| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.9 | Very low | 46.1 | Very low | 240 Ų | 240 | 169.3 Ų | 169.3 | 100% | 1.182 | 82% | 0.822 | S | S | * | * | 0 | 78.1 | 0 | -161.6 | 172 | -78.2 | 0 | 0 | 105.5 | |||||
| 2 | E | 43 | Very low | 46 | Very low | 168 Ų | 168 | 163 Ų | 163 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | trans | -100 | 117.3 | 178.9 | -72.6 | -179.7 | 134.8 | 0 | 0 | 106.9 | F4 | E2-F4 HydrophobicContact CB-CE2 4.45Å; E2-F4 PolarHBondContact O-N 3.15Å | ||
| 3 | L | 48.6 | Very low | 45.3 | Very low | 168 Ų | 168 | 161.5 Ų | 161.5 | 88% | 0.88 | 80% | 0.801 | S | S | * | * | trans | -86.7 | 106.4 | 175.7 | -76.6 | 164.3 | 0 | 0 | 0 | 107.6 | E5 | L3-E5 PolarHBondContact O-N 3.3Š| ||
| 4 | F | 45.6 | Very low | 44.8 | Very low | 173 Ų | 173 | 163.7 Ų | 163.7 | 76% | 0.759 | 81% | 0.809 | S | S | * | * | trans | -73.5 | 108.8 | 165.1 | -66.2 | -86.7 | 0 | 0 | 0 | 108.2 | E2 T6 | E2-F4 HydrophobicContact CB-CE2 4.45Å; E2-F4 PolarHBondContact O-N 3.15Å; F4-T6 PolarHBondContact O-N 3.23Å; F4-T6 VanDerWaalsContact O-N 3.16Å | ||
| 5 | E | 51.2 | Low | 44.7 | Very low | 199 Ų | 199 | 166.7 Ų | 166.7 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | trans | -62.4 | 109.5 | 164.2 | -86.1 | 176.4 | 141.9 | 0 | 0 | 108.8 | L3 | L3-E5 PolarHBondContact O-N 3.3Š| ||
| 6 | T | 54.3 | Low | 43.8 | Very low | 129 Ų | 129 | 168.2 Ų | 168.2 | 79% | 0.791 | 81% | 0.809 | S | S | * | * | trans | -92.9 | 117.4 | 169.4 | 46.3 | 0 | 0 | 0 | 0 | 108.7 | F4 | F4-T6 PolarHBondContact O-N 3.23Å; F4-T6 VanDerWaalsContact O-N 3.16Å | ||
| 7 | N | 40 | Very low | 43.3 | Very low | 124 Ų | 124 | 172.4 Ų | 172.4 | 66% | 0.663 | 82% | 0.816 | S | S | * | * | trans | -57.2 | 127.7 | 175.6 | -176.8 | -12.8 | 0 | 0 | 0 | 110.9 | Y9 | N7-Y9 PolarHBondContact O-N 2.7Å; N7-Y9 PolarHBondContact OD1-N 3.39Å | ||
| 8 | P | 53.1 | Low | 43.1 | Very low | 113 Ų | 113 | 172.3 Ų | 172.3 | 73% | 0.734 | 82% | 0.815 | S | S | * | * | S | Bend | trans | -79.9 | 10.1 | -175.4 | 32.2 | -34.4 | 0 | 0 | 0 | 114.5 | ||
| 9 | Y | 48.1 | Very low | 42.6 | Very low | 181 Ų | 181 | 166.8 Ų | 166.8 | 71% | 0.71 | 81% | 0.809 | S | S | * | * | trans | -121.9 | 79.3 | 176.8 | -72.7 | -83.5 | 0 | 0 | 0 | 111.5 | N7 F11 | N7-Y9 PolarHBondContact O-N 2.7Å; N7-Y9 PolarHBondContact OD1-N 3.39Å; Y9-F11 HydrophobicContact CD1-CE2 4.49Å | ||
| 10 | F | 36.2 | Very low | 42.2 | Very low | 180 Ų | 180 | 161.8 Ų | 161.8 | 79% | 0.789 | 80% | 0.803 | S | S | * | * | trans | -125.2 | 102.1 | 159.9 | -157.7 | -95.6 | 0 | 0 | 0 | 108.3 | P12 | F10-P12 HydrophobicContact CD1-CG 4.05Å; F10-P12 HydrophobicContact CE1-CG 4.17Å; F10-P12 WeakPolarHBondContact O-CD 3.28Å | ||
| 11 | F | 44.8 | Very low | 41.7 | Very low | 187 Ų | 187 | 161.5 Ų | 161.5 | 82% | 0.82 | 80% | 0.804 | S | S | * | * | trans | -95.7 | 109.6 | 167 | -84.6 | -89.3 | 0 | 0 | 0 | 107.7 | Y9 D13 | Y9-F11 HydrophobicContact CD1-CE2 4.49Å; F11-D13 PolarHBondContact O-N 2.86Å | ||
| 12 | P | 45.6 | Very low | 41.7 | Very low | 94 Ų | 94 | 154.5 Ų | 154.5 | 61% | 0.61 | 78% | 0.779 | S | S | * | * | trans | -74.3 | 118.9 | 162.3 | -4.8 | 22 | 0 | 0 | 0 | 108 | F10 Q14 | F10-P12 HydrophobicContact CD1-CG 4.05Å; F10-P12 HydrophobicContact CE1-CG 4.17Å; F10-P12 WeakPolarHBondContact O-CD 3.28Å; P12-Q14 PolarHBondContact O-N 3.37Å | ||
| 13 | D | 37 | Very low | 41.5 | Very low | 143 Ų | 143 | 157.5 Ų | 157.5 | 77% | 0.765 | 79% | 0.785 | S | S | * | * | trans | -60.4 | 98.1 | 171.7 | -157.3 | -23.6 | 0 | 0 | 0 | 109.4 | F11 R15 | F11-D13 PolarHBondContact O-N 2.86Å; D13-R15 VanDerWaalsContact C-N 3.35Å; D13-R15 PolarHBondContact O-N 3.15Å | ||
| 14 | Q | 38.6 | Very low | 41 | Very low | 193 Ų | 193 | 158.7 Ų | 158.7 | 90% | 0.902 | 78% | 0.784 | S | S | * | * | trans | -84.9 | 81.1 | 169.4 | -94.6 | 175.5 | -1.2 | 0 | 0 | 109.3 | P12 | P12-Q14 PolarHBondContact O-N 3.37Š| ||
| 15 | R | 42.8 | Very low | 41 | Very low | 209 Ų | 209 | 156.3 Ų | 156.3 | 79% | 0.789 | 79% | 0.785 | S | S | * | * | trans | -128.5 | 96.3 | 155.8 | -72.6 | -147.7 | -155.4 | 159.8 | 10.1 | 109.2 | D13 | D13-R15 VanDerWaalsContact C-N 3.35Å; D13-R15 PolarHBondContact O-N 3.15Å | ||
| 16 | F | 30.5 | Very low | 40.5 | Very low | 190 Ų | 190 | 151.9 Ų | 151.9 | 83% | 0.833 | 78% | 0.776 | S | S | * | * | trans | 175.7 | 92.3 | 141.9 | -103.8 | -77.4 | 0 | 0 | 0 | 106.2 | ||||
| 17 | Y | 35.1 | Very low | 39.7 | Very low | 239 Ų | 239 | 156.3 Ų | 156.3 | 94% | 0.937 | 78% | 0.779 | S | S | * | * | trans | -108.6 | 103.2 | 162.2 | -125 | -79.7 | 0 | 0 | 0 | 105.9 | ||||
| 18 | E | 40.4 | Very low | 39.6 | Very low | 171 Ų | 171 | 157.4 Ų | 157.4 | 80% | 0.799 | 78% | 0.783 | S | S | * | * | trans | -132 | 127.8 | 167.2 | -172 | 156.3 | -166.3 | 0 | 0 | 107.9 | ||||
| 19 | G | 31.8 | Very low | 39.3 | Very low | 68 Ų | 68 | 157.8 Ų | 157.8 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | 84.5 | 132.7 | -178 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 20 | G | 34.7 | Very low | 38.6 | Very low | 66 Ų | 66 | 152.1 Ų | 152.1 | 68% | 0.68 | 78% | 0.783 | S | S | * | * | cis | 158.3 | 136.7 | 11.9 | 0 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 21 | D | 33.1 | Very low | 38.4 | Very low | 156 Ų | 156 | 150.2 Ų | 150.2 | 83% | 0.834 | 79% | 0.786 | S | S | * | * | trans | 72 | 114.4 | 163 | -59.2 | -52 | 0 | 0 | 0 | 121.5 | ||||
| 22 | S | 42.1 | Very low | 37.9 | Very low | 93 Ų | 93 | 151.6 Ų | 151.6 | 65% | 0.65 | 79% | 0.787 | S | S | * | * | 45.2 | 113 | 124.7 | -47.8 | 0 | 0 | 0 | 0 | 118.6 | |||||
| 23 | Y | 37.5 | Very low | 37.6 | Very low | 231 Ų | 231 | 152.6 Ų | 152.6 | 91% | 0.906 | 79% | 0.788 | S | S | * | * | 176.9 | 111.7 | 125.5 | -93.6 | -71.2 | 0 | 0 | 0 | 109.8 | |||||
| 24 | F | 38 | Very low | 38 | Very low | 194 Ų | 194 | 154.6 Ų | 154.6 | 85% | 0.851 | 79% | 0.792 | S | S | * | * | trans | -65.6 | 144.6 | 162.4 | -93.1 | -95.4 | 0 | 0 | 0 | 110.3 | ||||
| 25 | P | 46 | Very low | 38 | Very low | 123 Ų | 123 | 150 Ų | 150 | 80% | 0.799 | 79% | 0.788 | S | S | * | * | trans | -109.9 | 117.8 | 151.6 | 27.8 | -13.4 | 0 | 0 | 0 | 110.7 | ||||
| 26 | S | 39.9 | Very low | 38 | Very low | 105 Ų | 105 | 143.4 Ų | 143.4 | 73% | 0.734 | 78% | 0.784 | S | S | * | * | trans | -96.6 | 133.9 | 164.1 | -72.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 27 | R | 39.2 | Very low | 38.5 | Very low | 223 Ų | 223 | 145.6 Ų | 145.6 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | trans | 133.6 | 103 | 145.9 | -73.7 | -170.4 | -167.6 | -117.7 | 6.4 | 113.3 | ||||
| 28 | L | 37.3 | Very low | 38.7 | Very low | 146 Ų | 146 | 142.8 Ų | 142.8 | 76% | 0.764 | 78% | 0.784 | S | S | * | * | 96.1 | 162.6 | 95.9 | -75.8 | 177.5 | 0 | 0 | 0 | 112.3 | |||||
| 29 | P | 47.6 | Very low | 38.5 | Very low | 121 Ų | 121 | 141.1 Ų | 141.1 | 79% | 0.786 | 78% | 0.781 | S | S | * | * | cis | -133.6 | 172.4 | -32.5 | 36.6 | -18.7 | 0 | 0 | 0 | 113.8 | ||||
| 30 | G | 31.7 | Very low | 39.4 | Very low | 63 Ų | 63 | 148.5 Ų | 148.5 | 65% | 0.649 | 79% | 0.787 | S | S | * | * | trans | 114.4 | 114.4 | 145.3 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 31 | T | 32.4 | Very low | 39.8 | Very low | 139 Ų | 139 | 152.4 Ų | 152.4 | 85% | 0.853 | 79% | 0.792 | S | S | * | * | trans | 69.4 | 122.3 | 137.4 | 63.5 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 32 | Y | 34.1 | Very low | 40.5 | Very low | 216 Ų | 216 | 150.5 Ų | 150.5 | 85% | 0.847 | 79% | 0.792 | S | S | * | * | trans | 71.9 | 126.8 | 149.1 | -169 | -98.6 | 0 | 0 | 0 | 116 | ||||
| 33 | D | 39.3 | Very low | 41.2 | Very low | 116 Ų | 116 | 153.6 Ų | 153.6 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | cis | -154.3 | 162.4 | 20.6 | -164.4 | -115.1 | 0 | 0 | 0 | 110.5 | ||||
| 34 | Q | 45.7 | Very low | 41.8 | Very low | 185 Ų | 185 | 150 Ų | 150 | 86% | 0.864 | 79% | 0.791 | S | S | * | * | trans | -95 | 111.1 | -174.6 | 172.2 | 172.8 | 83.3 | 0 | 0 | 110.7 | ||||
| 35 | A | 38 | Very low | 42 | Very low | 97 Ų | 97 | 145 Ų | 145 | 80% | 0.802 | 79% | 0.794 | S | S | * | * | trans | -154 | 113.8 | 161.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 36 | G | 43.5 | Very low | 41.8 | Very low | 69 Ų | 69 | 145.8 Ų | 145.8 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | S | Bend | trans | 80.3 | 88.8 | 144.1 | 0 | 0 | 0 | 0 | 0 | 118 | ||
| 37 | Y | 41.2 | Very low | 41.9 | Very low | 236 Ų | 236 | 146.3 Ų | 146.3 | 93% | 0.925 | 79% | 0.793 | S | S | * | * | trans | 146.1 | 70.3 | 137.1 | -84.8 | -77.4 | 0 | 0 | 0 | 109.8 | D39 | Y37-D39 PolarHBondContact O-N 3Š| ||
| 38 | Q | 38.8 | Very low | 41.6 | Very low | 181 Ų | 181 | 139.2 Ų | 139.2 | 85% | 0.846 | 79% | 0.789 | S | S | * | * | trans | -67.9 | 111.4 | 158.8 | -88.7 | -80.3 | -3.3 | 0 | 0 | 107.7 | R40 | Q38-R40 PolarHBondContact O-N 3.39Š| ||
| 39 | D | 37 | Very low | 41.6 | Very low | 136 Ų | 136 | 137.5 Ų | 137.5 | 73% | 0.727 | 79% | 0.789 | S | S | * | * | trans | -61.8 | 80.6 | 167.9 | -177.2 | 35.2 | 0 | 0 | 0 | 109.4 | Y37 N41 | Y37-D39 PolarHBondContact O-N 3Å; D39-N41 PolarHBondContact O-N 3.11Å; D39-N41 VanDerWaalsContact O-N 3.1Å | ||
| 40 | R | 49.2 | Very low | 41.3 | Very low | 222 Ų | 222 | 140.2 Ų | 140.2 | 84% | 0.838 | 80% | 0.796 | S | S | * | * | trans | -86.9 | 54.2 | -178.6 | -157.4 | 166 | 84.5 | 174 | 6.1 | 111.3 | Q38 | Q38-R40 PolarHBondContact O-N 3.39Š| ||
| 41 | N | 43.3 | Very low | 41.7 | Very low | 148 Ų | 148 | 142.3 Ų | 142.3 | 79% | 0.791 | 81% | 0.808 | S | S | * | * | trans | -126.5 | 22.8 | 177.3 | -146.1 | 75.6 | 0 | 0 | 0 | 114.6 | D39 | D39-N41 PolarHBondContact O-N 3.11Å; D39-N41 VanDerWaalsContact O-N 3.1Å | ||
| 42 | S | 49.5 | Very low | 41.8 | Very low | 117 Ų | 117 | 139.2 Ų | 139.2 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | S | Bend | trans | -124.4 | 15.4 | -179.8 | -140 | 0 | 0 | 0 | 0 | 115.7 | ||
| 43 | M | 55.5 | Low | 41.6 | Very low | 157 Ų | 157 | 132.6 Ų | 132.6 | 77% | 0.773 | 80% | 0.801 | S | S | * | * | S | Bend | trans | -144.1 | 134.1 | 169.1 | 77.8 | -178.2 | -161.3 | 0 | 0 | 112.7 | ||
| 44 | M | 50.2 | Low | 41.4 | Very low | 157 Ų | 157 | 131.7 Ų | 131.7 | 77% | 0.773 | 81% | 0.809 | S | S | * | * | trans | 72 | 85.4 | 177.6 | -64.5 | -165.4 | -164.5 | 0 | 0 | 117.8 | L46 | M44-L46 HydrophobicContact SD-CD1 4.34Š| ||
| 45 | G | 42.1 | Very low | 40.8 | Very low | 88 Ų | 88 | 128.1 Ų | 128.1 | 91% | 0.907 | 81% | 0.805 | S | S | * | * | trans | -92.3 | 71.3 | 146.7 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 46 | L | 42.8 | Very low | 40.7 | Very low | 140 Ų | 140 | 130.3 Ų | 130.3 | 73% | 0.733 | 81% | 0.808 | S | S | * | * | trans | -94.8 | 124 | 164 | -72.4 | 171.5 | 0 | 0 | 0 | 107.6 | M44 G48 | M44-L46 HydrophobicContact SD-CD1 4.34Å; L46-G48 PolarHBondContact O-N 3.21Å; L46-G48 VanDerWaalsContact O-N 3.13Å | ||
| 47 | C | 41.2 | Very low | 40.4 | Very low | 116 Ų | 116 | 130.1 Ų | 130.1 | 78% | 0.784 | 81% | 0.806 | S | S | * | * | trans | -50.4 | 112.1 | 172.9 | 51.3 | 0 | 0 | 0 | 0 | 111.2 | S49 | C47-S49 PolarHBondContact O-N 3.2Å; C47-S49 VanDerWaalsContact O-N 3.09Å | ||
| 48 | G | 33 | Very low | 40.1 | Very low | 74 Ų | 74 | 126 Ų | 126 | 76% | 0.763 | 81% | 0.805 | S | S | * | * | trans | -73.9 | 93.3 | 167.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | L46 L50 | L46-G48 PolarHBondContact O-N 3.21Å; L46-G48 VanDerWaalsContact O-N 3.13Å; G48-L50 PolarHBondContact O-N 2.94Å | ||
| 49 | S | 36.8 | Very low | 39.9 | Very low | 109 Ų | 109 | 122 Ų | 122 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | trans | -70.9 | 118.4 | 158 | -65.2 | 0 | 0 | 0 | 0 | 107.4 | C47 A51 | C47-S49 PolarHBondContact O-N 3.2Å; C47-S49 VanDerWaalsContact O-N 3.09Å; S49-A51 PolarHBondContact O-N 3.06Å; S49-A51 VanDerWaalsContact O-N 3.07Å | ||
| 50 | L | 41.7 | Very low | 39.8 | Very low | 178 Ų | 178 | 120.1 Ų | 120.1 | 93% | 0.932 | 80% | 0.8 | S | S | * | * | trans | -68.6 | 103.4 | 173 | -71.1 | 163.4 | 0 | 0 | 0 | 108.4 | G48 G52 | G48-L50 PolarHBondContact O-N 2.94Å; L50-G52 PolarHBondContact O-N 3.17Å | ||
| 51 | A | 39.4 | Very low | 39.6 | Very low | 108 Ų | 108 | 116.3 Ų | 116.3 | 89% | 0.893 | 80% | 0.802 | S | S | * | * | trans | -75.5 | 112.5 | 161.7 | 0 | 0 | 0 | 0 | 0 | 108.2 | S49 | S49-A51 PolarHBondContact O-N 3.06Å; S49-A51 VanDerWaalsContact O-N 3.07Å | ||
| 52 | G | 34.8 | Very low | 39.5 | Very low | 74 Ų | 74 | 117.3 Ų | 117.3 | 76% | 0.763 | 80% | 0.802 | S | S | * | * | trans | -149 | 104.7 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | L50 | L50-G52 PolarHBondContact O-N 3.17Š| ||
| 53 | G | 31.4 | Very low | 38.9 | Very low | 77 Ų | 77 | 118.9 Ų | 118.9 | 79% | 0.794 | 80% | 0.801 | S | S | * | * | trans | 73.6 | 101.2 | 140.2 | 0 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 54 | A | 33.3 | Very low | 38.3 | Very low | 96 Ų | 96 | 120.9 Ų | 120.9 | 79% | 0.793 | 81% | 0.805 | S | S | * | * | trans | 52.1 | 115.6 | 131.2 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 55 | S | 34.3 | Very low | 38.1 | Very low | 110 Ų | 110 | 117.3 Ų | 117.3 | 77% | 0.769 | 80% | 0.801 | S | S | * | * | trans | 58.5 | 116.6 | 140.9 | 64.5 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 56 | V | 36.2 | Very low | 38.2 | Very low | 144 Ų | 144 | 118.7 Ų | 118.7 | 87% | 0.873 | 80% | 0.797 | S | S | * | * | -166.5 | 129.1 | 96.1 | 171.3 | 0 | 0 | 0 | 0 | 106.8 | |||||
| 57 | G | 36.1 | Very low | 38.5 | Very low | 64 Ų | 64 | 117.4 Ų | 117.4 | 66% | 0.66 | 80% | 0.797 | S | S | * | * | trans | -89.2 | 158.6 | -174.2 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||||
| 58 | V | 35.6 | Very low | 38.8 | Very low | 150 Ų | 150 | 117.2 Ų | 117.2 | 91% | 0.909 | 80% | 0.797 | S | S | * | * | trans | -158.9 | 134.6 | 140.3 | -138.5 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 59 | A | 34.4 | Very low | 39.6 | Very low | 98 Ų | 98 | 118.9 Ų | 118.9 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | 59.4 | 114.3 | 149.5 | 0 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 60 | S | 36.1 | Very low | 40.2 | Very low | 96 Ų | 96 | 121.8 Ų | 121.8 | 67% | 0.671 | 80% | 0.803 | S | S | * | * | trans | -53 | 141.2 | 156.1 | -169.1 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 61 | T | 44 | Very low | 40.2 | Very low | 141 Ų | 141 | 117.9 Ų | 117.9 | 87% | 0.865 | 79% | 0.791 | S | S | * | * | trans | -149 | 128.5 | 135.7 | 52.3 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 62 | E | 40.4 | Very low | 40.7 | Very low | 170 Ų | 170 | 119.1 Ų | 119.1 | 79% | 0.794 | 79% | 0.789 | S | S | * | * | trans | -78.2 | 157.6 | -173 | -64.2 | 173.1 | 96.6 | 0 | 0 | 114.3 | ||||
| 63 | D | 38.4 | Very low | 41.2 | Very low | 150 Ų | 150 | 122.4 Ų | 122.4 | 80% | 0.802 | 79% | 0.785 | S | S | * | * | trans | 70.4 | 109.5 | 144.4 | -117.1 | -78.9 | 0 | 0 | 0 | 121.8 | ||||
| 64 | K | 43 | Very low | 42.4 | Very low | 198 Ų | 198 | 124 Ų | 124 | 86% | 0.861 | 78% | 0.784 | S | S | * | * | -166.4 | 106.7 | 122.1 | -165.2 | 165.6 | 175 | 173.3 | 0 | 111.6 | |||||
| 65 | A | 44.4 | Very low | 43.3 | Very low | 83 Ų | 83 | 126.3 Ų | 126.3 | 69% | 0.686 | 78% | 0.778 | S | S | * | * | trans | -71.4 | 131.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 66 | S | 45.3 | Very low | 44.4 | Very low | 116 Ų | 116 | 126.9 Ų | 126.9 | 81% | 0.811 | 78% | 0.777 | S | S | * | * | trans | 179.5 | 156.2 | 145.2 | -87 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 67 | P | 49.6 | Very low | 45.8 | Very low | 113 Ų | 113 | 124.4 Ų | 124.4 | 73% | 0.734 | 76% | 0.756 | S | S | * | * | trans | -113.1 | 161 | -134.6 | 38 | -28.1 | 0 | 0 | 0 | 115.8 | ||||
| 68 | S | 47.6 | Very low | 47.3 | Very low | 112 Ų | 112 | 123.3 Ų | 123.3 | 78% | 0.783 | 74% | 0.737 | S | S | * | * | trans | 46.4 | 112.6 | 143.3 | -56.6 | 0 | 0 | 0 | 0 | 121.5 | ||||
| 69 | S | 48.2 | Very low | 48.8 | Very low | 110 Ų | 110 | 120.8 Ų | 120.8 | 77% | 0.769 | 72% | 0.724 | S | S | * | * | trans | 148.3 | 111.6 | 130.3 | 60.8 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 70 | L | 49.5 | Very low | 50.4 | Low | 170 Ų | 170 | 119.5 Ų | 119.5 | 89% | 0.89 | 72% | 0.72 | S | S | * | * | -167.3 | 79.3 | 85.8 | -74.8 | 166.5 | 0 | 0 | 0 | 107.9 | |||||
| 71 | S | 42.5 | Very low | 52.4 | Low | 96 Ų | 96 | 122 Ų | 122 | 67% | 0.671 | 72% | 0.722 | S | S | * | * | S | Bend | trans | -103.1 | 131.3 | 155.3 | -87.6 | 0 | 0 | 0 | 0 | 106 | H73 | S71-H73 PolarHBondContact O-N 3.16Š|
| 72 | P | 49.3 | Very low | 54.6 | Low | 134 Ų | 134 | 117 Ų | 117 | 87% | 0.87 | 69% | 0.692 | S | S | * | * | trans | -68.7 | 85.9 | 166.5 | 28.2 | -27.9 | 0 | 0 | 0 | 106.2 | S74 | P72-S74 PolarHBondContact O-N 3.15Š| ||
| 73 | H | 46.2 | Very low | 56.7 | Low | 143 Ų | 143 | 113.7 Ų | 113.7 | 66% | 0.662 | 68% | 0.679 | S | S | * | * | trans | -45 | 117.8 | 161.5 | -97.5 | -98.8 | 0 | 0 | 0 | 105.7 | S71 E75 | S71-H73 PolarHBondContact O-N 3.16Å; H73-E75 HydrophobicContact CB-CG 4Å; H73-E75 PolarHBondContact O-N 3.43Å | ||
| 74 | S | 56.8 | Low | 58.8 | Low | 110 Ų | 110 | 109.7 Ų | 109.7 | 77% | 0.769 | 66% | 0.661 | S | S | * | * | trans | -62.7 | 71.4 | 146.8 | 55.3 | 0 | 0 | 0 | 0 | 106.6 | P72 T76 | P72-S74 PolarHBondContact O-N 3.15Å; S74-T76 PolarHBondContact O-N 3.09Å; S74-T76 VanDerWaalsContact O-N 3.17Å | ||
| 75 | E | 52.4 | Low | 60.7 | Low | 145 Ų | 145 | 109.4 Ų | 109.4 | 68% | 0.678 | 66% | 0.655 | S | S | * | * | trans | -45.7 | 122.9 | 156.5 | -71.7 | -75.9 | 128.4 | 0 | 0 | 104.6 | H73 H77 | H73-E75 HydrophobicContact CB-CG 4Å; H73-E75 PolarHBondContact O-N 3.43Å; E75-H77 PolarHBondContact O-N 3.45Å | ||
| 76 | T | 57.1 | Low | 62.9 | Low | 121 Ų | 121 | 108.4 Ų | 108.4 | 74% | 0.742 | 65% | 0.647 | S | S | * | * | trans | -67.1 | 67.2 | -175.9 | -30.4 | 0 | 0 | 0 | 0 | 108.7 | S74 C78 | S74-T76 PolarHBondContact O-N 3.09Å; S74-T76 VanDerWaalsContact O-N 3.17Å; T76-C78 PolarHBondContact O-N 3.41Å; T76-C78 VanDerWaalsContact O-N 3.09Å | ||
| 77 | H | 65.7 | Low | 65 | Low | 93 Ų | 93 | 103.9 Ų | 103.9 | 43% | 0.431 | 62% | 0.615 | S | S | . | * | trans | -67.8 | 114.1 | -173.9 | 176.9 | -75.3 | 0 | 0 | 0 | 107.6 | E75 C87 | E75-H77 PolarHBondContact O-N 3.45Å; H77-C87 PolarHBondContact CE1-SG 3Å | ||
| 78 | C | 66.7 | Low | 66.9 | Low | 41 Ų | 41 | 107 Ų | 107 | 28% | 0.277 | 62% | 0.617 | S | S | . | * | trans | 60.9 | 95 | -168.8 | -55.6 | 0 | 0 | 0 | 0 | 114.1 | T76 G80 C82 | T76-C78 PolarHBondContact O-N 3.41Å; T76-C78 VanDerWaalsContact O-N 3.09Å; C78-G80 PolarHBondContact O-N 3.44Å; C78-C82 HydrophobicContact CB-CB 4.06Å; C78-C82 WeakPolarHBondContact CB-SG 3.31Å; C78-C82 WeakPolarHBondContact SG-CB 3.33Å; C78-C82 CovalentContact SG-SG 2.04Å; C78-C82 PolarHBondContact SG-SG 2.87Å | ||
| 79 | P | 67.8 | Low | 68.7 | Low | 96 Ų | 96 | 106.3 Ų | 106.3 | 62% | 0.623 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -71.3 | 55.7 | 160.5 | 28.6 | -28.5 | 0 | 0 | 0 | 111.2 | Q81 | P79-Q81 VanDerWaalsContact C-OE1 3.3Å; P79-Q81 PolarHBondContact O-NE2 3.43Å; P79-Q81 PolarHBondContact O-OE1 2.6Å |
| 80 | G | 67 | Low | 70.6 | Confident | 71 Ų | 71 | 102.2 Ų | 102.2 | 73% | 0.732 | 58% | 0.575 | S | S | * | * | S | Bend | trans | 89.3 | -2.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | C78 | C78-G80 PolarHBondContact O-N 3.44Š|
| 81 | Q | 79.3 | Confident | 72.5 | Confident | 150 Ų | 150 | 99.6 Ų | 99.6 | 70% | 0.701 | 56% | 0.556 | S | S | * | * | trans | -81.9 | -11.5 | -176 | -68.1 | 81.4 | 15.8 | 0 | 0 | 115.6 | P79 | P79-Q81 VanDerWaalsContact C-OE1 3.3Å; P79-Q81 PolarHBondContact O-NE2 3.43Å; P79-Q81 PolarHBondContact O-OE1 2.6Å | ||
| 82 | C | 88.9 | Confident | 74.6 | Confident | 35 Ų | 35 | 103 Ų | 103 | 24% | 0.236 | 56% | 0.555 | C | S | . | * | S | Bend | trans | -114.6 | 136.8 | -177.1 | 70.8 | 0 | 0 | 0 | 0 | 113.2 | C78 C87 C90 | C78-C82 HydrophobicContact CB-CB 4.06Å; C78-C82 WeakPolarHBondContact CB-SG 3.31Å; C78-C82 WeakPolarHBondContact SG-CB 3.33Å; C78-C82 CovalentContact SG-SG 2.04Å; C78-C82 PolarHBondContact SG-SG 2.87Å; C82-C87 HydrophobicContact CB-CB 3.93Å; C82-C90 PolarHBondContact SG-SG 2.74Å |
| 83 | L | 85.3 | Confident | 76.4 | Confident | 100 Ų | 100 | 103.4 Ų | 103.4 | 52% | 0.524 | 54% | 0.542 | S | S | . | . | trans | -69.7 | 130.3 | 175.8 | -64.6 | 172.2 | 0 | 0 | 0 | 109.8 | W85 A86 C87 | L83-W85 HydrophobicContact CB-CD2 4.48Å; L83-W85 HydrophobicContact CB-CG 4.45Å; L83-W85 HydrophobicContact CB-CZ2 4.48Å; L83-W85 HydrophobicContact CD1-CZ2 3.49Å; L83-W85 VanDerWaalsContact CD1-CZ2 3.49Å; L83-W85 PolarHBondContact O-N 2.91Å; L83-A86 HydrophobicContact CB-CB 4.18Å; L83-A86 PolarHBondContact O-N 3.41Å; L83-C87 PolarHBondContact O-N 2.87Å; L83-C87 VanDerWaalsContact O-N 3.1Å | ||
| 84 | P | 81.7 | Confident | 78.5 | Confident | 66 Ų | 66 | 98.9 Ų | 98.9 | 43% | 0.429 | 53% | 0.525 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.6 | -22.3 | -176.4 | -26.8 | 34.3 | 0 | 0 | 0 | 115 | K91 T94 | P84-K91 WeakPolarHBondContact O-CA 3.22Å; P84-K91 WeakPolarHBondContact O-CB 3.37Å; P84-K91 PolarHBondContact O-N 3.49Å; P84-T94 HydrophobicContact CB-CG2 4Å |
| 85 | W | 84.1 | Confident | 80.1 | Confident | 192 Ų | 192 | 96.3 Ų | 96.3 | 73% | 0.727 | 51% | 0.505 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.8 | -27.2 | 177.5 | 60.9 | -98.8 | 0 | 0 | 0 | 113.2 | L83 | L83-W85 HydrophobicContact CB-CD2 4.48Å; L83-W85 HydrophobicContact CB-CG 4.45Å; L83-W85 HydrophobicContact CB-CZ2 4.48Å; L83-W85 HydrophobicContact CD1-CZ2 3.49Å; L83-W85 VanDerWaalsContact CD1-CZ2 3.49Å; L83-W85 PolarHBondContact O-N 2.91Å |
| 86 | A | 89.7 | Confident | 82 | Confident | 63 Ų | 63 | 93 Ų | 93 | 52% | 0.521 | 49% | 0.494 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.9 | -30.1 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113 | L83 | L83-A86 HydrophobicContact CB-CB 4.18Å; L83-A86 PolarHBondContact O-N 3.41Å |
| 87 | C | 90.3 | Very high | 83.8 | Confident | 21 Ų | 21 | 90 Ų | 90 | 14% | 0.142 | 47% | 0.473 | C | S | . | . | trans | -90.9 | 123.4 | 177.4 | 176 | 0 | 0 | 0 | 0 | 112 | H77 C82 L83 L89 C90 K91 | H77-C87 PolarHBondContact CE1-SG 3Å; C82-C87 HydrophobicContact CB-CB 3.93Å; L83-C87 PolarHBondContact O-N 2.87Å; L83-C87 VanDerWaalsContact O-N 3.1Å; C87-L89 PolarHBondContact O-N 3.32Å; C87-C90 HydrophobicContact CB-CB 4.01Å; C87-C90 PolarHBondContact O-N 3.37Å; C87-K91 VanDerWaalsContact O-CB 3.25Å; C87-K91 WeakPolarHBondContact O-CB 3.44Å; C87-K91 PolarHBondContact O-N 3.01Å | ||
| 88 | K | 87.9 | Confident | 85.2 | Confident | 177 Ų | 177 | 89.6 Ų | 89.6 | 77% | 0.77 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -61.2 | -38.2 | -178.7 | -62.4 | -177.2 | -164.5 | 178.2 | 0 | 113.7 | R92 | K88-R92 WeakPolarHBondContact O-CB 3.35Å; K88-R92 PolarHBondContact O-N 2.91Å |
| 89 | L | 87.3 | Confident | 86.6 | Confident | 99 Ų | 99 | 96.1 Ų | 96.1 | 52% | 0.518 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70 | -47.1 | 178.7 | -74.9 | 118.3 | 0 | 0 | 0 | 111.3 | C87 R92 K93 | C87-L89 PolarHBondContact O-N 3.32Å; L89-R92 PolarHBondContact O-N 3.42Å; L89-K93 PolarHBondContact O-N 3.42Å |
| 90 | C | 87.8 | Confident | 88 | Confident | 23 Ų | 23 | 99.7 Ų | 99.7 | 16% | 0.155 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -65.8 | -40.1 | 177.3 | -64.6 | 0 | 0 | 0 | 0 | 111.9 | C82 C87 R92 K93 T94 | C82-C90 PolarHBondContact SG-SG 2.74Å; C87-C90 HydrophobicContact CB-CB 4.01Å; C87-C90 PolarHBondContact O-N 3.37Å; C90-R92 PolarHBondContact O-N 3.39Å; C90-K93 PolarHBondContact O-N 3.36Å; C90-T94 WeakPolarHBondContact O-CG2 3.46Å; C90-T94 PolarHBondContact O-N 2.95Å; C90-T94 PolarHBondContact O-OG1 2.99Å; C90-T94 VanDerWaalsContact O-OG1 3.11Å |
| 91 | K | 88 | Confident | 89.5 | Confident | 115 Ų | 115 | 104.2 Ų | 104.2 | 50% | 0.5 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -59.2 | -45.2 | 173.3 | -170.7 | 173.4 | -178.7 | 175.2 | 0 | 111.9 | P84 C87 T94 V95 | P84-K91 WeakPolarHBondContact O-CA 3.22Å; P84-K91 WeakPolarHBondContact O-CB 3.37Å; P84-K91 PolarHBondContact O-N 3.49Å; C87-K91 VanDerWaalsContact O-CB 3.25Å; C87-K91 WeakPolarHBondContact O-CB 3.44Å; C87-K91 PolarHBondContact O-N 3.01Å; K91-T94 WeakPolarHBondContact CA-OG1 3.25Å; K91-T94 PolarHBondContact O-OG1 2.96Å; K91-T94 VanDerWaalsContact O-OG1 3.05Å; K91-V95 HydrophobicContact CG-CG2 4.28Å; K91-V95 VanDerWaalsContact O-CB 3.29Å; K91-V95 WeakPolarHBondContact O-CB 3.48Å; K91-V95 WeakPolarHBondContact O-CG2 3.35Å; K91-V95 PolarHBondContact O-N 3.5Å |
| 92 | R | 87.7 | Confident | 90.4 | Very high | 169 Ų | 169 | 98.9 Ų | 98.9 | 64% | 0.638 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63.9 | -43.6 | 177.5 | -167.4 | -176.2 | -67.1 | 130.8 | -5.1 | 110.5 | K88 L89 C90 T96 | K88-R92 WeakPolarHBondContact O-CB 3.35Å; K88-R92 PolarHBondContact O-N 2.91Å; L89-R92 PolarHBondContact O-N 3.42Å; C90-R92 PolarHBondContact O-N 3.39Å; R92-T96 WeakPolarHBondContact O-CG2 3.44Å; R92-T96 PolarHBondContact O-N 3.13Å; R92-T96 PolarHBondContact O-OG1 2.98Å |
| 93 | K | 87.4 | Confident | 90.8 | Very high | 141 Ų | 141 | 99.5 Ų | 99.5 | 61% | 0.613 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -62.2 | -48.5 | 177.2 | -172.2 | 69 | 173.4 | -167.7 | 0 | 111.6 | L89 C90 T96 M97 | L89-K93 PolarHBondContact O-N 3.42Å; C90-K93 PolarHBondContact O-N 3.36Å; K93-T96 PolarHBondContact O-N 3.39Å; K93-T96 PolarHBondContact O-OG1 3.32Å; K93-M97 WeakPolarHBondContact O-CB 3.33Å; K93-M97 WeakPolarHBondContact O-CG 3.48Å; K93-M97 PolarHBondContact O-N 3.42Å |
| 94 | T | 88.8 | Confident | 91.5 | Very high | 49 Ų | 49 | 99.2 Ų | 99.2 | 30% | 0.301 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -63.8 | -48 | 178.6 | 54.3 | 0 | 0 | 0 | 0 | 111.6 | P84 C90 K91 T96 M97 D98 | P84-T94 HydrophobicContact CB-CG2 4Å; C90-T94 WeakPolarHBondContact O-CG2 3.46Å; C90-T94 PolarHBondContact O-N 2.95Å; C90-T94 PolarHBondContact O-OG1 2.99Å; C90-T94 VanDerWaalsContact O-OG1 3.11Å; K91-T94 WeakPolarHBondContact CA-OG1 3.25Å; K91-T94 PolarHBondContact O-OG1 2.96Å; K91-T94 VanDerWaalsContact O-OG1 3.05Å; T94-T96 VanDerWaalsContact C-N 3.29Å; T94-T96 PolarHBondContact O-N 2.69Å; T94-M97 CarbonylContact O-C 3.55Å; T94-M97 PolarHBondContact O-N 2.99Å; T94-D98 WeakPolarHBondContact O-CB 3.25Å; T94-D98 VanDerWaalsContact O-CG 3.25Å; T94-D98 PolarHBondContact O-N 3.24Å |
| 95 | V | 90.8 | Very high | 92.3 | Very high | 56 Ų | 56 | 100 Ų | 100 | 34% | 0.339 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -57.8 | -42 | 177.4 | 171.3 | 0 | 0 | 0 | 0 | 111.5 | K91 R99 | K91-V95 HydrophobicContact CG-CG2 4.28Å; K91-V95 VanDerWaalsContact O-CB 3.29Å; K91-V95 WeakPolarHBondContact O-CB 3.48Å; K91-V95 WeakPolarHBondContact O-CG2 3.35Å; K91-V95 PolarHBondContact O-N 3.5Å; V95-R99 HydrophobicContact CG1-CG 4.49Å; V95-R99 WeakPolarHBondContact O-CB 3.47Å; V95-R99 VanDerWaalsContact O-CG 3.22Å; V95-R99 WeakPolarHBondContact O-CG 3.43Å; V95-R99 PolarHBondContact O-N 3Å |
| 96 | T | 93.6 | Very high | 93 | Very high | 74 Ų | 74 | 98.2 Ų | 98.2 | 45% | 0.454 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 176 | 59.6 | 0 | 0 | 0 | 0 | 112.5 | R92 K93 T94 R100 | R92-T96 WeakPolarHBondContact O-CG2 3.44Å; R92-T96 PolarHBondContact O-N 3.13Å; R92-T96 PolarHBondContact O-OG1 2.98Å; K93-T96 PolarHBondContact O-N 3.39Å; K93-T96 PolarHBondContact O-OG1 3.32Å; T94-T96 VanDerWaalsContact C-N 3.29Å; T94-T96 PolarHBondContact O-N 2.69Å; T96-R100 PolarHBondContact O-N 3.27Å; T96-R100 VanDerWaalsContact O-N 3.08Å |
| 97 | M | 93.3 | Very high | 93.4 | Very high | 60 Ų | 60 | 99 Ų | 99 | 30% | 0.296 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -68.1 | -41.5 | 176.9 | -73.7 | -60.5 | -62.7 | 0 | 0 | 112.1 | K93 T94 R100 R101 | K93-M97 WeakPolarHBondContact O-CB 3.33Å; K93-M97 WeakPolarHBondContact O-CG 3.48Å; K93-M97 PolarHBondContact O-N 3.42Å; T94-M97 CarbonylContact O-C 3.55Å; T94-M97 PolarHBondContact O-N 2.99Å; M97-R100 WeakPolarHBondContact O-CB 3.47Å; M97-R100 PolarHBondContact O-N 3.03Å; M97-R101 WeakPolarHBondContact O-CG 3.39Å; M97-R101 PolarHBondContact O-N 3.27Å |
| 98 | D | 95.4 | Very high | 93.8 | Very high | 83 Ų | 83 | 105.2 Ų | 105.2 | 44% | 0.444 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.7 | -41.5 | 178 | -68.2 | -25 | 0 | 0 | 0 | 110.9 | T94 R100 R101 A102 | T94-D98 WeakPolarHBondContact O-CB 3.25Å; T94-D98 VanDerWaalsContact O-CG 3.25Å; T94-D98 PolarHBondContact O-N 3.24Å; D98-R100 VanDerWaalsContact C-N 3.3Å; D98-R100 PolarHBondContact O-N 3.17Å; D98-R101 PolarHBondContact O-N 3.39Å; D98-A102 VanDerWaalsContact O-CB 3.26Å; D98-A102 WeakPolarHBondContact O-CB 3.31Å; D98-A102 PolarHBondContact O-N 3.36Å |
| 99 | R | 96.8 | Very high | 94.3 | Very high | 179 Ų | 179 | 104.3 Ų | 104.3 | 68% | 0.675 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -58 | -43.3 | 171.4 | -77.2 | 177 | 178.5 | -161.9 | -0.2 | 111.8 | V95 A102 A103 | V95-R99 HydrophobicContact CG1-CG 4.49Å; V95-R99 WeakPolarHBondContact O-CB 3.47Å; V95-R99 VanDerWaalsContact O-CG 3.22Å; V95-R99 WeakPolarHBondContact O-CG 3.43Å; V95-R99 PolarHBondContact O-N 3Å; R99-A102 PolarHBondContact O-N 3.25Å; R99-A103 WeakPolarHBondContact O-CB 3.43Å; R99-A103 PolarHBondContact O-N 3.42Å |
| 100 | R | 98.1 | Very high | 94.9 | Very high | 170 Ų | 170 | 105.7 Ų | 105.7 | 64% | 0.642 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -62.4 | -50.3 | 176.7 | -173.5 | -176.2 | -66.8 | -171.9 | -3 | 111.1 | T96 M97 D98 A102 A103 T104 | T96-R100 PolarHBondContact O-N 3.27Å; T96-R100 VanDerWaalsContact O-N 3.08Å; M97-R100 WeakPolarHBondContact O-CB 3.47Å; M97-R100 PolarHBondContact O-N 3.03Å; D98-R100 VanDerWaalsContact C-N 3.3Å; D98-R100 PolarHBondContact O-N 3.17Å; R100-A102 VanDerWaalsContact C-N 3.35Å; R100-A102 PolarHBondContact O-N 3.08Å; R100-A103 WeakPolarHBondContact O-CB 3.39Å; R100-A103 PolarHBondContact O-N 3.48Å; R100-T104 PolarHBondContact O-N 3.38Å; R100-T104 PolarHBondContact O-OG1 3.17Å |
| 101 | R | 97.6 | Very high | 95.4 | Very high | 167 Ų | 167 | 108 Ų | 108 | 63% | 0.63 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -59.6 | -43.7 | 177.6 | -72 | 172.7 | 174.9 | 175.3 | -4.6 | 112 | M97 D98 A103 T104 L105 | M97-R101 WeakPolarHBondContact O-CG 3.39Å; M97-R101 PolarHBondContact O-N 3.27Å; D98-R101 PolarHBondContact O-N 3.39Å; R101-A103 VanDerWaalsContact C-N 3.35Å; R101-A103 PolarHBondContact O-N 3.02Å; R101-T104 PolarHBondContact O-N 2.9Å; R101-L105 PolarHBondContact O-N 3.07Å |
| 102 | A | 98.1 | Very high | 95.9 | Very high | 38 Ų | 38 | 108.8 Ų | 108.8 | 31% | 0.314 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.5 | -40.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | D98 R99 R100 L105 R106 | D98-A102 VanDerWaalsContact O-CB 3.26Å; D98-A102 WeakPolarHBondContact O-CB 3.31Å; D98-A102 PolarHBondContact O-N 3.36Å; R99-A102 PolarHBondContact O-N 3.25Å; R100-A102 VanDerWaalsContact C-N 3.35Å; R100-A102 PolarHBondContact O-N 3.08Å; A102-L105 PolarHBondContact O-N 3.3Å; A102-R106 WeakPolarHBondContact O-CG 3.5Å; A102-R106 PolarHBondContact O-N 3.37Å |
| 103 | A | 98.3 | Very high | 96.4 | Very high | 47 Ų | 47 | 107.9 Ų | 107.9 | 39% | 0.388 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63 | -46.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.8 | R99 R100 R101 L105 R106 E107 | R99-A103 WeakPolarHBondContact O-CB 3.43Å; R99-A103 PolarHBondContact O-N 3.42Å; R100-A103 WeakPolarHBondContact O-CB 3.39Å; R100-A103 PolarHBondContact O-N 3.48Å; R101-A103 VanDerWaalsContact C-N 3.35Å; R101-A103 PolarHBondContact O-N 3.02Å; A103-L105 VanDerWaalsContact C-N 3.32Å; A103-L105 PolarHBondContact O-N 3.15Å; A103-R106 PolarHBondContact O-N 3.36Å; A103-E107 PolarHBondContact O-N 3.04Å |
| 104 | T | 98.4 | Very high | 96.9 | Very high | 94 Ų | 94 | 103.5 Ų | 103.5 | 58% | 0.577 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -59.1 | -42.1 | 175.5 | -56.4 | 0 | 0 | 0 | 0 | 112 | R100 R101 E107 K108 | R100-T104 PolarHBondContact O-N 3.38Å; R100-T104 PolarHBondContact O-OG1 3.17Å; R101-T104 PolarHBondContact O-N 2.9Å; T104-E107 PolarHBondContact O-N 3.43Å; T104-K108 WeakPolarHBondContact O-CB 3.37Å; T104-K108 PolarHBondContact O-N 3.16Å |
| 105 | L | 98.6 | Very high | 97.4 | Very high | 82 Ų | 82 | 104.4 Ų | 104.4 | 43% | 0.429 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.5 | -39.3 | 178.6 | -173 | 62.5 | 0 | 0 | 0 | 112.1 | R101 A102 A103 K108 R109 | R101-L105 PolarHBondContact O-N 3.07Å; A102-L105 PolarHBondContact O-N 3.3Å; A103-L105 VanDerWaalsContact C-N 3.32Å; A103-L105 PolarHBondContact O-N 3.15Å; L105-K108 PolarHBondContact O-N 3.34Å; L105-R109 WeakPolarHBondContact O-CG 3.4Å; L105-R109 PolarHBondContact O-N 3.38Å |
| 106 | R | 98.8 | Very high | 97.7 | Very high | 155 Ų | 155 | 106 Ų | 106 | 59% | 0.585 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60.7 | -45.6 | 173.1 | -76.8 | -174.9 | -74.9 | -107 | 1.3 | 111.4 | A102 A103 R109 R110 | A102-R106 WeakPolarHBondContact O-CG 3.5Å; A102-R106 PolarHBondContact O-N 3.37Å; A103-R106 PolarHBondContact O-N 3.36Å; R106-R109 WeakPolarHBondContact O-CB 3.44Å; R106-R109 PolarHBondContact O-N 3.01Å; R106-R110 PolarHBondContact O-N 3.43Å |
| 107 | E | 98.6 | Very high | 98 | Very high | 79 Ų | 79 | 105.5 Ų | 105.5 | 37% | 0.369 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.5 | -40.8 | 178.6 | -178.3 | 55.8 | -163.8 | 0 | 0 | 112.1 | A103 T104 R109 R110 L111 | A103-E107 PolarHBondContact O-N 3.04Å; T104-E107 PolarHBondContact O-N 3.43Å; E107-R109 VanDerWaalsContact C-N 3.3Å; E107-R109 PolarHBondContact O-N 3.07Å; E107-R110 WeakPolarHBondContact O-CB 3.32Å; E107-R110 PolarHBondContact O-N 2.73Å; E107-R110 VanDerWaalsContact O-N 3.16Å; E107-R110 IonicContact OE1-CZ 3.37Å; E107-R110 IonicContact OE1-NE 2.74Å; E107-R110 PolarHBondContact OE1-NE 3.07Å; E107-R110 IonicContact OE1-NH2 3.22Å; E107-R110 PolarHBondContact OE1-NH2 3.48Å; E107-R110 IonicContact OE2-CZ 3.73Å; E107-R110 IonicContact OE2-NE 2.7Å; E107-R110 PolarHBondContact OE2-NE 3.31Å; E107-R110 IonicContact OE2-NH2 2.81Å; E107-L111 HydrophobicContact CG-CD1 4.27Å; E107-L111 WeakPolarHBondContact O-CG 3.43Å; E107-L111 PolarHBondContact O-N 3.09Å |
| 108 | K | 98.7 | Very high | 98.2 | Very high | 153 Ų | 153 | 104.5 Ų | 104.5 | 67% | 0.665 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -56.6 | -44.2 | 172.5 | -176.3 | 177.8 | 179.2 | 178.2 | 0 | 111.7 | T104 L105 L111 K112 | T104-K108 WeakPolarHBondContact O-CB 3.37Å; T104-K108 PolarHBondContact O-N 3.16Å; L105-K108 PolarHBondContact O-N 3.34Å; K108-L111 PolarHBondContact O-N 2.86Å; K108-K112 PolarHBondContact O-N 3.16Å |
| 109 | R | 98.8 | Very high | 98.3 | Very high | 158 Ų | 158 | 103.7 Ų | 103.7 | 60% | 0.596 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.8 | -41.1 | 176.7 | -70.3 | 171.6 | -175.2 | 179.5 | 0.9 | 111.8 | L105 R106 E107 K112 K113 | L105-R109 WeakPolarHBondContact O-CG 3.4Å; L105-R109 PolarHBondContact O-N 3.38Å; R106-R109 WeakPolarHBondContact O-CB 3.44Å; R106-R109 PolarHBondContact O-N 3.01Å; E107-R109 VanDerWaalsContact C-N 3.3Å; E107-R109 PolarHBondContact O-N 3.07Å; R109-K112 WeakPolarHBondContact O-CB 3.48Å; R109-K112 PolarHBondContact O-N 3.3Å; R109-K113 PolarHBondContact O-N 3.43Å |
| 110 | R | 98.8 | Very high | 98.3 | Very high | 128 Ų | 128 | 97.6 Ų | 97.6 | 48% | 0.483 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -60.9 | -48.9 | 176.4 | -167.4 | -166.3 | 70.9 | 82.1 | 0.5 | 111.2 | R106 E107 K112 K113 V114 | R106-R110 PolarHBondContact O-N 3.43Å; E107-R110 WeakPolarHBondContact O-CB 3.32Å; E107-R110 PolarHBondContact O-N 2.73Å; E107-R110 VanDerWaalsContact O-N 3.16Å; E107-R110 IonicContact OE1-CZ 3.37Å; E107-R110 IonicContact OE1-NE 2.74Å; E107-R110 PolarHBondContact OE1-NE 3.07Å; E107-R110 IonicContact OE1-NH2 3.22Å; E107-R110 PolarHBondContact OE1-NH2 3.48Å; E107-R110 IonicContact OE2-CZ 3.73Å; E107-R110 IonicContact OE2-NE 2.7Å; E107-R110 PolarHBondContact OE2-NE 3.31Å; E107-R110 IonicContact OE2-NH2 2.81Å; R110-K112 VanDerWaalsContact C-N 3.31Å; R110-K112 PolarHBondContact O-N 3.27Å; R110-K113 PolarHBondContact O-N 3.35Å; R110-V114 PolarHBondContact O-N 3.42Å; R110-V114 VanDerWaalsContact O-N 3.12Å |
| 111 | L | 98.5 | Very high | 98.3 | Very high | 70 Ų | 70 | 91.9 Ų | 91.9 | 37% | 0.366 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.7 | -35.1 | 178.1 | -71.1 | 173.5 | 0 | 0 | 0 | 112.6 | E107 K108 V114 N115 | E107-L111 HydrophobicContact CG-CD1 4.27Å; E107-L111 WeakPolarHBondContact O-CG 3.43Å; E107-L111 PolarHBondContact O-N 3.09Å; K108-L111 PolarHBondContact O-N 2.86Å; L111-V114 PolarHBondContact O-N 3.13Å; L111-N115 WeakPolarHBondContact O-CB 3.43Å; L111-N115 VanDerWaalsContact O-CG 3.23Å; L111-N115 PolarHBondContact O-N 3.02Å; L111-N115 PolarHBondContact O-ND2 3.29Å |
| 112 | K | 98.6 | Very high | 98.3 | Very high | 133 Ų | 133 | 85.3 Ų | 85.3 | 58% | 0.578 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -58.1 | -49.7 | 173.9 | -165.9 | -168.1 | -178.8 | -149.3 | 0 | 111.1 | K108 R109 R110 V114 N115 E116 | K108-K112 PolarHBondContact O-N 3.16Å; R109-K112 WeakPolarHBondContact O-CB 3.48Å; R109-K112 PolarHBondContact O-N 3.3Å; R110-K112 VanDerWaalsContact C-N 3.31Å; R110-K112 PolarHBondContact O-N 3.27Å; K112-V114 VanDerWaalsContact C-N 3.34Å; K112-V114 PolarHBondContact O-N 3.3Å; K112-N115 PolarHBondContact O-N 3.25Å; K112-N115 VanDerWaalsContact O-N 3.14Å; K112-E116 WeakPolarHBondContact CD-OE1 3.37Å; K112-E116 WeakPolarHBondContact CE-OE1 3.39Å; K112-E116 IonicContact NZ-OE1 3.2Å; K112-E116 PolarHBondContact NZ-OE1 2.99Å; K112-E116 WeakPolarHBondContact O-CG 3.45Å; K112-E116 PolarHBondContact O-N 3.25Å |
| 113 | K | 98.7 | Very high | 98.3 | Very high | 150 Ų | 150 | 91.7 Ų | 91.7 | 65% | 0.652 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -60.3 | -42.2 | 177.5 | -66.7 | -177 | 177.6 | -170.2 | 0 | 112.3 | R109 R110 N115 E116 A117 | R109-K113 PolarHBondContact O-N 3.43Å; R110-K113 PolarHBondContact O-N 3.35Å; K113-N115 VanDerWaalsContact C-N 3.33Å; K113-N115 PolarHBondContact O-N 2.95Å; K113-E116 PolarHBondContact O-N 3.12Å; K113-A117 PolarHBondContact O-N 3.09Å |
| 114 | V | 98.6 | Very high | 98.2 | Very high | 48 Ų | 48 | 92.6 Ų | 92.6 | 29% | 0.291 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -60.7 | -44.9 | 175.4 | 172.2 | 0 | 0 | 0 | 0 | 110.5 | R110 L111 K112 A117 F118 | R110-V114 PolarHBondContact O-N 3.42Å; R110-V114 VanDerWaalsContact O-N 3.12Å; L111-V114 PolarHBondContact O-N 3.13Å; K112-V114 VanDerWaalsContact C-N 3.34Å; K112-V114 PolarHBondContact O-N 3.3Å; V114-A117 PolarHBondContact O-N 3.34Å; V114-F118 HydrophobicContact CG1-CD2 3.92Å; V114-F118 HydrophobicContact CG1-CE2 3.94Å; V114-F118 WeakPolarHBondContact O-CD2 3.33Å; V114-F118 PolarHBondContact O-N 2.75Å |
| 115 | N | 98.1 | Very high | 98.1 | Very high | 68 Ų | 68 | 88.6 Ų | 88.6 | 36% | 0.364 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -66.4 | -40.2 | 179.3 | -68.1 | -15.5 | 0 | 0 | 0 | 112.1 | L111 K112 K113 A117 F118 D119 K135 | L111-N115 WeakPolarHBondContact O-CB 3.43Å; L111-N115 VanDerWaalsContact O-CG 3.23Å; L111-N115 PolarHBondContact O-N 3.02Å; L111-N115 PolarHBondContact O-ND2 3.29Å; K112-N115 PolarHBondContact O-N 3.25Å; K112-N115 VanDerWaalsContact O-N 3.14Å; K113-N115 VanDerWaalsContact C-N 3.33Å; K113-N115 PolarHBondContact O-N 2.95Å; N115-A117 VanDerWaalsContact C-N 3.29Å; N115-A117 PolarHBondContact O-N 3.46Å; N115-F118 WeakPolarHBondContact O-CB 3.42Å; N115-F118 PolarHBondContact O-N 3.22Å; N115-F118 VanDerWaalsContact O-N 3.13Å; N115-D119 PolarHBondContact O-N 3.48Å; N115-K135 WeakPolarHBondContact OD1-CE 3.47Å; N115-K135 PolarHBondContact OD1-NZ 3.06Å |
| 116 | E | 98.3 | Very high | 97.9 | Very high | 91 Ų | 91 | 85.8 Ų | 85.8 | 43% | 0.425 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -58.1 | -41 | 173.4 | -73.4 | 167.4 | -176 | 0 | 0 | 111.5 | K112 K113 D119 A120 | K112-E116 WeakPolarHBondContact CD-OE1 3.37Å; K112-E116 WeakPolarHBondContact CE-OE1 3.39Å; K112-E116 IonicContact NZ-OE1 3.2Å; K112-E116 PolarHBondContact NZ-OE1 2.99Å; K112-E116 WeakPolarHBondContact O-CG 3.45Å; K112-E116 PolarHBondContact O-N 3.25Å; K113-E116 PolarHBondContact O-N 3.12Å; E116-D119 PolarHBondContact O-N 3.36Å; E116-A120 PolarHBondContact O-N 3.46Å |
| 117 | A | 98.3 | Very high | 97.5 | Very high | 63 Ų | 63 | 85.3 Ų | 85.3 | 52% | 0.521 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -65.3 | -40.2 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | K113 V114 N115 D119 A120 L121 | K113-A117 PolarHBondContact O-N 3.09Å; V114-A117 PolarHBondContact O-N 3.34Å; N115-A117 VanDerWaalsContact C-N 3.29Å; N115-A117 PolarHBondContact O-N 3.46Å; A117-D119 VanDerWaalsContact C-N 3.31Å; A117-D119 PolarHBondContact O-N 2.8Å; A117-A120 PolarHBondContact O-N 3.14Å; A117-L121 WeakPolarHBondContact O-CB 3.37Å; A117-L121 PolarHBondContact O-N 3.28Å |
| 118 | F | 98.3 | Very high | 97.2 | Very high | 38 Ų | 38 | 86.7 Ų | 86.7 | 17% | 0.167 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -62.9 | -37.9 | 172.6 | -91.7 | -83.1 | 0 | 0 | 0 | 112 | V114 N115 L121 K122 K135 I138 L139 | V114-F118 HydrophobicContact CG1-CD2 3.92Å; V114-F118 HydrophobicContact CG1-CE2 3.94Å; V114-F118 WeakPolarHBondContact O-CD2 3.33Å; V114-F118 PolarHBondContact O-N 2.75Å; N115-F118 WeakPolarHBondContact O-CB 3.42Å; N115-F118 PolarHBondContact O-N 3.22Å; N115-F118 VanDerWaalsContact O-N 3.13Å; F118-L121 PolarHBondContact O-N 3.42Å; F118-K122 WeakPolarHBondContact O-CG 3.35Å; F118-K122 PolarHBondContact O-N 3.48Å; F118-K135 HydrophobicContact CD1-CB 4.35Å; F118-K135 HydrophobicContact CD1-CG 4.15Å; F118-K135 HydrophobicContact CD2-CD 4.2Å; F118-K135 HydrophobicContact CD2-CG 4.49Å; F118-K135 HydrophobicContact CE1-CB 3.71Å; F118-K135 HydrophobicContact CE1-CD 4.39Å; F118-K135 HydrophobicContact CE1-CG 3.93Å; F118-K135 HydrophobicContact CE2-CD 3.87Å; F118-K135 HydrophobicContact CE2-CG 4.3Å; F118-K135 HydrophobicContact CG-CG 4.43Å; F118-K135 HydrophobicContact CZ-CB 3.85Å; F118-K135 HydrophobicContact CZ-CD 3.98Å; F118-K135 HydrophobicContact CZ-CG 4.02Å; F118-I138 HydrophobicContact CD1-CB 4.2Å; F118-I138 HydrophobicContact CD1-CD1 3.97Å; F118-I138 HydrophobicContact CD1-CG2 4.05Å; F118-I138 HydrophobicContact CE1-CB 4.42Å; F118-L139 HydrophobicContact CE1-CD2 4.01Å; F118-L139 HydrophobicContact CE1-CG 4.02Å; F118-L139 HydrophobicContact CZ-CD1 4.4Å; F118-L139 HydrophobicContact CZ-CD2 4.18Å; F118-L139 HydrophobicContact CZ-CG 4.29Å |
| 119 | D | 97.3 | Very high | 96.7 | Very high | 67 Ų | 67 | 81.3 Ų | 81.3 | 36% | 0.358 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -69.1 | -33.9 | 176.4 | -71.8 | -36.3 | 0 | 0 | 0 | 112.7 | N115 E116 A117 K122 R123 | N115-D119 PolarHBondContact O-N 3.48Å; E116-D119 PolarHBondContact O-N 3.36Å; A117-D119 VanDerWaalsContact C-N 3.31Å; A117-D119 PolarHBondContact O-N 2.8Å; D119-K122 WeakPolarHBondContact OD1-CE 3.49Å; D119-K122 IonicContact OD1-NZ 3.78Å; D119-K122 PolarHBondContact OD1-NZ 3.2Å; D119-R123 WeakPolarHBondContact O-CG 3.3Å; D119-R123 PolarHBondContact O-N 2.96Å; D119-R123 PolarHBondContact O-NE 3.43Å; D119-R123 VanDerWaalsContact O-NE 3.08Å |
| 120 | A | 97.6 | Very high | 96.4 | Very high | 50 Ų | 50 | 81.4 Ų | 81.4 | 41% | 0.413 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -66.3 | -44.7 | 170.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | E116 A117 K122 R123 S124 | E116-A120 PolarHBondContact O-N 3.46Å; A117-A120 PolarHBondContact O-N 3.14Å; A120-K122 VanDerWaalsContact C-N 3.34Å; A120-K122 PolarHBondContact O-N 2.97Å; A120-R123 WeakPolarHBondContact O-CB 3.48Å; A120-R123 PolarHBondContact O-N 3.41Å; A120-R123 VanDerWaalsContact O-N 3.11Å; A120-S124 PolarHBondContact O-N 3.21Å |
| 121 | L | 98 | Very high | 96.1 | Very high | 50 Ų | 50 | 80.4 Ų | 80.4 | 26% | 0.262 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.2 | -40.5 | 178 | -177.1 | 61 | 0 | 0 | 0 | 112.5 | A117 F118 R123 S124 T125 I138 L139 A142 | A117-L121 WeakPolarHBondContact O-CB 3.37Å; A117-L121 PolarHBondContact O-N 3.28Å; F118-L121 PolarHBondContact O-N 3.42Å; L121-R123 VanDerWaalsContact C-N 3.3Å; L121-R123 PolarHBondContact O-N 3.47Å; L121-S124 PolarHBondContact O-N 3.28Å; L121-S124 PolarHBondContact O-OG 3.19Å; L121-T125 HydrophobicContact CD1-CG2 3.7Å; L121-T125 HydrophobicContact CG-CG2 4.42Å; L121-T125 WeakPolarHBondContact O-CB 3.48Å; L121-T125 PolarHBondContact O-N 2.98Å; L121-T125 PolarHBondContact O-OG1 2.7Å; L121-I138 HydrophobicContact CB-CG2 4.46Å; L121-I138 HydrophobicContact CD2-CG2 3.89Å; L121-I138 HydrophobicContact CG-CG2 4.05Å; L121-L139 HydrophobicContact CD2-CD2 4.16Å; L121-A142 HydrophobicContact CD1-CB 3.86Å; L121-A142 HydrophobicContact CD2-CB 4.13Å; L121-A142 HydrophobicContact CG-CB 4.22Å |
| 122 | K | 97.7 | Very high | 95.9 | Very high | 29 Ų | 29 | 88.7 Ų | 88.7 | 13% | 0.126 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -58.8 | -42.9 | 173.8 | -75.8 | -171.9 | -67.7 | 166.1 | 0 | 111.9 | F118 D119 A120 S124 L126 P129 I138 | F118-K122 WeakPolarHBondContact O-CG 3.35Å; F118-K122 PolarHBondContact O-N 3.48Å; D119-K122 WeakPolarHBondContact OD1-CE 3.49Å; D119-K122 IonicContact OD1-NZ 3.78Å; D119-K122 PolarHBondContact OD1-NZ 3.2Å; A120-K122 VanDerWaalsContact C-N 3.34Å; A120-K122 PolarHBondContact O-N 2.97Å; K122-S124 VanDerWaalsContact C-N 3.27Å; K122-S124 PolarHBondContact O-N 3.12Å; K122-L126 HydrophobicContact CB-CD1 3.9Å; K122-L126 HydrophobicContact CD-CD1 4.24Å; K122-L126 HydrophobicContact CG-CD1 3.68Å; K122-L126 VanDerWaalsContact O-CB 3.27Å; K122-L126 WeakPolarHBondContact O-CB 3.46Å; K122-L126 PolarHBondContact O-N 3.06Å; K122-P129 HydrophobicContact CB-CB 4.41Å; K122-P129 PolarHBondContact NZ-O 3.43Å; K122-I138 HydrophobicContact CD-CD1 3.71Å; K122-I138 HydrophobicContact CD-CG1 4.24Å; K122-I138 HydrophobicContact CG-CD1 3.7Å; K122-I138 HydrophobicContact CG-CG1 3.91Å; K122-I138 HydrophobicContact CG-CG2 3.85Å |
| 123 | R | 97.1 | Very high | 95.7 | Very high | 172 Ų | 172 | 84.3 Ų | 84.3 | 65% | 0.649 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -64.5 | -30.8 | -179.4 | -76.6 | 178.6 | -92.1 | 173.6 | -9 | 113 | D119 A120 L121 P129 | D119-R123 WeakPolarHBondContact O-CG 3.3Å; D119-R123 PolarHBondContact O-N 2.96Å; D119-R123 PolarHBondContact O-NE 3.43Å; D119-R123 VanDerWaalsContact O-NE 3.08Å; A120-R123 WeakPolarHBondContact O-CB 3.48Å; A120-R123 PolarHBondContact O-N 3.41Å; A120-R123 VanDerWaalsContact O-N 3.11Å; L121-R123 VanDerWaalsContact C-N 3.3Å; L121-R123 PolarHBondContact O-N 3.47Å; R123-P129 HydrophobicContact CB-CB 4.49Å; R123-P129 HydrophobicContact CG-CB 3.77Å; R123-P129 HydrophobicContact CG-CG 4.28Å |
| 124 | S | 96.3 | Very high | 95.6 | Very high | 66 Ų | 66 | 80.1 Ų | 80.1 | 46% | 0.462 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -88.1 | -29.2 | 179.8 | 58.3 | 0 | 0 | 0 | 0 | 114.1 | A120 L121 K122 Y145 | A120-S124 PolarHBondContact O-N 3.21Å; L121-S124 PolarHBondContact O-N 3.28Å; L121-S124 PolarHBondContact O-OG 3.19Å; K122-S124 VanDerWaalsContact C-N 3.27Å; K122-S124 PolarHBondContact O-N 3.12Å; S124-Y145 WeakPolarHBondContact O-CE1 3.42Å |
| 125 | T | 96.6 | Very high | 95.5 | Very high | 10 Ų | 10 | 82.2 Ų | 82.2 | 6% | 0.061 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -107.9 | -26.6 | -169.7 | 58.6 | 0 | 0 | 0 | 0 | 114 | L121 A142 Y145 | L121-T125 HydrophobicContact CD1-CG2 3.7Å; L121-T125 HydrophobicContact CG-CG2 4.42Å; L121-T125 WeakPolarHBondContact O-CB 3.48Å; L121-T125 PolarHBondContact O-N 2.98Å; L121-T125 PolarHBondContact O-OG1 2.7Å; T125-A142 HydrophobicContact CG2-CB 3.79Å; T125-Y145 HydrophobicContact CG2-CD1 3.98Å; T125-Y145 HydrophobicContact CG2-CG 4.41Å |
| 126 | L | 93.9 | Very high | 95.6 | Very high | 24 Ų | 24 | 82.5 Ų | 82.5 | 13% | 0.126 | 42% | 0.422 | C | S | . | . | trans | -105 | 143.8 | -175.5 | -54.1 | 176.7 | 0 | 0 | 0 | 111 | K122 N128 L133 S141 | K122-L126 HydrophobicContact CB-CD1 3.9Å; K122-L126 HydrophobicContact CD-CD1 4.24Å; K122-L126 HydrophobicContact CG-CD1 3.68Å; K122-L126 VanDerWaalsContact O-CB 3.27Å; K122-L126 WeakPolarHBondContact O-CB 3.46Å; K122-L126 PolarHBondContact O-N 3.06Å; L126-N128 VanDerWaalsContact C-N 3.28Å; L126-N128 PolarHBondContact O-N 3.02Å; L126-L133 HydrophobicContact CD1-CD1 3.44Å; L126-L133 VanDerWaalsContact CD1-CD1 3.44Å; L126-L133 HydrophobicContact CD2-CD1 4.36Å; L126-S141 VanDerWaalsContact CD2-CB 3.45Å | ||
| 127 | M | 90.9 | Very high | 95.5 | Very high | 145 Ų | 145 | 82 Ų | 82 | 71% | 0.714 | 42% | 0.42 | S | S | * | . | S | Bend | trans | -69.8 | -28.5 | 174.6 | -53.6 | -65.3 | 86.4 | 0 | 0 | 112 | ||
| 128 | N | 91.8 | Very high | 95.5 | Very high | 108 Ų | 108 | 79.3 Ų | 79.3 | 58% | 0.578 | 40% | 0.396 | S | S | * | . | trans | -124.4 | 85.9 | -178.7 | -69.5 | -64.3 | 0 | 0 | 0 | 111.2 | L126 N130 Q131 | L126-N128 VanDerWaalsContact C-N 3.28Å; L126-N128 PolarHBondContact O-N 3.02Å; N128-N130 PolarHBondContact O-N 3.3Å; N128-Q131 WeakPolarHBondContact O-CB 3.48Å; N128-Q131 PolarHBondContact O-N 3.22Å | ||
| 129 | P | 89.6 | Confident | 95.5 | Very high | 39 Ų | 39 | 81.5 Ų | 81.5 | 25% | 0.253 | 41% | 0.409 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70 | -17.1 | -174.6 | 26.7 | -34.7 | 0 | 0 | 0 | 114.6 | K122 R123 Q131 | K122-P129 HydrophobicContact CB-CB 4.41Å; K122-P129 PolarHBondContact NZ-O 3.43Å; R123-P129 HydrophobicContact CB-CB 4.49Å; R123-P129 HydrophobicContact CG-CB 3.77Å; R123-P129 HydrophobicContact CG-CG 4.28Å; P129-Q131 VanDerWaalsContact C-N 3.29Å |
| 130 | N | 91.3 | Very high | 95.5 | Very high | 160 Ų | 160 | 84.7 Ų | 84.7 | 86% | 0.856 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.8 | -13.1 | 177.7 | -64.7 | -37.1 | 0 | 0 | 0 | 113.2 | N128 R132 | N128-N130 PolarHBondContact O-N 3.3Å; N130-R132 PolarHBondContact O-N 3.42Å |
| 131 | Q | 92.8 | Very high | 95.5 | Very high | 107 Ų | 107 | 84 Ų | 84 | 50% | 0.5 | 41% | 0.409 | S | S | . | . | S | Bend | trans | -67.3 | 131.3 | 176 | -171.9 | 177.2 | -8.7 | 0 | 0 | 110.2 | N128 P129 L133 | N128-Q131 WeakPolarHBondContact O-CB 3.48Å; N128-Q131 PolarHBondContact O-N 3.22Å; P129-Q131 VanDerWaalsContact C-N 3.29Å; Q131-L133 HydrophobicContact CB-CG 4.5Å; Q131-L133 HydrophobicContact CG-CD2 4.11Å; Q131-L133 HydrophobicContact CG-CG 4.05Å; Q131-L133 PolarHBondContact O-N 2.74Å |
| 132 | R | 94.4 | Very high | 95.6 | Very high | 245 Ų | 245 | 82.1 Ų | 82.1 | 93% | 0.925 | 40% | 0.4 | S | S | * | . | trans | -76.1 | 116.5 | 170.4 | -68.5 | -175.6 | 85.7 | 175.8 | 5.8 | 108.4 | N130 | N130-R132 PolarHBondContact O-N 3.42Š| ||
| 133 | L | 93.8 | Very high | 95.6 | Very high | 40 Ų | 40 | 85.3 Ų | 85.3 | 21% | 0.209 | 42% | 0.417 | C | S | . | . | trans | -124.8 | 149.2 | 177.2 | -69.1 | 173.1 | 0 | 0 | 0 | 110.3 | L126 Q131 I138 | L126-L133 HydrophobicContact CD1-CD1 3.44Å; L126-L133 VanDerWaalsContact CD1-CD1 3.44Å; L126-L133 HydrophobicContact CD2-CD1 4.36Å; Q131-L133 HydrophobicContact CB-CG 4.5Å; Q131-L133 HydrophobicContact CG-CD2 4.11Å; Q131-L133 HydrophobicContact CG-CG 4.05Å; Q131-L133 PolarHBondContact O-N 2.74Å; L133-I138 HydrophobicContact CB-CD1 4.36Å; L133-I138 HydrophobicContact CB-CG1 3.88Å | ||
| 134 | P | 97.2 | Very high | 95.7 | Very high | 63 Ų | 63 | 82.4 Ų | 82.4 | 41% | 0.409 | 41% | 0.411 | S | S | . | . | trans | -67.1 | 147.5 | 172.5 | 29.3 | -33.1 | 0 | 0 | 0 | 110.3 | V136 E137 I138 | P134-V136 HydrophobicContact CB-CG1 4.38Å; P134-V136 PolarHBondContact O-N 3.34Å; P134-V136 VanDerWaalsContact O-N 3.12Å; P134-E137 WeakPolarHBondContact CD-OE2 3.41Å; P134-E137 HydrophobicContact CG-CB 3.83Å; P134-E137 HydrophobicContact CG-CG 3.62Å; P134-E137 PolarHBondContact O-N 3.46Å; P134-I138 PolarHBondContact O-N 3.44Å | ||
| 135 | K | 97.6 | Very high | 95.7 | Very high | 92 Ų | 92 | 82.6 Ų | 82.6 | 40% | 0.4 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -53.8 | -37.9 | -176.9 | -71.5 | -173.4 | 174.5 | -172.8 | 0 | 112.7 | N115 F118 E137 I138 L139 | N115-K135 WeakPolarHBondContact OD1-CE 3.47Å; N115-K135 PolarHBondContact OD1-NZ 3.06Å; F118-K135 HydrophobicContact CD1-CB 4.35Å; F118-K135 HydrophobicContact CD1-CG 4.15Å; F118-K135 HydrophobicContact CD2-CD 4.2Å; F118-K135 HydrophobicContact CD2-CG 4.49Å; F118-K135 HydrophobicContact CE1-CB 3.71Å; F118-K135 HydrophobicContact CE1-CD 4.39Å; F118-K135 HydrophobicContact CE1-CG 3.93Å; F118-K135 HydrophobicContact CE2-CD 3.87Å; F118-K135 HydrophobicContact CE2-CG 4.3Å; F118-K135 HydrophobicContact CG-CG 4.43Å; F118-K135 HydrophobicContact CZ-CB 3.85Å; F118-K135 HydrophobicContact CZ-CD 3.98Å; F118-K135 HydrophobicContact CZ-CG 4.02Å; K135-E137 PolarHBondContact O-N 2.83Å; K135-I138 PolarHBondContact O-N 2.76Å; K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.17Å |
| 136 | V | 98.3 | Very high | 95.8 | Very high | 73 Ų | 73 | 86.4 Ų | 86.4 | 44% | 0.442 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -65.3 | -36.4 | 179.2 | 69.7 | 0 | 0 | 0 | 0 | 112.6 | P134 L139 R140 | P134-V136 HydrophobicContact CB-CG1 4.38Å; P134-V136 PolarHBondContact O-N 3.34Å; P134-V136 VanDerWaalsContact O-N 3.12Å; V136-L139 PolarHBondContact O-N 3.25Å; V136-R140 WeakPolarHBondContact O-CG 2.94Å; V136-R140 PolarHBondContact O-N 3.23Å; V136-R140 VanDerWaalsContact O-N 3.09Å |
| 137 | E | 97.5 | Very high | 96 | Very high | 82 Ų | 82 | 90.4 Ų | 90.4 | 38% | 0.383 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -72.7 | -39.2 | 178.1 | -75.8 | 177.3 | -158.8 | 0 | 0 | 111.7 | P134 K135 L139 R140 S141 | P134-E137 WeakPolarHBondContact CD-OE2 3.41Å; P134-E137 HydrophobicContact CG-CB 3.83Å; P134-E137 HydrophobicContact CG-CG 3.62Å; P134-E137 PolarHBondContact O-N 3.46Å; K135-E137 PolarHBondContact O-N 2.83Å; E137-L139 PolarHBondContact O-N 2.96Å; E137-R140 PolarHBondContact O-N 3.36Å; E137-R140 VanDerWaalsContact O-N 3.09Å; E137-S141 PolarHBondContact O-N 3.22Å; E137-S141 PolarHBondContact O-OG 3.41Å |
| 138 | I | 97.6 | Very high | 96.4 | Very high | 6 Ų | 6 | 90.7 Ų | 90.7 | 3% | 0.031 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -55.7 | -42.5 | 173.7 | -59 | 167.5 | 0 | 0 | 0 | 110.2 | F118 L121 K122 L133 P134 K135 A142 | F118-I138 HydrophobicContact CD1-CB 4.2Å; F118-I138 HydrophobicContact CD1-CD1 3.97Å; F118-I138 HydrophobicContact CD1-CG2 4.05Å; F118-I138 HydrophobicContact CE1-CB 4.42Å; L121-I138 HydrophobicContact CB-CG2 4.46Å; L121-I138 HydrophobicContact CD2-CG2 3.89Å; L121-I138 HydrophobicContact CG-CG2 4.05Å; K122-I138 HydrophobicContact CD-CD1 3.71Å; K122-I138 HydrophobicContact CD-CG1 4.24Å; K122-I138 HydrophobicContact CG-CD1 3.7Å; K122-I138 HydrophobicContact CG-CG1 3.91Å; K122-I138 HydrophobicContact CG-CG2 3.85Å; L133-I138 HydrophobicContact CB-CD1 4.36Å; L133-I138 HydrophobicContact CB-CG1 3.88Å; P134-I138 PolarHBondContact O-N 3.44Å; K135-I138 PolarHBondContact O-N 2.76Å; I138-A142 WeakPolarHBondContact O-CB 3.27Å; I138-A142 PolarHBondContact O-N 3.5Å |
| 139 | L | 98.5 | Very high | 96.7 | Very high | 83 Ų | 83 | 89 Ų | 89 | 44% | 0.435 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -65.4 | -43.3 | 176.7 | -64.7 | 175.1 | 0 | 0 | 0 | 112.4 | F118 L121 K135 V136 E137 A142 I143 | F118-L139 HydrophobicContact CE1-CD2 4.01Å; F118-L139 HydrophobicContact CE1-CG 4.02Å; F118-L139 HydrophobicContact CZ-CD1 4.4Å; F118-L139 HydrophobicContact CZ-CD2 4.18Å; F118-L139 HydrophobicContact CZ-CG 4.29Å; L121-L139 HydrophobicContact CD2-CD2 4.16Å; K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.17Å; V136-L139 PolarHBondContact O-N 3.25Å; E137-L139 PolarHBondContact O-N 2.96Å; L139-A142 WeakPolarHBondContact O-CB 3.45Å; L139-A142 PolarHBondContact O-N 2.9Å; L139-I143 WeakPolarHBondContact O-CG1 3.44Å; L139-I143 PolarHBondContact O-N 3.26Å; L139-I143 VanDerWaalsContact O-N 3.13Å |
| 140 | R | 98.2 | Very high | 97.1 | Very high | 135 Ų | 135 | 92.7 Ų | 92.7 | 51% | 0.509 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -62.3 | -44.4 | 176.7 | -70 | -179.8 | -167.4 | 131.7 | -1.8 | 111.9 | V136 E137 A142 I143 Q144 | V136-R140 WeakPolarHBondContact O-CG 2.94Å; V136-R140 PolarHBondContact O-N 3.23Å; V136-R140 VanDerWaalsContact O-N 3.09Å; E137-R140 PolarHBondContact O-N 3.36Å; E137-R140 VanDerWaalsContact O-N 3.09Å; R140-A142 VanDerWaalsContact C-N 3.29Å; R140-A142 PolarHBondContact O-N 3.39Å; R140-I143 PolarHBondContact O-N 2.81Å; R140-Q144 WeakPolarHBondContact O-CG 3.48Å; R140-Q144 PolarHBondContact O-N 2.7Å; R140-Q144 VanDerWaalsContact O-N 3.12Å |
| 141 | S | 97.5 | Very high | 97.4 | Very high | 36 Ų | 36 | 88 Ų | 88 | 25% | 0.252 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -63.8 | -35.8 | 177.4 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | L126 E137 Q144 Y145 | L126-S141 VanDerWaalsContact CD2-CB 3.45Å; E137-S141 PolarHBondContact O-N 3.22Å; E137-S141 PolarHBondContact O-OG 3.41Å; S141-Q144 PolarHBondContact O-N 3.12Å; S141-Y145 WeakPolarHBondContact O-CB 3.2Å; S141-Y145 PolarHBondContact O-N 2.9Å |
| 142 | A | 98.4 | Very high | 97.7 | Very high | 9 Ų | 9 | 87.4 Ų | 87.4 | 7% | 0.074 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L121 T125 I138 L139 R140 Y145 I146 | L121-A142 HydrophobicContact CD1-CB 3.86Å; L121-A142 HydrophobicContact CD2-CB 4.13Å; L121-A142 HydrophobicContact CG-CB 4.22Å; T125-A142 HydrophobicContact CG2-CB 3.79Å; I138-A142 WeakPolarHBondContact O-CB 3.27Å; I138-A142 PolarHBondContact O-N 3.5Å; L139-A142 WeakPolarHBondContact O-CB 3.45Å; L139-A142 PolarHBondContact O-N 2.9Å; R140-A142 VanDerWaalsContact C-N 3.29Å; R140-A142 PolarHBondContact O-N 3.39Å; A142-Y145 PolarHBondContact O-N 3.14Å; A142-I146 WeakPolarHBondContact O-CG1 3.45Å; A142-I146 PolarHBondContact O-N 3.42Å; A142-I146 VanDerWaalsContact O-N 3.08Å |
| 143 | I | 98.4 | Very high | 97.8 | Very high | 97 Ų | 97 | 80.4 Ų | 80.4 | 50% | 0.497 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -59 | -51.1 | 176.6 | -65.6 | 164 | 0 | 0 | 0 | 110.1 | L139 R140 Y145 I146 E147 | L139-I143 WeakPolarHBondContact O-CG1 3.44Å; L139-I143 PolarHBondContact O-N 3.26Å; L139-I143 VanDerWaalsContact O-N 3.13Å; R140-I143 PolarHBondContact O-N 2.81Å; I143-Y145 VanDerWaalsContact C-N 3.26Å; I143-Y145 PolarHBondContact O-N 3.41Å; I143-I146 PolarHBondContact O-N 3.03Å; I143-I146 VanDerWaalsContact O-N 3.17Å; I143-E147 WeakPolarHBondContact O-CG 3.48Å; I143-E147 PolarHBondContact O-N 3.37Å |
| 144 | Q | 98.3 | Very high | 97.9 | Very high | 111 Ų | 111 | 81.6 Ų | 81.6 | 52% | 0.519 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -62.6 | -31.2 | 178.9 | -68 | 174.8 | 17.6 | 0 | 0 | 113.3 | R140 S141 R148 | R140-Q144 WeakPolarHBondContact O-CG 3.48Å; R140-Q144 PolarHBondContact O-N 2.7Å; R140-Q144 VanDerWaalsContact O-N 3.12Å; S141-Q144 PolarHBondContact O-N 3.12Å; Q144-R148 WeakPolarHBondContact O-CB 3.46Å; Q144-R148 VanDerWaalsContact O-CG 3.31Å; Q144-R148 WeakPolarHBondContact O-CG 3.5Å; Q144-R148 PolarHBondContact O-N 2.93Å; Q144-R148 VanDerWaalsContact O-N 3.15Å; Q144-R148 PolarHBondContact O-NE 3.47Å |
| 145 | Y | 98.3 | Very high | 97.8 | Very high | 69 Ų | 69 | 80.6 Ų | 80.6 | 27% | 0.271 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -68.3 | -44.7 | 176.2 | -176.8 | -110.9 | 0 | 0 | 0 | 111.2 | S124 T125 S141 A142 I143 R148 L149 | S124-Y145 WeakPolarHBondContact O-CE1 3.42Å; T125-Y145 HydrophobicContact CG2-CD1 3.98Å; T125-Y145 HydrophobicContact CG2-CG 4.41Å; S141-Y145 WeakPolarHBondContact O-CB 3.2Å; S141-Y145 PolarHBondContact O-N 2.9Å; A142-Y145 PolarHBondContact O-N 3.14Å; I143-Y145 VanDerWaalsContact C-N 3.26Å; I143-Y145 PolarHBondContact O-N 3.41Å; Y145-R148 PolarHBondContact O-N 3.31Å; Y145-L149 HydrophobicContact CD1-CD1 3.9Å; Y145-L149 HydrophobicContact CE1-CD1 3.41Å; Y145-L149 VanDerWaalsContact CE1-CD1 3.41Å; Y145-L149 HydrophobicContact CE1-CG 4.21Å; Y145-L149 HydrophobicContact CE2-CD1 4.4Å; Y145-L149 HydrophobicContact CE2-CD2 4.49Å; Y145-L149 HydrophobicContact CE2-CG 4.38Å; Y145-L149 WeakPolarHBondContact O-CG 3.42Å; Y145-L149 PolarHBondContact O-N 3.33Å |
| 146 | I | 98.3 | Very high | 97.7 | Very high | 90 Ų | 90 | 80.4 Ų | 80.4 | 46% | 0.462 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -60.5 | -48.1 | 176 | -65.4 | 165.5 | 0 | 0 | 0 | 110.5 | A142 I143 R148 L149 Q150 | A142-I146 WeakPolarHBondContact O-CG1 3.45Å; A142-I146 PolarHBondContact O-N 3.42Å; A142-I146 VanDerWaalsContact O-N 3.08Å; I143-I146 PolarHBondContact O-N 3.03Å; I143-I146 VanDerWaalsContact O-N 3.17Å; I146-R148 VanDerWaalsContact C-N 3.32Å; I146-R148 PolarHBondContact O-N 3.47Å; I146-L149 PolarHBondContact O-N 2.96Å; I146-Q150 HydrophobicContact CG2-CG 4.29Å; I146-Q150 WeakPolarHBondContact O-CG 3.48Å; I146-Q150 PolarHBondContact O-N 3.27Å |
| 147 | E | 98.5 | Very high | 97.4 | Very high | 109 Ų | 109 | 81.8 Ų | 81.8 | 51% | 0.509 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -58.4 | -42.4 | 179.3 | -70.5 | 170.6 | 167.5 | 0 | 0 | 112.1 | I143 Q150 A151 | I143-E147 WeakPolarHBondContact O-CG 3.48Å; I143-E147 PolarHBondContact O-N 3.37Å; E147-Q150 PolarHBondContact O-N 3.13Å; E147-A151 PolarHBondContact O-N 3.03Å |
| 148 | R | 98.2 | Very high | 97.1 | Very high | 150 Ų | 150 | 83.6 Ų | 83.6 | 57% | 0.566 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -65 | -41.9 | 176.4 | -75.9 | -174.2 | -64.6 | 144.1 | -6 | 112.6 | Q144 Y145 I146 A151 L152 | Q144-R148 WeakPolarHBondContact O-CB 3.46Å; Q144-R148 VanDerWaalsContact O-CG 3.31Å; Q144-R148 WeakPolarHBondContact O-CG 3.5Å; Q144-R148 PolarHBondContact O-N 2.93Å; Q144-R148 VanDerWaalsContact O-N 3.15Å; Q144-R148 PolarHBondContact O-NE 3.47Å; Y145-R148 PolarHBondContact O-N 3.31Å; I146-R148 VanDerWaalsContact C-N 3.32Å; I146-R148 PolarHBondContact O-N 3.47Å; R148-A151 PolarHBondContact O-N 3.38Å; R148-L152 PolarHBondContact O-N 3.29Å |
| 149 | L | 98.2 | Very high | 96.6 | Very high | 74 Ų | 74 | 88.1 Ų | 88.1 | 39% | 0.387 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -64.7 | -41.1 | 176.3 | -70.9 | -179.9 | 0 | 0 | 0 | 111.5 | Y145 I146 A151 L152 V153 | Y145-L149 HydrophobicContact CD1-CD1 3.9Å; Y145-L149 HydrophobicContact CE1-CD1 3.41Å; Y145-L149 VanDerWaalsContact CE1-CD1 3.41Å; Y145-L149 HydrophobicContact CE1-CG 4.21Å; Y145-L149 HydrophobicContact CE2-CD1 4.4Å; Y145-L149 HydrophobicContact CE2-CD2 4.49Å; Y145-L149 HydrophobicContact CE2-CG 4.38Å; Y145-L149 WeakPolarHBondContact O-CG 3.42Å; Y145-L149 PolarHBondContact O-N 3.33Å; I146-L149 PolarHBondContact O-N 2.96Å; L149-A151 PolarHBondContact O-N 3.11Å; L149-L152 PolarHBondContact O-N 3.08Å; L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 3.46Å |
| 150 | Q | 98.4 | Very high | 95.8 | Very high | 115 Ų | 115 | 89.5 Ų | 89.5 | 54% | 0.537 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -61.3 | -42.8 | 175.5 | -72.9 | 171.8 | -23.7 | 0 | 0 | 111.8 | I146 E147 V153 S154 | I146-Q150 HydrophobicContact CG2-CG 4.29Å; I146-Q150 WeakPolarHBondContact O-CG 3.48Å; I146-Q150 PolarHBondContact O-N 3.27Å; E147-Q150 PolarHBondContact O-N 3.13Å; Q150-V153 PolarHBondContact O-N 2.88Å; Q150-S154 WeakPolarHBondContact O-CB 3.34Å; Q150-S154 PolarHBondContact O-N 2.9Å; Q150-S154 PolarHBondContact O-OG 3.22Å |
| 151 | A | 97.6 | Very high | 94.9 | Very high | 61 Ų | 61 | 86.7 Ų | 86.7 | 50% | 0.504 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112 | E147 R148 L149 S154 S155 | E147-A151 PolarHBondContact O-N 3.03Å; R148-A151 PolarHBondContact O-N 3.38Å; L149-A151 PolarHBondContact O-N 3.11Å; A151-S154 PolarHBondContact O-N 2.74Å; A151-S155 PolarHBondContact O-N 3.4Å |
| 152 | L | 97.8 | Very high | 93.7 | Very high | 96 Ų | 96 | 89.5 Ų | 89.5 | 50% | 0.503 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.8 | -51 | 177.1 | -178.8 | 63.4 | 0 | 0 | 0 | 111.6 | R148 L149 S154 S155 L156 | R148-L152 PolarHBondContact O-N 3.29Å; L149-L152 PolarHBondContact O-N 3.08Å; L152-S154 VanDerWaalsContact C-N 3.29Å; L152-S154 PolarHBondContact O-N 3.41Å; L152-S155 PolarHBondContact O-N 3.49Å; L152-S155 VanDerWaalsContact O-N 3.13Å; L152-S155 PolarHBondContact O-OG 3.34Å; L152-L156 HydrophobicContact CD1-CD1 4.46Å; L152-L156 HydrophobicContact CG-CD1 4.22Å; L152-L156 WeakPolarHBondContact O-CG 3.22Å; L152-L156 PolarHBondContact O-N 3.22Å |
| 153 | V | 97.4 | Very high | 92.1 | Very high | 97 Ų | 97 | 93.1 Ų | 93.1 | 59% | 0.588 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -59.1 | -41.6 | 178 | 172.3 | 0 | 0 | 0 | 0 | 111.2 | L149 Q150 S155 L156 N157 | L149-V153 WeakPolarHBondContact O-CG2 3.4Å; L149-V153 PolarHBondContact O-N 3.46Å; Q150-V153 PolarHBondContact O-N 2.88Å; V153-S155 VanDerWaalsContact C-N 3.32Å; V153-S155 PolarHBondContact O-N 2.95Å; V153-L156 PolarHBondContact O-N 2.95Å; V153-N157 WeakPolarHBondContact O-CB 3.5Å; V153-N157 PolarHBondContact O-N 3.46Å |
| 154 | S | 95.8 | Very high | 90.2 | Very high | 65 Ų | 65 | 90.7 Ų | 90.7 | 46% | 0.455 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.9 | -36.7 | 177.5 | -56.9 | 0 | 0 | 0 | 0 | 112.4 | Q150 A151 L152 Q158 | Q150-S154 WeakPolarHBondContact O-CB 3.34Å; Q150-S154 PolarHBondContact O-N 2.9Å; Q150-S154 PolarHBondContact O-OG 3.22Å; A151-S154 PolarHBondContact O-N 2.74Å; L152-S154 VanDerWaalsContact C-N 3.29Å; L152-S154 PolarHBondContact O-N 3.41Å; S154-Q158 WeakPolarHBondContact O-CG 3.39Å; S154-Q158 PolarHBondContact O-N 3.08Å; S154-Q158 VanDerWaalsContact O-N 3.17Å; S154-Q158 PolarHBondContact O-NE2 3.44Å |
| 155 | S | 95.8 | Very high | 88.1 | Confident | 42 Ų | 42 | 91.8 Ų | 91.8 | 29% | 0.294 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -70.1 | -38.8 | 176.2 | 73.5 | 0 | 0 | 0 | 0 | 112.8 | A151 L152 V153 Q158 Q159 | A151-S155 PolarHBondContact O-N 3.4Å; L152-S155 PolarHBondContact O-N 3.49Å; L152-S155 VanDerWaalsContact O-N 3.13Å; L152-S155 PolarHBondContact O-OG 3.34Å; V153-S155 VanDerWaalsContact C-N 3.32Å; V153-S155 PolarHBondContact O-N 2.95Å; S155-Q158 PolarHBondContact O-N 3.15Å; S155-Q159 WeakPolarHBondContact O-CG 3.26Å; S155-Q159 PolarHBondContact O-N 3.2Å |
| 156 | L | 94.9 | Very high | 86 | Confident | 88 Ų | 88 | 95.1 Ų | 95.1 | 46% | 0.461 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.3 | -42.2 | 177.5 | -71.6 | 169.9 | 0 | 0 | 0 | 111.1 | L152 V153 Q158 Q159 D160 | L152-L156 HydrophobicContact CD1-CD1 4.46Å; L152-L156 HydrophobicContact CG-CD1 4.22Å; L152-L156 WeakPolarHBondContact O-CG 3.22Å; L152-L156 PolarHBondContact O-N 3.22Å; V153-L156 PolarHBondContact O-N 2.95Å; L156-Q158 VanDerWaalsContact C-N 3.33Å; L156-Q158 PolarHBondContact O-N 3.23Å; L156-Q159 WeakPolarHBondContact O-CB 3.33Å; L156-Q159 PolarHBondContact O-N 2.9Å; L156-Q159 VanDerWaalsContact O-N 3.16Å; L156-D160 PolarHBondContact O-N 3.33Å |
| 157 | N | 92.6 | Very high | 83.6 | Confident | 103 Ų | 103 | 93.6 Ų | 93.6 | 55% | 0.551 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.9 | -36.1 | 177.4 | -168.9 | 63.1 | 0 | 0 | 0 | 112.3 | V153 D160 T161 | V153-N157 WeakPolarHBondContact O-CB 3.5Å; V153-N157 PolarHBondContact O-N 3.46Å; N157-D160 PolarHBondContact O-N 3.29Å; N157-T161 WeakPolarHBondContact O-CG2 3.4Å; N157-T161 PolarHBondContact O-N 2.92Å; N157-T161 VanDerWaalsContact O-N 3.09Å; N157-T161 PolarHBondContact O-OG1 3.22Å |
| 158 | Q | 90 | Very high | 81.3 | Confident | 120 Ų | 120 | 95.6 Ų | 95.6 | 56% | 0.561 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -61.6 | -45.8 | 171.2 | -79.8 | 168.6 | 95 | 0 | 0 | 110.9 | S154 S155 L156 D160 T161 E162 | S154-Q158 WeakPolarHBondContact O-CG 3.39Å; S154-Q158 PolarHBondContact O-N 3.08Å; S154-Q158 VanDerWaalsContact O-N 3.17Å; S154-Q158 PolarHBondContact O-NE2 3.44Å; S155-Q158 PolarHBondContact O-N 3.15Å; L156-Q158 VanDerWaalsContact C-N 3.33Å; L156-Q158 PolarHBondContact O-N 3.23Å; Q158-D160 PolarHBondContact O-N 2.97Å; Q158-T161 PolarHBondContact O-N 3.41Å; Q158-T161 VanDerWaalsContact O-N 3.15Å; Q158-T161 PolarHBondContact O-OG1 3.03Å; Q158-E162 WeakPolarHBondContact O-CG 3.04Å; Q158-E162 PolarHBondContact O-N 3.39Å |
| 159 | Q | 86.8 | Confident | 78.8 | Confident | 100 Ų | 100 | 96.2 Ų | 96.2 | 47% | 0.467 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -57.9 | -42.8 | 175 | -74.7 | 178.9 | 49.9 | 0 | 0 | 113.1 | S155 L156 T161 E162 T163 | S155-Q159 WeakPolarHBondContact O-CG 3.26Å; S155-Q159 PolarHBondContact O-N 3.2Å; L156-Q159 WeakPolarHBondContact O-CB 3.33Å; L156-Q159 PolarHBondContact O-N 2.9Å; L156-Q159 VanDerWaalsContact O-N 3.16Å; Q159-T161 VanDerWaalsContact C-N 3.34Å; Q159-T161 PolarHBondContact O-N 3.36Å; Q159-E162 WeakPolarHBondContact CA-OE1 3.15Å; Q159-E162 WeakPolarHBondContact CG-OE1 3.29Å; Q159-E162 PolarHBondContact N-OE1 3.44Å; Q159-E162 VanDerWaalsContact O-CG 3.25Å; Q159-E162 WeakPolarHBondContact O-CG 3.41Å; Q159-E162 PolarHBondContact O-N 3Å; Q159-T163 VanDerWaalsContact O-CB 3.25Å; Q159-T163 WeakPolarHBondContact O-CB 3.33Å; Q159-T163 PolarHBondContact O-N 3.23Å; Q159-T163 PolarHBondContact O-OG1 3.35Å |
| 160 | D | 83.1 | Confident | 76.1 | Confident | 113 Ų | 113 | 103.1 Ų | 103.1 | 60% | 0.604 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.6 | -37.9 | 176.8 | -76.5 | -30.7 | 0 | 0 | 0 | 112.2 | L156 N157 Q158 G164 | L156-D160 PolarHBondContact O-N 3.33Å; N157-D160 PolarHBondContact O-N 3.29Å; Q158-D160 PolarHBondContact O-N 2.97Å; D160-G164 PolarHBondContact O-N 3.01Å |
| 161 | T | 79.1 | Confident | 73.5 | Confident | 75 Ų | 75 | 107.5 Ų | 107.5 | 46% | 0.46 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -69 | -36.1 | 177.1 | 60.2 | 0 | 0 | 0 | 0 | 113.3 | N157 Q158 Q159 Q165 | N157-T161 WeakPolarHBondContact O-CG2 3.4Å; N157-T161 PolarHBondContact O-N 2.92Å; N157-T161 VanDerWaalsContact O-N 3.09Å; N157-T161 PolarHBondContact O-OG1 3.22Å; Q158-T161 PolarHBondContact O-N 3.41Å; Q158-T161 VanDerWaalsContact O-N 3.15Å; Q158-T161 PolarHBondContact O-OG1 3.03Å; Q159-T161 VanDerWaalsContact C-N 3.34Å; Q159-T161 PolarHBondContact O-N 3.36Å; T161-Q165 WeakPolarHBondContact O-CG 3.48Å; T161-Q165 PolarHBondContact O-NE2 3.2Å |
| 162 | E | 71.7 | Confident | 71 | Confident | 96 Ų | 96 | 110.3 Ų | 110.3 | 45% | 0.449 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -79.4 | -32.4 | 177.1 | 64 | -169.4 | 130.2 | 0 | 0 | 112.4 | Q158 Q159 Q166 | Q158-E162 WeakPolarHBondContact O-CG 3.04Å; Q158-E162 PolarHBondContact O-N 3.39Å; Q159-E162 WeakPolarHBondContact CA-OE1 3.15Å; Q159-E162 WeakPolarHBondContact CG-OE1 3.29Å; Q159-E162 PolarHBondContact N-OE1 3.44Å; Q159-E162 VanDerWaalsContact O-CG 3.25Å; Q159-E162 WeakPolarHBondContact O-CG 3.41Å; Q159-E162 PolarHBondContact O-N 3Å; E162-Q166 VanDerWaalsContact O-CG 3.31Å; E162-Q166 WeakPolarHBondContact O-CG 3.41Å; E162-Q166 PolarHBondContact O-N 3.46Å; E162-Q166 PolarHBondContact O-NE2 3.16Å |
| 163 | T | 64.1 | Low | 68.5 | Low | 84 Ų | 84 | 110.7 Ų | 110.7 | 52% | 0.515 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -79.1 | -35.9 | 178.5 | -42 | 0 | 0 | 0 | 0 | 111.5 | Q159 Q165 Q166 G167 | Q159-T163 VanDerWaalsContact O-CB 3.25Å; Q159-T163 WeakPolarHBondContact O-CB 3.33Å; Q159-T163 PolarHBondContact O-N 3.23Å; Q159-T163 PolarHBondContact O-OG1 3.35Å; T163-Q165 VanDerWaalsContact C-N 3.28Å; T163-Q165 PolarHBondContact O-N 2.95Å; T163-Q166 PolarHBondContact O-N 2.72Å; T163-Q166 VanDerWaalsContact O-N 3.15Å; T163-G167 PolarHBondContact O-N 3.03Å |
| 164 | G | 59 | Low | 66.3 | Low | 46 Ų | 46 | 112 Ų | 112 | 47% | 0.474 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -65.1 | -27.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | D160 | D160-G164 PolarHBondContact O-N 3.01Å |
| 165 | Q | 54.8 | Low | 64 | Low | 134 Ų | 134 | 114.5 Ų | 114.5 | 63% | 0.626 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -78.3 | -29.1 | 172.2 | -73.3 | 176.7 | 85.2 | 0 | 0 | 112.6 | T161 T163 | T161-Q165 WeakPolarHBondContact O-CG 3.48Å; T161-Q165 PolarHBondContact O-NE2 3.2Å; T163-Q165 VanDerWaalsContact C-N 3.28Å; T163-Q165 PolarHBondContact O-N 2.95Å |
| 166 | Q | 53.4 | Low | 61.5 | Low | 140 Ų | 140 | 121 Ų | 121 | 65% | 0.654 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -81.8 | -21.6 | 177.3 | -67.7 | 176.5 | 78.4 | 0 | 0 | 113 | E162 T163 | E162-Q166 VanDerWaalsContact O-CG 3.31Å; E162-Q166 WeakPolarHBondContact O-CG 3.41Å; E162-Q166 PolarHBondContact O-N 3.46Å; E162-Q166 PolarHBondContact O-NE2 3.16Å; T163-Q166 PolarHBondContact O-N 2.72Å; T163-Q166 VanDerWaalsContact O-N 3.15Å |
| 167 | G | 47.7 | Very low | 59.6 | Low | 58 Ų | 58 | 121.9 Ų | 121.9 | 60% | 0.598 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.4 | -11.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | T163 | T163-G167 PolarHBondContact O-N 3.03Š|
| 168 | L | 50.5 | Low | 57.2 | Low | 150 Ų | 150 | 128.5 Ų | 128.5 | 79% | 0.785 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.5 | 0.8 | 177.9 | -68.4 | 178.6 | 0 | 0 | 0 | 114.1 | ||
| 169 | H | 45.7 | Very low | 54.7 | Low | 164 Ų | 164 | 129.1 Ų | 129.1 | 76% | 0.759 | 68% | 0.677 | S | S | * | * | trans | -102 | 36 | 174.1 | -69.7 | -74.1 | 0 | 0 | 0 | 113 | R171 | H169-R171 VanDerWaalsContact C-N 3.33Å; H169-R171 PolarHBondContact O-N 2.76Å; H169-R171 VanDerWaalsContact O-N 3.11Å | ||
| 170 | Y | 42.7 | Very low | 52.7 | Low | 218 Ų | 218 | 129.9 Ų | 129.9 | 86% | 0.855 | 69% | 0.694 | S | S | * | * | trans | -76.8 | 94.3 | 155.6 | -145.8 | -89.1 | 0 | 0 | 0 | 108 | P172 | Y170-P172 VanDerWaalsContact O-CD 3.28Å; Y170-P172 WeakPolarHBondContact O-CD 3.42Å; Y170-P172 VanDerWaalsContact O-N 3.14Å | ||
| 171 | R | 43.8 | Very low | 50.6 | Low | 207 Ų | 207 | 130.5 Ų | 130.5 | 78% | 0.781 | 71% | 0.707 | S | S | * | * | trans | -45.1 | 112.9 | 175.2 | 179.9 | 179.1 | -176.3 | 158.2 | 0.3 | 110.7 | H169 T173 | H169-R171 VanDerWaalsContact C-N 3.33Å; H169-R171 PolarHBondContact O-N 2.76Å; H169-R171 VanDerWaalsContact O-N 3.11Å; R171-T173 PolarHBondContact O-N 2.96Å; R171-T173 VanDerWaalsContact O-N 3.15Å | ||
| 172 | P | 45.1 | Very low | 49.2 | Very low | 120 Ų | 120 | 132 Ų | 132 | 78% | 0.779 | 72% | 0.72 | S | S | * | * | trans | -77.2 | 104.2 | 169 | 23.4 | -16.3 | 0 | 0 | 0 | 107.6 | Y170 | Y170-P172 VanDerWaalsContact O-CD 3.28Å; Y170-P172 WeakPolarHBondContact O-CD 3.42Å; Y170-P172 VanDerWaalsContact O-N 3.14Å | ||
| 173 | T | 44.4 | Very low | 47.6 | Very low | 105 Ų | 105 | 133 Ų | 133 | 64% | 0.644 | 74% | 0.738 | S | S | * | * | trans | -70.9 | 123.9 | 165.4 | 42 | 0 | 0 | 0 | 0 | 109 | R171 T175 | R171-T173 PolarHBondContact O-N 2.96Å; R171-T173 VanDerWaalsContact O-N 3.15Å; T173-T175 PolarHBondContact O-N 3.24Å | ||
| 174 | P | 52.4 | Low | 47 | Very low | 123 Ų | 123 | 137.4 Ų | 137.4 | 80% | 0.799 | 75% | 0.753 | S | S | * | * | trans | -92.1 | 90.1 | -177.2 | 34.8 | -29.3 | 0 | 0 | 0 | 109.6 | ||||
| 175 | T | 47 | Very low | 46.6 | Very low | 118 Ų | 118 | 140.8 Ų | 140.8 | 72% | 0.724 | 77% | 0.767 | S | S | * | * | trans | -155.6 | 109 | 162.7 | 37 | 0 | 0 | 0 | 0 | 113 | T173 | T173-T175 PolarHBondContact O-N 3.24Š| ||
| 176 | Q | 42.4 | Very low | 45.8 | Very low | 179 Ų | 179 | 140.3 Ų | 140.3 | 84% | 0.836 | 78% | 0.778 | S | S | * | * | trans | 100.5 | 143.8 | 141.7 | -59.8 | -64.8 | -22.1 | 0 | 0 | 120.5 | ||||
| 177 | P | 56.2 | Low | 45.8 | Very low | 107 Ų | 107 | 139.5 Ų | 139.5 | 70% | 0.695 | 79% | 0.787 | S | S | * | * | trans | -100.5 | 174.1 | -167.5 | 41.1 | -35 | 0 | 0 | 0 | 113.8 | ||||
| 178 | R | 42 | Very low | 45.7 | Very low | 242 Ų | 242 | 140.2 Ų | 140.2 | 91% | 0.913 | 80% | 0.795 | S | S | * | * | trans | 85.3 | 123.3 | 166.9 | -165.4 | -173.6 | -83.3 | -117.8 | 1.9 | 112.3 | ||||
| 179 | V | 36.9 | Very low | 45.4 | Very low | 132 Ų | 132 | 138.4 Ų | 138.4 | 80% | 0.8 | 80% | 0.795 | S | S | * | * | -158.7 | 145.4 | 50.9 | 40.6 | 0 | 0 | 0 | 0 | 109.7 | |||||
| 180 | S | 45.7 | Very low | 45.7 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 82% | 0.818 | 80% | 0.799 | S | S | * | * | trans | -51.5 | 141.8 | 171.5 | -46.4 | 0 | 0 | 0 | 0 | 114 | ||||
| 181 | S | 38.7 | Very low | 45.7 | Very low | 125 Ų | 125 | 131.8 Ų | 131.8 | 87% | 0.874 | 79% | 0.792 | S | S | * | * | trans | -142.5 | 122.4 | 146 | -151.4 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 182 | S | 48.5 | Very low | 45.6 | Very low | 107 Ų | 107 | 128 Ų | 128 | 75% | 0.748 | 80% | 0.796 | S | S | * | * | trans | -59 | 136.5 | 173.4 | 146.8 | 0 | 0 | 0 | 0 | 112 | ||||
| 183 | S | 39.6 | Very low | 45.6 | Very low | 118 Ų | 118 | 128.1 Ų | 128.1 | 83% | 0.825 | 80% | 0.8 | S | S | * | * | -174 | 139.5 | 129 | 28.4 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 184 | E | 50 | Low | 45.4 | Very low | 176 Ų | 176 | 127.2 Ų | 127.2 | 82% | 0.822 | 80% | 0.798 | S | S | * | * | trans | -55.4 | 162.1 | -172.6 | -68.6 | -91.6 | 100.6 | 0 | 0 | 116.3 | S186 | E184-S186 PolarHBondContact O-N 2.99Š| ||
| 185 | P | 51.9 | Low | 45.3 | Very low | 117 Ų | 117 | 125.5 Ų | 125.5 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | trans | -81 | 112.8 | 178.1 | 32.7 | -31.2 | 0 | 0 | 0 | 110.9 | ||||
| 186 | S | 37.9 | Very low | 45.4 | Very low | 123 Ų | 123 | 129.2 Ų | 129.2 | 86% | 0.86 | 80% | 0.796 | S | S | * | * | trans | -95.7 | 105.2 | 167.3 | -163.6 | 0 | 0 | 0 | 0 | 109.8 | E184 G188 | E184-S186 PolarHBondContact O-N 2.99Å; S186-G188 PolarHBondContact O-N 3.15Å | ||
| 187 | S | 53.5 | Low | 45.9 | Very low | 123 Ų | 123 | 130.4 Ų | 130.4 | 86% | 0.86 | 79% | 0.793 | S | S | * | * | trans | -51.5 | 125.6 | 161.4 | -74 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 188 | G | 45.1 | Very low | 45.4 | Very low | 74 Ų | 74 | 128.6 Ų | 128.6 | 76% | 0.763 | 78% | 0.783 | S | S | * | * | trans | 174.5 | 52.2 | 176 | 0 | 0 | 0 | 0 | 0 | 113.5 | S186 | S186-G188 PolarHBondContact O-N 3.15Š| ||
| 189 | S | 44.1 | Very low | 45.2 | Very low | 112 Ų | 112 | 122.7 Ų | 122.7 | 78% | 0.783 | 78% | 0.778 | S | S | * | * | trans | -97.6 | 89.2 | 167.3 | 174.7 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 190 | T | 52.2 | Low | 45.6 | Very low | 138 Ų | 138 | 122.2 Ų | 122.2 | 85% | 0.847 | 78% | 0.776 | S | S | * | * | trans | -97.3 | 96.5 | 157.3 | 44.1 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 191 | C | 42.4 | Very low | 45.6 | Very low | 105 Ų | 105 | 122.5 Ų | 122.5 | 71% | 0.709 | 78% | 0.775 | S | S | * | * | trans | -158.1 | 51.6 | 153.2 | 61.2 | 0 | 0 | 0 | 0 | 112.2 | S193 | C191-S193 VanDerWaalsContact C-N 3.34Å; C191-S193 PolarHBondContact O-N 3.31Å | ||
| 192 | C | 41.5 | Very low | 45.5 | Very low | 126 Ų | 126 | 125.5 Ų | 125.5 | 85% | 0.851 | 78% | 0.775 | S | S | * | * | trans | -84.5 | 82 | 158.5 | -67.7 | 0 | 0 | 0 | 0 | 108.6 | S194 | C192-S194 VanDerWaalsContact C-N 3.26Å; C192-S194 PolarHBondContact O-N 2.98Å | ||
| 193 | S | 46.2 | Very low | 44.9 | Very low | 124 Ų | 124 | 129.4 Ų | 129.4 | 87% | 0.867 | 78% | 0.782 | S | S | * | * | trans | -86.2 | 76.4 | 159.5 | -69.8 | 0 | 0 | 0 | 0 | 108.4 | C191 | C191-S193 VanDerWaalsContact C-N 3.34Å; C191-S193 PolarHBondContact O-N 3.31Å | ||
| 194 | S | 40.2 | Very low | 44.6 | Very low | 86 Ų | 86 | 129.9 Ų | 129.9 | 60% | 0.601 | 78% | 0.784 | S | S | * | * | trans | -94.4 | 133.1 | 166.4 | -71.8 | 0 | 0 | 0 | 0 | 108.9 | C192 | C192-S194 VanDerWaalsContact C-N 3.26Å; C192-S194 PolarHBondContact O-N 2.98Å | ||
| 195 | P | 50.1 | Low | 44.2 | Very low | 86 Ų | 86 | 127.2 Ų | 127.2 | 56% | 0.558 | 78% | 0.782 | S | S | * | * | trans | -60.5 | 148 | 177.1 | -20.9 | 31.9 | 0 | 0 | 0 | 112.3 | W197 S198 | P195-W197 PolarHBondContact O-N 2.76Å; P195-S198 PolarHBondContact O-N 3.03Å | ||
| 196 | E | 48.7 | Very low | 44 | Very low | 196 Ų | 196 | 127.5 Ų | 127.5 | 92% | 0.916 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -56.8 | 9.7 | -170 | -169.2 | 163.5 | 75.3 | 0 | 0 | 117.6 | ||
| 197 | W | 52.2 | Low | 43.7 | Very low | 204 Ų | 204 | 127.5 Ų | 127.5 | 77% | 0.773 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -2.7 | 175.7 | 63.5 | -86.4 | 0 | 0 | 0 | 114.1 | P195 S199 | P195-W197 PolarHBondContact O-N 2.76Å; W197-S199 PolarHBondContact O-N 2.82Å |
| 198 | S | 45.2 | Very low | 43.1 | Very low | 70 Ų | 70 | 131.4 Ų | 131.4 | 49% | 0.49 | 78% | 0.781 | S | S | . | * | trans | -89.1 | 12.1 | -177.1 | -58.8 | 0 | 0 | 0 | 0 | 115.5 | P195 | P195-S198 PolarHBondContact O-N 3.03Š| ||
| 199 | S | 37.7 | Very low | 42.6 | Very low | 117 Ų | 117 | 132.3 Ų | 132.3 | 82% | 0.818 | 78% | 0.775 | S | S | * | * | trans | -102.8 | 84.8 | 172.1 | -64.5 | 0 | 0 | 0 | 0 | 110.4 | W197 | W197-S199 PolarHBondContact O-N 2.82Š| ||
| 200 | T | 46.1 | Very low | 42.4 | Very low | 123 Ų | 123 | 131.7 Ų | 131.7 | 76% | 0.755 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -101.6 | 128.9 | 159.2 | 49 | 0 | 0 | 0 | 0 | 108.4 | ||
| 201 | P | 45.1 | Very low | 41.8 | Very low | 123 Ų | 123 | 130.1 Ų | 130.1 | 80% | 0.799 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 145.8 | -178.7 | 29.3 | -32.6 | 0 | 0 | 0 | 110.8 | Q203 | P201-Q203 PolarHBondContact O-N 3.37Š|
| 202 | E | 38.3 | Very low | 41.5 | Very low | 187 Ų | 187 | 132.4 Ų | 132.4 | 87% | 0.874 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -53.4 | 123.5 | 176.6 | -60.3 | -153.4 | 120.9 | 0 | 0 | 112.8 | ||
| 203 | Q | 35.2 | Very low | 41.3 | Very low | 190 Ų | 190 | 133.4 Ų | 133.4 | 89% | 0.888 | 77% | 0.773 | S | S | * | * | trans | -174.5 | 85.8 | 137.5 | -99.5 | 158.9 | 66.1 | 0 | 0 | 108.4 | P201 | P201-Q203 PolarHBondContact O-N 3.37Š| ||
| 204 | C | 33.3 | Very low | 41.1 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 87% | 0.865 | 77% | 0.773 | S | S | * | * | trans | -120.8 | 120.8 | 159.9 | -83.4 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 205 | P | 42.4 | Very low | 41 | Very low | 120 Ų | 120 | 136.9 Ų | 136.9 | 78% | 0.779 | 78% | 0.784 | S | S | * | * | trans | -71.2 | 155.4 | 163.7 | 30.1 | -30.4 | 0 | 0 | 0 | 109.9 | ||||
| 206 | P | 45.9 | Very low | 40.5 | Very low | 122 Ų | 122 | 137.5 Ų | 137.5 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | trans | -70.2 | 135.5 | -160.5 | 26.6 | -33.6 | 0 | 0 | 0 | 113.1 | Y208 | P206-Y208 PolarHBondContact O-N 2.89Š| ||
| 207 | S | 33.2 | Very low | 40.5 | Very low | 124 Ų | 124 | 133.5 Ų | 133.5 | 87% | 0.867 | 80% | 0.796 | S | S | * | * | trans | -64.1 | 106.8 | 165.7 | 174.2 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 208 | Y | 40.1 | Very low | 40.3 | Very low | 204 Ų | 204 | 130.5 Ų | 130.5 | 80% | 0.8 | 79% | 0.791 | S | S | * | * | trans | -87.3 | 142.3 | 161.4 | 84.1 | -93.3 | 0 | 0 | 0 | 109.7 | P206 | P206-Y208 PolarHBondContact O-N 2.89Š| ||
| 209 | S | 33.8 | Very low | 40.5 | Very low | 93 Ų | 93 | 130.5 Ų | 130.5 | 65% | 0.65 | 79% | 0.791 | S | S | * | * | trans | -40.5 | 141.2 | -178.5 | 48.9 | 0 | 0 | 0 | 0 | 116.1 | S211 | S209-S211 PolarHBondContact O-N 3.31Š| ||
| 210 | A | 40.7 | Very low | 41.3 | Very low | 99 Ų | 99 | 130.8 Ų | 130.8 | 82% | 0.818 | 79% | 0.79 | S | S | * | * | trans | -54.5 | 118.1 | 161.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 211 | S | 38.6 | Very low | 41.7 | Very low | 106 Ų | 106 | 131.8 Ų | 131.8 | 74% | 0.741 | 79% | 0.786 | S | S | * | * | trans | -168.9 | 114.5 | 145.2 | -75.6 | 0 | 0 | 0 | 0 | 109.3 | S209 | S209-S211 PolarHBondContact O-N 3.31Š| ||
| 212 | D | 36.5 | Very low | 42.3 | Very low | 153 Ų | 153 | 131 Ų | 131 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | 74.7 | 140 | 139.5 | -111 | -28.2 | 0 | 0 | 0 | 121.3 | ||||
| 213 | L | 36.9 | Very low | 43.6 | Very low | 147 Ų | 147 | 124.6 Ų | 124.6 | 77% | 0.77 | 76% | 0.756 | S | S | * | * | trans | 93.1 | 96.3 | 161.4 | -46.6 | -176.9 | 0 | 0 | 0 | 119.7 | ||||
| 214 | L | 43.2 | Very low | 45.3 | Very low | 163 Ų | 163 | 120.3 Ų | 120.3 | 85% | 0.853 | 74% | 0.739 | S | S | * | * | trans | 7.6 | 116.6 | 130.2 | -58.9 | 167.8 | 0 | 0 | 0 | 116.5 | ||||
| 215 | S | 37.2 | Very low | 47.2 | Very low | 120 Ų | 120 | 119.9 Ų | 119.9 | 84% | 0.839 | 73% | 0.726 | S | S | * | * | trans | 175.5 | 137.4 | 131.8 | -82.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 216 | A | 40.6 | Very low | 48.8 | Very low | 98 Ų | 98 | 120.8 Ų | 120.8 | 81% | 0.81 | 72% | 0.719 | S | S | * | * | trans | 53.8 | 108.7 | 155.3 | 0 | 0 | 0 | 0 | 0 | 119 | E218 | A216-E218 PolarHBondContact O-N 2.75Š| ||
| 217 | A | 48.3 | Very low | 50.3 | Low | 112 Ų | 112 | 117.4 Ų | 117.4 | 93% | 0.926 | 70% | 0.702 | S | S | * | * | trans | -58 | 115.2 | 160.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 218 | E | 47.4 | Very low | 52.5 | Low | 142 Ų | 142 | 115.8 Ų | 115.8 | 66% | 0.664 | 68% | 0.683 | S | S | * | * | trans | -110.4 | 120.4 | 158.4 | -149.9 | -179.7 | 129.2 | 0 | 0 | 108.5 | A216 Q222 | A216-E218 PolarHBondContact O-N 2.75Å; E218-Q222 PolarHBondContact OE1-NE2 3.27Å; E218-Q222 PolarHBondContact OE1-OE1 2.94Å | ||
| 219 | S | 50.8 | Low | 54.5 | Low | 69 Ų | 69 | 109.9 Ų | 109.9 | 48% | 0.483 | 67% | 0.668 | S | S | . | * | trans | -71.1 | 141 | -174.2 | -177.6 | 0 | 0 | 0 | 0 | 110.8 | E221 Q222 | S219-E221 PolarHBondContact O-N 3.48Å; S219-Q222 PolarHBondContact O-N 3.05Å | ||
| 220 | P | 53.9 | Low | 56.8 | Low | 123 Ų | 123 | 109 Ų | 109 | 80% | 0.799 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.1 | -1 | -178.4 | 26.3 | -35.1 | 0 | 0 | 0 | 115.2 | ||
| 221 | E | 54.6 | Low | 58.9 | Low | 145 Ų | 145 | 108.8 Ų | 108.8 | 68% | 0.678 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -74.9 | -22.5 | 175.8 | -68.6 | -164.3 | 124.5 | 0 | 0 | 113.6 | S219 N224 M225 | S219-E221 PolarHBondContact O-N 3.48Å; E221-N224 PolarHBondContact O-N 3.05Å; E221-M225 WeakPolarHBondContact O-CG 3.25Å; E221-M225 PolarHBondContact O-N 3.09Å |
| 222 | Q | 57.6 | Low | 61.1 | Low | 107 Ų | 107 | 107.8 Ų | 107.8 | 50% | 0.5 | 64% | 0.636 | S | S | . | * | H | α-helix | trans | -73.3 | -36.4 | -171.9 | -154 | 154.4 | -32.6 | 0 | 0 | 112.9 | E218 S219 Q226 | E218-Q222 PolarHBondContact OE1-NE2 3.27Å; E218-Q222 PolarHBondContact OE1-OE1 2.94Å; S219-Q222 PolarHBondContact O-N 3.05Å; Q222-Q226 PolarHBondContact O-N 2.91Å |
| 223 | G | 65.1 | Low | 63.2 | Low | 52 Ų | 52 | 105.6 Ų | 105.6 | 54% | 0.536 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -69.3 | -32.2 | 173.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | A227 | G223-A227 PolarHBondContact O-N 2.82Å |
| 224 | N | 71.9 | Confident | 65 | Low | 99 Ų | 99 | 102.3 Ų | 102.3 | 53% | 0.529 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -68 | -40.8 | 177.2 | -170.3 | 9.1 | 0 | 0 | 0 | 111.4 | E221 Q226 A227 L228 | E221-N224 PolarHBondContact O-N 3.05Å; N224-Q226 VanDerWaalsContact C-N 3.35Å; N224-Q226 PolarHBondContact O-N 3.45Å; N224-A227 PolarHBondContact O-N 3.07Å; N224-L228 WeakPolarHBondContact O-CG 3.48Å; N224-L228 PolarHBondContact O-N 3.47Å |
| 225 | M | 73.5 | Confident | 66.5 | Low | 120 Ų | 120 | 99.9 Ų | 99.9 | 59% | 0.591 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -65.1 | -36.1 | 178.4 | -68.3 | -63.1 | -68.3 | 0 | 0 | 112.9 | E221 T229 | E221-M225 WeakPolarHBondContact O-CG 3.25Å; E221-M225 PolarHBondContact O-N 3.09Å; M225-T229 PolarHBondContact O-N 3.34Å; M225-T229 VanDerWaalsContact O-N 3.07Å; M225-T229 PolarHBondContact O-OG1 3.25Å |
| 226 | Q | 75.6 | Confident | 68.1 | Low | 138 Ų | 138 | 98.1 Ų | 98.1 | 65% | 0.645 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -69.2 | -38.5 | 175.8 | -69.3 | -174.6 | -4.9 | 0 | 0 | 112.3 | Q222 N224 T229 S230 | Q222-Q226 PolarHBondContact O-N 2.91Å; N224-Q226 VanDerWaalsContact C-N 3.35Å; N224-Q226 PolarHBondContact O-N 3.45Å; Q226-T229 PolarHBondContact O-N 3.46Å; Q226-S230 PolarHBondContact O-N 3.13Å |
| 227 | A | 77.4 | Confident | 69.1 | Low | 51 Ų | 51 | 97.7 Ų | 97.7 | 42% | 0.421 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -63.8 | -42.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | G223 N224 T229 S230 I231 | G223-A227 PolarHBondContact O-N 2.82Å; N224-A227 PolarHBondContact O-N 3.07Å; A227-T229 VanDerWaalsContact C-N 3.33Å; A227-T229 PolarHBondContact O-N 3.11Å; A227-S230 PolarHBondContact O-N 3.17Å; A227-I231 WeakPolarHBondContact O-CG1 3.22Å; A227-I231 PolarHBondContact O-N 2.64Å; A227-I231 VanDerWaalsContact O-N 3.16Å |
| 228 | L | 79.4 | Confident | 69.8 | Low | 91 Ų | 91 | 96.6 Ų | 96.6 | 48% | 0.476 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -64.6 | -37.5 | 175.4 | -66.4 | 175.4 | 0 | 0 | 0 | 112.1 | N224 I231 V232 | N224-L228 WeakPolarHBondContact O-CG 3.48Å; N224-L228 PolarHBondContact O-N 3.47Å; L228-I231 PolarHBondContact O-N 3.26Å; L228-V232 WeakPolarHBondContact O-CG2 3.19Å; L228-V232 PolarHBondContact O-N 3.38Å; L228-V232 VanDerWaalsContact O-N 3.16Å |
| 229 | T | 81.9 | Confident | 70.3 | Confident | 80 Ų | 80 | 97.4 Ų | 97.4 | 49% | 0.491 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -64.8 | -43.3 | 176.7 | -52.3 | 0 | 0 | 0 | 0 | 111.2 | M225 Q226 A227 I231 V232 D233 | M225-T229 PolarHBondContact O-N 3.34Å; M225-T229 VanDerWaalsContact O-N 3.07Å; M225-T229 PolarHBondContact O-OG1 3.25Å; Q226-T229 PolarHBondContact O-N 3.46Å; A227-T229 VanDerWaalsContact C-N 3.33Å; A227-T229 PolarHBondContact O-N 3.11Å; T229-I231 VanDerWaalsContact C-N 3.3Å; T229-I231 PolarHBondContact O-N 3.36Å; T229-V232 PolarHBondContact O-N 2.83Å; T229-D233 PolarHBondContact O-N 3.1Å |
| 230 | S | 81.3 | Confident | 70.5 | Confident | 74 Ų | 74 | 96.7 Ų | 96.7 | 52% | 0.517 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -62.5 | -33.4 | 176 | -176.2 | 0 | 0 | 0 | 0 | 113.4 | Q226 A227 S234 | Q226-S230 PolarHBondContact O-N 3.13Å; A227-S230 PolarHBondContact O-N 3.17Å; S230-S234 PolarHBondContact O-N 2.8Å; S230-S234 PolarHBondContact O-OG 3.23Å |
| 231 | I | 85.4 | Confident | 70.4 | Confident | 94 Ų | 94 | 95.6 Ų | 95.6 | 48% | 0.482 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -70.2 | -43.3 | 177 | -67.4 | 164.3 | 0 | 0 | 0 | 110.6 | A227 L228 T229 S234 I235 | A227-I231 WeakPolarHBondContact O-CG1 3.22Å; A227-I231 PolarHBondContact O-N 2.64Å; A227-I231 VanDerWaalsContact O-N 3.16Å; L228-I231 PolarHBondContact O-N 3.26Å; T229-I231 VanDerWaalsContact C-N 3.3Å; T229-I231 PolarHBondContact O-N 3.36Å; I231-S234 PolarHBondContact O-N 3.09Å; I231-I235 HydrophobicContact CG2-CD1 3.9Å; I231-I235 WeakPolarHBondContact O-CG1 2.96Å; I231-I235 PolarHBondContact O-N 2.04Å; I231-I235 VanDerWaalsContact O-N 3.14Å |
| 232 | V | 84.9 | Confident | 70.2 | Confident | 86 Ų | 86 | 94.1 Ų | 94.1 | 52% | 0.521 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -65.3 | -41.1 | 179.5 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | L228 T229 S234 I235 S236 | L228-V232 WeakPolarHBondContact O-CG2 3.19Å; L228-V232 PolarHBondContact O-N 3.38Å; L228-V232 VanDerWaalsContact O-N 3.16Å; T229-V232 PolarHBondContact O-N 2.83Å; V232-S234 VanDerWaalsContact C-N 3.31Å; V232-S234 PolarHBondContact O-N 3.06Å; V232-I235 PolarHBondContact O-N 3.02Å; V232-S236 WeakPolarHBondContact O-CB 3.05Å; V232-S236 PolarHBondContact O-N 3.19Å; V232-S236 PolarHBondContact O-OG 3.25Å |
| 233 | D | 79.5 | Confident | 69.7 | Low | 107 Ų | 107 | 93.5 Ų | 93.5 | 57% | 0.572 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -63.8 | -37.5 | 175.3 | -83.3 | -19.2 | 0 | 0 | 0 | 112 | T229 I235 S236 A237 | T229-D233 PolarHBondContact O-N 3.1Å; D233-I235 PolarHBondContact O-N 2.98Å; D233-S236 PolarHBondContact O-N 3.1Å; D233-A237 VanDerWaalsContact O-CB 3.3Å; D233-A237 WeakPolarHBondContact O-CB 3.45Å; D233-A237 PolarHBondContact O-N 3.26Å |
| 234 | S | 75.8 | Confident | 68.7 | Low | 77 Ų | 77 | 99.4 Ų | 99.4 | 54% | 0.538 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -65.9 | -37.2 | 177.8 | -58.2 | 0 | 0 | 0 | 0 | 112.6 | S230 I231 V232 | S230-S234 PolarHBondContact O-N 2.8Å; S230-S234 PolarHBondContact O-OG 3.23Å; I231-S234 PolarHBondContact O-N 3.09Å; V232-S234 VanDerWaalsContact C-N 3.31Å; V232-S234 PolarHBondContact O-N 3.06Å |
| 235 | I | 74 | Confident | 67.7 | Low | 112 Ų | 112 | 100.3 Ų | 100.3 | 57% | 0.574 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -72.8 | -42.3 | 177.8 | -62.5 | 162.7 | 0 | 0 | 0 | 110 | I231 V232 D233 A237 S238 | I231-I235 HydrophobicContact CG2-CD1 3.9Å; I231-I235 WeakPolarHBondContact O-CG1 2.96Å; I231-I235 PolarHBondContact O-N 2.04Å; I231-I235 VanDerWaalsContact O-N 3.14Å; V232-I235 PolarHBondContact O-N 3.02Å; D233-I235 PolarHBondContact O-N 2.98Å; I235-A237 VanDerWaalsContact C-N 3.31Å; I235-A237 PolarHBondContact O-N 3.2Å; I235-S238 PolarHBondContact O-N 3.39Å; I235-S238 PolarHBondContact O-OG 3.27Å |
| 236 | S | 72.3 | Confident | 66.8 | Low | 84 Ų | 84 | 100.2 Ų | 100.2 | 59% | 0.587 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -68.7 | -29.7 | -178.8 | -53.5 | 0 | 0 | 0 | 0 | 112.8 | V232 D233 S238 | V232-S236 WeakPolarHBondContact O-CB 3.05Å; V232-S236 PolarHBondContact O-N 3.19Å; V232-S236 PolarHBondContact O-OG 3.25Å; D233-S236 PolarHBondContact O-N 3.1Å; S236-S238 PolarHBondContact O-N 2.83Å |
| 237 | A | 61.1 | Low | 65.6 | Low | 88 Ų | 88 | 101.2 Ų | 101.2 | 73% | 0.727 | 64% | 0.635 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75 | -11 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | D233 I235 | D233-A237 VanDerWaalsContact O-CB 3.3Å; D233-A237 WeakPolarHBondContact O-CB 3.45Å; D233-A237 PolarHBondContact O-N 3.26Å; I235-A237 VanDerWaalsContact C-N 3.31Å; I235-A237 PolarHBondContact O-N 3.2Å |
| 238 | S | 61.5 | Low | 64.1 | Low | 90 Ų | 90 | 105.6 Ų | 105.6 | 63% | 0.629 | 65% | 0.65 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96 | 1.5 | -173.4 | 70.7 | 0 | 0 | 0 | 0 | 115.5 | I235 S236 G240 | I235-S238 PolarHBondContact O-N 3.39Å; I235-S238 PolarHBondContact O-OG 3.27Å; S236-S238 PolarHBondContact O-N 2.83Å; S238-G240 PolarHBondContact O-N 3.16Å |
| 239 | D | 59.4 | Low | 63.1 | Low | 158 Ų | 158 | 107.1 Ų | 107.1 | 85% | 0.845 | 67% | 0.666 | S | S | * | * | trans | -88.4 | 64.2 | 175.7 | -147.7 | 7.8 | 0 | 0 | 0 | 111.3 | ||||
| 240 | G | 53.5 | Low | 61.6 | Low | 55 Ų | 55 | 116.6 Ų | 116.6 | 57% | 0.567 | 70% | 0.7 | S | S | * | * | trans | -94.3 | 110.1 | 168.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | S238 V242 | S238-G240 PolarHBondContact O-N 3.16Å; G240-V242 PolarHBondContact O-N 3.28Å | ||
| 241 | A | 52.8 | Low | 60.6 | Low | 99 Ų | 99 | 118.7 Ų | 118.7 | 82% | 0.818 | 71% | 0.709 | S | S | * | * | trans | -41.5 | 114.3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 242 | V | 50.2 | Low | 59.3 | Low | 115 Ų | 115 | 120 Ų | 120 | 70% | 0.697 | 72% | 0.721 | S | S | * | * | trans | -92.6 | 96.8 | 164.7 | -164.3 | 0 | 0 | 0 | 0 | 107.9 | G240 F244 | G240-V242 PolarHBondContact O-N 3.28Å; V242-F244 HydrophobicContact CB-CE2 4.37Å; V242-F244 HydrophobicContact CG1-CD2 4.15Å; V242-F244 HydrophobicContact CG1-CE2 3.66Å; V242-F244 HydrophobicContact CG1-CZ 4.14Å; V242-F244 PolarHBondContact O-N 3.5Å | ||
| 243 | A | 46.9 | Very low | 57.9 | Low | 94 Ų | 94 | 121.9 Ų | 121.9 | 78% | 0.777 | 73% | 0.732 | S | S | * | * | trans | -76.6 | 115.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 244 | F | 43.7 | Very low | 56.6 | Low | 175 Ų | 175 | 122.8 Ų | 122.8 | 77% | 0.768 | 74% | 0.742 | S | S | * | * | trans | -98.7 | 119.4 | 167.1 | -77.5 | -84 | 0 | 0 | 0 | 109.4 | V242 | V242-F244 HydrophobicContact CB-CE2 4.37Å; V242-F244 HydrophobicContact CG1-CD2 4.15Å; V242-F244 HydrophobicContact CG1-CE2 3.66Å; V242-F244 HydrophobicContact CG1-CZ 4.14Å; V242-F244 PolarHBondContact O-N 3.5Å | ||
| 245 | P | 52.8 | Low | 55.4 | Low | 118 Ų | 118 | 125.6 Ų | 125.6 | 77% | 0.766 | 75% | 0.754 | S | S | * | * | trans | -78.2 | 123.7 | 167.5 | 30 | -29.5 | 0 | 0 | 0 | 109.5 | ||||
| 246 | V | 52.9 | Low | 54.2 | Low | 118 Ų | 118 | 126.5 Ų | 126.5 | 72% | 0.715 | 77% | 0.766 | S | S | * | * | trans | -106.7 | 105.5 | 171.4 | 178.2 | 0 | 0 | 0 | 0 | 107.8 | I248 | V246-I248 HydrophobicContact CG1-CD1 4.26Å; V246-I248 HydrophobicContact CG1-CG1 4.02Å | ||
| 247 | D | 51.8 | Low | 52.9 | Low | 159 Ų | 159 | 129.6 Ų | 129.6 | 85% | 0.85 | 78% | 0.779 | S | S | * | * | trans | -86.9 | 125.9 | 167.2 | -87.7 | -58.8 | 0 | 0 | 0 | 109.7 | ||||
| 248 | I | 44.8 | Very low | 52.3 | Low | 144 Ų | 144 | 132.8 Ų | 132.8 | 74% | 0.738 | 78% | 0.783 | S | S | * | * | trans | -121.4 | 119.9 | 171.9 | -62.7 | 167.4 | 0 | 0 | 0 | 107.4 | V246 | V246-I248 HydrophobicContact CG1-CD1 4.26Å; V246-I248 HydrophobicContact CG1-CG1 4.02Å | ||
| 249 | P | 59.1 | Low | 51.5 | Low | 123 Ų | 123 | 136.3 Ų | 136.3 | 80% | 0.799 | 80% | 0.796 | S | S | * | * | trans | -85.6 | 150.3 | 167.1 | 32.7 | -29.1 | 0 | 0 | 0 | 111.7 | ||||
| 250 | K | 50.3 | Low | 50.8 | Low | 278 Ų | 278 | 134.4 Ų | 134.4 | 100% | 1.209 | 79% | 0.791 | S | S | * | * | trans | -85.7 | 0 | -172.1 | -178 | 168.1 | -180 | 161.7 | 0 | 113.4 |
Retrieved 250 of 250 residues in 49.2 ms
(Link to these results)