| 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 | 28.4 | Very low | 25.3 | Very low | 241 Ų | 241 | 169.1 Ų | 169.1 | 100% | 1.187 | 79% | 0.792 | S | S | * | * | 0 | 88.3 | 0 | -81.9 | -177.1 | 164 | 0 | 0 | 108.2 | |||||
| 2 | N | 26.6 | Very low | 25.2 | Very low | 119 Ų | 119 | 173.6 Ų | 173.6 | 64% | 0.636 | 80% | 0.796 | S | S | * | * | trans | -121.3 | 102.8 | 174.6 | -81.7 | -27.3 | 0 | 0 | 0 | 107.1 | D223 | N2-D223 PolarHBondContact ND2-OD2 3.38Š| ||
| 3 | G | 24.2 | Very low | 25.3 | Very low | 76 Ų | 76 | 166.7 Ų | 166.7 | 78% | 0.784 | 80% | 0.802 | S | S | * | * | trans | -77.5 | 121.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q5 | G3-Q5 PolarHBondContact O-N 2.86Å; G3-Q5 VanDerWaalsContact O-N 3.08Å | ||
| 4 | Y | 23.4 | Very low | 25.3 | Very low | 209 Ų | 209 | 166.4 Ų | 166.4 | 82% | 0.82 | 80% | 0.799 | S | S | * | * | trans | -65 | 106.7 | 166.4 | -75.1 | -87.8 | 0 | 0 | 0 | 109.1 | H6 | Y4-H6 PolarHBondContact O-N 2.83Å; Y4-H6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | Q | 23.7 | Very low | 25.3 | Very low | 157 Ų | 157 | 163.1 Ų | 163.1 | 73% | 0.734 | 79% | 0.793 | S | S | * | * | trans | -72.9 | 100.2 | 165.3 | -81.8 | -175.4 | -17.6 | 0 | 0 | 108.7 | G3 F7 | G3-Q5 PolarHBondContact O-N 2.86Å; G3-Q5 VanDerWaalsContact O-N 3.08Å; Q5-F7 HydrophobicContact CB-CE2 4.29Å; Q5-F7 PolarHBondContact O-N 3.12Å; Q5-F7 VanDerWaalsContact O-N 3.15Å | ||
| 6 | H | 24.1 | Very low | 25.4 | Very low | 175 Ų | 175 | 157.8 Ų | 157.8 | 81% | 0.81 | 78% | 0.784 | S | S | * | * | trans | -67.9 | 105.6 | 164.2 | -73.2 | -77.3 | 0 | 0 | 0 | 109.2 | Y4 K8 | Y4-H6 PolarHBondContact O-N 2.83Å; Y4-H6 VanDerWaalsContact O-N 3.15Å; H6-K8 PolarHBondContact O-N 2.87Å | ||
| 7 | F | 23.3 | Very low | 25.3 | Very low | 179 Ų | 179 | 162.1 Ų | 162.1 | 79% | 0.785 | 79% | 0.789 | S | S | * | * | trans | -73.2 | 91.6 | 167.6 | -78 | -86.4 | 0 | 0 | 0 | 109.6 | Q5 R9 | Q5-F7 HydrophobicContact CB-CE2 4.29Å; Q5-F7 PolarHBondContact O-N 3.12Å; Q5-F7 VanDerWaalsContact O-N 3.15Å; F7-R9 PolarHBondContact O-N 3Å | ||
| 8 | K | 24.9 | Very low | 25.5 | Very low | 176 Ų | 176 | 159.8 Ų | 159.8 | 77% | 0.765 | 77% | 0.774 | S | S | * | * | trans | -73.8 | 101.4 | 161 | -98.4 | -176 | 174.6 | -179.4 | 0 | 108.4 | H6 | H6-K8 PolarHBondContact O-N 2.87Š| ||
| 9 | R | 26.7 | Very low | 25.5 | Very low | 200 Ų | 200 | 156.1 Ų | 156.1 | 76% | 0.755 | 76% | 0.764 | S | S | * | * | trans | -83.6 | 114.8 | 165 | -103.4 | -177.8 | 172.6 | -174.2 | -2.9 | 108.7 | F7 F11 | F7-R9 PolarHBondContact O-N 3Å; R9-F11 PolarHBondContact O-N 2.86Å | ||
| 10 | F | 25.2 | Very low | 25.5 | Very low | 185 Ų | 185 | 153.4 Ų | 153.4 | 81% | 0.811 | 76% | 0.757 | S | S | * | * | trans | -74.7 | 111.6 | 166.6 | -69.9 | -88 | 0 | 0 | 0 | 108.6 | R12 | F10-R12 PolarHBondContact O-N 3.32Š| ||
| 11 | F | 27.9 | Very low | 25.5 | Very low | 143 Ų | 143 | 152.7 Ų | 152.7 | 63% | 0.627 | 76% | 0.756 | S | S | * | * | trans | -78.3 | 109.2 | 163.6 | -78.4 | -85.9 | 0 | 0 | 0 | 108.2 | R9 G13 | R9-F11 PolarHBondContact O-N 2.86Å; F11-G13 PolarHBondContact O-N 3.28Å | ||
| 12 | R | 24.5 | Very low | 25.4 | Very low | 223 Ų | 223 | 147.9 Ų | 147.9 | 84% | 0.842 | 74% | 0.735 | S | S | * | * | trans | -63.6 | 117.9 | 160.1 | -83 | -172.2 | 173 | -168.5 | -0.9 | 106.9 | F10 E14 | F10-R12 PolarHBondContact O-N 3.32Å; R12-E14 PolarHBondContact O-N 3.16Å | ||
| 13 | G | 25.8 | Very low | 25.4 | Very low | 84 Ų | 84 | 145.7 Ų | 145.7 | 87% | 0.866 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | 28.5 | -165.9 | 0 | 0 | 0 | 0 | 0 | 117.9 | F11 | F11-G13 PolarHBondContact O-N 3.28Š|
| 14 | E | 26.1 | Very low | 25.5 | Very low | 163 Ų | 163 | 147 Ų | 147 | 76% | 0.762 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -111.4 | -6.3 | -175.3 | -67.8 | -176.3 | 151.2 | 0 | 0 | 114.3 | R12 | R12-E14 PolarHBondContact O-N 3.16Š|
| 15 | T | 25.2 | Very low | 25.6 | Very low | 117 Ų | 117 | 142.6 Ų | 142.6 | 72% | 0.718 | 72% | 0.719 | S | S | * | * | trans | -106.4 | -2.6 | -168.8 | 46.8 | 0 | 0 | 0 | 0 | 115.9 | R17 | T15-R17 VanDerWaalsContact C-N 3.34Å; T15-R17 PolarHBondContact O-N 3.29Å | ||
| 16 | A | 26 | Very low | 25.5 | Very low | 77 Ų | 77 | 140.8 Ų | 140.8 | 64% | 0.636 | 72% | 0.724 | S | S | * | * | trans | -91.4 | 61.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 17 | R | 24.8 | Very low | 25.6 | Very low | 232 Ų | 232 | 135.9 Ų | 135.9 | 88% | 0.875 | 71% | 0.709 | S | S | * | * | trans | -86.3 | 112.1 | 166.3 | -72.8 | -171.3 | 179.2 | -178.5 | 1.2 | 108.6 | T15 | T15-R17 VanDerWaalsContact C-N 3.34Å; T15-R17 PolarHBondContact O-N 3.29Å | ||
| 18 | F | 27.8 | Very low | 25.5 | Very low | 120 Ų | 120 | 132.1 Ų | 132.1 | 53% | 0.526 | 71% | 0.705 | S | S | . | * | trans | -53.7 | 142.6 | 162 | -77.7 | -92.2 | 0 | 0 | 0 | 108.6 | T20 I48 | F18-T20 PolarHBondContact O-N 3.36Å; F18-I48 HydrophobicContact CE1-CD1 4.35Å | ||
| 19 | P | 26.5 | Very low | 25.5 | Very low | 90 Ų | 90 | 130.6 Ų | 130.6 | 58% | 0.584 | 71% | 0.705 | S | S | * | * | trans | -52.5 | 115.6 | 169.8 | 21 | -29.5 | 0 | 0 | 0 | 107.3 | A23 | P19-A23 HydrophobicContact CB-CB 4.33Š| ||
| 20 | T | 25.5 | Very low | 25.4 | Very low | 102 Ų | 102 | 129 Ų | 129 | 63% | 0.626 | 70% | 0.701 | S | S | * | * | trans | -53 | 142.4 | 172 | 17.5 | 0 | 0 | 0 | 0 | 107.5 | F18 N22 A23 | F18-T20 PolarHBondContact O-N 3.36Å; T20-N22 PolarHBondContact O-N 3.46Å; T20-A23 WeakPolarHBondContact O-CB 3.43Å; T20-A23 PolarHBondContact O-N 3.1Å | ||
| 21 | L | 25.9 | Very low | 25.4 | Very low | 138 Ų | 138 | 128 Ų | 128 | 72% | 0.723 | 69% | 0.693 | S | S | * | * | G | 310 helix | trans | -47.6 | -21.4 | 176.5 | -82 | 145 | 0 | 0 | 0 | 113.3 | A23 L24 | L21-A23 VanDerWaalsContact C-N 3.28Å; L21-A23 PolarHBondContact O-N 3.03Å; L21-L24 HydrophobicContact CD2-CD1 3.89Å; L21-L24 WeakPolarHBondContact O-CB 3.49Å; L21-L24 PolarHBondContact O-N 3Å |
| 22 | N | 26.1 | Very low | 25.4 | Very low | 141 Ų | 141 | 127.6 Ų | 127.6 | 75% | 0.754 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -72.3 | -11.8 | 176 | -56.9 | -3.9 | 0 | 0 | 0 | 114.9 | T20 L24 | T20-N22 PolarHBondContact O-N 3.46Å; N22-L24 VanDerWaalsContact C-N 3.34Å |
| 23 | A | 26 | Very low | 25.5 | Very low | 73 Ų | 73 | 121.6 Ų | 121.6 | 60% | 0.603 | 68% | 0.678 | S | S | * | * | G | 310 helix | trans | -91.8 | 2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | P19 T20 L21 | P19-A23 HydrophobicContact CB-CB 4.33Å; T20-A23 WeakPolarHBondContact O-CB 3.43Å; T20-A23 PolarHBondContact O-N 3.1Å; L21-A23 VanDerWaalsContact C-N 3.28Å; L21-A23 PolarHBondContact O-N 3.03Å |
| 24 | L | 26.6 | Very low | 25.4 | Very low | 103 Ų | 103 | 121.9 Ų | 121.9 | 54% | 0.539 | 66% | 0.66 | S | S | . | * | S | Bend | trans | -80.7 | 136.3 | 168.4 | -66.8 | 165.7 | 0 | 0 | 0 | 108.5 | L21 N22 S26 | L21-L24 HydrophobicContact CD2-CD1 3.89Å; L21-L24 WeakPolarHBondContact O-CB 3.49Å; L21-L24 PolarHBondContact O-N 3Å; N22-L24 VanDerWaalsContact C-N 3.34Å; L24-S26 PolarHBondContact O-N 2.72Å; L24-S26 VanDerWaalsContact O-N 3.14Å |
| 25 | P | 24.7 | Very low | 25.4 | Very low | 116 Ų | 116 | 119 Ų | 119 | 75% | 0.753 | 65% | 0.653 | S | S | * | * | trans | -53.4 | 124.2 | 178.4 | 20 | -30.2 | 0 | 0 | 0 | 109.6 | S27 | P25-S27 VanDerWaalsContact C-N 3.27Å; P25-S27 PolarHBondContact O-N 3.21Å | ||
| 26 | S | 22.8 | Very low | 25.3 | Very low | 119 Ų | 119 | 115.3 Ų | 115.3 | 83% | 0.832 | 64% | 0.635 | S | S | * | * | trans | -65.7 | 86 | 173.8 | 53.7 | 0 | 0 | 0 | 0 | 109 | L24 S28 | L24-S26 PolarHBondContact O-N 2.72Å; L24-S26 VanDerWaalsContact O-N 3.14Å; S26-S28 PolarHBondContact O-N 3.45Å; S26-S28 VanDerWaalsContact O-N 3.09Å | ||
| 27 | S | 25.1 | Very low | 25.2 | Very low | 72 Ų | 72 | 115.6 Ų | 115.6 | 50% | 0.503 | 63% | 0.625 | S | S | . | * | trans | -79.8 | 90.1 | 174.1 | 56.9 | 0 | 0 | 0 | 0 | 108.9 | P25 | P25-S27 VanDerWaalsContact C-N 3.27Å; P25-S27 PolarHBondContact O-N 3.21Å | ||
| 28 | S | 22.4 | Very low | 25.2 | Very low | 101 Ų | 101 | 109.9 Ų | 109.9 | 71% | 0.706 | 61% | 0.612 | S | S | * | * | trans | -60 | 135.7 | 155.6 | 46.4 | 0 | 0 | 0 | 0 | 108.6 | S26 | S26-S28 PolarHBondContact O-N 3.45Å; S26-S28 VanDerWaalsContact O-N 3.09Å | ||
| 29 | N | 23.6 | Very low | 25.1 | Very low | 144 Ų | 144 | 106.4 Ų | 106.4 | 77% | 0.77 | 60% | 0.602 | S | S | * | * | S | Bend | trans | 63.7 | 79.8 | 171.9 | -59.4 | -23.9 | 0 | 0 | 0 | 116.8 | ||
| 30 | Y | 25 | Very low | 25.1 | Very low | 167 Ų | 167 | 105.2 Ų | 105.2 | 66% | 0.655 | 59% | 0.593 | S | S | * | * | trans | -167.9 | 99.3 | 146.9 | -99.7 | -73.2 | 0 | 0 | 0 | 110.1 | D32 H33 | Y30-D32 PolarHBondContact O-N 3.48Å; Y30-H33 WeakPolarHBondContact CB-CD2 3.35Å; Y30-H33 AromaticContact CG-CD2 3.71Å; Y30-H33 PolarHBondContact O-N 2.69Å | ||
| 31 | Y | 25.4 | Very low | 25.1 | Very low | 164 Ų | 164 | 103 Ų | 103 | 64% | 0.643 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.7 | -10.7 | -178.4 | -113.4 | -84.7 | 0 | 0 | 0 | 114.5 | R365 | Y31-R365 PolarHBondContact OH-NE 3.04Å; Y31-R365 PolarHBondContact OH-NH2 3.44Å |
| 32 | D | 28.1 | Very low | 25.1 | Very low | 133 Ų | 133 | 104.9 Ų | 104.9 | 71% | 0.711 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.7 | -19 | 175.9 | -85.8 | -37.7 | 0 | 0 | 0 | 114.2 | Y30 | Y30-D32 PolarHBondContact O-N 3.48Š|
| 33 | H | 26.1 | Very low | 25.2 | Very low | 97 Ų | 97 | 106.8 Ų | 106.8 | 45% | 0.449 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -82.5 | -21.2 | 179.1 | -71.9 | -41.6 | 0 | 0 | 0 | 113 | Y30 A36 N37 | Y30-H33 WeakPolarHBondContact CB-CD2 3.35Å; Y30-H33 AromaticContact CG-CD2 3.71Å; Y30-H33 PolarHBondContact O-N 2.69Å; H33-A36 PolarHBondContact O-N 3.43Å; H33-N37 WeakPolarHBondContact O-CB 3.32Å; H33-N37 VanDerWaalsContact O-CG 3.32Å; H33-N37 PolarHBondContact O-N 3.01Å; H33-N37 PolarHBondContact O-ND2 3Å |
| 34 | D | 24 | Very low | 25.4 | Very low | 91 Ų | 91 | 106.4 Ų | 106.4 | 49% | 0.487 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -67.1 | -36.2 | 175.1 | -76.5 | -26.9 | 0 | 0 | 0 | 112.5 | L38 | D34-L38 VanDerWaalsContact O-CB 3.25Å; D34-L38 WeakPolarHBondContact O-CB 3.22Å; D34-L38 WeakPolarHBondContact O-CD1 3.26Å; D34-L38 WeakPolarHBondContact O-CG 3.46Å; D34-L38 PolarHBondContact O-N 3.39Å |
| 35 | V | 25.2 | Very low | 25.5 | Very low | 102 Ų | 102 | 105.4 Ų | 105.4 | 62% | 0.618 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -71.4 | -40.5 | 175.4 | -177.5 | 0 | 0 | 0 | 0 | 110.5 | S39 | V35-S39 WeakPolarHBondContact O-CB 3.2Å; V35-S39 PolarHBondContact O-N 3.1Å |
| 36 | A | 23.1 | Very low | 25.9 | Very low | 40 Ų | 40 | 104.5 Ų | 104.5 | 33% | 0.331 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | H33 S39 V40 | H33-A36 PolarHBondContact O-N 3.43Å; A36-S39 PolarHBondContact O-N 3.03Å; A36-S39 PolarHBondContact O-OG 3.5Å; A36-V40 WeakPolarHBondContact O-CB 3.31Å; A36-V40 WeakPolarHBondContact O-CG2 3.45Å; A36-V40 PolarHBondContact O-N 3.19Å |
| 37 | N | 25 | Very low | 26.6 | Very low | 83 Ų | 83 | 101.9 Ų | 101.9 | 44% | 0.444 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.8 | -35.5 | 178.4 | -78.2 | -23.3 | 0 | 0 | 0 | 112.7 | H33 V40 C41 | H33-N37 WeakPolarHBondContact O-CB 3.32Å; H33-N37 VanDerWaalsContact O-CG 3.32Å; H33-N37 PolarHBondContact O-N 3.01Å; H33-N37 PolarHBondContact O-ND2 3Å; N37-V40 PolarHBondContact O-N 2.95Å; N37-C41 WeakPolarHBondContact O-CB 3.23Å; N37-C41 PolarHBondContact O-N 2.98Å; N37-C41 PolarHBondContact O-SG 3.39Å; N37-C41 VanDerWaalsContact O-SG 3.36Å |
| 38 | L | 24.7 | Very low | 27.2 | Very low | 112 Ų | 112 | 100.3 Ų | 100.3 | 59% | 0.586 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -67.1 | -37.1 | 170.1 | -82.7 | 161 | 0 | 0 | 0 | 112 | D34 R42 | D34-L38 VanDerWaalsContact O-CB 3.25Å; D34-L38 WeakPolarHBondContact O-CB 3.22Å; D34-L38 WeakPolarHBondContact O-CD1 3.26Å; D34-L38 WeakPolarHBondContact O-CG 3.46Å; D34-L38 PolarHBondContact O-N 3.39Å; L38-R42 VanDerWaalsContact O-CB 3.3Å; L38-R42 WeakPolarHBondContact O-CB 3.47Å; L38-R42 WeakPolarHBondContact O-CG 3.44Å; L38-R42 PolarHBondContact O-N 3.43Å |
| 39 | S | 25.2 | Very low | 27.9 | Very low | 47 Ų | 47 | 97.3 Ų | 97.3 | 33% | 0.329 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.5 | -38.4 | 175.2 | 85.9 | 0 | 0 | 0 | 0 | 111.9 | V35 A36 R42 R43 | V35-S39 WeakPolarHBondContact O-CB 3.2Å; V35-S39 PolarHBondContact O-N 3.1Å; A36-S39 PolarHBondContact O-N 3.03Å; A36-S39 PolarHBondContact O-OG 3.5Å; S39-R42 PolarHBondContact O-N 3.36Å; S39-R43 WeakPolarHBondContact O-CB 3.4Å; S39-R43 VanDerWaalsContact O-CG 3.23Å; S39-R43 WeakPolarHBondContact O-CG 3.38Å; S39-R43 PolarHBondContact O-N 3.02Å |
| 40 | V | 26 | Very low | 28.7 | Very low | 64 Ų | 64 | 93 Ų | 93 | 39% | 0.388 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -71.4 | -44.7 | 177.9 | 169 | 0 | 0 | 0 | 0 | 109.9 | A36 N37 R42 R43 I44 | A36-V40 WeakPolarHBondContact O-CB 3.31Å; A36-V40 WeakPolarHBondContact O-CG2 3.45Å; A36-V40 PolarHBondContact O-N 3.19Å; N37-V40 PolarHBondContact O-N 2.95Å; V40-R42 PolarHBondContact O-N 3.15Å; V40-R43 CarbonylContact O-C 3.46Å; V40-R43 PolarHBondContact O-N 3.46Å; V40-R43 VanDerWaalsContact O-N 3.14Å; V40-I44 HydrophobicContact CG1-CD1 3.55Å; V40-I44 HydrophobicContact CG1-CG1 4.37Å; V40-I44 WeakPolarHBondContact O-CB 3.28Å; V40-I44 WeakPolarHBondContact O-CD1 3.47Å; V40-I44 WeakPolarHBondContact O-CG1 3.36Å; V40-I44 PolarHBondContact O-N 3.14Å |
| 41 | C | 25.3 | Very low | 29.5 | Very low | 55 Ų | 55 | 88.9 Ų | 88.9 | 37% | 0.372 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.6 | -39.6 | 172.6 | -79.1 | 0 | 0 | 0 | 0 | 112.1 | N37 I44 T45 | N37-C41 WeakPolarHBondContact O-CB 3.23Å; N37-C41 PolarHBondContact O-N 2.98Å; N37-C41 PolarHBondContact O-SG 3.39Å; N37-C41 VanDerWaalsContact O-SG 3.36Å; C41-I44 PolarHBondContact O-N 3.34Å; C41-T45 WeakPolarHBondContact O-CB 3.31Å; C41-T45 WeakPolarHBondContact O-CG2 3.43Å; C41-T45 PolarHBondContact O-N 3.36Å; C41-T45 PolarHBondContact O-OG1 2.83Å |
| 42 | R | 27.6 | Very low | 30.3 | Very low | 178 Ų | 178 | 88.9 Ų | 88.9 | 67% | 0.672 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -64.3 | -40.3 | 171.3 | -81.7 | -179.2 | 175.4 | -176.4 | 0.2 | 111.8 | L38 S39 V40 I44 Q46 | L38-R42 VanDerWaalsContact O-CB 3.3Å; L38-R42 WeakPolarHBondContact O-CB 3.47Å; L38-R42 WeakPolarHBondContact O-CG 3.44Å; L38-R42 PolarHBondContact O-N 3.43Å; S39-R42 PolarHBondContact O-N 3.36Å; V40-R42 PolarHBondContact O-N 3.15Å; R42-I44 VanDerWaalsContact C-N 3.35Å; R42-I44 PolarHBondContact O-N 3.44Å; R42-Q46 WeakPolarHBondContact O-CB 3.39Å; R42-Q46 WeakPolarHBondContact O-CG 3.19Å; R42-Q46 PolarHBondContact O-N 3.41Å |
| 43 | R | 27.4 | Very low | 31 | Very low | 182 Ų | 182 | 86.9 Ų | 86.9 | 69% | 0.687 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -67.6 | -30.3 | 175.9 | -78 | 174.1 | -177.2 | -173.7 | 3.6 | 113.4 | S39 V40 P47 | S39-R43 WeakPolarHBondContact O-CB 3.4Å; S39-R43 VanDerWaalsContact O-CG 3.23Å; S39-R43 WeakPolarHBondContact O-CG 3.38Å; S39-R43 PolarHBondContact O-N 3.02Å; V40-R43 CarbonylContact O-C 3.46Å; V40-R43 PolarHBondContact O-N 3.46Å; V40-R43 VanDerWaalsContact O-N 3.14Å; R43-P47 WeakPolarHBondContact O-CD 3.34Å; R43-P47 WeakPolarHBondContact O-CG 3.26Å |
| 44 | I | 29 | Very low | 31.7 | Very low | 64 Ų | 64 | 89.5 Ų | 89.5 | 33% | 0.328 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -83.7 | -37.3 | 179.2 | -67.8 | 164.6 | 0 | 0 | 0 | 111.6 | V40 C41 R42 P47 F127 | V40-I44 HydrophobicContact CG1-CD1 3.55Å; V40-I44 HydrophobicContact CG1-CG1 4.37Å; V40-I44 WeakPolarHBondContact O-CB 3.28Å; V40-I44 WeakPolarHBondContact O-CD1 3.47Å; V40-I44 WeakPolarHBondContact O-CG1 3.36Å; V40-I44 PolarHBondContact O-N 3.14Å; C41-I44 PolarHBondContact O-N 3.34Å; R42-I44 VanDerWaalsContact C-N 3.35Å; R42-I44 PolarHBondContact O-N 3.44Å; I44-P47 WeakPolarHBondContact O-CD 3.43Å; I44-F127 HydrophobicContact CD1-CZ 4.19Å |
| 45 | T | 30.2 | Very low | 32.8 | Very low | 83 Ų | 83 | 93.8 Ų | 93.8 | 51% | 0.509 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -84.3 | -24.3 | -179.2 | 53.9 | 0 | 0 | 0 | 0 | 113.2 | C41 I48 G49 | C41-T45 WeakPolarHBondContact O-CB 3.31Å; C41-T45 WeakPolarHBondContact O-CG2 3.43Å; C41-T45 PolarHBondContact O-N 3.36Å; C41-T45 PolarHBondContact O-OG1 2.83Å; T45-I48 PolarHBondContact O-N 3.15Å; T45-I48 VanDerWaalsContact O-N 3.15Å; T45-G49 PolarHBondContact O-N 3.12Å |
| 46 | Q | 32.6 | Very low | 33.6 | Very low | 96 Ų | 96 | 99.1 Ų | 99.1 | 45% | 0.449 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -55.5 | -50.7 | 174.8 | -91.4 | 178.5 | -7 | 0 | 0 | 112.8 | R42 I48 G49 I50 | R42-Q46 WeakPolarHBondContact O-CB 3.39Å; R42-Q46 WeakPolarHBondContact O-CG 3.19Å; R42-Q46 PolarHBondContact O-N 3.41Å; Q46-I48 VanDerWaalsContact C-N 3.26Å; Q46-I48 PolarHBondContact O-N 3.31Å; Q46-G49 PolarHBondContact O-N 2.84Å; Q46-I50 HydrophobicContact CB-CD1 4.38Å; Q46-I50 WeakPolarHBondContact O-CB 3.34Å; Q46-I50 WeakPolarHBondContact O-CD1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.06Å; Q46-I50 PolarHBondContact O-N 3.21Å |
| 47 | P | 37.4 | Very low | 34.5 | Very low | 65 Ų | 65 | 99.4 Ų | 99.4 | 42% | 0.422 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -55.4 | -41.4 | 174.7 | -24.8 | 31 | 0 | 0 | 0 | 112.5 | R43 I44 M51 | R43-P47 WeakPolarHBondContact O-CD 3.34Å; R43-P47 WeakPolarHBondContact O-CG 3.26Å; I44-P47 WeakPolarHBondContact O-CD 3.43Å; P47-M51 WeakPolarHBondContact O-CB 3.4Å; P47-M51 WeakPolarHBondContact O-CG 3.39Å; P47-M51 PolarHBondContact O-N 3.26Å |
| 48 | I | 38.9 | Very low | 34.9 | Very low | 38 Ų | 38 | 98.5 Ų | 98.5 | 20% | 0.195 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -70.3 | -41.4 | -179.4 | -60.7 | 173.3 | 0 | 0 | 0 | 111.3 | F18 T45 Q46 M51 R52 | F18-I48 HydrophobicContact CE1-CD1 4.35Å; T45-I48 PolarHBondContact O-N 3.15Å; T45-I48 VanDerWaalsContact O-N 3.15Å; Q46-I48 VanDerWaalsContact C-N 3.26Å; Q46-I48 PolarHBondContact O-N 3.31Å; I48-M51 HydrophobicContact CG1-CE 4.18Å; I48-M51 PolarHBondContact O-N 3.43Å; I48-R52 WeakPolarHBondContact O-CB 3.45Å; I48-R52 VanDerWaalsContact O-CG 3.31Å; I48-R52 WeakPolarHBondContact O-CG 3.25Å; I48-R52 PolarHBondContact O-N 2.94Å |
| 49 | G | 36.5 | Very low | 35.4 | Very low | 39 Ų | 39 | 100.7 Ų | 100.7 | 40% | 0.402 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.1 | -42.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | T45 Q46 R52 E53 | T45-G49 PolarHBondContact O-N 3.12Å; Q46-G49 PolarHBondContact O-N 2.84Å; G49-R52 PolarHBondContact O-N 3.38Å; G49-E53 VanDerWaalsContact O-CB 3.29Å; G49-E53 WeakPolarHBondContact O-CB 2.92Å; G49-E53 PolarHBondContact O-N 2.83Å |
| 50 | I | 39.6 | Very low | 36 | Very low | 54 Ų | 54 | 101.8 Ų | 101.8 | 28% | 0.277 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.6 | -44.1 | 175.1 | -67.9 | 159.6 | 0 | 0 | 0 | 110.6 | Q46 E53 W54 V61 T63 | Q46-I50 HydrophobicContact CB-CD1 4.38Å; Q46-I50 WeakPolarHBondContact O-CB 3.34Å; Q46-I50 WeakPolarHBondContact O-CD1 3.28Å; Q46-I50 WeakPolarHBondContact O-CG1 3.06Å; Q46-I50 PolarHBondContact O-N 3.21Å; I50-E53 PolarHBondContact O-N 2.95Å; I50-W54 WeakPolarHBondContact O-CB 3.49Å; I50-W54 PolarHBondContact O-N 3.02Å; I50-V61 HydrophobicContact CG2-CB 4.26Å; I50-T63 HydrophobicContact CD1-CG2 3.25Å; I50-T63 HydrophobicContact CG1-CG2 3.86Å |
| 51 | M | 42.4 | Very low | 36.3 | Very low | 79 Ų | 79 | 101.2 Ų | 101.2 | 39% | 0.389 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.9 | -40 | 177.2 | -74.8 | -174.8 | -51.9 | 0 | 0 | 112.6 | P47 I48 K55 F148 | P47-M51 WeakPolarHBondContact O-CB 3.4Å; P47-M51 WeakPolarHBondContact O-CG 3.39Å; P47-M51 PolarHBondContact O-N 3.26Å; I48-M51 HydrophobicContact CG1-CE 4.18Å; I48-M51 PolarHBondContact O-N 3.43Å; M51-K55 WeakPolarHBondContact O-CB 3.07Å; M51-K55 PolarHBondContact O-N 3.15Å; M51-F148 HydrophobicContact CE-CD2 4.42Å; M51-F148 HydrophobicContact CE-CE2 3.66Å; M51-F148 HydrophobicContact CE-CZ 3.96Å |
| 52 | R | 43 | Very low | 36.7 | Very low | 164 Ų | 164 | 103.1 Ų | 103.1 | 62% | 0.619 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64.6 | -43.8 | 175.6 | -77.5 | 178.5 | -178.4 | -171.6 | 1.2 | 111.7 | I48 G49 K55 R56 | I48-R52 WeakPolarHBondContact O-CB 3.45Å; I48-R52 VanDerWaalsContact O-CG 3.31Å; I48-R52 WeakPolarHBondContact O-CG 3.25Å; I48-R52 PolarHBondContact O-N 2.94Å; G49-R52 PolarHBondContact O-N 3.38Å; R52-K55 PolarHBondContact O-N 2.94Å; R52-R56 WeakPolarHBondContact O-CB 3.32Å; R52-R56 PolarHBondContact O-N 3.35Å |
| 53 | E | 41.1 | Very low | 37.1 | Very low | 91 Ų | 91 | 98.5 Ų | 98.5 | 43% | 0.425 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -74 | -33 | -179.3 | -175.6 | 63.6 | -156.4 | 0 | 0 | 111.7 | G49 I50 R56 S57 V61 | G49-E53 VanDerWaalsContact O-CB 3.29Å; G49-E53 WeakPolarHBondContact O-CB 2.92Å; G49-E53 PolarHBondContact O-N 2.83Å; I50-E53 PolarHBondContact O-N 2.95Å; E53-R56 PolarHBondContact O-N 2.83Å; E53-S57 VanDerWaalsContact O-CB 3.26Å; E53-S57 WeakPolarHBondContact O-CB 3.33Å; E53-S57 PolarHBondContact O-N 2.97Å; E53-S57 PolarHBondContact O-OG 3.33Å; E53-V61 HydrophobicContact CB-CG2 3.67Å; E53-V61 HydrophobicContact CG-CG1 4.48Å; E53-V61 HydrophobicContact CG-CG2 3.49Å; E53-V61 VanDerWaalsContact CG-CG2 3.49Å |
| 54 | W | 41.2 | Very low | 37.2 | Very low | 153 Ų | 153 | 97.1 Ų | 97.1 | 58% | 0.58 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.8 | -45.9 | 167.6 | 179.9 | 71 | 0 | 0 | 0 | 111.6 | I50 R56 S57 G58 | I50-W54 WeakPolarHBondContact O-CB 3.49Å; I50-W54 PolarHBondContact O-N 3.02Å; W54-R56 VanDerWaalsContact C-N 3.3Å; W54-R56 PolarHBondContact O-N 2.88Å; W54-S57 PolarHBondContact O-N 2.8Å; W54-G58 WeakPolarHBondContact O-CA 3.48Å; W54-G58 PolarHBondContact O-N 3.08Å |
| 55 | K | 47.4 | Very low | 37.1 | Very low | 181 Ų | 181 | 98.5 Ų | 98.5 | 79% | 0.787 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -64.6 | -32.9 | 176.9 | -166 | 176.1 | -176.4 | 177.1 | 0 | 112.7 | M51 R52 | M51-K55 WeakPolarHBondContact O-CB 3.07Å; M51-K55 PolarHBondContact O-N 3.15Å; R52-K55 PolarHBondContact O-N 2.94Å |
| 56 | R | 41.7 | Very low | 36.8 | Very low | 213 Ų | 213 | 104.9 Ų | 104.9 | 80% | 0.804 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -76.4 | -43.3 | 177.4 | -173.5 | -175.8 | 175.9 | 109.7 | 1.6 | 112.6 | R52 E53 W54 | R52-R56 WeakPolarHBondContact O-CB 3.32Å; R52-R56 PolarHBondContact O-N 3.35Å; E53-R56 PolarHBondContact O-N 2.83Å; W54-R56 VanDerWaalsContact C-N 3.3Å; W54-R56 PolarHBondContact O-N 2.88Å |
| 57 | S | 42.1 | Very low | 36.4 | Very low | 46 Ų | 46 | 103.4 Ų | 103.4 | 32% | 0.322 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -97.4 | -17.6 | -169.8 | 67 | 0 | 0 | 0 | 0 | 114.1 | E53 W54 K59 | E53-S57 VanDerWaalsContact O-CB 3.26Å; E53-S57 WeakPolarHBondContact O-CB 3.33Å; E53-S57 PolarHBondContact O-N 2.97Å; E53-S57 PolarHBondContact O-OG 3.33Å; W54-S57 PolarHBondContact O-N 2.8Å; S57-K59 PolarHBondContact O-N 3.44Å; S57-K59 VanDerWaalsContact O-N 3.13Å; S57-K59 PolarHBondContact OG-N 3.48Å; S57-K59 VanDerWaalsContact OG-N 3.12Å; S57-K59 PolarHBondContact OG-O 2.75Å |
| 58 | G | 33.3 | Very low | 35.9 | Very low | 65 Ų | 65 | 105 Ų | 105 | 67% | 0.67 | 56% | 0.563 | S | S | * | * | S | Bend | trans | 63.5 | 7.3 | -167.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | W54 | W54-G58 WeakPolarHBondContact O-CA 3.48Å; W54-G58 PolarHBondContact O-N 3.08Å |
| 59 | K | 36.4 | Very low | 35.1 | Very low | 157 Ų | 157 | 110.6 Ų | 110.6 | 68% | 0.683 | 59% | 0.594 | S | S | * | * | S | Bend | trans | -114.1 | 136.2 | -175.1 | -66.9 | 175.2 | -177 | 179.8 | 0 | 109.5 | S57 V61 | S57-K59 PolarHBondContact O-N 3.44Å; S57-K59 VanDerWaalsContact O-N 3.13Å; S57-K59 PolarHBondContact OG-N 3.48Å; S57-K59 VanDerWaalsContact OG-N 3.12Å; S57-K59 PolarHBondContact OG-O 2.75Å; K59-V61 PolarHBondContact O-N 3.04Å; K59-V61 VanDerWaalsContact O-N 3.17Å |
| 60 | A | 36.2 | Very low | 34.6 | Very low | 71 Ų | 71 | 113.7 Ų | 113.7 | 59% | 0.587 | 61% | 0.609 | S | S | * | * | trans | -59.9 | 120.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | S62 | A60-S62 PolarHBondContact O-N 3.03Š| ||
| 61 | V | 33.1 | Very low | 33.9 | Very low | 52 Ų | 52 | 116.2 Ų | 116.2 | 32% | 0.315 | 63% | 0.632 | S | S | . | * | trans | -78.2 | 110.5 | -179.3 | -177.8 | 0 | 0 | 0 | 0 | 107.9 | I50 E53 K59 T63 | I50-V61 HydrophobicContact CG2-CB 4.26Å; E53-V61 HydrophobicContact CB-CG2 3.67Å; E53-V61 HydrophobicContact CG-CG1 4.48Å; E53-V61 HydrophobicContact CG-CG2 3.49Å; E53-V61 VanDerWaalsContact CG-CG2 3.49Å; K59-V61 PolarHBondContact O-N 3.04Å; K59-V61 VanDerWaalsContact O-N 3.17Å; V61-T63 PolarHBondContact O-N 2.98Å | ||
| 62 | S | 33.1 | Very low | 33.2 | Very low | 95 Ų | 95 | 118.9 Ų | 118.9 | 66% | 0.664 | 65% | 0.648 | S | S | * | * | trans | -71.1 | 112.7 | 175.4 | 78 | 0 | 0 | 0 | 0 | 109.2 | A60 K64 | A60-S62 PolarHBondContact O-N 3.03Å; S62-K64 VanDerWaalsContact C-N 3.29Å; S62-K64 PolarHBondContact O-N 3.32Å | ||
| 63 | T | 35.7 | Very low | 32.5 | Very low | 80 Ų | 80 | 117.1 Ų | 117.1 | 49% | 0.491 | 66% | 0.657 | S | S | . | * | trans | -74.1 | 84.7 | 168.1 | 49 | 0 | 0 | 0 | 0 | 109.1 | I50 V61 C65 | I50-T63 HydrophobicContact CD1-CG2 3.25Å; I50-T63 HydrophobicContact CG1-CG2 3.86Å; V61-T63 PolarHBondContact O-N 2.98Å; T63-C65 PolarHBondContact O-N 3.48Å | ||
| 64 | K | 29.6 | Very low | 31.9 | Very low | 154 Ų | 154 | 119.8 Ų | 119.8 | 67% | 0.67 | 67% | 0.674 | S | S | * | * | trans | -69.8 | 87.1 | 155.9 | -76.2 | -172.4 | 179.9 | 179.3 | 0 | 106.9 | S62 Y66 | S62-K64 VanDerWaalsContact C-N 3.29Å; S62-K64 PolarHBondContact O-N 3.32Å; K64-Y66 VanDerWaalsContact C-N 3.34Å; K64-Y66 PolarHBondContact O-N 2.92Å | ||
| 65 | C | 27 | Very low | 31.2 | Very low | 92 Ų | 92 | 118 Ų | 118 | 62% | 0.622 | 69% | 0.685 | S | S | * | * | trans | -65.2 | 99.1 | 165.4 | -67.1 | 0 | 0 | 0 | 0 | 106.8 | T63 G67 | T63-C65 PolarHBondContact O-N 3.48Å; C65-G67 VanDerWaalsContact C-N 3.33Å; C65-G67 PolarHBondContact O-N 3.4Å | ||
| 66 | Y | 25.3 | Very low | 30.2 | Very low | 218 Ų | 218 | 117.6 Ų | 117.6 | 86% | 0.855 | 69% | 0.691 | S | S | * | * | trans | -60.1 | 105.1 | 156.4 | -77.2 | -86 | 0 | 0 | 0 | 106.5 | K64 A68 | K64-Y66 VanDerWaalsContact C-N 3.34Å; K64-Y66 PolarHBondContact O-N 2.92Å; Y66-A68 PolarHBondContact O-N 2.85Å | ||
| 67 | G | 24.2 | Very low | 29.4 | Very low | 64 Ų | 64 | 112.6 Ų | 112.6 | 66% | 0.66 | 69% | 0.688 | S | S | * | * | trans | -60 | 115.1 | 164.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | C65 D69 | C65-G67 VanDerWaalsContact C-N 3.33Å; C65-G67 PolarHBondContact O-N 3.4Å; G67-D69 PolarHBondContact O-N 3.47Å | ||
| 68 | A | 25.4 | Very low | 28.7 | Very low | 99 Ų | 99 | 115 Ų | 115 | 82% | 0.818 | 71% | 0.705 | S | S | * | * | trans | -83.9 | 72.2 | 157.1 | 0 | 0 | 0 | 0 | 0 | 106.7 | Y66 | Y66-A68 PolarHBondContact O-N 2.85Š| ||
| 69 | D | 23.2 | Very low | 28.3 | Very low | 156 Ų | 156 | 121 Ų | 121 | 83% | 0.834 | 71% | 0.713 | S | S | * | * | trans | -79.4 | 109.2 | 154 | -79.2 | -32.5 | 0 | 0 | 0 | 106.3 | G67 | G67-D69 PolarHBondContact O-N 3.47Š| ||
| 70 | S | 25.3 | Very low | 27.9 | Very low | 103 Ų | 103 | 119.2 Ų | 119.2 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | trans | 146.6 | 131.6 | 163.1 | 65.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 71 | S | 26 | Very low | 27.5 | Very low | 107 Ų | 107 | 124 Ų | 124 | 75% | 0.748 | 73% | 0.731 | S | S | * | * | cis | -178.2 | 147.7 | 16.7 | 32.8 | 0 | 0 | 0 | 0 | 108 | ||||
| 72 | D | 27.5 | Very low | 27.2 | Very low | 136 Ų | 136 | 129.3 Ų | 129.3 | 73% | 0.727 | 75% | 0.752 | S | S | * | * | trans | 8.7 | 129 | 165.1 | -78 | -54 | 0 | 0 | 0 | 121.5 | N74 | D72-N74 VanDerWaalsContact C-N 3.25Å; D72-N74 PolarHBondContact O-N 2.93Å | ||
| 73 | P | 27.3 | Very low | 26.8 | Very low | 127 Ų | 127 | 130.1 Ų | 130.1 | 83% | 0.825 | 76% | 0.755 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -80.6 | 12.4 | 175.7 | 30.5 | -27.3 | 0 | 0 | 0 | 115 | ||
| 74 | N | 28.9 | Very low | 26.4 | Very low | 146 Ų | 146 | 132.3 Ų | 132.3 | 78% | 0.781 | 77% | 0.77 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.3 | 8.2 | -166.9 | -87 | -18.2 | 0 | 0 | 0 | 117.5 | D72 L76 | D72-N74 VanDerWaalsContact C-N 3.25Å; D72-N74 PolarHBondContact O-N 2.93Å; N74-L76 PolarHBondContact O-N 2.96Å |
| 75 | S | 27.2 | Very low | 26.2 | Very low | 115 Ų | 115 | 134.3 Ų | 134.3 | 80% | 0.804 | 78% | 0.779 | S | S | * | * | trans | -94.9 | 66.5 | 178.6 | 74.7 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 76 | L | 24.8 | Very low | 26.1 | Very low | 173 Ų | 173 | 141.6 Ų | 141.6 | 91% | 0.906 | 79% | 0.794 | S | S | * | * | trans | -75.7 | 111.3 | 152.1 | -83.9 | 158.9 | 0 | 0 | 0 | 107.1 | N74 | N74-L76 PolarHBondContact O-N 2.96Š| ||
| 77 | S | 25.9 | Very low | 26.2 | Very low | 108 Ų | 108 | 136.1 Ų | 136.1 | 76% | 0.755 | 79% | 0.794 | S | S | * | * | trans | 167.2 | 134.6 | 143.7 | 180 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 78 | S | 27.7 | Very low | 26.2 | Very low | 96 Ų | 96 | 139.7 Ų | 139.7 | 67% | 0.671 | 80% | 0.802 | S | S | * | * | trans | 68.1 | 109.7 | 156.6 | 78.8 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 79 | K | 25.4 | Very low | 26.2 | Very low | 193 Ų | 193 | 144.2 Ų | 144.2 | 84% | 0.839 | 81% | 0.807 | S | S | * | * | 50.7 | 113.7 | 103 | -69 | -174.9 | 177.1 | 179.4 | 0 | 111.6 | |||||
| 80 | V | 28.1 | Very low | 26.2 | Very low | 119 Ų | 119 | 148.5 Ų | 148.5 | 72% | 0.721 | 81% | 0.811 | S | S | * | * | 159.7 | 118.8 | 120.7 | 164 | 0 | 0 | 0 | 0 | 106.8 | E82 | V80-E82 HydrophobicContact CG1-CB 4.45Å; V80-E82 PolarHBondContact O-N 3.19Å | |||
| 81 | N | 25.9 | Very low | 26.3 | Very low | 172 Ų | 172 | 148.9 Ų | 148.9 | 92% | 0.92 | 81% | 0.813 | S | S | * | * | trans | -60.5 | 95.8 | 166.7 | -74.3 | -43.7 | 0 | 0 | 0 | 108.8 | ||||
| 82 | E | 28.4 | Very low | 26.3 | Very low | 162 Ų | 162 | 149.7 Ų | 149.7 | 76% | 0.757 | 81% | 0.814 | S | S | * | * | trans | -164.4 | 130.6 | 157.8 | -116.6 | 175.7 | 172.8 | 0 | 0 | 110.3 | V80 | V80-E82 HydrophobicContact CG1-CB 4.45Å; V80-E82 PolarHBondContact O-N 3.19Å | ||
| 83 | P | 24.1 | Very low | 26.1 | Very low | 112 Ų | 112 | 149.6 Ų | 149.6 | 73% | 0.727 | 82% | 0.821 | S | S | * | * | trans | -69.2 | 128 | 176.1 | 27.7 | -30.6 | 0 | 0 | 0 | 109 | K85 | P83-K85 PolarHBondContact O-N 3.17Š| ||
| 84 | P | 27.8 | Very low | 26.1 | Very low | 126 Ų | 126 | 148.1 Ų | 148.1 | 82% | 0.818 | 81% | 0.814 | S | S | * | * | trans | -69.6 | 98.6 | -177.5 | 25.8 | -30.6 | 0 | 0 | 0 | 110.5 | R86 | P84-R86 VanDerWaalsContact C-N 3.27Å; P84-R86 PolarHBondContact O-N 3.24Å | ||
| 85 | K | 25.5 | Very low | 26 | Very low | 197 Ų | 197 | 151.2 Ų | 151.2 | 86% | 0.857 | 82% | 0.815 | S | S | * | * | trans | -61.8 | 84.5 | 156.3 | -73.4 | 174 | 176.8 | 170.6 | 0 | 108.4 | P83 | P83-K85 PolarHBondContact O-N 3.17Š| ||
| 86 | R | 25.2 | Very low | 26 | Very low | 244 Ų | 244 | 155.5 Ų | 155.5 | 92% | 0.921 | 81% | 0.813 | S | S | * | * | trans | 168.6 | 92.6 | 159.7 | -94.8 | 156 | -167.8 | -153.3 | 5.6 | 110.1 | P84 | P84-R86 VanDerWaalsContact C-N 3.27Å; P84-R86 PolarHBondContact O-N 3.24Å | ||
| 87 | A | 26.2 | Very low | 26.2 | Very low | 104 Ų | 104 | 151 Ų | 151 | 86% | 0.86 | 80% | 0.797 | S | S | * | * | trans | -162 | 48.2 | 151.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 88 | V | 24.9 | Very low | 26.2 | Very low | 139 Ų | 139 | 151 Ų | 151 | 84% | 0.842 | 79% | 0.788 | S | S | * | * | trans | -107.4 | 86.6 | 168 | 179.4 | 0 | 0 | 0 | 0 | 105.5 | ||||
| 89 | E | 24.9 | Very low | 26.4 | Very low | 194 Ų | 194 | 149.7 Ų | 149.7 | 91% | 0.907 | 78% | 0.779 | S | S | * | * | trans | -130.4 | 114.2 | 159.7 | -100.6 | -179 | 178.4 | 0 | 0 | 109.4 | ||||
| 90 | R | 23.9 | Very low | 26.5 | Very low | 246 Ų | 246 | 148.3 Ų | 148.3 | 93% | 0.928 | 78% | 0.775 | S | S | * | * | trans | -61.2 | 129.6 | -178.5 | -73.6 | 163 | 157.5 | 169.1 | -7 | 110.5 | ||||
| 91 | S | 27.1 | Very low | 26.5 | Very low | 110 Ų | 110 | 149.9 Ų | 149.9 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | -126.1 | 96.9 | 154.4 | 40.9 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 92 | T | 25.2 | Very low | 26.6 | Very low | 124 Ų | 124 | 150.3 Ų | 150.3 | 76% | 0.761 | 76% | 0.763 | S | S | * | * | trans | 32.2 | 126.6 | 152.4 | 47.9 | 0 | 0 | 0 | 0 | 121 | S94 | T92-S94 PolarHBondContact O-N 3.12Š| ||
| 93 | P | 23.7 | Very low | 26.6 | Very low | 134 Ų | 134 | 145.3 Ų | 145.3 | 87% | 0.87 | 75% | 0.75 | S | S | * | * | trans | -73.4 | 91.6 | 179.6 | 32.2 | -32.8 | 0 | 0 | 0 | 111 | R95 | P93-R95 PolarHBondContact O-N 2.66Š| ||
| 94 | S | 26.4 | Very low | 26.6 | Very low | 97 Ų | 97 | 141.3 Ų | 141.3 | 68% | 0.678 | 73% | 0.729 | S | S | * | * | trans | -76 | 106.6 | 168.6 | 168.3 | 0 | 0 | 0 | 0 | 109.2 | T92 W96 | T92-S94 PolarHBondContact O-N 3.12Å; S94-W96 PolarHBondContact O-N 3.13Å | ||
| 95 | R | 27.1 | Very low | 26.6 | Very low | 211 Ų | 211 | 141.4 Ų | 141.4 | 80% | 0.796 | 72% | 0.719 | S | S | * | * | trans | -24.2 | 107 | 173.2 | -76.2 | 175.6 | 169.1 | -178.6 | -4.4 | 114.3 | P93 S97 | P93-R95 PolarHBondContact O-N 2.66Å; R95-S97 VanDerWaalsContact C-N 3.32Å | ||
| 96 | W | 27.8 | Very low | 26.7 | Very low | 204 Ų | 204 | 135.8 Ų | 135.8 | 77% | 0.773 | 70% | 0.7 | S | S | * | * | trans | -86.3 | 3 | 172.8 | -87.7 | 24.4 | 0 | 0 | 0 | 113.8 | S94 D98 | S94-W96 PolarHBondContact O-N 3.13Å; W96-D98 VanDerWaalsContact C-N 3.29Å; W96-D98 PolarHBondContact O-N 3.23Å | ||
| 97 | S | 29.2 | Very low | 26.8 | Very low | 80 Ų | 80 | 130.8 Ų | 130.8 | 56% | 0.559 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68 | -22.8 | -175.8 | 50.1 | 0 | 0 | 0 | 0 | 114.6 | R95 | R95-S97 VanDerWaalsContact C-N 3.32Š|
| 98 | D | 26.5 | Very low | 26.9 | Very low | 107 Ų | 107 | 136.5 Ų | 136.5 | 57% | 0.572 | 69% | 0.689 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.2 | -0.4 | -168.3 | -55.1 | -2.2 | 0 | 0 | 0 | 112.8 | W96 | W96-D98 VanDerWaalsContact C-N 3.29Å; W96-D98 PolarHBondContact O-N 3.23Å |
| 99 | S | 30.8 | Very low | 27 | Very low | 69 Ų | 69 | 133 Ų | 133 | 48% | 0.483 | 67% | 0.67 | S | S | . | * | H | α-helix | trans | -101.1 | -27 | -175.1 | 85.3 | 0 | 0 | 0 | 0 | 114.7 | R102 A103 | S99-R102 PolarHBondContact O-N 3Å; S99-A103 PolarHBondContact O-N 2.98Å |
| 100 | E | 28.4 | Very low | 27.4 | Very low | 163 Ų | 163 | 128.1 Ų | 128.1 | 76% | 0.762 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -71.2 | -33.7 | 174.5 | -81.3 | -172.8 | 149.8 | 0 | 0 | 111.8 | A103 G104 | E100-A103 PolarHBondContact O-N 3.48Å; E100-G104 PolarHBondContact O-N 3.17Å |
| 101 | E | 27.2 | Very low | 27.8 | Very low | 152 Ų | 152 | 117.8 Ų | 117.8 | 71% | 0.71 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -67.5 | -38.7 | 175.7 | -150.3 | 170.3 | -159.4 | 0 | 0 | 111.4 | G104 E105 | E101-G104 PolarHBondContact O-N 3.47Å; E101-E105 PolarHBondContact O-N 3.23Å |
| 102 | R | 27.6 | Very low | 28.1 | Very low | 181 Ų | 181 | 118.2 Ų | 118.2 | 68% | 0.683 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -68.3 | -36.7 | 172.4 | -95.7 | -179.2 | 178.5 | 150.7 | 1.8 | 113.8 | S99 G104 E105 V106 | S99-R102 PolarHBondContact O-N 3Å; R102-G104 VanDerWaalsContact C-N 3.32Å; R102-E105 PolarHBondContact O-N 3.02Å; R102-V106 WeakPolarHBondContact O-CB 3.35Å; R102-V106 WeakPolarHBondContact O-CG2 3.23Å; R102-V106 PolarHBondContact O-N 2.8Å |
| 103 | A | 28.5 | Very low | 28.5 | Very low | 57 Ų | 57 | 117.4 Ų | 117.4 | 47% | 0.471 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68.2 | -34.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | S99 E100 M107 | S99-A103 PolarHBondContact O-N 2.98Å; E100-A103 PolarHBondContact O-N 3.48Å; A103-M107 WeakPolarHBondContact O-CB 3.27Å; A103-M107 VanDerWaalsContact O-CG 3.23Å; A103-M107 WeakPolarHBondContact O-CG 3.48Å; A103-M107 PolarHBondContact O-N 2.7Å; A103-M107 VanDerWaalsContact O-N 3.14Å |
| 104 | G | 25.8 | Very low | 29.1 | Very low | 28 Ų | 28 | 114.7 Ų | 114.7 | 29% | 0.289 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -66.2 | -40.6 | 170.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | E100 E101 R102 R108 | E100-G104 PolarHBondContact O-N 3.17Å; E101-G104 PolarHBondContact O-N 3.47Å; R102-G104 VanDerWaalsContact C-N 3.32Å; G104-R108 WeakPolarHBondContact O-CB 3.19Å; G104-R108 VanDerWaalsContact O-CG 3.26Å; G104-R108 WeakPolarHBondContact O-CG 3.18Å; G104-R108 PolarHBondContact O-N 3Å |
| 105 | E | 26.2 | Very low | 29.5 | Very low | 129 Ų | 129 | 114.3 Ų | 114.3 | 60% | 0.603 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -68.1 | -36.4 | 174.7 | -96.7 | -178.9 | 150 | 0 | 0 | 113.4 | E101 R102 R108 S109 | E101-E105 PolarHBondContact O-N 3.23Å; R102-E105 PolarHBondContact O-N 3.02Å; E105-R108 PolarHBondContact O-N 2.88Å; E105-S109 VanDerWaalsContact O-CB 3.32Å; E105-S109 WeakPolarHBondContact O-CB 3.09Å; E105-S109 PolarHBondContact O-N 3.34Å; E105-S109 VanDerWaalsContact O-N 3.1Å; E105-S109 PolarHBondContact O-OG 2.9Å |
| 106 | V | 27.1 | Very low | 30.2 | Very low | 78 Ų | 78 | 106.3 Ų | 106.3 | 47% | 0.473 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -74.4 | -27.8 | 178.8 | 173.2 | 0 | 0 | 0 | 0 | 112.4 | R102 S109 | R102-V106 WeakPolarHBondContact O-CB 3.35Å; R102-V106 WeakPolarHBondContact O-CG2 3.23Å; R102-V106 PolarHBondContact O-N 2.8Å; V106-S109 WeakPolarHBondContact CA-OG 3.13Å; V106-S109 PolarHBondContact O-OG 3.14Å |
| 107 | M | 27.6 | Very low | 30.9 | Very low | 140 Ų | 140 | 100.2 Ų | 100.2 | 69% | 0.69 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -82 | -27.6 | 172.6 | -69.8 | -100 | -137 | 0 | 0 | 112.6 | A103 | A103-M107 WeakPolarHBondContact O-CB 3.27Å; A103-M107 VanDerWaalsContact O-CG 3.23Å; A103-M107 WeakPolarHBondContact O-CG 3.48Å; A103-M107 PolarHBondContact O-N 2.7Å; A103-M107 VanDerWaalsContact O-N 3.14Å |
| 108 | R | 29 | Very low | 31.8 | Very low | 224 Ų | 224 | 101.3 Ų | 101.3 | 85% | 0.845 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -79.1 | -20.2 | 174.5 | -77.1 | 176.9 | -179.2 | 156.5 | 1.1 | 114 | G104 E105 | G104-R108 WeakPolarHBondContact O-CB 3.19Å; G104-R108 VanDerWaalsContact O-CG 3.26Å; G104-R108 WeakPolarHBondContact O-CG 3.18Å; G104-R108 PolarHBondContact O-N 3Å; E105-R108 PolarHBondContact O-N 2.88Å |
| 109 | S | 28 | Very low | 32.6 | Very low | 65 Ų | 65 | 98.2 Ų | 98.2 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | S | Bend | trans | -100.1 | -7 | -175.7 | 53.4 | 0 | 0 | 0 | 0 | 115.1 | E105 V106 | E105-S109 VanDerWaalsContact O-CB 3.32Å; E105-S109 WeakPolarHBondContact O-CB 3.09Å; E105-S109 PolarHBondContact O-N 3.34Å; E105-S109 VanDerWaalsContact O-N 3.1Å; E105-S109 PolarHBondContact O-OG 2.9Å; V106-S109 WeakPolarHBondContact CA-OG 3.13Å; V106-S109 PolarHBondContact O-OG 3.14Å |
| 110 | K | 32.8 | Very low | 33.4 | Very low | 91 Ų | 91 | 95.3 Ų | 95.3 | 40% | 0.396 | 50% | 0.496 | S | S | . | . | S | Bend | trans | -112.8 | 111.2 | 174.5 | -74.5 | 177 | -177.9 | 157 | 0 | 108.3 | D114 | K110-D114 HydrophobicContact CB-CB 4.18Š|
| 111 | G | 31.9 | Very low | 34.3 | Very low | 30 Ų | 30 | 91.9 Ų | 91.9 | 31% | 0.309 | 48% | 0.48 | S | S | . | . | trans | -50.9 | 147.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110 | D113 D114 | G111-D113 PolarHBondContact O-N 3Å; G111-D114 WeakPolarHBondContact O-CB 3.17Å; G111-D114 PolarHBondContact O-N 3.15Å | ||
| 112 | T | 33 | Very low | 35.3 | Very low | 119 Ų | 119 | 94 Ų | 94 | 73% | 0.73 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -44.9 | -31.6 | 172.2 | 37.9 | 0 | 0 | 0 | 0 | 112.4 | V115 F116 | T112-V115 PolarHBondContact O-N 3.49Å; T112-F116 VanDerWaalsContact O-CB 3.31Å; T112-F116 WeakPolarHBondContact O-CB 3.33Å; T112-F116 PolarHBondContact O-N 3.16Å |
| 113 | D | 33.2 | Very low | 36.1 | Very low | 106 Ų | 106 | 88.5 Ų | 88.5 | 57% | 0.567 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -62.6 | -39 | 176 | -59.5 | -19.4 | 0 | 0 | 0 | 113.1 | G111 F116 V117 | G111-D113 PolarHBondContact O-N 3Å; D113-F116 PolarHBondContact O-N 3.15Å; D113-V117 WeakPolarHBondContact O-CB 3.33Å; D113-V117 WeakPolarHBondContact O-CG2 3.38Å; D113-V117 PolarHBondContact O-N 2.88Å |
| 114 | D | 36 | Very low | 36.9 | Very low | 78 Ų | 78 | 87.9 Ų | 87.9 | 42% | 0.417 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -69.7 | -36.1 | 178.2 | -84.2 | -16.4 | 0 | 0 | 0 | 112.4 | K110 G111 F116 K118 | K110-D114 HydrophobicContact CB-CB 4.18Å; G111-D114 WeakPolarHBondContact O-CB 3.17Å; G111-D114 PolarHBondContact O-N 3.15Å; D114-F116 VanDerWaalsContact C-N 3.3Å; D114-K118 WeakPolarHBondContact O-CB 3.29Å; D114-K118 VanDerWaalsContact O-CG 3.31Å; D114-K118 WeakPolarHBondContact O-CG 3.37Å; D114-K118 PolarHBondContact O-N 3.37Å |
| 115 | V | 36.6 | Very low | 37.8 | Very low | 89 Ų | 89 | 96.2 Ų | 96.2 | 54% | 0.539 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -68 | -39.9 | 175.6 | 179.1 | 0 | 0 | 0 | 0 | 109.6 | T112 K118 A119 | T112-V115 PolarHBondContact O-N 3.49Å; V115-K118 PolarHBondContact O-N 2.98Å; V115-A119 PolarHBondContact O-N 3.4Å |
| 116 | F | 41.8 | Very low | 38.5 | Very low | 43 Ų | 43 | 92.8 Ų | 92.8 | 19% | 0.189 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -70.1 | -47.2 | -179 | -170.4 | -117.5 | 0 | 0 | 0 | 112.7 | T112 D113 D114 K118 A119 V120 L143 M150 L152 | T112-F116 VanDerWaalsContact O-CB 3.31Å; T112-F116 WeakPolarHBondContact O-CB 3.33Å; T112-F116 PolarHBondContact O-N 3.16Å; D113-F116 PolarHBondContact O-N 3.15Å; D114-F116 VanDerWaalsContact C-N 3.3Å; F116-K118 VanDerWaalsContact C-N 3.26Å; F116-K118 PolarHBondContact O-N 3.02Å; F116-A119 WeakPolarHBondContact O-CB 3.5Å; F116-A119 PolarHBondContact O-N 3.46Å; F116-V120 HydrophobicContact CD1-CG2 4.43Å; F116-V120 HydrophobicContact CE1-CG2 4.22Å; F116-V120 HydrophobicContact CE2-CG2 4.42Å; F116-V120 HydrophobicContact CZ-CG2 4.2Å; F116-V120 WeakPolarHBondContact O-CG2 3.31Å; F116-V120 PolarHBondContact O-N 2.98Å; F116-L143 HydrophobicContact CD1-CD2 4.26Å; F116-L143 HydrophobicContact CE1-CD1 4.1Å; F116-L143 HydrophobicContact CE1-CD2 3.09Å; F116-L143 HydrophobicContact CE1-CG 4.23Å; F116-L143 HydrophobicContact CE2-CD2 4.27Å; F116-L143 HydrophobicContact CZ-CD2 3.09Å; F116-M150 HydrophobicContact CD2-CE 4.42Å; F116-M150 HydrophobicContact CD2-SD 4.05Å; F116-M150 HydrophobicContact CE1-CE 4.46Å; F116-M150 HydrophobicContact CE2-CE 3.26Å; F116-M150 HydrophobicContact CE2-SD 3.39Å; F116-M150 WeakPolarHBondContact CE2-SD 3.41Å; F116-M150 HydrophobicContact CZ-CE 3.26Å; F116-M150 HydrophobicContact CZ-SD 3.74Å; F116-L152 HydrophobicContact CD1-CD1 4.43Å; F116-L152 HydrophobicContact CE1-CD1 3.54Å; F116-L152 HydrophobicContact CE1-CD2 4.42Å; F116-L152 HydrophobicContact CZ-CD1 3.92Å |
| 117 | V | 42.6 | Very low | 39 | Very low | 75 Ų | 75 | 91.7 Ų | 91.7 | 46% | 0.455 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -56.4 | -42.7 | 174 | 169.6 | 0 | 0 | 0 | 0 | 110.5 | D113 A119 V120 E121 | D113-V117 WeakPolarHBondContact O-CB 3.33Å; D113-V117 WeakPolarHBondContact O-CG2 3.38Å; D113-V117 PolarHBondContact O-N 2.88Å; V117-A119 PolarHBondContact O-N 3.35Å; V117-V120 PolarHBondContact O-N 3.33Å; V117-E121 HydrophobicContact CG1-CG 4.37Å; V117-E121 WeakPolarHBondContact O-CB 3.27Å; V117-E121 WeakPolarHBondContact O-CG 3.17Å; V117-E121 PolarHBondContact O-N 3.21Å |
| 118 | K | 46.6 | Very low | 39.7 | Very low | 104 Ų | 104 | 86.9 Ų | 86.9 | 45% | 0.452 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -65.6 | -35 | 175.6 | -76.3 | 176.8 | -177.7 | 175.2 | 0 | 113.7 | D114 V115 F116 R122 | D114-K118 WeakPolarHBondContact O-CB 3.29Å; D114-K118 VanDerWaalsContact O-CG 3.31Å; D114-K118 WeakPolarHBondContact O-CG 3.37Å; D114-K118 PolarHBondContact O-N 3.37Å; V115-K118 PolarHBondContact O-N 2.98Å; F116-K118 VanDerWaalsContact C-N 3.26Å; F116-K118 PolarHBondContact O-N 3.02Å; K118-R122 WeakPolarHBondContact O-CB 3.42Å; K118-R122 VanDerWaalsContact O-CG 3.28Å; K118-R122 WeakPolarHBondContact O-CG 3.18Å; K118-R122 PolarHBondContact O-N 2.98Å |
| 119 | A | 44.4 | Very low | 40.3 | Very low | 41 Ų | 41 | 84.7 Ų | 84.7 | 34% | 0.339 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -67 | -44.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | V115 F116 V117 R122 I123 | V115-A119 PolarHBondContact O-N 3.4Å; F116-A119 WeakPolarHBondContact O-CB 3.5Å; F116-A119 PolarHBondContact O-N 3.46Å; V117-A119 PolarHBondContact O-N 3.35Å; A119-R122 PolarHBondContact O-N 3.43Å; A119-I123 VanDerWaalsContact O-CG1 3.27Å; A119-I123 WeakPolarHBondContact O-CG1 3.46Å; A119-I123 PolarHBondContact O-N 3.12Å |
| 120 | V | 48 | Very low | 40.9 | Very low | 8 Ų | 8 | 88.2 Ų | 88.2 | 5% | 0.048 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 176.2 | 176.3 | 0 | 0 | 0 | 0 | 111.2 | F116 V117 R122 I123 L124 I142 L143 I146 | F116-V120 HydrophobicContact CD1-CG2 4.43Å; F116-V120 HydrophobicContact CE1-CG2 4.22Å; F116-V120 HydrophobicContact CE2-CG2 4.42Å; F116-V120 HydrophobicContact CZ-CG2 4.2Å; F116-V120 WeakPolarHBondContact O-CG2 3.31Å; F116-V120 PolarHBondContact O-N 2.98Å; V117-V120 PolarHBondContact O-N 3.33Å; V120-R122 VanDerWaalsContact C-N 3.33Å; V120-R122 PolarHBondContact O-N 3.41Å; V120-I123 PolarHBondContact O-N 2.84Å; V120-L124 HydrophobicContact CG1-CD1 4.36Å; V120-L124 WeakPolarHBondContact O-CB 3.43Å; V120-L124 WeakPolarHBondContact O-CG 3.35Å; V120-L124 PolarHBondContact O-N 2.92Å; V120-I142 HydrophobicContact CG1-CB 4.35Å; V120-I142 HydrophobicContact CG1-CD1 4.15Å; V120-I142 HydrophobicContact CG1-CG2 4.02Å; V120-L143 HydrophobicContact CG2-CD2 3.61Å; V120-L143 HydrophobicContact CG2-CG 4.35Å; V120-I146 HydrophobicContact CG2-CD1 4.32Å |
| 121 | E | 46.5 | Very low | 41.3 | Very low | 92 Ų | 92 | 84.9 Ų | 84.9 | 43% | 0.43 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.8 | -38.9 | 175 | -78.3 | -174 | 164.5 | 0 | 0 | 112.5 | V117 L124 R125 | V117-E121 HydrophobicContact CG1-CG 4.37Å; V117-E121 WeakPolarHBondContact O-CB 3.27Å; V117-E121 WeakPolarHBondContact O-CG 3.17Å; V117-E121 PolarHBondContact O-N 3.21Å; E121-L124 PolarHBondContact O-N 3.25Å; E121-R125 WeakPolarHBondContact O-CG 3.33Å; E121-R125 PolarHBondContact O-N 2.88Å |
| 122 | R | 47.3 | Very low | 41.6 | Very low | 196 Ų | 196 | 88.1 Ų | 88.1 | 74% | 0.74 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -65 | -41.2 | 174.5 | -81.3 | 177.8 | 177 | 176.7 | -0.5 | 111.7 | K118 A119 V120 R125 A126 | K118-R122 WeakPolarHBondContact O-CB 3.42Å; K118-R122 VanDerWaalsContact O-CG 3.28Å; K118-R122 WeakPolarHBondContact O-CG 3.18Å; K118-R122 PolarHBondContact O-N 2.98Å; A119-R122 PolarHBondContact O-N 3.43Å; V120-R122 VanDerWaalsContact C-N 3.33Å; V120-R122 PolarHBondContact O-N 3.41Å; R122-R125 PolarHBondContact O-N 2.94Å; R122-A126 PolarHBondContact O-N 2.96Å; R122-A126 VanDerWaalsContact O-N 3.12Å |
| 123 | I | 45.5 | Very low | 41.9 | Very low | 66 Ų | 66 | 92.1 Ų | 92.1 | 34% | 0.338 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -63.5 | -44.9 | 175.2 | -68.1 | 164.2 | 0 | 0 | 0 | 110 | A119 V120 R125 A126 F127 I146 | A119-I123 VanDerWaalsContact O-CG1 3.27Å; A119-I123 WeakPolarHBondContact O-CG1 3.46Å; A119-I123 PolarHBondContact O-N 3.12Å; V120-I123 PolarHBondContact O-N 2.84Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 3.43Å; I123-A126 WeakPolarHBondContact O-CB 3.43Å; I123-A126 PolarHBondContact O-N 3.28Å; I123-A126 VanDerWaalsContact O-N 3.1Å; I123-F127 HydrophobicContact CG2-CD2 4.17Å; I123-F127 WeakPolarHBondContact O-CD2 3.01Å; I123-F127 PolarHBondContact O-N 2.83Å; I123-I146 HydrophobicContact CD1-CD1 4.36Å |
| 124 | L | 45 | Very low | 42.1 | Very low | 44 Ų | 44 | 94.6 Ų | 94.6 | 23% | 0.23 | 46% | 0.457 | C | S | . | . | H | α-helix | trans | -59.1 | -42.7 | 176.8 | -86.2 | 172 | 0 | 0 | 0 | 114 | V120 E121 A126 F127 Y131 I142 | V120-L124 HydrophobicContact CG1-CD1 4.36Å; V120-L124 WeakPolarHBondContact O-CB 3.43Å; V120-L124 WeakPolarHBondContact O-CG 3.35Å; V120-L124 PolarHBondContact O-N 2.92Å; E121-L124 PolarHBondContact O-N 3.25Å; L124-A126 VanDerWaalsContact C-N 3.26Å; L124-A126 PolarHBondContact O-N 3.29Å; L124-F127 CarbonylContact O-C 3.57Å; L124-F127 PolarHBondContact O-N 3.49Å; L124-Y131 HydrophobicContact CD2-CD2 3.74Å; L124-Y131 HydrophobicContact CD2-CG 3.84Å; L124-I142 HydrophobicContact CD1-CD1 3.29Å; L124-I142 HydrophobicContact CD2-CD1 3.06Å; L124-I142 HydrophobicContact CD2-CG1 3.75Å; L124-I142 HydrophobicContact CG-CD1 3.22Å; L124-I142 HydrophobicContact CG-CG1 4.21Å |
| 125 | R | 45.7 | Very low | 42.1 | Very low | 202 Ų | 202 | 93 Ų | 93 | 76% | 0.762 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -66.8 | -30.7 | 176.7 | -73.6 | 179.6 | -172.1 | -169.5 | 4.8 | 112.1 | E121 R122 I123 | E121-R125 WeakPolarHBondContact O-CG 3.33Å; E121-R125 PolarHBondContact O-N 2.88Å; R122-R125 PolarHBondContact O-N 2.94Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 3.43Å |
| 126 | A | 39.2 | Very low | 42 | Very low | 57 Ų | 57 | 97 Ų | 97 | 47% | 0.471 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -77.7 | -27.6 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | R122 I123 L124 P128 | R122-A126 PolarHBondContact O-N 2.96Å; R122-A126 VanDerWaalsContact O-N 3.12Å; I123-A126 WeakPolarHBondContact O-CB 3.43Å; I123-A126 PolarHBondContact O-N 3.28Å; I123-A126 VanDerWaalsContact O-N 3.1Å; L124-A126 VanDerWaalsContact C-N 3.26Å; L124-A126 PolarHBondContact O-N 3.29Å; A126-P128 VanDerWaalsContact C-CD 3.42Å; A126-P128 WeakPolarHBondContact O-CD 3.35Å |
| 127 | F | 39.5 | Very low | 41.7 | Very low | 55 Ų | 55 | 100.1 Ų | 100.1 | 24% | 0.241 | 49% | 0.488 | C | S | . | . | trans | -126 | 63.2 | -177.1 | -60.9 | -81.6 | 0 | 0 | 0 | 112.6 | I44 I123 L124 H129 W130 | I44-F127 HydrophobicContact CD1-CZ 4.19Å; I123-F127 HydrophobicContact CG2-CD2 4.17Å; I123-F127 WeakPolarHBondContact O-CD2 3.01Å; I123-F127 PolarHBondContact O-N 2.83Å; L124-F127 CarbonylContact O-C 3.57Å; L124-F127 PolarHBondContact O-N 3.49Å; F127-H129 PolarHBondContact O-N 2.92Å; F127-W130 HydrophobicContact CB-CB 3.99Å; F127-W130 HydrophobicContact CB-CD2 3.95Å; F127-W130 HydrophobicContact CB-CE3 4.11Å; F127-W130 HydrophobicContact CB-CG 3.89Å; F127-W130 AromaticContact CD1-CD2 3.84Å; F127-W130 HydrophobicContact CD1-CD2 3.84Å; F127-W130 AromaticContact CD1-CE2 3.82Å; F127-W130 HydrophobicContact CD1-CE3 4.05Å; F127-W130 HydrophobicContact CD1-CG 4.39Å; F127-W130 HydrophobicContact CD1-CH2 4.26Å; F127-W130 HydrophobicContact CD1-CZ2 4.05Å; F127-W130 HydrophobicContact CD1-CZ3 4.26Å; F127-W130 HydrophobicContact CE1-CH2 4.18Å; F127-W130 HydrophobicContact CE1-CZ2 4.14Å; F127-W130 HydrophobicContact CE1-CZ3 4.44Å; F127-W130 HydrophobicContact CG-CD2 4.04Å; F127-W130 AromaticContact CG-CE3 3.99Å; F127-W130 HydrophobicContact CG-CE3 3.99Å; F127-W130 HydrophobicContact CG-CG 4.46Å; F127-W130 HydrophobicContact CG-CZ3 4.4Å; F127-W130 PolarHBondContact O-N 3.37Å; F127-W130 VanDerWaalsContact O-N 3.12Å | ||
| 128 | P | 41 | Very low | 41.3 | Very low | 39 Ų | 39 | 97.4 Ų | 97.4 | 25% | 0.253 | 47% | 0.472 | S | S | . | . | G | 310 helix | trans | -64.3 | -24.2 | -178.9 | 27.3 | -34.4 | 0 | 0 | 0 | 113 | A126 W130 | A126-P128 VanDerWaalsContact C-CD 3.42Å; A126-P128 WeakPolarHBondContact O-CD 3.35Å; P128-W130 VanDerWaalsContact C-N 3.34Å |
| 129 | H | 42.5 | Very low | 40.8 | Very low | 178 Ų | 178 | 95.5 Ų | 95.5 | 82% | 0.824 | 47% | 0.471 | S | S | * | . | G | 310 helix | trans | -78.1 | -16.9 | 178.1 | -46.9 | -66 | 0 | 0 | 0 | 113.5 | F127 | F127-H129 PolarHBondContact O-N 2.92Š|
| 130 | W | 39.6 | Very low | 40.6 | Very low | 140 Ų | 140 | 95.3 Ų | 95.3 | 53% | 0.53 | 47% | 0.47 | S | S | . | . | G | 310 helix | trans | -87 | -11.4 | -177.3 | -73 | 10 | 0 | 0 | 0 | 112.9 | F127 P128 | F127-W130 HydrophobicContact CB-CB 3.99Å; F127-W130 HydrophobicContact CB-CD2 3.95Å; F127-W130 HydrophobicContact CB-CE3 4.11Å; F127-W130 HydrophobicContact CB-CG 3.89Å; F127-W130 AromaticContact CD1-CD2 3.84Å; F127-W130 HydrophobicContact CD1-CD2 3.84Å; F127-W130 AromaticContact CD1-CE2 3.82Å; F127-W130 HydrophobicContact CD1-CE3 4.05Å; F127-W130 HydrophobicContact CD1-CG 4.39Å; F127-W130 HydrophobicContact CD1-CH2 4.26Å; F127-W130 HydrophobicContact CD1-CZ2 4.05Å; F127-W130 HydrophobicContact CD1-CZ3 4.26Å; F127-W130 HydrophobicContact CE1-CH2 4.18Å; F127-W130 HydrophobicContact CE1-CZ2 4.14Å; F127-W130 HydrophobicContact CE1-CZ3 4.44Å; F127-W130 HydrophobicContact CG-CD2 4.04Å; F127-W130 AromaticContact CG-CE3 3.99Å; F127-W130 HydrophobicContact CG-CE3 3.99Å; F127-W130 HydrophobicContact CG-CG 4.46Å; F127-W130 HydrophobicContact CG-CZ3 4.4Å; F127-W130 PolarHBondContact O-N 3.37Å; F127-W130 VanDerWaalsContact O-N 3.12Å; P128-W130 VanDerWaalsContact C-N 3.34Å |
| 131 | Y | 42 | Very low | 40.2 | Very low | 20 Ų | 20 | 98 Ų | 98 | 8% | 0.078 | 48% | 0.482 | C | S | . | . | S | Bend | trans | -144.7 | 120.4 | -172.6 | -64.3 | -76.5 | 0 | 0 | 0 | 111.2 | L124 R133 I142 | L124-Y131 HydrophobicContact CD2-CD2 3.74Å; L124-Y131 HydrophobicContact CD2-CG 3.84Å; Y131-R133 PolarHBondContact O-N 2.94Å; Y131-I142 HydrophobicContact CD1-CD1 4.35Å; Y131-I142 HydrophobicContact CD1-CG1 3.4Å; Y131-I142 HydrophobicContact CD2-CG1 3.93Å; Y131-I142 HydrophobicContact CE1-CB 4Å; Y131-I142 HydrophobicContact CE1-CG1 3.23Å; Y131-I142 HydrophobicContact CE2-CG1 3.78Å; Y131-I142 HydrophobicContact CE2-CG2 4.39Å; Y131-I142 HydrophobicContact CG-CD1 4.41Å; Y131-I142 HydrophobicContact CG-CG1 3.75Å; Y131-I142 VanDerWaalsContact CZ-CG1 3.44Å |
| 132 | P | 38.7 | Very low | 40 | Very low | 99 Ų | 99 | 93.6 Ų | 93.6 | 64% | 0.643 | 46% | 0.462 | S | S | * | . | trans | -61.5 | 114.5 | 174.6 | 23.1 | -30.2 | 0 | 0 | 0 | 109 | N134 S135 C138 | P132-N134 PolarHBondContact O-N 2.92Å; P132-S135 PolarHBondContact O-N 3.38Å; P132-C138 PolarHBondContact O-SG 3.34Å | ||
| 133 | R | 37.4 | Very low | 39.7 | Very low | 202 Ų | 202 | 86 Ų | 86 | 76% | 0.762 | 44% | 0.435 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.9 | -6.3 | -173.2 | -73.4 | -173.9 | 174 | -173.8 | 0.4 | 115.3 | Y131 | Y131-R133 PolarHBondContact O-N 2.94Š|
| 134 | N | 37.6 | Very low | 39.5 | Very low | 159 Ų | 159 | 89.7 Ų | 89.7 | 85% | 0.85 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.9 | 6.4 | -171.5 | -63.7 | -11.2 | 0 | 0 | 0 | 114.1 | P132 L136 | P132-N134 PolarHBondContact O-N 2.92Å; N134-L136 PolarHBondContact O-N 2.9Å |
| 135 | S | 35.8 | Very low | 39.1 | Very low | 44 Ų | 44 | 95 Ų | 95 | 31% | 0.308 | 47% | 0.466 | S | S | . | . | trans | -83.2 | 114.8 | 174.4 | 160 | 0 | 0 | 0 | 0 | 109.9 | P132 N137 C138 | P132-S135 PolarHBondContact O-N 3.38Å; S135-N137 PolarHBondContact O-N 2.86Å; S135-N137 WeakPolarHBondContact OG-CA 3.31Å; S135-N137 PolarHBondContact OG-N 3.21Å; S135-N137 VanDerWaalsContact OG-N 3.16Å; S135-C138 VanDerWaalsContact O-CB 3.25Å; S135-C138 WeakPolarHBondContact O-CB 3.34Å; S135-C138 PolarHBondContact O-N 3.18Å; S135-C138 PolarHBondContact OG-N 2.91Å | ||
| 136 | L | 35.3 | Very low | 38.9 | Very low | 174 Ų | 174 | 86.9 Ų | 86.9 | 91% | 0.911 | 44% | 0.437 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.1 | -18.5 | 166.3 | -88.7 | 148.7 | 0 | 0 | 0 | 112.4 | N134 | N134-L136 PolarHBondContact O-N 2.9Š|
| 137 | N | 35.7 | Very low | 38.6 | Very low | 108 Ų | 108 | 88 Ų | 88 | 58% | 0.578 | 44% | 0.44 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.6 | 12 | 178.4 | -67.5 | -31.4 | 0 | 0 | 0 | 113.3 | S135 S139 A140 E141 | S135-N137 PolarHBondContact O-N 2.86Å; S135-N137 WeakPolarHBondContact OG-CA 3.31Å; S135-N137 PolarHBondContact OG-N 3.21Å; S135-N137 VanDerWaalsContact OG-N 3.16Å; N137-S139 VanDerWaalsContact C-N 3.31Å; N137-S139 PolarHBondContact O-N 2.85Å; N137-A140 PolarHBondContact O-N 3.13Å; N137-A140 VanDerWaalsContact O-N 3.14Å; N137-E141 PolarHBondContact O-N 3.05Å |
| 138 | C | 33.2 | Very low | 38.4 | Very low | 17 Ų | 17 | 89.3 Ų | 89.3 | 12% | 0.115 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -55.5 | -49.8 | -176.1 | -121.7 | 0 | 0 | 0 | 0 | 110.2 | P132 S135 A140 E141 I142 | P132-C138 PolarHBondContact O-SG 3.34Å; S135-C138 VanDerWaalsContact O-CB 3.25Å; S135-C138 WeakPolarHBondContact O-CB 3.34Å; S135-C138 PolarHBondContact O-N 3.18Å; S135-C138 PolarHBondContact OG-N 2.91Å; C138-A140 PolarHBondContact O-N 3.42Å; C138-E141 PolarHBondContact O-N 3.43Å; C138-E141 VanDerWaalsContact O-N 3.15Å; C138-I142 HydrophobicContact CB-CD1 4.31Å; C138-I142 WeakPolarHBondContact O-CD1 3.34Å; C138-I142 WeakPolarHBondContact O-CG1 3.42Å; C138-I142 PolarHBondContact O-N 3.32Å |
| 139 | S | 37.6 | Very low | 37.8 | Very low | 64 Ų | 64 | 95.8 Ų | 95.8 | 45% | 0.448 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -48.8 | -53.5 | 174.9 | 48.1 | 0 | 0 | 0 | 0 | 112.1 | N137 E141 I142 L143 | N137-S139 VanDerWaalsContact C-N 3.31Å; N137-S139 PolarHBondContact O-N 2.85Å; S139-E141 PolarHBondContact O-N 3.46Å; S139-I142 PolarHBondContact O-N 3.24Å; S139-L143 WeakPolarHBondContact O-CB 3.36Å; S139-L143 WeakPolarHBondContact O-CD1 3.3Å; S139-L143 WeakPolarHBondContact O-CG 3.35Å; S139-L143 PolarHBondContact O-N 3.21Å |
| 140 | A | 40.2 | Very low | 37.2 | Very low | 38 Ų | 38 | 91 Ų | 91 | 31% | 0.314 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -64.5 | -40.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | N137 C138 L143 K144 | N137-A140 PolarHBondContact O-N 3.13Å; N137-A140 VanDerWaalsContact O-N 3.14Å; C138-A140 PolarHBondContact O-N 3.42Å; A140-L143 PolarHBondContact O-N 3.38Å; A140-K144 VanDerWaalsContact O-CG 3.28Å; A140-K144 WeakPolarHBondContact O-CG 3.19Å; A140-K144 PolarHBondContact O-N 3Å |
| 141 | E | 39.7 | Very low | 36.6 | Very low | 64 Ų | 64 | 90.3 Ų | 90.3 | 30% | 0.299 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -64.1 | -39.1 | 175.7 | -83.2 | -70.7 | 122.1 | 0 | 0 | 112.5 | N137 C138 S139 K144 R145 | N137-E141 PolarHBondContact O-N 3.05Å; C138-E141 PolarHBondContact O-N 3.43Å; C138-E141 VanDerWaalsContact O-N 3.15Å; S139-E141 PolarHBondContact O-N 3.46Å; E141-K144 PolarHBondContact O-N 3.02Å; E141-K144 IonicContact OE1-NZ 2.91Å; E141-K144 PolarHBondContact OE1-NZ 2.97Å; E141-R145 WeakPolarHBondContact O-CG 3.42Å; E141-R145 PolarHBondContact O-N 3.1Å; E141-R145 IonicContact OE2-NH2 3.83Å |
| 142 | I | 41.1 | Very low | 35.9 | Very low | 0 Ų | 0 | 92 Ų | 92 | 0% | 0 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -67.5 | -41.3 | 175.9 | -60 | 144 | 0 | 0 | 0 | 110.2 | V120 L124 Y131 C138 S139 K144 R145 I146 | V120-I142 HydrophobicContact CG1-CB 4.35Å; V120-I142 HydrophobicContact CG1-CD1 4.15Å; V120-I142 HydrophobicContact CG1-CG2 4.02Å; L124-I142 HydrophobicContact CD1-CD1 3.29Å; L124-I142 HydrophobicContact CD2-CD1 3.06Å; L124-I142 HydrophobicContact CD2-CG1 3.75Å; L124-I142 HydrophobicContact CG-CD1 3.22Å; L124-I142 HydrophobicContact CG-CG1 4.21Å; Y131-I142 HydrophobicContact CD1-CD1 4.35Å; Y131-I142 HydrophobicContact CD1-CG1 3.4Å; Y131-I142 HydrophobicContact CD2-CG1 3.93Å; Y131-I142 HydrophobicContact CE1-CB 4Å; Y131-I142 HydrophobicContact CE1-CG1 3.23Å; Y131-I142 HydrophobicContact CE2-CG1 3.78Å; Y131-I142 HydrophobicContact CE2-CG2 4.39Å; Y131-I142 HydrophobicContact CG-CD1 4.41Å; Y131-I142 HydrophobicContact CG-CG1 3.75Å; Y131-I142 VanDerWaalsContact CZ-CG1 3.44Å; C138-I142 HydrophobicContact CB-CD1 4.31Å; C138-I142 WeakPolarHBondContact O-CD1 3.34Å; C138-I142 WeakPolarHBondContact O-CG1 3.42Å; C138-I142 PolarHBondContact O-N 3.32Å; S139-I142 PolarHBondContact O-N 3.24Å; I142-K144 VanDerWaalsContact C-N 3.29Å; I142-K144 PolarHBondContact O-N 3.44Å; I142-R145 CarbonylContact O-C 3.56Å; I142-R145 PolarHBondContact O-N 2.84Å; I142-I146 HydrophobicContact CG2-CD1 3.79Å; I142-I146 HydrophobicContact CG2-CG1 4.25Å; I142-I146 VanDerWaalsContact O-CG1 3.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.25Å; I142-I146 PolarHBondContact O-N 3.05Å |
| 143 | L | 40.9 | Very low | 35.2 | Very low | 35 Ų | 35 | 93.1 Ų | 93.1 | 18% | 0.183 | 49% | 0.488 | C | S | . | . | H | α-helix | trans | -65.5 | -33.3 | 178.6 | -69.8 | 172.1 | 0 | 0 | 0 | 112.4 | F116 V120 S139 A140 R145 I146 F154 | F116-L143 HydrophobicContact CD1-CD2 4.26Å; F116-L143 HydrophobicContact CE1-CD1 4.1Å; F116-L143 HydrophobicContact CE1-CD2 3.09Å; F116-L143 HydrophobicContact CE1-CG 4.23Å; F116-L143 HydrophobicContact CE2-CD2 4.27Å; F116-L143 HydrophobicContact CZ-CD2 3.09Å; V120-L143 HydrophobicContact CG2-CD2 3.61Å; V120-L143 HydrophobicContact CG2-CG 4.35Å; S139-L143 WeakPolarHBondContact O-CB 3.36Å; S139-L143 WeakPolarHBondContact O-CD1 3.3Å; S139-L143 WeakPolarHBondContact O-CG 3.35Å; S139-L143 PolarHBondContact O-N 3.21Å; A140-L143 PolarHBondContact O-N 3.38Å; L143-R145 VanDerWaalsContact C-N 3.27Å; L143-R145 PolarHBondContact O-N 3.36Å; L143-I146 HydrophobicContact CD2-CD1 4.15Å; L143-F154 HydrophobicContact CD1-CE1 4.38Å; L143-F154 HydrophobicContact CD1-CZ 3.86Å |
| 144 | K | 41.9 | Very low | 34.7 | Very low | 144 Ų | 144 | 89.6 Ų | 89.6 | 63% | 0.626 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -67.1 | -24.8 | 170.5 | -71.2 | 171.8 | -165.9 | 171.3 | 0 | 113.6 | A140 E141 I142 | A140-K144 VanDerWaalsContact O-CG 3.28Å; A140-K144 WeakPolarHBondContact O-CG 3.19Å; A140-K144 PolarHBondContact O-N 3Å; E141-K144 PolarHBondContact O-N 3.02Å; E141-K144 IonicContact OE1-NZ 2.91Å; E141-K144 PolarHBondContact OE1-NZ 2.97Å; I142-K144 VanDerWaalsContact C-N 3.29Å; I142-K144 PolarHBondContact O-N 3.44Å |
| 145 | R | 37.1 | Very low | 34.1 | Very low | 157 Ų | 157 | 87.2 Ų | 87.2 | 59% | 0.592 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -99.2 | -13 | -176.4 | -68.3 | -178.6 | -171.9 | -154.6 | 0.2 | 113.7 | E141 I142 L143 | E141-R145 WeakPolarHBondContact O-CG 3.42Å; E141-R145 PolarHBondContact O-N 3.1Å; E141-R145 IonicContact OE2-NH2 3.83Å; I142-R145 CarbonylContact O-C 3.56Å; I142-R145 PolarHBondContact O-N 2.84Å; L143-R145 VanDerWaalsContact C-N 3.27Å; L143-R145 PolarHBondContact O-N 3.36Å |
| 146 | I | 40.9 | Very low | 33.6 | Very low | 30 Ų | 30 | 91.7 Ų | 91.7 | 15% | 0.154 | 50% | 0.497 | C | S | . | . | S | Bend | trans | -73.4 | 126.3 | 174.7 | -74.2 | 165.2 | 0 | 0 | 0 | 108.7 | V120 I123 I142 L143 F148 | V120-I146 HydrophobicContact CG2-CD1 4.32Å; I123-I146 HydrophobicContact CD1-CD1 4.36Å; I142-I146 HydrophobicContact CG2-CD1 3.79Å; I142-I146 HydrophobicContact CG2-CG1 4.25Å; I142-I146 VanDerWaalsContact O-CG1 3.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.25Å; I142-I146 PolarHBondContact O-N 3.05Å; L143-I146 HydrophobicContact CD2-CD1 4.15Å; I146-F148 HydrophobicContact CG2-CB 4.24Å; I146-F148 HydrophobicContact CG2-CD2 3.41Å; I146-F148 VanDerWaalsContact CG2-CD2 3.41Å; I146-F148 HydrophobicContact CG2-CE2 4.19Å; I146-F148 HydrophobicContact CG2-CG 4.25Å; I146-F148 PolarHBondContact O-N 2.92Å |
| 147 | P | 33.6 | Very low | 33.3 | Very low | 80 Ų | 80 | 89.1 Ų | 89.1 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -75.7 | 29.6 | -169.8 | 31.4 | -37.5 | 0 | 0 | 0 | 114.5 | ||
| 148 | F | 35.1 | Very low | 32.8 | Very low | 83 Ų | 83 | 88.1 Ų | 88.1 | 36% | 0.364 | 49% | 0.487 | S | S | . | . | trans | -118.8 | 119.4 | -177.6 | -60.8 | -62.9 | 0 | 0 | 0 | 109.9 | M51 I146 M150 | M51-F148 HydrophobicContact CE-CD2 4.42Å; M51-F148 HydrophobicContact CE-CE2 3.66Å; M51-F148 HydrophobicContact CE-CZ 3.96Å; I146-F148 HydrophobicContact CG2-CB 4.24Å; I146-F148 HydrophobicContact CG2-CD2 3.41Å; I146-F148 VanDerWaalsContact CG2-CD2 3.41Å; I146-F148 HydrophobicContact CG2-CE2 4.19Å; I146-F148 HydrophobicContact CG2-CG 4.25Å; I146-F148 PolarHBondContact O-N 2.92Å; F148-M150 VanDerWaalsContact C-N 3.33Å; F148-M150 HydrophobicContact CB-CE 4Å; F148-M150 PolarHBondContact O-N 2.79Å | ||
| 149 | E | 27.9 | Very low | 32.5 | Very low | 175 Ų | 175 | 93.3 Ų | 93.3 | 82% | 0.818 | 52% | 0.521 | S | S | * | . | trans | -58.6 | 98.5 | 160.3 | -78.4 | -175.3 | 151.5 | 0 | 0 | 108.2 | ||||
| 150 | M | 30 | Very low | 32.1 | Very low | 77 Ų | 77 | 98 Ų | 98 | 38% | 0.379 | 54% | 0.54 | S | S | . | . | trans | -110.8 | 119.2 | 160.3 | -74.5 | 170.9 | -73.1 | 0 | 0 | 106.5 | F116 F148 L152 | F116-M150 HydrophobicContact CD2-CE 4.42Å; F116-M150 HydrophobicContact CD2-SD 4.05Å; F116-M150 HydrophobicContact CE1-CE 4.46Å; F116-M150 HydrophobicContact CE2-CE 3.26Å; F116-M150 HydrophobicContact CE2-SD 3.39Å; F116-M150 WeakPolarHBondContact CE2-SD 3.41Å; F116-M150 HydrophobicContact CZ-CE 3.26Å; F116-M150 HydrophobicContact CZ-SD 3.74Å; F148-M150 VanDerWaalsContact C-N 3.33Å; F148-M150 HydrophobicContact CB-CE 4Å; F148-M150 PolarHBondContact O-N 2.79Å; M150-L152 HydrophobicContact CB-CD1 3.9Å; M150-L152 HydrophobicContact CB-CD2 4.49Å; M150-L152 HydrophobicContact CB-CG 3.77Å; M150-L152 PolarHBondContact O-N 2.83Å | ||
| 151 | S | 25.8 | Very low | 31.4 | Very low | 127 Ų | 127 | 103.6 Ų | 103.6 | 89% | 0.888 | 56% | 0.564 | S | S | * | * | trans | -65 | 71.9 | 169.3 | -47.5 | 0 | 0 | 0 | 0 | 108.8 | S153 | S151-S153 PolarHBondContact O-N 3.49Š| ||
| 152 | L | 28 | Very low | 30.8 | Very low | 56 Ų | 56 | 109 Ų | 109 | 29% | 0.293 | 59% | 0.594 | S | S | . | * | trans | -87.9 | 109.7 | 179.2 | -70.4 | 164.2 | 0 | 0 | 0 | 107.9 | F116 M150 F154 | F116-L152 HydrophobicContact CD1-CD1 4.43Å; F116-L152 HydrophobicContact CE1-CD1 3.54Å; F116-L152 HydrophobicContact CE1-CD2 4.42Å; F116-L152 HydrophobicContact CZ-CD1 3.92Å; M150-L152 HydrophobicContact CB-CD1 3.9Å; M150-L152 HydrophobicContact CB-CD2 4.49Å; M150-L152 HydrophobicContact CB-CG 3.77Å; M150-L152 PolarHBondContact O-N 2.83Å; L152-F154 VanDerWaalsContact C-N 3.27Å; L152-F154 HydrophobicContact CB-CD2 3.79Å; L152-F154 HydrophobicContact CB-CE2 3.26Å; L152-F154 HydrophobicContact CB-CZ 3.75Å; L152-F154 HydrophobicContact CD1-CE2 3.83Å; L152-F154 HydrophobicContact CD1-CZ 3.76Å; L152-F154 HydrophobicContact CG-CE2 4.15Å; L152-F154 HydrophobicContact CG-CZ 4.28Å; L152-F154 WeakPolarHBondContact O-CD2 3.5Å; L152-F154 PolarHBondContact O-N 3.39Å | ||
| 153 | S | 24.1 | Very low | 30.1 | Very low | 121 Ų | 121 | 117.3 Ų | 117.3 | 85% | 0.846 | 63% | 0.633 | S | S | * | * | trans | -69.2 | 83.7 | 170.5 | -44 | 0 | 0 | 0 | 0 | 108.6 | S151 | S151-S153 PolarHBondContact O-N 3.49Š| ||
| 154 | F | 27.6 | Very low | 29.4 | Very low | 129 Ų | 129 | 123 Ų | 123 | 57% | 0.566 | 66% | 0.663 | S | S | * | * | trans | -78.2 | 128.3 | 172.3 | -71.4 | -75.5 | 0 | 0 | 0 | 109.5 | L143 L152 T156 | L143-F154 HydrophobicContact CD1-CE1 4.38Å; L143-F154 HydrophobicContact CD1-CZ 3.86Å; L152-F154 VanDerWaalsContact C-N 3.27Å; L152-F154 HydrophobicContact CB-CD2 3.79Å; L152-F154 HydrophobicContact CB-CE2 3.26Å; L152-F154 HydrophobicContact CB-CZ 3.75Å; L152-F154 HydrophobicContact CD1-CE2 3.83Å; L152-F154 HydrophobicContact CD1-CZ 3.76Å; L152-F154 HydrophobicContact CG-CE2 4.15Å; L152-F154 HydrophobicContact CG-CZ 4.28Å; L152-F154 WeakPolarHBondContact O-CD2 3.5Å; L152-F154 PolarHBondContact O-N 3.39Å; F154-T156 PolarHBondContact O-N 3.14Å; F154-T156 VanDerWaalsContact O-N 3.12Å | ||
| 155 | P | 24.9 | Very low | 28.5 | Very low | 108 Ų | 108 | 122.8 Ų | 122.8 | 70% | 0.701 | 67% | 0.674 | S | S | * | * | trans | -60.3 | 119.4 | 161.6 | 25.2 | -29.4 | 0 | 0 | 0 | 106.8 | T157 | P155-T157 VanDerWaalsContact C-N 3.28Å; P155-T157 PolarHBondContact O-N 3.48Å | ||
| 156 | T | 25.5 | Very low | 28 | Very low | 138 Ų | 138 | 120.8 Ų | 120.8 | 85% | 0.847 | 68% | 0.682 | S | S | * | * | trans | -58.8 | 93.1 | 171.5 | 35.4 | 0 | 0 | 0 | 0 | 108.5 | F154 T158 | F154-T156 PolarHBondContact O-N 3.14Å; F154-T156 VanDerWaalsContact O-N 3.12Å; T156-T158 PolarHBondContact O-N 3.46Å; T156-T158 VanDerWaalsContact O-N 3.15Å | ||
| 157 | T | 27.9 | Very low | 27.1 | Very low | 121 Ų | 121 | 125.3 Ų | 125.3 | 74% | 0.742 | 71% | 0.711 | S | S | * | * | trans | -66.8 | 111 | 161.1 | 48.5 | 0 | 0 | 0 | 0 | 106.2 | P155 | P155-T157 VanDerWaalsContact C-N 3.28Å; P155-T157 PolarHBondContact O-N 3.48Å | ||
| 158 | T | 25.9 | Very low | 26.6 | Very low | 86 Ų | 86 | 127.2 Ų | 127.2 | 53% | 0.528 | 72% | 0.724 | S | S | . | * | trans | -40.6 | 144.6 | 166.2 | 24.3 | 0 | 0 | 0 | 0 | 110.8 | T156 L160 F226 | T156-T158 PolarHBondContact O-N 3.46Å; T156-T158 VanDerWaalsContact O-N 3.15Å; T158-L160 PolarHBondContact O-N 3.37Å; T158-F226 HydrophobicContact CG2-CE1 4.26Å; T158-F226 HydrophobicContact CG2-CZ 4.12Å | ||
| 159 | P | 25.8 | Very low | 26 | Very low | 127 Ų | 127 | 128.2 Ų | 128.2 | 83% | 0.825 | 74% | 0.742 | S | S | * | * | trans | -61.1 | 107.9 | 179.4 | 26.2 | -30.6 | 0 | 0 | 0 | 107.7 | D161 | P159-D161 VanDerWaalsContact C-N 3.31Å; P159-D161 PolarHBondContact O-N 3.45Å | ||
| 160 | L | 30.7 | Very low | 25.9 | Very low | 163 Ų | 163 | 132.1 Ų | 132.1 | 85% | 0.853 | 75% | 0.749 | S | S | * | * | trans | -67.8 | 97.9 | 169.5 | -90.1 | 154.3 | 0 | 0 | 0 | 106.6 | T158 L162 | T158-L160 PolarHBondContact O-N 3.37Å; L160-L162 PolarHBondContact O-N 2.82Å | ||
| 161 | D | 25.2 | Very low | 25.6 | Very low | 155 Ų | 155 | 132.3 Ų | 132.3 | 83% | 0.829 | 76% | 0.763 | S | S | * | * | trans | -47.7 | 125 | 156.9 | -112.4 | -29.6 | 0 | 0 | 0 | 108.1 | P159 Q163 | P159-D161 VanDerWaalsContact C-N 3.31Å; P159-D161 PolarHBondContact O-N 3.45Å; D161-Q163 PolarHBondContact O-N 2.73Å | ||
| 162 | L | 27.1 | Very low | 25.4 | Very low | 176 Ų | 176 | 132 Ų | 132 | 92% | 0.921 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -63 | 87.7 | 174.1 | -81.6 | 140.4 | 0 | 0 | 0 | 109.9 | L160 | L160-L162 PolarHBondContact O-N 2.82Š|
| 163 | Q | 25.6 | Very low | 25.3 | Very low | 176 Ų | 176 | 137.3 Ų | 137.3 | 82% | 0.822 | 79% | 0.786 | S | S | * | * | trans | -143.7 | 133 | 153.8 | -67.7 | -163.4 | -1 | 0 | 0 | 109.6 | D161 | D161-Q163 PolarHBondContact O-N 2.73Š| ||
| 164 | D | 26.3 | Very low | 25.3 | Very low | 153 Ų | 153 | 136 Ų | 136 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | 80.2 | 80.1 | 172.1 | -55.7 | -24.1 | 0 | 0 | 0 | 118.3 | P166 | D164-P166 WeakPolarHBondContact O-CD 3.45Š| ||
| 165 | V | 23.2 | Very low | 25.2 | Very low | 141 Ų | 141 | 140.8 Ų | 140.8 | 86% | 0.855 | 79% | 0.791 | S | S | * | * | trans | -75.6 | 129.8 | 151.6 | 176.9 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 166 | P | 26.2 | Very low | 25.2 | Very low | 115 Ų | 115 | 142.1 Ų | 142.1 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | trans | -118.2 | 109.5 | 143.9 | 27.9 | -14.9 | 0 | 0 | 0 | 109.7 | D164 | D164-P166 WeakPolarHBondContact O-CD 3.45Š| ||
| 167 | T | 22.4 | Very low | 25.1 | Very low | 125 Ų | 125 | 141 Ų | 141 | 77% | 0.767 | 79% | 0.793 | S | S | * | * | trans | -0.6 | 121.4 | 143 | -25.1 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 168 | C | 23.2 | Very low | 24.8 | Very low | 119 Ų | 119 | 140.1 Ų | 140.1 | 80% | 0.804 | 79% | 0.791 | S | S | * | * | trans | -165.9 | 110.3 | 142.7 | -120.1 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 169 | S | 23.5 | Very low | 24.7 | Very low | 104 Ų | 104 | 145.3 Ų | 145.3 | 73% | 0.727 | 81% | 0.807 | S | S | * | * | trans | 35.7 | 106.1 | 136.7 | 65.7 | 0 | 0 | 0 | 0 | 119.3 | A171 | S169-A171 PolarHBondContact O-N 2.86Š| ||
| 170 | R | 25.3 | Very low | 24.6 | Very low | 257 Ų | 257 | 150 Ų | 150 | 97% | 0.97 | 81% | 0.808 | S | S | * | * | trans | -75.2 | 107.1 | 155.1 | -94.3 | 178.9 | 165.1 | 162.8 | -1.9 | 109.7 | ||||
| 171 | A | 23.5 | Very low | 24.3 | Very low | 82 Ų | 82 | 148.6 Ų | 148.6 | 68% | 0.678 | 80% | 0.802 | S | S | * | * | trans | -85.3 | 136.5 | 155.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | S169 | S169-A171 PolarHBondContact O-N 2.86Š| ||
| 172 | P | 22.6 | Very low | 24.2 | Very low | 119 Ų | 119 | 149.7 Ų | 149.7 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | trans | -85.6 | 120.3 | -179.7 | 32.8 | -28.1 | 0 | 0 | 0 | 109.1 | ||||
| 173 | L | 25.4 | Very low | 24.2 | Very low | 168 Ų | 168 | 147.7 Ų | 147.7 | 88% | 0.88 | 80% | 0.796 | S | S | * | * | trans | -110.8 | 92.3 | 171.1 | -82.4 | 166.3 | 0 | 0 | 0 | 111.3 | ||||
| 174 | S | 24.3 | Very low | 24 | Very low | 95 Ų | 95 | 145.2 Ų | 145.2 | 66% | 0.664 | 80% | 0.797 | S | S | * | * | trans | -40.2 | 138 | 147.7 | 43.2 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 175 | R | 24.8 | Very low | 24.1 | Very low | 228 Ų | 228 | 142.8 Ų | 142.8 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | 63.6 | 126.6 | 155.8 | -71.9 | -177.9 | 173.4 | 176.9 | -1.5 | 118.9 | V177 | R175-V177 PolarHBondContact O-N 3.48Š| ||
| 176 | P | 25.4 | Very low | 24.3 | Very low | 136 Ų | 136 | 145.9 Ų | 145.9 | 88% | 0.883 | 79% | 0.794 | S | S | * | * | trans | -78.5 | 119.4 | 169.7 | 32.7 | -29.5 | 0 | 0 | 0 | 109.8 | ||||
| 177 | V | 23.5 | Very low | 24.3 | Very low | 115 Ų | 115 | 149.5 Ų | 149.5 | 70% | 0.697 | 80% | 0.801 | S | S | * | * | trans | -105.5 | 121.7 | 168.3 | -178.2 | 0 | 0 | 0 | 0 | 107.4 | R175 F179 | R175-V177 PolarHBondContact O-N 3.48Å; V177-F179 HydrophobicContact CG1-CD2 3.7Å; V177-F179 HydrophobicContact CG1-CE2 3.59Å | ||
| 178 | S | 21.4 | Very low | 24.5 | Very low | 103 Ų | 103 | 149.4 Ų | 149.4 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -78.3 | 131.2 | 171.4 | 64.5 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 179 | F | 23.9 | Very low | 24.7 | Very low | 194 Ų | 194 | 147.4 Ų | 147.4 | 85% | 0.851 | 80% | 0.795 | S | S | * | * | trans | -144.6 | 127.9 | 151 | -83.4 | -73.8 | 0 | 0 | 0 | 110.7 | V177 | V177-F179 HydrophobicContact CG1-CD2 3.7Å; V177-F179 HydrophobicContact CG1-CE2 3.59Å | ||
| 180 | R | 22.7 | Very low | 24.8 | Very low | 227 Ų | 227 | 150.2 Ų | 150.2 | 86% | 0.857 | 80% | 0.802 | S | S | * | * | trans | -68.2 | 159.6 | 165.6 | -89.8 | -177.7 | 170.2 | 178.3 | -4.4 | 110.6 | ||||
| 181 | D | 25.4 | Very low | 24.9 | Very low | 133 Ų | 133 | 143.4 Ų | 143.4 | 71% | 0.711 | 79% | 0.793 | S | S | * | * | trans | 84.6 | 111.7 | 153.5 | -59.7 | -28.7 | 0 | 0 | 0 | 120 | ||||
| 182 | Q | 23.6 | Very low | 24.9 | Very low | 177 Ų | 177 | 146.7 Ų | 146.7 | 83% | 0.827 | 80% | 0.8 | S | S | * | * | trans | 29.4 | 128.4 | 130.6 | -61.6 | -177.6 | 0.1 | 0 | 0 | 118.2 | ||||
| 183 | V | 25.8 | Very low | 25 | Very low | 134 Ų | 134 | 145.5 Ų | 145.5 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | -179.6 | 125.8 | 117.1 | 159.8 | 0 | 0 | 0 | 0 | 109.5 | |||||
| 184 | C | 20.8 | Very low | 24.9 | Very low | 125 Ų | 125 | 148.7 Ų | 148.7 | 85% | 0.845 | 79% | 0.794 | S | S | * | * | trans | -74.2 | 140.5 | 166.4 | -76.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 185 | S | 28.4 | Very low | 25 | Very low | 102 Ų | 102 | 150.1 Ų | 150.1 | 71% | 0.713 | 80% | 0.803 | S | S | * | * | trans | -171.1 | 114.4 | 140.5 | 25 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 186 | K | 29 | Very low | 24.9 | Very low | 206 Ų | 206 | 149 Ų | 149 | 90% | 0.896 | 80% | 0.799 | S | S | * | * | trans | 57.2 | 112.3 | 130.9 | -59.2 | -176.9 | 178.9 | -179.9 | 0 | 121 | ||||
| 187 | Q | 25.4 | Very low | 24.8 | Very low | 190 Ų | 190 | 150.6 Ų | 150.6 | 89% | 0.888 | 79% | 0.787 | S | S | * | * | trans | -70.2 | 160.8 | 154.8 | -76 | -178.4 | -38.2 | 0 | 0 | 112.6 | ||||
| 188 | P | 27 | Very low | 24.9 | Very low | 123 Ų | 123 | 153.3 Ų | 153.3 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | -139.2 | 130 | 116.6 | 31.3 | -14.9 | 0 | 0 | 0 | 112.1 | |||||
| 189 | A | 26.2 | Very low | 25 | Very low | 78 Ų | 78 | 152.9 Ų | 152.9 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | 73 | 105.2 | 87.7 | 0 | 0 | 0 | 0 | 0 | 115 | |||||
| 190 | N | 25.8 | Very low | 25 | Very low | 162 Ų | 162 | 150 Ų | 150 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | 127.1 | 90.8 | 146.1 | -64.6 | -16 | 0 | 0 | 0 | 114.6 | ||||
| 191 | S | 28.3 | Very low | 25.1 | Very low | 114 Ų | 114 | 143.6 Ų | 143.6 | 80% | 0.797 | 78% | 0.78 | S | S | * | * | 178.8 | 127.5 | 128.4 | 55.5 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 192 | D | 23.9 | Very low | 25.1 | Very low | 151 Ų | 151 | 149.3 Ų | 149.3 | 81% | 0.807 | 79% | 0.791 | S | S | * | * | trans | 64.8 | 97.9 | 155.3 | -76.8 | -36.3 | 0 | 0 | 0 | 122.8 | ||||
| 193 | S | 24.3 | Very low | 25.1 | Very low | 94 Ų | 94 | 148 Ų | 148 | 66% | 0.657 | 79% | 0.785 | S | S | * | * | 47.4 | 91.1 | 118.2 | 74 | 0 | 0 | 0 | 0 | 119.2 | |||||
| 194 | R | 23.9 | Very low | 25 | Very low | 235 Ų | 235 | 145.8 Ų | 145.8 | 89% | 0.887 | 78% | 0.776 | S | S | * | * | S | Bend | 159.3 | 110.4 | 111.9 | -84.4 | 175 | -170.5 | -168.4 | 3.6 | 107.6 | |||
| 195 | C | 24.7 | Very low | 25 | Very low | 126 Ų | 126 | 144.5 Ų | 144.5 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | trans | 53.4 | 89.9 | 170.7 | -57.4 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 196 | R | 23.6 | Very low | 24.8 | Very low | 205 Ų | 205 | 146.7 Ų | 146.7 | 77% | 0.774 | 76% | 0.757 | S | S | * | * | 35.2 | 111.9 | 56.7 | -93.7 | -166.4 | 172.7 | 174.4 | 3.9 | 109.6 | |||||
| 197 | R | 24.3 | Very low | 24.5 | Very low | 168 Ų | 168 | 142.3 Ų | 142.3 | 63% | 0.634 | 74% | 0.743 | S | S | * | * | cis | 178.3 | 149.8 | 45.6 | -105.8 | 164 | -179.2 | 178.5 | -1.3 | 107 | ||||
| 198 | Q | 25.3 | Very low | 24.5 | Very low | 172 Ų | 172 | 137.6 Ų | 137.6 | 80% | 0.804 | 73% | 0.728 | S | S | * | * | trans | 65 | 121.5 | 144 | -63.2 | 161.9 | -26.5 | 0 | 0 | 115.7 | ||||
| 199 | S | 23.4 | Very low | 24.5 | Very low | 95 Ų | 95 | 139.2 Ų | 139.2 | 66% | 0.664 | 73% | 0.729 | S | S | * | * | cis | -162.4 | 119.6 | 17.9 | 40.9 | 0 | 0 | 0 | 0 | 105.8 | T201 | S199-T201 PolarHBondContact O-N 2.96Š| ||
| 200 | S | 23.7 | Very low | 24.5 | Very low | 133 Ų | 133 | 140.6 Ų | 140.6 | 93% | 0.93 | 74% | 0.735 | S | S | * | * | trans | -76.7 | 72 | 171.6 | 67.4 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 201 | T | 24.8 | Very low | 24.6 | Very low | 92 Ų | 92 | 135.1 Ų | 135.1 | 56% | 0.564 | 71% | 0.709 | S | S | * | * | trans | -117.3 | 81.7 | 164 | -20.5 | 0 | 0 | 0 | 0 | 105.3 | S199 Q203 | S199-T201 PolarHBondContact O-N 2.96Å; T201-Q203 HydrophobicContact CG2-CG 3.89Å; T201-Q203 PolarHBondContact O-N 2.88Å | ||
| 202 | R | 24.4 | Very low | 24.5 | Very low | 254 Ų | 254 | 139.2 Ų | 139.2 | 96% | 0.958 | 71% | 0.708 | S | S | * | * | trans | -70.7 | 72.8 | 154.9 | -88 | -173 | 169.1 | 176.7 | -2.5 | 106.5 | S204 | R202-S204 VanDerWaalsContact C-N 3.3Å; R202-S204 PolarHBondContact O-N 2.89Å; R202-S204 VanDerWaalsContact O-N 3.12Å | ||
| 203 | Q | 23.6 | Very low | 24.7 | Very low | 148 Ų | 148 | 135.3 Ų | 135.3 | 69% | 0.692 | 70% | 0.704 | S | S | * | * | trans | -62.7 | 103.3 | 152 | -87 | 172.6 | -10.8 | 0 | 0 | 104.9 | T201 V205 | T201-Q203 HydrophobicContact CG2-CG 3.89Å; T201-Q203 PolarHBondContact O-N 2.88Å; Q203-V205 HydrophobicContact CB-CG2 4Å; Q203-V205 PolarHBondContact O-N 2.64Å | ||
| 204 | S | 23.7 | Very low | 25 | Very low | 88 Ų | 88 | 137.9 Ų | 137.9 | 62% | 0.615 | 71% | 0.71 | S | S | * | * | trans | -60.1 | 87.7 | 150.3 | 48.6 | 0 | 0 | 0 | 0 | 106.1 | R202 Y206 | R202-S204 VanDerWaalsContact C-N 3.3Å; R202-S204 PolarHBondContact O-N 2.89Å; R202-S204 VanDerWaalsContact O-N 3.12Å; S204-Y206 VanDerWaalsContact C-N 3.27Å; S204-Y206 WeakPolarHBondContact O-CD2 3.38Å; S204-Y206 PolarHBondContact O-N 2.8Å | ||
| 205 | V | 21.9 | Very low | 25.3 | Very low | 98 Ų | 98 | 131 Ų | 131 | 59% | 0.594 | 69% | 0.69 | S | S | * | * | trans | -69.6 | 96.2 | 167.6 | 179.8 | 0 | 0 | 0 | 0 | 105.2 | Q203 L207 | Q203-V205 HydrophobicContact CB-CG2 4Å; Q203-V205 PolarHBondContact O-N 2.64Å; V205-L207 VanDerWaalsContact C-N 3.34Å; V205-L207 HydrophobicContact CG1-CD2 4.3Å; V205-L207 HydrophobicContact CG1-CG 4.25Å; V205-L207 PolarHBondContact O-N 3.21Å | ||
| 206 | Y | 22.7 | Very low | 25.4 | Very low | 149 Ų | 149 | 129.4 Ų | 129.4 | 58% | 0.584 | 68% | 0.681 | S | S | * | * | trans | -65.1 | 101 | 162.9 | -74.4 | -91.1 | 0 | 0 | 0 | 106.5 | S204 T208 | S204-Y206 VanDerWaalsContact C-N 3.27Å; S204-Y206 WeakPolarHBondContact O-CD2 3.38Å; S204-Y206 PolarHBondContact O-N 2.8Å; Y206-T208 VanDerWaalsContact C-N 3.31Å; Y206-T208 PolarHBondContact O-N 3.15Å | ||
| 207 | L | 22.7 | Very low | 25.6 | Very low | 113 Ų | 113 | 124 Ų | 124 | 59% | 0.592 | 67% | 0.672 | S | S | * | * | trans | -70.8 | 91.7 | 170.3 | -75.8 | 163.4 | 0 | 0 | 0 | 107.6 | V205 | V205-L207 VanDerWaalsContact C-N 3.34Å; V205-L207 HydrophobicContact CG1-CD2 4.3Å; V205-L207 HydrophobicContact CG1-CG 4.25Å; V205-L207 PolarHBondContact O-N 3.21Å | ||
| 208 | T | 25.2 | Very low | 25.8 | Very low | 92 Ų | 92 | 120.1 Ų | 120.1 | 56% | 0.564 | 67% | 0.667 | S | S | * | * | trans | -73.1 | 147.1 | 159.6 | 45.1 | 0 | 0 | 0 | 0 | 109 | Y206 S210 S211 | Y206-T208 VanDerWaalsContact C-N 3.31Å; Y206-T208 PolarHBondContact O-N 3.15Å; T208-S210 PolarHBondContact O-N 2.99Å; T208-S211 PolarHBondContact O-N 3.47Å; T208-S211 PolarHBondContact O-OG 3.48Å | ||
| 209 | D | 27.7 | Very low | 25.9 | Very low | 156 Ų | 156 | 117 Ų | 117 | 83% | 0.834 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -50.3 | -2.6 | -173.8 | -81.4 | -38 | 0 | 0 | 0 | 117 | ||
| 210 | S | 26.5 | Very low | 26.1 | Very low | 108 Ų | 108 | 117.6 Ų | 117.6 | 76% | 0.755 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.9 | 2.5 | 176 | 50.9 | 0 | 0 | 0 | 0 | 115.4 | T208 | T208-S210 PolarHBondContact O-N 2.99Š|
| 211 | S | 27.1 | Very low | 26.4 | Very low | 47 Ų | 47 | 118.5 Ų | 118.5 | 33% | 0.329 | 64% | 0.641 | S | S | . | * | trans | -106.3 | 0.5 | -167 | -38.2 | 0 | 0 | 0 | 0 | 116 | T208 G213 | T208-S211 PolarHBondContact O-N 3.47Å; T208-S211 PolarHBondContact O-OG 3.48Å; S211-G213 PolarHBondContact O-N 3.34Å; S211-G213 VanDerWaalsContact O-N 3.1Å | ||
| 212 | Y | 26.8 | Very low | 26.4 | Very low | 199 Ų | 199 | 117.5 Ų | 117.5 | 78% | 0.78 | 64% | 0.637 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -1.4 | -166.7 | -106.1 | -91.3 | 0 | 0 | 0 | 116.3 | ||
| 213 | G | 28.4 | Very low | 26.4 | Very low | 70 Ų | 70 | 109 Ų | 109 | 72% | 0.722 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.1 | -12.9 | -172 | 0 | 0 | 0 | 0 | 0 | 117.4 | S211 | S211-G213 PolarHBondContact O-N 3.34Å; S211-G213 VanDerWaalsContact O-N 3.1Å |
| 214 | N | 31.3 | Very low | 26.7 | Very low | 148 Ų | 148 | 107.6 Ų | 107.6 | 79% | 0.791 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -120.9 | 10.4 | -163.8 | -82.6 | -13 | 0 | 0 | 0 | 116.4 | ||
| 215 | L | 28.9 | Very low | 27 | Very low | 89 Ų | 89 | 110 Ų | 110 | 47% | 0.466 | 61% | 0.609 | S | S | . | * | trans | -91.7 | -0.2 | -176 | -82.3 | 160.4 | 0 | 0 | 0 | 115.5 | V218 | L215-V218 PolarHBondContact O-N 3.12Š| ||
| 216 | S | 28.2 | Very low | 27.3 | Very low | 93 Ų | 93 | 111.3 Ų | 111.3 | 65% | 0.65 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -63.6 | -32.6 | -173.8 | -154.7 | 0 | 0 | 0 | 0 | 116.3 | ||
| 217 | P | 27.9 | Very low | 27.5 | Very low | 91 Ų | 91 | 108 Ų | 108 | 59% | 0.591 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -88.2 | -10.4 | -178.9 | 30.3 | -30.4 | 0 | 0 | 0 | 114.9 | ||
| 218 | V | 27.5 | Very low | 27.9 | Very low | 87 Ų | 87 | 107 Ų | 107 | 53% | 0.527 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -88.1 | -26.4 | -179.5 | -179.5 | 0 | 0 | 0 | 0 | 111.6 | L215 | L215-V218 PolarHBondContact O-N 3.12Å |
| 219 | L | 27.5 | Very low | 28.1 | Very low | 106 Ų | 106 | 108.4 Ų | 108.4 | 56% | 0.555 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -76 | -32.8 | 177.6 | -71 | 165.4 | 0 | 0 | 0 | 112.5 | Q221 C222 D223 | L219-Q221 VanDerWaalsContact C-N 3.29Å; L219-Q221 PolarHBondContact O-N 3.46Å; L219-C222 PolarHBondContact O-N 3.4Å; L219-D223 PolarHBondContact O-N 3.25Å |
| 220 | D | 26.8 | Very low | 28.1 | Very low | 108 Ų | 108 | 110.6 Ų | 110.6 | 58% | 0.578 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -70.9 | -19.8 | 178.8 | -80.8 | -21.7 | 0 | 0 | 0 | 113.9 | N224 | D220-N224 PolarHBondContact O-ND2 3.2Å; D220-N224 VanDerWaalsContact O-ND2 3.16Å |
| 221 | Q | 29.7 | Very low | 28.4 | Very low | 152 Ų | 152 | 113 Ų | 113 | 71% | 0.71 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -78.5 | -30.5 | 173.7 | -99.6 | 177 | -3.1 | 0 | 0 | 112.8 | L219 | L219-Q221 VanDerWaalsContact C-N 3.29Å; L219-Q221 PolarHBondContact O-N 3.46Å |
| 222 | C | 25.3 | Very low | 28.4 | Very low | 71 Ų | 71 | 120.7 Ų | 120.7 | 48% | 0.48 | 62% | 0.624 | S | S | . | * | H | α-helix | trans | -78.7 | -31.1 | -179.7 | -69.5 | 0 | 0 | 0 | 0 | 113 | L219 N224 | L219-C222 PolarHBondContact O-N 3.4Å; C222-N224 VanDerWaalsContact C-N 3.32Å; C222-N224 PolarHBondContact O-N 2.91Å |
| 223 | D | 25.6 | Very low | 28.5 | Very low | 77 Ų | 77 | 115.8 Ų | 115.8 | 41% | 0.412 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.8 | -23.5 | 179.5 | -82.5 | -15.1 | 0 | 0 | 0 | 113.1 | N2 L219 S227 | N2-D223 PolarHBondContact ND2-OD2 3.38Å; L219-D223 PolarHBondContact O-N 3.25Å; D223-S227 PolarHBondContact O-OG 3.38Å |
| 224 | N | 29.1 | Very low | 28.4 | Very low | 118 Ų | 118 | 118.2 Ų | 118.2 | 63% | 0.631 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -80.4 | -26.4 | 176.7 | -81 | -48.1 | 0 | 0 | 0 | 113.7 | D220 C222 | D220-N224 PolarHBondContact O-ND2 3.2Å; D220-N224 VanDerWaalsContact O-ND2 3.16Å; C222-N224 VanDerWaalsContact C-N 3.32Å; C222-N224 PolarHBondContact O-N 2.91Å |
| 225 | E | 30.6 | Very low | 28.3 | Very low | 138 Ų | 138 | 120.2 Ų | 120.2 | 65% | 0.645 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -79.2 | -28.8 | 176.4 | -73.1 | -172.4 | 160.5 | 0 | 0 | 112.9 | T228 | E225-T228 PolarHBondContact O-OG1 2.89Å |
| 226 | F | 28.5 | Very low | 28.4 | Very low | 125 Ų | 125 | 125.3 Ų | 125.3 | 55% | 0.548 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -72.8 | -29.7 | 175.9 | -97 | -85.5 | 0 | 0 | 0 | 113.9 | T158 | T158-F226 HydrophobicContact CG2-CE1 4.26Å; T158-F226 HydrophobicContact CG2-CZ 4.12Å |
| 227 | S | 26.6 | Very low | 28.3 | Very low | 80 Ų | 80 | 131.5 Ų | 131.5 | 56% | 0.559 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -71.7 | -30.6 | -179.1 | -66.1 | 0 | 0 | 0 | 0 | 112.8 | D223 | D223-S227 PolarHBondContact O-OG 3.38Å |
| 228 | T | 31.6 | Very low | 28.1 | Very low | 93 Ų | 93 | 131.8 Ų | 131.8 | 57% | 0.571 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -80.9 | -20.4 | 179.7 | 55.7 | 0 | 0 | 0 | 0 | 113.8 | E225 | E225-T228 PolarHBondContact O-OG1 2.89Å |
| 229 | M | 27.6 | Very low | 28 | Very low | 121 Ų | 121 | 136.6 Ų | 136.6 | 60% | 0.596 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -80.1 | -32.2 | 176.5 | -120.5 | -177.1 | -70.3 | 0 | 0 | 112.7 | R232 S233 | M229-R232 PolarHBondContact O-N 2.8Å; M229-S233 PolarHBondContact O-N 2.78Å; M229-S233 PolarHBondContact O-OG 3.36Å |
| 230 | R | 29.5 | Very low | 27.7 | Very low | 201 Ų | 201 | 140.7 Ų | 140.7 | 76% | 0.758 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -73.9 | -29 | -175.8 | -145.3 | 175.2 | -173.8 | -176.9 | 1.4 | 113.4 | ||
| 231 | E | 31.9 | Very low | 27.6 | Very low | 158 Ų | 158 | 142.9 Ų | 142.9 | 74% | 0.738 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -74.9 | -23.5 | 173 | -81.3 | -171.8 | 151.5 | 0 | 0 | 113.7 | ||
| 232 | R | 27.1 | Very low | 27.4 | Very low | 210 Ų | 210 | 140.1 Ų | 140.1 | 79% | 0.792 | 69% | 0.689 | S | S | * | * | H | α-helix | trans | -80.7 | -28.2 | 177 | -77.3 | -178.7 | 173.8 | 175.9 | -0.4 | 113.3 | M229 | M229-R232 PolarHBondContact O-N 2.8Å |
| 233 | S | 28.4 | Very low | 27.3 | Very low | 95 Ų | 95 | 145.2 Ų | 145.2 | 66% | 0.664 | 71% | 0.71 | S | S | * | * | H | α-helix | trans | -85.2 | -17.4 | -178.6 | -57.6 | 0 | 0 | 0 | 0 | 114.4 | M229 K235 | M229-S233 PolarHBondContact O-N 2.78Å; M229-S233 PolarHBondContact O-OG 3.36Å; S233-K235 VanDerWaalsContact C-N 3.34Å |
| 234 | L | 27.1 | Very low | 27.3 | Very low | 122 Ų | 122 | 150.5 Ų | 150.5 | 64% | 0.639 | 73% | 0.732 | S | S | * | * | G | 310 helix | trans | -80.9 | -11 | 175.8 | -84.4 | 156.6 | 0 | 0 | 0 | 113.9 | ||
| 235 | K | 28.9 | Very low | 27.1 | Very low | 190 Ų | 190 | 154.6 Ų | 154.6 | 83% | 0.826 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -91.1 | 5.7 | -177.4 | -115.9 | 177.1 | -178.7 | 176.4 | 0 | 115.6 | S233 | S233-K235 VanDerWaalsContact C-N 3.34Š|
| 236 | K | 31.5 | Very low | 26.9 | Very low | 195 Ų | 195 | 150.9 Ų | 150.9 | 85% | 0.848 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -111.6 | 17 | 178.8 | -80.4 | -171 | 175.3 | -176.7 | 0 | 115.1 | S238 | K236-S238 PolarHBondContact O-N 3.43Š|
| 237 | R | 24.9 | Very low | 26.6 | Very low | 224 Ų | 224 | 155.6 Ų | 155.6 | 85% | 0.845 | 76% | 0.762 | S | S | * | * | trans | -93.9 | 86.2 | 170.6 | -83.1 | -175.9 | 175.4 | 178.4 | -1.6 | 111 | ||||
| 238 | S | 24.1 | Very low | 26.4 | Very low | 96 Ų | 96 | 162.3 Ų | 162.3 | 67% | 0.671 | 78% | 0.781 | S | S | * | * | trans | -175 | 60.5 | 159.9 | 59 | 0 | 0 | 0 | 0 | 112 | K236 | K236-S238 PolarHBondContact O-N 3.43Š| ||
| 239 | H | 25.4 | Very low | 26.1 | Very low | 189 Ų | 189 | 163.3 Ų | 163.3 | 88% | 0.875 | 79% | 0.792 | S | S | * | * | trans | -141.3 | 108.2 | 156.9 | -81.8 | -63.7 | 0 | 0 | 0 | 110.1 | ||||
| 240 | Q | 22.5 | Very low | 25.9 | Very low | 192 Ų | 192 | 162 Ų | 162 | 90% | 0.897 | 80% | 0.795 | S | S | * | * | trans | -81.1 | 120.4 | 172.8 | 178.9 | -178.4 | 9.1 | 0 | 0 | 107.9 | ||||
| 241 | L | 24.2 | Very low | 25.6 | Very low | 153 Ų | 153 | 158.1 Ų | 158.1 | 80% | 0.801 | 80% | 0.796 | S | S | * | * | trans | -147.3 | 88.9 | 168.5 | -87.5 | 154.8 | 0 | 0 | 0 | 105.5 | ||||
| 242 | S | 25.3 | Very low | 25.3 | Very low | 95 Ų | 95 | 158.6 Ų | 158.6 | 66% | 0.664 | 80% | 0.803 | S | S | * | * | 58.3 | 103.9 | 94.1 | 65.4 | 0 | 0 | 0 | 0 | 113.5 | E244 | S242-E244 PolarHBondContact O-N 3.32Š| |||
| 243 | L | 22.9 | Very low | 25.2 | Very low | 177 Ų | 177 | 156.1 Ų | 156.1 | 93% | 0.927 | 80% | 0.8 | S | S | * | * | trans | -47.6 | 122 | 164.5 | -125.9 | 82.7 | 0 | 0 | 0 | 110.5 | ||||
| 244 | E | 26.1 | Very low | 25.1 | Very low | 189 Ų | 189 | 156.5 Ų | 156.5 | 88% | 0.883 | 80% | 0.801 | S | S | * | * | trans | -131.7 | 130.7 | 153.4 | -83.3 | -162.8 | 160.7 | 0 | 0 | 108.8 | S242 | S242-E244 PolarHBondContact O-N 3.32Š| ||
| 245 | E | 25.4 | Very low | 25.1 | Very low | 203 Ų | 203 | 157.1 Ų | 157.1 | 95% | 0.949 | 80% | 0.801 | S | S | * | * | trans | -63.4 | 124.9 | -177.2 | -64.1 | 165 | 143.2 | 0 | 0 | 110.8 | ||||
| 246 | G | 25 | Very low | 25 | Very low | 60 Ų | 60 | 158.1 Ų | 158.1 | 62% | 0.619 | 80% | 0.8 | S | S | * | * | trans | -171.9 | 98.5 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 247 | Y | 23.3 | Very low | 24.9 | Very low | 225 Ų | 225 | 155.6 Ų | 155.6 | 88% | 0.882 | 79% | 0.791 | S | S | * | * | trans | 71.1 | 72.6 | 159.2 | -64.7 | -90.4 | 0 | 0 | 0 | 118.2 | ||||
| 248 | F | 22.7 | Very low | 25.1 | Very low | 220 Ų | 220 | 149.8 Ų | 149.8 | 97% | 0.965 | 78% | 0.782 | S | S | * | * | trans | -99 | 97.5 | 138.1 | -77.7 | -83.3 | 0 | 0 | 0 | 107.6 | S250 | F248-S250 PolarHBondContact O-N 2.94Š| ||
| 249 | S | 23.9 | Very low | 25.5 | Very low | 114 Ų | 114 | 152.9 Ų | 152.9 | 80% | 0.797 | 79% | 0.786 | S | S | * | * | trans | -65.4 | 117.1 | 166.5 | 38.4 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 250 | S | 22.8 | Very low | 25.7 | Very low | 94 Ų | 94 | 150.1 Ų | 150.1 | 66% | 0.657 | 78% | 0.783 | S | S | * | * | trans | -3.7 | 140.4 | 167.7 | -168.5 | 0 | 0 | 0 | 0 | 117.3 | F248 L252 | F248-S250 PolarHBondContact O-N 2.94Å; S250-L252 PolarHBondContact O-N 3.27Å | ||
| 251 | P | 24.7 | Very low | 26 | Very low | 120 Ų | 120 | 151.2 Ų | 151.2 | 78% | 0.779 | 78% | 0.78 | S | S | * | * | trans | -54.2 | 113.9 | 165.2 | 26 | -32.3 | 0 | 0 | 0 | 107.8 | E253 | P251-E253 PolarHBondContact O-N 3.35Š| ||
| 252 | L | 24.7 | Very low | 26.3 | Very low | 167 Ų | 167 | 151.3 Ų | 151.3 | 87% | 0.874 | 78% | 0.781 | S | S | * | * | trans | -58.9 | 122 | 176 | -88.2 | 153.8 | 0 | 0 | 0 | 107.7 | S250 C254 | S250-L252 PolarHBondContact O-N 3.27Å; L252-C254 PolarHBondContact O-N 3.33Å; L252-C254 VanDerWaalsContact O-N 3.13Å | ||
| 253 | E | 24.8 | Very low | 26.5 | Very low | 159 Ų | 159 | 152.7 Ų | 152.7 | 74% | 0.743 | 78% | 0.781 | S | S | * | * | trans | -51.2 | 114.4 | 175.6 | -68.2 | 176.5 | 153.8 | 0 | 0 | 109.7 | P251 Q255 | P251-E253 PolarHBondContact O-N 3.35Å; E253-Q255 VanDerWaalsContact C-N 3.32Å; E253-Q255 PolarHBondContact O-N 3.24Å | ||
| 254 | C | 26.2 | Very low | 26.7 | Very low | 102 Ų | 102 | 150.2 Ų | 150.2 | 69% | 0.689 | 78% | 0.776 | S | S | * | * | trans | -65.5 | 96.8 | 162.7 | -70.9 | 0 | 0 | 0 | 0 | 107.7 | L252 W256 | L252-C254 PolarHBondContact O-N 3.33Å; L252-C254 VanDerWaalsContact O-N 3.13Å; C254-W256 PolarHBondContact O-N 3.25Å | ||
| 255 | Q | 27.8 | Very low | 26.8 | Very low | 135 Ų | 135 | 147.8 Ų | 147.8 | 63% | 0.631 | 77% | 0.768 | S | S | * | * | trans | -75.1 | 122.9 | 171 | -74.6 | -174.3 | -1.2 | 0 | 0 | 109.6 | E253 H257 | E253-Q255 VanDerWaalsContact C-N 3.32Å; E253-Q255 PolarHBondContact O-N 3.24Å; Q255-H257 PolarHBondContact O-N 3.34Å | ||
| 256 | W | 26.7 | Very low | 26.8 | Very low | 212 Ų | 212 | 142.1 Ų | 142.1 | 80% | 0.803 | 76% | 0.764 | S | S | * | * | trans | -64.7 | 113.4 | 170.2 | -109.7 | 83 | 0 | 0 | 0 | 109.4 | C254 | C254-W256 PolarHBondContact O-N 3.25Š| ||
| 257 | H | 30.2 | Very low | 27.1 | Very low | 141 Ų | 141 | 147.3 Ų | 147.3 | 65% | 0.653 | 77% | 0.773 | S | S | * | * | trans | -112.2 | 106.5 | 167.8 | -82.6 | -54.9 | 0 | 0 | 0 | 110.2 | Q255 E259 | Q255-H257 PolarHBondContact O-N 3.34Å; H257-E259 VanDerWaalsContact C-N 3.26Å; H257-E259 PolarHBondContact O-N 2.92Å | ||
| 258 | P | 28 | Very low | 27.3 | Very low | 103 Ų | 103 | 147 Ų | 147 | 67% | 0.669 | 78% | 0.776 | S | S | * | * | trans | -73.9 | 85.5 | 166.2 | 29.6 | -30.1 | 0 | 0 | 0 | 108.3 | T260 | P258-T260 PolarHBondContact O-N 3.29Š| ||
| 259 | E | 34.1 | Very low | 27.6 | Very low | 161 Ų | 161 | 142.4 Ų | 142.4 | 75% | 0.752 | 77% | 0.766 | S | S | * | * | trans | -72.2 | 112.7 | 167.5 | -79 | -167.8 | 165.4 | 0 | 0 | 109.3 | H257 Y261 | H257-E259 VanDerWaalsContact C-N 3.26Å; H257-E259 PolarHBondContact O-N 2.92Å; E259-Y261 PolarHBondContact O-N 3.34Å | ||
| 260 | T | 27.6 | Very low | 27.6 | Very low | 131 Ų | 131 | 145.7 Ų | 145.7 | 80% | 0.804 | 77% | 0.771 | S | S | * | * | trans | -69.9 | 103.5 | 177.9 | 14.8 | 0 | 0 | 0 | 0 | 108.2 | P258 D262 | P258-T260 PolarHBondContact O-N 3.29Å; T260-D262 PolarHBondContact O-N 3.21Å; T260-D262 VanDerWaalsContact O-N 3.1Å | ||
| 261 | Y | 29.3 | Very low | 27.8 | Very low | 214 Ų | 214 | 146.3 Ų | 146.3 | 84% | 0.839 | 77% | 0.772 | S | S | * | * | trans | -73.1 | 101.3 | 161.5 | -85.5 | -91.4 | 0 | 0 | 0 | 107.7 | E259 N263 | E259-Y261 PolarHBondContact O-N 3.34Å; Y261-N263 PolarHBondContact O-N 2.76Å | ||
| 262 | D | 30.2 | Very low | 27.9 | Very low | 155 Ų | 155 | 143.8 Ų | 143.8 | 83% | 0.829 | 77% | 0.769 | S | S | * | * | trans | -49.3 | 100.3 | 164 | -83.5 | -35.8 | 0 | 0 | 0 | 108.5 | T260 P264 | T260-D262 PolarHBondContact O-N 3.21Å; T260-D262 VanDerWaalsContact O-N 3.1Å; D262-P264 WeakPolarHBondContact O-CD 3.22Å | ||
| 263 | N | 29.4 | Very low | 28 | Very low | 124 Ų | 124 | 143.5 Ų | 143.5 | 66% | 0.663 | 77% | 0.768 | S | S | * | * | trans | -89.7 | 106.1 | 170.1 | -156.4 | -2.2 | 0 | 0 | 0 | 106.7 | Y261 L265 | Y261-N263 PolarHBondContact O-N 2.76Å; N263-L265 PolarHBondContact O-N 3.42Å | ||
| 264 | P | 27.2 | Very low | 28.1 | Very low | 126 Ų | 126 | 140.3 Ų | 140.3 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -69.4 | 10.4 | -177 | 28.1 | -35 | 0 | 0 | 0 | 114 | D262 | D262-P264 WeakPolarHBondContact O-CD 3.22Š|
| 265 | L | 28.7 | Very low | 28.2 | Very low | 137 Ų | 137 | 140.2 Ų | 140.2 | 72% | 0.717 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -112 | 90.8 | 176 | -76.7 | 153.5 | 0 | 0 | 0 | 108.3 | N263 E267 | N263-L265 PolarHBondContact O-N 3.42Å; L265-E267 PolarHBondContact O-N 2.92Å |
| 266 | G | 25.9 | Very low | 28.1 | Very low | 84 Ų | 84 | 135.4 Ų | 135.4 | 87% | 0.866 | 75% | 0.75 | S | S | * | * | trans | -64.9 | 63.1 | -174.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 267 | E | 30.7 | Very low | 28.1 | Very low | 170 Ų | 170 | 129.7 Ų | 129.7 | 79% | 0.794 | 74% | 0.739 | S | S | * | * | trans | -105.9 | 106.8 | 167 | -75.6 | -171 | 163.5 | 0 | 0 | 110.6 | L265 T269 | L265-E267 PolarHBondContact O-N 2.92Å; E267-T269 PolarHBondContact O-N 3.05Å; E267-T269 PolarHBondContact O-OG1 3Å | ||
| 268 | K | 27.5 | Very low | 27.8 | Very low | 219 Ų | 219 | 125.9 Ų | 125.9 | 95% | 0.952 | 73% | 0.727 | S | S | * | * | trans | -55.4 | 91.6 | 173 | -68.8 | 174.8 | 176.1 | 176.1 | 0 | 110.5 | ||||
| 269 | T | 29 | Very low | 27.7 | Very low | 123 Ų | 123 | 124.5 Ų | 124.5 | 76% | 0.755 | 72% | 0.717 | S | S | * | * | trans | -121 | 118.3 | 166 | 41.2 | 0 | 0 | 0 | 0 | 108.5 | E267 | E267-T269 PolarHBondContact O-N 3.05Å; E267-T269 PolarHBondContact O-OG1 3Å | ||
| 270 | M | 25.1 | Very low | 27.4 | Very low | 182 Ų | 182 | 119.8 Ų | 119.8 | 90% | 0.897 | 70% | 0.701 | S | S | * | * | trans | -58.1 | 143.1 | 176.4 | -67.2 | -160.1 | -174.8 | 0 | 0 | 110.2 | G272 | M270-G272 VanDerWaalsContact C-N 3.31Å; M270-G272 PolarHBondContact O-N 3.44Å | ||
| 271 | P | 26.4 | Very low | 27.3 | Very low | 107 Ų | 107 | 118.8 Ų | 118.8 | 70% | 0.695 | 69% | 0.689 | S | S | * | * | trans | -77.8 | 83.3 | -177.4 | 32.3 | -32 | 0 | 0 | 0 | 109.5 | N273 | P271-N273 PolarHBondContact O-N 3.37Š| ||
| 272 | G | 27.1 | Very low | 27.1 | Very low | 68 Ų | 68 | 114.7 Ų | 114.7 | 70% | 0.701 | 68% | 0.678 | S | S | * | * | S | Bend | trans | -77.1 | 1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 114.2 | M270 | M270-G272 VanDerWaalsContact C-N 3.31Å; M270-G272 PolarHBondContact O-N 3.44Å |
| 273 | N | 27 | Very low | 26.8 | Very low | 161 Ų | 161 | 112.9 Ų | 112.9 | 86% | 0.861 | 68% | 0.678 | S | S | * | * | trans | -161.5 | 75 | 178.4 | -80.8 | -35.6 | 0 | 0 | 0 | 107.8 | P271 | P271-N273 PolarHBondContact O-N 3.37Š| ||
| 274 | S | 25.7 | Very low | 26.6 | Very low | 92 Ų | 92 | 111 Ų | 111 | 64% | 0.643 | 67% | 0.67 | S | S | * | * | trans | -91.4 | 99 | 166.9 | 50.4 | 0 | 0 | 0 | 0 | 107.9 | G276 | S274-G276 PolarHBondContact O-N 3.08Š| ||
| 275 | S | 28.1 | Very low | 26.4 | Very low | 99 Ų | 99 | 114.3 Ų | 114.3 | 69% | 0.692 | 68% | 0.675 | S | S | * | * | trans | -66.1 | 99.1 | 166.1 | 53.1 | 0 | 0 | 0 | 0 | 107.4 | V277 | S275-V277 PolarHBondContact O-N 3.42Å; S275-V277 VanDerWaalsContact O-N 3.13Å | ||
| 276 | G | 25.7 | Very low | 26.2 | Very low | 34 Ų | 34 | 110.2 Ų | 110.2 | 35% | 0.351 | 67% | 0.666 | S | S | . | * | trans | -65.5 | 108.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | S274 C278 | S274-G276 PolarHBondContact O-N 3.08Å; G276-C278 PolarHBondContact O-N 3.46Å | ||
| 277 | V | 26.2 | Very low | 26.1 | Very low | 93 Ų | 93 | 115.1 Ų | 115.1 | 56% | 0.564 | 67% | 0.667 | S | S | * | * | trans | -82.4 | 105.9 | 171.1 | -177.2 | 0 | 0 | 0 | 0 | 106.5 | S275 T279 | S275-V277 PolarHBondContact O-N 3.42Å; S275-V277 VanDerWaalsContact O-N 3.13Å; V277-T279 HydrophobicContact CG1-CG2 4.04Å; V277-T279 PolarHBondContact O-N 3.24Å | ||
| 278 | C | 25.2 | Very low | 25.7 | Very low | 60 Ų | 60 | 114.3 Ų | 114.3 | 41% | 0.405 | 66% | 0.662 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -76.9 | 108.7 | 167.1 | -145.3 | 0 | 0 | 0 | 0 | 107.1 | G276 C294 | G276-C278 PolarHBondContact O-N 3.46Å; C278-C294 HydrophobicContact CB-CB 3.98Å; C278-C294 PolarHBondContact O-N 2.63Å |
| 279 | T | 26.5 | Very low | 25.4 | Very low | 74 Ų | 74 | 114.3 Ų | 114.3 | 45% | 0.454 | 66% | 0.656 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -91.2 | 105.4 | 171.8 | 41.9 | 0 | 0 | 0 | 0 | 109.6 | V277 I281 A291 F292 | V277-T279 HydrophobicContact CG1-CG2 4.04Å; V277-T279 PolarHBondContact O-N 3.24Å; T279-I281 PolarHBondContact O-N 3.46Å; T279-A291 HydrophobicContact CG2-CB 4.35Å; T279-F292 WeakPolarHBondContact CA-O 3.31Å |
| 280 | C | 26.3 | Very low | 25.1 | Very low | 62 Ų | 62 | 112.8 Ų | 112.8 | 42% | 0.419 | 64% | 0.643 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -78.1 | 109.5 | 163.2 | -64.8 | 0 | 0 | 0 | 0 | 107.8 | E282 | C280-E282 PolarHBondContact O-N 2.93Å |
| 281 | I | 25.8 | Very low | 25 | Very low | 110 Ų | 110 | 108 Ų | 108 | 56% | 0.564 | 63% | 0.633 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.9 | 101.2 | 176.1 | -58.3 | 173.9 | 0 | 0 | 0 | 107.3 | T279 W289 | T279-I281 PolarHBondContact O-N 3.46Å; I281-W289 HydrophobicContact CG2-CE3 3.84Å; I281-W289 HydrophobicContact CG2-CZ3 3.86Å |
| 282 | E | 25.6 | Very low | 24.9 | Very low | 128 Ų | 128 | 107.9 Ų | 107.9 | 60% | 0.598 | 62% | 0.622 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -81.5 | 113.9 | 161.8 | -88.6 | -174.5 | 156.8 | 0 | 0 | 108.5 | C280 V284 | C280-E282 PolarHBondContact O-N 2.93Å; E282-V284 HydrophobicContact CB-CG2 4.46Å; E282-V284 PolarHBondContact O-N 3.21Å; E282-V284 VanDerWaalsContact O-N 3.13Å |
| 283 | S | 24 | Very low | 24.7 | Very low | 117 Ų | 117 | 107.6 Ų | 107.6 | 82% | 0.818 | 62% | 0.618 | S | S | * | * | trans | -70.4 | 97.3 | 164.8 | 159.3 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 284 | V | 24.4 | Very low | 24.5 | Very low | 84 Ų | 84 | 103.3 Ų | 103.3 | 51% | 0.509 | 60% | 0.6 | S | S | . | * | trans | -94.4 | 127.2 | 165.4 | -172.2 | 0 | 0 | 0 | 0 | 107.3 | E282 G286 | E282-V284 HydrophobicContact CB-CG2 4.46Å; E282-V284 PolarHBondContact O-N 3.21Å; E282-V284 VanDerWaalsContact O-N 3.13Å; V284-G286 PolarHBondContact O-N 3.13Å; V284-G286 VanDerWaalsContact O-N 3.17Å | ||
| 285 | E | 24.5 | Very low | 24.4 | Very low | 196 Ų | 196 | 104.4 Ų | 104.4 | 92% | 0.916 | 61% | 0.608 | S | S | * | * | S | Bend | trans | -47.7 | 120.3 | 176.9 | -70.4 | 178.4 | 147.5 | 0 | 0 | 111.4 | ||
| 286 | G | 22.7 | Very low | 24.3 | Very low | 52 Ų | 52 | 106 Ų | 106 | 54% | 0.536 | 61% | 0.609 | S | S | . | * | S | Bend | trans | 104.5 | 99.9 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | V284 H288 | V284-G286 PolarHBondContact O-N 3.13Å; V284-G286 VanDerWaalsContact O-N 3.17Å; G286-H288 PolarHBondContact O-N 3.26Å |
| 287 | E | 24.1 | Very low | 24.2 | Very low | 187 Ų | 187 | 112.7 Ų | 112.7 | 87% | 0.874 | 63% | 0.63 | S | S | * | * | S | Bend | trans | 44.1 | 5.4 | 157 | -62.4 | -167.9 | 158.6 | 0 | 0 | 121.2 | ||
| 288 | H | 22.7 | Very low | 24.1 | Very low | 152 Ų | 152 | 118 Ų | 118 | 70% | 0.704 | 65% | 0.646 | S | S | * | * | trans | -128.6 | 115.8 | -173.4 | -66 | -43.4 | 0 | 0 | 0 | 112.6 | G286 | G286-H288 PolarHBondContact O-N 3.26Š| ||
| 289 | W | 22.4 | Very low | 24 | Very low | 219 Ų | 219 | 123 Ų | 123 | 83% | 0.83 | 66% | 0.664 | S | S | * | * | trans | -88.8 | 122.4 | 173.6 | -58.1 | 86.1 | 0 | 0 | 0 | 109.6 | I281 | I281-W289 HydrophobicContact CG2-CE3 3.84Å; I281-W289 HydrophobicContact CG2-CZ3 3.86Å | ||
| 290 | L | 22.5 | Very low | 23.8 | Very low | 91 Ų | 91 | 126.4 Ų | 126.4 | 48% | 0.476 | 68% | 0.678 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -99.3 | 108.2 | 169.7 | -86 | 158.1 | 0 | 0 | 0 | 108.8 | F292 | L290-F292 HydrophobicContact CB-CD2 4.4Å; L290-F292 HydrophobicContact CB-CE2 3.9Å |
| 291 | A | 22.9 | Very low | 23.7 | Very low | 82 Ų | 82 | 132 Ų | 132 | 68% | 0.678 | 70% | 0.698 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89 | 110.5 | 169 | 0 | 0 | 0 | 0 | 0 | 109.2 | T279 | T279-A291 HydrophobicContact CG2-CB 4.35Å |
| 292 | F | 24 | Very low | 23.5 | Very low | 105 Ų | 105 | 132 Ų | 132 | 46% | 0.461 | 71% | 0.707 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -90.2 | 116.9 | 167 | -70 | -86.8 | 0 | 0 | 0 | 108.5 | T279 L290 | T279-F292 WeakPolarHBondContact CA-O 3.31Å; L290-F292 HydrophobicContact CB-CD2 4.4Å; L290-F292 HydrophobicContact CB-CE2 3.9Å |
| 293 | G | 22.5 | Very low | 23.5 | Very low | 61 Ų | 61 | 130.7 Ų | 130.7 | 63% | 0.629 | 71% | 0.71 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -88.5 | 117 | 171.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||
| 294 | C | 23.6 | Very low | 23.4 | Very low | 71 Ų | 71 | 131 Ų | 131 | 48% | 0.48 | 71% | 0.707 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85.5 | 131.8 | 166.5 | -64.9 | 0 | 0 | 0 | 0 | 109.8 | C278 | C278-C294 HydrophobicContact CB-CB 3.98Å; C278-C294 PolarHBondContact O-N 2.63Å |
| 295 | S | 23.9 | Very low | 23.2 | Very low | 115 Ų | 115 | 133 Ų | 133 | 80% | 0.804 | 72% | 0.719 | S | S | * | * | trans | -110.5 | 115.4 | 165.5 | 52.8 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 296 | D | 25 | Very low | 23.1 | Very low | 134 Ų | 134 | 129.4 Ų | 129.4 | 72% | 0.717 | 71% | 0.71 | S | S | * | * | trans | 9 | 119.4 | 173.7 | -60.1 | -29.5 | 0 | 0 | 0 | 120.1 | ||||
| 297 | H | 23.5 | Very low | 23.1 | Very low | 173 Ų | 173 | 133.5 Ų | 133.5 | 80% | 0.801 | 72% | 0.716 | S | S | * | * | trans | -66.6 | 137.6 | 157.8 | -83.7 | -86.3 | 0 | 0 | 0 | 111.5 | ||||
| 298 | F | 23.9 | Very low | 23 | Very low | 206 Ų | 206 | 132 Ų | 132 | 90% | 0.904 | 72% | 0.719 | S | S | * | * | trans | -121.3 | 123.1 | 134 | -91.9 | -84.4 | 0 | 0 | 0 | 108.1 | ||||
| 299 | E | 22.8 | Very low | 22.9 | Very low | 164 Ų | 164 | 129.7 Ų | 129.7 | 77% | 0.766 | 71% | 0.707 | S | S | * | * | trans | -49 | 146.7 | 171.7 | -60.8 | 161.3 | 155.6 | 0 | 0 | 110.5 | ||||
| 300 | I | 23.8 | Very low | 22.8 | Very low | 146 Ų | 146 | 127.9 Ų | 127.9 | 75% | 0.749 | 71% | 0.713 | S | S | * | * | -163.7 | 125.4 | 72 | -76.9 | 161.1 | 0 | 0 | 0 | 108.9 | |||||
| 301 | E | 24.2 | Very low | 22.8 | Very low | 179 Ų | 179 | 129.6 Ų | 129.6 | 84% | 0.836 | 72% | 0.722 | S | S | * | * | trans | 39 | 111.4 | 138 | -53.2 | 179.7 | 151.9 | 0 | 0 | 121.5 | ||||
| 302 | S | 20.1 | Very low | 22.6 | Very low | 109 Ų | 109 | 130.9 Ų | 130.9 | 76% | 0.762 | 73% | 0.726 | S | S | * | * | trans | -17.9 | 168.5 | 135 | -163.9 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 303 | P | 26.9 | Very low | 22.5 | Very low | 101 Ų | 101 | 132 Ų | 132 | 66% | 0.656 | 75% | 0.745 | S | S | * | * | cis | -129.9 | -172.9 | -32.6 | 29 | -6.8 | 0 | 0 | 0 | 110.8 | ||||
| 304 | V | 21.2 | Very low | 22.5 | Very low | 124 Ų | 124 | 135 Ų | 135 | 75% | 0.752 | 75% | 0.752 | S | S | * | * | trans | 68.2 | 115.5 | 158.1 | -174 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 305 | V | 21.4 | Very low | 22.5 | Very low | 126 Ų | 126 | 142.2 Ų | 142.2 | 76% | 0.764 | 78% | 0.775 | S | S | * | * | trans | 57.2 | 116.4 | 153.9 | -177.4 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 306 | T | 22.4 | Very low | 22.4 | Very low | 120 Ų | 120 | 140.6 Ų | 140.6 | 74% | 0.736 | 77% | 0.768 | S | S | * | * | trans | -178.3 | 113.6 | 148.3 | 29.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 307 | E | 21.8 | Very low | 22.3 | Very low | 139 Ų | 139 | 137.9 Ų | 137.9 | 65% | 0.65 | 77% | 0.772 | S | S | * | * | 48.8 | 107.7 | 92.1 | -74.6 | -169.6 | 167.8 | 0 | 0 | 113.6 | F309 | E307-F309 HydrophobicContact CB-CD2 4.36Å; E307-F309 HydrophobicContact CB-CE2 3.91Å; E307-F309 WeakPolarHBondContact O-CD2 3.17Å; E307-F309 PolarHBondContact O-N 3.2Å; E307-F309 VanDerWaalsContact O-N 3.14Å | |||
| 308 | T | 21.7 | Very low | 22.3 | Very low | 154 Ų | 154 | 136.6 Ų | 136.6 | 95% | 0.945 | 78% | 0.777 | S | S | * | * | trans | -65 | 103.3 | 176 | -12 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 309 | F | 20.8 | Very low | 22.2 | Very low | 104 Ų | 104 | 132.1 Ų | 132.1 | 46% | 0.456 | 77% | 0.771 | S | S | . | * | trans | -99 | 122.5 | 165.9 | -75.5 | -85.7 | 0 | 0 | 0 | 110 | E307 L311 K323 | E307-F309 HydrophobicContact CB-CD2 4.36Å; E307-F309 HydrophobicContact CB-CE2 3.91Å; E307-F309 WeakPolarHBondContact O-CD2 3.17Å; E307-F309 PolarHBondContact O-N 3.2Å; E307-F309 VanDerWaalsContact O-N 3.14Å; F309-L311 PolarHBondContact O-N 2.98Å; F309-K323 HydrophobicContact CE1-CG 4.23Å | ||
| 310 | L | 20.3 | Very low | 22.2 | Very low | 181 Ų | 181 | 134.5 Ų | 134.5 | 95% | 0.948 | 78% | 0.779 | S | S | * | * | trans | -74.5 | 113.1 | 167 | -89.4 | 152 | 0 | 0 | 0 | 108.6 | ||||
| 311 | L | 21.6 | Very low | 22.3 | Very low | 128 Ų | 128 | 134.3 Ų | 134.3 | 67% | 0.67 | 78% | 0.778 | S | S | * | * | trans | -120.4 | 109.2 | 169.4 | -84.9 | 159.1 | 0 | 0 | 0 | 109.6 | F309 L321 | F309-L311 PolarHBondContact O-N 2.98Å; L311-L321 HydrophobicContact CD2-CD2 4.35Å | ||
| 312 | S | 20.6 | Very low | 22.2 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 76% | 0.762 | 78% | 0.781 | S | S | * | * | trans | -79.3 | 127.2 | 165 | 50.9 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 313 | C | 21.2 | Very low | 22.5 | Very low | 128 Ų | 128 | 137.8 Ų | 137.8 | 87% | 0.865 | 78% | 0.78 | S | S | * | * | trans | -105.2 | 107.9 | 169.3 | -73.9 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 314 | T | 22.3 | Very low | 22.4 | Very low | 125 Ų | 125 | 138.8 Ų | 138.8 | 77% | 0.767 | 79% | 0.787 | S | S | * | * | trans | -86.7 | 149 | 162.7 | 41.3 | 0 | 0 | 0 | 0 | 109.7 | A316 | T314-A316 PolarHBondContact O-N 3.1Š| ||
| 315 | K | 22.7 | Very low | 22.5 | Very low | 222 Ų | 222 | 137.8 Ų | 137.8 | 97% | 0.965 | 79% | 0.791 | S | S | * | * | S | Bend | trans | -63.2 | 89.8 | 174.8 | -79.9 | 179.4 | 172.3 | 179 | 0 | 110.6 | ||
| 316 | A | 22.8 | Very low | 22.7 | Very low | 80 Ų | 80 | 138.8 Ų | 138.8 | 66% | 0.661 | 80% | 0.797 | S | S | * | * | S | Bend | trans | 168.1 | 126.2 | 151.2 | 0 | 0 | 0 | 0 | 0 | 106.9 | T314 T318 | T314-A316 PolarHBondContact O-N 3.1Å; A316-T318 PolarHBondContact O-N 3.23Å |
| 317 | G | 23.2 | Very low | 22.9 | Very low | 78 Ų | 78 | 141.9 Ų | 141.9 | 80% | 0.804 | 80% | 0.803 | S | S | * | * | trans | -55.8 | 125.8 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 318 | T | 22.2 | Very low | 23 | Very low | 146 Ų | 146 | 143 Ų | 143 | 90% | 0.896 | 81% | 0.814 | S | S | * | * | trans | 175.5 | 120.3 | 142.4 | 29.4 | 0 | 0 | 0 | 0 | 108.5 | A316 | A316-T318 PolarHBondContact O-N 3.23Š| ||
| 319 | S | 21.6 | Very low | 23.1 | Very low | 112 Ų | 112 | 143.3 Ų | 143.3 | 78% | 0.783 | 81% | 0.809 | S | S | * | * | trans | -84 | 132.3 | -177.3 | 58.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 320 | K | 23.9 | Very low | 23.2 | Very low | 214 Ų | 214 | 147 Ų | 147 | 93% | 0.93 | 83% | 0.827 | S | S | * | * | trans | -142.8 | 114.7 | 152.5 | -74.7 | -167.8 | 178.3 | 179.2 | 0 | 110 | ||||
| 321 | L | 25.1 | Very low | 23.5 | Very low | 141 Ų | 141 | 147 Ų | 147 | 74% | 0.738 | 82% | 0.822 | S | S | * | * | trans | -87.3 | 128.4 | 175.4 | -87 | 153.8 | 0 | 0 | 0 | 110.2 | L311 | L311-L321 HydrophobicContact CD2-CD2 4.35Š| ||
| 322 | Q | 23.2 | Very low | 23.6 | Very low | 192 Ų | 192 | 149.5 Ų | 149.5 | 90% | 0.897 | 83% | 0.831 | S | S | * | * | trans | -126.7 | 124.8 | 168.2 | -117 | 179.9 | 0.7 | 0 | 0 | 108.8 | ||||
| 323 | K | 25.8 | Very low | 23.8 | Very low | 170 Ų | 170 | 150.4 Ų | 150.4 | 74% | 0.739 | 83% | 0.834 | S | S | * | * | trans | -83.7 | 137 | 176.7 | -87.9 | -177.8 | 170.3 | -175.1 | 0 | 111.1 | F309 | F309-K323 HydrophobicContact CE1-CG 4.23Š| ||
| 324 | P | 24.6 | Very low | 24.1 | Very low | 122 Ų | 122 | 151.1 Ų | 151.1 | 79% | 0.792 | 83% | 0.834 | S | S | * | * | trans | -104.6 | 141.2 | 157.9 | 24.7 | -8.8 | 0 | 0 | 0 | 112.3 | ||||
| 325 | A | 23.7 | Very low | 24.2 | Very low | 102 Ų | 102 | 153.8 Ų | 153.8 | 84% | 0.843 | 84% | 0.835 | S | S | * | * | trans | -79.6 | 143.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 326 | V | 26.3 | Very low | 24.3 | Very low | 147 Ų | 147 | 154.7 Ų | 154.7 | 89% | 0.891 | 83% | 0.833 | S | S | * | * | trans | -140.9 | 128.6 | 163.3 | -174.5 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 327 | E | 25.8 | Very low | 24.4 | Very low | 186 Ų | 186 | 155.4 Ų | 155.4 | 87% | 0.869 | 83% | 0.833 | S | S | * | * | trans | -69.9 | 155.4 | -169.5 | -72.6 | 166.3 | 128 | 0 | 0 | 116.1 | ||||
| 328 | N | 23 | Very low | 24.5 | Very low | 163 Ų | 163 | 155.6 Ų | 155.6 | 87% | 0.872 | 82% | 0.822 | S | S | * | * | trans | -64.3 | 122.9 | 174.3 | -69.5 | -49.8 | 0 | 0 | 0 | 112.8 | ||||
| 329 | L | 25 | Very low | 24.7 | Very low | 159 Ų | 159 | 154.3 Ų | 154.3 | 83% | 0.832 | 81% | 0.813 | S | S | * | * | trans | -116.4 | 103.3 | 162.2 | -87.1 | 159.9 | 0 | 0 | 0 | 109.7 | ||||
| 330 | Q | 22.2 | Very low | 25 | Very low | 181 Ų | 181 | 153.1 Ų | 153.1 | 85% | 0.846 | 81% | 0.805 | S | S | * | * | trans | -75.4 | 132.6 | 167 | -71.7 | 179.1 | -15.9 | 0 | 0 | 109.4 | ||||
| 331 | H | 26.7 | Very low | 25.2 | Very low | 183 Ų | 183 | 148.6 Ų | 148.6 | 85% | 0.847 | 79% | 0.788 | S | S | * | * | trans | -141.7 | 124.8 | 161 | -95.4 | -55.9 | 0 | 0 | 0 | 111.6 | ||||
| 332 | E | 24.5 | Very low | 25.3 | Very low | 180 Ų | 180 | 151 Ų | 151 | 84% | 0.841 | 79% | 0.788 | S | S | * | * | trans | -64.8 | 155.8 | 179.7 | -72 | -174 | 135.4 | 0 | 0 | 114 | T334 | E332-T334 PolarHBondContact O-N 3.13Š| ||
| 333 | P | 24.8 | Very low | 25.5 | Very low | 128 Ų | 128 | 147.3 Ų | 147.3 | 83% | 0.831 | 77% | 0.774 | S | S | * | * | trans | -89.8 | 100.7 | -179.2 | 34.2 | -28.9 | 0 | 0 | 0 | 111.5 | K335 | P333-K335 PolarHBondContact O-N 3.34Š| ||
| 334 | T | 26.8 | Very low | 25.6 | Very low | 143 Ų | 143 | 146.6 Ų | 146.6 | 88% | 0.877 | 78% | 0.778 | S | S | * | * | trans | -78.3 | 121.3 | 171.7 | -33.2 | 0 | 0 | 0 | 0 | 111 | E332 | E332-T334 PolarHBondContact O-N 3.13Š| ||
| 335 | K | 24.2 | Very low | 25.9 | Very low | 181 Ų | 181 | 149.9 Ų | 149.9 | 79% | 0.787 | 78% | 0.78 | S | S | * | * | trans | -61.9 | 142.8 | 173 | -78.6 | 172.9 | 174.4 | 170.3 | 0 | 111.8 | P333 | P333-K335 PolarHBondContact O-N 3.34Š| ||
| 336 | R | 24 | Very low | 26.1 | Very low | 240 Ų | 240 | 150 Ų | 150 | 91% | 0.906 | 77% | 0.765 | S | S | * | * | trans | 74.4 | 108.6 | 157.9 | -62.1 | 169.1 | 173.8 | -175.1 | -2.7 | 117.4 | ||||
| 337 | S | 25.1 | Very low | 26.2 | Very low | 95 Ų | 95 | 148 Ų | 148 | 66% | 0.664 | 75% | 0.749 | S | S | * | * | -172.5 | 157.2 | 110.9 | 67 | 0 | 0 | 0 | 0 | 110.6 | E341 | S337-E341 VanDerWaalsContact CB-OE2 3.27Å; S337-E341 WeakPolarHBondContact CB-OE2 3.45Å; S337-E341 PolarHBondContact OG-OE2 2.9Å | |||
| 338 | S | 26.3 | Very low | 26.3 | Very low | 83 Ų | 83 | 144 Ų | 144 | 58% | 0.58 | 74% | 0.738 | S | S | * | * | trans | -68.2 | 147.7 | -165.6 | 43.7 | 0 | 0 | 0 | 0 | 115 | S340 E341 | S338-S340 PolarHBondContact O-N 3.03Å; S338-E341 PolarHBondContact O-N 2.92Å | ||
| 339 | V | 26.6 | Very low | 26.6 | Very low | 118 Ų | 118 | 139.7 Ų | 139.7 | 72% | 0.715 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -51.3 | -19.8 | 178.2 | 176.2 | 0 | 0 | 0 | 0 | 114.4 | Y342 | V339-Y342 PolarHBondContact O-N 2.86Š|
| 340 | S | 27.3 | Very low | 26.7 | Very low | 88 Ų | 88 | 139.3 Ų | 139.3 | 62% | 0.615 | 72% | 0.719 | S | S | * | * | G | 310 helix | trans | -69.3 | -27.2 | 175.8 | -68.1 | 0 | 0 | 0 | 0 | 114.7 | S338 Y342 | S338-S340 PolarHBondContact O-N 3.03Å; S340-Y342 VanDerWaalsContact C-N 3.26Å; S340-Y342 PolarHBondContact O-N 3.14Å |
| 341 | E | 28.4 | Very low | 26.9 | Very low | 119 Ų | 119 | 137.5 Ų | 137.5 | 56% | 0.556 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -76.2 | -13.3 | 178.7 | -80 | -177.4 | 145.8 | 0 | 0 | 113.5 | S337 S338 | S337-E341 VanDerWaalsContact CB-OE2 3.27Å; S337-E341 WeakPolarHBondContact CB-OE2 3.45Å; S337-E341 PolarHBondContact OG-OE2 2.9Å; S338-E341 PolarHBondContact O-N 2.92Å |
| 342 | Y | 27.2 | Very low | 26.8 | Very low | 192 Ų | 192 | 134.1 Ų | 134.1 | 75% | 0.753 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -90.9 | -16 | -178.6 | -125.9 | -89.3 | 0 | 0 | 0 | 113.4 | V339 S340 | V339-Y342 PolarHBondContact O-N 2.86Å; S340-Y342 VanDerWaalsContact C-N 3.26Å; S340-Y342 PolarHBondContact O-N 3.14Å |
| 343 | L | 28 | Very low | 26.8 | Very low | 114 Ų | 114 | 130.7 Ų | 130.7 | 60% | 0.597 | 70% | 0.703 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -22.4 | -178.3 | -68.2 | 172.5 | 0 | 0 | 0 | 113 | K345 I346 | L343-K345 PolarHBondContact O-N 3.29Å; L343-I346 HydrophobicContact CD2-CD1 4.17Å; L343-I346 PolarHBondContact O-N 2.82Å |
| 344 | D | 28 | Very low | 26.8 | Very low | 154 Ų | 154 | 130.3 Ų | 130.3 | 82% | 0.824 | 70% | 0.7 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.4 | -7 | 174.4 | -82.6 | -13.6 | 0 | 0 | 0 | 114 | ||
| 345 | K | 29.5 | Very low | 26.7 | Very low | 191 Ų | 191 | 131.7 Ų | 131.7 | 83% | 0.83 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | 0.6 | 176.6 | -73.4 | -176.3 | 178.7 | 176.7 | 0 | 114.1 | L343 D347 | L343-K345 PolarHBondContact O-N 3.29Å; K345-D347 PolarHBondContact O-N 3.41Å |
| 346 | I | 28.5 | Very low | 26.7 | Very low | 104 Ų | 104 | 130 Ų | 130 | 53% | 0.533 | 70% | 0.696 | S | S | . | * | S | Bend | trans | -91.1 | 104.5 | 175.2 | -58.5 | -179.8 | 0 | 0 | 0 | 107.8 | L343 T348 | L343-I346 HydrophobicContact CD2-CD1 4.17Å; L343-I346 PolarHBondContact O-N 2.82Å; I346-T348 PolarHBondContact O-N 3.43Å |
| 347 | D | 27.7 | Very low | 26.8 | Very low | 105 Ų | 105 | 124.9 Ų | 124.9 | 56% | 0.561 | 69% | 0.694 | S | S | * | * | trans | -54.4 | 100.6 | 178.9 | -161.6 | -16.4 | 0 | 0 | 0 | 111 | K345 S349 L350 | K345-D347 PolarHBondContact O-N 3.41Å; D347-S349 PolarHBondContact O-N 2.81Å; D347-S349 VanDerWaalsContact O-N 3.08Å; D347-S349 VanDerWaalsContact OD1-CB 3.31Å; D347-S349 WeakPolarHBondContact OD1-CB 3.4Å; D347-S349 PolarHBondContact OD1-N 3.48Å; D347-S349 PolarHBondContact OD1-OG 3.45Å; D347-S349 PolarHBondContact OD2-OG 2.91Å; D347-L350 PolarHBondContact O-N 3.23Å | ||
| 348 | T | 29 | Very low | 26.7 | Very low | 103 Ų | 103 | 130.3 Ų | 130.3 | 63% | 0.632 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -65.3 | -6.8 | -179.2 | 41.8 | 0 | 0 | 0 | 0 | 113.4 | I346 L350 L351 | I346-T348 PolarHBondContact O-N 3.43Å; T348-L350 PolarHBondContact O-N 3.37Å; T348-L351 PolarHBondContact O-N 3.09Å |
| 349 | S | 28.4 | Very low | 26.6 | Very low | 72 Ų | 72 | 132.1 Ų | 132.1 | 50% | 0.503 | 71% | 0.712 | S | S | . | * | G | 310 helix | trans | -68.4 | -16.1 | 175.1 | 67.2 | 0 | 0 | 0 | 0 | 114 | D347 T352 | D347-S349 PolarHBondContact O-N 2.81Å; D347-S349 VanDerWaalsContact O-N 3.08Å; D347-S349 VanDerWaalsContact OD1-CB 3.31Å; D347-S349 WeakPolarHBondContact OD1-CB 3.4Å; D347-S349 PolarHBondContact OD1-N 3.48Å; D347-S349 PolarHBondContact OD1-OG 3.45Å; D347-S349 PolarHBondContact OD2-OG 2.91Å; S349-T352 PolarHBondContact O-OG1 2.77Å |
| 350 | L | 27.9 | Very low | 26.4 | Very low | 152 Ų | 152 | 133.5 Ų | 133.5 | 80% | 0.796 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -86.2 | -5.5 | 175.5 | -70.4 | 167.9 | 0 | 0 | 0 | 113.8 | D347 T348 | D347-L350 PolarHBondContact O-N 3.23Å; T348-L350 PolarHBondContact O-N 3.37Å |
| 351 | L | 25.9 | Very low | 26.3 | Very low | 143 Ų | 143 | 132.8 Ų | 132.8 | 75% | 0.749 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -101.9 | 6.3 | -175.1 | -73.1 | 166.3 | 0 | 0 | 0 | 114.2 | T348 | T348-L351 PolarHBondContact O-N 3.09Š|
| 352 | T | 24.8 | Very low | 26 | Very low | 112 Ų | 112 | 133.2 Ų | 133.2 | 69% | 0.687 | 74% | 0.738 | S | S | * | * | trans | -119.9 | 14.8 | -169.1 | 47.8 | 0 | 0 | 0 | 0 | 116.6 | S349 P354 | S349-T352 PolarHBondContact O-OG1 2.77Å; T352-P354 WeakPolarHBondContact O-CD 3.42Å | ||
| 353 | S | 25 | Very low | 25.7 | Very low | 108 Ų | 108 | 130 Ų | 130 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | trans | -93.1 | 118.4 | 172.8 | -92.5 | 0 | 0 | 0 | 0 | 113 | L355 | S353-L355 PolarHBondContact O-N 3.14Š| ||
| 354 | P | 23.4 | Very low | 25.5 | Very low | 120 Ų | 120 | 132.7 Ų | 132.7 | 78% | 0.779 | 75% | 0.749 | S | S | * | * | trans | -81.3 | 106.6 | 177 | 32.2 | -28.6 | 0 | 0 | 0 | 109.1 | T352 E356 | T352-P354 WeakPolarHBondContact O-CD 3.42Å; P354-E356 PolarHBondContact O-N 3.39Å | ||
| 355 | L | 24.8 | Very low | 25.3 | Very low | 172 Ų | 172 | 134.7 Ų | 134.7 | 90% | 0.901 | 75% | 0.745 | S | S | * | * | trans | -90.4 | 105.1 | 172.7 | -76.3 | 166.9 | 0 | 0 | 0 | 109.8 | S353 | S353-L355 PolarHBondContact O-N 3.14Š| ||
| 356 | E | 25.5 | Very low | 25 | Very low | 144 Ų | 144 | 134.8 Ų | 134.8 | 67% | 0.673 | 75% | 0.746 | S | S | * | * | trans | -54.3 | 153.1 | 174.9 | -72.6 | -164.8 | 153.9 | 0 | 0 | 113.9 | P354 R358 | P354-E356 PolarHBondContact O-N 3.39Å; E356-R358 PolarHBondContact O-N 3.46Å; E356-R358 IonicContact OE2-NE 3.79Å | ||
| 357 | P | 24.6 | Very low | 24.8 | Very low | 133 Ų | 133 | 133.3 Ų | 133.3 | 86% | 0.864 | 76% | 0.756 | S | S | * | * | trans | -79.3 | 105.4 | 176.2 | 32.9 | -29.5 | 0 | 0 | 0 | 109.5 | ||||
| 358 | R | 23.9 | Very low | 24.5 | Very low | 210 Ų | 210 | 140 Ų | 140 | 79% | 0.792 | 77% | 0.774 | S | S | * | * | trans | -125.7 | 125 | 171.2 | -77.3 | -171 | 175.2 | -160.2 | -2.9 | 113.2 | E356 | E356-R358 PolarHBondContact O-N 3.46Å; E356-R358 IonicContact OE2-NE 3.79Å | ||
| 359 | S | 24.7 | Very low | 24.4 | Very low | 120 Ų | 120 | 142.5 Ų | 142.5 | 84% | 0.839 | 78% | 0.783 | S | S | * | * | trans | 85.3 | 91.5 | 162 | 70.2 | 0 | 0 | 0 | 0 | 118.5 | G361 | S359-G361 PolarHBondContact O-N 2.85Š| ||
| 360 | V | 22.4 | Very low | 24.2 | Very low | 148 Ų | 148 | 145 Ų | 145 | 90% | 0.897 | 80% | 0.8 | S | S | * | * | trans | -63.1 | 110.1 | 155.4 | 178.9 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 361 | G | 23.8 | Very low | 24 | Very low | 73 Ų | 73 | 143 Ų | 143 | 75% | 0.753 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -91.7 | 124.4 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | S359 | S359-G361 PolarHBondContact O-N 2.85Š|
| 362 | T | 22.5 | Very low | 23.8 | Very low | 127 Ų | 127 | 141.2 Ų | 141.2 | 78% | 0.779 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 137.8 | -174.4 | 34.3 | 0 | 0 | 0 | 0 | 113.8 | K364 | T362-K364 PolarHBondContact O-N 2.85Š|
| 363 | C | 21.4 | Very low | 23.7 | Very low | 126 Ų | 126 | 146 Ų | 146 | 85% | 0.851 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 116.5 | 171.2 | -174.4 | 0 | 0 | 0 | 0 | 110.1 | ||
| 364 | K | 24.1 | Very low | 23.7 | Very low | 170 Ų | 170 | 150 Ų | 150 | 74% | 0.739 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -98.7 | 116.1 | 166.2 | -82.6 | -175.6 | 175 | -180 | 0 | 109 | T362 F366 | T362-K364 PolarHBondContact O-N 2.85Å; K364-F366 HydrophobicContact CB-CE2 4.42Å |
| 365 | R | 23.2 | Very low | 23.6 | Very low | 196 Ų | 196 | 148.7 Ų | 148.7 | 74% | 0.74 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -69 | 123.4 | 167.2 | -89 | 177.5 | 166 | 169.1 | -5.5 | 109.3 | Y31 | Y31-R365 PolarHBondContact OH-NE 3.04Å; Y31-R365 PolarHBondContact OH-NH2 3.44Å |
| 366 | F | 24.2 | Very low | 23.6 | Very low | 193 Ų | 193 | 148 Ų | 148 | 85% | 0.846 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -95.2 | 130.3 | 163.1 | -74.9 | -85.1 | 0 | 0 | 0 | 109.1 | K364 | K364-F366 HydrophobicContact CB-CE2 4.42Š|
| 367 | G | 23.1 | Very low | 23.5 | Very low | 72 Ų | 72 | 149.7 Ų | 149.7 | 74% | 0.742 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -75.1 | 163 | -175.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | D369 | G367-D369 PolarHBondContact O-N 3.49Š|
| 368 | R | 22.9 | Very low | 23.5 | Very low | 246 Ų | 246 | 153.8 Ų | 153.8 | 93% | 0.928 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -55 | 102.5 | 172.2 | -71.2 | 175.1 | 177.3 | -178.1 | -2.1 | 109.5 | ||
| 369 | D | 25.3 | Very low | 23.5 | Very low | 156 Ų | 156 | 153.3 Ų | 153.3 | 83% | 0.834 | 81% | 0.809 | S | S | * | * | trans | -176.9 | 108.9 | 145.8 | -83.9 | -27.1 | 0 | 0 | 0 | 106.9 | G367 | G367-D369 PolarHBondContact O-N 3.49Š| ||
| 370 | S | 24.4 | Very low | 23.5 | Very low | 123 Ų | 123 | 157.7 Ų | 157.7 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -62.5 | 144.2 | 176 | -54.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 371 | P | 23.5 | Very low | 23.5 | Very low | 110 Ų | 110 | 157.5 Ų | 157.5 | 71% | 0.714 | 80% | 0.798 | S | S | * | * | -146.7 | 150.7 | 101.6 | 34.8 | -17.7 | 0 | 0 | 0 | 114.4 | |||||
| 372 | S | 23.4 | Very low | 23.6 | Very low | 107 Ų | 107 | 162.9 Ų | 162.9 | 75% | 0.748 | 80% | 0.803 | S | S | * | * | trans | 50.3 | 111.5 | 147.8 | 60 | 0 | 0 | 0 | 0 | 119.6 | Q374 | S372-Q374 PolarHBondContact O-N 3.31Š| ||
| 373 | F | 21.7 | Very low | 23.7 | Very low | 211 Ų | 211 | 166.5 Ų | 166.5 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | trans | -1.3 | 107.5 | 142.7 | -105.8 | -98.4 | 0 | 0 | 0 | 116.1 | ||||
| 374 | Q | 24 | Very low | 23.8 | Very low | 193 Ų | 193 | 169 Ų | 169 | 90% | 0.902 | 80% | 0.804 | S | S | * | * | trans | -139.5 | 115.9 | 144.7 | -95.1 | -175.1 | -1.5 | 0 | 0 | 109 | S372 | S372-Q374 PolarHBondContact O-N 3.31Š| ||
| 375 | S | 23 | Very low | 24.1 | Very low | 93 Ų | 93 | 174.2 Ų | 174.2 | 65% | 0.65 | 83% | 0.827 | S | S | * | * | trans | -71.8 | 122.4 | 177.9 | 45.5 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 376 | D | 24 | Very low | 24.1 | Very low | 158 Ų | 158 | 173.2 Ų | 173.2 | 85% | 0.845 | 83% | 0.831 | S | S | * | * | trans | -122.2 | 79.8 | 160.3 | -88.9 | -23.4 | 0 | 0 | 0 | 109.3 | R378 | D376-R378 PolarHBondContact O-N 2.88Š| ||
| 377 | F | 23.9 | Very low | 24.1 | Very low | 179 Ų | 179 | 172.1 Ų | 172.1 | 79% | 0.785 | 83% | 0.831 | S | S | * | * | trans | -78.8 | 107.9 | 164.7 | -93.5 | -92.2 | 0 | 0 | 0 | 108.8 | Y379 | F377-Y379 PolarHBondContact O-N 3.24Š| ||
| 378 | R | 23.7 | Very low | 24.2 | Very low | 219 Ų | 219 | 177.7 Ų | 177.7 | 83% | 0.826 | 84% | 0.836 | S | S | * | * | trans | -87.6 | 104 | 163.9 | -70.6 | -171.7 | -176.7 | -168.8 | 1.3 | 109.5 | D376 | D376-R378 PolarHBondContact O-N 2.88Š| ||
| 379 | Y | 23.8 | Very low | 24.3 | Very low | 200 Ų | 200 | 173.6 Ų | 173.6 | 78% | 0.784 | 83% | 0.83 | S | S | * | * | trans | -61.4 | 127.9 | 167.4 | -106.8 | -104.4 | 0 | 0 | 0 | 110.4 | F377 | F377-Y379 PolarHBondContact O-N 3.24Š| ||
| 380 | Y | 24.7 | Very low | 24.2 | Very low | 212 Ų | 212 | 174.8 Ų | 174.8 | 83% | 0.831 | 83% | 0.83 | S | S | * | * | trans | -109.7 | 102.9 | 152.7 | -85 | -82.2 | 0 | 0 | 0 | 108.4 | ||||
| 381 | Q | 23.8 | Very low | 24.2 | Very low | 144 Ų | 144 | 178.2 Ų | 178.2 | 67% | 0.673 | 83% | 0.828 | S | S | * | * | trans | -85.5 | 112.5 | 173.3 | -171.9 | -179.3 | 22.4 | 0 | 0 | 107.2 | ||||
| 382 | H | 26.2 | Very low | 24.2 | Very low | 185 Ų | 185 | 183.1 Ų | 183.1 | 86% | 0.856 | 84% | 0.836 | S | S | * | * | trans | -111.3 | 108.9 | 161.4 | -100.8 | -80.3 | 0 | 0 | 0 | 109.1 | ||||
| 383 | R | 24.2 | Very low | 24.3 | Very low | 203 Ų | 203 | 188.9 Ų | 188.9 | 77% | 0.766 | 84% | 0.843 | S | S | * | * | trans | -61.7 | 140.7 | 174.2 | -75.4 | 177.7 | 168.7 | 179.7 | -4.5 | 109.9 | ||||
| 384 | M | 22.5 | Very low | 24.5 | Very low | 178 Ų | 178 | 187.1 Ų | 187.1 | 88% | 0.877 | 84% | 0.836 | S | S | * | * | trans | -55.2 | 134.5 | 165.6 | -57.6 | -179.2 | -150.7 | 0 | 0 | 110.5 | ||||
| 385 | F | 30.4 | Very low | 24.6 | Very low | 281 Ų | 281 | 186.5 Ų | 186.5 | 100% | 1.232 | 83% | 0.83 | S | S | * | * | trans | -145.5 | 0 | 139.1 | -86 | -72.1 | 0 | 0 | 0 | 107.7 |
Retrieved 385 of 385 residues in 100.8 ms
(Link to these results)