Ų | 121 | 148.9 Ų | 148.9 | 85% | 0.846 | 81% | 0.812 | S | S | * | * | | | trans | -156.1 | 120.8 | 144.3 | 61.1 | 0 | 0 | 0 | 0 | 111.5 | | |
| 159 | L | 28.8 | Very low | 32.5 | Very low | 159 Ų | 159 | 149.4 Ų | 149.4 | 83% | 0.832 | 81% | 0.81 | S | S | * | * | | | trans | -63.8 | 132.7 | 166.5 | -173.5 | 85.1 | 0 | 0 | 0 | 110.7 | | |
| 160 | L | 35.2 | Very low | 32.7 | Very low | 169 Ų | 169 | 148 Ų | 148 | 89% | 0.885 | 81% | 0.812 | S | S | * | * | | | trans | -156.8 | 92.9 | 147 | -142.3 | 101.6 | 0 | 0 | 0 | 111.7 | | |
| 161 | E | 29.5 | Very low | 32.5 | Very low | 143 Ų | 143 | 143.1 Ų | 143.1 | 67% | 0.668 | 80% | 0.799 | S | S | * | * | | | | 23.7 | 122.7 | 124.4 | -160.4 | 173.9 | 148.9 | 0 | 0 | 122.5 | | |
| 162 | N | 30.1 | Very low | 32.6 | Very low | 147 Ų | 147 | 146.2 Ų | 146.2 | 79% | 0.786 | 80% | 0.803 | S | S | * | * | | | trans | 69 | 134 | 139.4 | -59.5 | -15.1 | 0 | 0 | 0 | 124.1 | | |
| 163 | G | 32 | Very low | 32.8 | Very low | 81 Ų | 81 | 140.2 Ų | 140.2 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | | | trans | 166.2 | 80.3 | 164.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | | |
| 164 | T | 32.2 | Very low | 33 | Very low | 134 Ų | 134 | 142.3 Ų | 142.3 | 82% | 0.822 | 81% | 0.805 | S | S | * | * | | | trans | -73.5 | 152.7 | -179.4 | 27.9 | 0 | 0 | 0 | 0 | 115.9 | | |
| 165 | V | 31.5 | Very low | 33.5 | Very low | 111 Ų | 111 | 139.6 Ų | 139.6 | 67% | 0.673 | 81% | 0.805 | S | S | * | * | | | trans | 77.6 | 116.3 | 146.3 | 174.5 | 0 | 0 | 0 | 0 | 117.4 | | |
| 166 | H | 35.5 | Very low | 33.6 | Very low | 192 Ų | 192 | 134.4 Ų | 134.4 | 89% | 0.889 | 80% | 0.799 | S | S | * | * | | | | -156.5 | 140.5 | 117.8 | -89.2 | -62.3 | 0 | 0 | 0 | 112 | | |
| 167 | Q | 34.2 | Very low | 33.8 | Very low | 173 Ų | 173 | 130.9 Ų | 130.9 | 81% | 0.808 | 80% | 0.799 | S | S | * | * | | | trans | -77.7 | 149 | -173.5 | -151.8 | -175.1 | 21.5 | 0 | 0 | 111 | | |
| 168 | G | 34.1 | Very low | 34.1 | Very low | 70 Ų | 70 | 130 Ų | 130 | 72% | 0.722 | 80% | 0.798 | S | S | * | * | | | trans | -170.5 | 82.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | | |
| 169 | D | 35.4 | Very low | 34.3 | Very low | 143 Ų | 143 | 129.8 Ų | 129.8 | 77% | 0.765 | 80% | 0.797 | S | S | * | * | | | trans | -61.6 | 132.7 | 172.8 | -65.5 | -46.4 | 0 | 0 | 0 | 110.4 | | |
| 170 | T | 40.8 | Very low | 34.8 | Very low | 142 Ų | 142 | 131.2 Ų | 131.2 | 87% | 0.871 | 80% | 0.799 | S | S | * | * | | | trans | -140.6 | 100.9 | 154.9 | -36.3 | 0 | 0 | 0 | 0 | 109.1 | | |
| 171 | S | 34.2 | Very low | 34.8 | Very low | 95 Ų | 95 | 128.5 Ų | 128.5 | 66% | 0.664 | 80% | 0.795 | S | S | * | * | | | trans | -78.7 | 142 | 170.6 | 160 | 0 | 0 | 0 | 0 | 110.6 | | |
| 172 | W | 35.5 | Very low | 35.3 | Very low | 256 Ų | 256 | 126.7 Ų | 126.7 | 97% | 0.97 | 80% | 0.797 | S | S | * | * | | | trans | 122.2 | 129.9 | 162.2 | -83.8 | -43.5 | 0 | 0 | 0 | 112 | | |
| 173 | G | 30.8 | Very low | 35.9 | Very low | 65 Ų | 65 | 128.5 Ų | 128.5 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | | | cis | -168.5 | 138.6 | 2.6 | 0 | 0 | 0 | 0 | 0 | 107.7 | | |
| 174 | S | 35.6 | Very low | 35.9 | Very low | 129 Ų | 129 | 127.9 Ų | 127.9 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | | | trans | -76.3 | 122.8 | 173.5 | -169.3 | 0 | 0 | 0 | 0 | 108.8 | | |
| 175 | S | 39.3 | Very low | 36.3 | Very low | 114 Ų | 114 | 132 Ų | 132 | 80% | 0.797 | 80% | 0.795 | S | S | * | * | | | trans | -125.2 | 98.6 | 161 | 55.3 | 0 | 0 | 0 | 0 | 108.1 | | |
| 176 | G | 33.3 | Very low | 36.8 | Very low | 70 Ų | 70 | 134 Ų | 134 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | | | trans | -68.1 | 137 | 165.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | | |
| 177 | S | 37 | Very low | 37 | Very low | 116 Ų | 116 | 130.2 Ų | 130.2 | 81% | 0.811 | 80% | 0.798 | S | S | * | * | | | trans | -121.7 | 97.5 | 154.5 | -68.2 | 0 | 0 | 0 | 0 | 107 | | |
| 178 | A | 36.2 | Very low | 37.1 | Very low | 100 Ų | 100 | 130.7 Ų | 130.7 | 83% | 0.826 | 80% | 0.8 | S | S | * | * | | | trans | -74 | 118.2 | 161.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | | |
| 179 | S | 39.5 | Very low | 37.2 | Very low | 117 Ų | 117 | 133.5 Ų | 133.5 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | | | trans | -112.8 | 103.4 | 163 | -61.4 | 0 | 0 | 0 | 0 | 107.4 | | |
| 180 | Q | 38.6 | Very low | 37.4 | Very low | 189 Ų | 189 | 131.5 Ų | 131.5 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | | | trans | -78.7 | 133.6 | 162.3 | -67.5 | -179.1 | -12 | 0 | 0 | 108.5 | | |
| 181 | S | 36.1 | Very low | 37.6 | Very low | 112 Ų | 112 | 130.6 Ų | 130.6 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | | | trans | 161.9 | 131 | 159.6 | 160.3 | 0 | 0 | 0 | 0 | 106.2 | | |
| 182 | S | 38.8 | Very low | 37.7 | Very low | 104 Ų | 104 | 133.5 Ų | 133.5 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | | | cis | -166.9 | 147.8 | -2.9 | 32.3 | 0 | 0 | 0 | 0 | 106.4 | G184 | S182-G184 PolarHBondContact O-N 3.26Š|
| 183 | Q | 42.7 | Very low | 37.9 | Very low | 185 Ų | 185 | 126.2 Ų | 126.2 | 86% | 0.864 | 80% | 0.8 | S | S | * | * | | | trans | -44.4 | 129 | 165.9 | -119.3 | 81.8 | 6.3 | 0 | 0 | 112.4 | | |
| 184 | G | 32.5 | Very low | 38.1 | Very low | 69 Ų | 69 | 131.7 Ų | 131.7 | 71% | 0.711 | 81% | 0.809 | S | S | * | * | | | trans | -134.6 | 98.3 | 155.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | S182 | S182-G184 PolarHBondContact O-N 3.26Š|
| 185 | R | 41.1 | Very low | 38 | Very low | 219 Ų | 219 | 134.4 Ų | 134.4 | 83% | 0.826 | 81% | 0.807 | S | S | * | * | | | | 56 | 78 | 82.8 | -72.8 | -170.7 | 143.6 | -170.8 | -6.2 | 112 | S187 | R185-S187 PolarHBondContact O-N 3.34Š|
| 186 | D | 42.7 | Very low | 37.9 | Very low | 153 Ų | 153 | 138.4 Ų | 138.4 | 82% | 0.818 | 81% | 0.806 | S | S | * | * | | | trans | -18.2 | 122.4 | 139.7 | -8.1 | -44.6 | 0 | 0 | 0 | 111.2 | | |
| 187 | S | 39.2 | Very low | 38.4 | Very low | 113 Ų | 113 | 139.6 Ų | 139.6 | 79% | 0.79 | 80% | 0.801 | S | S | * | * | | | trans | -139.4 | 132.7 | 171.1 | -74.4 | 0 | 0 | 0 | 0 | 109.9 | R185 | R185-S187 PolarHBondContact O-N 3.34Š|
| 188 | H | 35.2 | Very low | 38.1 | Very low | 183 Ų | 183 | 141.7 Ų | 141.7 | 85% | 0.847 | 80% | 0.803 | S | S | * | * | | | trans | -71.3 | 145 | -163.6 | -62.9 | -91.9 | 0 | 0 | 0 | 112.5 | S190 | H188-S190 PolarHBondContact O-N 3.31Š|
| 189 | S | 37.9 | Very low | 38.2 | Very low | 129 Ų | 129 | 147.1 Ų | 147.1 | 90% | 0.902 | 80% | 0.802 | S | S | * | * | | | trans | -56 | 124.4 | 162.9 | -59.8 | 0 | 0 | 0 | 0 | 110.5 | | |
| 190 | S | 37.9 | Very low | 38.2 | Very low | 101 Ų | 101 | 146.8 Ų | 146.8 | 71% | 0.706 | 80% | 0.798 | S | S | * | * | | | trans | -109.2 | 106.3 | 160.9 | 55.6 | 0 | 0 | 0 | 0 | 108.6 | H188 L192 | H188-S190 PolarHBondContact O-N 3.31Å; S190-L192 PolarHBondContact O-N 3.35Å |
| 191 | S | 46.3 | Very low | 38.5 | Very low | 124 Ų | 124 | 142.4 Ų | 142.4 | 87% | 0.867 | 79% | 0.794 | S | S | * | * | | | trans | -58.9 | 122.5 | 159.3 | -63.3 | 0 | 0 | 0 | 0 | 108.2 | | |
| 192 | L | 36.6 | Very low | 38.8 | Very low | 155 Ų | 155 | 145.4 Ų | 145.4 | 81% | 0.812 | 80% | 0.795 | S | S | * | * | | | trans | -125.3 | 116.1 | 169.2 | -125.5 | 140.3 | 0 | 0 | 0 | 107.9 | S190 | S190-L192 PolarHBondContact O-N 3.35Š|
| 193 | S | 39 | Very low | 39.1 | Very low | 103 Ų | 103 | 147.1 Ų | 147.1 | 72% | 0.72 | 80% | 0.796 | S | S | * | * | | | trans | -51.1 | 133.4 | -179.6 | 45.8 | 0 | 0 | 0 | 0 | 112.7 | Q195 | S193-Q195 PolarHBondContact O-N 3.27Š|
| 194 | E | 34.3 | Very low | 39 | Very low | 181 Ų | 181 | 147.1 Ų | 147.1 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | | | trans | -58.5 | 125.1 | 163.7 | -63 | -174.5 | 139.9 | 0 | 0 | 109.9 | | |
| 195 | Q | 33.1 | Very low | 39.4 | Very low | 186 Ų | 186 | 152.9 Ų | 152.9 | 87% | 0.869 | 80% | 0.804 | S | S | * | * | | | trans | -120.1 | 97.8 | 162.4 | -172.5 | 165.3 | 17.5 | 0 | 0 | 107.2 | S193 | S193-Q195 PolarHBondContact O-N 3.27Š|
| 196 | Y | 38.6 | Very low | 39 | Very low | 197 Ų | 197 | 148.7 Ų | 148.7 | 77% | 0.773 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.7 | 134.1 | 171.7 | -117.9 | -97.5 | 0 | 0 | 0 | 109.8 | | |
| 197 | P | 43.2 | Very low | 39 | Very low | 95 Ų | 95 | 149 Ų | 149 | 62% | 0.617 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 129.9 | 156.7 | -3.6 | 22.4 | 0 | 0 | 0 | 109.8 | | |
| 198 | D | 31.6 | Very low | 39.1 | Very low | 160 Ų | 160 | 149.6 Ų | 149.6 | 86% | 0.856 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 131 | 170.1 | -162.6 | 13.6 | 0 | 0 | 0 | 110.7 | | |
| 199 | W | 36.7 | Very low | 39.1 | Very low | 214 Ų | 214 | 145.3 Ų | 145.3 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | | | trans | -104.6 | 124.6 | 175.4 | -61.4 | 86.3 | 0 | 0 | 0 | 108.9 | A201 | W199-A201 PolarHBondContact O-N 3.46Š|
| 200 | P | 40.1 | Very low | 39.3 | Very low | 111 Ų | 111 | 145 Ų | 145 | 72% | 0.721 | 79% | 0.787 | S | S | * | * | | | trans | -73.4 | 130.9 | 175 | 28.2 | -30.3 | 0 | 0 | 0 | 110.5 | E202 | P200-E202 PolarHBondContact O-N 3.32Š|
| 201 | A | 45.3 | Very low | 39.1 | Very low | 97 Ų | 97 | 146.6 Ų | 146.6 | 80% | 0.802 | 80% | 0.797 | S | S | * | * | | | trans | -70.3 | 113.9 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | W199 | W199-A201 PolarHBondContact O-N 3.46Š|
| 202 | E | 42 | Very low | 38.5 | Very low | 174 Ų | 174 | 149.8 Ų | 149.8 | 81% | 0.813 | 80% | 0.798 | S | S | * | * | | | trans | -110.9 | 110 | 164.5 | -68.9 | -65.3 | 154.4 | 0 | 0 | 108.1 | P200 | P200-E202 PolarHBondContact O-N 3.32Š|
| 203 | D | 46 | Very low | 38.5 | Very low | 140 Ų | 140 | 150.4 Ų | 150.4 | 75% | 0.749 | 80% | 0.801 | S | S | * | * | | | trans | -81.2 | 118.1 | 177 | -179.4 | 29.9 | 0 | 0 | 0 | 109.1 | | |
| 204 | M | 39.6 | Very low | 38.4 | Very low | 186 Ų | 186 | 153.3 Ų | 153.3 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | | | trans | -146.7 | 79.3 | 165.1 | -79.6 | -168.4 | 84.4 | 0 | 0 | 110 | | |
| 205 | F | 40.4 | Very low | 38.7 | Very low | 189 Ų | 189 | 154.4 Ų | 154.4 | 83% | 0.829 | 81% | 0.809 | S | S | * | * | | | trans | -84.8 | 123.1 | 146.3 | -94.7 | -88.3 | 0 | 0 | 0 | 108.1 | | |
| 206 | D | 34.3 | Very low | 38.7 | Very low | 132 Ų | 132 | 149 Ų | 149 | 71% | 0.706 | 80% | 0.803 | S | S | * | * | | | trans | -170 | 125.6 | 135.8 | -104 | -29.8 | 0 | 0 | 0 | 115.8 | | |
| 207 | H | 41.1 | Very low | 38.7 | Very low | 158 Ų | 158 | 147.8 Ų | 147.8 | 73% | 0.731 | 80% | 0.802 | S | S | * | * | | | trans | 89.9 | 130.5 | 148.9 | -47 | -33.6 | 0 | 0 | 0 | 122.2 | | |
| 208 | P | 42.4 | Very low | 38.2 | Very low | 126 Ų | 126 | 150 Ų | 150 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -90.7 | 137.1 | 175.3 | 36 | -31.1 | 0 | 0 | 0 | 112.3 | | |
| 209 | A | 35.5 | Very low | 38.6 | Very low | 94 Ų | 94 | 150.9 Ų | 150.9 | 78% | 0.777 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -91.8 | 135.8 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | | |
| 210 | P | 41.3 | Very low | 38.7 | Very low | 123 Ų | 123 | 145.3 Ų | 145.3 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 127.7 | 173.3 | 31.8 | -28 | 0 | 0 | 0 | 110.6 | | |
| 211 | C | 33.5 | Very low | 39.1 | Very low | 133 Ų | 133 | 149 Ų | 149 | 90% | 0.899 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 120 | 170.6 | -71.6 | 0 | 0 | 0 | 0 | 110.1 | | |
| 212 | E | 34.3 | Very low | 38.9 | Very low | 192 Ų | 192 | 152 Ų | 152 | 90% | 0.897 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 130.8 | 173.2 | -70.9 | -158.9 | 148.4 | 0 | 0 | 112.1 | | |
| 213 | L | 36.8 | Very low | 39 | Very low | 167 Ų | 167 | 148.1 Ų | 148.1 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -92.5 | 118.6 | 177.2 | -172.7 | 89.9 | 0 | 0 | 0 | 110.1 | K215 | L213-K215 PolarHBondContact O-N 3Š|
| 214 | I | 37.3 | Very low | 39.1 | Very low | 165 Ų | 165 | 148.4 Ų | 148.4 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 124.3 | 172.2 | -63.9 | 172 | 0 | 0 | 0 | 109.7 | G216 | I214-G216 PolarHBondContact O-N 2.83Š|
| 215 | K | 40.2 | Very low | 39.7 | Very low | 203 Ų | 203 | 143.6 Ų | 143.6 | 88% | 0.883 | 79% | 0.786 | S | S | * | * | | | trans | -77.4 | 100 | -177.2 | -168.5 | 165 | -175.2 | 171.6 | 0 | 111.2 | L213 | L213-K215 PolarHBondContact O-N 3Š|
| 216 | G | 31.6 | Very low | 40.2 | Very low | 73 Ų | 73 | 141.2 Ų | 141.2 | 75% | 0.753 | 78% | 0.782 | S | S | * | * | | | trans | -113.4 | 114.8 | 166.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | I214 | I214-G216 PolarHBondContact O-N 2.83Š|
| 217 | K | 40.2 | Very low | 41 | Very low | 172 Ų | 172 | 141.4 Ų | 141.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | | | trans | -95.2 | 111.6 | -175.5 | 174.1 | 154.8 | 172.3 | 153.2 | 0 | 110.6 | | |
| 218 | T | 31.7 | Very low | 41.4 | Very low | 140 Ų | 140 | 138.5 Ų | 138.5 | 86% | 0.859 | 78% | 0.776 | S | S | * | * | | | trans | -138.2 | 134.4 | 157 | 50 | 0 | 0 | 0 | 0 | 110 | | |
| 219 | K | 40.2 | Very low | 41.8 | Very low | 179 Ų | 179 | 134.6 Ų | 134.6 | 78% | 0.778 | 76% | 0.759 | S | S | * | * | | | trans | -93.5 | 117.3 | -175.3 | -44.1 | 162.6 | -171 | 171.2 | 0 | 106 | | |
| 220 | S | 39.4 | Very low | 42.5 | Very low | 98 Ų | 98 | 134.9 Ų | 134.9 | 69% | 0.685 | 76% | 0.755 | S | S | * | * | | | trans | -156.2 | 110.7 | 158.1 | -169 | 0 | 0 | 0 | 0 | 107.5 | E222 | S220-E222 PolarHBondContact O-N 3.06Š|
| 221 | E | 47.9 | Very low | 43.1 | Very low | 188 Ų | 188 | 136.3 Ų | 136.3 | 88% | 0.879 | 76% | 0.755 | S | S | * | * | | | trans | -82.4 | 95.6 | 175.5 | 49.2 | -141.4 | 97 | 0 | 0 | 109.5 | | |
| 222 | E | 40.8 | Very low | 44.2 | Very low | 161 Ų | 161 | 137.4 Ų | 137.4 | 75% | 0.752 | 75% | 0.751 | S | S | * | * | | | trans | -150.7 | 128.8 | 153.9 | 59 | -170.9 | 140.8 | 0 | 0 | 108.8 | S220 L224 | S220-E222 PolarHBondContact O-N 3.06Å; E222-L224 PolarHBondContact O-N 3.29Å |
| 223 | S | 43.7 | Very low | 45.1 | Very low | 92 Ų | 92 | 132.3 Ų | 132.3 | 64% | 0.643 | 74% | 0.737 | S | S | * | * | | | trans | -57.4 | 113 | -166.5 | -78.3 | 0 | 0 | 0 | 0 | 113.7 | S225 | S223-S225 PolarHBondContact O-N 2.84Š|
| 224 | L | 48.7 | Very low | 45.9 | Very low | 146 Ų | 146 | 130.7 Ų | 130.7 | 76% | 0.764 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.9 | 2.9 | 165.5 | -69.2 | 175.3 | 0 | 0 | 0 | 113.5 | E222 | E222-L224 PolarHBondContact O-N 3.29Š|
| 225 | S | 52.7 | Low | 47.3 | Very low | 85 Ų | 85 | 131.4 Ų | 131.4 | 59% | 0.594 | 73% | 0.728 | S | S | * | * | H | α-helix | trans | -74.1 | -22.8 | 179.3 | -54.2 | 0 | 0 | 0 | 0 | 113.8 | S223 | S223-S225 PolarHBondContact O-N 2.84Å |
| 226 | D | 51.5 | Low | 48.7 | Very low | 138 Ų | 138 | 127.6 Ų | 127.6 | 74% | 0.738 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -88.8 | -18.5 | -174.7 | -66.9 | -25.3 | 0 | 0 | 0 | 113.5 | | |
| 227 | L | 49.7 | Very low | 50.5 | Low | 137 Ų | 137 | 131 Ų | 131 | 72% | 0.717 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -85.4 | -28.2 | -179.7 | -172 | 59.7 | 0 | 0 | 0 | 113 | | |
| 228 | T | 49.8 | Very low | 52 | Low | 97 Ų | 97 | 126.6 Ų | 126.6 | 60% | 0.595 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -90.4 | -13.5 | 177.7 | 55.7 | 0 | 0 | 0 | 0 | 113.1 | S230 | T228-S230 VanDerWaalsContact C-N 3.31Å; T228-S230 PolarHBondContact O-N 2.79Å |
| 229 | G | 50.3 | Low | 54.2 | Low | 44 Ų | 44 | 120.8 Ų | 120.8 | 45% | 0.454 | 67% | 0.67 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.7 | -14 | -179 | 0 | 0 | 0 | 0 | 0 | 115.6 | S233 | G229-S233 PolarHBondContact O-OG 2.87Š|
| 230 | S | 50.7 | Low | 55.8 | Low | 100 Ų | 100 | 117.7 Ų | 117.7 | 70% | 0.699 | 67% | 0.668 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.6 | -3.9 | -171.8 | -160.8 | 0 | 0 | 0 | 0 | 116.3 | T228 | T228-S230 VanDerWaalsContact C-N 3.31Å; T228-S230 PolarHBondContact O-N 2.79Å |
| 231 | L | 54.8 | Low | 57.3 | Low | 153 Ų | 153 | 117.9 Ų | 117.9 | 80% | 0.801 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.7 | -9.9 | 178.5 | -70.7 | -179.7 | 0 | 0 | 0 | 114.8 | | |
| 232 | L | 55.1 | Low | 58.9 | Low | 156 Ų | 156 | 112.4 Ų | 112.4 | 82% | 0.817 | 65% | 0.645 | S | S | * | * | S | Bend | trans | -133 | 2.2 | 178.8 | -67.1 | 173.8 | 0 | 0 | 0 | 114.2 | L234 | L232-L234 PolarHBondContact O-N 3.07Š|
| 233 | S | 53.2 | Low | 61 | Low | 84 Ų | 84 | 108.6 Ų | 108.6 | 59% | 0.587 | 63% | 0.63 | S | S | * | * | | | trans | -78.8 | 65.2 | 172.3 | 80.2 | 0 | 0 | 0 | 0 | 110.4 | G229 Q235 | G229-S233 PolarHBondContact O-OG 2.87Å; S233-Q235 VanDerWaalsContact C-N 3.29Å; S233-Q235 PolarHBondContact O-N 3.41Å |
| 234 | L | 53.9 | Low | 62.8 | Low | 134 Ų | 134 | 109.9 Ų | 109.9 | 70% | 0.702 | 63% | 0.63 | S | S | * | * | | | trans | -71 | 94.4 | 164.6 | -173.1 | 67.2 | 0 | 0 | 0 | 106.9 | L232 L236 | L232-L234 PolarHBondContact O-N 3.07Å; L234-L236 VanDerWaalsContact C-N 3.26Å; L234-L236 HydrophobicContact CD2-CD1 4.29Å; L234-L236 HydrophobicContact CD2-CD2 3.5Å; L234-L236 HydrophobicContact CD2-CG 3.85Å; L234-L236 HydrophobicContact CG-CD2 3.73Å; L234-L236 HydrophobicContact CG-CG 3.88Å; L234-L236 PolarHBondContact O-N 2.92Å |
| 235 | Q | 66.2 | Low | 64.6 | Low | 179 Ų | 179 | 108.9 Ų | 108.9 | 84% | 0.836 | 62% | 0.621 | S | S | * | * | | | trans | -67.9 | 91.4 | 169.4 | -171.3 | 110.1 | 3.5 | 0 | 0 | 107.5 | S233 D237 | S233-Q235 VanDerWaalsContact C-N 3.29Å; S233-Q235 PolarHBondContact O-N 3.41Å; Q235-D237 PolarHBondContact O-N 3.14Å; Q235-D237 VanDerWaalsContact O-N 3.08Å |
| 236 | L | 69.6 | Low | 66.1 | Low | 124 Ų | 124 | 108 Ų | 108 | 65% | 0.649 | 61% | 0.612 | S | S | * | * | | | trans | -76.5 | 89.9 | 174.7 | -71.7 | 174.9 | 0 | 0 | 0 | 108.8 | L234 L238 | L234-L236 VanDerWaalsContact C-N 3.26Å; L234-L236 HydrophobicContact CD2-CD1 4.29Å; L234-L236 HydrophobicContact CD2-CD2 3.5Å; L234-L236 HydrophobicContact CD2-CG 3.85Å; L234-L236 HydrophobicContact CG-CD2 3.73Å; L234-L236 HydrophobicContact CG-CG 3.88Å; L234-L236 PolarHBondContact O-N 2.92Å; L236-L238 HydrophobicContact CB-CD2 4.48Å; L236-L238 PolarHBondContact O-N 2.92Å |
| 237 | D | 69.9 | Low | 67.6 | Low | 143 Ų | 143 | 106.1 Ų | 106.1 | 77% | 0.765 | 60% | 0.601 | S | S | * | * | | | trans | -80.6 | 98.7 | 167.2 | -174 | 11.1 | 0 | 0 | 0 | 108.8 | Q235 G239 | Q235-D237 PolarHBondContact O-N 3.14Å; Q235-D237 VanDerWaalsContact O-N 3.08Å; D237-G239 PolarHBondContact O-N 3.06Å; D237-G239 PolarHBondContact OD1-N 3.41Å; D237-G239 VanDerWaalsContact OD1-N 3.08Å |
| 238 | L | 72.4 | Confident | 69.2 | Low | 80 Ų | 80 | 104.6 Ų | 104.6 | 42% | 0.419 | 59% | 0.594 | S | S | . | * | | | trans | -73.1 | -11.3 | 178.7 | -60.9 | -179.5 | 0 | 0 | 0 | 111.9 | L236 L242 L243 | L236-L238 HydrophobicContact CB-CD2 4.48Å; L236-L238 PolarHBondContact O-N 2.92Å; L238-L242 HydrophobicContact CB-CB 4.31Å; L238-L242 HydrophobicContact CB-CD2 3.96Å; L238-L242 HydrophobicContact CB-CG 4.42Å; L238-L242 HydrophobicContact CD2-CD2 3.66Å; L238-L242 HydrophobicContact CG-CD2 4.24Å; L238-L242 WeakPolarHBondContact O-CB 3.32Å; L238-L243 HydrophobicContact CB-CD2 4.21Å; L238-L243 HydrophobicContact CB-CG 4.2Å; L238-L243 HydrophobicContact CD1-CD2 4.19Å |
| 239 | G | 76.9 | Confident | 70.9 | Confident | 18 Ų | 18 | 103 Ų | 103 | 19% | 0.186 | 58% | 0.584 | C | S | . | * | H | α-helix | trans | 62.8 | 162 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | D237 S241 L242 L243 | D237-G239 PolarHBondContact O-N 3.06Å; D237-G239 PolarHBondContact OD1-N 3.41Å; D237-G239 VanDerWaalsContact OD1-N 3.08Å; G239-S241 VanDerWaalsContact C-N 3.27Å; G239-S241 PolarHBondContact O-N 2.85Å; G239-L242 PolarHBondContact O-N 3.45Å; G239-L243 WeakPolarHBondContact O-CG 3.28Å; G239-L243 PolarHBondContact O-N 2.53Å |
| 240 | P | 74 | Confident | 72.3 | Confident | 114 Ų | 114 | 106.9 Ų | 106.9 | 74% | 0.74 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.5 | -28.3 | -173.9 | 23.1 | -32.1 | 0 | 0 | 0 | 113.6 | D244 | P240-D244 WeakPolarHBondContact O-CB 3.48Å; P240-D244 PolarHBondContact O-N 2.92Å |
| 241 | S | 71.4 | Confident | 73.7 | Confident | 102 Ų | 102 | 107 Ų | 107 | 71% | 0.713 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -74.8 | -35.4 | -177.6 | -64.7 | 0 | 0 | 0 | 0 | 114.3 | G239 E245 | G239-S241 VanDerWaalsContact C-N 3.27Å; G239-S241 PolarHBondContact O-N 2.85Å; S241-E245 PolarHBondContact O-N 2.94Å |
| 242 | L | 81.4 | Confident | 74.7 | Confident | 73 Ų | 73 | 106.6 Ų | 106.6 | 38% | 0.382 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -80.6 | -33.9 | 177.8 | -173.4 | 61.9 | 0 | 0 | 0 | 111.2 | L238 G239 D244 E245 V246 | L238-L242 HydrophobicContact CB-CB 4.31Å; L238-L242 HydrophobicContact CB-CD2 3.96Å; L238-L242 HydrophobicContact CB-CG 4.42Å; L238-L242 HydrophobicContact CD2-CD2 3.66Å; L238-L242 HydrophobicContact CG-CD2 4.24Å; L238-L242 WeakPolarHBondContact O-CB 3.32Å; G239-L242 PolarHBondContact O-N 3.45Å; L242-D244 VanDerWaalsContact C-N 3.31Å; L242-D244 PolarHBondContact O-N 3.11Å; L242-E245 PolarHBondContact O-N 3.19Å; L242-V246 WeakPolarHBondContact O-CB 3.31Å; L242-V246 VanDerWaalsContact O-CG2 3.27Å; L242-V246 WeakPolarHBondContact O-CG2 3.47Å; L242-V246 PolarHBondContact O-N 3.33Å |
| 243 | L | 84.7 | Confident | 75.2 | Confident | 81 Ų | 81 | 105.3 Ų | 105.3 | 42% | 0.424 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -61 | -41.3 | 173.4 | -71.2 | 175 | 0 | 0 | 0 | 111.4 | L238 G239 V246 L247 | L238-L243 HydrophobicContact CB-CD2 4.21Å; L238-L243 HydrophobicContact CB-CG 4.2Å; L238-L243 HydrophobicContact CD1-CD2 4.19Å; G239-L243 WeakPolarHBondContact O-CG 3.28Å; G239-L243 PolarHBondContact O-N 2.53Å; L243-V246 PolarHBondContact O-N 3.19Å; L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 VanDerWaalsContact O-CD1 3.22Å; L243-L247 WeakPolarHBondContact O-CD1 3.37Å; L243-L247 PolarHBondContact O-N 3.28Å |
| 244 | D | 82.1 | Confident | 75.4 | Confident | 119 Ų | 119 | 112.7 Ų | 112.7 | 64% | 0.636 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.1 | -43.3 | 175.5 | -169.8 | 52.9 | 0 | 0 | 0 | 112.2 | P240 L242 V246 L247 N248 | P240-D244 WeakPolarHBondContact O-CB 3.48Å; P240-D244 PolarHBondContact O-N 2.92Å; L242-D244 VanDerWaalsContact C-N 3.31Å; L242-D244 PolarHBondContact O-N 3.11Å; D244-V246 PolarHBondContact O-N 3.12Å; D244-L247 PolarHBondContact O-N 3.36Å; D244-N248 VanDerWaalsContact O-CB 3.23Å; D244-N248 WeakPolarHBondContact O-CB 3.02Å; D244-N248 PolarHBondContact O-N 3.26Å |
| 245 | E | 85.3 | Confident | 76.5 | Confident | 126 Ų | 126 | 111.7 Ų | 111.7 | 59% | 0.589 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.2 | -41.1 | 176.4 | -168.8 | 174.5 | -178.1 | 0 | 0 | 112.2 | S241 L242 V249 | S241-E245 PolarHBondContact O-N 2.94Å; L242-E245 PolarHBondContact O-N 3.19Å; E245-V249 WeakPolarHBondContact O-CG2 3.46Å; E245-V249 PolarHBondContact O-N 3.18Å; E245-V249 VanDerWaalsContact O-N 3.1Å |
| 246 | V | 86 | Confident | 77.1 | Confident | 67 Ų | 67 | 108.1 Ų | 108.1 | 41% | 0.406 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -69 | -43.3 | 177.2 | 171.7 | 0 | 0 | 0 | 0 | 111.9 | L242 L243 D244 V249 M250 | L242-V246 WeakPolarHBondContact O-CB 3.31Å; L242-V246 VanDerWaalsContact O-CG2 3.27Å; L242-V246 WeakPolarHBondContact O-CG2 3.47Å; L242-V246 PolarHBondContact O-N 3.33Å; L243-V246 PolarHBondContact O-N 3.19Å; D244-V246 PolarHBondContact O-N 3.12Å; V246-V249 WeakPolarHBondContact O-CB 3.33Å; V246-V249 PolarHBondContact O-N 3.27Å; V246-M250 PolarHBondContact O-N 3.38Å; V246-M250 VanDerWaalsContact O-N 3.11Å |
| 247 | L | 81.8 | Confident | 77.5 | Confident | 98 Ų | 98 | 107.2 Ų | 107.2 | 51% | 0.513 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -62.8 | -44.9 | 175.1 | -96.3 | 112.8 | 0 | 0 | 0 | 111.3 | L243 D244 V249 M250 D251 | L243-L247 WeakPolarHBondContact O-CB 3.45Å; L243-L247 VanDerWaalsContact O-CD1 3.22Å; L243-L247 WeakPolarHBondContact O-CD1 3.37Å; L243-L247 PolarHBondContact O-N 3.28Å; D244-L247 PolarHBondContact O-N 3.36Å; L247-V249 PolarHBondContact O-N 3.48Å; L247-M250 CarbonylContact O-C 3.55Å; L247-M250 WeakPolarHBondContact O-CA 3.3Å; L247-M250 WeakPolarHBondContact O-CB 3.45Å; L247-M250 PolarHBondContact O-N 3.39Å; L247-D251 PolarHBondContact O-N 2.72Å |
| 248 | N | 84.5 | Confident | 77.9 | Confident | 105 Ų | 105 | 105.1 Ų | 105.1 | 56% | 0.561 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -60.4 | -29.4 | 175.6 | -172.7 | 44.6 | 0 | 0 | 0 | 112.3 | D244 K252 | D244-N248 VanDerWaalsContact O-CB 3.23Å; D244-N248 WeakPolarHBondContact O-CB 3.02Å; D244-N248 PolarHBondContact O-N 3.26Å; N248-K252 WeakPolarHBondContact O-CB 3.4Å; N248-K252 WeakPolarHBondContact O-CG 3.06Å; N248-K252 PolarHBondContact O-N 3.35Å |
| 249 | V | 85.5 | Confident | 78.3 | Confident | 62 Ų | 62 | 106.7 Ų | 106.7 | 38% | 0.376 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -71.2 | -33 | 172.2 | 169.7 | 0 | 0 | 0 | 0 | 112.9 | E245 V246 L247 K252 | E245-V249 WeakPolarHBondContact O-CG2 3.46Å; E245-V249 PolarHBondContact O-N 3.18Å; E245-V249 VanDerWaalsContact O-N 3.1Å; V246-V249 WeakPolarHBondContact O-CB 3.33Å; V246-V249 PolarHBondContact O-N 3.27Å; L247-V249 PolarHBondContact O-N 3.48Å; V249-K252 VanDerWaalsContact CA-CE 3.45Å; V249-K252 WeakPolarHBondContact O-CE 3.14Å; V249-K252 VanDerWaalsContact O-CG 3.3Å; V249-K252 WeakPolarHBondContact O-CG 3.47Å |
| 250 | M | 78 | Confident | 78.3 | Confident | 126 Ų | 126 | 112.6 Ų | 112.6 | 62% | 0.621 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -81.2 | -19.4 | 176.6 | -71.3 | 176.9 | 53.4 | 0 | 0 | 113.5 | V246 L247 N253 | V246-M250 PolarHBondContact O-N 3.38Å; V246-M250 VanDerWaalsContact O-N 3.11Å; L247-M250 CarbonylContact O-C 3.55Å; L247-M250 WeakPolarHBondContact O-CA 3.3Å; L247-M250 WeakPolarHBondContact O-CB 3.45Å; L247-M250 PolarHBondContact O-N 3.39Å; M250-N253 VanDerWaalsContact C-OD1 3.27Å; M250-N253 PolarHBondContact O-OD1 3.4Å |
| 251 | D | 80.1 | Confident | 78.7 | Confident | 104 Ų | 104 | 112.5 Ų | 112.5 | 56% | 0.556 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -94 | -24.5 | 179.3 | -70.7 | -34.1 | 0 | 0 | 0 | 112.6 | L247 N253 | L247-D251 PolarHBondContact O-N 2.72Å; D251-N253 PolarHBondContact O-N 3.48Å |
| 252 | K | 75.8 | Confident | 79.2 | Confident | 143 Ų | 143 | 113.3 Ų | 113.3 | 62% | 0.622 | 57% | 0.571 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.4 | -8.9 | -179.7 | 70.4 | -172.3 | 178.3 | -164.2 | 0 | 115.1 | N248 V249 | N248-K252 WeakPolarHBondContact O-CB 3.4Å; N248-K252 WeakPolarHBondContact O-CG 3.06Å; N248-K252 PolarHBondContact O-N 3.35Å; V249-K252 VanDerWaalsContact CA-CE 3.45Å; V249-K252 WeakPolarHBondContact O-CE 3.14Å; V249-K252 VanDerWaalsContact O-CG 3.3Å; V249-K252 WeakPolarHBondContact O-CG 3.47Å |
| 253 | N | 66.9 | Low | 79 | Confident | 129 Ų | 129 | 116.7 Ų | 116.7 | 69% | 0.69 | 59% | 0.586 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.3 | 18.4 | -178.5 | 56.7 | 2.7 | 0 | 0 | 0 | 112.9 | M250 D251 | M250-N253 VanDerWaalsContact C-OD1 3.27Å; M250-N253 PolarHBondContact O-OD1 3.4Å; D251-N253 PolarHBondContact O-N 3.48Å |
| 254 | K | 57.6 | Low | 78.5 | Confident | 240 Ų | 240 | 119.9 Ų | 119.9 | 100% | 1.043 | 60% | 0.601 | S | S | * | * | | | trans | -121.3 | 0 | 174 | -173.1 | 174.7 | 177.2 | -68 | 0 | 111.2 | | |