| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.2 | Very low | 48.6 | Very low | 250 Ų | 250 | 150.3 Ų | 150.3 | 100% | 1.232 | 86% | 0.861 | S | S | * | * | 0 | 104.5 | 0 | -60.4 | -179.6 | 89.4 | 0 | 0 | 107.7 | |||||
| 2 | S | 45.6 | Very low | 48.7 | Very low | 118 Ų | 118 | 148.8 Ų | 148.8 | 83% | 0.825 | 85% | 0.845 | S | S | * | * | trans | -133.1 | 109.5 | 172.1 | 63.4 | 0 | 0 | 0 | 0 | 108.6 | Q4 | S2-Q4 PolarHBondContact O-N 3.02Š| ||
| 3 | G | 43.3 | Very low | 48.1 | Very low | 80 Ų | 80 | 145.6 Ų | 145.6 | 83% | 0.825 | 83% | 0.831 | S | S | * | * | trans | -74.5 | 120.3 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | R5 | G3-R5 PolarHBondContact O-N 3.04Š| ||
| 4 | Q | 48.9 | Very low | 48.2 | Very low | 197 Ų | 197 | 146.8 Ų | 146.8 | 92% | 0.921 | 83% | 0.834 | S | S | * | * | trans | -73.7 | 113.8 | 160.5 | -89.2 | 165.7 | -55.3 | 0 | 0 | 108.6 | S2 G6 | S2-Q4 PolarHBondContact O-N 3.02Å; Q4-G6 PolarHBondContact O-N 3.4Å | ||
| 5 | R | 52.9 | Low | 48.3 | Very low | 252 Ų | 252 | 146.6 Ų | 146.6 | 95% | 0.951 | 83% | 0.83 | S | S | * | * | trans | -77.8 | 106 | 164.8 | -77.2 | -175 | 178.1 | -167.6 | -0.1 | 108 | G3 G7 | G3-R5 PolarHBondContact O-N 3.04Å; R5-G7 PolarHBondContact O-N 3.15Å | ||
| 6 | G | 46.6 | Very low | 48.6 | Very low | 70 Ų | 70 | 148.9 Ų | 148.9 | 72% | 0.722 | 83% | 0.831 | S | S | * | * | trans | -68.6 | 112.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q4 K8 | Q4-G6 PolarHBondContact O-N 3.4Å; G6-K8 PolarHBondContact O-N 2.91Å | ||
| 7 | G | 49.8 | Very low | 48.8 | Very low | 81 Ų | 81 | 151.9 Ų | 151.9 | 84% | 0.835 | 84% | 0.837 | S | S | * | * | trans | -71.5 | 108.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 108.8 | R5 S9 | R5-G7 PolarHBondContact O-N 3.15Å; G7-S9 PolarHBondContact O-N 3.12Å | ||
| 8 | K | 59.7 | Low | 48.9 | Very low | 204 Ų | 204 | 152.9 Ų | 152.9 | 89% | 0.887 | 84% | 0.835 | S | S | * | * | trans | -81.6 | 104.9 | 171 | -64.3 | 178.9 | -178 | -179.1 | 0 | 107.4 | G6 L10 | G6-K8 PolarHBondContact O-N 2.91Å; K8-L10 PolarHBondContact O-N 3.41Å | ||
| 9 | S | 48.4 | Very low | 48.9 | Very low | 106 Ų | 106 | 155.2 Ų | 155.2 | 74% | 0.741 | 84% | 0.839 | S | S | * | * | trans | -71.6 | 121 | 164.4 | -173.8 | 0 | 0 | 0 | 0 | 107.9 | G7 I11 | G7-S9 PolarHBondContact O-N 3.12Å; S9-I11 PolarHBondContact O-N 2.86Å | ||
| 10 | L | 48.7 | Very low | 49 | Very low | 149 Ų | 149 | 151.7 Ų | 151.7 | 78% | 0.78 | 82% | 0.823 | S | S | * | * | trans | -83.9 | 96.1 | 177.1 | -164.8 | 78.9 | 0 | 0 | 0 | 107.7 | K8 I12 | K8-L10 PolarHBondContact O-N 3.41Å; L10-I12 HydrophobicContact CD2-CD1 4Å; L10-I12 HydrophobicContact CD2-CG1 4.01Å; L10-I12 HydrophobicContact CG-CG1 4.17Å; L10-I12 PolarHBondContact O-N 3.42Å | ||
| 11 | I | 49.3 | Very low | 49.1 | Very low | 146 Ų | 146 | 153 Ų | 153 | 75% | 0.749 | 82% | 0.824 | S | S | * | * | trans | -77.9 | 104 | 169.1 | -61.1 | 172.4 | 0 | 0 | 0 | 106.1 | S9 | S9-I11 PolarHBondContact O-N 2.86Š| ||
| 12 | I | 50.1 | Low | 49.6 | Very low | 132 Ų | 132 | 148 Ų | 148 | 68% | 0.677 | 80% | 0.802 | S | S | * | * | trans | -89 | 112.7 | 166.1 | -59.3 | 176.5 | 0 | 0 | 0 | 105.1 | L10 D14 | L10-I12 HydrophobicContact CD2-CD1 4Å; L10-I12 HydrophobicContact CD2-CG1 4.01Å; L10-I12 HydrophobicContact CG-CG1 4.17Å; L10-I12 PolarHBondContact O-N 3.42Å; I12-D14 PolarHBondContact O-N 3.15Å | ||
| 13 | T | 41.1 | Very low | 50 | Low | 108 Ų | 108 | 145.2 Ų | 145.2 | 66% | 0.663 | 79% | 0.792 | S | S | * | * | trans | -62.6 | 113.8 | 171.9 | 43.4 | 0 | 0 | 0 | 0 | 108.6 | D15 | T13-D15 PolarHBondContact O-N 3.11Š| ||
| 14 | D | 48.8 | Very low | 50.5 | Low | 162 Ų | 162 | 149.2 Ų | 149.2 | 87% | 0.866 | 79% | 0.793 | S | S | * | * | trans | -64.2 | 103.8 | 161.7 | -83.8 | -33.8 | 0 | 0 | 0 | 107.3 | I12 | I12-D14 PolarHBondContact O-N 3.15Š| ||
| 15 | D | 49.5 | Very low | 51.6 | Low | 144 Ų | 144 | 144 Ų | 144 | 77% | 0.77 | 77% | 0.772 | S | S | * | * | trans | -115.2 | 135.2 | 162.8 | -94.3 | -27.4 | 0 | 0 | 0 | 108 | T13 | T13-D15 PolarHBondContact O-N 3.11Š| ||
| 16 | E | 52.7 | Low | 52.4 | Low | 184 Ų | 184 | 136.1 Ų | 136.1 | 86% | 0.86 | 75% | 0.753 | S | S | * | * | trans | 86.8 | 87.2 | 176.1 | -53.5 | -160.9 | 161.8 | 0 | 0 | 116.5 | E18 | E16-E18 PolarHBondContact O-N 2.98Å; E16-E18 VanDerWaalsContact O-N 3.08Å | ||
| 17 | E | 52.8 | Low | 53.2 | Low | 200 Ų | 200 | 141.7 Ų | 141.7 | 94% | 0.935 | 76% | 0.758 | S | S | * | * | trans | -53.7 | 96.4 | 152.6 | -63.8 | 177.3 | 166.1 | 0 | 0 | 110.1 | ||||
| 18 | E | 50.1 | Low | 54.6 | Low | 169 Ų | 169 | 139.5 Ų | 139.5 | 79% | 0.79 | 73% | 0.73 | S | S | * | * | trans | -97.8 | 112.6 | 151.1 | -86.2 | -170.9 | 157 | 0 | 0 | 107.8 | E16 V20 | E16-E18 PolarHBondContact O-N 2.98Å; E16-E18 VanDerWaalsContact O-N 3.08Å; E18-V20 VanDerWaalsContact C-N 3.31Å; E18-V20 PolarHBondContact O-N 3.48Å | ||
| 19 | E | 49.4 | Very low | 55.1 | Low | 197 Ų | 197 | 136.2 Ų | 136.2 | 92% | 0.921 | 72% | 0.716 | S | S | * | * | trans | -52.2 | 93.8 | 167.3 | -75.6 | -172.9 | 152.5 | 0 | 0 | 109.3 | Q21 | E19-Q21 PolarHBondContact O-N 3.24Š| ||
| 20 | V | 50.4 | Low | 56.3 | Low | 85 Ų | 85 | 138.5 Ų | 138.5 | 52% | 0.515 | 71% | 0.712 | S | S | . | * | trans | -73.7 | 105 | 168.8 | -176.3 | 0 | 0 | 0 | 0 | 106.5 | E18 D22 | E18-V20 VanDerWaalsContact C-N 3.31Å; E18-V20 PolarHBondContact O-N 3.48Å; V20-D22 PolarHBondContact O-N 2.89Å | ||
| 21 | Q | 52.4 | Low | 57.8 | Low | 179 Ų | 179 | 134.8 Ų | 134.8 | 84% | 0.836 | 69% | 0.691 | S | S | * | * | trans | -43.8 | 93.2 | 171.6 | -138.3 | 160.5 | 39.1 | 0 | 0 | 110.8 | E19 G23 | E19-Q21 PolarHBondContact O-N 3.24Å; Q21-G23 PolarHBondContact O-N 2.88Å | ||
| 22 | D | 50.7 | Low | 59.2 | Low | 145 Ų | 145 | 133.5 Ų | 133.5 | 78% | 0.775 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.9 | 31.9 | 179.7 | -88 | -22.9 | 0 | 0 | 0 | 113.4 | V20 | V20-D22 PolarHBondContact O-N 2.89Š|
| 23 | G | 53.6 | Low | 60.6 | Low | 59 Ų | 59 | 130.6 Ų | 130.6 | 61% | 0.608 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.6 | -8.1 | -164.9 | 0 | 0 | 0 | 0 | 0 | 117.1 | Q21 | Q21-G23 PolarHBondContact O-N 2.88Š|
| 24 | L | 55.1 | Low | 62.3 | Low | 164 Ų | 164 | 132.8 Ų | 132.8 | 86% | 0.859 | 66% | 0.662 | S | S | * | * | trans | -137.5 | 29 | -165.8 | -62.6 | 174.6 | 0 | 0 | 0 | 114.9 | P26 | L24-P26 WeakPolarHBondContact O-CD 3.49Š| ||
| 25 | N | 70.5 | Confident | 63.4 | Low | 88 Ų | 88 | 133.8 Ų | 133.8 | 47% | 0.471 | 65% | 0.654 | S | S | . | * | trans | -91.5 | 103.5 | 164.9 | -176.7 | 8.3 | 0 | 0 | 0 | 109.6 | F27 S28 | N25-F27 PolarHBondContact O-N 3.08Å; N25-F27 VanDerWaalsContact O-N 3.1Å; N25-F27 PolarHBondContact OD1-N 3.42Å; N25-S28 WeakPolarHBondContact O-CB 3.39Å; N25-S28 PolarHBondContact O-N 3.36Å | ||
| 26 | P | 69.9 | Low | 64.7 | Low | 86 Ų | 86 | 133 Ų | 133 | 56% | 0.558 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.2 | -7.9 | 178.3 | 28.9 | -35.9 | 0 | 0 | 0 | 113.5 | L24 | L24-P26 WeakPolarHBondContact O-CD 3.49Š|
| 27 | F | 64.3 | Low | 65.8 | Low | 188 Ų | 188 | 128.7 Ų | 128.7 | 83% | 0.825 | 63% | 0.626 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.2 | 16.8 | 173.5 | -57.5 | -76 | 0 | 0 | 0 | 112.8 | N25 | N25-F27 PolarHBondContact O-N 3.08Å; N25-F27 VanDerWaalsContact O-N 3.1Å; N25-F27 PolarHBondContact OD1-N 3.42Å |
| 28 | S | 78.3 | Confident | 66.3 | Low | 34 Ų | 34 | 124.7 Ų | 124.7 | 24% | 0.238 | 61% | 0.607 | C | S | . | * | trans | -67 | 145 | 176.6 | 167.7 | 0 | 0 | 0 | 0 | 111.8 | N25 K30 E31 F32 | N25-S28 WeakPolarHBondContact O-CB 3.39Å; N25-S28 PolarHBondContact O-N 3.36Å; S28-K30 PolarHBondContact O-N 2.65Å; S28-K30 PolarHBondContact OG-N 2.95Å; S28-K30 VanDerWaalsContact OG-N 3.1Å; S28-E31 WeakPolarHBondContact O-CA 3.49Å; S28-E31 VanDerWaalsContact O-CB 3.29Å; S28-E31 WeakPolarHBondContact O-CB 3.48Å; S28-E31 PolarHBondContact O-N 2.94Å; S28-F32 PolarHBondContact O-N 3.45Å | ||
| 29 | F | 70.3 | Confident | 66.5 | Low | 135 Ų | 135 | 121.2 Ų | 121.2 | 59% | 0.592 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -59.8 | -26.8 | 171.6 | -169.9 | -109.2 | 0 | 0 | 0 | 112.6 | F32 L33 | F29-F32 HydrophobicContact CD2-CB 4.43Å; F29-F32 AromaticContact CD2-CD1 3.84Å; F29-F32 HydrophobicContact CD2-CD1 3.84Å; F29-F32 HydrophobicContact CD2-CG 4.44Å; F29-F32 AromaticContact CE2-CD1 3.64Å; F29-F32 HydrophobicContact CE2-CD1 3.64Å; F29-F32 HydrophobicContact CE2-CE1 4.02Å; F29-F32 HydrophobicContact CZ-CD1 4.45Å; F29-F32 WeakPolarHBondContact O-CB 3.31Å; F29-F32 PolarHBondContact O-N 2.87Å; F29-L33 HydrophobicContact CD1-CD1 3.96Å; F29-L33 HydrophobicContact CD1-CG 4.23Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CE1-CD2 4.29Å; F29-L33 HydrophobicContact CE1-CG 3.95Å; F29-L33 HydrophobicContact CZ-CD1 4.44Å; F29-L33 HydrophobicContact CZ-CD2 4.25Å; F29-L33 HydrophobicContact CZ-CG 4.28Å; F29-L33 WeakPolarHBondContact O-CG 3.45Å; F29-L33 PolarHBondContact O-N 3.37Å |
| 30 | K | 75 | Confident | 66.7 | Low | 155 Ų | 155 | 119.1 Ų | 119.1 | 67% | 0.674 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -67.9 | -35.9 | 171.8 | -65.9 | -179.2 | -179.8 | 172.8 | 0 | 112.3 | S28 R34 | S28-K30 PolarHBondContact O-N 2.65Å; S28-K30 PolarHBondContact OG-N 2.95Å; S28-K30 VanDerWaalsContact OG-N 3.1Å; K30-R34 WeakPolarHBondContact O-CB 3.34Å; K30-R34 PolarHBondContact O-N 3.47Å |
| 31 | E | 78.7 | Confident | 66.7 | Low | 70 Ų | 70 | 121.4 Ų | 121.4 | 33% | 0.327 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -68 | -42.1 | 171.2 | -87.5 | -89.8 | 136.4 | 0 | 0 | 110.6 | S28 L33 R34 W35 | S28-E31 WeakPolarHBondContact O-CA 3.49Å; S28-E31 VanDerWaalsContact O-CB 3.29Å; S28-E31 WeakPolarHBondContact O-CB 3.48Å; S28-E31 PolarHBondContact O-N 2.94Å; E31-L33 PolarHBondContact O-N 3.28Å; E31-R34 WeakPolarHBondContact O-CB 3.47Å; E31-R34 PolarHBondContact O-N 2.64Å; E31-R34 VanDerWaalsContact O-N 3.1Å; E31-R34 IonicContact OE1-CZ 3.24Å; E31-R34 IonicContact OE1-NH1 3.76Å; E31-R34 PolarHBondContact OE1-NH1 2.96Å; E31-W35 PolarHBondContact O-N 3.16Å |
| 32 | F | 80.2 | Confident | 66.4 | Low | 119 Ų | 119 | 118.3 Ų | 118.3 | 52% | 0.522 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -58.9 | -44.3 | 174.9 | 176.2 | -100.7 | 0 | 0 | 0 | 112.5 | S28 F29 W35 K36 | S28-F32 PolarHBondContact O-N 3.45Å; F29-F32 HydrophobicContact CD2-CB 4.43Å; F29-F32 AromaticContact CD2-CD1 3.84Å; F29-F32 HydrophobicContact CD2-CD1 3.84Å; F29-F32 HydrophobicContact CD2-CG 4.44Å; F29-F32 AromaticContact CE2-CD1 3.64Å; F29-F32 HydrophobicContact CE2-CD1 3.64Å; F29-F32 HydrophobicContact CE2-CE1 4.02Å; F29-F32 HydrophobicContact CZ-CD1 4.45Å; F29-F32 WeakPolarHBondContact O-CB 3.31Å; F29-F32 PolarHBondContact O-N 2.87Å; F32-W35 PolarHBondContact O-N 2.96Å; F32-K36 PolarHBondContact O-N 2.96Å |
| 33 | L | 78.6 | Confident | 66.1 | Low | 72 Ų | 72 | 118.4 Ų | 118.4 | 38% | 0.377 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -66.7 | -36 | 174.1 | -71.4 | 176.5 | 0 | 0 | 0 | 112.3 | F29 E31 K36 N37 | F29-L33 HydrophobicContact CD1-CD1 3.96Å; F29-L33 HydrophobicContact CD1-CG 4.23Å; F29-L33 HydrophobicContact CE1-CD1 3.68Å; F29-L33 HydrophobicContact CE1-CD2 4.29Å; F29-L33 HydrophobicContact CE1-CG 3.95Å; F29-L33 HydrophobicContact CZ-CD1 4.44Å; F29-L33 HydrophobicContact CZ-CD2 4.25Å; F29-L33 HydrophobicContact CZ-CG 4.28Å; F29-L33 WeakPolarHBondContact O-CG 3.45Å; F29-L33 PolarHBondContact O-N 3.37Å; E31-L33 PolarHBondContact O-N 3.28Å; L33-K36 PolarHBondContact O-N 3Å; L33-N37 WeakPolarHBondContact O-CB 3.4Å; L33-N37 PolarHBondContact O-N 2.89Å; L33-N37 VanDerWaalsContact O-N 3.1Å; L33-N37 PolarHBondContact O-ND2 3.04Å; L33-N37 VanDerWaalsContact O-ND2 3.08Å |
| 34 | R | 77.9 | Confident | 65.6 | Low | 154 Ų | 154 | 124.1 Ų | 124.1 | 58% | 0.581 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -61.6 | -45.2 | 174.4 | -170.5 | -171.2 | -66.7 | 159.3 | 4.6 | 111.1 | K30 E31 N37 Q38 | K30-R34 WeakPolarHBondContact O-CB 3.34Å; K30-R34 PolarHBondContact O-N 3.47Å; E31-R34 WeakPolarHBondContact O-CB 3.47Å; E31-R34 PolarHBondContact O-N 2.64Å; E31-R34 VanDerWaalsContact O-N 3.1Å; E31-R34 IonicContact OE1-CZ 3.24Å; E31-R34 IonicContact OE1-NH1 3.76Å; E31-R34 PolarHBondContact OE1-NH1 2.96Å; R34-N37 PolarHBondContact O-N 3.41Å; R34-Q38 PolarHBondContact O-N 2.87Å |
| 35 | W | 71.6 | Confident | 65 | Low | 183 Ų | 183 | 123.7 Ų | 123.7 | 69% | 0.693 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -59.3 | -51.3 | 175.3 | -172.1 | -53.1 | 0 | 0 | 0 | 111 | E31 F32 N37 Q38 | E31-W35 PolarHBondContact O-N 3.16Å; F32-W35 PolarHBondContact O-N 2.96Å; W35-N37 PolarHBondContact O-N 3.41Å; W35-Q38 WeakPolarHBondContact O-CB 3.42Å; W35-Q38 PolarHBondContact O-N 3.17Å |
| 36 | K | 76.4 | Confident | 63.6 | Low | 128 Ų | 128 | 127.5 Ų | 127.5 | 56% | 0.557 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -62.3 | -29.6 | -176.4 | -168.4 | 175.9 | 179.2 | 176.9 | 0 | 113.3 | F32 L33 | F32-K36 PolarHBondContact O-N 2.96Å; L33-K36 PolarHBondContact O-N 3Å |
| 37 | N | 74.8 | Confident | 62.2 | Low | 92 Ų | 92 | 130.5 Ų | 130.5 | 49% | 0.492 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -84.1 | -11.6 | 176.4 | -65.5 | -26.9 | 0 | 0 | 0 | 113.3 | L33 R34 W35 N41 | L33-N37 WeakPolarHBondContact O-CB 3.4Å; L33-N37 PolarHBondContact O-N 2.89Å; L33-N37 VanDerWaalsContact O-N 3.1Å; L33-N37 PolarHBondContact O-ND2 3.04Å; L33-N37 VanDerWaalsContact O-ND2 3.08Å; R34-N37 PolarHBondContact O-N 3.41Å; W35-N37 PolarHBondContact O-N 3.41Å; N37-N41 PolarHBondContact O-ND2 3.29Å |
| 38 | Q | 63.3 | Low | 61 | Low | 116 Ų | 116 | 131 Ų | 131 | 54% | 0.542 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -82.9 | -29.9 | 179.6 | -163.5 | 159 | 9 | 0 | 0 | 112.1 | R34 W35 Q40 N41 | R34-Q38 PolarHBondContact O-N 2.87Å; W35-Q38 WeakPolarHBondContact O-CB 3.42Å; W35-Q38 PolarHBondContact O-N 3.17Å; Q38-Q40 VanDerWaalsContact C-N 3.27Å; Q38-Q40 PolarHBondContact O-N 3.33Å; Q38-N41 PolarHBondContact O-N 3.33Å |
| 39 | D | 55.6 | Low | 58.9 | Low | 97 Ų | 97 | 136.9 Ų | 136.9 | 52% | 0.519 | 65% | 0.649 | S | S | . | * | G | 310 helix | trans | -69.1 | -21.9 | 175.4 | -70.6 | -25.8 | 0 | 0 | 0 | 113.1 | ||
| 40 | Q | 53.8 | Low | 57.6 | Low | 152 Ų | 152 | 139.3 Ų | 139.3 | 71% | 0.71 | 66% | 0.663 | S | S | * | * | G | 310 helix | trans | -82.2 | -13.2 | 177.9 | -69.1 | -169.5 | -5.2 | 0 | 0 | 114.2 | Q38 | Q38-Q40 VanDerWaalsContact C-N 3.27Å; Q38-Q40 PolarHBondContact O-N 3.33Å |
| 41 | N | 50.3 | Low | 55.9 | Low | 133 Ų | 133 | 138.8 Ų | 138.8 | 71% | 0.711 | 67% | 0.667 | S | S | * | * | G | 310 helix | trans | -102.7 | -0.2 | -176.9 | -70.5 | -48.6 | 0 | 0 | 0 | 113.7 | N37 Q38 | N37-N41 PolarHBondContact O-ND2 3.29Å; Q38-N41 PolarHBondContact O-N 3.33Å |
| 42 | Q | 46.9 | Very low | 53.9 | Low | 115 Ų | 115 | 144.2 Ų | 144.2 | 54% | 0.537 | 69% | 0.692 | S | S | . | * | S | Bend | trans | -91.5 | -7.2 | 178.9 | -73.6 | -171.2 | 21.7 | 0 | 0 | 114.5 | Q44 | Q42-Q44 VanDerWaalsContact C-N 3.3Å; Q42-Q44 PolarHBondContact O-N 2.95Å |
| 43 | D | 43.4 | Very low | 51.8 | Low | 146 Ų | 146 | 144.8 Ų | 144.8 | 78% | 0.781 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.4 | 9.3 | -177.6 | -73.3 | -25.2 | 0 | 0 | 0 | 114.6 | ||
| 44 | Q | 42.7 | Very low | 49.8 | Very low | 180 Ų | 180 | 150.6 Ų | 150.6 | 84% | 0.841 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.7 | -7.7 | 179.4 | -73.2 | -168.2 | 8.6 | 0 | 0 | 116.5 | Q42 | Q42-Q44 VanDerWaalsContact C-N 3.3Å; Q42-Q44 PolarHBondContact O-N 2.95Å |
| 45 | D | 43.7 | Very low | 47.7 | Very low | 155 Ų | 155 | 153.2 Ų | 153.2 | 83% | 0.829 | 74% | 0.741 | S | S | * | * | trans | -128.1 | 40.5 | -176.1 | -72.6 | -35.7 | 0 | 0 | 0 | 114.1 | ||||
| 46 | Q | 39.7 | Very low | 45.8 | Very low | 167 Ų | 167 | 152.3 Ų | 152.3 | 78% | 0.78 | 74% | 0.742 | S | S | * | * | trans | -112.5 | 70.2 | 168.3 | -71.8 | -167.7 | 30.2 | 0 | 0 | 111.6 | ||||
| 47 | D | 40.3 | Very low | 43.6 | Very low | 150 Ų | 150 | 154.7 Ų | 154.7 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | S | Bend | trans | -143.9 | 64.6 | 159.1 | -116.2 | -9.3 | 0 | 0 | 0 | 109.6 | ||
| 48 | Q | 39.5 | Very low | 41.8 | Very low | 198 Ų | 198 | 159.7 Ų | 159.7 | 93% | 0.925 | 78% | 0.775 | S | S | * | * | S | Bend | trans | -178.2 | 140.9 | 143.2 | -99.6 | 154.5 | 83.5 | 0 | 0 | 111.3 | ||
| 49 | N | 34.7 | Very low | 40.8 | Very low | 157 Ų | 157 | 158.3 Ų | 158.3 | 84% | 0.84 | 78% | 0.783 | S | S | * | * | trans | 94.9 | 61.7 | 159.7 | -124.2 | 13.4 | 0 | 0 | 0 | 117.8 | N51 | N49-N51 PolarHBondContact O-N 3.26Š| ||
| 50 | Q | 41.7 | Very low | 39.9 | Very low | 187 Ų | 187 | 160.7 Ų | 160.7 | 87% | 0.874 | 80% | 0.795 | S | S | * | * | trans | -76.3 | 99.5 | 148.5 | -67.9 | -179 | 18 | 0 | 0 | 109.4 | ||||
| 51 | N | 39.4 | Very low | 39.1 | Very low | 143 Ų | 143 | 162.5 Ų | 162.5 | 77% | 0.765 | 80% | 0.804 | S | S | * | * | trans | 170.1 | 141.5 | 139.4 | -95.8 | -31.5 | 0 | 0 | 0 | 110.8 | N49 | N49-N51 PolarHBondContact O-N 3.26Š| ||
| 52 | Q | 38.2 | Very low | 38.3 | Very low | 184 Ų | 184 | 165.8 Ų | 165.8 | 86% | 0.86 | 81% | 0.806 | S | S | * | * | trans | 85.6 | 117.3 | -175.6 | -57.1 | 176 | 14.7 | 0 | 0 | 111.4 | ||||
| 53 | T | 34.6 | Very low | 38.1 | Very low | 131 Ų | 131 | 164.7 Ų | 164.7 | 80% | 0.804 | 81% | 0.811 | S | S | * | * | cis | -164.4 | 120 | 38 | -5.5 | 0 | 0 | 0 | 0 | 109.7 | R55 | T53-R55 PolarHBondContact O-N 3.45Š| ||
| 54 | H | 36.4 | Very low | 37.6 | Very low | 195 Ų | 195 | 167.3 Ų | 167.3 | 90% | 0.903 | 82% | 0.816 | S | S | * | * | trans | -64.8 | 115.7 | 148.3 | -97.6 | -76.6 | 0 | 0 | 0 | 108.2 | ||||
| 55 | R | 33.9 | Very low | 37.3 | Very low | 209 Ų | 209 | 167.7 Ų | 167.7 | 79% | 0.789 | 82% | 0.818 | S | S | * | * | trans | 177.8 | 126.4 | 138.3 | -113.6 | -178.3 | 171.6 | 176.6 | 0.4 | 112.4 | T53 | T53-R55 PolarHBondContact O-N 3.45Š| ||
| 56 | K | 32.1 | Very low | 37.3 | Very low | 164 Ų | 164 | 166.3 Ų | 166.3 | 71% | 0.713 | 82% | 0.817 | S | S | * | * | trans | 72.2 | 129.2 | 154.5 | -57 | 176.9 | 178 | -170.8 | 0 | 113 | ||||
| 57 | E | 29.9 | Very low | 37.3 | Very low | 177 Ų | 177 | 166.3 Ų | 166.3 | 83% | 0.827 | 82% | 0.822 | S | S | * | * | cis | -157.3 | 128.6 | 46.1 | -119.7 | 141.1 | -148.8 | 0 | 0 | 110.7 | A59 | E57-A59 PolarHBondContact O-N 2.96Š| ||
| 58 | E | 38.5 | Very low | 37.4 | Very low | 198 Ų | 198 | 164.5 Ų | 164.5 | 93% | 0.925 | 82% | 0.816 | S | S | * | * | trans | -66.1 | 111 | 155 | -64.6 | 167.5 | 158.6 | 0 | 0 | 108 | ||||
| 59 | A | 42.5 | Very low | 37.2 | Very low | 86 Ų | 86 | 162.6 Ų | 162.6 | 71% | 0.711 | 81% | 0.812 | S | S | * | * | trans | -173.4 | 94.9 | 153 | 0 | 0 | 0 | 0 | 0 | 108.4 | E57 | E57-A59 PolarHBondContact O-N 2.96Š| ||
| 60 | L | 35.1 | Very low | 37.7 | Very low | 148 Ų | 148 | 160.7 Ų | 160.7 | 78% | 0.775 | 81% | 0.811 | S | S | * | * | trans | 173.8 | 71.6 | 132 | -87.1 | 161.2 | 0 | 0 | 0 | 107.6 | W62 | L60-W62 PolarHBondContact O-N 2.85Å; L60-W62 VanDerWaalsContact O-N 3.16Å | ||
| 61 | E | 37.8 | Very low | 37.5 | Very low | 189 Ų | 189 | 156.3 Ų | 156.3 | 88% | 0.883 | 81% | 0.807 | S | S | * | * | trans | -61.6 | 100 | 154.9 | -174.5 | 176.2 | -162.7 | 0 | 0 | 107.8 | ||||
| 62 | W | 32.5 | Very low | 37.3 | Very low | 202 Ų | 202 | 155.3 Ų | 155.3 | 77% | 0.765 | 81% | 0.811 | S | S | * | * | trans | -121.6 | 88 | 162.6 | -82.9 | 65 | 0 | 0 | 0 | 108.5 | L60 F64 | L60-W62 PolarHBondContact O-N 2.85Å; L60-W62 VanDerWaalsContact O-N 3.16Å; W62-F64 PolarHBondContact O-N 3.48Å | ||
| 63 | S | 43.7 | Very low | 37.3 | Very low | 93 Ų | 93 | 150.9 Ų | 150.9 | 65% | 0.65 | 80% | 0.801 | S | S | * | * | trans | 3.7 | 109.2 | 141.6 | 53.8 | 0 | 0 | 0 | 0 | 117 | ||||
| 64 | F | 33.5 | Very low | 37.2 | Very low | 201 Ų | 201 | 151.5 Ų | 151.5 | 88% | 0.882 | 80% | 0.798 | S | S | * | * | trans | -137.5 | 109.7 | 148.5 | -94.5 | -86.8 | 0 | 0 | 0 | 108.8 | W62 | W62-F64 PolarHBondContact O-N 3.48Š| ||
| 65 | Q | 35.4 | Very low | 37 | Very low | 187 Ų | 187 | 148 Ų | 148 | 87% | 0.874 | 79% | 0.794 | S | S | * | * | trans | -86.8 | 135.7 | 168.4 | -70.2 | 177.2 | -43.1 | 0 | 0 | 108.9 | ||||
| 66 | P | 43.9 | Very low | 37 | Very low | 126 Ų | 126 | 144 Ų | 144 | 82% | 0.818 | 79% | 0.793 | S | S | * | * | trans | -86.8 | 114.2 | 164.4 | 11.5 | 5.8 | 0 | 0 | 0 | 109.3 | V68 | P66-V68 PolarHBondContact O-N 3.33Š| ||
| 67 | L | 38.8 | Very low | 37.2 | Very low | 167 Ų | 167 | 143.1 Ų | 143.1 | 87% | 0.874 | 80% | 0.796 | S | S | * | * | trans | -77.2 | 114.3 | 165.3 | -179.6 | 62.7 | 0 | 0 | 0 | 108.2 | ||||
| 68 | V | 43.8 | Very low | 38.2 | Very low | 112 Ų | 112 | 144.6 Ų | 144.6 | 68% | 0.679 | 80% | 0.8 | S | S | * | * | trans | -71.7 | 131.4 | 163.4 | -69.2 | 0 | 0 | 0 | 0 | 108.6 | P66 | P66-V68 PolarHBondContact O-N 3.33Š| ||
| 69 | D | 33.9 | Very low | 38.6 | Very low | 158 Ų | 158 | 143.1 Ų | 143.1 | 85% | 0.845 | 79% | 0.793 | S | S | * | * | -163.4 | 140.2 | 124.4 | -93.5 | -25.3 | 0 | 0 | 0 | 111.8 | |||||
| 70 | S | 47 | Very low | 38.7 | Very low | 118 Ų | 118 | 148.3 Ų | 148.3 | 83% | 0.825 | 80% | 0.803 | S | S | * | * | trans | -72.5 | 145.5 | -171.9 | -59 | 0 | 0 | 0 | 0 | 113 | ||||
| 71 | A | 37.4 | Very low | 39.4 | Very low | 95 Ų | 95 | 149.4 Ų | 149.4 | 79% | 0.785 | 80% | 0.804 | S | S | * | * | 144.8 | 146.1 | 106.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 72 | S | 34.5 | Very low | 39.4 | Very low | 121 Ų | 121 | 148 Ų | 148 | 85% | 0.846 | 80% | 0.803 | S | S | * | * | trans | 86.8 | 136.3 | 159.4 | -168.9 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 73 | S | 38.6 | Very low | 40.1 | Very low | 92 Ų | 92 | 142.8 Ų | 142.8 | 64% | 0.643 | 80% | 0.802 | S | S | * | * | cis | -179.2 | 160.3 | -17 | 179.2 | 0 | 0 | 0 | 0 | 105.2 | ||||
| 74 | L | 32.4 | Very low | 39.9 | Very low | 144 Ų | 144 | 145.8 Ų | 145.8 | 75% | 0.754 | 81% | 0.811 | S | S | * | * | trans | 77.3 | 84 | 166.4 | -72.4 | 117.5 | 0 | 0 | 0 | 118.6 | ||||
| 75 | C | 30.8 | Very low | 40.6 | Very low | 121 Ų | 121 | 145.4 Ų | 145.4 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | trans | -107 | 117 | 139 | -68.4 | 0 | 0 | 0 | 0 | 108.1 | N77 | C75-N77 PolarHBondContact O-N 3Š| ||
| 76 | T | 35.1 | Very low | 40.9 | Very low | 124 Ų | 124 | 143.4 Ų | 143.4 | 76% | 0.761 | 81% | 0.807 | S | S | * | * | trans | -76.8 | 103.2 | 172.6 | 49.4 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 77 | N | 36.7 | Very low | 41.1 | Very low | 146 Ų | 146 | 145 Ų | 145 | 78% | 0.781 | 81% | 0.809 | S | S | * | * | trans | -79.4 | 125.6 | 161 | -65.8 | -30.1 | 0 | 0 | 0 | 107.5 | C75 | C75-N77 PolarHBondContact O-N 3Š| ||
| 78 | K | 49.7 | Very low | 41.3 | Very low | 209 Ų | 209 | 147 Ų | 147 | 91% | 0.909 | 81% | 0.805 | S | S | * | * | trans | -95.4 | 114.7 | 160 | -88.3 | 179.8 | 176.7 | 168.6 | 0 | 107.4 | ||||
| 79 | E | 46.6 | Very low | 41.2 | Very low | 167 Ų | 167 | 144.6 Ų | 144.6 | 78% | 0.78 | 80% | 0.802 | S | S | * | * | trans | -55.4 | 134 | 162 | -62.1 | 155 | 170.1 | 0 | 0 | 109.1 | ||||
| 80 | E | 46 | Very low | 41.5 | Very low | 195 Ų | 195 | 145.1 Ų | 145.1 | 91% | 0.911 | 80% | 0.8 | S | S | * | * | trans | -132.5 | 112.2 | 139.3 | -74.1 | -164.4 | 171.6 | 0 | 0 | 106.9 | ||||
| 81 | E | 48.4 | Very low | 41.2 | Very low | 170 Ų | 170 | 146.3 Ų | 146.3 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | trans | -68.8 | 132.6 | 170.2 | -60.1 | 172.3 | 147 | 0 | 0 | 108.4 | ||||
| 82 | D | 38.5 | Very low | 41.2 | Very low | 161 Ų | 161 | 147.6 Ų | 147.6 | 86% | 0.861 | 79% | 0.79 | S | S | * | * | trans | -137.1 | 86.7 | 150.4 | -85.5 | -36.9 | 0 | 0 | 0 | 106.7 | ||||
| 83 | A | 46.6 | Very low | 41.6 | Very low | 91 Ų | 91 | 150.8 Ų | 150.8 | 75% | 0.752 | 78% | 0.784 | S | S | * | * | trans | -83.6 | 103.4 | 165.4 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 84 | D | 40.3 | Very low | 41.4 | Very low | 157 Ų | 157 | 155.7 Ų | 155.7 | 84% | 0.84 | 79% | 0.794 | S | S | * | * | trans | -118.3 | 80.5 | 158.1 | -80.6 | -35 | 0 | 0 | 0 | 108.1 | D86 | D84-D86 PolarHBondContact O-N 3.21Š| ||
| 85 | E | 48.6 | Very low | 41.7 | Very low | 193 Ų | 193 | 153.9 Ų | 153.9 | 90% | 0.902 | 79% | 0.793 | S | S | * | * | trans | -68.7 | 108.5 | 153.2 | -81 | -167.5 | 155.4 | 0 | 0 | 108.1 | ||||
| 86 | D | 41.7 | Very low | 41.9 | Very low | 145 Ų | 145 | 157.1 Ų | 157.1 | 78% | 0.775 | 79% | 0.794 | S | S | * | * | trans | -135.1 | 66.8 | 158.5 | -139 | -3.3 | 0 | 0 | 0 | 109.5 | D84 R88 | D84-D86 PolarHBondContact O-N 3.21Å; D86-R88 PolarHBondContact O-N 3.48Å | ||
| 87 | N | 47.2 | Very low | 42.5 | Very low | 158 Ų | 158 | 157.7 Ų | 157.7 | 85% | 0.845 | 79% | 0.793 | S | S | * | * | trans | -93.9 | 69.3 | 165.4 | -173.5 | 28 | 0 | 0 | 0 | 109.2 | G89 | N87-G89 VanDerWaalsContact C-N 3.26Å; N87-G89 PolarHBondContact O-N 3Å; N87-G89 VanDerWaalsContact O-N 3.13Å | ||
| 88 | R | 42.8 | Very low | 43 | Very low | 210 Ų | 210 | 156.3 Ų | 156.3 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | -81.2 | 80.7 | 162.7 | -109.8 | -178.8 | -164.5 | -112 | 1.2 | 109 | D86 E90 | D86-R88 PolarHBondContact O-N 3.48Å; R88-E90 PolarHBondContact O-N 2.89Å; R88-E90 VanDerWaalsContact O-N 3.1Å | ||
| 89 | G | 42.1 | Very low | 42.8 | Very low | 61 Ų | 61 | 155.8 Ų | 155.8 | 63% | 0.629 | 79% | 0.792 | S | S | * | * | trans | -63.5 | 101.6 | 157.2 | 0 | 0 | 0 | 0 | 0 | 109 | N87 E91 | N87-G89 VanDerWaalsContact C-N 3.26Å; N87-G89 PolarHBondContact O-N 3Å; N87-G89 VanDerWaalsContact O-N 3.13Å; G89-E91 VanDerWaalsContact C-N 3.25Å; G89-E91 PolarHBondContact O-N 3.16Å | ||
| 90 | E | 41.2 | Very low | 42.6 | Very low | 170 Ų | 170 | 151.5 Ų | 151.5 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | trans | -72 | 86.7 | 163 | -79 | -173.1 | 152.6 | 0 | 0 | 108.4 | R88 T92 | R88-E90 PolarHBondContact O-N 2.89Å; R88-E90 VanDerWaalsContact O-N 3.1Å; E90-T92 PolarHBondContact O-N 3.44Å; E90-T92 VanDerWaalsContact O-N 3.13Å | ||
| 91 | E | 39.7 | Very low | 42.7 | Very low | 143 Ų | 143 | 146 Ų | 146 | 67% | 0.668 | 79% | 0.789 | S | S | * | * | trans | -65.4 | 96.4 | 157.7 | -92.8 | -165.4 | 161.5 | 0 | 0 | 108.5 | G89 R93 | G89-E91 VanDerWaalsContact C-N 3.25Å; G89-E91 PolarHBondContact O-N 3.16Å; E91-R93 VanDerWaalsContact CD-NH1 3.33Å; E91-R93 PolarHBondContact O-N 3.21Å; E91-R93 IonicContact OE1-NH1 3.51Å; E91-R93 PolarHBondContact OE1-NH1 2.92Å; E91-R93 IonicContact OE2-NH1 2.71Å; E91-R93 PolarHBondContact OE2-NH1 3.28Å | ||
| 92 | T | 38.1 | Very low | 42.6 | Very low | 121 Ų | 121 | 144.9 Ų | 144.9 | 74% | 0.742 | 79% | 0.788 | S | S | * | * | trans | -76.8 | 73 | 162.7 | -47.1 | 0 | 0 | 0 | 0 | 109 | E90 F94 | E90-T92 PolarHBondContact O-N 3.44Å; E90-T92 VanDerWaalsContact O-N 3.13Å; T92-F94 PolarHBondContact O-N 3.35Å | ||
| 93 | R | 42.1 | Very low | 43 | Very low | 189 Ų | 189 | 144.7 Ų | 144.7 | 71% | 0.713 | 78% | 0.782 | S | S | * | * | trans | -76.3 | 93.5 | 161.8 | -94.6 | -178.5 | 156.5 | 113.2 | -2.7 | 108.1 | E91 | E91-R93 VanDerWaalsContact CD-NH1 3.33Å; E91-R93 PolarHBondContact O-N 3.21Å; E91-R93 IonicContact OE1-NH1 3.51Å; E91-R93 PolarHBondContact OE1-NH1 2.92Å; E91-R93 IonicContact OE2-NH1 2.71Å; E91-R93 PolarHBondContact OE2-NH1 3.28Å | ||
| 94 | F | 34.2 | Very low | 43.3 | Very low | 194 Ų | 194 | 146.3 Ų | 146.3 | 85% | 0.851 | 78% | 0.783 | S | S | * | * | trans | -90.8 | 105.2 | 166.2 | -133 | -91.2 | 0 | 0 | 0 | 108.8 | T92 | T92-F94 PolarHBondContact O-N 3.35Š| ||
| 95 | S | 40.1 | Very low | 43.7 | Very low | 106 Ų | 106 | 144.6 Ų | 144.6 | 74% | 0.741 | 78% | 0.78 | S | S | * | * | trans | -66.2 | 139.9 | 179.7 | -58.9 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 96 | F | 35.2 | Very low | 43.8 | Very low | 189 Ų | 189 | 143.7 Ų | 143.7 | 83% | 0.829 | 78% | 0.781 | S | S | * | * | trans | -72.4 | 127.5 | 167.6 | -103.9 | -102.6 | 0 | 0 | 0 | 111.1 | ||||
| 97 | N | 46.8 | Very low | 44.3 | Very low | 137 Ų | 137 | 140.2 Ų | 140.2 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | 48.4 | 141.9 | 146.6 | -63.8 | 2.1 | 0 | 0 | 0 | 121.4 | ||||
| 98 | P | 46.2 | Very low | 44 | Very low | 117 Ų | 117 | 141.3 Ų | 141.3 | 76% | 0.76 | 78% | 0.779 | S | S | * | * | -140.7 | 142.4 | 87.4 | 33.6 | -15.8 | 0 | 0 | 0 | 116.2 | |||||
| 99 | E | 47.2 | Very low | 44.6 | Very low | 197 Ų | 197 | 134.9 Ų | 134.9 | 92% | 0.921 | 77% | 0.767 | S | S | * | * | 53.4 | 121.4 | 128 | -143.6 | 167.1 | -161.6 | 0 | 0 | 121 | |||||
| 100 | G | 42.3 | Very low | 45.3 | Very low | 77 Ų | 77 | 138.5 Ų | 138.5 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | 175.6 | 84.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 101 | G | 46.7 | Very low | 46.2 | Very low | 80 Ų | 80 | 133.2 Ų | 133.2 | 83% | 0.825 | 76% | 0.757 | S | S | * | * | trans | -72.6 | 134.2 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 102 | D | 46.8 | Very low | 47.3 | Very low | 146 Ų | 146 | 129.4 Ų | 129.4 | 78% | 0.781 | 75% | 0.746 | S | S | * | * | trans | -166.6 | 127.2 | 152 | -149 | 34.3 | 0 | 0 | 0 | 110.3 | ||||
| 103 | E | 46.7 | Very low | 48.6 | Very low | 157 Ų | 157 | 132.9 Ų | 132.9 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | trans | 41.3 | 118.4 | 156.1 | -47.8 | -60 | 104.6 | 0 | 0 | 120.7 | P105 | E103-P105 WeakPolarHBondContact O-CD 3.45Š| ||
| 104 | T | 53.3 | Low | 50.1 | Low | 125 Ų | 125 | 125.4 Ų | 125.4 | 77% | 0.767 | 73% | 0.727 | S | S | * | * | trans | -75.4 | 126.8 | 166.9 | -48.5 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 105 | P | 49.6 | Very low | 51.9 | Low | 122 Ų | 122 | 125.3 Ų | 125.3 | 79% | 0.792 | 72% | 0.721 | S | S | * | * | trans | -102.7 | 108.6 | 158.2 | 9.7 | 11.2 | 0 | 0 | 0 | 109.3 | E103 G107 | E103-P105 WeakPolarHBondContact O-CD 3.45Å; P105-G107 PolarHBondContact O-N 3.41Å | ||
| 106 | L | 50.6 | Low | 53.8 | Low | 174 Ų | 174 | 124.2 Ų | 124.2 | 91% | 0.911 | 71% | 0.713 | S | S | * | * | trans | -63 | 117.6 | 166.8 | -74.6 | 159.3 | 0 | 0 | 0 | 109.4 | ||||
| 107 | G | 51.2 | Low | 56.4 | Low | 72 Ų | 72 | 120 Ų | 120 | 74% | 0.742 | 70% | 0.699 | S | S | * | * | trans | 136.9 | 70.3 | 160.9 | 0 | 0 | 0 | 0 | 0 | 116.9 | P105 | P105-G107 PolarHBondContact O-N 3.41Š| ||
| 108 | Q | 41.6 | Very low | 58.4 | Low | 180 Ų | 180 | 117.3 Ų | 117.3 | 84% | 0.841 | 68% | 0.684 | S | S | * | * | trans | -141.6 | 132.1 | 155.5 | -67.1 | -169.5 | 17.5 | 0 | 0 | 110.8 | ||||
| 109 | S | 54.1 | Low | 60.5 | Low | 76 Ų | 76 | 115.9 Ų | 115.9 | 53% | 0.531 | 67% | 0.667 | S | S | . | * | trans | -53 | 135 | -171.6 | 170.7 | 0 | 0 | 0 | 0 | 115.6 | A111 S112 | S109-A111 PolarHBondContact O-N 3.26Å; S109-A111 VanDerWaalsContact O-N 3.17Å; S109-A111 PolarHBondContact OG-N 2.93Å; S109-S112 PolarHBondContact O-N 3.46Å; S109-S112 VanDerWaalsContact O-N 3.13Å; S109-S112 PolarHBondContact O-OG 3.14Å | ||
| 110 | D | 57.6 | Low | 62.6 | Low | 137 Ų | 137 | 111.1 Ų | 111.1 | 73% | 0.733 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -59.7 | -23.4 | 177.1 | -73 | -41.7 | 0 | 0 | 0 | 114 | S112 G114 | D110-S112 VanDerWaalsContact C-N 3.32Å; D110-S112 PolarHBondContact O-N 2.97Å; D110-G114 PolarHBondContact O-N 2.9Å |
| 111 | A | 60.5 | Low | 65 | Low | 59 Ų | 59 | 112.5 Ų | 112.5 | 49% | 0.488 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -71.2 | -25.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | S109 R115 | S109-A111 PolarHBondContact O-N 3.26Å; S109-A111 VanDerWaalsContact O-N 3.17Å; S109-A111 PolarHBondContact OG-N 2.93Å; A111-R115 PolarHBondContact O-N 3.34Å |
| 112 | S | 61.9 | Low | 67.2 | Low | 63 Ų | 63 | 116.4 Ų | 116.4 | 44% | 0.441 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -77.4 | -40.4 | 177 | 1.6 | 0 | 0 | 0 | 0 | 111.7 | S109 D110 R115 S116 | S109-S112 PolarHBondContact O-N 3.46Å; S109-S112 VanDerWaalsContact O-N 3.13Å; S109-S112 PolarHBondContact O-OG 3.14Å; D110-S112 VanDerWaalsContact C-N 3.32Å; D110-S112 PolarHBondContact O-N 2.97Å; S112-R115 PolarHBondContact O-N 3.41Å; S112-S116 PolarHBondContact O-N 3.03Å; S112-S116 VanDerWaalsContact O-N 3.13Å |
| 113 | R | 66.9 | Low | 69.4 | Low | 193 Ų | 193 | 114.5 Ų | 114.5 | 73% | 0.728 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -64.7 | -42.3 | 174.6 | -74.5 | 175.2 | 102.8 | 172.3 | 6 | 111.6 | R115 S116 L117 | R113-R115 PolarHBondContact O-N 3.42Å; R113-S116 PolarHBondContact O-N 3.32Å; R113-L117 PolarHBondContact O-N 3.49Å |
| 114 | G | 71.6 | Confident | 71.7 | Confident | 32 Ų | 32 | 111.7 Ų | 111.7 | 33% | 0.33 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -62 | -40.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | D110 I118 | D110-G114 PolarHBondContact O-N 2.9Å; G114-I118 WeakPolarHBondContact O-CD1 3.36Å; G114-I118 VanDerWaalsContact O-CG1 3.23Å; G114-I118 WeakPolarHBondContact O-CG1 3.46Å; G114-I118 PolarHBondContact O-N 3.41Å; G114-I118 VanDerWaalsContact O-N 3.15Å |
| 115 | R | 73.8 | Confident | 73.7 | Confident | 193 Ų | 193 | 109.3 Ų | 109.3 | 73% | 0.728 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66.1 | -41.4 | 174.6 | -78.4 | -175.5 | -142.6 | -123.3 | 1.4 | 113 | A111 S112 R113 I118 Q119 | A111-R115 PolarHBondContact O-N 3.34Å; S112-R115 PolarHBondContact O-N 3.41Å; R113-R115 PolarHBondContact O-N 3.42Å; R115-I118 PolarHBondContact O-N 3.45Å; R115-Q119 WeakPolarHBondContact O-CB 3.38Å; R115-Q119 PolarHBondContact O-N 3.11Å |
| 116 | S | 79.9 | Confident | 76 | Confident | 82 Ų | 82 | 106 Ų | 106 | 57% | 0.573 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62.4 | -43 | 178.1 | -166.8 | 0 | 0 | 0 | 0 | 111.7 | S112 R113 Q119 Q120 | S112-S116 PolarHBondContact O-N 3.03Å; S112-S116 VanDerWaalsContact O-N 3.13Å; R113-S116 PolarHBondContact O-N 3.32Å; S116-Q119 PolarHBondContact O-N 2.88Å; S116-Q120 PolarHBondContact O-N 3.49Å |
| 117 | L | 88.9 | Confident | 78.1 | Confident | 102 Ų | 102 | 99.5 Ų | 99.5 | 53% | 0.534 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.7 | -42.4 | 178.2 | -178.3 | 63.8 | 0 | 0 | 0 | 112.3 | R113 Q119 Q120 M121 | R113-L117 PolarHBondContact O-N 3.49Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 2.99Å; L117-Q120 PolarHBondContact O-N 3.21Å; L117-M121 WeakPolarHBondContact O-CG 3.46Å; L117-M121 PolarHBondContact O-N 2.95Å |
| 118 | I | 88.5 | Confident | 80.4 | Confident | 80 Ų | 80 | 101.5 Ų | 101.5 | 41% | 0.41 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.1 | -38.6 | 177.6 | -69.2 | 165.4 | 0 | 0 | 0 | 111.2 | G114 R115 R122 | G114-I118 WeakPolarHBondContact O-CD1 3.36Å; G114-I118 VanDerWaalsContact O-CG1 3.23Å; G114-I118 WeakPolarHBondContact O-CG1 3.46Å; G114-I118 PolarHBondContact O-N 3.41Å; G114-I118 VanDerWaalsContact O-N 3.15Å; R115-I118 PolarHBondContact O-N 3.45Å; I118-R122 WeakPolarHBondContact O-CG 3.47Å; I118-R122 PolarHBondContact O-N 3.17Å; I118-R122 VanDerWaalsContact O-N 3.12Å |
| 119 | Q | 90.3 | Very high | 83 | Confident | 87 Ų | 87 | 100.1 Ų | 100.1 | 41% | 0.407 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.7 | -44.8 | 177 | -176.6 | 60.5 | 21.6 | 0 | 0 | 111.6 | R115 S116 L117 M121 R122 E123 | R115-Q119 WeakPolarHBondContact O-CB 3.38Å; R115-Q119 PolarHBondContact O-N 3.11Å; S116-Q119 PolarHBondContact O-N 2.88Å; L117-Q119 VanDerWaalsContact C-N 3.31Å; L117-Q119 PolarHBondContact O-N 2.99Å; Q119-M121 PolarHBondContact O-N 3.46Å; Q119-R122 WeakPolarHBondContact O-CB 3.49Å; Q119-R122 PolarHBondContact O-N 3.29Å; Q119-R122 VanDerWaalsContact O-N 3.11Å; Q119-E123 WeakPolarHBondContact CG-OE1 3.43Å; Q119-E123 PolarHBondContact NE2-OE1 2.82Å; Q119-E123 PolarHBondContact O-N 3.5Å |
| 120 | Q | 91.8 | Very high | 85.1 | Confident | 96 Ų | 96 | 103.8 Ų | 103.8 | 45% | 0.449 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -58 | -47.7 | 174.8 | -177.2 | -178.9 | -9.2 | 0 | 0 | 111.6 | S116 L117 R122 E123 E124 | S116-Q120 PolarHBondContact O-N 3.49Å; L117-Q120 PolarHBondContact O-N 3.21Å; Q120-R122 PolarHBondContact O-N 2.9Å; Q120-E123 PolarHBondContact O-N 2.9Å; Q120-E123 VanDerWaalsContact O-N 3.15Å; Q120-E124 HydrophobicContact CG-CG 4.45Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.46Å; Q120-E124 PolarHBondContact NE2-OE1 3.33Å; Q120-E124 WeakPolarHBondContact O-CB 3.44Å; Q120-E124 WeakPolarHBondContact O-CG 3.46Å; Q120-E124 PolarHBondContact O-N 2.93Å |
| 121 | M | 92.3 | Very high | 87 | Confident | 106 Ų | 106 | 100.3 Ų | 100.3 | 52% | 0.522 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -60 | -34.4 | 176.6 | -72.5 | -161.8 | -54.1 | 0 | 0 | 112.7 | L117 Q119 N125 | L117-M121 WeakPolarHBondContact O-CG 3.46Å; L117-M121 PolarHBondContact O-N 2.95Å; Q119-M121 PolarHBondContact O-N 3.46Å; M121-N125 VanDerWaalsContact O-CB 3.22Å; M121-N125 WeakPolarHBondContact O-CB 3.4Å; M121-N125 PolarHBondContact O-N 3.37Å |
| 122 | R | 93.1 | Very high | 88.8 | Confident | 162 Ų | 162 | 101 Ų | 101 | 61% | 0.611 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -68.4 | -42.1 | 176.1 | -76.3 | 173.6 | 176 | 163.2 | -0.7 | 111.9 | I118 Q119 Q120 N125 S126 | I118-R122 WeakPolarHBondContact O-CG 3.47Å; I118-R122 PolarHBondContact O-N 3.17Å; I118-R122 VanDerWaalsContact O-N 3.12Å; Q119-R122 WeakPolarHBondContact O-CB 3.49Å; Q119-R122 PolarHBondContact O-N 3.29Å; Q119-R122 VanDerWaalsContact O-N 3.11Å; Q120-R122 PolarHBondContact O-N 2.9Å; R122-N125 PolarHBondContact O-N 3.32Å; R122-S126 WeakPolarHBondContact O-CB 3.41Å; R122-S126 PolarHBondContact O-N 3.5Å |
| 123 | E | 93.9 | Very high | 90.5 | Very high | 106 Ų | 106 | 105.3 Ų | 105.3 | 50% | 0.495 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.6 | -45.5 | 177.5 | -73 | 168.6 | -164.8 | 0 | 0 | 111 | Q119 Q120 N125 S126 A127 | Q119-E123 WeakPolarHBondContact CG-OE1 3.43Å; Q119-E123 PolarHBondContact NE2-OE1 2.82Å; Q119-E123 PolarHBondContact O-N 3.5Å; Q120-E123 PolarHBondContact O-N 2.9Å; Q120-E123 VanDerWaalsContact O-N 3.15Å; E123-N125 PolarHBondContact O-N 3Å; E123-S126 WeakPolarHBondContact O-CB 3.43Å; E123-S126 PolarHBondContact O-N 3.45Å; E123-S126 VanDerWaalsContact O-N 3.17Å; E123-S126 PolarHBondContact O-OG 2.97Å; E123-A127 WeakPolarHBondContact O-CB 3.46Å; E123-A127 PolarHBondContact O-N 2.94Å |
| 124 | E | 95 | Very high | 91.9 | Very high | 99 Ų | 99 | 99.6 Ų | 99.6 | 46% | 0.463 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60.3 | -45.3 | 173.4 | -72 | 174.7 | -170.2 | 0 | 0 | 111.5 | Q120 S126 A127 L128 | Q120-E124 HydrophobicContact CG-CG 4.45Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.46Å; Q120-E124 PolarHBondContact NE2-OE1 3.33Å; Q120-E124 WeakPolarHBondContact O-CB 3.44Å; Q120-E124 WeakPolarHBondContact O-CG 3.46Å; Q120-E124 PolarHBondContact O-N 2.93Å; E124-S126 VanDerWaalsContact C-N 3.28Å; E124-S126 PolarHBondContact O-N 3.49Å; E124-A127 WeakPolarHBondContact O-CB 3.47Å; E124-A127 PolarHBondContact O-N 2.85Å; E124-A127 VanDerWaalsContact O-N 3.08Å; E124-L128 WeakPolarHBondContact O-CB 3.31Å; E124-L128 WeakPolarHBondContact O-CG 3.45Å; E124-L128 PolarHBondContact O-N 3Å |
| 125 | N | 95.4 | Very high | 93.1 | Very high | 75 Ų | 75 | 102.9 Ų | 102.9 | 40% | 0.401 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -37.5 | 176.3 | -154 | -88.6 | 0 | 0 | 0 | 111.5 | M121 R122 E123 A127 R129 | M121-N125 VanDerWaalsContact O-CB 3.22Å; M121-N125 WeakPolarHBondContact O-CB 3.4Å; M121-N125 PolarHBondContact O-N 3.37Å; R122-N125 PolarHBondContact O-N 3.32Å; E123-N125 PolarHBondContact O-N 3Å; N125-A127 VanDerWaalsContact C-N 3.35Å; N125-R129 WeakPolarHBondContact O-CB 3.38Å; N125-R129 VanDerWaalsContact O-CG 3.22Å; N125-R129 WeakPolarHBondContact O-CG 3.48Å; N125-R129 PolarHBondContact O-N 2.89Å; N125-R129 PolarHBondContact OD1-NE 3.48Å; N125-R129 PolarHBondContact OD1-NH2 3.33Å |
| 126 | S | 96.3 | Very high | 94.3 | Very high | 51 Ų | 51 | 98.8 Ų | 98.8 | 36% | 0.357 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -65.2 | -38.1 | 173.8 | 87.8 | 0 | 0 | 0 | 0 | 112.1 | R122 E123 E124 R130 | R122-S126 WeakPolarHBondContact O-CB 3.41Å; R122-S126 PolarHBondContact O-N 3.5Å; E123-S126 WeakPolarHBondContact O-CB 3.43Å; E123-S126 PolarHBondContact O-N 3.45Å; E123-S126 VanDerWaalsContact O-N 3.17Å; E123-S126 PolarHBondContact O-OG 2.97Å; E124-S126 VanDerWaalsContact C-N 3.28Å; E124-S126 PolarHBondContact O-N 3.49Å; S126-R130 WeakPolarHBondContact O-CG 3.5Å; S126-R130 PolarHBondContact O-N 3.24Å; S126-R130 VanDerWaalsContact O-N 3.12Å; S126-R130 PolarHBondContact O-NE 3.29Å; S126-R130 PolarHBondContact OG-NH2 3.39Å |
| 127 | A | 96.6 | Very high | 95.2 | Very high | 39 Ų | 39 | 102.3 Ų | 102.3 | 32% | 0.322 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -70.1 | -45.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | E123 E124 N125 R129 R130 S131 | E123-A127 WeakPolarHBondContact O-CB 3.46Å; E123-A127 PolarHBondContact O-N 2.94Å; E124-A127 WeakPolarHBondContact O-CB 3.47Å; E124-A127 PolarHBondContact O-N 2.85Å; E124-A127 VanDerWaalsContact O-N 3.08Å; N125-A127 VanDerWaalsContact C-N 3.35Å; A127-R129 PolarHBondContact O-N 2.85Å; A127-R130 WeakPolarHBondContact O-CB 3.41Å; A127-R130 PolarHBondContact O-N 2.92Å; A127-R130 VanDerWaalsContact O-N 3.15Å; A127-S131 PolarHBondContact O-N 3.21Å |
| 128 | L | 97.6 | Very high | 95.6 | Very high | 113 Ų | 113 | 103.8 Ų | 103.8 | 59% | 0.592 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60 | -44.2 | 174.6 | -70.6 | 173.2 | 0 | 0 | 0 | 111.4 | E124 R130 S131 V132 | E124-L128 WeakPolarHBondContact O-CB 3.31Å; E124-L128 WeakPolarHBondContact O-CG 3.45Å; E124-L128 PolarHBondContact O-N 3Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 3.44Å; L128-S131 PolarHBondContact O-N 3.48Å; L128-V132 WeakPolarHBondContact O-CG2 3.44Å; L128-V132 PolarHBondContact O-N 3.22Å |
| 129 | R | 97.6 | Very high | 96 | Very high | 152 Ų | 152 | 102.7 Ų | 102.7 | 57% | 0.574 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -61.3 | -37.7 | 175.3 | -74 | 173.5 | -170.7 | -87.1 | -0.8 | 112.6 | N125 A127 R133 | N125-R129 WeakPolarHBondContact O-CB 3.38Å; N125-R129 VanDerWaalsContact O-CG 3.22Å; N125-R129 WeakPolarHBondContact O-CG 3.48Å; N125-R129 PolarHBondContact O-N 2.89Å; N125-R129 PolarHBondContact OD1-NE 3.48Å; N125-R129 PolarHBondContact OD1-NH2 3.33Å; A127-R129 PolarHBondContact O-N 2.85Å; R129-R133 VanDerWaalsContact O-CG 3.3Å; R129-R133 WeakPolarHBondContact O-CG 3.5Å; R129-R133 PolarHBondContact O-N 3.46Å |
| 130 | R | 97.4 | Very high | 96.4 | Very high | 153 Ų | 153 | 104.1 Ų | 104.1 | 58% | 0.577 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.3 | -45.8 | 173.3 | -76.6 | 179.8 | -79.4 | 123.2 | -8.9 | 111.1 | S126 A127 L128 V132 R133 E134 | S126-R130 WeakPolarHBondContact O-CG 3.5Å; S126-R130 PolarHBondContact O-N 3.24Å; S126-R130 VanDerWaalsContact O-N 3.12Å; S126-R130 PolarHBondContact O-NE 3.29Å; S126-R130 PolarHBondContact OG-NH2 3.39Å; A127-R130 WeakPolarHBondContact O-CB 3.41Å; A127-R130 PolarHBondContact O-N 2.92Å; A127-R130 VanDerWaalsContact O-N 3.15Å; L128-R130 VanDerWaalsContact C-N 3.3Å; L128-R130 PolarHBondContact O-N 3.44Å; R130-V132 PolarHBondContact O-N 2.93Å; R130-R133 PolarHBondContact O-N 3.44Å; R130-E134 PolarHBondContact O-N 2.96Å |
| 131 | S | 97.5 | Very high | 96.7 | Very high | 63 Ų | 63 | 105.5 Ų | 105.5 | 44% | 0.441 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -60.7 | -42.8 | 177.4 | -168.8 | 0 | 0 | 0 | 0 | 112.4 | A127 L128 E134 L135 | A127-S131 PolarHBondContact O-N 3.21Å; L128-S131 PolarHBondContact O-N 3.48Å; S131-E134 PolarHBondContact O-N 2.96Å; S131-L135 WeakPolarHBondContact O-CB 3.33Å; S131-L135 WeakPolarHBondContact O-CG 3.35Å; S131-L135 PolarHBondContact O-N 2.94Å |
| 132 | V | 97.9 | Very high | 97 | Very high | 75 Ų | 75 | 106.4 Ų | 106.4 | 46% | 0.455 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.4 | -44.4 | 177.1 | 169.4 | 0 | 0 | 0 | 0 | 111 | L128 R130 E134 L135 Q136 | L128-V132 WeakPolarHBondContact O-CG2 3.44Å; L128-V132 PolarHBondContact O-N 3.22Å; R130-V132 PolarHBondContact O-N 2.93Å; V132-E134 VanDerWaalsContact C-N 3.32Å; V132-E134 PolarHBondContact O-N 3.43Å; V132-L135 PolarHBondContact O-N 2.96Å; V132-Q136 HydrophobicContact CG1-CG 4.44Å; V132-Q136 WeakPolarHBondContact O-CB 3.3Å; V132-Q136 VanDerWaalsContact O-CG 3.24Å; V132-Q136 WeakPolarHBondContact O-CG 3.46Å; V132-Q136 PolarHBondContact O-N 3.47Å |
| 133 | R | 97.6 | Very high | 97.2 | Very high | 153 Ų | 153 | 103.6 Ų | 103.6 | 58% | 0.577 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63 | -39.4 | 177.1 | -70.8 | 173.7 | -166.3 | 177.4 | 3.1 | 112.2 | R129 R130 Q136 R137 | R129-R133 VanDerWaalsContact O-CG 3.3Å; R129-R133 WeakPolarHBondContact O-CG 3.5Å; R129-R133 PolarHBondContact O-N 3.46Å; R130-R133 PolarHBondContact O-N 3.44Å; R133-Q136 PolarHBondContact O-N 3.29Å; R133-R137 WeakPolarHBondContact O-CG 3.4Å; R133-R137 PolarHBondContact O-N 3.34Å |
| 134 | E | 97.6 | Very high | 97.4 | Very high | 72 Ų | 72 | 102 Ų | 102 | 34% | 0.336 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.4 | -43.7 | 178.3 | -177.4 | 56.1 | -155.4 | 0 | 0 | 111.6 | R130 S131 V132 Q136 R137 R138 | R130-E134 PolarHBondContact O-N 2.96Å; S131-E134 PolarHBondContact O-N 2.96Å; V132-E134 VanDerWaalsContact C-N 3.32Å; V132-E134 PolarHBondContact O-N 3.43Å; E134-Q136 VanDerWaalsContact C-N 3.31Å; E134-Q136 PolarHBondContact O-N 2.94Å; E134-R137 PolarHBondContact O-N 2.91Å; E134-R138 WeakPolarHBondContact O-CG 3.46Å; E134-R138 PolarHBondContact O-N 3.3Å; E134-R138 IonicContact OE1-CZ 2.86Å; E134-R138 IonicContact OE1-NE 2.75Å; E134-R138 PolarHBondContact OE1-NE 2.91Å; E134-R138 IonicContact OE1-NH2 3.24Å; E134-R138 PolarHBondContact OE1-NH2 3.46Å |
| 135 | L | 97.4 | Very high | 97.6 | Very high | 101 Ų | 101 | 105.4 Ų | 105.4 | 53% | 0.529 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.7 | -40.2 | 172.7 | -73 | 172.3 | 0 | 0 | 0 | 112 | S131 V132 R138 A139 | S131-L135 WeakPolarHBondContact O-CB 3.33Å; S131-L135 WeakPolarHBondContact O-CG 3.35Å; S131-L135 PolarHBondContact O-N 2.94Å; V132-L135 PolarHBondContact O-N 2.96Å; L135-R138 PolarHBondContact O-N 3.48Å; L135-A139 VanDerWaalsContact O-CB 3.31Å; L135-A139 WeakPolarHBondContact O-CB 3.48Å; L135-A139 PolarHBondContact O-N 3.4Å |
| 136 | Q | 97.7 | Very high | 97.7 | Very high | 107 Ų | 107 | 104.2 Ų | 104.2 | 50% | 0.5 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61 | -47 | 175 | -76.8 | 170.8 | -20.6 | 0 | 0 | 111.6 | V132 R133 E134 R138 A139 E140 | V132-Q136 HydrophobicContact CG1-CG 4.44Å; V132-Q136 WeakPolarHBondContact O-CB 3.3Å; V132-Q136 VanDerWaalsContact O-CG 3.24Å; V132-Q136 WeakPolarHBondContact O-CG 3.46Å; V132-Q136 PolarHBondContact O-N 3.47Å; R133-Q136 PolarHBondContact O-N 3.29Å; E134-Q136 VanDerWaalsContact C-N 3.31Å; E134-Q136 PolarHBondContact O-N 2.94Å; Q136-R138 PolarHBondContact O-N 2.89Å; Q136-A139 PolarHBondContact O-N 3.39Å; Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 3.27Å |
| 137 | R | 98 | Very high | 97.8 | Very high | 157 Ų | 157 | 108.7 Ų | 108.7 | 59% | 0.592 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.6 | -45.5 | 176 | -73.3 | 171.7 | 177.1 | -175.2 | -4.6 | 112.2 | R133 E134 A139 E140 L141 | R133-R137 WeakPolarHBondContact O-CG 3.4Å; R133-R137 PolarHBondContact O-N 3.34Å; E134-R137 PolarHBondContact O-N 2.91Å; R137-A139 VanDerWaalsContact C-N 3.35Å; R137-A139 PolarHBondContact O-N 3.04Å; R137-E140 PolarHBondContact O-N 3.34Å; R137-L141 WeakPolarHBondContact O-CG 3.17Å; R137-L141 PolarHBondContact O-N 3.33Å |
| 138 | R | 98.2 | Very high | 97.9 | Very high | 132 Ų | 132 | 114 Ų | 114 | 50% | 0.498 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 176.4 | -68.3 | 174.5 | -167.7 | -175.1 | 0.3 | 111.2 | E134 L135 Q136 E140 L141 H142 | E134-R138 WeakPolarHBondContact O-CG 3.46Å; E134-R138 PolarHBondContact O-N 3.3Å; E134-R138 IonicContact OE1-CZ 2.86Å; E134-R138 IonicContact OE1-NE 2.75Å; E134-R138 PolarHBondContact OE1-NE 2.91Å; E134-R138 IonicContact OE1-NH2 3.24Å; E134-R138 PolarHBondContact OE1-NH2 3.46Å; L135-R138 PolarHBondContact O-N 3.48Å; Q136-R138 PolarHBondContact O-N 2.89Å; R138-E140 PolarHBondContact O-N 2.91Å; R138-L141 PolarHBondContact O-N 2.97Å; R138-H142 PolarHBondContact O-CD2 2.87Å; R138-H142 PolarHBondContact O-N 3.47Å |
| 139 | A | 97.5 | Very high | 98 | Very high | 58 Ų | 58 | 112.1 Ų | 112.1 | 48% | 0.479 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.7 | -42.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | L135 Q136 R137 H142 Q143 | L135-A139 VanDerWaalsContact O-CB 3.31Å; L135-A139 WeakPolarHBondContact O-CB 3.48Å; L135-A139 PolarHBondContact O-N 3.4Å; Q136-A139 PolarHBondContact O-N 3.39Å; R137-A139 VanDerWaalsContact C-N 3.35Å; R137-A139 PolarHBondContact O-N 3.04Å; A139-H142 PolarHBondContact O-N 2.91Å; A139-Q143 VanDerWaalsContact O-CB 3.25Å; A139-Q143 WeakPolarHBondContact O-CB 3.5Å; A139-Q143 PolarHBondContact O-N 3.21Å |
| 140 | E | 98 | Very high | 98 | Very high | 117 Ų | 117 | 107.9 Ų | 107.9 | 55% | 0.547 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 175.8 | -72.9 | 169.5 | -173.2 | 0 | 0 | 112.3 | Q136 R137 R138 Q143 S144 | Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 3.27Å; R137-E140 PolarHBondContact O-N 3.34Å; R138-E140 PolarHBondContact O-N 2.91Å; E140-Q143 PolarHBondContact O-N 3.08Å; E140-S144 WeakPolarHBondContact O-CB 3.41Å; E140-S144 PolarHBondContact O-N 3.35Å; E140-S144 PolarHBondContact O-OG 3.45Å |
| 141 | L | 98.3 | Very high | 98 | Very high | 124 Ų | 124 | 106.6 Ų | 106.6 | 65% | 0.649 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.3 | -47.4 | 174.7 | -71.7 | 170.7 | 0 | 0 | 0 | 111.6 | R137 R138 Q143 S144 R145 | R137-L141 WeakPolarHBondContact O-CG 3.17Å; R137-L141 PolarHBondContact O-N 3.33Å; R138-L141 PolarHBondContact O-N 2.97Å; L141-Q143 VanDerWaalsContact C-N 3.33Å; L141-Q143 PolarHBondContact O-N 3.09Å; L141-S144 PolarHBondContact O-N 3.01Å; L141-R145 WeakPolarHBondContact O-CB 3.4Å; L141-R145 PolarHBondContact O-N 3.43Å |
| 142 | H | 98 | Very high | 98.1 | Very high | 126 Ų | 126 | 106.9 Ų | 106.9 | 58% | 0.583 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.6 | -40 | 175.8 | -72.3 | -56.8 | 0 | 0 | 0 | 111.9 | R138 A139 R145 A146 | R138-H142 PolarHBondContact O-CD2 2.87Å; R138-H142 PolarHBondContact O-N 3.47Å; A139-H142 PolarHBondContact O-N 2.91Å; H142-R145 PolarHBondContact O-N 3.45Å; H142-A146 VanDerWaalsContact O-CB 3.29Å; H142-A146 WeakPolarHBondContact O-CB 3.22Å; H142-A146 PolarHBondContact O-N 2.96Å |
| 143 | Q | 98.4 | Very high | 98.1 | Very high | 103 Ų | 103 | 107.9 Ų | 107.9 | 48% | 0.481 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.2 | -42.9 | 175.8 | -172.7 | 178.8 | 34.7 | 0 | 0 | 111.3 | A139 E140 L141 A146 R147 | A139-Q143 VanDerWaalsContact O-CB 3.25Å; A139-Q143 WeakPolarHBondContact O-CB 3.5Å; A139-Q143 PolarHBondContact O-N 3.21Å; E140-Q143 PolarHBondContact O-N 3.08Å; L141-Q143 VanDerWaalsContact C-N 3.33Å; L141-Q143 PolarHBondContact O-N 3.09Å; Q143-A146 PolarHBondContact O-N 2.86Å; Q143-R147 VanDerWaalsContact NE2-NH2 3.13Å; Q143-R147 WeakPolarHBondContact O-CG 3.44Å; Q143-R147 PolarHBondContact O-N 3.31Å |
| 144 | S | 98.4 | Very high | 98.1 | Very high | 72 Ų | 72 | 105.4 Ų | 105.4 | 50% | 0.503 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.3 | -43 | 177.6 | -58.2 | 0 | 0 | 0 | 0 | 111.6 | E140 L141 R147 R148 | E140-S144 WeakPolarHBondContact O-CB 3.41Å; E140-S144 PolarHBondContact O-N 3.35Å; E140-S144 PolarHBondContact O-OG 3.45Å; L141-S144 PolarHBondContact O-N 3.01Å; S144-R147 PolarHBondContact O-N 3.18Å; S144-R148 PolarHBondContact O-N 3.42Å |
| 145 | R | 98.3 | Very high | 98.2 | Very high | 170 Ų | 170 | 107.2 Ų | 107.2 | 64% | 0.642 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -62 | -44.9 | 174.4 | -175.9 | 175.8 | 178.7 | 173.7 | -0 | 111.7 | L141 H142 R147 R148 L149 | L141-R145 WeakPolarHBondContact O-CB 3.4Å; L141-R145 PolarHBondContact O-N 3.43Å; H142-R145 PolarHBondContact O-N 3.45Å; R145-R147 VanDerWaalsContact C-N 3.33Å; R145-R147 PolarHBondContact O-N 2.98Å; R145-R148 PolarHBondContact O-N 3.38Å; R145-L149 HydrophobicContact CG-CD1 4.05Å; R145-L149 HydrophobicContact CG-CG 4.47Å; R145-L149 WeakPolarHBondContact O-CG 3.41Å; R145-L149 PolarHBondContact O-N 3.26Å |
| 146 | A | 98.2 | Very high | 98.2 | Very high | 51 Ų | 51 | 110 Ų | 110 | 42% | 0.421 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.7 | -40 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112 | H142 Q143 S150 | H142-A146 VanDerWaalsContact O-CB 3.29Å; H142-A146 WeakPolarHBondContact O-CB 3.22Å; H142-A146 PolarHBondContact O-N 2.96Å; Q143-A146 PolarHBondContact O-N 2.86Å; A146-S150 WeakPolarHBondContact O-CB 3.39Å; A146-S150 PolarHBondContact O-N 3.42Å; A146-S150 PolarHBondContact O-OG 3Å |
| 147 | R | 98.4 | Very high | 98.2 | Very high | 144 Ų | 144 | 112.8 Ų | 112.8 | 54% | 0.543 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62 | -51.4 | 174.3 | -73.6 | 176.5 | -173 | -178.8 | 6 | 111.8 | Q143 S144 R145 L149 S150 E151 | Q143-R147 VanDerWaalsContact NE2-NH2 3.13Å; Q143-R147 WeakPolarHBondContact O-CG 3.44Å; Q143-R147 PolarHBondContact O-N 3.31Å; S144-R147 PolarHBondContact O-N 3.18Å; R145-R147 VanDerWaalsContact C-N 3.33Å; R145-R147 PolarHBondContact O-N 2.98Å; R147-L149 PolarHBondContact O-N 3.46Å; R147-S150 WeakPolarHBondContact O-CB 3.48Å; R147-S150 PolarHBondContact O-N 2.98Å; R147-S150 VanDerWaalsContact O-N 3.1Å; R147-E151 WeakPolarHBondContact O-CG 3.48Å; R147-E151 PolarHBondContact O-N 3.49Å |
| 148 | R | 98.5 | Very high | 98.3 | Very high | 150 Ų | 150 | 112.5 Ų | 112.5 | 57% | 0.566 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -57 | -48.2 | 178.5 | -178.9 | -173.4 | 145.4 | -143.6 | -14.2 | 112 | S144 R145 S150 E151 E152 | S144-R148 PolarHBondContact O-N 3.42Å; R145-R148 PolarHBondContact O-N 3.38Å; R148-S150 VanDerWaalsContact C-N 3.28Å; R148-S150 PolarHBondContact O-N 3.05Å; R148-E151 PolarHBondContact O-N 2.83Å; R148-E152 IonicContact CZ-OE1 2.97Å; R148-E152 VanDerWaalsContact CZ-OE1 3.24Å; R148-E152 IonicContact NE-OE1 3.94Å; R148-E152 PolarHBondContact NE-OE1 3.27Å; R148-E152 IonicContact NH2-OE1 2.97Å; R148-E152 PolarHBondContact NH2-OE1 2.71Å; R148-E152 IonicContact NH2-OE2 2.9Å; R148-E152 WeakPolarHBondContact O-CG 3.5Å; R148-E152 PolarHBondContact O-N 2.73Å |
| 149 | L | 98.5 | Very high | 98.3 | Very high | 74 Ų | 74 | 110.6 Ų | 110.6 | 39% | 0.387 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.3 | -35.9 | 177.9 | -70.2 | 173.7 | 0 | 0 | 0 | 112 | R145 R147 E152 L153 | R145-L149 HydrophobicContact CG-CD1 4.05Å; R145-L149 HydrophobicContact CG-CG 4.47Å; R145-L149 WeakPolarHBondContact O-CG 3.41Å; R145-L149 PolarHBondContact O-N 3.26Å; R147-L149 PolarHBondContact O-N 3.46Å; L149-E152 PolarHBondContact O-N 3.13Å; L149-L153 WeakPolarHBondContact O-CB 3.38Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.31Å; L149-L153 PolarHBondContact O-N 3.4Å |
| 150 | S | 97.6 | Very high | 98.3 | Very high | 64 Ų | 64 | 113.5 Ų | 113.5 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.7 | -40.6 | 175.7 | -59.3 | 0 | 0 | 0 | 0 | 111.8 | A146 R147 R148 L153 Q154 | A146-S150 WeakPolarHBondContact O-CB 3.39Å; A146-S150 PolarHBondContact O-N 3.42Å; A146-S150 PolarHBondContact O-OG 3Å; R147-S150 WeakPolarHBondContact O-CB 3.48Å; R147-S150 PolarHBondContact O-N 2.98Å; R147-S150 VanDerWaalsContact O-N 3.1Å; R148-S150 VanDerWaalsContact C-N 3.28Å; R148-S150 PolarHBondContact O-N 3.05Å; S150-L153 PolarHBondContact O-N 2.93Å; S150-Q154 WeakPolarHBondContact O-CG 3.31Å; S150-Q154 PolarHBondContact O-N 2.9Å |
| 151 | E | 98.5 | Very high | 98.3 | Very high | 126 Ų | 126 | 113.7 Ų | 113.7 | 59% | 0.589 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.8 | -46.1 | 175 | -70.7 | 167 | -173.4 | 0 | 0 | 111.5 | R147 R148 L153 Q154 Q155 | R147-E151 WeakPolarHBondContact O-CG 3.48Å; R147-E151 PolarHBondContact O-N 3.49Å; R148-E151 PolarHBondContact O-N 2.83Å; E151-L153 PolarHBondContact O-N 2.9Å; E151-Q154 PolarHBondContact O-N 2.81Å; E151-Q155 PolarHBondContact O-N 3.34Å |
| 152 | E | 98.5 | Very high | 98.3 | Very high | 69 Ų | 69 | 112.3 Ų | 112.3 | 32% | 0.322 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59 | -44.5 | 175.4 | -73.9 | 176.2 | -170.6 | 0 | 0 | 111.4 | R148 L149 Q154 Q155 R156 | R148-E152 IonicContact CZ-OE1 2.97Å; R148-E152 VanDerWaalsContact CZ-OE1 3.24Å; R148-E152 IonicContact NE-OE1 3.94Å; R148-E152 PolarHBondContact NE-OE1 3.27Å; R148-E152 IonicContact NH2-OE1 2.97Å; R148-E152 PolarHBondContact NH2-OE1 2.71Å; R148-E152 IonicContact NH2-OE2 2.9Å; R148-E152 WeakPolarHBondContact O-CG 3.5Å; R148-E152 PolarHBondContact O-N 2.73Å; L149-E152 PolarHBondContact O-N 3.13Å; E152-Q154 PolarHBondContact O-N 2.9Å; E152-Q155 PolarHBondContact O-N 3.02Å; E152-R156 WeakPolarHBondContact O-CG 3.42Å; E152-R156 PolarHBondContact O-N 2.76Å |
| 153 | L | 98.5 | Very high | 98.3 | Very high | 95 Ų | 95 | 112 Ų | 112 | 50% | 0.497 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.1 | -39.8 | 176.2 | -75.2 | 175.3 | 0 | 0 | 0 | 112.5 | L149 S150 E151 Q155 R157 | L149-L153 WeakPolarHBondContact O-CB 3.38Å; L149-L153 VanDerWaalsContact O-CG 3.28Å; L149-L153 WeakPolarHBondContact O-CG 3.31Å; L149-L153 PolarHBondContact O-N 3.4Å; S150-L153 PolarHBondContact O-N 2.93Å; E151-L153 PolarHBondContact O-N 2.9Å; L153-Q155 VanDerWaalsContact C-N 3.35Å; L153-R157 WeakPolarHBondContact O-CG 3.44Å; L153-R157 PolarHBondContact O-N 3.43Å |
| 154 | Q | 98.3 | Very high | 98.3 | Very high | 102 Ų | 102 | 109.7 Ų | 109.7 | 48% | 0.477 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.9 | -37.6 | 175.6 | -75.4 | -176.9 | 2.4 | 0 | 0 | 111.9 | S150 E151 E152 R158 | S150-Q154 WeakPolarHBondContact O-CG 3.31Å; S150-Q154 PolarHBondContact O-N 2.9Å; E151-Q154 PolarHBondContact O-N 2.81Å; E152-Q154 PolarHBondContact O-N 2.9Å; Q154-R158 WeakPolarHBondContact O-CG 3.43Å; Q154-R158 PolarHBondContact O-N 2.87Å; Q154-R158 PolarHBondContact O-NH1 3.46Å |
| 155 | Q | 98.5 | Very high | 98.3 | Very high | 110 Ų | 110 | 110.5 Ų | 110.5 | 51% | 0.514 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -64.6 | -46.8 | 175.4 | -177.6 | 174.6 | -0.9 | 0 | 0 | 111.2 | E151 E152 L153 R157 R158 Q159 | E151-Q155 PolarHBondContact O-N 3.34Å; E152-Q155 PolarHBondContact O-N 3.02Å; L153-Q155 VanDerWaalsContact C-N 3.35Å; Q155-R157 PolarHBondContact O-N 3.4Å; Q155-R158 PolarHBondContact O-N 3.48Å; Q155-Q159 WeakPolarHBondContact O-CG 3.38Å; Q155-Q159 PolarHBondContact O-N 3.35Å |
| 156 | R | 98.4 | Very high | 98.3 | Very high | 158 Ų | 158 | 106.2 Ų | 106.2 | 60% | 0.596 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.1 | -44.4 | 176.4 | -73.6 | -170.6 | -178 | -144 | 2.5 | 112.2 | E152 R158 Q159 E160 | E152-R156 WeakPolarHBondContact O-CG 3.42Å; E152-R156 PolarHBondContact O-N 2.76Å; R156-R158 VanDerWaalsContact C-N 3.32Å; R156-R158 PolarHBondContact O-N 3.27Å; R156-Q159 WeakPolarHBondContact O-CB 3.38Å; R156-Q159 PolarHBondContact O-N 2.93Å; R156-Q159 VanDerWaalsContact O-N 3.11Å; R156-E160 WeakPolarHBondContact O-CG 3.13Å; R156-E160 PolarHBondContact O-N 2.93Å |
| 157 | R | 98.3 | Very high | 98.3 | Very high | 166 Ų | 166 | 108.7 Ų | 108.7 | 63% | 0.626 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -57.1 | -43.2 | 175.6 | -74.9 | -178.9 | -147.9 | -125.2 | 4.2 | 113 | L153 Q155 Q159 E160 E161 | L153-R157 WeakPolarHBondContact O-CG 3.44Å; L153-R157 PolarHBondContact O-N 3.43Å; Q155-R157 PolarHBondContact O-N 3.4Å; R157-Q159 VanDerWaalsContact C-N 3.32Å; R157-E160 PolarHBondContact O-N 3.47Å; R157-E161 WeakPolarHBondContact O-CB 3.45Å; R157-E161 PolarHBondContact O-N 3.23Å |
| 158 | R | 98.4 | Very high | 98.3 | Very high | 151 Ų | 151 | 106.9 Ų | 106.9 | 57% | 0.57 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.7 | -37.1 | 177.8 | -68.6 | -178.8 | -165.8 | 98.9 | -0.5 | 112 | Q154 Q155 R156 Q162 | Q154-R158 WeakPolarHBondContact O-CG 3.43Å; Q154-R158 PolarHBondContact O-N 2.87Å; Q154-R158 PolarHBondContact O-NH1 3.46Å; Q155-R158 PolarHBondContact O-N 3.48Å; R156-R158 VanDerWaalsContact C-N 3.32Å; R156-R158 PolarHBondContact O-N 3.27Å; R158-Q162 WeakPolarHBondContact O-CB 3.48Å; R158-Q162 PolarHBondContact O-N 3.39Å |
| 159 | Q | 98.4 | Very high | 98.3 | Very high | 93 Ų | 93 | 103.1 Ų | 103.1 | 44% | 0.435 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.2 | -48.6 | 176.4 | -71.3 | 172.5 | -23.7 | 0 | 0 | 111.1 | Q155 R156 R157 E161 Q162 E163 | Q155-Q159 WeakPolarHBondContact O-CG 3.38Å; Q155-Q159 PolarHBondContact O-N 3.35Å; R156-Q159 WeakPolarHBondContact O-CB 3.38Å; R156-Q159 PolarHBondContact O-N 2.93Å; R156-Q159 VanDerWaalsContact O-N 3.11Å; R157-Q159 VanDerWaalsContact C-N 3.32Å; Q159-E161 VanDerWaalsContact C-N 3.3Å; Q159-E161 PolarHBondContact O-N 2.94Å; Q159-Q162 PolarHBondContact O-N 3.02Å; Q159-E163 WeakPolarHBondContact O-CB 3.49Å; Q159-E163 WeakPolarHBondContact O-CG 3.33Å; Q159-E163 PolarHBondContact O-N 3.31Å |
| 160 | E | 97.9 | Very high | 98.3 | Very high | 119 Ų | 119 | 104.9 Ų | 104.9 | 56% | 0.556 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.7 | -40.3 | 176.9 | -71.6 | 170.3 | -171.9 | 0 | 0 | 111.9 | R156 R157 E163 A164 | R156-E160 WeakPolarHBondContact O-CG 3.13Å; R156-E160 PolarHBondContact O-N 2.93Å; R157-E160 PolarHBondContact O-N 3.47Å; E160-E163 PolarHBondContact O-N 3.12Å; E160-A164 VanDerWaalsContact O-CB 3.28Å; E160-A164 WeakPolarHBondContact O-CB 3.3Å; E160-A164 PolarHBondContact O-N 3.45Å |
| 161 | E | 98.1 | Very high | 98.3 | Very high | 121 Ų | 121 | 105.5 Ų | 105.5 | 57% | 0.565 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -64.8 | -42.6 | 175.6 | -174.8 | 174 | -172.6 | 0 | 0 | 112 | R157 Q159 A164 Q165 | R157-E161 WeakPolarHBondContact O-CB 3.45Å; R157-E161 PolarHBondContact O-N 3.23Å; Q159-E161 VanDerWaalsContact C-N 3.3Å; Q159-E161 PolarHBondContact O-N 2.94Å; E161-A164 PolarHBondContact O-N 2.94Å; E161-Q165 VanDerWaalsContact O-CG 3.29Å; E161-Q165 WeakPolarHBondContact O-CG 3.38Å; E161-Q165 PolarHBondContact O-N 3.28Å |
| 162 | Q | 98.4 | Very high | 98.3 | Very high | 95 Ų | 95 | 103.7 Ų | 103.7 | 44% | 0.444 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.6 | -46.2 | 175.9 | -176.5 | 63.2 | 48.1 | 0 | 0 | 111.7 | R158 Q159 A164 Q165 D166 | R158-Q162 WeakPolarHBondContact O-CB 3.48Å; R158-Q162 PolarHBondContact O-N 3.39Å; Q159-Q162 PolarHBondContact O-N 3.02Å; Q162-A164 VanDerWaalsContact C-N 3.29Å; Q162-A164 PolarHBondContact O-N 3.5Å; Q162-Q165 WeakPolarHBondContact O-CB 3.39Å; Q162-Q165 PolarHBondContact O-N 2.89Å; Q162-Q165 VanDerWaalsContact O-N 3.17Å; Q162-D166 PolarHBondContact NE2-OD1 3.25Å; Q162-D166 PolarHBondContact O-N 3.1Å |
| 163 | E | 98 | Very high | 98.3 | Very high | 120 Ų | 120 | 103.8 Ų | 103.8 | 56% | 0.561 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.7 | -39.4 | 177.7 | -72.4 | 174.6 | -166.1 | 0 | 0 | 111.2 | Q159 E160 D166 L167 | Q159-E163 WeakPolarHBondContact O-CB 3.49Å; Q159-E163 WeakPolarHBondContact O-CG 3.33Å; Q159-E163 PolarHBondContact O-N 3.31Å; E160-E163 PolarHBondContact O-N 3.12Å; E163-D166 PolarHBondContact O-N 3.41Å; E163-L167 WeakPolarHBondContact O-CB 3.37Å; E163-L167 VanDerWaalsContact O-CG 3.22Å; E163-L167 WeakPolarHBondContact O-CG 3.21Å; E163-L167 PolarHBondContact O-N 3.05Å |
| 164 | A | 98.1 | Very high | 98.3 | Very high | 54 Ų | 54 | 103.9 Ų | 103.9 | 45% | 0.446 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -62.5 | -41.8 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | E160 E161 Q162 L167 E168 | E160-A164 VanDerWaalsContact O-CB 3.28Å; E160-A164 WeakPolarHBondContact O-CB 3.3Å; E160-A164 PolarHBondContact O-N 3.45Å; E161-A164 PolarHBondContact O-N 2.94Å; Q162-A164 VanDerWaalsContact C-N 3.29Å; Q162-A164 PolarHBondContact O-N 3.5Å; A164-L167 PolarHBondContact O-N 3.4Å; A164-E168 WeakPolarHBondContact O-CB 3.4Å; A164-E168 PolarHBondContact O-N 2.9Å |
| 165 | Q | 98.5 | Very high | 98.3 | Very high | 89 Ų | 89 | 104.1 Ų | 104.1 | 42% | 0.416 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.8 | -40.4 | 176.4 | -72.1 | 173 | 12.1 | 0 | 0 | 112.5 | E161 Q162 E168 S169 | E161-Q165 VanDerWaalsContact O-CG 3.29Å; E161-Q165 WeakPolarHBondContact O-CG 3.38Å; E161-Q165 PolarHBondContact O-N 3.28Å; Q162-Q165 WeakPolarHBondContact O-CB 3.39Å; Q162-Q165 PolarHBondContact O-N 2.89Å; Q162-Q165 VanDerWaalsContact O-N 3.17Å; Q165-E168 PolarHBondContact O-N 3.45Å; Q165-S169 PolarHBondContact O-N 2.95Å; Q165-S169 PolarHBondContact O-OG 3.47Å |
| 166 | D | 98.3 | Very high | 98.3 | Very high | 80 Ų | 80 | 104.8 Ų | 104.8 | 43% | 0.428 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66.1 | -42.5 | 177 | -68.1 | -15.8 | 0 | 0 | 0 | 110.8 | Q162 E163 S169 M170 | Q162-D166 PolarHBondContact NE2-OD1 3.25Å; Q162-D166 PolarHBondContact O-N 3.1Å; E163-D166 PolarHBondContact O-N 3.41Å; D166-S169 PolarHBondContact O-N 3.1Å; D166-M170 WeakPolarHBondContact O-CG 3.47Å; D166-M170 PolarHBondContact O-N 3.49Å |
| 167 | L | 98.6 | Very high | 98.3 | Very high | 102 Ų | 102 | 101.9 Ų | 101.9 | 53% | 0.534 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.6 | -44 | 174 | -73.7 | 168.1 | 0 | 0 | 0 | 111.8 | E163 A164 S169 M170 V171 | E163-L167 WeakPolarHBondContact O-CB 3.37Å; E163-L167 VanDerWaalsContact O-CG 3.22Å; E163-L167 WeakPolarHBondContact O-CG 3.21Å; E163-L167 PolarHBondContact O-N 3.05Å; A164-L167 PolarHBondContact O-N 3.4Å; L167-S169 VanDerWaalsContact C-N 3.33Å; L167-S169 PolarHBondContact O-N 3.46Å; L167-M170 HydrophobicContact CD2-CE 3.76Å; L167-M170 HydrophobicContact CG-CE 4.32Å; L167-M170 PolarHBondContact O-N 2.89Å; L167-V171 WeakPolarHBondContact O-CG2 3.32Å; L167-V171 PolarHBondContact O-N 3.34Å |
| 168 | E | 98.1 | Very high | 98.3 | Very high | 107 Ų | 107 | 98 Ų | 98 | 50% | 0.5 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.9 | -44.7 | 176.3 | -170.6 | -179 | 172.9 | 0 | 0 | 111.2 | A164 Q165 M170 V171 Q172 | A164-E168 WeakPolarHBondContact O-CB 3.4Å; A164-E168 PolarHBondContact O-N 2.9Å; Q165-E168 PolarHBondContact O-N 3.45Å; E168-M170 VanDerWaalsContact C-N 3.32Å; E168-M170 PolarHBondContact O-N 3.16Å; E168-V171 PolarHBondContact O-N 2.83Å; E168-Q172 VanDerWaalsContact O-CG 3.3Å; E168-Q172 WeakPolarHBondContact O-CG 3.33Å; E168-Q172 PolarHBondContact O-N 2.9Å; E168-Q172 PolarHBondContact OE1-NE2 3.39Å |
| 169 | S | 98.5 | Very high | 98.3 | Very high | 70 Ų | 70 | 95.5 Ų | 95.5 | 49% | 0.49 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -40.9 | 177.3 | -60.6 | 0 | 0 | 0 | 0 | 112.2 | Q165 D166 L167 S173 | Q165-S169 PolarHBondContact O-N 2.95Å; Q165-S169 PolarHBondContact O-OG 3.47Å; D166-S169 PolarHBondContact O-N 3.1Å; L167-S169 VanDerWaalsContact C-N 3.33Å; L167-S169 PolarHBondContact O-N 3.46Å; S169-S173 PolarHBondContact O-N 3.31Å; S169-S173 VanDerWaalsContact O-N 3.11Å |
| 170 | M | 98.3 | Very high | 98.3 | Very high | 111 Ų | 111 | 94.5 Ų | 94.5 | 55% | 0.547 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -66.1 | -43.3 | 175.1 | -73.1 | -172.8 | -73.2 | 0 | 0 | 112 | D166 L167 E168 S173 V174 | D166-M170 WeakPolarHBondContact O-CG 3.47Å; D166-M170 PolarHBondContact O-N 3.49Å; L167-M170 HydrophobicContact CD2-CE 3.76Å; L167-M170 HydrophobicContact CG-CE 4.32Å; L167-M170 PolarHBondContact O-N 2.89Å; E168-M170 VanDerWaalsContact C-N 3.32Å; E168-M170 PolarHBondContact O-N 3.16Å; M170-S173 PolarHBondContact O-N 2.83Å; M170-V174 WeakPolarHBondContact O-CG2 3.4Å; M170-V174 PolarHBondContact O-N 3.47Å |
| 171 | V | 98.4 | Very high | 98.3 | Very high | 78 Ų | 78 | 94.1 Ų | 94.1 | 47% | 0.473 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60.9 | -47.8 | 177.1 | 169.9 | 0 | 0 | 0 | 0 | 110.6 | L167 E168 S173 V174 E175 | L167-V171 WeakPolarHBondContact O-CG2 3.32Å; L167-V171 PolarHBondContact O-N 3.34Å; E168-V171 PolarHBondContact O-N 2.83Å; V171-S173 VanDerWaalsContact C-N 3.29Å; V171-S173 PolarHBondContact O-N 3.49Å; V171-V174 PolarHBondContact O-N 3.3Å; V171-V174 VanDerWaalsContact O-N 3.14Å; V171-E175 HydrophobicContact CG1-CG 4.25Å; V171-E175 WeakPolarHBondContact O-CG 3.4Å; V171-E175 PolarHBondContact O-N 3.34Å |
| 172 | Q | 98.6 | Very high | 98.4 | Very high | 87 Ų | 87 | 94.4 Ų | 94.4 | 41% | 0.407 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -57.1 | -42.2 | 176.9 | -71.2 | 176.4 | 10.5 | 0 | 0 | 112 | E168 E175 Q176 | E168-Q172 VanDerWaalsContact O-CG 3.3Å; E168-Q172 WeakPolarHBondContact O-CG 3.33Å; E168-Q172 PolarHBondContact O-N 2.9Å; E168-Q172 PolarHBondContact OE1-NE2 3.39Å; Q172-E175 PolarHBondContact O-N 3Å; Q172-Q176 VanDerWaalsContact O-CG 3.27Å; Q172-Q176 WeakPolarHBondContact O-CG 3.34Å; Q172-Q176 PolarHBondContact O-N 3.39Å |
| 173 | S | 98.3 | Very high | 98.4 | Very high | 71 Ų | 71 | 96.9 Ų | 96.9 | 50% | 0.497 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.1 | -43 | 176.7 | -174 | 0 | 0 | 0 | 0 | 112.5 | S169 M170 V171 Q176 N177 | S169-S173 PolarHBondContact O-N 3.31Å; S169-S173 VanDerWaalsContact O-N 3.11Å; M170-S173 PolarHBondContact O-N 2.83Å; V171-S173 VanDerWaalsContact C-N 3.29Å; V171-S173 PolarHBondContact O-N 3.49Å; S173-Q176 PolarHBondContact O-N 3.34Å; S173-N177 PolarHBondContact O-N 2.89Å |
| 174 | V | 98.5 | Very high | 98.4 | Very high | 98 Ų | 98 | 99.3 Ų | 99.3 | 59% | 0.594 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -64.6 | -41.8 | 176.5 | 171.4 | 0 | 0 | 0 | 0 | 111 | M170 V171 N177 L178 | M170-V174 WeakPolarHBondContact O-CG2 3.4Å; M170-V174 PolarHBondContact O-N 3.47Å; V171-V174 PolarHBondContact O-N 3.3Å; V171-V174 VanDerWaalsContact O-N 3.14Å; V174-N177 PolarHBondContact O-N 2.98Å; V174-L178 WeakPolarHBondContact O-CB 3.35Å; V174-L178 PolarHBondContact O-N 2.94Å |
| 175 | E | 98.1 | Very high | 98.4 | Very high | 106 Ų | 106 | 98.7 Ų | 98.7 | 50% | 0.495 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -60.4 | -47.1 | 176.4 | -74.9 | 179.9 | 172.2 | 0 | 0 | 111.8 | V171 Q172 N177 L178 Q179 | V171-E175 HydrophobicContact CG1-CG 4.25Å; V171-E175 WeakPolarHBondContact O-CG 3.4Å; V171-E175 PolarHBondContact O-N 3.34Å; Q172-E175 PolarHBondContact O-N 3Å; E175-N177 VanDerWaalsContact C-N 3.33Å; E175-N177 PolarHBondContact O-N 3.28Å; E175-L178 PolarHBondContact O-N 3.45Å; E175-Q179 WeakPolarHBondContact O-CG 3.45Å; E175-Q179 PolarHBondContact O-N 3.17Å |
| 176 | Q | 98.5 | Very high | 98.4 | Very high | 125 Ų | 125 | 98.8 Ų | 98.8 | 58% | 0.584 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60 | -43.6 | 175.8 | -71.1 | 169.8 | 14.1 | 0 | 0 | 111.6 | Q172 S173 L178 Q179 L180 | Q172-Q176 VanDerWaalsContact O-CG 3.27Å; Q172-Q176 WeakPolarHBondContact O-CG 3.34Å; Q172-Q176 PolarHBondContact O-N 3.39Å; S173-Q176 PolarHBondContact O-N 3.34Å; Q176-L178 VanDerWaalsContact C-N 3.34Å; Q176-L178 PolarHBondContact O-N 2.95Å; Q176-Q179 PolarHBondContact O-N 3.44Å; Q176-L180 PolarHBondContact O-N 3.02Å |
| 177 | N | 98.3 | Very high | 98.4 | Very high | 97 Ų | 97 | 102.6 Ų | 102.6 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.9 | -42.4 | 177.4 | -169 | -87.6 | 0 | 0 | 0 | 111.7 | S173 V174 E175 L180 M181 | S173-N177 PolarHBondContact O-N 2.89Å; V174-N177 PolarHBondContact O-N 2.98Å; E175-N177 VanDerWaalsContact C-N 3.33Å; E175-N177 PolarHBondContact O-N 3.28Å; N177-L180 PolarHBondContact O-N 3.42Å; N177-M181 WeakPolarHBondContact O-CB 3.3Å; N177-M181 PolarHBondContact O-N 3.47Å |
| 178 | L | 98.5 | Very high | 98.4 | Very high | 83 Ų | 83 | 100.3 Ų | 100.3 | 44% | 0.435 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.7 | -41.2 | 177.6 | -177.4 | 62.6 | 0 | 0 | 0 | 111.5 | V174 E175 Q176 M181 K182 | V174-L178 WeakPolarHBondContact O-CB 3.35Å; V174-L178 PolarHBondContact O-N 2.94Å; E175-L178 PolarHBondContact O-N 3.45Å; Q176-L178 VanDerWaalsContact C-N 3.34Å; Q176-L178 PolarHBondContact O-N 2.95Å; L178-M181 PolarHBondContact O-N 3.09Å; L178-K182 WeakPolarHBondContact O-CG 3.41Å; L178-K182 PolarHBondContact O-N 3.09Å |
| 179 | Q | 98.3 | Very high | 98.4 | Very high | 99 Ų | 99 | 101 Ų | 101 | 46% | 0.463 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.1 | -44.9 | 173.7 | -71.9 | 178 | 2.5 | 0 | 0 | 111.6 | E175 Q176 M181 K182 R183 | E175-Q179 WeakPolarHBondContact O-CG 3.45Å; E175-Q179 PolarHBondContact O-N 3.17Å; Q176-Q179 PolarHBondContact O-N 3.44Å; Q179-M181 VanDerWaalsContact C-N 3.33Å; Q179-M181 PolarHBondContact O-N 2.84Å; Q179-K182 PolarHBondContact O-N 2.97Å; Q179-R183 WeakPolarHBondContact O-CG 3.35Å; Q179-R183 PolarHBondContact O-N 3.44Å |
| 180 | L | 98.6 | Very high | 98.4 | Very high | 73 Ų | 73 | 100.6 Ų | 100.6 | 38% | 0.382 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.5 | -42.2 | 175.6 | -178.8 | 63.6 | 0 | 0 | 0 | 111.5 | Q176 N177 R183 R184 | Q176-L180 PolarHBondContact O-N 3.02Å; N177-L180 PolarHBondContact O-N 3.42Å; L180-R183 PolarHBondContact O-N 3.25Å; L180-R184 WeakPolarHBondContact O-CB 3.36Å; L180-R184 WeakPolarHBondContact O-CG 3.45Å; L180-R184 PolarHBondContact O-N 2.9Å |
| 181 | M | 98.3 | Very high | 98.5 | Very high | 110 Ų | 110 | 97.8 Ų | 97.8 | 54% | 0.542 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -61.5 | -44 | 176.2 | -171.7 | -177.2 | -63.8 | 0 | 0 | 111.3 | N177 L178 Q179 R184 A185 | N177-M181 WeakPolarHBondContact O-CB 3.3Å; N177-M181 PolarHBondContact O-N 3.47Å; L178-M181 PolarHBondContact O-N 3.09Å; Q179-M181 VanDerWaalsContact C-N 3.33Å; Q179-M181 PolarHBondContact O-N 2.84Å; M181-R184 PolarHBondContact O-N 3.33Å; M181-A185 WeakPolarHBondContact O-CB 3.38Å; M181-A185 PolarHBondContact O-N 3.31Å |
| 182 | K | 98.4 | Very high | 98.5 | Very high | 127 Ų | 127 | 98.5 Ų | 98.5 | 55% | 0.552 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -59.7 | -47.9 | 174.6 | -73.5 | 173 | -179.9 | 178 | 0 | 111.6 | L178 Q179 R184 A185 V186 | L178-K182 WeakPolarHBondContact O-CG 3.41Å; L178-K182 PolarHBondContact O-N 3.09Å; Q179-K182 PolarHBondContact O-N 2.97Å; K182-R184 PolarHBondContact O-N 2.79Å; K182-A185 PolarHBondContact O-N 3.43Å; K182-V186 WeakPolarHBondContact O-CG2 3.48Å; K182-V186 PolarHBondContact O-N 3.25Å |
| 183 | R | 98.6 | Very high | 98.5 | Very high | 147 Ų | 147 | 98 Ų | 98 | 56% | 0.555 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.9 | -44.6 | 177 | -69.6 | 179.7 | -172.2 | -176.1 | 3.2 | 111.7 | Q179 L180 V186 K187 | Q179-R183 WeakPolarHBondContact O-CG 3.35Å; Q179-R183 PolarHBondContact O-N 3.44Å; L180-R183 PolarHBondContact O-N 3.25Å; R183-V186 PolarHBondContact O-N 2.88Å; R183-K187 WeakPolarHBondContact O-CB 3.43Å; R183-K187 PolarHBondContact O-N 2.91Å |
| 184 | R | 98.6 | Very high | 98.5 | Very high | 171 Ų | 171 | 101.9 Ų | 101.9 | 65% | 0.645 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.7 | -42.4 | 176.4 | -74.6 | 177.6 | 178.5 | 178.4 | 0.5 | 112 | L180 M181 K182 K187 A188 | L180-R184 WeakPolarHBondContact O-CB 3.36Å; L180-R184 WeakPolarHBondContact O-CG 3.45Å; L180-R184 PolarHBondContact O-N 2.9Å; M181-R184 PolarHBondContact O-N 3.33Å; K182-R184 PolarHBondContact O-N 2.79Å; R184-K187 PolarHBondContact O-N 3.34Å; R184-A188 WeakPolarHBondContact O-CB 3.35Å; R184-A188 PolarHBondContact O-N 3.27Å |
| 185 | A | 98.6 | Very high | 98.5 | Very high | 42 Ų | 42 | 102 Ų | 102 | 35% | 0.347 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61 | -50.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111 | M181 K182 K187 A188 E189 | M181-A185 WeakPolarHBondContact O-CB 3.38Å; M181-A185 PolarHBondContact O-N 3.31Å; K182-A185 PolarHBondContact O-N 3.43Å; A185-K187 VanDerWaalsContact C-N 3.33Å; A185-K187 PolarHBondContact O-N 2.96Å; A185-A188 CarbonylContact O-C 3.53Å; A185-A188 WeakPolarHBondContact O-CB 3.44Å; A185-A188 PolarHBondContact O-N 3.47Å; A185-A188 VanDerWaalsContact O-N 3.09Å; A185-E189 WeakPolarHBondContact O-CG 3.4Å; A185-E189 PolarHBondContact O-N 3.46Å |
| 186 | V | 98.4 | Very high | 98.5 | Very high | 91 Ų | 91 | 103.1 Ų | 103.1 | 55% | 0.552 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -59.6 | -42 | 178.2 | 173.3 | 0 | 0 | 0 | 0 | 111.8 | K182 R183 A188 E189 S190 | K182-V186 WeakPolarHBondContact O-CG2 3.48Å; K182-V186 PolarHBondContact O-N 3.25Å; R183-V186 PolarHBondContact O-N 2.88Å; V186-A188 VanDerWaalsContact C-N 3.34Å; V186-A188 PolarHBondContact O-N 3.28Å; V186-E189 PolarHBondContact O-N 3.45Å; V186-S190 WeakPolarHBondContact O-CB 3.35Å; V186-S190 PolarHBondContact O-N 2.85Å |
| 187 | K | 98.6 | Very high | 98.5 | Very high | 160 Ų | 160 | 99.7 Ų | 99.7 | 70% | 0.696 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -63.5 | -40.3 | 176.3 | -172.5 | 172.3 | -177 | 170.9 | 0 | 111.8 | R183 R184 A185 S191 | R183-K187 WeakPolarHBondContact O-CB 3.43Å; R183-K187 PolarHBondContact O-N 2.91Å; R184-K187 PolarHBondContact O-N 3.34Å; A185-K187 VanDerWaalsContact C-N 3.33Å; A185-K187 PolarHBondContact O-N 2.96Å; K187-S191 PolarHBondContact O-N 3.02Å; K187-S191 VanDerWaalsContact O-N 3.09Å; K187-S191 PolarHBondContact O-OG 3.32Å |
| 188 | A | 98.6 | Very high | 98.6 | Very high | 53 Ų | 53 | 99.3 Ų | 99.3 | 44% | 0.438 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -65.7 | -44.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | R184 A185 V186 S190 S191 V192 | R184-A188 WeakPolarHBondContact O-CB 3.35Å; R184-A188 PolarHBondContact O-N 3.27Å; A185-A188 CarbonylContact O-C 3.53Å; A185-A188 WeakPolarHBondContact O-CB 3.44Å; A185-A188 PolarHBondContact O-N 3.47Å; A185-A188 VanDerWaalsContact O-N 3.09Å; V186-A188 VanDerWaalsContact C-N 3.34Å; V186-A188 PolarHBondContact O-N 3.28Å; A188-S190 PolarHBondContact O-N 3.46Å; A188-S191 WeakPolarHBondContact O-CB 3.43Å; A188-S191 PolarHBondContact O-N 2.84Å; A188-S191 VanDerWaalsContact O-N 3.17Å; A188-V192 WeakPolarHBondContact O-CG2 3.34Å; A188-V192 PolarHBondContact O-N 3.14Å |
| 189 | E | 98.4 | Very high | 98.6 | Very high | 122 Ų | 122 | 101.2 Ų | 101.2 | 57% | 0.57 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.4 | -42.7 | 176.3 | -73.1 | 172.3 | -175.6 | 0 | 0 | 112.5 | A185 V186 S191 V192 S193 | A185-E189 WeakPolarHBondContact O-CG 3.4Å; A185-E189 PolarHBondContact O-N 3.46Å; V186-E189 PolarHBondContact O-N 3.45Å; E189-S191 VanDerWaalsContact C-N 3.35Å; E189-V192 PolarHBondContact O-N 3.33Å; E189-S193 WeakPolarHBondContact O-CB 3.45Å; E189-S193 PolarHBondContact O-N 3.44Å; E189-S193 PolarHBondContact O-OG 3.28Å |
| 190 | S | 98.4 | Very high | 98.6 | Very high | 61 Ų | 61 | 102.2 Ų | 102.2 | 43% | 0.427 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.2 | -43 | 174.8 | 179.4 | 0 | 0 | 0 | 0 | 111.6 | V186 A188 S193 R194 | V186-S190 WeakPolarHBondContact O-CB 3.35Å; V186-S190 PolarHBondContact O-N 2.85Å; A188-S190 PolarHBondContact O-N 3.46Å; S190-S193 PolarHBondContact O-N 3.45Å; S190-R194 PolarHBondContact O-N 3.1Å |
| 191 | S | 98.6 | Very high | 98.6 | Very high | 52 Ų | 52 | 105.2 Ų | 105.2 | 36% | 0.364 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 177.5 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | K187 A188 E189 S193 R194 L195 | K187-S191 PolarHBondContact O-N 3.02Å; K187-S191 VanDerWaalsContact O-N 3.09Å; K187-S191 PolarHBondContact O-OG 3.32Å; A188-S191 WeakPolarHBondContact O-CB 3.43Å; A188-S191 PolarHBondContact O-N 2.84Å; A188-S191 VanDerWaalsContact O-N 3.17Å; E189-S191 VanDerWaalsContact C-N 3.35Å; S191-S193 VanDerWaalsContact C-N 3.35Å; S191-S193 PolarHBondContact O-N 3.21Å; S191-R194 PolarHBondContact O-N 3.4Å; S191-L195 WeakPolarHBondContact O-CG 3.43Å; S191-L195 PolarHBondContact O-N 3.28Å |
| 192 | V | 98.8 | Very high | 98.6 | Very high | 93 Ų | 93 | 104.6 Ų | 104.6 | 56% | 0.564 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -62.7 | -41.9 | 175.7 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | A188 E189 R194 L195 K196 | A188-V192 WeakPolarHBondContact O-CG2 3.34Å; A188-V192 PolarHBondContact O-N 3.14Å; E189-V192 PolarHBondContact O-N 3.33Å; V192-R194 VanDerWaalsContact C-N 3.33Å; V192-R194 PolarHBondContact O-N 2.9Å; V192-L195 PolarHBondContact O-N 2.96Å; V192-K196 VanDerWaalsContact O-CB 3.3Å; V192-K196 WeakPolarHBondContact O-CB 3.34Å; V192-K196 PolarHBondContact O-N 3Å |
| 193 | S | 98.7 | Very high | 98.6 | Very high | 77 Ų | 77 | 103.4 Ų | 103.4 | 54% | 0.538 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.1 | -41.3 | 178.1 | -60.1 | 0 | 0 | 0 | 0 | 111.8 | E189 S190 S191 K196 A197 | E189-S193 WeakPolarHBondContact O-CB 3.45Å; E189-S193 PolarHBondContact O-N 3.44Å; E189-S193 PolarHBondContact O-OG 3.28Å; S190-S193 PolarHBondContact O-N 3.45Å; S191-S193 VanDerWaalsContact C-N 3.35Å; S191-S193 PolarHBondContact O-N 3.21Å; S193-K196 PolarHBondContact O-N 2.89Å; S193-A197 PolarHBondContact O-N 3Å; S193-A197 VanDerWaalsContact O-N 3.1Å |
| 194 | R | 98.8 | Very high | 98.6 | Very high | 152 Ų | 152 | 100.8 Ų | 100.8 | 57% | 0.574 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -65.1 | -49.4 | 175.6 | -167.5 | -175.9 | -54.1 | 159.1 | 5.3 | 112.1 | S190 S191 V192 K196 A197 E198 | S190-R194 PolarHBondContact O-N 3.1Å; S191-R194 PolarHBondContact O-N 3.4Å; V192-R194 VanDerWaalsContact C-N 3.33Å; V192-R194 PolarHBondContact O-N 2.9Å; R194-K196 VanDerWaalsContact C-N 3.25Å; R194-K196 PolarHBondContact O-N 2.99Å; R194-A197 WeakPolarHBondContact O-CB 3.5Å; R194-A197 PolarHBondContact O-N 3.28Å; R194-A197 VanDerWaalsContact O-N 3.1Å; R194-E198 PolarHBondContact O-N 3.37Å |
| 195 | L | 98.8 | Very high | 98.6 | Very high | 100 Ų | 100 | 97.4 Ų | 97.4 | 52% | 0.524 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.6 | -36.2 | 177.7 | -72.2 | 172 | 0 | 0 | 0 | 112.1 | S191 V192 E198 L199 | S191-L195 WeakPolarHBondContact O-CG 3.43Å; S191-L195 PolarHBondContact O-N 3.28Å; V192-L195 PolarHBondContact O-N 2.96Å; L195-E198 PolarHBondContact O-N 3.3Å; L195-L199 WeakPolarHBondContact O-CB 3.15Å; L195-L199 PolarHBondContact O-N 3.3Å |
| 196 | K | 98.8 | Very high | 98.6 | Very high | 131 Ų | 131 | 98 Ų | 98 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -65.4 | -40.9 | 175.4 | -171.1 | 177.5 | -179 | 179.4 | 0 | 111.8 | V192 S193 R194 Q200 | V192-K196 VanDerWaalsContact O-CB 3.3Å; V192-K196 WeakPolarHBondContact O-CB 3.34Å; V192-K196 PolarHBondContact O-N 3Å; S193-K196 PolarHBondContact O-N 2.89Å; R194-K196 VanDerWaalsContact C-N 3.25Å; R194-K196 PolarHBondContact O-N 2.99Å; K196-Q200 WeakPolarHBondContact O-CG 3.34Å; K196-Q200 PolarHBondContact O-N 3.34Å |
| 197 | A | 98.6 | Very high | 98.7 | Very high | 53 Ų | 53 | 97.2 Ų | 97.2 | 44% | 0.438 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.6 | -44.8 | 175 | 0 | 0 | 0 | 0 | 0 | 111.6 | S193 R194 L199 Q200 Q201 | S193-A197 PolarHBondContact O-N 3Å; S193-A197 VanDerWaalsContact O-N 3.1Å; R194-A197 WeakPolarHBondContact O-CB 3.5Å; R194-A197 PolarHBondContact O-N 3.28Å; R194-A197 VanDerWaalsContact O-N 3.1Å; A197-L199 PolarHBondContact O-N 3.31Å; A197-Q200 PolarHBondContact O-N 3.49Å; A197-Q201 PolarHBondContact O-N 3.01Å |
| 198 | E | 98.6 | Very high | 98.7 | Very high | 89 Ų | 89 | 93.1 Ų | 93.1 | 42% | 0.416 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 175.9 | -71.9 | 173.4 | -159.5 | 0 | 0 | 112 | R194 L195 Q200 Q201 L202 | R194-E198 PolarHBondContact O-N 3.37Å; L195-E198 PolarHBondContact O-N 3.3Å; E198-Q200 VanDerWaalsContact C-N 3.35Å; E198-Q200 PolarHBondContact O-N 3.35Å; E198-Q201 PolarHBondContact O-N 2.94Å; E198-L202 WeakPolarHBondContact O-CB 3.44Å; E198-L202 WeakPolarHBondContact O-CG 3.33Å; E198-L202 PolarHBondContact O-N 3.1Å |
| 199 | L | 98.7 | Very high | 98.7 | Very high | 122 Ų | 122 | 95.6 Ų | 95.6 | 64% | 0.639 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.9 | -43.7 | 174.8 | -89 | 171.7 | 0 | 0 | 0 | 112.3 | L195 A197 L202 Q203 | L195-L199 WeakPolarHBondContact O-CB 3.15Å; L195-L199 PolarHBondContact O-N 3.3Å; A197-L199 PolarHBondContact O-N 3.31Å; L199-L202 PolarHBondContact O-N 2.81Å; L199-Q203 VanDerWaalsContact O-CB 3.32Å; L199-Q203 WeakPolarHBondContact O-CB 3.35Å; L199-Q203 PolarHBondContact O-N 2.83Å |
| 200 | Q | 98.7 | Very high | 98.7 | Very high | 120 Ų | 120 | 97.1 Ų | 97.1 | 56% | 0.561 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -64 | -42.5 | 177 | -74.8 | 177.1 | -13.5 | 0 | 0 | 111.5 | K196 A197 E198 Q203 V204 | K196-Q200 WeakPolarHBondContact O-CG 3.34Å; K196-Q200 PolarHBondContact O-N 3.34Å; A197-Q200 PolarHBondContact O-N 3.49Å; E198-Q200 VanDerWaalsContact C-N 3.35Å; E198-Q200 PolarHBondContact O-N 3.35Å; Q200-Q203 PolarHBondContact O-N 2.94Å; Q200-V204 WeakPolarHBondContact O-CG2 3.29Å; Q200-V204 PolarHBondContact O-N 2.88Å; Q200-V204 VanDerWaalsContact O-N 3.12Å |
| 201 | Q | 98.8 | Very high | 98.7 | Very high | 137 Ų | 137 | 97.6 Ų | 97.6 | 64% | 0.64 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -61.6 | -49.1 | 176.5 | -179.1 | -179.8 | -12.6 | 0 | 0 | 111.7 | A197 E198 Q203 V204 E205 | A197-Q201 PolarHBondContact O-N 3.01Å; E198-Q201 PolarHBondContact O-N 2.94Å; Q201-Q203 VanDerWaalsContact C-N 3.3Å; Q201-Q203 PolarHBondContact O-N 3.18Å; Q201-V204 PolarHBondContact O-N 3.4Å; Q201-E205 PolarHBondContact O-N 3.4Å |
| 202 | L | 98.8 | Very high | 98.7 | Very high | 97 Ų | 97 | 98.9 Ų | 98.9 | 51% | 0.508 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.7 | -37.2 | 178.4 | -73 | 171.7 | 0 | 0 | 0 | 112.1 | E198 L199 E205 V206 | E198-L202 WeakPolarHBondContact O-CB 3.44Å; E198-L202 WeakPolarHBondContact O-CG 3.33Å; E198-L202 PolarHBondContact O-N 3.1Å; L199-L202 PolarHBondContact O-N 2.81Å; L202-E205 PolarHBondContact O-N 2.92Å; L202-V206 WeakPolarHBondContact O-CG2 3.3Å; L202-V206 PolarHBondContact O-N 3.39Å |
| 203 | Q | 98.8 | Very high | 98.7 | Very high | 101 Ų | 101 | 98 Ų | 98 | 47% | 0.472 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61 | -46 | 175.4 | -177.9 | 59 | 48.7 | 0 | 0 | 111.3 | L199 Q200 Q201 E205 V206 D207 | L199-Q203 VanDerWaalsContact O-CB 3.32Å; L199-Q203 WeakPolarHBondContact O-CB 3.35Å; L199-Q203 PolarHBondContact O-N 2.83Å; Q200-Q203 PolarHBondContact O-N 2.94Å; Q201-Q203 VanDerWaalsContact C-N 3.3Å; Q201-Q203 PolarHBondContact O-N 3.18Å; Q203-E205 VanDerWaalsContact C-N 3.33Å; Q203-E205 PolarHBondContact O-N 3.05Å; Q203-V206 PolarHBondContact O-N 2.81Å; Q203-D207 PolarHBondContact NE2-OD1 3.34Å; Q203-D207 PolarHBondContact NE2-OD2 3.4Å; Q203-D207 PolarHBondContact O-N 3.08Å |
| 204 | V | 98.7 | Very high | 98.7 | Very high | 93 Ų | 93 | 99.3 Ų | 99.3 | 56% | 0.564 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.8 | -41.2 | 176.4 | 171.9 | 0 | 0 | 0 | 0 | 111.4 | Q200 Q201 D207 T208 | Q200-V204 WeakPolarHBondContact O-CG2 3.29Å; Q200-V204 PolarHBondContact O-N 2.88Å; Q200-V204 VanDerWaalsContact O-N 3.12Å; Q201-V204 PolarHBondContact O-N 3.4Å; V204-D207 PolarHBondContact O-N 3.25Å; V204-T208 WeakPolarHBondContact O-CB 3.37Å; V204-T208 PolarHBondContact O-N 3.11Å; V204-T208 PolarHBondContact O-OG1 3.25Å |
| 205 | E | 98.6 | Very high | 98.7 | Very high | 99 Ų | 99 | 99.4 Ų | 99.4 | 46% | 0.463 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.6 | -45 | 177.4 | -174 | 176.2 | 179.2 | 0 | 0 | 111.9 | Q201 L202 Q203 D207 T208 L209 | Q201-E205 PolarHBondContact O-N 3.4Å; L202-E205 PolarHBondContact O-N 2.92Å; Q203-E205 VanDerWaalsContact C-N 3.33Å; Q203-E205 PolarHBondContact O-N 3.05Å; E205-D207 VanDerWaalsContact C-N 3.34Å; E205-D207 PolarHBondContact O-N 3.45Å; E205-T208 PolarHBondContact O-N 2.99Å; E205-L209 HydrophobicContact CG-CD1 4.11Å; E205-L209 HydrophobicContact CG-CG 4.49Å; E205-L209 WeakPolarHBondContact O-CB 3.14Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.9Å |
| 206 | V | 98.7 | Very high | 98.7 | Very high | 56 Ų | 56 | 99 Ų | 99 | 34% | 0.339 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -59.4 | -44.8 | 176 | 166.3 | 0 | 0 | 0 | 0 | 111.2 | L202 Q203 T208 L209 R210 | L202-V206 WeakPolarHBondContact O-CG2 3.3Å; L202-V206 PolarHBondContact O-N 3.39Å; Q203-V206 PolarHBondContact O-N 2.81Å; V206-T208 VanDerWaalsContact C-N 3.34Å; V206-L209 PolarHBondContact O-N 3.37Å; V206-R210 HydrophobicContact CG1-CG 4.42Å; V206-R210 WeakPolarHBondContact O-CB 3.37Å; V206-R210 WeakPolarHBondContact O-CG 3.45Å; V206-R210 PolarHBondContact O-N 2.95Å |
| 207 | D | 98.7 | Very high | 98.7 | Very high | 73 Ų | 73 | 98.3 Ų | 98.3 | 39% | 0.39 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -67.8 | -37.7 | 180 | -68.1 | -28.5 | 0 | 0 | 0 | 111.6 | Q203 V204 E205 R210 S211 | Q203-D207 PolarHBondContact NE2-OD1 3.34Å; Q203-D207 PolarHBondContact NE2-OD2 3.4Å; Q203-D207 PolarHBondContact O-N 3.08Å; V204-D207 PolarHBondContact O-N 3.25Å; E205-D207 VanDerWaalsContact C-N 3.34Å; E205-D207 PolarHBondContact O-N 3.45Å; D207-R210 PolarHBondContact O-N 3.45Å; D207-R210 IonicContact OD1-NH1 3.5Å; D207-S211 WeakPolarHBondContact O-CB 3.27Å; D207-S211 PolarHBondContact O-N 3.01Å |
| 208 | T | 98.8 | Very high | 98.7 | Very high | 74 Ų | 74 | 98.9 Ų | 98.9 | 45% | 0.454 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.5 | -53.7 | 173.7 | -56.6 | 0 | 0 | 0 | 0 | 110.9 | V204 E205 V206 R210 S211 E212 | V204-T208 WeakPolarHBondContact O-CB 3.37Å; V204-T208 PolarHBondContact O-N 3.11Å; V204-T208 PolarHBondContact O-OG1 3.25Å; E205-T208 PolarHBondContact O-N 2.99Å; V206-T208 VanDerWaalsContact C-N 3.34Å; T208-R210 VanDerWaalsContact C-N 3.31Å; T208-R210 PolarHBondContact O-N 3.18Å; T208-S211 PolarHBondContact O-N 2.71Å; T208-S211 VanDerWaalsContact O-N 3.13Å; T208-S211 PolarHBondContact O-OG 3.43Å; T208-E212 PolarHBondContact O-N 3.01Å |
| 209 | L | 98.6 | Very high | 98.6 | Very high | 105 Ų | 105 | 96.8 Ų | 96.8 | 55% | 0.55 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.5 | -37.1 | 179.1 | -71.8 | 173.7 | 0 | 0 | 0 | 112.5 | E205 V206 E212 N213 | E205-L209 HydrophobicContact CG-CD1 4.11Å; E205-L209 HydrophobicContact CG-CG 4.49Å; E205-L209 WeakPolarHBondContact O-CB 3.14Å; E205-L209 WeakPolarHBondContact O-CG 3.46Å; E205-L209 PolarHBondContact O-N 2.9Å; V206-L209 PolarHBondContact O-N 3.37Å; L209-E212 PolarHBondContact O-N 3.4Å; L209-N213 VanDerWaalsContact O-CB 3.3Å; L209-N213 WeakPolarHBondContact O-CB 3.22Å; L209-N213 PolarHBondContact O-N 2.88Å |
| 210 | R | 98.8 | Very high | 98.6 | Very high | 154 Ų | 154 | 97.2 Ų | 97.2 | 58% | 0.581 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -62.8 | -45.6 | 174 | -79.2 | 172.5 | 174.9 | 171.1 | -1.2 | 111.6 | V206 D207 T208 N213 N214 | V206-R210 HydrophobicContact CG1-CG 4.42Å; V206-R210 WeakPolarHBondContact O-CB 3.37Å; V206-R210 WeakPolarHBondContact O-CG 3.45Å; V206-R210 PolarHBondContact O-N 2.95Å; D207-R210 PolarHBondContact O-N 3.45Å; D207-R210 IonicContact OD1-NH1 3.5Å; T208-R210 VanDerWaalsContact C-N 3.31Å; T208-R210 PolarHBondContact O-N 3.18Å; R210-N213 PolarHBondContact O-N 3.2Å; R210-N214 VanDerWaalsContact O-CG 3.29Å; R210-N214 PolarHBondContact O-N 3.1Å; R210-N214 PolarHBondContact O-ND2 3.1Å |
| 211 | S | 98.6 | Very high | 98.6 | Very high | 72 Ų | 72 | 94.8 Ų | 94.8 | 50% | 0.503 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.1 | -42.1 | 178.2 | 76 | 0 | 0 | 0 | 0 | 112 | D207 T208 N214 R215 | D207-S211 WeakPolarHBondContact O-CB 3.27Å; D207-S211 PolarHBondContact O-N 3.01Å; T208-S211 PolarHBondContact O-N 2.71Å; T208-S211 VanDerWaalsContact O-N 3.13Å; T208-S211 PolarHBondContact O-OG 3.43Å; S211-N214 PolarHBondContact O-N 3.03Å; S211-R215 WeakPolarHBondContact O-CB 3.5Å; S211-R215 PolarHBondContact O-N 3.43Å |
| 212 | E | 98.6 | Very high | 98.6 | Very high | 79 Ų | 79 | 94.7 Ų | 94.7 | 37% | 0.369 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.1 | -47.5 | 174.7 | -171.9 | 85.6 | -133.3 | 0 | 0 | 111.1 | T208 L209 N214 R215 L216 | T208-E212 PolarHBondContact O-N 3.01Å; L209-E212 PolarHBondContact O-N 3.4Å; E212-N214 VanDerWaalsContact C-N 3.34Å; E212-N214 PolarHBondContact O-N 3.08Å; E212-R215 WeakPolarHBondContact O-CB 3.38Å; E212-R215 PolarHBondContact O-N 2.97Å; E212-R215 IonicContact OE1-CZ 3.62Å; E212-R215 IonicContact OE1-NE 3.7Å; E212-R215 IonicContact OE1-NH2 2.71Å; E212-R215 PolarHBondContact OE1-NH2 2.91Å; E212-L216 HydrophobicContact CG-CD1 4.23Å; E212-L216 WeakPolarHBondContact O-CG 3.37Å; E212-L216 PolarHBondContact O-N 3.13Å |
| 213 | N | 98.7 | Very high | 98.6 | Very high | 75 Ų | 75 | 94.6 Ų | 94.6 | 40% | 0.401 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 179.8 | -166.4 | -93.4 | 0 | 0 | 0 | 112.1 | L209 R210 R215 L216 K217 | L209-N213 VanDerWaalsContact O-CB 3.3Å; L209-N213 WeakPolarHBondContact O-CB 3.22Å; L209-N213 PolarHBondContact O-N 2.88Å; R210-N213 PolarHBondContact O-N 3.2Å; N213-R215 VanDerWaalsContact C-N 3.35Å; N213-L216 PolarHBondContact O-N 3.49Å; N213-K217 WeakPolarHBondContact O-CB 3.48Å; N213-K217 WeakPolarHBondContact O-CG 3.46Å; N213-K217 PolarHBondContact O-N 3.24Å; N213-K217 WeakPolarHBondContact OD1-CE 3.43Å; N213-K217 PolarHBondContact OD1-NZ 3.43Å |
| 214 | N | 98.5 | Very high | 98.6 | Very high | 103 Ų | 103 | 93.8 Ų | 93.8 | 55% | 0.551 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -64 | -41.5 | 175.5 | -71.1 | -23.5 | 0 | 0 | 0 | 111.5 | R210 S211 E212 K217 A218 | R210-N214 VanDerWaalsContact O-CG 3.29Å; R210-N214 PolarHBondContact O-N 3.1Å; R210-N214 PolarHBondContact O-ND2 3.1Å; S211-N214 PolarHBondContact O-N 3.03Å; E212-N214 VanDerWaalsContact C-N 3.34Å; E212-N214 PolarHBondContact O-N 3.08Å; N214-K217 PolarHBondContact O-N 2.86Å; N214-A218 WeakPolarHBondContact O-CB 3.41Å; N214-A218 PolarHBondContact O-N 3.49Å |
| 215 | R | 98.7 | Very high | 98.5 | Very high | 154 Ų | 154 | 95 Ų | 95 | 58% | 0.581 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -62.4 | -45 | 176.1 | -170.9 | -176.9 | 72.4 | 91.3 | -1.8 | 111.7 | S211 E212 N213 A218 A219 | S211-R215 WeakPolarHBondContact O-CB 3.5Å; S211-R215 PolarHBondContact O-N 3.43Å; E212-R215 WeakPolarHBondContact O-CB 3.38Å; E212-R215 PolarHBondContact O-N 2.97Å; E212-R215 IonicContact OE1-CZ 3.62Å; E212-R215 IonicContact OE1-NE 3.7Å; E212-R215 IonicContact OE1-NH2 2.71Å; E212-R215 PolarHBondContact OE1-NH2 2.91Å; N213-R215 VanDerWaalsContact C-N 3.35Å; R215-A218 PolarHBondContact O-N 3.34Å; R215-A219 PolarHBondContact O-N 2.97Å |
| 216 | L | 98.6 | Very high | 98.5 | Very high | 92 Ų | 92 | 93.7 Ų | 93.7 | 48% | 0.482 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 177.5 | -71.5 | 173.2 | 0 | 0 | 0 | 111.9 | E212 N213 A218 A219 E220 | E212-L216 HydrophobicContact CG-CD1 4.23Å; E212-L216 WeakPolarHBondContact O-CG 3.37Å; E212-L216 PolarHBondContact O-N 3.13Å; N213-L216 PolarHBondContact O-N 3.49Å; L216-A218 VanDerWaalsContact C-N 3.33Å; L216-A218 PolarHBondContact O-N 3.11Å; L216-A219 PolarHBondContact O-N 3.42Å; L216-E220 WeakPolarHBondContact O-CB 3.38Å; L216-E220 PolarHBondContact O-N 2.91Å |
| 217 | K | 98.6 | Very high | 98.5 | Very high | 117 Ų | 117 | 97.6 Ų | 97.6 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -60.2 | -41 | 174.8 | -78.6 | 171.2 | 172.2 | 158.8 | 0 | 112.6 | N213 N214 S221 | N213-K217 WeakPolarHBondContact O-CB 3.48Å; N213-K217 WeakPolarHBondContact O-CG 3.46Å; N213-K217 PolarHBondContact O-N 3.24Å; N213-K217 WeakPolarHBondContact OD1-CE 3.43Å; N213-K217 PolarHBondContact OD1-NZ 3.43Å; N214-K217 PolarHBondContact O-N 2.86Å; K217-S221 WeakPolarHBondContact O-CB 3.48Å; K217-S221 PolarHBondContact O-N 3.41Å |
| 218 | A | 98.4 | Very high | 98.5 | Very high | 64 Ų | 64 | 102.4 Ų | 102.4 | 53% | 0.529 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -64.1 | -46 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | N214 R215 L216 S221 E222 | N214-A218 WeakPolarHBondContact O-CB 3.41Å; N214-A218 PolarHBondContact O-N 3.49Å; R215-A218 PolarHBondContact O-N 3.34Å; L216-A218 VanDerWaalsContact C-N 3.33Å; L216-A218 PolarHBondContact O-N 3.11Å; A218-S221 PolarHBondContact O-N 3.06Å; A218-E222 PolarHBondContact O-N 3.03Å |
| 219 | A | 98.4 | Very high | 98.5 | Very high | 45 Ų | 45 | 103.8 Ų | 103.8 | 37% | 0.372 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | R215 L216 E222 V223 | R215-A219 PolarHBondContact O-N 2.97Å; L216-A219 PolarHBondContact O-N 3.42Å; A219-E222 WeakPolarHBondContact O-CB 3.28Å; A219-E222 PolarHBondContact O-N 3.38Å; A219-V223 WeakPolarHBondContact O-CG2 3.42Å; A219-V223 PolarHBondContact O-N 2.93Å; A219-V223 VanDerWaalsContact O-N 3.08Å |
| 220 | E | 98.3 | Very high | 98.4 | Very high | 131 Ų | 131 | 104.1 Ų | 104.1 | 61% | 0.612 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -60.7 | -45.9 | 175 | -176.3 | -178 | -176.3 | 0 | 0 | 111.3 | L216 E222 V223 V224 | L216-E220 WeakPolarHBondContact O-CB 3.38Å; L216-E220 PolarHBondContact O-N 2.91Å; E220-E222 VanDerWaalsContact C-N 3.27Å; E220-E222 PolarHBondContact O-N 2.95Å; E220-V223 PolarHBondContact O-N 2.96Å; E220-V224 WeakPolarHBondContact O-CG2 3.4Å; E220-V224 PolarHBondContact O-N 3.05Å |
| 221 | S | 98.3 | Very high | 98.4 | Very high | 69 Ų | 69 | 99.7 Ų | 99.7 | 48% | 0.483 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.1 | -39.2 | 176.8 | -176.3 | 0 | 0 | 0 | 0 | 112 | K217 A218 V224 M225 | K217-S221 WeakPolarHBondContact O-CB 3.48Å; K217-S221 PolarHBondContact O-N 3.41Å; A218-S221 PolarHBondContact O-N 3.06Å; S221-V224 PolarHBondContact O-N 3.17Å; S221-M225 WeakPolarHBondContact O-CB 3.44Å; S221-M225 WeakPolarHBondContact O-CG 3.46Å; S221-M225 PolarHBondContact O-N 3Å |
| 222 | E | 98.4 | Very high | 98.4 | Very high | 136 Ų | 136 | 100.9 Ų | 100.9 | 64% | 0.636 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64 | -45.4 | 176.8 | -172.9 | -178.6 | 172.6 | 0 | 0 | 111.6 | A218 A219 E220 V224 M225 T226 | A218-E222 PolarHBondContact O-N 3.03Å; A219-E222 WeakPolarHBondContact O-CB 3.28Å; A219-E222 PolarHBondContact O-N 3.38Å; E220-E222 VanDerWaalsContact C-N 3.27Å; E220-E222 PolarHBondContact O-N 2.95Å; E222-V224 PolarHBondContact O-N 2.86Å; E222-M225 PolarHBondContact O-N 2.86Å; E222-T226 WeakPolarHBondContact O-CG2 3.41Å; E222-T226 PolarHBondContact O-N 3.23Å; E222-T226 PolarHBondContact O-OG1 3.5Å; E222-T226 VanDerWaalsContact O-OG1 3.09Å |
| 223 | V | 98.4 | Very high | 98.4 | Very high | 94 Ų | 94 | 99.4 Ų | 99.4 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.7 | -43.6 | 175.9 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | A219 E220 M225 T226 M227 | A219-V223 WeakPolarHBondContact O-CG2 3.42Å; A219-V223 PolarHBondContact O-N 2.93Å; A219-V223 VanDerWaalsContact O-N 3.08Å; E220-V223 PolarHBondContact O-N 2.96Å; V223-M225 VanDerWaalsContact C-N 3.35Å; V223-M225 PolarHBondContact O-N 3.34Å; V223-T226 WeakPolarHBondContact CA-OG1 3.29Å; V223-T226 PolarHBondContact O-N 3.22Å; V223-T226 PolarHBondContact O-OG1 3.17Å; V223-M227 VanDerWaalsContact O-CB 3.31Å; V223-M227 WeakPolarHBondContact O-CB 3.5Å; V223-M227 PolarHBondContact O-N 3.25Å |
| 224 | V | 98.4 | Very high | 98.4 | Very high | 85 Ų | 85 | 98.2 Ų | 98.2 | 52% | 0.515 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.2 | -41 | 177.6 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | E220 S221 E222 M227 R228 | E220-V224 WeakPolarHBondContact O-CG2 3.4Å; E220-V224 PolarHBondContact O-N 3.05Å; S221-V224 PolarHBondContact O-N 3.17Å; E222-V224 PolarHBondContact O-N 2.86Å; V224-M227 PolarHBondContact O-N 2.94Å; V224-R228 VanDerWaalsContact O-CB 3.31Å; V224-R228 WeakPolarHBondContact O-CB 3.45Å; V224-R228 PolarHBondContact O-N 2.99Å |
| 225 | M | 98.1 | Very high | 98.4 | Very high | 118 Ų | 118 | 96 Ų | 96 | 58% | 0.581 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -64.2 | -44.7 | 177.6 | -76.5 | -64.8 | -68.2 | 0 | 0 | 112.1 | S221 E222 V223 R228 Q229 | S221-M225 WeakPolarHBondContact O-CB 3.44Å; S221-M225 WeakPolarHBondContact O-CG 3.46Å; S221-M225 PolarHBondContact O-N 3Å; E222-M225 PolarHBondContact O-N 2.86Å; V223-M225 VanDerWaalsContact C-N 3.35Å; V223-M225 PolarHBondContact O-N 3.34Å; M225-R228 PolarHBondContact O-N 3.37Å; M225-Q229 WeakPolarHBondContact O-CB 3.35Å; M225-Q229 PolarHBondContact O-N 3.39Å |
| 226 | T | 98.2 | Very high | 98.4 | Very high | 71 Ų | 71 | 92.8 Ų | 92.8 | 44% | 0.436 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.9 | -41.8 | 176.8 | 53.3 | 0 | 0 | 0 | 0 | 111.8 | E222 V223 R228 Q229 N230 | E222-T226 WeakPolarHBondContact O-CG2 3.41Å; E222-T226 PolarHBondContact O-N 3.23Å; E222-T226 PolarHBondContact O-OG1 3.5Å; E222-T226 VanDerWaalsContact O-OG1 3.09Å; V223-T226 WeakPolarHBondContact CA-OG1 3.29Å; V223-T226 PolarHBondContact O-N 3.22Å; V223-T226 PolarHBondContact O-OG1 3.17Å; T226-R228 PolarHBondContact O-N 3.1Å; T226-Q229 PolarHBondContact O-N 3.45Å; T226-N230 WeakPolarHBondContact O-CB 3.28Å; T226-N230 VanDerWaalsContact O-CG 3.26Å; T226-N230 PolarHBondContact O-N 3.21Å |
| 227 | M | 98.4 | Very high | 98.4 | Very high | 138 Ų | 138 | 96.2 Ų | 96.2 | 68% | 0.68 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.1 | -42.8 | 175.2 | -174.6 | 176.9 | 174.7 | 0 | 0 | 111.8 | V223 V224 N230 A231 | V223-M227 VanDerWaalsContact O-CB 3.31Å; V223-M227 WeakPolarHBondContact O-CB 3.5Å; V223-M227 PolarHBondContact O-N 3.25Å; V224-M227 PolarHBondContact O-N 2.94Å; M227-N230 PolarHBondContact O-N 3.2Å; M227-A231 WeakPolarHBondContact O-CB 3.35Å; M227-A231 PolarHBondContact O-N 3.13Å |
| 228 | R | 98.4 | Very high | 98.3 | Very high | 175 Ų | 175 | 96.4 Ų | 96.4 | 66% | 0.66 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.3 | -44.7 | 175.3 | -178.3 | 178.8 | 175.7 | 162.9 | 0.4 | 111.5 | V224 M225 T226 A231 Q232 | V224-R228 VanDerWaalsContact O-CB 3.31Å; V224-R228 WeakPolarHBondContact O-CB 3.45Å; V224-R228 PolarHBondContact O-N 2.99Å; M225-R228 PolarHBondContact O-N 3.37Å; T226-R228 PolarHBondContact O-N 3.1Å; R228-A231 PolarHBondContact O-N 3.41Å; R228-Q232 WeakPolarHBondContact O-CB 3.38Å; R228-Q232 PolarHBondContact O-N 3.01Å |
| 229 | Q | 98.3 | Very high | 98.3 | Very high | 103 Ų | 103 | 96.8 Ų | 96.8 | 48% | 0.481 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 176.8 | -176.6 | 61.3 | 26.5 | 0 | 0 | 111.3 | M225 T226 A231 Q232 V233 | M225-Q229 WeakPolarHBondContact O-CB 3.35Å; M225-Q229 PolarHBondContact O-N 3.39Å; T226-Q229 PolarHBondContact O-N 3.45Å; Q229-A231 PolarHBondContact O-N 3.5Å; Q229-Q232 PolarHBondContact O-N 3.22Å; Q229-V233 WeakPolarHBondContact O-CG2 3.42Å; Q229-V233 PolarHBondContact O-N 2.99Å |
| 230 | N | 98.2 | Very high | 98.3 | Very high | 111 Ų | 111 | 100.3 Ų | 100.3 | 59% | 0.594 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.6 | -42.8 | 178 | -71.7 | -13 | 0 | 0 | 0 | 112 | T226 M227 Q232 V233 A234 | T226-N230 WeakPolarHBondContact O-CB 3.28Å; T226-N230 VanDerWaalsContact O-CG 3.26Å; T226-N230 PolarHBondContact O-N 3.21Å; M227-N230 PolarHBondContact O-N 3.2Å; N230-Q232 VanDerWaalsContact C-N 3.33Å; N230-Q232 PolarHBondContact O-N 2.96Å; N230-V233 PolarHBondContact O-N 3.48Å; N230-A234 WeakPolarHBondContact O-CB 3.47Å; N230-A234 PolarHBondContact O-N 3.23Å |
| 231 | A | 98.5 | Very high | 98.3 | Very high | 61 Ų | 61 | 97.6 Ų | 97.6 | 50% | 0.504 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.9 | -41 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | M227 R228 Q229 A234 A235 | M227-A231 WeakPolarHBondContact O-CB 3.35Å; M227-A231 PolarHBondContact O-N 3.13Å; R228-A231 PolarHBondContact O-N 3.41Å; Q229-A231 PolarHBondContact O-N 3.5Å; A231-A234 PolarHBondContact O-N 3.39Å; A231-A235 WeakPolarHBondContact O-CB 3.29Å; A231-A235 PolarHBondContact O-N 2.93Å |
| 232 | Q | 98.3 | Very high | 98.3 | Very high | 97 Ų | 97 | 98 Ų | 98 | 45% | 0.453 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.3 | -46.9 | 176.7 | -176.3 | 170.8 | -12.4 | 0 | 0 | 111.7 | R228 Q229 N230 A234 A235 E236 | R228-Q232 WeakPolarHBondContact O-CB 3.38Å; R228-Q232 PolarHBondContact O-N 3.01Å; Q229-Q232 PolarHBondContact O-N 3.22Å; N230-Q232 VanDerWaalsContact C-N 3.33Å; N230-Q232 PolarHBondContact O-N 2.96Å; Q232-A234 VanDerWaalsContact C-N 3.34Å; Q232-A234 PolarHBondContact O-N 2.93Å; Q232-A235 WeakPolarHBondContact O-CB 3.44Å; Q232-A235 PolarHBondContact O-N 3.45Å; Q232-E236 WeakPolarHBondContact O-CG 3.34Å; Q232-E236 PolarHBondContact O-N 3.29Å |
| 233 | V | 98.3 | Very high | 98.3 | Very high | 48 Ų | 48 | 94.9 Ų | 94.9 | 29% | 0.291 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.7 | -44.8 | 176.3 | 169.7 | 0 | 0 | 0 | 0 | 111 | Q229 N230 A235 E236 Y237 | Q229-V233 WeakPolarHBondContact O-CG2 3.42Å; Q229-V233 PolarHBondContact O-N 2.99Å; N230-V233 PolarHBondContact O-N 3.48Å; V233-A235 VanDerWaalsContact C-N 3.35Å; V233-A235 PolarHBondContact O-N 2.92Å; V233-E236 PolarHBondContact O-N 2.89Å; V233-Y237 HydrophobicContact CG1-CD2 3.68Å; V233-Y237 HydrophobicContact CG1-CE2 3.42Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.42Å; V233-Y237 WeakPolarHBondContact O-CD2 3.41Å; V233-Y237 PolarHBondContact O-N 3.02Å |
| 234 | A | 98.4 | Very high | 98.3 | Very high | 50 Ų | 50 | 97 Ų | 97 | 41% | 0.413 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | N230 A231 Q232 E236 Y237 L238 | N230-A234 WeakPolarHBondContact O-CB 3.47Å; N230-A234 PolarHBondContact O-N 3.23Å; A231-A234 PolarHBondContact O-N 3.39Å; Q232-A234 VanDerWaalsContact C-N 3.34Å; Q232-A234 PolarHBondContact O-N 2.93Å; A234-E236 PolarHBondContact O-N 3.34Å; A234-Y237 PolarHBondContact O-N 2.98Å; A234-L238 WeakPolarHBondContact O-CG 3.36Å; A234-L238 PolarHBondContact O-N 2.72Å |
| 235 | A | 98.5 | Very high | 98.3 | Very high | 56 Ų | 56 | 95.2 Ų | 95.2 | 46% | 0.463 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A231 Q232 V233 L238 S239 | A231-A235 WeakPolarHBondContact O-CB 3.29Å; A231-A235 PolarHBondContact O-N 2.93Å; Q232-A235 WeakPolarHBondContact O-CB 3.44Å; Q232-A235 PolarHBondContact O-N 3.45Å; V233-A235 VanDerWaalsContact C-N 3.35Å; V233-A235 PolarHBondContact O-N 2.92Å; A235-L238 PolarHBondContact O-N 3.49Å; A235-S239 WeakPolarHBondContact O-CB 3.36Å; A235-S239 PolarHBondContact O-N 3.24Å |
| 236 | E | 98.2 | Very high | 98.3 | Very high | 88 Ų | 88 | 94.7 Ų | 94.7 | 41% | 0.411 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.5 | -42.5 | 175.1 | -72.3 | 175.4 | -162.6 | 0 | 0 | 112.1 | Q232 V233 A234 S239 K240 | Q232-E236 WeakPolarHBondContact O-CG 3.34Å; Q232-E236 PolarHBondContact O-N 3.29Å; V233-E236 PolarHBondContact O-N 2.89Å; A234-E236 PolarHBondContact O-N 3.34Å; E236-S239 PolarHBondContact O-N 2.75Å; E236-K240 WeakPolarHBondContact O-CG 3.46Å; E236-K240 PolarHBondContact O-N 2.89Å |
| 237 | Y | 98.4 | Very high | 98.3 | Very high | 163 Ų | 163 | 94.6 Ų | 94.6 | 64% | 0.639 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -60.2 | -45.2 | 174.6 | -84.4 | -66 | 0 | 0 | 0 | 112.1 | V233 A234 K240 S241 | V233-Y237 HydrophobicContact CG1-CD2 3.68Å; V233-Y237 HydrophobicContact CG1-CE2 3.42Å; V233-Y237 VanDerWaalsContact CG1-CE2 3.42Å; V233-Y237 WeakPolarHBondContact O-CD2 3.41Å; V233-Y237 PolarHBondContact O-N 3.02Å; A234-Y237 PolarHBondContact O-N 2.98Å; Y237-K240 PolarHBondContact O-N 3.41Å; Y237-S241 WeakPolarHBondContact O-CB 3.33Å; Y237-S241 PolarHBondContact O-N 2.85Å |
| 238 | L | 98.3 | Very high | 98.3 | Very high | 121 Ų | 121 | 91 Ų | 91 | 63% | 0.634 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.8 | -42.9 | 176.6 | -70.6 | 173.7 | 0 | 0 | 0 | 111.5 | A234 A235 K240 S241 V242 | A234-L238 WeakPolarHBondContact O-CG 3.36Å; A234-L238 PolarHBondContact O-N 2.72Å; A235-L238 PolarHBondContact O-N 3.49Å; L238-K240 PolarHBondContact O-N 3.31Å; L238-S241 PolarHBondContact O-N 3.4Å; L238-V242 WeakPolarHBondContact O-CG2 3.31Å; L238-V242 PolarHBondContact O-N 3.28Å |
| 239 | S | 98.4 | Very high | 98.3 | Very high | 72 Ų | 72 | 87.2 Ų | 87.2 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -60.5 | -42.7 | 176.8 | -178.1 | 0 | 0 | 0 | 0 | 112.5 | A235 E236 V242 S243 | A235-S239 WeakPolarHBondContact O-CB 3.36Å; A235-S239 PolarHBondContact O-N 3.24Å; E236-S239 PolarHBondContact O-N 2.75Å; S239-V242 PolarHBondContact O-N 2.9Å; S239-S243 WeakPolarHBondContact O-CB 3.44Å; S239-S243 PolarHBondContact O-N 2.91Å; S239-S243 PolarHBondContact O-OG 3.47Å |
| 240 | K | 98.4 | Very high | 98.3 | Very high | 119 Ų | 119 | 89.9 Ų | 89.9 | 52% | 0.517 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.9 | -45.7 | 173.6 | -72.5 | 173.8 | -175.9 | 171.1 | 0 | 111.5 | E236 Y237 L238 V242 S243 H244 | E236-K240 WeakPolarHBondContact O-CG 3.46Å; E236-K240 PolarHBondContact O-N 2.89Å; Y237-K240 PolarHBondContact O-N 3.41Å; L238-K240 PolarHBondContact O-N 3.31Å; K240-V242 PolarHBondContact O-N 3.02Å; K240-S243 WeakPolarHBondContact O-CB 3.33Å; K240-S243 PolarHBondContact O-N 3.48Å; K240-H244 PolarHBondContact O-CD2 3.45Å; K240-H244 PolarHBondContact O-N 3.41Å |
| 241 | S | 98.4 | Very high | 98.2 | Very high | 74 Ų | 74 | 89.6 Ų | 89.6 | 52% | 0.517 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.9 | -45.9 | 177.5 | -172.2 | 0 | 0 | 0 | 0 | 112.1 | Y237 L238 S243 H244 A245 | Y237-S241 WeakPolarHBondContact O-CB 3.33Å; Y237-S241 PolarHBondContact O-N 2.85Å; L238-S241 PolarHBondContact O-N 3.4Å; S241-S243 VanDerWaalsContact C-N 3.34Å; S241-S243 PolarHBondContact O-N 2.91Å; S241-H244 PolarHBondContact O-N 3.44Å; S241-A245 WeakPolarHBondContact O-CB 3.45Å; S241-A245 PolarHBondContact O-N 3.35Å |
| 242 | V | 98.3 | Very high | 98.2 | Very high | 79 Ų | 79 | 91.7 Ų | 91.7 | 48% | 0.479 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 174.7 | 169.9 | 0 | 0 | 0 | 0 | 111.2 | L238 S239 K240 H244 A245 H246 | L238-V242 WeakPolarHBondContact O-CG2 3.31Å; L238-V242 PolarHBondContact O-N 3.28Å; S239-V242 PolarHBondContact O-N 2.9Å; K240-V242 PolarHBondContact O-N 3.02Å; V242-H244 PolarHBondContact O-N 2.81Å; V242-A245 PolarHBondContact O-N 2.94Å; V242-H246 WeakPolarHBondContact O-CB 3.37Å; V242-H246 PolarHBondContact O-N 3.1Å |
| 243 | S | 98.1 | Very high | 98.1 | Very high | 70 Ų | 70 | 92 Ų | 92 | 49% | 0.49 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.4 | -41.8 | 177.7 | -59.7 | 0 | 0 | 0 | 0 | 112.1 | S239 K240 S241 H246 S247 | S239-S243 WeakPolarHBondContact O-CB 3.44Å; S239-S243 PolarHBondContact O-N 2.91Å; S239-S243 PolarHBondContact O-OG 3.47Å; K240-S243 WeakPolarHBondContact O-CB 3.33Å; K240-S243 PolarHBondContact O-N 3.48Å; S241-S243 VanDerWaalsContact C-N 3.34Å; S241-S243 PolarHBondContact O-N 2.91Å; S243-H246 PolarHBondContact O-N 2.98Å; S243-S247 PolarHBondContact O-N 3.19Å |
| 244 | H | 98.3 | Very high | 98 | Very high | 138 Ų | 138 | 95.8 Ų | 95.8 | 64% | 0.639 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63.7 | -45.5 | 173.8 | -74.6 | -56.4 | 0 | 0 | 0 | 112 | K240 S241 V242 H246 S247 S248 | K240-H244 PolarHBondContact O-CD2 3.45Å; K240-H244 PolarHBondContact O-N 3.41Å; S241-H244 PolarHBondContact O-N 3.44Å; V242-H244 PolarHBondContact O-N 2.81Å; H244-H246 VanDerWaalsContact C-N 3.34Å; H244-H246 PolarHBondContact O-N 3.35Å; H244-S247 WeakPolarHBondContact O-CB 3.37Å; H244-S247 PolarHBondContact O-N 3.03Å; H244-S247 VanDerWaalsContact O-N 3.17Å; H244-S248 PolarHBondContact O-N 2.89Å |
| 245 | A | 98.1 | Very high | 97.9 | Very high | 47 Ų | 47 | 97.5 Ų | 97.5 | 39% | 0.388 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.7 | -44.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | S241 V242 S247 S248 I249 | S241-A245 WeakPolarHBondContact O-CB 3.45Å; S241-A245 PolarHBondContact O-N 3.35Å; V242-A245 PolarHBondContact O-N 2.94Å; A245-S247 VanDerWaalsContact C-N 3.32Å; A245-S247 PolarHBondContact O-N 2.87Å; A245-S248 PolarHBondContact O-N 3.4Å; A245-I249 WeakPolarHBondContact O-CB 3.37Å; A245-I249 VanDerWaalsContact O-CG1 3.3Å; A245-I249 WeakPolarHBondContact O-CG1 3.4Å; A245-I249 PolarHBondContact O-N 3Å |
| 246 | H | 98.2 | Very high | 97.8 | Very high | 108 Ų | 108 | 97.3 Ų | 97.3 | 50% | 0.5 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61 | -37.4 | 174.5 | -85.6 | -158.5 | 0 | 0 | 0 | 113.1 | V242 S243 H244 R250 | V242-H246 WeakPolarHBondContact O-CB 3.37Å; V242-H246 PolarHBondContact O-N 3.1Å; S243-H246 PolarHBondContact O-N 2.98Å; H244-H246 VanDerWaalsContact C-N 3.34Å; H244-H246 PolarHBondContact O-N 3.35Å; H246-R250 WeakPolarHBondContact O-CB 3.34Å; H246-R250 PolarHBondContact O-N 3.45Å; H246-R250 VanDerWaalsContact O-N 3.14Å; H246-R250 PolarHBondContact O-NE 3.01Å |
| 247 | S | 98.1 | Very high | 97.7 | Very high | 69 Ų | 69 | 98.8 Ų | 98.8 | 48% | 0.483 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67 | -45.2 | 175 | -168.2 | 0 | 0 | 0 | 0 | 111.2 | S243 H244 A245 R250 Q251 | S243-S247 PolarHBondContact O-N 3.19Å; H244-S247 WeakPolarHBondContact O-CB 3.37Å; H244-S247 PolarHBondContact O-N 3.03Å; H244-S247 VanDerWaalsContact O-N 3.17Å; A245-S247 VanDerWaalsContact C-N 3.32Å; A245-S247 PolarHBondContact O-N 2.87Å; S247-R250 PolarHBondContact O-N 3.46Å; S247-Q251 PolarHBondContact O-N 3.43Å |
| 248 | S | 98.3 | Very high | 97.6 | Very high | 62 Ų | 62 | 95 Ų | 95 | 43% | 0.434 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.4 | -42.8 | 179.1 | 179.1 | 0 | 0 | 0 | 0 | 112.2 | H244 A245 R250 Q251 L252 | H244-S248 PolarHBondContact O-N 2.89Å; A245-S248 PolarHBondContact O-N 3.4Å; S248-R250 PolarHBondContact O-N 3.4Å; S248-Q251 PolarHBondContact O-N 3.42Å; S248-L252 WeakPolarHBondContact O-CG 3.25Å; S248-L252 PolarHBondContact O-N 3.31Å |
| 249 | I | 97.9 | Very high | 97.5 | Very high | 96 Ų | 96 | 95 Ų | 95 | 49% | 0.492 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -61.5 | -44.5 | 175.2 | -69.8 | 166.9 | 0 | 0 | 0 | 110.8 | A245 Q251 L252 L253 | A245-I249 WeakPolarHBondContact O-CB 3.37Å; A245-I249 VanDerWaalsContact O-CG1 3.3Å; A245-I249 WeakPolarHBondContact O-CG1 3.4Å; A245-I249 PolarHBondContact O-N 3Å; I249-Q251 VanDerWaalsContact C-N 3.34Å; I249-Q251 PolarHBondContact O-N 2.89Å; I249-L252 PolarHBondContact O-N 3.45Å; I249-L253 HydrophobicContact CG2-CD1 4.19Å; I249-L253 WeakPolarHBondContact O-CG 3.41Å; I249-L253 PolarHBondContact O-N 3.28Å |
| 250 | R | 97.8 | Very high | 97.4 | Very high | 159 Ų | 159 | 98.3 Ų | 98.3 | 60% | 0.6 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.5 | -44.3 | 177.1 | -86.8 | -173.1 | -84.6 | -172.3 | -4.8 | 112.1 | H246 S247 S248 L252 L253 E254 | H246-R250 WeakPolarHBondContact O-CB 3.34Å; H246-R250 PolarHBondContact O-N 3.45Å; H246-R250 VanDerWaalsContact O-N 3.14Å; H246-R250 PolarHBondContact O-NE 3.01Å; S247-R250 PolarHBondContact O-N 3.46Å; S248-R250 PolarHBondContact O-N 3.4Å; R250-L252 PolarHBondContact O-N 2.96Å; R250-L253 WeakPolarHBondContact O-CB 3.39Å; R250-L253 PolarHBondContact O-N 3.45Å; R250-E254 PolarHBondContact O-N 3.27Å |
| 251 | Q | 97.5 | Very high | 97.2 | Very high | 105 Ų | 105 | 97.5 Ų | 97.5 | 49% | 0.491 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.3 | -45.6 | 176.5 | -174.4 | -174.7 | -21.6 | 0 | 0 | 111.8 | S247 S248 I249 L253 E254 E255 | S247-Q251 PolarHBondContact O-N 3.43Å; S248-Q251 PolarHBondContact O-N 3.42Å; I249-Q251 VanDerWaalsContact C-N 3.34Å; I249-Q251 PolarHBondContact O-N 2.89Å; Q251-L253 VanDerWaalsContact C-N 3.27Å; Q251-L253 PolarHBondContact O-N 2.86Å; Q251-E254 PolarHBondContact O-N 3.5Å; Q251-E255 WeakPolarHBondContact CG-OE1 3.48Å; Q251-E255 PolarHBondContact NE2-OE1 2.89Å; Q251-E255 WeakPolarHBondContact O-CG 3.34Å; Q251-E255 PolarHBondContact O-N 2.88Å |
| 252 | L | 97.4 | Very high | 97.1 | Very high | 105 Ų | 105 | 97.5 Ų | 97.5 | 55% | 0.55 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.8 | -36.5 | 176.7 | -74.6 | 170.4 | 0 | 0 | 0 | 112.6 | S248 I249 R250 A256 | S248-L252 WeakPolarHBondContact O-CG 3.25Å; S248-L252 PolarHBondContact O-N 3.31Å; I249-L252 PolarHBondContact O-N 3.45Å; R250-L252 PolarHBondContact O-N 2.96Å; L252-A256 VanDerWaalsContact O-CB 3.31Å; L252-A256 WeakPolarHBondContact O-CB 3.48Å; L252-A256 PolarHBondContact O-N 3.35Å |
| 253 | L | 96.6 | Very high | 96.9 | Very high | 104 Ų | 104 | 96.9 Ų | 96.9 | 55% | 0.545 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.8 | -43.9 | 175.1 | -72.7 | 170.7 | 0 | 0 | 0 | 111.7 | I249 R250 Q251 A256 E257 | I249-L253 HydrophobicContact CG2-CD1 4.19Å; I249-L253 WeakPolarHBondContact O-CG 3.41Å; I249-L253 PolarHBondContact O-N 3.28Å; R250-L253 WeakPolarHBondContact O-CB 3.39Å; R250-L253 PolarHBondContact O-N 3.45Å; Q251-L253 VanDerWaalsContact C-N 3.27Å; Q251-L253 PolarHBondContact O-N 2.86Å; L253-A256 PolarHBondContact O-N 3.34Å; L253-E257 WeakPolarHBondContact O-CG 3.35Å; L253-E257 PolarHBondContact O-N 2.92Å |
| 254 | E | 96.8 | Very high | 96.7 | Very high | 126 Ų | 126 | 97.9 Ų | 97.9 | 59% | 0.589 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -60.4 | -45.9 | 174.4 | -72.7 | 173.6 | -171.3 | 0 | 0 | 111.2 | R250 Q251 A256 E257 T258 | R250-E254 PolarHBondContact O-N 3.27Å; Q251-E254 PolarHBondContact O-N 3.5Å; E254-A256 VanDerWaalsContact C-N 3.35Å; E254-A256 PolarHBondContact O-N 3.23Å; E254-E257 WeakPolarHBondContact O-CB 3.49Å; E254-E257 PolarHBondContact O-N 2.82Å; E254-E257 VanDerWaalsContact O-N 3.16Å; E254-T258 WeakPolarHBondContact O-CG2 3.41Å; E254-T258 PolarHBondContact O-N 2.87Å |
| 255 | E | 96.8 | Very high | 96.5 | Very high | 86 Ų | 86 | 95.8 Ų | 95.8 | 40% | 0.402 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -60.9 | -42.6 | 175.5 | -71.7 | 174.2 | -166.2 | 0 | 0 | 111.5 | Q251 E257 T258 L259 | Q251-E255 WeakPolarHBondContact CG-OE1 3.48Å; Q251-E255 PolarHBondContact NE2-OE1 2.89Å; Q251-E255 WeakPolarHBondContact O-CG 3.34Å; Q251-E255 PolarHBondContact O-N 2.88Å; E255-E257 VanDerWaalsContact C-N 3.32Å; E255-E257 PolarHBondContact O-N 3.08Å; E255-T258 PolarHBondContact O-N 2.64Å; E255-T258 VanDerWaalsContact O-N 3.17Å; E255-T258 PolarHBondContact O-OG1 3.12Å; E255-L259 WeakPolarHBondContact O-CG 3.49Å; E255-L259 PolarHBondContact O-N 3.45Å |
| 256 | A | 96.6 | Very high | 96.1 | Very high | 53 Ų | 53 | 98.8 Ų | 98.8 | 44% | 0.438 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -62.3 | -37.2 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L252 L253 E254 L259 R260 | L252-A256 VanDerWaalsContact O-CB 3.31Å; L252-A256 WeakPolarHBondContact O-CB 3.48Å; L252-A256 PolarHBondContact O-N 3.35Å; L253-A256 PolarHBondContact O-N 3.34Å; E254-A256 VanDerWaalsContact C-N 3.35Å; E254-A256 PolarHBondContact O-N 3.23Å; A256-L259 PolarHBondContact O-N 3.01Å; A256-R260 WeakPolarHBondContact O-CB 3.5Å; A256-R260 PolarHBondContact O-N 2.84Å |
| 257 | E | 95.5 | Very high | 95.8 | Very high | 119 Ų | 119 | 99 Ų | 99 | 56% | 0.556 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.5 | -40.7 | 172.6 | -73.7 | -178.2 | 178.4 | 0 | 0 | 112.1 | L253 E254 E255 R260 L261 | L253-E257 WeakPolarHBondContact O-CG 3.35Å; L253-E257 PolarHBondContact O-N 2.92Å; E254-E257 WeakPolarHBondContact O-CB 3.49Å; E254-E257 PolarHBondContact O-N 2.82Å; E254-E257 VanDerWaalsContact O-N 3.16Å; E255-E257 VanDerWaalsContact C-N 3.32Å; E255-E257 PolarHBondContact O-N 3.08Å; E257-R260 WeakPolarHBondContact O-CB 3.41Å; E257-R260 PolarHBondContact O-N 2.82Å; E257-L261 PolarHBondContact O-N 2.86Å |
| 258 | T | 95.9 | Very high | 95.5 | Very high | 83 Ų | 83 | 98.1 Ų | 98.1 | 51% | 0.509 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -62.4 | -43.5 | 174 | 67 | 0 | 0 | 0 | 0 | 111.9 | E254 E255 R260 L261 V262 | E254-T258 WeakPolarHBondContact O-CG2 3.41Å; E254-T258 PolarHBondContact O-N 2.87Å; E255-T258 PolarHBondContact O-N 2.64Å; E255-T258 VanDerWaalsContact O-N 3.17Å; E255-T258 PolarHBondContact O-OG1 3.12Å; T258-R260 VanDerWaalsContact C-N 3.31Å; T258-R260 PolarHBondContact O-N 3.17Å; T258-L261 WeakPolarHBondContact O-CB 3.24Å; T258-L261 PolarHBondContact O-N 3.38Å; T258-L261 VanDerWaalsContact O-N 3.16Å; T258-V262 WeakPolarHBondContact O-CG2 3.42Å; T258-V262 PolarHBondContact O-N 3.15Å |
| 259 | L | 95.9 | Very high | 95 | Very high | 121 Ų | 121 | 100 Ų | 100 | 63% | 0.634 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -62.7 | -38.4 | 176.3 | -71.3 | 173.9 | 0 | 0 | 0 | 111.8 | E255 A256 V262 S263 | E255-L259 WeakPolarHBondContact O-CG 3.49Å; E255-L259 PolarHBondContact O-N 3.45Å; A256-L259 PolarHBondContact O-N 3.01Å; L259-V262 PolarHBondContact O-N 3.33Å; L259-S263 WeakPolarHBondContact O-CB 3.42Å; L259-S263 PolarHBondContact O-N 3.06Å |
| 260 | R | 95.6 | Very high | 94.3 | Very high | 141 Ų | 141 | 100.6 Ų | 100.6 | 53% | 0.532 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 173.9 | -174.8 | 175.4 | 65.1 | 87.6 | -2.4 | 111.6 | A256 E257 T258 S263 Q264 | A256-R260 WeakPolarHBondContact O-CB 3.5Å; A256-R260 PolarHBondContact O-N 2.84Å; E257-R260 WeakPolarHBondContact O-CB 3.41Å; E257-R260 PolarHBondContact O-N 2.82Å; T258-R260 VanDerWaalsContact C-N 3.31Å; T258-R260 PolarHBondContact O-N 3.17Å; R260-S263 PolarHBondContact O-N 3.44Å; R260-Q264 WeakPolarHBondContact O-CG 3.3Å; R260-Q264 PolarHBondContact O-N 3.38Å |
| 261 | L | 95.6 | Very high | 93.6 | Very high | 103 Ų | 103 | 99.6 Ų | 99.6 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -62.4 | -44.2 | 175.3 | -169 | 77.6 | 0 | 0 | 0 | 111.4 | E257 T258 S263 Q264 L265 | E257-L261 PolarHBondContact O-N 2.86Å; T258-L261 WeakPolarHBondContact O-CB 3.24Å; T258-L261 PolarHBondContact O-N 3.38Å; T258-L261 VanDerWaalsContact O-N 3.16Å; L261-S263 VanDerWaalsContact C-N 3.35Å; L261-S263 PolarHBondContact O-N 3.31Å; L261-Q264 PolarHBondContact O-N 3.18Å; L261-L265 HydrophobicContact CG-CD1 4.41Å; L261-L265 PolarHBondContact O-N 3.32Å |
| 262 | V | 95 | Very high | 92.8 | Very high | 74 Ų | 74 | 100.7 Ų | 100.7 | 45% | 0.448 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -60.3 | -44.4 | 175.1 | 172.7 | 0 | 0 | 0 | 0 | 111 | T258 L259 Q264 L265 L266 | T258-V262 WeakPolarHBondContact O-CG2 3.42Å; T258-V262 PolarHBondContact O-N 3.15Å; L259-V262 PolarHBondContact O-N 3.33Å; V262-Q264 VanDerWaalsContact C-N 3.35Å; V262-Q264 PolarHBondContact O-N 3.13Å; V262-L265 WeakPolarHBondContact O-CB 3.43Å; V262-L265 PolarHBondContact O-N 3.48Å; V262-L266 HydrophobicContact CG1-CD1 4.05Å; V262-L266 HydrophobicContact CG1-CG 4.41Å; V262-L266 WeakPolarHBondContact O-CG 3.22Å; V262-L266 PolarHBondContact O-N 3.46Å |
| 263 | S | 94.8 | Very high | 91.5 | Very high | 65 Ų | 65 | 100.4 Ų | 100.4 | 46% | 0.455 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -59.8 | -43.5 | 175.6 | 178.4 | 0 | 0 | 0 | 0 | 112 | L259 R260 L261 L266 Q267 | L259-S263 WeakPolarHBondContact O-CB 3.42Å; L259-S263 PolarHBondContact O-N 3.06Å; R260-S263 PolarHBondContact O-N 3.44Å; L261-S263 VanDerWaalsContact C-N 3.35Å; L261-S263 PolarHBondContact O-N 3.31Å; S263-L266 PolarHBondContact O-N 3.15Å; S263-Q267 PolarHBondContact O-N 3.5Å |
| 264 | Q | 93.7 | Very high | 89.5 | Confident | 92 Ų | 92 | 99.2 Ų | 99.2 | 43% | 0.43 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -63.9 | -41 | 175.6 | -72.9 | 178.3 | -19.6 | 0 | 0 | 112.5 | R260 L261 V262 Q267 S268 | R260-Q264 WeakPolarHBondContact O-CG 3.3Å; R260-Q264 PolarHBondContact O-N 3.38Å; L261-Q264 PolarHBondContact O-N 3.18Å; V262-Q264 VanDerWaalsContact C-N 3.35Å; V262-Q264 PolarHBondContact O-N 3.13Å; Q264-Q267 PolarHBondContact O-N 3.06Å; Q264-S268 WeakPolarHBondContact O-CB 3.36Å; Q264-S268 PolarHBondContact O-N 3.02Å |
| 265 | L | 93.4 | Very high | 87.5 | Confident | 94 Ų | 94 | 98.5 Ų | 98.5 | 49% | 0.492 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -59.7 | -49.6 | 173.1 | -88.8 | 156.8 | 0 | 0 | 0 | 111 | L261 V262 Q267 S268 I269 | L261-L265 HydrophobicContact CG-CD1 4.41Å; L261-L265 PolarHBondContact O-N 3.32Å; V262-L265 WeakPolarHBondContact O-CB 3.43Å; V262-L265 PolarHBondContact O-N 3.48Å; L265-Q267 VanDerWaalsContact C-N 3.34Å; L265-Q267 PolarHBondContact O-N 3.02Å; L265-S268 PolarHBondContact O-N 3.45Å; L265-S268 VanDerWaalsContact O-N 3.08Å; L265-S268 PolarHBondContact O-OG 2.98Å; L265-I269 WeakPolarHBondContact O-CG1 3.22Å; L265-I269 PolarHBondContact O-N 3.38Å |
| 266 | L | 91.6 | Very high | 85 | Confident | 109 Ų | 109 | 102.3 Ų | 102.3 | 57% | 0.571 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -59.6 | -42.6 | 176.4 | -70.8 | 171.8 | 0 | 0 | 0 | 111.9 | V262 S263 S268 I269 D270 | V262-L266 HydrophobicContact CG1-CD1 4.05Å; V262-L266 HydrophobicContact CG1-CG 4.41Å; V262-L266 WeakPolarHBondContact O-CG 3.22Å; V262-L266 PolarHBondContact O-N 3.46Å; S263-L266 PolarHBondContact O-N 3.15Å; L266-S268 VanDerWaalsContact C-N 3.32Å; L266-S268 PolarHBondContact O-N 3.25Å; L266-I269 PolarHBondContact O-N 2.9Å; L266-D270 PolarHBondContact O-N 3.43Å |
| 267 | Q | 90.8 | Very high | 82.6 | Confident | 113 Ų | 113 | 105.5 Ų | 105.5 | 53% | 0.528 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.4 | -37 | 173 | -107.4 | 179.8 | 13.8 | 0 | 0 | 113 | S263 Q264 L265 D270 K271 | S263-Q267 PolarHBondContact O-N 3.5Å; Q264-Q267 PolarHBondContact O-N 3.06Å; L265-Q267 VanDerWaalsContact C-N 3.34Å; L265-Q267 PolarHBondContact O-N 3.02Å; Q267-D270 PolarHBondContact O-N 3.27Å; Q267-K271 WeakPolarHBondContact O-CG 3.47Å; Q267-K271 PolarHBondContact O-N 2.68Å |
| 268 | S | 91.3 | Very high | 80.2 | Confident | 50 Ų | 50 | 108.1 Ų | 108.1 | 35% | 0.35 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -68.3 | -37 | 176.7 | 75.5 | 0 | 0 | 0 | 0 | 111.8 | Q264 L265 L266 K271 I272 | Q264-S268 WeakPolarHBondContact O-CB 3.36Å; Q264-S268 PolarHBondContact O-N 3.02Å; L265-S268 PolarHBondContact O-N 3.45Å; L265-S268 VanDerWaalsContact O-N 3.08Å; L265-S268 PolarHBondContact O-OG 2.98Å; L266-S268 VanDerWaalsContact C-N 3.32Å; L266-S268 PolarHBondContact O-N 3.25Å; S268-K271 PolarHBondContact O-N 3.11Å; S268-I272 VanDerWaalsContact O-CG1 3.31Å; S268-I272 WeakPolarHBondContact O-CG1 3.43Å; S268-I272 PolarHBondContact O-N 3.13Å; S268-I272 VanDerWaalsContact O-N 3.12Å |
| 269 | I | 87.8 | Confident | 78 | Confident | 101 Ų | 101 | 107.2 Ų | 107.2 | 52% | 0.518 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -64.5 | -45.8 | 173.6 | -67.2 | 166.5 | 0 | 0 | 0 | 110.1 | L265 L266 K271 I272 S273 | L265-I269 WeakPolarHBondContact O-CG1 3.22Å; L265-I269 PolarHBondContact O-N 3.38Å; L266-I269 PolarHBondContact O-N 2.9Å; I269-K271 VanDerWaalsContact C-N 3.32Å; I269-K271 PolarHBondContact O-N 3.12Å; I269-I272 PolarHBondContact O-N 2.9Å; I269-I272 VanDerWaalsContact O-N 3.15Å; I269-S273 WeakPolarHBondContact O-CB 3.42Å; I269-S273 PolarHBondContact O-N 2.79Å |
| 270 | D | 83 | Confident | 75.3 | Confident | 110 Ų | 110 | 106.6 Ų | 106.6 | 59% | 0.588 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -57.3 | -44 | 176.3 | -171.2 | 53.6 | 0 | 0 | 0 | 111.8 | L266 Q267 I272 S273 S274 | L266-D270 PolarHBondContact O-N 3.43Å; Q267-D270 PolarHBondContact O-N 3.27Å; D270-I272 PolarHBondContact O-N 3.43Å; D270-S273 CarbonylContact O-C 3.6Å; D270-S273 WeakPolarHBondContact O-CB 3.37Å; D270-S273 PolarHBondContact O-N 3.17Å; D270-S273 VanDerWaalsContact O-N 3.15Å; D270-S274 WeakPolarHBondContact O-CB 3.23Å; D270-S274 PolarHBondContact O-N 3.2Å |
| 271 | K | 84.3 | Confident | 72.9 | Confident | 138 Ų | 138 | 106.5 Ų | 106.5 | 60% | 0.6 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -62.8 | -35.7 | 175.1 | -73.9 | 174.2 | -177.6 | 178.7 | 0 | 114.2 | Q267 S268 I269 S274 | Q267-K271 WeakPolarHBondContact O-CG 3.47Å; Q267-K271 PolarHBondContact O-N 2.68Å; S268-K271 PolarHBondContact O-N 3.11Å; I269-K271 VanDerWaalsContact C-N 3.32Å; I269-K271 PolarHBondContact O-N 3.12Å; K271-S274 PolarHBondContact O-OG 3.45Å; K271-S274 VanDerWaalsContact O-OG 3.11Å |
| 272 | I | 80.2 | Confident | 70.5 | Confident | 128 Ų | 128 | 105.8 Ų | 105.8 | 66% | 0.656 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -72 | -36.7 | 175.1 | -64 | 162.6 | 0 | 0 | 0 | 109.8 | S268 I269 D270 S274 | S268-I272 VanDerWaalsContact O-CG1 3.31Å; S268-I272 WeakPolarHBondContact O-CG1 3.43Å; S268-I272 PolarHBondContact O-N 3.13Å; S268-I272 VanDerWaalsContact O-N 3.12Å; I269-I272 PolarHBondContact O-N 2.9Å; I269-I272 VanDerWaalsContact O-N 3.15Å; D270-I272 PolarHBondContact O-N 3.43Å; I272-S274 VanDerWaalsContact C-N 3.34Å |
| 273 | S | 69.9 | Low | 68.2 | Low | 99 Ų | 99 | 110.3 Ų | 110.3 | 69% | 0.692 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -71.8 | -24.4 | 176.7 | -166 | 0 | 0 | 0 | 0 | 113.5 | I269 D270 | I269-S273 WeakPolarHBondContact O-CB 3.42Å; I269-S273 PolarHBondContact O-N 2.79Å; D270-S273 CarbonylContact O-C 3.6Å; D270-S273 WeakPolarHBondContact O-CB 3.37Å; D270-S273 PolarHBondContact O-N 3.17Å; D270-S273 VanDerWaalsContact O-N 3.15Å |
| 274 | S | 55.3 | Low | 65.8 | Low | 78 Ų | 78 | 114.9 Ų | 114.9 | 55% | 0.545 | 66% | 0.659 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -87 | 0.7 | 179.1 | 73.3 | 0 | 0 | 0 | 0 | 114.5 | D270 K271 I272 Q276 | D270-S274 WeakPolarHBondContact O-CB 3.23Å; D270-S274 PolarHBondContact O-N 3.2Å; K271-S274 PolarHBondContact O-OG 3.45Å; K271-S274 VanDerWaalsContact O-OG 3.11Å; I272-S274 VanDerWaalsContact C-N 3.34Å; S274-Q276 PolarHBondContact O-N 3.33Å |
| 275 | V | 54.5 | Low | 63.6 | Low | 111 Ų | 111 | 117.3 Ų | 117.3 | 67% | 0.673 | 68% | 0.68 | S | S | * | * | trans | -68 | 99.4 | 167.5 | -177.5 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 276 | Q | 45.1 | Very low | 61.6 | Low | 166 Ų | 166 | 119 Ų | 119 | 78% | 0.776 | 69% | 0.694 | S | S | * | * | trans | -55.6 | 142.1 | 173 | -70.2 | -166.5 | 24.4 | 0 | 0 | 109.8 | S274 D278 | S274-Q276 PolarHBondContact O-N 3.33Å; Q276-D278 PolarHBondContact O-N 3.15Å | ||
| 277 | P | 45.2 | Very low | 59.4 | Low | 120 Ų | 120 | 123 Ų | 123 | 78% | 0.779 | 71% | 0.71 | S | S | * | * | trans | -66.7 | 103.9 | 159.4 | 29.3 | -28.9 | 0 | 0 | 0 | 106.8 | G279 | P277-G279 PolarHBondContact O-N 3.44Š| ||
| 278 | D | 44.7 | Very low | 57.5 | Low | 174 Ų | 174 | 122.4 Ų | 122.4 | 93% | 0.93 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -62.6 | 106.5 | 166.5 | -158.7 | 8.3 | 0 | 0 | 0 | 107.4 | Q276 | Q276-D278 PolarHBondContact O-N 3.15Š|
| 279 | G | 49.8 | Very low | 55.2 | Low | 65 Ų | 65 | 124.3 Ų | 124.3 | 67% | 0.67 | 74% | 0.737 | S | S | * | * | trans | 130.4 | 84.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 116 | P277 | P277-G279 PolarHBondContact O-N 3.44Š| ||
| 280 | A | 40.3 | Very low | 53.9 | Low | 107 Ų | 107 | 129 Ų | 129 | 88% | 0.884 | 77% | 0.774 | S | S | * | * | trans | -155.2 | 127.3 | 145 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 281 | V | 43.9 | Very low | 52.5 | Low | 140 Ų | 140 | 130 Ų | 130 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | trans | -100.9 | 140.6 | -169.8 | 167.5 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 282 | A | 45.5 | Very low | 50.8 | Low | 87 Ų | 87 | 129.6 Ų | 129.6 | 72% | 0.719 | 79% | 0.793 | S | S | * | * | trans | 74.1 | 154.3 | 146.4 | 0 | 0 | 0 | 0 | 0 | 124 | ||||
| 283 | M | 46.5 | Very low | 49.2 | Very low | 169 Ų | 169 | 129.7 Ų | 129.7 | 83% | 0.833 | 80% | 0.801 | S | S | * | * | trans | 95.7 | 91.9 | 155.6 | -69.4 | -163 | 178 | 0 | 0 | 119.3 | ||||
| 284 | E | 45.3 | Very low | 47.9 | Very low | 162 Ų | 162 | 131.5 Ų | 131.5 | 76% | 0.757 | 81% | 0.807 | S | S | * | * | 37.7 | 116.3 | 106.8 | -166.2 | 174.2 | -159 | 0 | 0 | 117.3 | |||||
| 285 | T | 46.7 | Very low | 47.5 | Very low | 142 Ų | 142 | 134.8 Ų | 134.8 | 87% | 0.871 | 82% | 0.823 | S | S | * | * | -162.4 | 132.3 | 118.4 | 39.6 | 0 | 0 | 0 | 0 | 111.9 | |||||
| 286 | V | 51 | Low | 47 | Very low | 129 Ų | 129 | 136.4 Ų | 136.4 | 78% | 0.782 | 83% | 0.834 | S | S | * | * | trans | -56.3 | 138.5 | 162.8 | 172.3 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 287 | E | 45.6 | Very low | 47.1 | Very low | 195 Ų | 195 | 134.3 Ų | 134.3 | 91% | 0.911 | 84% | 0.838 | S | S | * | * | trans | -161.9 | 150.5 | 133.9 | -145.8 | 164.7 | 175.1 | 0 | 0 | 112.5 | ||||
| 288 | S | 50.7 | Low | 47.3 | Very low | 100 Ų | 100 | 135.4 Ų | 135.4 | 70% | 0.699 | 84% | 0.842 | S | S | * | * | trans | -111.3 | 134.2 | -159.3 | -176.2 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 289 | A | 42.9 | Very low | 47.5 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 74% | 0.744 | 84% | 0.835 | S | S | * | * | trans | 56.4 | 161.7 | 143.6 | 0 | 0 | 0 | 0 | 0 | 120.2 | ||||
| 290 | P | 61.9 | Low | 47.3 | Very low | 200 Ų | 200 | 138.3 Ų | 138.3 | 100% | 1.299 | 85% | 0.85 | S | S | * | * | cis | -116.2 | 0 | 7.2 | 39.3 | -27.4 | 0 | 0 | 0 | 116.5 |
Retrieved 290 of 290 residues in 694.1 ms
(Link to these results)