| 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 | 55.9 | Low | 78.8 | Confident | 202 Ų | 202 | 127.7 Ų | 127.7 | 100% | 0.995 | 65% | 0.645 | S | S | * | * | 0 | -46.6 | 0 | -128 | 170.1 | -168.4 | 0 | 0 | 112.8 | T3 I4 | M1-T3 PolarHBondContact O-N 3.49Å; M1-I4 PolarHBondContact O-N 3.2Å | |||
| 2 | N | 62.5 | Low | 78.9 | Confident | 138 Ų | 138 | 129.6 Ų | 129.6 | 74% | 0.738 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -59.4 | -34.1 | -175.8 | -78.3 | -8.9 | 0 | 0 | 0 | 116.3 | I4 L6 | N2-I4 PolarHBondContact O-N 3.29Å; N2-L6 PolarHBondContact O-N 2.81Å |
| 3 | T | 74.9 | Confident | 78.8 | Confident | 106 Ų | 106 | 132.4 Ų | 132.4 | 65% | 0.65 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -67.8 | -33.7 | -177.5 | -36.9 | 0 | 0 | 0 | 0 | 113.3 | M1 L7 | M1-T3 PolarHBondContact O-N 3.49Å; T3-L7 PolarHBondContact O-N 3.17Å |
| 4 | I | 84.6 | Confident | 77.9 | Confident | 114 Ų | 114 | 133.1 Ų | 133.1 | 59% | 0.585 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -70.7 | -41.3 | -177.8 | -62.6 | 174.7 | 0 | 0 | 0 | 110.4 | M1 N2 L6 L7 L8 | M1-I4 PolarHBondContact O-N 3.2Å; N2-I4 PolarHBondContact O-N 3.29Å; I4-L6 VanDerWaalsContact C-N 3.33Å; I4-L6 PolarHBondContact O-N 3.25Å; I4-L7 PolarHBondContact O-N 2.86Å; I4-L8 HydrophobicContact CG2-CD1 4.3Å; I4-L8 PolarHBondContact O-N 3.14Å; I4-L8 VanDerWaalsContact O-N 3.12Å |
| 5 | I | 84.2 | Confident | 76.9 | Confident | 95 Ų | 95 | 132.7 Ų | 132.7 | 49% | 0.487 | 65% | 0.646 | S | S | . | * | H | α-helix | trans | -62.5 | -43 | 178.2 | -62.9 | 177.6 | 0 | 0 | 0 | 110.3 | L7 L8 I9 | I5-L7 VanDerWaalsContact C-N 3.34Å; I5-L7 PolarHBondContact O-N 3.33Å; I5-L8 PolarHBondContact O-N 3.48Å; I5-I9 HydrophobicContact CG2-CD1 3.98Å; I5-I9 WeakPolarHBondContact O-CG1 3.16Å; I5-I9 PolarHBondContact O-N 3.42Å; I5-I9 VanDerWaalsContact O-N 3.08Å |
| 6 | L | 82.8 | Confident | 75.9 | Confident | 113 Ų | 113 | 129.8 Ų | 129.8 | 59% | 0.592 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -64.3 | -37.7 | 179.8 | -158.5 | 74.5 | 0 | 0 | 0 | 112.5 | N2 I4 K10 | N2-L6 PolarHBondContact O-N 2.81Å; I4-L6 VanDerWaalsContact C-N 3.33Å; I4-L6 PolarHBondContact O-N 3.25Å; L6-K10 PolarHBondContact O-N 3.27Å; L6-K10 VanDerWaalsContact O-N 3.08Å |
| 7 | L | 84 | Confident | 75.2 | Confident | 116 Ų | 116 | 126.7 Ų | 126.7 | 61% | 0.607 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -65.5 | -40.5 | 175.2 | -81.1 | 163.4 | 0 | 0 | 0 | 112.3 | T3 I4 I5 K10 K11 | T3-L7 PolarHBondContact O-N 3.17Å; I4-L7 PolarHBondContact O-N 2.86Å; I5-L7 VanDerWaalsContact C-N 3.34Å; I5-L7 PolarHBondContact O-N 3.33Å; L7-K10 PolarHBondContact O-N 2.66Å; L7-K11 WeakPolarHBondContact O-CB 3.49Å; L7-K11 PolarHBondContact O-N 3.21Å |
| 8 | L | 84.9 | Confident | 73.4 | Confident | 111 Ų | 111 | 127.4 Ų | 127.4 | 58% | 0.581 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -65.5 | -40.8 | 177.3 | -73.6 | 169.3 | 0 | 0 | 0 | 112.2 | I4 I5 K11 K12 | I4-L8 HydrophobicContact CG2-CD1 4.3Å; I4-L8 PolarHBondContact O-N 3.14Å; I4-L8 VanDerWaalsContact O-N 3.12Å; I5-L8 PolarHBondContact O-N 3.48Å; L8-K11 PolarHBondContact O-N 2.82Å; L8-K12 WeakPolarHBondContact O-CB 3.49Å; L8-K12 PolarHBondContact O-N 2.9Å |
| 9 | I | 85.3 | Confident | 72.3 | Confident | 102 Ų | 102 | 125.8 Ų | 125.8 | 52% | 0.523 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -64.1 | -46.7 | 176.5 | -66.1 | 169.5 | 0 | 0 | 0 | 110.5 | I5 K11 K12 Y13 | I5-I9 HydrophobicContact CG2-CD1 3.98Å; I5-I9 WeakPolarHBondContact O-CG1 3.16Å; I5-I9 PolarHBondContact O-N 3.42Å; I5-I9 VanDerWaalsContact O-N 3.08Å; I9-K11 VanDerWaalsContact C-N 3.34Å; I9-K11 PolarHBondContact O-N 3.27Å; I9-K12 PolarHBondContact O-N 2.92Å; I9-Y13 PolarHBondContact O-N 3.11Å |
| 10 | K | 84.4 | Confident | 70.9 | Confident | 154 Ų | 154 | 129.2 Ų | 129.2 | 67% | 0.67 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -59 | -44.1 | 176.4 | -92.5 | -172.6 | 172 | -177.2 | 0 | 112.2 | L6 L7 K12 Y13 M14 | L6-K10 PolarHBondContact O-N 3.27Å; L6-K10 VanDerWaalsContact O-N 3.08Å; L7-K10 PolarHBondContact O-N 2.66Å; K10-K12 VanDerWaalsContact C-N 3.35Å; K10-K12 PolarHBondContact O-N 3.22Å; K10-Y13 PolarHBondContact O-N 3.41Å; K10-M14 PolarHBondContact O-N 3.3Å |
| 11 | K | 83.6 | Confident | 69.7 | Low | 154 Ų | 154 | 129.3 Ų | 129.3 | 67% | 0.67 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -62.2 | -43 | 179.1 | -166.5 | 176.8 | -177 | 179.3 | 0 | 111.6 | L7 L8 I9 M14 Q15 | L7-K11 WeakPolarHBondContact O-CB 3.49Å; L7-K11 PolarHBondContact O-N 3.21Å; L8-K11 PolarHBondContact O-N 2.82Å; I9-K11 VanDerWaalsContact C-N 3.34Å; I9-K11 PolarHBondContact O-N 3.27Å; K11-M14 PolarHBondContact O-N 3.36Å; K11-Q15 PolarHBondContact O-N 2.96Å |
| 12 | K | 79.9 | Confident | 69.2 | Low | 150 Ų | 150 | 126.4 Ų | 126.4 | 65% | 0.652 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -67.3 | -37.6 | 178.7 | -160.1 | 168.4 | -175.1 | 174.6 | 0 | 112.1 | L8 I9 K10 I16 | L8-K12 WeakPolarHBondContact O-CB 3.49Å; L8-K12 PolarHBondContact O-N 2.9Å; I9-K12 PolarHBondContact O-N 2.92Å; K10-K12 VanDerWaalsContact C-N 3.35Å; K10-K12 PolarHBondContact O-N 3.22Å; K12-I16 WeakPolarHBondContact O-CD1 3.24Å; K12-I16 WeakPolarHBondContact O-CG1 3.21Å; K12-I16 PolarHBondContact O-N 3.33Å |
| 13 | Y | 76.8 | Confident | 67.9 | Low | 166 Ų | 166 | 126.3 Ų | 126.3 | 65% | 0.651 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.1 | -42.2 | 177.6 | -153.1 | -88 | 0 | 0 | 0 | 112.1 | I9 K10 Q15 I16 V17 | I9-Y13 PolarHBondContact O-N 3.11Å; K10-Y13 PolarHBondContact O-N 3.41Å; Y13-Q15 VanDerWaalsContact C-N 3.34Å; Y13-Q15 PolarHBondContact O-N 3.42Å; Y13-I16 PolarHBondContact O-N 3.44Å; Y13-V17 HydrophobicContact CD1-CG2 4.07Å; Y13-V17 HydrophobicContact CE1-CG2 4.05Å; Y13-V17 WeakPolarHBondContact O-CG2 3.45Å; Y13-V17 PolarHBondContact O-N 3.44Å |
| 14 | M | 66.3 | Low | 65.7 | Low | 142 Ų | 142 | 130 Ų | 130 | 70% | 0.7 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -63 | -40.4 | 178.9 | -163.2 | -169.9 | -101.8 | 0 | 0 | 111.7 | K10 K11 I16 V17 E18 | K10-M14 PolarHBondContact O-N 3.3Å; K11-M14 PolarHBondContact O-N 3.36Å; M14-I16 VanDerWaalsContact C-N 3.32Å; M14-I16 PolarHBondContact O-N 3.23Å; M14-V17 PolarHBondContact O-N 3.32Å; M14-E18 PolarHBondContact O-N 3.16Å; M14-E18 VanDerWaalsContact O-N 3.13Å |
| 15 | Q | 63.8 | Low | 63.1 | Low | 127 Ų | 127 | 129.4 Ų | 129.4 | 59% | 0.593 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -61.3 | -38.5 | 176 | -125.6 | 174.9 | 18.2 | 0 | 0 | 112.8 | K11 Y13 V19 | K11-Q15 PolarHBondContact O-N 2.96Å; Y13-Q15 VanDerWaalsContact C-N 3.34Å; Y13-Q15 PolarHBondContact O-N 3.42Å; Q15-V19 WeakPolarHBondContact O-CG2 3.47Å; Q15-V19 PolarHBondContact O-N 3.45Å |
| 16 | I | 61.1 | Low | 60.7 | Low | 87 Ų | 87 | 134.8 Ų | 134.8 | 45% | 0.446 | 66% | 0.655 | S | S | . | * | H | α-helix | trans | -69.4 | -36.5 | 179.1 | -67.6 | 161.1 | 0 | 0 | 0 | 111.4 | K12 Y13 M14 R20 | K12-I16 WeakPolarHBondContact O-CD1 3.24Å; K12-I16 WeakPolarHBondContact O-CG1 3.21Å; K12-I16 PolarHBondContact O-N 3.33Å; Y13-I16 PolarHBondContact O-N 3.44Å; M14-I16 VanDerWaalsContact C-N 3.32Å; M14-I16 PolarHBondContact O-N 3.23Å; I16-R20 PolarHBondContact O-N 2.82Å |
| 17 | V | 62.5 | Low | 58.1 | Low | 77 Ų | 77 | 139.4 Ų | 139.4 | 47% | 0.467 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -68.8 | -40.6 | 178.9 | 174.1 | 0 | 0 | 0 | 0 | 111 | Y13 M14 V19 R20 | Y13-V17 HydrophobicContact CD1-CG2 4.07Å; Y13-V17 HydrophobicContact CE1-CG2 4.05Å; Y13-V17 WeakPolarHBondContact O-CG2 3.45Å; Y13-V17 PolarHBondContact O-N 3.44Å; M14-V17 PolarHBondContact O-N 3.32Å; V17-V19 PolarHBondContact O-N 3.26Å; V17-R20 PolarHBondContact O-N 3.15Å |
| 18 | E | 44.4 | Very low | 55.5 | Low | 140 Ų | 140 | 139.3 Ų | 139.3 | 65% | 0.654 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -65.9 | -39.7 | -178.4 | -146.8 | 169.1 | -153.9 | 0 | 0 | 112.2 | M14 R20 N21 | M14-E18 PolarHBondContact O-N 3.16Å; M14-E18 VanDerWaalsContact O-N 3.13Å; E18-R20 VanDerWaalsContact C-N 3.27Å; E18-R20 PolarHBondContact O-N 3.49Å; E18-N21 PolarHBondContact O-N 3.26Å |
| 19 | V | 52.2 | Low | 52.8 | Low | 96 Ų | 96 | 139 Ų | 139 | 58% | 0.582 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -65.7 | -30.5 | 175.8 | 175.4 | 0 | 0 | 0 | 0 | 112 | Q15 V17 | Q15-V19 WeakPolarHBondContact O-CG2 3.47Å; Q15-V19 PolarHBondContact O-N 3.45Å; V17-V19 PolarHBondContact O-N 3.26Å |
| 20 | R | 44.5 | Very low | 50.1 | Low | 193 Ų | 193 | 140.5 Ų | 140.5 | 73% | 0.728 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -75.1 | -26.1 | -175.7 | -154.7 | -179.9 | -80 | 175.9 | -5.5 | 112.9 | I16 V17 E18 L22 | I16-R20 PolarHBondContact O-N 2.82Å; V17-R20 PolarHBondContact O-N 3.15Å; E18-R20 VanDerWaalsContact C-N 3.27Å; E18-R20 PolarHBondContact O-N 3.49Å; R20-L22 VanDerWaalsContact C-N 3.33Å; R20-L22 PolarHBondContact O-N 3.33Å |
| 21 | N | 45 | Very low | 47.4 | Very low | 132 Ų | 132 | 140.4 Ų | 140.4 | 71% | 0.706 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78 | -11.3 | 179.8 | -91.4 | -15.3 | 0 | 0 | 0 | 114.7 | E18 | E18-N21 PolarHBondContact O-N 3.26Š|
| 22 | L | 45.4 | Very low | 44.8 | Very low | 142 Ų | 142 | 143.2 Ų | 143.2 | 74% | 0.743 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -9.9 | -177.5 | -81.9 | 158.3 | 0 | 0 | 0 | 114.4 | R20 | R20-L22 VanDerWaalsContact C-N 3.33Å; R20-L22 PolarHBondContact O-N 3.33Å |
| 23 | N | 36.1 | Very low | 42.5 | Very low | 135 Ų | 135 | 140.9 Ų | 140.9 | 72% | 0.722 | 73% | 0.726 | S | S | * | * | trans | -102 | 12 | -170.1 | -67.8 | -15.2 | 0 | 0 | 0 | 114.7 | S25 | N23-S25 PolarHBondContact O-N 3.42Š| ||
| 24 | E | 27.7 | Very low | 40.1 | Very low | 183 Ų | 183 | 142.8 Ų | 142.8 | 86% | 0.855 | 74% | 0.738 | S | S | * | * | trans | -98.6 | 68 | -177.5 | -148.8 | 167.9 | -147.5 | 0 | 0 | 111.1 | ||||
| 25 | S | 31 | Very low | 38.2 | Very low | 103 Ų | 103 | 145.5 Ų | 145.5 | 72% | 0.72 | 75% | 0.749 | S | S | * | * | trans | -133.7 | 115.1 | 172.2 | 80.1 | 0 | 0 | 0 | 0 | 113.8 | N23 | N23-S25 PolarHBondContact O-N 3.42Š| ||
| 26 | K | 33.8 | Very low | 36.5 | Very low | 207 Ų | 207 | 144.5 Ų | 144.5 | 90% | 0.9 | 76% | 0.756 | S | S | * | * | trans | 56.2 | 95.1 | 151.6 | -72.8 | 177.3 | 175.8 | 175.7 | 0 | 118.9 | ||||
| 27 | K | 27.4 | Very low | 35.4 | Very low | 210 Ų | 210 | 146.2 Ų | 146.2 | 91% | 0.913 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 130.5 | 157.1 | -98.5 | 173.9 | 173.1 | 171.2 | 0 | 111.9 | ||
| 28 | P | 29.9 | Very low | 34 | Very low | 115 Ų | 115 | 152.2 Ų | 152.2 | 75% | 0.747 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -90.3 | 141.1 | 155 | 21.5 | -7.8 | 0 | 0 | 0 | 111 | ||
| 29 | S | 28 | Very low | 33.3 | Very low | 105 Ų | 105 | 154.7 Ų | 154.7 | 73% | 0.734 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -84.7 | 124 | 176.2 | 138.2 | 0 | 0 | 0 | 0 | 109.6 | ||
| 30 | T | 28.2 | Very low | 32.6 | Very low | 132 Ų | 132 | 156 Ų | 156 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | trans | -124.4 | 125.5 | 172.3 | 9.2 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 31 | N | 28.5 | Very low | 31.8 | Very low | 153 Ų | 153 | 151 Ų | 151 | 82% | 0.818 | 82% | 0.817 | S | S | * | * | trans | -75.7 | 141.4 | -173.5 | -69.8 | -55.9 | 0 | 0 | 0 | 112.2 | A33 | N31-A33 PolarHBondContact O-N 2.94Š| ||
| 32 | F | 28.6 | Very low | 31.2 | Very low | 213 Ų | 213 | 154.4 Ų | 154.4 | 93% | 0.934 | 82% | 0.82 | S | S | * | * | trans | -75.7 | 113.8 | 172.7 | -76.7 | -92.5 | 0 | 0 | 0 | 110.6 | ||||
| 33 | A | 31 | Very low | 30.7 | Very low | 100 Ų | 100 | 157.1 Ų | 157.1 | 83% | 0.826 | 83% | 0.829 | S | S | * | * | trans | -100.9 | 120.1 | 162.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | N31 | N31-A33 PolarHBondContact O-N 2.94Š| ||
| 34 | K | 26.4 | Very low | 30.9 | Very low | 207 Ų | 207 | 154.9 Ų | 154.9 | 90% | 0.9 | 82% | 0.823 | S | S | * | * | trans | -73.9 | 120.5 | 171.1 | -78.5 | 170.7 | 171.2 | 174.8 | 0 | 108.6 | ||||
| 35 | E | 27.4 | Very low | 31 | Very low | 198 Ų | 198 | 149.8 Ų | 149.8 | 93% | 0.925 | 82% | 0.82 | S | S | * | * | trans | -132.8 | 133.8 | 160.8 | -152.5 | 168.4 | -172.1 | 0 | 0 | 109.4 | ||||
| 36 | S | 28.2 | Very low | 31 | Very low | 106 Ų | 106 | 150.5 Ų | 150.5 | 74% | 0.741 | 82% | 0.815 | S | S | * | * | trans | -107.2 | 168.3 | -171.2 | -63.9 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 37 | P | 37.6 | Very low | 31.4 | Very low | 123 Ų | 123 | 145 Ų | 145 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | trans | -93 | 153.4 | -138.1 | 35.9 | -35.8 | 0 | 0 | 0 | 114.4 | ||||
| 38 | K | 33 | Very low | 31.9 | Very low | 203 Ų | 203 | 140 Ų | 140 | 88% | 0.883 | 78% | 0.784 | S | S | * | * | trans | -126.2 | 116.9 | 159.4 | -91.6 | 172.5 | 175.8 | 170.9 | 0 | 108.5 | D40 | K38-D40 PolarHBondContact O-N 3.34Š| ||
| 39 | E | 29.5 | Very low | 32.5 | Very low | 193 Ų | 193 | 141.5 Ų | 141.5 | 90% | 0.902 | 79% | 0.786 | S | S | * | * | trans | -70.7 | 115.3 | 167.6 | -66.3 | -166.1 | 158.4 | 0 | 0 | 108.8 | ||||
| 40 | D | 36.6 | Very low | 33 | Very low | 123 Ų | 123 | 141 Ų | 141 | 66% | 0.658 | 78% | 0.778 | S | S | * | * | trans | -120.1 | 108.7 | 162.1 | -92.6 | -37.3 | 0 | 0 | 0 | 107.3 | K38 R42 | K38-D40 PolarHBondContact O-N 3.34Å; D40-R42 PolarHBondContact O-N 2.91Å | ||
| 41 | G | 27.8 | Very low | 33.5 | Very low | 89 Ų | 89 | 141 Ų | 141 | 92% | 0.918 | 77% | 0.772 | S | S | * | * | trans | -70.6 | 59.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 42 | R | 32.2 | Very low | 34 | Very low | 202 Ų | 202 | 140 Ų | 140 | 76% | 0.762 | 77% | 0.767 | S | S | * | * | trans | -106.8 | 106.8 | 169 | -50.6 | -171.3 | -159.2 | -167.9 | 6.4 | 106.7 | D40 S44 | D40-R42 PolarHBondContact O-N 2.91Å; R42-S44 PolarHBondContact O-N 3.24Å | ||
| 43 | E | 35.9 | Very low | 34.5 | Very low | 200 Ų | 200 | 138.5 Ų | 138.5 | 94% | 0.935 | 76% | 0.763 | S | S | * | * | trans | -59.1 | 81.9 | 161.7 | -175.1 | 177.6 | -174.3 | 0 | 0 | 106.9 | G45 | E43-G45 PolarHBondContact O-N 2.99Š| ||
| 44 | S | 39.6 | Very low | 34.8 | Very low | 87 Ų | 87 | 139.6 Ų | 139.6 | 61% | 0.608 | 76% | 0.76 | S | S | * | * | trans | -68.6 | 103.7 | 175.5 | -174.5 | 0 | 0 | 0 | 0 | 105.3 | R42 I46 | R42-S44 PolarHBondContact O-N 3.24Å; S44-I46 PolarHBondContact O-N 3.48Å | ||
| 45 | G | 30.2 | Very low | 35.4 | Very low | 76 Ų | 76 | 135.1 Ų | 135.1 | 78% | 0.784 | 75% | 0.754 | S | S | * | * | trans | -55 | 92.7 | 167.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | E43 D47 | E43-G45 PolarHBondContact O-N 2.99Å; G45-D47 PolarHBondContact O-N 2.86Å | ||
| 46 | I | 32.2 | Very low | 35.8 | Very low | 119 Ų | 119 | 131.1 Ų | 131.1 | 61% | 0.61 | 74% | 0.744 | S | S | * | * | trans | -78 | 103.8 | 169.4 | -67.7 | 145.3 | 0 | 0 | 0 | 104 | S44 | S44-I46 PolarHBondContact O-N 3.48Š| ||
| 47 | D | 40.7 | Very low | 36.1 | Very low | 92 Ų | 92 | 130.1 Ų | 130.1 | 49% | 0.492 | 74% | 0.736 | S | S | . | * | trans | -50.3 | 121.3 | 167.7 | -170 | -15.6 | 0 | 0 | 0 | 107.9 | G45 D49 T50 | G45-D47 PolarHBondContact O-N 2.86Å; D47-D49 PolarHBondContact O-N 2.85Å; D47-D49 PolarHBondContact OD1-N 3.47Å; D47-T50 PolarHBondContact O-N 2.97Å; D47-T50 PolarHBondContact O-OG1 3.23Å; D47-T50 VanDerWaalsContact O-OG1 3.14Å | ||
| 48 | P | 38 | Very low | 36.2 | Very low | 103 Ų | 103 | 132.2 Ų | 132.2 | 67% | 0.669 | 74% | 0.738 | S | S | * | * | G | 310 helix | trans | -57.2 | -15.4 | -177.7 | 22.3 | -34 | 0 | 0 | 0 | 113.5 | T50 | P48-T50 VanDerWaalsContact C-N 3.25Å; P48-T50 PolarHBondContact O-N 3.17Å |
| 49 | D | 43.6 | Very low | 36.4 | Very low | 148 Ų | 148 | 130.1 Ų | 130.1 | 79% | 0.791 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -77.8 | -5 | 176.8 | -71.1 | -10 | 0 | 0 | 0 | 114 | D47 | D47-D49 PolarHBondContact O-N 2.85Å; D47-D49 PolarHBondContact OD1-N 3.47Å |
| 50 | T | 37.2 | Very low | 36.5 | Very low | 94 Ų | 94 | 123.5 Ų | 123.5 | 58% | 0.577 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -104.9 | 13.3 | -178.9 | -13.8 | 0 | 0 | 0 | 0 | 114.6 | D47 P48 D52 | D47-T50 PolarHBondContact O-N 2.97Å; D47-T50 PolarHBondContact O-OG1 3.23Å; D47-T50 VanDerWaalsContact O-OG1 3.14Å; P48-T50 VanDerWaalsContact C-N 3.25Å; P48-T50 PolarHBondContact O-N 3.17Å; T50-D52 PolarHBondContact O-N 3.33Å |
| 51 | L | 39.5 | Very low | 36.6 | Very low | 131 Ų | 131 | 123.6 Ų | 123.6 | 69% | 0.686 | 72% | 0.718 | S | S | * | * | trans | -78.4 | 67.2 | 168 | -66.4 | -178.4 | 0 | 0 | 0 | 109.8 | E53 | L51-E53 PolarHBondContact O-N 3.35Š| ||
| 52 | D | 37.9 | Very low | 37 | Very low | 134 Ų | 134 | 124.7 Ų | 124.7 | 72% | 0.717 | 71% | 0.712 | S | S | * | * | trans | -55.3 | 105 | 162.3 | -104.9 | -15.6 | 0 | 0 | 0 | 108 | T50 T54 | T50-D52 PolarHBondContact O-N 3.33Å; D52-T54 PolarHBondContact O-N 3.42Å; D52-T54 PolarHBondContact O-OG1 3.46Å | ||
| 53 | E | 40.5 | Very low | 37.3 | Very low | 181 Ų | 181 | 121.2 Ų | 121.2 | 85% | 0.846 | 71% | 0.708 | S | S | * | * | trans | 21.8 | 47.9 | 148.3 | -57.6 | -167.2 | 167 | 0 | 0 | 118.1 | L51 S55 | L51-E53 PolarHBondContact O-N 3.35Å; E53-S55 PolarHBondContact O-N 3.42Å | ||
| 54 | T | 37.6 | Very low | 37.6 | Very low | 123 Ų | 123 | 114.9 Ų | 114.9 | 76% | 0.755 | 69% | 0.686 | S | S | * | * | trans | -91.5 | 52.6 | 161.9 | 27.2 | 0 | 0 | 0 | 0 | 109.2 | D52 T56 | D52-T54 PolarHBondContact O-N 3.42Å; D52-T54 PolarHBondContact O-OG1 3.46Å; T54-T56 PolarHBondContact O-N 3.37Å | ||
| 55 | S | 37.8 | Very low | 37.5 | Very low | 112 Ų | 112 | 118.2 Ų | 118.2 | 78% | 0.783 | 70% | 0.696 | S | S | * | * | trans | -66.2 | 77.7 | 150.8 | -65.1 | 0 | 0 | 0 | 0 | 106.4 | E53 S57 | E53-S55 PolarHBondContact O-N 3.42Å; S55-S57 PolarHBondContact O-N 3.06Å | ||
| 56 | T | 35.8 | Very low | 38.1 | Very low | 115 Ų | 115 | 121 Ų | 121 | 71% | 0.706 | 69% | 0.693 | S | S | * | * | trans | -63.7 | 86.9 | 163.7 | 38.6 | 0 | 0 | 0 | 0 | 106.1 | T54 M58 | T54-T56 PolarHBondContact O-N 3.37Å; T56-M58 PolarHBondContact O-N 3.28Å | ||
| 57 | S | 34 | Very low | 38.4 | Very low | 84 Ų | 84 | 121.2 Ų | 121.2 | 59% | 0.587 | 70% | 0.695 | S | S | * | * | trans | -59.7 | 90.3 | 169.7 | -177 | 0 | 0 | 0 | 0 | 106.7 | S55 I59 | S55-S57 PolarHBondContact O-N 3.06Å; S57-I59 PolarHBondContact O-N 3.44Å; S57-I59 WeakPolarHBondContact OG-CB 3.25Å | ||
| 58 | M | 40.7 | Very low | 38.3 | Very low | 167 Ų | 167 | 123.9 Ų | 123.9 | 82% | 0.823 | 71% | 0.707 | S | S | * | * | trans | -72.9 | 20.8 | 166.4 | -65.8 | -136.7 | 89.1 | 0 | 0 | 111.3 | T56 G60 | T56-M58 PolarHBondContact O-N 3.28Å; M58-G60 PolarHBondContact O-N 3.33Å | ||
| 59 | I | 36.3 | Very low | 38.2 | Very low | 159 Ų | 159 | 128.3 Ų | 128.3 | 82% | 0.815 | 72% | 0.715 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.9 | 75.4 | 160.7 | -104.1 | 139.4 | 0 | 0 | 0 | 106.9 | S57 | S57-I59 PolarHBondContact O-N 3.44Å; S57-I59 WeakPolarHBondContact OG-CB 3.25Å |
| 60 | G | 33.3 | Very low | 37.8 | Very low | 54 Ų | 54 | 125.9 Ų | 125.9 | 56% | 0.557 | 71% | 0.709 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -169.1 | 0.7 | -172.9 | 0 | 0 | 0 | 0 | 0 | 117.4 | M58 | M58-G60 PolarHBondContact O-N 3.33Š|
| 61 | N | 37.6 | Very low | 37.7 | Very low | 125 Ų | 125 | 127.8 Ų | 127.8 | 67% | 0.668 | 72% | 0.72 | S | S | * | * | trans | -113.3 | 64 | 168.3 | -80.7 | 16.2 | 0 | 0 | 0 | 109.8 | L63 | N61-L63 HydrophobicContact CB-CG 4.44Å; N61-L63 PolarHBondContact O-N 3.23Å | ||
| 62 | S | 36.5 | Very low | 37.4 | Very low | 112 Ų | 112 | 127.8 Ų | 127.8 | 78% | 0.783 | 73% | 0.726 | S | S | * | * | trans | -64.5 | 79.4 | 145.1 | 53.6 | 0 | 0 | 0 | 0 | 106.4 | S64 | S62-S64 PolarHBondContact O-N 3.46Š| ||
| 63 | L | 39 | Very low | 37.2 | Very low | 130 Ų | 130 | 128.1 Ų | 128.1 | 68% | 0.681 | 73% | 0.728 | S | S | * | * | trans | -62.7 | 92.8 | 161.3 | -72.4 | 169.7 | 0 | 0 | 0 | 104.7 | N61 L65 | N61-L63 HydrophobicContact CB-CG 4.44Å; N61-L63 PolarHBondContact O-N 3.23Å; L63-L65 PolarHBondContact O-N 2.94Å | ||
| 64 | S | 41.2 | Very low | 36.8 | Very low | 67 Ų | 67 | 126.6 Ų | 126.6 | 47% | 0.469 | 73% | 0.726 | S | S | . | * | trans | -48.3 | 137.3 | 169.3 | -178.5 | 0 | 0 | 0 | 0 | 107.1 | S62 N66 D67 | S62-S64 PolarHBondContact O-N 3.46Å; S64-N66 PolarHBondContact O-N 3.18Å; S64-D67 PolarHBondContact O-N 3.35Å; S64-D67 VanDerWaalsContact O-N 3.14Å | ||
| 65 | L | 38.7 | Very low | 36.5 | Very low | 157 Ų | 157 | 129.3 Ų | 129.3 | 82% | 0.822 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.4 | -8.6 | -172.8 | -129.4 | 92 | 0 | 0 | 0 | 114.4 | L63 | L63-L65 PolarHBondContact O-N 2.94Š|
| 66 | N | 42.7 | Very low | 36.2 | Very low | 133 Ų | 133 | 129 Ų | 129 | 71% | 0.711 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.6 | -13.1 | -173.2 | -61.9 | -14.8 | 0 | 0 | 0 | 114.6 | S64 M68 | S64-N66 PolarHBondContact O-N 3.18Å; N66-M68 VanDerWaalsContact C-N 3.34Å; N66-M68 PolarHBondContact O-N 2.92Å |
| 67 | D | 37.9 | Very low | 36 | Very low | 124 Ų | 124 | 131.3 Ų | 131.3 | 66% | 0.663 | 74% | 0.74 | S | S | * | * | trans | -83.5 | -3.3 | -169.7 | -77.5 | -15.1 | 0 | 0 | 0 | 115.3 | S64 K69 | S64-D67 PolarHBondContact O-N 3.35Å; S64-D67 VanDerWaalsContact O-N 3.14Å; D67-K69 PolarHBondContact O-N 3.1Å | ||
| 68 | M | 38.5 | Very low | 36.2 | Very low | 148 Ų | 148 | 132.7 Ų | 132.7 | 73% | 0.729 | 75% | 0.745 | S | S | * | * | trans | -101.3 | 81.5 | 171.1 | -156.4 | 167.1 | -103.4 | 0 | 0 | 109.6 | N66 C70 | N66-M68 VanDerWaalsContact C-N 3.34Å; N66-M68 PolarHBondContact O-N 2.92Å; M68-C70 VanDerWaalsContact C-N 3.31Å; M68-C70 PolarHBondContact O-N 2.85Å | ||
| 69 | K | 35.2 | Very low | 36.1 | Very low | 197 Ų | 197 | 132 Ų | 132 | 86% | 0.857 | 75% | 0.751 | S | S | * | * | trans | -50.3 | 99.7 | 157.7 | -92.7 | 174.6 | 171.1 | 179.7 | 0 | 107.5 | D67 T71 | D67-K69 PolarHBondContact O-N 3.1Å; K69-T71 PolarHBondContact O-N 2.86Å; K69-T71 VanDerWaalsContact O-N 3.15Å | ||
| 70 | C | 36.9 | Very low | 36.4 | Very low | 97 Ų | 97 | 131.1 Ų | 131.1 | 66% | 0.655 | 74% | 0.743 | S | S | * | * | trans | -60.8 | 116.4 | 163.2 | -68 | 0 | 0 | 0 | 0 | 106.2 | M68 T72 | M68-C70 VanDerWaalsContact C-N 3.31Å; M68-C70 PolarHBondContact O-N 2.85Å; C70-T72 PolarHBondContact O-N 3.27Å | ||
| 71 | T | 33.1 | Very low | 37.2 | Very low | 133 Ų | 133 | 135.6 Ų | 135.6 | 82% | 0.816 | 76% | 0.759 | S | S | * | * | trans | -63.3 | 87.5 | 165.9 | 50.2 | 0 | 0 | 0 | 0 | 107.3 | K69 N73 | K69-T71 PolarHBondContact O-N 2.86Å; K69-T71 VanDerWaalsContact O-N 3.15Å; T71-N73 PolarHBondContact O-N 3.41Å | ||
| 72 | T | 34.4 | Very low | 38 | Very low | 132 Ų | 132 | 135.7 Ų | 135.7 | 81% | 0.81 | 76% | 0.76 | S | S | * | * | trans | -72.3 | 79.5 | 166 | 25.7 | 0 | 0 | 0 | 0 | 107.9 | C70 D74 | C70-T72 PolarHBondContact O-N 3.27Å; T72-D74 PolarHBondContact O-N 3.45Å | ||
| 73 | N | 33.9 | Very low | 39.3 | Very low | 141 Ų | 141 | 139.6 Ų | 139.6 | 75% | 0.754 | 76% | 0.763 | S | S | * | * | trans | -75.2 | 109.4 | 145.8 | -79.8 | 5 | 0 | 0 | 0 | 105 | T71 | T71-N73 PolarHBondContact O-N 3.41Š| ||
| 74 | D | 32.2 | Very low | 40.8 | Very low | 149 Ų | 149 | 136.3 Ų | 136.3 | 80% | 0.797 | 75% | 0.749 | S | S | * | * | trans | 153.7 | 89.1 | 143.1 | -71.4 | -15.2 | 0 | 0 | 0 | 109.8 | T72 S76 | T72-D74 PolarHBondContact O-N 3.45Å; D74-S76 PolarHBondContact O-N 2.9Å; D74-S76 VanDerWaalsContact O-N 3.17Å | ||
| 75 | L | 30.8 | Very low | 42.7 | Very low | 179 Ų | 179 | 136 Ų | 136 | 94% | 0.937 | 75% | 0.747 | S | S | * | * | trans | 3.9 | 93.5 | 138 | -157.7 | 75.1 | 0 | 0 | 0 | 116 | ||||
| 76 | S | 32.5 | Very low | 44.8 | Very low | 107 Ų | 107 | 133.6 Ų | 133.6 | 75% | 0.748 | 74% | 0.739 | S | S | * | * | trans | -173.1 | 134.9 | 139.3 | 46.2 | 0 | 0 | 0 | 0 | 110.8 | D74 T78 | D74-S76 PolarHBondContact O-N 2.9Å; D74-S76 VanDerWaalsContact O-N 3.17Å; S76-T78 PolarHBondContact O-N 3.3Å | ||
| 77 | N | 31.6 | Very low | 46.7 | Very low | 162 Ų | 162 | 132.5 Ų | 132.5 | 87% | 0.866 | 73% | 0.732 | S | S | * | * | trans | -73.1 | 109.3 | 179 | -56.7 | -47.5 | 0 | 0 | 0 | 109.5 | ||||
| 78 | T | 37.5 | Very low | 48.9 | Very low | 113 Ų | 113 | 128.9 Ų | 128.9 | 69% | 0.693 | 71% | 0.714 | S | S | * | * | trans | -158.1 | 128.1 | 142.6 | 43.9 | 0 | 0 | 0 | 0 | 109 | S76 E80 | S76-T78 PolarHBondContact O-N 3.3Å; T78-E80 PolarHBondContact O-N 2.9Å | ||
| 79 | T | 37.9 | Very low | 51.3 | Low | 152 Ų | 152 | 125.5 Ų | 125.5 | 93% | 0.933 | 70% | 0.698 | S | S | * | * | trans | -68.8 | 41.1 | 179.1 | 33.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 80 | E | 43.7 | Very low | 53.9 | Low | 142 Ų | 142 | 121.1 Ų | 121.1 | 66% | 0.664 | 68% | 0.684 | S | S | * | * | trans | -91.1 | 111.7 | 165.3 | -72.5 | -166.8 | 165.8 | 0 | 0 | 107.6 | T78 N82 | T78-E80 PolarHBondContact O-N 2.9Å; E80-N82 PolarHBondContact O-N 3.36Å | ||
| 81 | V | 49.8 | Very low | 56.4 | Low | 147 Ų | 147 | 123.4 Ų | 123.4 | 89% | 0.891 | 68% | 0.679 | S | S | * | * | trans | -58.4 | 84.1 | 163.6 | 178.2 | 0 | 0 | 0 | 0 | 105.8 | K83 | V81-K83 PolarHBondContact O-N 2.99Š| ||
| 82 | N | 53.6 | Low | 58.8 | Low | 127 Ų | 127 | 123.9 Ų | 123.9 | 68% | 0.679 | 67% | 0.666 | S | S | * | * | trans | -54.9 | 113.6 | -168.8 | -86.2 | -44.2 | 0 | 0 | 0 | 107.8 | E80 P84 | E80-N82 PolarHBondContact O-N 3.36Å; N82-P84 VanDerWaalsContact O-N 3.12Å | ||
| 83 | K | 64.2 | Low | 61.5 | Low | 194 Ų | 194 | 121.8 Ų | 121.8 | 84% | 0.843 | 65% | 0.649 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 125 | 167.4 | -88.6 | 173.5 | 177.2 | 170 | 0 | 106.1 | V81 S85 | V81-K83 PolarHBondContact O-N 2.99Å; K83-S85 PolarHBondContact O-N 3.49Å |
| 84 | P | 71 | Confident | 64.2 | Low | 61 Ų | 61 | 117.8 Ų | 117.8 | 40% | 0.396 | 64% | 0.635 | S | S | . | * | P | Polyproline II helix | trans | -54.8 | 130.8 | -179.3 | 20.6 | -30.2 | 0 | 0 | 0 | 107.8 | N82 T88 I89 | N82-P84 VanDerWaalsContact O-N 3.12Å; P84-T88 HydrophobicContact CB-CG2 4.32Å; P84-I89 HydrophobicContact CB-CG1 4.04Å; P84-I89 HydrophobicContact CG-CD1 4.09Å; P84-I89 HydrophobicContact CG-CG1 3.9Å; P84-I89 WeakPolarHBondContact O-CD1 3.47Å |
| 85 | S | 80.5 | Confident | 67.1 | Low | 61 Ų | 61 | 117.5 Ų | 117.5 | 43% | 0.427 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -56 | 150.4 | -178.9 | 92.6 | 0 | 0 | 0 | 0 | 109.4 | K83 I87 T88 I89 | K83-S85 PolarHBondContact O-N 3.49Å; S85-I87 PolarHBondContact O-N 3.34Å; S85-I87 VanDerWaalsContact O-N 3.08Å; S85-I87 PolarHBondContact OG-N 3.49Å; S85-T88 WeakPolarHBondContact O-CA 3.49Å; S85-T88 VanDerWaalsContact O-CB 3.32Å; S85-T88 WeakPolarHBondContact O-CB 3.33Å; S85-T88 PolarHBondContact O-N 2.98Å; S85-T88 PolarHBondContact OG-N 3.26Å; S85-T88 PolarHBondContact OG-OG1 3.3Å; S85-I89 PolarHBondContact O-N 3.48Å |
| 86 | V | 83.1 | Confident | 70 | Confident | 107 Ų | 107 | 116.2 Ų | 116.2 | 65% | 0.648 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -51 | -38.2 | 178.4 | 177.5 | 0 | 0 | 0 | 0 | 110.7 | T88 I89 L90 | V86-T88 PolarHBondContact O-N 2.9Å; V86-I89 PolarHBondContact O-N 3.15Å; V86-L90 HydrophobicContact CG1-CD1 3.99Å; V86-L90 HydrophobicContact CG1-CG 4.32Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 WeakPolarHBondContact O-CG 3.4Å; V86-L90 PolarHBondContact O-N 3.4Å |
| 87 | I | 81.8 | Confident | 72.9 | Confident | 109 Ų | 109 | 115.3 Ų | 115.3 | 56% | 0.559 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -61.6 | -43.1 | 176.4 | -57.6 | 171.8 | 0 | 0 | 0 | 111.1 | S85 L90 R91 | S85-I87 PolarHBondContact O-N 3.34Å; S85-I87 VanDerWaalsContact O-N 3.08Å; S85-I87 PolarHBondContact OG-N 3.49Å; I87-L90 PolarHBondContact O-N 3.41Å; I87-R91 VanDerWaalsContact O-CB 3.28Å; I87-R91 WeakPolarHBondContact O-CB 3.33Å; I87-R91 PolarHBondContact O-N 3.36Å |
| 88 | T | 85.5 | Confident | 75.9 | Confident | 49 Ų | 49 | 110.3 Ų | 110.3 | 30% | 0.301 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -64.3 | -42 | 176.3 | -52.6 | 0 | 0 | 0 | 0 | 111.6 | P84 S85 V86 R91 R92 | P84-T88 HydrophobicContact CB-CG2 4.32Å; S85-T88 WeakPolarHBondContact O-CA 3.49Å; S85-T88 VanDerWaalsContact O-CB 3.32Å; S85-T88 WeakPolarHBondContact O-CB 3.33Å; S85-T88 PolarHBondContact O-N 2.98Å; S85-T88 PolarHBondContact OG-N 3.26Å; S85-T88 PolarHBondContact OG-OG1 3.3Å; V86-T88 PolarHBondContact O-N 2.9Å; T88-R91 PolarHBondContact O-N 3.07Å; T88-R92 WeakPolarHBondContact O-CG 3.25Å; T88-R92 PolarHBondContact O-N 3.47Å |
| 89 | I | 87.7 | Confident | 78.4 | Confident | 76 Ų | 76 | 110.7 Ų | 110.7 | 39% | 0.39 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -63.8 | -47.8 | 177.4 | -62.1 | 171.7 | 0 | 0 | 0 | 110.4 | P84 S85 V86 R91 R92 L93 | P84-I89 HydrophobicContact CB-CG1 4.04Å; P84-I89 HydrophobicContact CG-CD1 4.09Å; P84-I89 HydrophobicContact CG-CG1 3.9Å; P84-I89 WeakPolarHBondContact O-CD1 3.47Å; S85-I89 PolarHBondContact O-N 3.48Å; V86-I89 PolarHBondContact O-N 3.15Å; I89-R91 VanDerWaalsContact C-N 3.34Å; I89-R91 PolarHBondContact O-N 2.72Å; I89-R92 WeakPolarHBondContact O-CB 3.25Å; I89-R92 PolarHBondContact O-N 3.45Å; I89-L93 HydrophobicContact CG2-CD1 3.96Å; I89-L93 PolarHBondContact O-N 3.49Å |
| 90 | L | 89.8 | Confident | 81.1 | Confident | 105 Ų | 105 | 110.3 Ų | 110.3 | 55% | 0.55 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.1 | -41.9 | 177.4 | -72.5 | 173.6 | 0 | 0 | 0 | 111.8 | V86 I87 R92 L93 A94 | V86-L90 HydrophobicContact CG1-CD1 3.99Å; V86-L90 HydrophobicContact CG1-CG 4.32Å; V86-L90 WeakPolarHBondContact O-CB 3.49Å; V86-L90 WeakPolarHBondContact O-CG 3.4Å; V86-L90 PolarHBondContact O-N 3.4Å; I87-L90 PolarHBondContact O-N 3.41Å; L90-R92 VanDerWaalsContact C-N 3.34Å; L90-R92 PolarHBondContact O-N 3.13Å; L90-L93 PolarHBondContact O-N 3.18Å; L90-A94 WeakPolarHBondContact O-CB 3.49Å; L90-A94 PolarHBondContact O-N 3.14Å |
| 91 | R | 89.3 | Confident | 83.5 | Confident | 146 Ų | 146 | 107.8 Ų | 107.8 | 55% | 0.551 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -64.5 | -38 | 176.5 | -165.2 | 179 | -68.5 | 150.4 | -1.9 | 111.8 | I87 T88 I89 R95 | I87-R91 VanDerWaalsContact O-CB 3.28Å; I87-R91 WeakPolarHBondContact O-CB 3.33Å; I87-R91 PolarHBondContact O-N 3.36Å; T88-R91 PolarHBondContact O-N 3.07Å; I89-R91 VanDerWaalsContact C-N 3.34Å; I89-R91 PolarHBondContact O-N 2.72Å; R91-R95 WeakPolarHBondContact O-CG 3.48Å; R91-R95 PolarHBondContact O-N 2.88Å; R91-R95 VanDerWaalsContact O-N 3.15Å |
| 92 | R | 83.4 | Confident | 85.5 | Confident | 143 Ų | 143 | 103.6 Ų | 103.6 | 54% | 0.54 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.5 | -45.9 | 173.3 | -76.4 | 178.9 | 178 | -177.1 | -0.4 | 111.6 | T88 I89 L90 R95 Y96 | T88-R92 WeakPolarHBondContact O-CG 3.25Å; T88-R92 PolarHBondContact O-N 3.47Å; I89-R92 WeakPolarHBondContact O-CB 3.25Å; I89-R92 PolarHBondContact O-N 3.45Å; L90-R92 VanDerWaalsContact C-N 3.34Å; L90-R92 PolarHBondContact O-N 3.13Å; R92-R95 PolarHBondContact O-N 3.39Å; R92-Y96 PolarHBondContact O-N 3.26Å |
| 93 | L | 91.7 | Very high | 87.3 | Confident | 87 Ų | 87 | 102.5 Ų | 102.5 | 46% | 0.455 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.8 | -46.8 | 175.9 | -91.2 | 157.3 | 0 | 0 | 0 | 112 | I89 L90 R95 Y96 L97 | I89-L93 HydrophobicContact CG2-CD1 3.96Å; I89-L93 PolarHBondContact O-N 3.49Å; L90-L93 PolarHBondContact O-N 3.18Å; L93-R95 VanDerWaalsContact C-N 3.33Å; L93-R95 PolarHBondContact O-N 3.26Å; L93-Y96 PolarHBondContact O-N 3.33Å; L93-L97 WeakPolarHBondContact O-CB 3.36Å; L93-L97 WeakPolarHBondContact O-CG 3.32Å; L93-L97 PolarHBondContact O-N 3.48Å |
| 94 | A | 91.6 | Very high | 88.9 | Confident | 57 Ų | 57 | 99.9 Ų | 99.9 | 47% | 0.471 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60 | -43.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L90 L97 A98 | L90-A94 WeakPolarHBondContact O-CB 3.49Å; L90-A94 PolarHBondContact O-N 3.14Å; A94-L97 PolarHBondContact O-N 3.44Å; A94-A98 WeakPolarHBondContact O-CB 3.37Å; A94-A98 PolarHBondContact O-N 3.27Å |
| 95 | R | 91.6 | Very high | 89.9 | Confident | 144 Ų | 144 | 105.8 Ų | 105.8 | 54% | 0.543 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -62.2 | -46 | 173.9 | -72.3 | 177.9 | -175.2 | -157.8 | 1.3 | 111.5 | R91 R92 L93 L97 A98 L99 | R91-R95 WeakPolarHBondContact O-CG 3.48Å; R91-R95 PolarHBondContact O-N 2.88Å; R91-R95 VanDerWaalsContact O-N 3.15Å; R92-R95 PolarHBondContact O-N 3.39Å; L93-R95 VanDerWaalsContact C-N 3.33Å; L93-R95 PolarHBondContact O-N 3.26Å; R95-L97 PolarHBondContact O-N 3.44Å; R95-A98 PolarHBondContact O-N 3.48Å; R95-L99 WeakPolarHBondContact O-CD1 3.43Å; R95-L99 PolarHBondContact O-N 3.05Å |
| 96 | Y | 93.1 | Very high | 90.6 | Very high | 151 Ų | 151 | 108.8 Ų | 108.8 | 59% | 0.592 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.8 | -43.7 | 178.2 | -176.4 | -101.5 | 0 | 0 | 0 | 112.3 | R92 L93 L99 R100 | R92-Y96 PolarHBondContact O-N 3.26Å; L93-Y96 PolarHBondContact O-N 3.33Å; Y96-L99 PolarHBondContact O-N 2.96Å; Y96-R100 WeakPolarHBondContact O-CB 3.47Å; Y96-R100 PolarHBondContact O-N 2.96Å |
| 97 | L | 93.2 | Very high | 91 | Very high | 89 Ų | 89 | 106.8 Ų | 106.8 | 47% | 0.466 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63 | -43.5 | 175.5 | -71.2 | 173.7 | 0 | 0 | 0 | 111.6 | L93 A94 R95 L99 R100 I101 | L93-L97 WeakPolarHBondContact O-CB 3.36Å; L93-L97 WeakPolarHBondContact O-CG 3.32Å; L93-L97 PolarHBondContact O-N 3.48Å; A94-L97 PolarHBondContact O-N 3.44Å; R95-L97 PolarHBondContact O-N 3.44Å; L97-L99 PolarHBondContact O-N 3.43Å; L97-R100 PolarHBondContact O-N 3.46Å; L97-I101 WeakPolarHBondContact O-CB 3.46Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 2.97Å |
| 98 | A | 93.8 | Very high | 91.5 | Very high | 56 Ų | 56 | 106.5 Ų | 106.5 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60 | -46.3 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | A94 R95 R100 I101 A102 | A94-A98 WeakPolarHBondContact O-CB 3.37Å; A94-A98 PolarHBondContact O-N 3.27Å; R95-A98 PolarHBondContact O-N 3.48Å; A98-R100 VanDerWaalsContact C-N 3.35Å; A98-R100 PolarHBondContact O-N 3.23Å; A98-I101 PolarHBondContact O-N 3Å; A98-A102 WeakPolarHBondContact O-CB 3.39Å; A98-A102 PolarHBondContact O-N 3.25Å |
| 99 | L | 91.1 | Very high | 91.8 | Very high | 121 Ų | 121 | 106.9 Ų | 106.9 | 63% | 0.634 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -60.8 | -43.9 | 174.6 | -89.7 | 84.2 | 0 | 0 | 0 | 111.5 | R95 Y96 L97 I101 A102 N103 | R95-L99 WeakPolarHBondContact O-CD1 3.43Å; R95-L99 PolarHBondContact O-N 3.05Å; Y96-L99 PolarHBondContact O-N 2.96Å; L97-L99 PolarHBondContact O-N 3.43Å; L99-I101 PolarHBondContact O-N 2.83Å; L99-A102 PolarHBondContact O-N 3.08Å; L99-N103 WeakPolarHBondContact O-CB 3.49Å; L99-N103 PolarHBondContact O-N 3.31Å |
| 100 | R | 94.1 | Very high | 91.9 | Very high | 144 Ų | 144 | 105.5 Ų | 105.5 | 54% | 0.543 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.1 | -40.9 | 179.5 | -163.9 | 177.6 | -160.5 | -164.8 | 5.7 | 111.9 | Y96 L97 A98 K104 | Y96-R100 WeakPolarHBondContact O-CB 3.47Å; Y96-R100 PolarHBondContact O-N 2.96Å; L97-R100 PolarHBondContact O-N 3.46Å; A98-R100 VanDerWaalsContact C-N 3.35Å; A98-R100 PolarHBondContact O-N 3.23Å; R100-K104 WeakPolarHBondContact O-CB 3.47Å; R100-K104 WeakPolarHBondContact O-CG 3.33Å; R100-K104 PolarHBondContact O-N 3.42Å |
| 101 | I | 92.7 | Very high | 92 | Very high | 90 Ų | 90 | 102.7 Ų | 102.7 | 46% | 0.462 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.9 | -44.5 | 176.3 | -69.8 | 165 | 0 | 0 | 0 | 110.3 | L97 A98 L99 N103 K104 R105 | L97-I101 WeakPolarHBondContact O-CB 3.46Å; L97-I101 VanDerWaalsContact O-CG1 3.23Å; L97-I101 WeakPolarHBondContact O-CG1 3.35Å; L97-I101 PolarHBondContact O-N 2.97Å; A98-I101 PolarHBondContact O-N 3Å; L99-I101 PolarHBondContact O-N 2.83Å; I101-N103 PolarHBondContact O-N 3.43Å; I101-K104 PolarHBondContact O-N 2.88Å; I101-R105 HydrophobicContact CG2-CG 4.48Å; I101-R105 WeakPolarHBondContact O-CG 3.41Å; I101-R105 PolarHBondContact O-N 3.26Å |
| 102 | A | 92.9 | Very high | 92.1 | Very high | 59 Ų | 59 | 100.4 Ų | 100.4 | 49% | 0.488 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.3 | -46 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A98 L99 K104 R105 H106 | A98-A102 WeakPolarHBondContact O-CB 3.39Å; A98-A102 PolarHBondContact O-N 3.25Å; L99-A102 PolarHBondContact O-N 3.08Å; A102-K104 PolarHBondContact O-N 3.44Å; A102-R105 PolarHBondContact O-N 3.29Å; A102-H106 PolarHBondContact O-N 3.02Å |
| 103 | N | 92 | Very high | 92.5 | Very high | 103 Ų | 103 | 99.8 Ų | 99.8 | 55% | 0.551 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -62.7 | -44.1 | 177.5 | -164.2 | 7.9 | 0 | 0 | 0 | 111.4 | L99 I101 R105 H106 S107 | L99-N103 WeakPolarHBondContact O-CB 3.49Å; L99-N103 PolarHBondContact O-N 3.31Å; I101-N103 PolarHBondContact O-N 3.43Å; N103-R105 VanDerWaalsContact C-N 3.34Å; N103-R105 PolarHBondContact O-N 3.41Å; N103-H106 WeakPolarHBondContact O-CB 3.33Å; N103-H106 PolarHBondContact O-N 3.08Å; N103-S107 PolarHBondContact O-N 3.08Å; N103-S107 PolarHBondContact O-OG 3.39Å |
| 104 | K | 96.1 | Very high | 92.4 | Very high | 140 Ų | 140 | 100.8 Ų | 100.8 | 61% | 0.609 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.7 | -40.5 | 174.7 | -77.9 | -169.1 | 173.7 | -156.6 | 0 | 113 | R100 I101 A102 H106 S107 L108 | R100-K104 WeakPolarHBondContact O-CB 3.47Å; R100-K104 WeakPolarHBondContact O-CG 3.33Å; R100-K104 PolarHBondContact O-N 3.42Å; I101-K104 PolarHBondContact O-N 2.88Å; A102-K104 PolarHBondContact O-N 3.44Å; K104-H106 VanDerWaalsContact C-N 3.34Å; K104-S107 PolarHBondContact O-N 2.92Å; K104-L108 WeakPolarHBondContact O-CB 3.46Å; K104-L108 PolarHBondContact O-N 3.12Å |
| 105 | R | 93.6 | Very high | 92.3 | Very high | 184 Ų | 184 | 102.5 Ų | 102.5 | 69% | 0.694 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 175.6 | -76.5 | 179.7 | 174.6 | -179.2 | -1.9 | 111.5 | I101 A102 N103 L108 A109 | I101-R105 HydrophobicContact CG2-CG 4.48Å; I101-R105 WeakPolarHBondContact O-CG 3.41Å; I101-R105 PolarHBondContact O-N 3.26Å; A102-R105 PolarHBondContact O-N 3.29Å; N103-R105 VanDerWaalsContact C-N 3.34Å; N103-R105 PolarHBondContact O-N 3.41Å; R105-L108 PolarHBondContact O-N 2.89Å; R105-A109 WeakPolarHBondContact O-CB 3.43Å; R105-A109 PolarHBondContact O-N 3.49Å |
| 106 | H | 93.5 | Very high | 92.1 | Very high | 124 Ų | 124 | 98.2 Ų | 98.2 | 57% | 0.574 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.8 | -50.4 | 175.2 | -179.3 | 64.8 | 0 | 0 | 0 | 111.7 | A102 N103 K104 L108 A109 T110 | A102-H106 PolarHBondContact O-N 3.02Å; N103-H106 WeakPolarHBondContact O-CB 3.33Å; N103-H106 PolarHBondContact O-N 3.08Å; K104-H106 VanDerWaalsContact C-N 3.34Å; H106-L108 VanDerWaalsContact C-N 3.28Å; H106-L108 PolarHBondContact O-N 3.27Å; H106-A109 WeakPolarHBondContact O-CB 3.5Å; H106-A109 PolarHBondContact O-N 3.36Å; H106-A109 VanDerWaalsContact O-N 3.09Å; H106-T110 PolarHBondContact O-N 2.99Å; H106-T110 PolarHBondContact O-OG1 3.42Å |
| 107 | S | 92.6 | Very high | 91.9 | Very high | 66 Ų | 66 | 99.2 Ų | 99.2 | 46% | 0.462 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -58.9 | -38.7 | 176.8 | -54.8 | 0 | 0 | 0 | 0 | 112.7 | N103 K104 T110 A111 | N103-S107 PolarHBondContact O-N 3.08Å; N103-S107 PolarHBondContact O-OG 3.39Å; K104-S107 PolarHBondContact O-N 2.92Å; S107-T110 PolarHBondContact O-N 3.23Å; S107-A111 WeakPolarHBondContact O-CB 3.5Å; S107-A111 PolarHBondContact O-N 3.44Å |
| 108 | L | 92.1 | Very high | 91.6 | Very high | 103 Ų | 103 | 99.5 Ų | 99.5 | 54% | 0.539 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.7 | -41.5 | 175.6 | -179.5 | 62 | 0 | 0 | 0 | 111.8 | K104 R105 H106 A111 N112 | K104-L108 WeakPolarHBondContact O-CB 3.46Å; K104-L108 PolarHBondContact O-N 3.12Å; R105-L108 PolarHBondContact O-N 2.89Å; H106-L108 VanDerWaalsContact C-N 3.28Å; H106-L108 PolarHBondContact O-N 3.27Å; L108-A111 PolarHBondContact O-N 3.03Å; L108-N112 WeakPolarHBondContact O-CB 3.35Å; L108-N112 PolarHBondContact O-N 3.04Å |
| 109 | A | 91.5 | Very high | 91.4 | Very high | 56 Ų | 56 | 99 Ų | 99 | 46% | 0.463 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | R105 H106 A111 N112 Q113 | R105-A109 WeakPolarHBondContact O-CB 3.43Å; R105-A109 PolarHBondContact O-N 3.49Å; H106-A109 WeakPolarHBondContact O-CB 3.5Å; H106-A109 PolarHBondContact O-N 3.36Å; H106-A109 VanDerWaalsContact O-N 3.09Å; A109-A111 PolarHBondContact O-N 2.98Å; A109-N112 PolarHBondContact O-N 3.37Å; A109-Q113 PolarHBondContact O-N 3.36Å |
| 110 | T | 90.7 | Very high | 91.3 | Very high | 47 Ų | 47 | 98.9 Ų | 98.9 | 29% | 0.288 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.9 | -45.7 | 174.7 | -52.7 | 0 | 0 | 0 | 0 | 111.5 | H106 S107 N112 Q113 H114 | H106-T110 PolarHBondContact O-N 2.99Å; H106-T110 PolarHBondContact O-OG1 3.42Å; S107-T110 PolarHBondContact O-N 3.23Å; T110-N112 VanDerWaalsContact C-N 3.35Å; T110-N112 PolarHBondContact O-N 3.41Å; T110-Q113 WeakPolarHBondContact O-CB 3.26Å; T110-Q113 PolarHBondContact O-N 2.96Å; T110-H114 PolarHBondContact O-CD2 3.36Å; T110-H114 PolarHBondContact O-N 2.97Å |
| 111 | A | 91.7 | Very high | 90.8 | Very high | 47 Ų | 47 | 96.5 Ų | 96.5 | 39% | 0.388 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -60.2 | -43.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | S107 L108 A109 Q113 H114 V115 | S107-A111 WeakPolarHBondContact O-CB 3.5Å; S107-A111 PolarHBondContact O-N 3.44Å; L108-A111 PolarHBondContact O-N 3.03Å; A109-A111 PolarHBondContact O-N 2.98Å; A111-Q113 VanDerWaalsContact C-N 3.33Å; A111-Q113 PolarHBondContact O-N 3.44Å; A111-H114 PolarHBondContact O-N 3.37Å; A111-V115 WeakPolarHBondContact O-CG2 3.38Å; A111-V115 PolarHBondContact O-N 2.92Å |
| 112 | N | 91.1 | Very high | 90.3 | Very high | 97 Ų | 97 | 96.1 Ų | 96.1 | 52% | 0.519 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.4 | -36.4 | 176.1 | -74.6 | -16.3 | 0 | 0 | 0 | 112.4 | L108 A109 T110 V115 A116 | L108-N112 WeakPolarHBondContact O-CB 3.35Å; L108-N112 PolarHBondContact O-N 3.04Å; A109-N112 PolarHBondContact O-N 3.37Å; T110-N112 VanDerWaalsContact C-N 3.35Å; T110-N112 PolarHBondContact O-N 3.41Å; N112-V115 PolarHBondContact O-N 3.29Å; N112-A116 WeakPolarHBondContact O-CB 3.48Å; N112-A116 PolarHBondContact O-N 2.91Å |
| 113 | Q | 92 | Very high | 90.1 | Very high | 131 Ų | 131 | 100.8 Ų | 100.8 | 61% | 0.612 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -63.7 | -42.1 | 173.7 | -173.4 | -178.9 | 0.4 | 0 | 0 | 111.5 | A109 T110 A111 A116 R117 | A109-Q113 PolarHBondContact O-N 3.36Å; T110-Q113 WeakPolarHBondContact O-CB 3.26Å; T110-Q113 PolarHBondContact O-N 2.96Å; A111-Q113 VanDerWaalsContact C-N 3.33Å; A111-Q113 PolarHBondContact O-N 3.44Å; Q113-A116 PolarHBondContact O-N 2.95Å; Q113-R117 WeakPolarHBondContact O-CB 3.47Å; Q113-R117 PolarHBondContact O-N 3.21Å |
| 114 | H | 90.1 | Very high | 89.9 | Confident | 108 Ų | 108 | 100.5 Ų | 100.5 | 50% | 0.5 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -62.6 | -41.5 | 173.6 | -72.4 | -67.3 | 0 | 0 | 0 | 112.3 | T110 A111 R117 N118 | T110-H114 PolarHBondContact O-CD2 3.36Å; T110-H114 PolarHBondContact O-N 2.97Å; A111-H114 PolarHBondContact O-N 3.37Å; H114-R117 PolarHBondContact O-N 2.93Å; H114-N118 WeakPolarHBondContact O-CB 3.41Å; H114-N118 PolarHBondContact O-N 3.47Å; H114-N118 PolarHBondContact O-OD1 3.47Å |
| 115 | V | 88.6 | Confident | 89.5 | Confident | 93 Ų | 93 | 98.9 Ų | 98.9 | 56% | 0.564 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.9 | -44 | 175.4 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | A111 N112 N118 A119 | A111-V115 WeakPolarHBondContact O-CG2 3.38Å; A111-V115 PolarHBondContact O-N 2.92Å; N112-V115 PolarHBondContact O-N 3.29Å; V115-N118 PolarHBondContact O-N 3.36Å; V115-A119 WeakPolarHBondContact O-CB 3.39Å; V115-A119 PolarHBondContact O-N 3.04Å |
| 116 | A | 88.3 | Confident | 88.9 | Confident | 53 Ų | 53 | 96 Ų | 96 | 44% | 0.438 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63 | -43.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112 | N112 Q113 A119 I120 | N112-A116 WeakPolarHBondContact O-CB 3.48Å; N112-A116 PolarHBondContact O-N 2.91Å; Q113-A116 PolarHBondContact O-N 2.95Å; A116-A119 PolarHBondContact O-N 3.39Å; A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 3.32Å |
| 117 | R | 88.5 | Confident | 88.3 | Confident | 173 Ų | 173 | 92.7 Ų | 92.7 | 65% | 0.653 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -60 | -48.7 | 174.4 | -179.5 | 178.8 | 173.8 | 153.4 | 2 | 111.4 | Q113 H114 A119 I120 E121 | Q113-R117 WeakPolarHBondContact O-CB 3.47Å; Q113-R117 PolarHBondContact O-N 3.21Å; H114-R117 PolarHBondContact O-N 2.93Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.85Å; R117-I120 PolarHBondContact O-N 3.08Å; R117-I120 VanDerWaalsContact O-N 3.12Å; R117-E121 WeakPolarHBondContact O-CB 3.33Å; R117-E121 PolarHBondContact O-N 3.37Å |
| 118 | N | 85.6 | Confident | 87.9 | Confident | 95 Ų | 95 | 96.5 Ų | 96.5 | 51% | 0.508 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.8 | -36.3 | 178.9 | -70.5 | 4.2 | 0 | 0 | 0 | 111.6 | H114 V115 E121 E122 | H114-N118 WeakPolarHBondContact O-CB 3.41Å; H114-N118 PolarHBondContact O-N 3.47Å; H114-N118 PolarHBondContact O-OD1 3.47Å; V115-N118 PolarHBondContact O-N 3.36Å; N118-E121 PolarHBondContact O-N 2.78Å; N118-E122 VanDerWaalsContact O-CB 3.32Å; N118-E122 WeakPolarHBondContact O-CB 3.36Å; N118-E122 PolarHBondContact O-N 2.86Å |
| 119 | A | 89.7 | Confident | 87.1 | Confident | 44 Ų | 44 | 97.1 Ų | 97.1 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -67.5 | -35.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V115 A116 R117 K123 | V115-A119 WeakPolarHBondContact O-CB 3.39Å; V115-A119 PolarHBondContact O-N 3.04Å; A116-A119 PolarHBondContact O-N 3.39Å; R117-A119 VanDerWaalsContact C-N 3.27Å; R117-A119 PolarHBondContact O-N 2.85Å; A119-K123 WeakPolarHBondContact O-CG 3.48Å; A119-K123 PolarHBondContact O-N 3.2Å; A119-K123 VanDerWaalsContact O-N 3.14Å |
| 120 | I | 89.3 | Confident | 86.3 | Confident | 120 Ų | 120 | 97.4 Ų | 97.4 | 62% | 0.615 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -69 | -45.6 | 173.5 | -67.4 | 162 | 0 | 0 | 0 | 110.2 | A116 R117 E122 K123 L124 | A116-I120 WeakPolarHBondContact O-CG1 3.34Å; A116-I120 PolarHBondContact O-N 3.32Å; R117-I120 PolarHBondContact O-N 3.08Å; R117-I120 VanDerWaalsContact O-N 3.12Å; I120-E122 VanDerWaalsContact C-N 3.32Å; I120-E122 PolarHBondContact O-N 2.95Å; I120-K123 PolarHBondContact O-N 3.19Å; I120-L124 PolarHBondContact O-N 2.92Å |
| 121 | E | 84.5 | Confident | 85.4 | Confident | 93 Ų | 93 | 99.5 Ų | 99.5 | 44% | 0.435 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.4 | -41.3 | 177.1 | -171.9 | 172.8 | 179.7 | 0 | 0 | 111.3 | R117 N118 K123 L124 L125 | R117-E121 WeakPolarHBondContact O-CB 3.33Å; R117-E121 PolarHBondContact O-N 3.37Å; N118-E121 PolarHBondContact O-N 2.78Å; E121-K123 PolarHBondContact O-N 2.86Å; E121-L124 WeakPolarHBondContact O-CB 3.28Å; E121-L124 PolarHBondContact O-N 3.3Å; E121-L125 HydrophobicContact CG-CD1 4.18Å; E121-L125 HydrophobicContact CG-CG 4.46Å; E121-L125 WeakPolarHBondContact O-CB 3.31Å; E121-L125 VanDerWaalsContact O-CG 3.26Å; E121-L125 WeakPolarHBondContact O-CG 3.45Å; E121-L125 PolarHBondContact O-N 3.31Å |
| 122 | E | 81.3 | Confident | 84 | Confident | 82 Ų | 82 | 102 Ų | 102 | 38% | 0.383 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -59.1 | -47 | 173.3 | -171.8 | -167.8 | 160.5 | 0 | 0 | 111.5 | N118 I120 L124 L125 R126 | N118-E122 VanDerWaalsContact O-CB 3.32Å; N118-E122 WeakPolarHBondContact O-CB 3.36Å; N118-E122 PolarHBondContact O-N 2.86Å; I120-E122 VanDerWaalsContact C-N 3.32Å; I120-E122 PolarHBondContact O-N 2.95Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 3.5Å; E122-L125 PolarHBondContact O-N 3.38Å; E122-R126 WeakPolarHBondContact O-CB 3.26Å; E122-R126 WeakPolarHBondContact O-CG 3.33Å; E122-R126 PolarHBondContact O-N 3.18Å; E122-R126 IonicContact OE1-CZ 3.96Å; E122-R126 VanDerWaalsContact OE1-CZ 3.25Å; E122-R126 IonicContact OE1-NE 3.7Å; E122-R126 PolarHBondContact OE1-NE 3.35Å; E122-R126 IonicContact OE1-NH2 3.37Å; E122-R126 PolarHBondContact OE1-NH2 3.46Å |
| 123 | K | 88.7 | Confident | 82.4 | Confident | 158 Ų | 158 | 102.9 Ų | 102.9 | 69% | 0.687 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.8 | -41.8 | 176.4 | -75.6 | 178 | 179.8 | -177.5 | 0 | 111.8 | A119 I120 E121 R126 S127 | A119-K123 WeakPolarHBondContact O-CG 3.48Å; A119-K123 PolarHBondContact O-N 3.2Å; A119-K123 VanDerWaalsContact O-N 3.14Å; I120-K123 PolarHBondContact O-N 3.19Å; E121-K123 PolarHBondContact O-N 2.86Å; K123-R126 PolarHBondContact O-N 3.15Å; K123-S127 WeakPolarHBondContact O-CB 3.42Å; K123-S127 PolarHBondContact O-N 3.43Å |
| 124 | L | 88.4 | Confident | 80.6 | Confident | 96 Ų | 96 | 102.3 Ų | 102.3 | 50% | 0.503 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.3 | -47.1 | 177.1 | 179.4 | 65.1 | 0 | 0 | 0 | 111.2 | I120 E121 E122 R126 S127 R128 | I120-L124 PolarHBondContact O-N 2.92Å; E121-L124 WeakPolarHBondContact O-CB 3.28Å; E121-L124 PolarHBondContact O-N 3.3Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 3.5Å; L124-R126 VanDerWaalsContact C-N 3.34Å; L124-R126 PolarHBondContact O-N 2.83Å; L124-S127 WeakPolarHBondContact O-CB 3.33Å; L124-S127 PolarHBondContact O-N 3.47Å; L124-R128 HydrophobicContact CD1-CG 4.37Å; L124-R128 WeakPolarHBondContact O-CG 3.44Å; L124-R128 PolarHBondContact O-N 2.87Å |
| 125 | L | 87.2 | Confident | 78.7 | Confident | 106 Ų | 106 | 101.4 Ų | 101.4 | 56% | 0.555 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.6 | -41.3 | 178.4 | -70.6 | 172.8 | 0 | 0 | 0 | 111.4 | E121 E122 R128 L129 | E121-L125 HydrophobicContact CG-CD1 4.18Å; E121-L125 HydrophobicContact CG-CG 4.46Å; E121-L125 WeakPolarHBondContact O-CB 3.31Å; E121-L125 VanDerWaalsContact O-CG 3.26Å; E121-L125 WeakPolarHBondContact O-CG 3.45Å; E121-L125 PolarHBondContact O-N 3.31Å; E122-L125 PolarHBondContact O-N 3.38Å; L125-R128 PolarHBondContact O-N 3.02Å; L125-L129 VanDerWaalsContact O-CB 3.25Å; L125-L129 WeakPolarHBondContact O-CB 3.08Å; L125-L129 PolarHBondContact O-N 2.83Å |
| 126 | R | 81.1 | Confident | 76.7 | Confident | 125 Ų | 125 | 104.4 Ų | 104.4 | 47% | 0.472 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.8 | -40.9 | 173.6 | -72.1 | -179.8 | -175.8 | -87.5 | 2.2 | 111.9 | E122 K123 L124 L129 S130 | E122-R126 WeakPolarHBondContact O-CB 3.26Å; E122-R126 WeakPolarHBondContact O-CG 3.33Å; E122-R126 PolarHBondContact O-N 3.18Å; E122-R126 IonicContact OE1-CZ 3.96Å; E122-R126 VanDerWaalsContact OE1-CZ 3.25Å; E122-R126 IonicContact OE1-NE 3.7Å; E122-R126 PolarHBondContact OE1-NE 3.35Å; E122-R126 IonicContact OE1-NH2 3.37Å; E122-R126 PolarHBondContact OE1-NH2 3.46Å; K123-R126 PolarHBondContact O-N 3.15Å; L124-R126 VanDerWaalsContact C-N 3.34Å; L124-R126 PolarHBondContact O-N 2.83Å; R126-L129 PolarHBondContact O-N 3.42Å; R126-S130 WeakPolarHBondContact O-CB 3.39Å; R126-S130 PolarHBondContact O-N 2.9Å |
| 127 | S | 81.1 | Confident | 74.7 | Confident | 53 Ų | 53 | 110 Ų | 110 | 37% | 0.371 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -61.6 | -51.2 | 174.7 | -166.8 | 0 | 0 | 0 | 0 | 111.4 | K123 L124 L129 S130 E131 | K123-S127 WeakPolarHBondContact O-CB 3.42Å; K123-S127 PolarHBondContact O-N 3.43Å; L124-S127 WeakPolarHBondContact O-CB 3.33Å; L124-S127 PolarHBondContact O-N 3.47Å; S127-L129 VanDerWaalsContact C-N 3.31Å; S127-L129 PolarHBondContact O-N 2.89Å; S127-S130 CarbonylContact O-C 3.58Å; S127-S130 WeakPolarHBondContact O-CA 3.45Å; S127-S130 WeakPolarHBondContact O-CB 3.38Å; S127-S130 PolarHBondContact O-N 3.31Å; S127-S130 PolarHBondContact O-OG 3.47Å; S127-E131 PolarHBondContact O-N 3.24Å |
| 128 | R | 83.8 | Confident | 72.6 | Confident | 146 Ų | 146 | 110.9 Ų | 110.9 | 55% | 0.551 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -61.5 | -39.6 | 178.8 | -68.9 | -62.6 | -168.9 | 156 | 4 | 112.3 | L124 L125 S130 E131 L132 | L124-R128 HydrophobicContact CD1-CG 4.37Å; L124-R128 WeakPolarHBondContact O-CG 3.44Å; L124-R128 PolarHBondContact O-N 2.87Å; L125-R128 PolarHBondContact O-N 3.02Å; R128-S130 VanDerWaalsContact C-N 3.29Å; R128-S130 PolarHBondContact O-N 2.94Å; R128-E131 IonicContact NH1-OE2 3.23Å; R128-E131 PolarHBondContact O-N 3.39Å; R128-L132 WeakPolarHBondContact O-CG 3.35Å; R128-L132 PolarHBondContact O-N 3.44Å |
| 129 | L | 75.6 | Confident | 70.5 | Confident | 117 Ų | 117 | 113.1 Ų | 113.1 | 61% | 0.613 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -64.3 | -37.1 | 175 | -171.6 | 63.7 | 0 | 0 | 0 | 111.3 | L125 R126 S127 N133 | L125-L129 VanDerWaalsContact O-CB 3.25Å; L125-L129 WeakPolarHBondContact O-CB 3.08Å; L125-L129 PolarHBondContact O-N 2.83Å; R126-L129 PolarHBondContact O-N 3.42Å; S127-L129 VanDerWaalsContact C-N 3.31Å; S127-L129 PolarHBondContact O-N 2.89Å; L129-N133 PolarHBondContact O-N 2.97Å; L129-N133 VanDerWaalsContact O-N 3.12Å |
| 130 | S | 75.3 | Confident | 68.2 | Low | 61 Ų | 61 | 119.3 Ų | 119.3 | 43% | 0.427 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -71.1 | -33 | 175.2 | 75.7 | 0 | 0 | 0 | 0 | 113.6 | R126 S127 R128 N133 | R126-S130 WeakPolarHBondContact O-CB 3.39Å; R126-S130 PolarHBondContact O-N 2.9Å; S127-S130 CarbonylContact O-C 3.58Å; S127-S130 WeakPolarHBondContact O-CA 3.45Å; S127-S130 WeakPolarHBondContact O-CB 3.38Å; S127-S130 PolarHBondContact O-N 3.31Å; S127-S130 PolarHBondContact O-OG 3.47Å; R128-S130 VanDerWaalsContact C-N 3.29Å; R128-S130 PolarHBondContact O-N 2.94Å; S130-N133 WeakPolarHBondContact O-CB 3.34Å; S130-N133 PolarHBondContact O-N 2.98Å |
| 131 | E | 72.2 | Confident | 65.8 | Low | 91 Ų | 91 | 121.1 Ų | 121.1 | 43% | 0.425 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.5 | -47.1 | 173.1 | -75.3 | 165.5 | -150.2 | 0 | 0 | 111.2 | S127 R128 N133 I134 D135 | S127-E131 PolarHBondContact O-N 3.24Å; R128-E131 IonicContact NH1-OE2 3.23Å; R128-E131 PolarHBondContact O-N 3.39Å; E131-N133 PolarHBondContact O-N 3.24Å; E131-I134 PolarHBondContact O-N 3.44Å; E131-D135 PolarHBondContact O-N 3.01Å; E131-D135 VanDerWaalsContact O-N 3.13Å |
| 132 | L | 61 | Low | 63.6 | Low | 101 Ų | 101 | 124.2 Ų | 124.2 | 53% | 0.529 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -61.1 | -30.3 | 175.9 | -70.9 | 173.3 | 0 | 0 | 0 | 112.2 | R128 I134 | R128-L132 WeakPolarHBondContact O-CG 3.35Å; R128-L132 PolarHBondContact O-N 3.44Å; L132-I134 PolarHBondContact O-N 3.03Å |
| 133 | N | 59.2 | Low | 61.5 | Low | 114 Ų | 114 | 127.2 Ų | 127.2 | 61% | 0.61 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -66.2 | -23.9 | 175 | -170.9 | 48.9 | 0 | 0 | 0 | 113.1 | L129 S130 E131 | L129-N133 PolarHBondContact O-N 2.97Å; L129-N133 VanDerWaalsContact O-N 3.12Å; S130-N133 WeakPolarHBondContact O-CB 3.34Å; S130-N133 PolarHBondContact O-N 2.98Å; E131-N133 PolarHBondContact O-N 3.24Å |
| 134 | I | 53.6 | Low | 59.2 | Low | 119 Ų | 119 | 125.2 Ų | 125.2 | 61% | 0.61 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -90.6 | -39.7 | 178.3 | -58 | 165.5 | 0 | 0 | 0 | 110.6 | E131 L132 Y136 H137 | E131-I134 PolarHBondContact O-N 3.44Å; L132-I134 PolarHBondContact O-N 3.03Å; I134-Y136 VanDerWaalsContact C-N 3.3Å; I134-Y136 PolarHBondContact O-N 3.4Å; I134-H137 PolarHBondContact O-N 2.91Å; I134-H137 VanDerWaalsContact O-N 3.16Å |
| 135 | D | 48.8 | Very low | 57 | Low | 90 Ų | 90 | 128.8 Ų | 128.8 | 48% | 0.481 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -70.4 | -25 | -168 | -149 | 24.5 | 0 | 0 | 0 | 113.7 | E131 H137 Y138 H139 | E131-D135 PolarHBondContact O-N 3.01Å; E131-D135 VanDerWaalsContact O-N 3.13Å; D135-H137 PolarHBondContact O-N 3.21Å; D135-H137 VanDerWaalsContact O-N 3.17Å; D135-Y138 PolarHBondContact O-N 3.39Å; D135-H139 PolarHBondContact O-N 3.3Å; D135-H139 IonicContact OD1-CD2 3.52Å; D135-H139 PolarHBondContact OD1-CD2 3.09Å; D135-H139 IonicContact OD1-NE2 3.97Å |
| 136 | Y | 47.2 | Very low | 54.7 | Low | 155 Ų | 155 | 131.4 Ų | 131.4 | 61% | 0.608 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -15.9 | 175 | -94.9 | -84 | 0 | 0 | 0 | 114.1 | I134 | I134-Y136 VanDerWaalsContact C-N 3.3Å; I134-Y136 PolarHBondContact O-N 3.4Å |
| 137 | H | 47.7 | Very low | 52.9 | Low | 171 Ų | 171 | 127.9 Ų | 127.9 | 79% | 0.792 | 62% | 0.62 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85 | -10.3 | 178.1 | -133 | 68.7 | 0 | 0 | 0 | 114.2 | I134 D135 | I134-H137 PolarHBondContact O-N 2.91Å; I134-H137 VanDerWaalsContact O-N 3.16Å; D135-H137 PolarHBondContact O-N 3.21Å; D135-H137 VanDerWaalsContact O-N 3.17Å |
| 138 | Y | 43.9 | Very low | 50.9 | Low | 192 Ų | 192 | 129.3 Ų | 129.3 | 75% | 0.753 | 62% | 0.624 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.9 | -15.6 | -177.5 | -83.8 | -82.3 | 0 | 0 | 0 | 115.7 | D135 | D135-Y138 PolarHBondContact O-N 3.39Š|
| 139 | H | 41.8 | Very low | 48.8 | Very low | 141 Ų | 141 | 126.9 Ų | 126.9 | 65% | 0.653 | 63% | 0.629 | S | S | * | * | trans | -114.5 | 54.1 | -176.7 | -69.9 | -58.7 | 0 | 0 | 0 | 113.6 | D135 H141 | D135-H139 PolarHBondContact O-N 3.3Å; D135-H139 IonicContact OD1-CD2 3.52Å; D135-H139 PolarHBondContact OD1-CD2 3.09Å; D135-H139 IonicContact OD1-NE2 3.97Å; H139-H141 VanDerWaalsContact C-N 3.3Å; H139-H141 PolarHBondContact O-N 3.3Å | ||
| 140 | H | 39.8 | Very low | 47 | Very low | 174 Ų | 174 | 130.2 Ų | 130.2 | 81% | 0.806 | 63% | 0.634 | S | S | * | * | trans | -84.6 | 74.2 | 163.8 | -135.8 | 48.5 | 0 | 0 | 0 | 108.8 | ||||
| 141 | H | 39.8 | Very low | 45.2 | Very low | 159 Ų | 159 | 129.9 Ų | 129.9 | 74% | 0.736 | 63% | 0.627 | S | S | * | * | S | Bend | trans | 176.4 | 124.7 | 155.5 | -94.3 | -58.8 | 0 | 0 | 0 | 109.5 | H139 | H139-H141 VanDerWaalsContact C-N 3.3Å; H139-H141 PolarHBondContact O-N 3.3Å |
| 142 | H | 38.4 | Very low | 43.8 | Very low | 158 Ų | 158 | 130.5 Ų | 130.5 | 73% | 0.731 | 64% | 0.642 | S | S | * | * | S | Bend | trans | 84.9 | 79.9 | 169.4 | -46.1 | -65.3 | 0 | 0 | 0 | 117.1 | ||
| 143 | N | 37.8 | Very low | 42.6 | Very low | 145 Ų | 145 | 130.9 Ų | 130.9 | 78% | 0.775 | 64% | 0.639 | S | S | * | * | trans | -175.9 | 61.5 | 136.9 | -87.7 | -25.8 | 0 | 0 | 0 | 111.3 | H145 | N143-H145 VanDerWaalsContact C-N 3.32Å; N143-H145 PolarHBondContact O-N 3.06Å; N143-H145 VanDerWaalsContact O-N 3.13Å | ||
| 144 | D | 39.2 | Very low | 41.7 | Very low | 115 Ų | 115 | 129.2 Ų | 129.2 | 62% | 0.615 | 63% | 0.63 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.3 | 29 | -169.3 | -66.5 | -41.5 | 0 | 0 | 0 | 116.3 | N148 | D144-N148 PolarHBondContact O-ND2 3.44Š|
| 145 | H | 43.2 | Very low | 41 | Very low | 172 Ų | 172 | 129 Ų | 129 | 80% | 0.796 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.5 | -23.9 | -178.1 | -117.1 | -59.4 | 0 | 0 | 0 | 117 | N143 | N143-H145 VanDerWaalsContact C-N 3.32Å; N143-H145 PolarHBondContact O-N 3.06Å; N143-H145 VanDerWaalsContact O-N 3.13Å |
| 146 | L | 38.8 | Very low | 40.6 | Very low | 160 Ų | 160 | 132.5 Ų | 132.5 | 84% | 0.838 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.3 | -22.9 | 172 | -78.4 | 169.9 | 0 | 0 | 0 | 113 | N148 | L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 3.04Å |
| 147 | V | 42.8 | Very low | 40.4 | Very low | 51 Ų | 51 | 133.6 Ų | 133.6 | 31% | 0.309 | 67% | 0.666 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -81 | -11.9 | -177.8 | -165.6 | 0 | 0 | 0 | 0 | 111.9 | S149 W150 N151 | V147-S149 PolarHBondContact O-N 3.17Å; V147-S149 VanDerWaalsContact O-N 3.16Å; V147-W150 HydrophobicContact CG1-CB 4.36Å; V147-W150 CarbonylContact O-C 3.44Å; V147-W150 WeakPolarHBondContact O-CA 3.48Å; V147-W150 PolarHBondContact O-N 2.97Å; V147-N151 PolarHBondContact O-N 2.79Å |
| 148 | N | 39.5 | Very low | 40.5 | Very low | 83 Ų | 83 | 128.1 Ų | 128.1 | 44% | 0.444 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -63.7 | -25.9 | 179.7 | -70.4 | -17.1 | 0 | 0 | 0 | 114.1 | D144 L146 W150 N151 | D144-N148 PolarHBondContact O-ND2 3.44Å; L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 3.04Å; N148-W150 VanDerWaalsContact C-N 3.26Å; N148-W150 PolarHBondContact O-N 3.01Å; N148-N151 PolarHBondContact OD1-ND2 3.21Å |
| 149 | S | 40.3 | Very low | 40.7 | Very low | 95 Ų | 95 | 124 Ų | 124 | 66% | 0.664 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.8 | -25.2 | 171.8 | -167.9 | 0 | 0 | 0 | 0 | 112.6 | V147 | V147-S149 PolarHBondContact O-N 3.17Å; V147-S149 VanDerWaalsContact O-N 3.16Å |
| 150 | W | 36.3 | Very low | 41 | Very low | 187 Ų | 187 | 123.1 Ų | 123.1 | 71% | 0.708 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -95.1 | -24.9 | 176.5 | -71 | 78.4 | 0 | 0 | 0 | 112 | V147 N148 S152 F153 | V147-W150 HydrophobicContact CG1-CB 4.36Å; V147-W150 CarbonylContact O-C 3.44Å; V147-W150 WeakPolarHBondContact O-CA 3.48Å; V147-W150 PolarHBondContact O-N 2.97Å; N148-W150 VanDerWaalsContact C-N 3.26Å; N148-W150 PolarHBondContact O-N 3.01Å; W150-S152 PolarHBondContact O-N 3.41Å; W150-F153 WeakPolarHBondContact O-CA 3.39Å; W150-F153 VanDerWaalsContact O-CB 3.23Å; W150-F153 WeakPolarHBondContact O-CB 3.35Å; W150-F153 PolarHBondContact O-N 2.93Å |
| 151 | N | 39 | Very low | 41.7 | Very low | 54 Ų | 54 | 116.7 Ų | 116.7 | 29% | 0.289 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -68 | -18.9 | 176.2 | -73 | -26.7 | 0 | 0 | 0 | 112.7 | V147 N148 F153 N154 | V147-N151 PolarHBondContact O-N 2.79Å; N148-N151 PolarHBondContact OD1-ND2 3.21Å; N151-F153 PolarHBondContact O-N 3.45Å; N151-N154 WeakPolarHBondContact O-CB 3.45Å; N151-N154 PolarHBondContact O-N 3.25Å; N151-N154 PolarHBondContact OD1-ND2 3.46Å |
| 152 | S | 41.1 | Very low | 42.9 | Very low | 104 Ų | 104 | 111.8 Ų | 111.8 | 73% | 0.727 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.1 | -19 | 167.2 | -156.7 | 0 | 0 | 0 | 0 | 112.2 | W150 | W150-S152 PolarHBondContact O-N 3.41Å |
| 153 | F | 35.9 | Very low | 44.2 | Very low | 109 Ų | 109 | 108.8 Ų | 108.8 | 48% | 0.478 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -85.1 | -19.8 | 167.7 | -67.2 | -89.2 | 0 | 0 | 0 | 113.1 | W150 N151 S155 M156 H300 | W150-F153 WeakPolarHBondContact O-CA 3.39Å; W150-F153 VanDerWaalsContact O-CB 3.23Å; W150-F153 WeakPolarHBondContact O-CB 3.35Å; W150-F153 PolarHBondContact O-N 2.93Å; N151-F153 PolarHBondContact O-N 3.45Å; F153-S155 VanDerWaalsContact C-N 3.26Å; F153-S155 PolarHBondContact O-N 2.84Å; F153-M156 PolarHBondContact O-N 2.93Å; F153-H300 AromaticContact CE1-CD2 3.93Å; F153-H300 AromaticContact CE1-NE2 3.28Å; F153-H300 VanDerWaalsContact CE1-NE2 3.28Å; F153-H300 WeakPolarHBondContact CE1-NE2 3.38Å; F153-H300 AromaticContact CZ-NE2 3.84Å |
| 154 | N | 41.4 | Very low | 45.7 | Very low | 79 Ų | 79 | 105.5 Ų | 105.5 | 42% | 0.422 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -76.3 | -8.1 | -177.4 | -75.2 | -9.3 | 0 | 0 | 0 | 114.3 | N151 M156 I158 | N151-N154 WeakPolarHBondContact O-CB 3.45Å; N151-N154 PolarHBondContact O-N 3.25Å; N151-N154 PolarHBondContact OD1-ND2 3.46Å; N154-M156 PolarHBondContact O-N 2.85Å; N154-I158 WeakPolarHBondContact OD1-CD1 3.41Å |
| 155 | S | 38.1 | Very low | 47.3 | Very low | 115 Ų | 115 | 104.7 Ų | 104.7 | 80% | 0.804 | 56% | 0.555 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.9 | -13.8 | 170.3 | -176.5 | 0 | 0 | 0 | 0 | 112.8 | F153 | F153-S155 VanDerWaalsContact C-N 3.26Å; F153-S155 PolarHBondContact O-N 2.84Å |
| 156 | M | 41.7 | Very low | 48.8 | Very low | 163 Ų | 163 | 104.2 Ų | 104.2 | 80% | 0.803 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -119.4 | 99.9 | 174.4 | -156.7 | 159.6 | -148.6 | 0 | 0 | 107 | F153 N154 I158 | F153-M156 PolarHBondContact O-N 2.93Å; N154-M156 PolarHBondContact O-N 2.85Å; M156-I158 PolarHBondContact O-N 3.01Å |
| 157 | E | 41.6 | Very low | 50.6 | Low | 178 Ų | 178 | 102.2 Ų | 102.2 | 83% | 0.832 | 53% | 0.531 | S | S | * | . | trans | -3.5 | 98.1 | 163.6 | -114.9 | 172.3 | -179.8 | 0 | 0 | 111.6 | N159 | E157-N159 PolarHBondContact O-N 3.21Š| ||
| 158 | I | 50.1 | Low | 52.2 | Low | 57 Ų | 57 | 102.5 Ų | 102.5 | 29% | 0.292 | 53% | 0.531 | S | S | . | . | trans | -65.7 | 91.2 | 175.7 | -64 | 170.5 | 0 | 0 | 0 | 105.7 | N154 M156 Y160 I163 | N154-I158 WeakPolarHBondContact OD1-CD1 3.41Å; M156-I158 PolarHBondContact O-N 3.01Å; I158-Y160 HydrophobicContact CB-CD2 4.37Å; I158-Y160 HydrophobicContact CB-CE2 4.01Å; I158-Y160 HydrophobicContact CG2-CD1 3.71Å; I158-Y160 HydrophobicContact CG2-CD2 3.92Å; I158-Y160 HydrophobicContact CG2-CE1 3.63Å; I158-Y160 HydrophobicContact CG2-CE2 3.84Å; I158-Y160 HydrophobicContact CG2-CG 3.85Å; I158-Y160 WeakPolarHBondContact O-CD2 3.39Å; I158-Y160 PolarHBondContact O-N 3.43Å; I158-I163 HydrophobicContact CG2-CD1 3.53Å; I158-I163 HydrophobicContact CG2-CG1 4.47Å | ||
| 159 | N | 48.4 | Very low | 54 | Low | 106 Ų | 106 | 107.4 Ų | 107.4 | 57% | 0.567 | 54% | 0.543 | S | S | * | . | trans | -75.2 | 86.4 | 174 | -156.5 | -41.7 | 0 | 0 | 0 | 104.4 | E157 G161 T162 | E157-N159 PolarHBondContact O-N 3.21Å; N159-G161 PolarHBondContact O-N 3.33Å; N159-G161 VanDerWaalsContact O-N 3.09Å; N159-T162 VanDerWaalsContact O-CA 3.31Å; N159-T162 WeakPolarHBondContact O-CA 3.44Å; N159-T162 WeakPolarHBondContact O-CB 3.36Å; N159-T162 PolarHBondContact O-N 3.34Å; N159-T162 PolarHBondContact O-OG1 2.93Å | ||
| 160 | Y | 48.1 | Very low | 56.1 | Low | 122 Ų | 122 | 107.3 Ų | 107.3 | 48% | 0.478 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -54.4 | -29.1 | -174.3 | -71.5 | -85.2 | 0 | 0 | 0 | 112.3 | I158 T162 I163 V164 | I158-Y160 HydrophobicContact CB-CD2 4.37Å; I158-Y160 HydrophobicContact CB-CE2 4.01Å; I158-Y160 HydrophobicContact CG2-CD1 3.71Å; I158-Y160 HydrophobicContact CG2-CD2 3.92Å; I158-Y160 HydrophobicContact CG2-CE1 3.63Å; I158-Y160 HydrophobicContact CG2-CE2 3.84Å; I158-Y160 HydrophobicContact CG2-CG 3.85Å; I158-Y160 WeakPolarHBondContact O-CD2 3.39Å; I158-Y160 PolarHBondContact O-N 3.43Å; Y160-T162 PolarHBondContact O-N 2.88Å; Y160-I163 HydrophobicContact CD1-CD1 4.46Å; Y160-I163 PolarHBondContact O-N 3.5Å; Y160-V164 PolarHBondContact O-N 3.42Å; Y160-V164 VanDerWaalsContact O-N 3.08Å |
| 161 | G | 55.3 | Low | 58.3 | Low | 38 Ų | 38 | 101.9 Ų | 101.9 | 39% | 0.392 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -56 | -31.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 113 | N159 N165 | N159-G161 PolarHBondContact O-N 3.33Å; N159-G161 VanDerWaalsContact O-N 3.09Å; G161-N165 WeakPolarHBondContact O-CB 3.39Å; G161-N165 PolarHBondContact O-N 3.04Å; G161-N165 VanDerWaalsContact O-N 3.08Å; G161-N165 PolarHBondContact O-ND2 3.2Å |
| 162 | T | 64.3 | Low | 60.5 | Low | 57 Ų | 57 | 104 Ų | 104 | 35% | 0.35 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -73.1 | -37.4 | 174.4 | -51.9 | 0 | 0 | 0 | 0 | 112.4 | N159 Y160 R166 | N159-T162 VanDerWaalsContact O-CA 3.31Å; N159-T162 WeakPolarHBondContact O-CA 3.44Å; N159-T162 WeakPolarHBondContact O-CB 3.36Å; N159-T162 PolarHBondContact O-N 3.34Å; N159-T162 PolarHBondContact O-OG1 2.93Å; Y160-T162 PolarHBondContact O-N 2.88Å; T162-R166 HydrophobicContact CG2-CG 4.47Å; T162-R166 WeakPolarHBondContact O-CB 3.37Å; T162-R166 WeakPolarHBondContact O-CG 3.39Å; T162-R166 PolarHBondContact O-N 2.82Å |
| 163 | I | 64.8 | Low | 62.7 | Low | 95 Ų | 95 | 103.6 Ų | 103.6 | 49% | 0.487 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69 | -46.8 | 178.8 | -63.6 | 175.6 | 0 | 0 | 0 | 110.2 | I158 Y160 N165 R166 F167 | I158-I163 HydrophobicContact CG2-CD1 3.53Å; I158-I163 HydrophobicContact CG2-CG1 4.47Å; Y160-I163 HydrophobicContact CD1-CD1 4.46Å; Y160-I163 PolarHBondContact O-N 3.5Å; I163-N165 VanDerWaalsContact C-N 3.33Å; I163-N165 PolarHBondContact O-N 2.96Å; I163-R166 WeakPolarHBondContact O-CB 3.47Å; I163-R166 PolarHBondContact O-N 2.92Å; I163-R166 VanDerWaalsContact O-N 3.1Å; I163-F167 PolarHBondContact O-N 3.46Å |
| 164 | V | 69.8 | Low | 65.3 | Low | 75 Ų | 75 | 101.6 Ų | 101.6 | 46% | 0.455 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60 | -45.8 | 176.1 | 179.4 | 0 | 0 | 0 | 0 | 110.1 | Y160 R166 F167 D168 | Y160-V164 PolarHBondContact O-N 3.42Å; Y160-V164 VanDerWaalsContact O-N 3.08Å; V164-R166 VanDerWaalsContact C-N 3.29Å; V164-R166 PolarHBondContact O-N 3.36Å; V164-F167 PolarHBondContact O-N 3.36Å; V164-F167 VanDerWaalsContact O-N 3.15Å; V164-D168 PolarHBondContact O-N 3.02Å |
| 165 | N | 72.9 | Confident | 67.5 | Low | 98 Ų | 98 | 101 Ų | 101 | 52% | 0.524 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61.2 | -34.7 | 175 | -75.7 | -22.8 | 0 | 0 | 0 | 113.3 | G161 I163 R169 | G161-N165 WeakPolarHBondContact O-CB 3.39Å; G161-N165 PolarHBondContact O-N 3.04Å; G161-N165 VanDerWaalsContact O-N 3.08Å; G161-N165 PolarHBondContact O-ND2 3.2Å; I163-N165 VanDerWaalsContact C-N 3.33Å; I163-N165 PolarHBondContact O-N 2.96Å; N165-R169 WeakPolarHBondContact O-CB 3.27Å; N165-R169 VanDerWaalsContact O-CG 3.26Å; N165-R169 WeakPolarHBondContact O-CG 3.47Å; N165-R169 PolarHBondContact O-N 3.32Å |
| 166 | R | 75.6 | Confident | 69.9 | Low | 162 Ų | 162 | 97.9 Ų | 97.9 | 61% | 0.611 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.8 | -42.7 | 174.5 | -77.1 | 173.8 | -171.1 | -160 | 7.6 | 111.3 | T162 I163 V164 R169 L170 | T162-R166 HydrophobicContact CG2-CG 4.47Å; T162-R166 WeakPolarHBondContact O-CB 3.37Å; T162-R166 WeakPolarHBondContact O-CG 3.39Å; T162-R166 PolarHBondContact O-N 2.82Å; I163-R166 WeakPolarHBondContact O-CB 3.47Å; I163-R166 PolarHBondContact O-N 2.92Å; I163-R166 VanDerWaalsContact O-N 3.1Å; V164-R166 VanDerWaalsContact C-N 3.29Å; V164-R166 PolarHBondContact O-N 3.36Å; R166-R169 PolarHBondContact O-N 3.42Å; R166-L170 WeakPolarHBondContact O-CB 3.5Å; R166-L170 PolarHBondContact O-N 3.37Å |
| 167 | F | 75.7 | Confident | 72.2 | Confident | 118 Ų | 118 | 93 Ų | 93 | 52% | 0.518 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.4 | -47.1 | 176.5 | -177.9 | -94.5 | 0 | 0 | 0 | 111.3 | I163 V164 R169 L170 H171 | I163-F167 PolarHBondContact O-N 3.46Å; V164-F167 PolarHBondContact O-N 3.36Å; V164-F167 VanDerWaalsContact O-N 3.15Å; F167-R169 VanDerWaalsContact C-N 3.33Å; F167-R169 PolarHBondContact O-N 3.48Å; F167-L170 PolarHBondContact O-N 2.94Å; F167-H171 WeakPolarHBondContact O-CB 3.41Å; F167-H171 PolarHBondContact O-N 2.95Å |
| 168 | D | 77.3 | Confident | 74.4 | Confident | 57 Ų | 57 | 89.1 Ų | 89.1 | 31% | 0.305 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.9 | -39.9 | 178.2 | -74.2 | -19.5 | 0 | 0 | 0 | 111.7 | V164 H171 N172 | V164-D168 PolarHBondContact O-N 3.02Å; D168-H171 PolarHBondContact O-N 3.21Å; D168-N172 WeakPolarHBondContact O-CB 3.23Å; D168-N172 VanDerWaalsContact O-CG 3.25Å; D168-N172 PolarHBondContact O-N 2.95Å; D168-N172 PolarHBondContact O-ND2 3.45Å; D168-N172 VanDerWaalsContact O-ND2 3.13Å |
| 169 | R | 77.3 | Confident | 76.4 | Confident | 186 Ų | 186 | 92.6 Ų | 92.6 | 70% | 0.702 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -61.7 | -46.6 | 172.4 | -80.3 | 179.2 | -178.8 | -158.4 | 1.5 | 112 | N165 R166 F167 H171 N172 N173 | N165-R169 WeakPolarHBondContact O-CB 3.27Å; N165-R169 VanDerWaalsContact O-CG 3.26Å; N165-R169 WeakPolarHBondContact O-CG 3.47Å; N165-R169 PolarHBondContact O-N 3.32Å; R166-R169 PolarHBondContact O-N 3.42Å; F167-R169 VanDerWaalsContact C-N 3.33Å; F167-R169 PolarHBondContact O-N 3.48Å; R169-H171 VanDerWaalsContact C-N 3.34Å; R169-N172 PolarHBondContact O-N 3.01Å; R169-N173 WeakPolarHBondContact O-CB 3.43Å; R169-N173 PolarHBondContact O-N 3.02Å; R169-N173 PolarHBondContact O-ND2 3.39Å |
| 170 | L | 82.7 | Confident | 78.4 | Confident | 93 Ų | 93 | 91.7 Ų | 91.7 | 49% | 0.487 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -61.9 | -43.5 | 178.3 | -178.7 | 68.5 | 0 | 0 | 0 | 111.3 | R166 F167 N173 T174 | R166-L170 WeakPolarHBondContact O-CB 3.5Å; R166-L170 PolarHBondContact O-N 3.37Å; F167-L170 PolarHBondContact O-N 2.94Å; L170-N173 PolarHBondContact O-N 2.93Å; L170-T174 WeakPolarHBondContact O-CB 3.33Å; L170-T174 PolarHBondContact O-N 3.5Å; L170-T174 PolarHBondContact O-OG1 3.47Å |
| 171 | H | 83.3 | Confident | 80.4 | Confident | 73 Ų | 73 | 90.8 Ų | 90.8 | 34% | 0.338 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -62.5 | -49.6 | 178.2 | -178.4 | 71.6 | 0 | 0 | 0 | 111.5 | F167 D168 R169 N173 T174 I175 | F167-H171 WeakPolarHBondContact O-CB 3.41Å; F167-H171 PolarHBondContact O-N 2.95Å; D168-H171 PolarHBondContact O-N 3.21Å; R169-H171 VanDerWaalsContact C-N 3.34Å; H171-N173 VanDerWaalsContact C-N 3.33Å; H171-N173 PolarHBondContact O-N 3.41Å; H171-T174 WeakPolarHBondContact O-CB 3.43Å; H171-T174 PolarHBondContact O-N 3.16Å; H171-T174 VanDerWaalsContact O-N 3.08Å; H171-I175 VanDerWaalsContact NE2-CD1 3.32Å; H171-I175 WeakPolarHBondContact NE2-CD1 3.33Å; H171-I175 WeakPolarHBondContact O-CG1 3.45Å; H171-I175 PolarHBondContact O-N 2.84Å |
| 172 | N | 85.8 | Confident | 82.1 | Confident | 99 Ų | 99 | 92 Ų | 92 | 53% | 0.529 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.7 | -40.1 | 177.6 | -73.2 | -30.9 | 0 | 0 | 0 | 112.3 | D168 R169 T174 I175 A176 | D168-N172 WeakPolarHBondContact O-CB 3.23Å; D168-N172 VanDerWaalsContact O-CG 3.25Å; D168-N172 PolarHBondContact O-N 2.95Å; D168-N172 PolarHBondContact O-ND2 3.45Å; D168-N172 VanDerWaalsContact O-ND2 3.13Å; R169-N172 PolarHBondContact O-N 3.01Å; N172-T174 VanDerWaalsContact C-N 3.32Å; N172-T174 PolarHBondContact O-N 3.41Å; N172-I175 PolarHBondContact O-N 3.02Å; N172-A176 PolarHBondContact O-N 3.22Å |
| 173 | N | 87 | Confident | 83.3 | Confident | 95 Ų | 95 | 93.9 Ų | 93.9 | 51% | 0.508 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.2 | -40 | 173.6 | -72.4 | -19.9 | 0 | 0 | 0 | 111.7 | R169 L170 H171 A176 V177 | R169-N173 WeakPolarHBondContact O-CB 3.43Å; R169-N173 PolarHBondContact O-N 3.02Å; R169-N173 PolarHBondContact O-ND2 3.39Å; L170-N173 PolarHBondContact O-N 2.93Å; H171-N173 VanDerWaalsContact C-N 3.33Å; H171-N173 PolarHBondContact O-N 3.41Å; N173-A176 PolarHBondContact O-N 3.34Å; N173-V177 WeakPolarHBondContact O-CG2 3.5Å; N173-V177 PolarHBondContact O-N 3.48Å |
| 174 | T | 89.8 | Confident | 84.5 | Confident | 67 Ų | 67 | 93.4 Ų | 93.4 | 41% | 0.411 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.1 | -43 | 177.9 | -56.5 | 0 | 0 | 0 | 0 | 111.2 | L170 H171 N172 A176 V177 I178 | L170-T174 WeakPolarHBondContact O-CB 3.33Å; L170-T174 PolarHBondContact O-N 3.5Å; L170-T174 PolarHBondContact O-OG1 3.47Å; H171-T174 WeakPolarHBondContact O-CB 3.43Å; H171-T174 PolarHBondContact O-N 3.16Å; H171-T174 VanDerWaalsContact O-N 3.08Å; N172-T174 VanDerWaalsContact C-N 3.32Å; N172-T174 PolarHBondContact O-N 3.41Å; T174-A176 VanDerWaalsContact C-N 3.34Å; T174-A176 PolarHBondContact O-N 2.91Å; T174-V177 PolarHBondContact O-N 3.37Å; T174-I178 HydrophobicContact CG2-CD1 4.02Å; T174-I178 VanDerWaalsContact O-CG1 3.32Å; T174-I178 WeakPolarHBondContact O-CG1 3.27Å; T174-I178 PolarHBondContact O-N 3.47Å |
| 175 | I | 87.9 | Confident | 85.5 | Confident | 66 Ų | 66 | 92.6 Ų | 92.6 | 34% | 0.338 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -58.4 | -46.9 | 173.9 | -69.1 | 169.9 | 0 | 0 | 0 | 110.6 | H171 N172 V177 I178 Q179 | H171-I175 VanDerWaalsContact NE2-CD1 3.32Å; H171-I175 WeakPolarHBondContact NE2-CD1 3.33Å; H171-I175 WeakPolarHBondContact O-CG1 3.45Å; H171-I175 PolarHBondContact O-N 2.84Å; N172-I175 PolarHBondContact O-N 3.02Å; I175-V177 VanDerWaalsContact C-N 3.34Å; I175-V177 PolarHBondContact O-N 2.85Å; I175-I178 PolarHBondContact O-N 3.39Å; I175-Q179 HydrophobicContact CG2-CG 4.38Å; I175-Q179 WeakPolarHBondContact O-CG 3.42Å; I175-Q179 PolarHBondContact O-N 3.15Å |
| 176 | A | 88.4 | Confident | 86.3 | Confident | 50 Ų | 50 | 95.3 Ų | 95.3 | 41% | 0.413 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -60.5 | -42.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | N172 N173 T174 Q179 L180 | N172-A176 PolarHBondContact O-N 3.22Å; N173-A176 PolarHBondContact O-N 3.34Å; T174-A176 VanDerWaalsContact C-N 3.34Å; T174-A176 PolarHBondContact O-N 2.91Å; A176-Q179 PolarHBondContact O-N 3.48Å; A176-L180 PolarHBondContact O-N 3.42Å |
| 177 | V | 89.7 | Confident | 86.9 | Confident | 62 Ų | 62 | 90.1 Ų | 90.1 | 38% | 0.376 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | 175.3 | 171.2 | 0 | 0 | 0 | 0 | 111.3 | N173 T174 I175 Q179 L180 L181 | N173-V177 WeakPolarHBondContact O-CG2 3.5Å; N173-V177 PolarHBondContact O-N 3.48Å; T174-V177 PolarHBondContact O-N 3.37Å; I175-V177 VanDerWaalsContact C-N 3.34Å; I175-V177 PolarHBondContact O-N 2.85Å; V177-Q179 VanDerWaalsContact C-N 3.34Å; V177-Q179 PolarHBondContact O-N 2.89Å; V177-L180 PolarHBondContact O-N 3.2Å; V177-L181 HydrophobicContact CG1-CD1 4.03Å; V177-L181 HydrophobicContact CG1-CG 4.43Å; V177-L181 WeakPolarHBondContact O-CG 3.38Å; V177-L181 PolarHBondContact O-N 3.4Å |
| 178 | I | 89.2 | Confident | 87.3 | Confident | 96 Ų | 96 | 89.2 Ų | 89.2 | 49% | 0.492 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 177.1 | -68.4 | 166.8 | 0 | 0 | 0 | 111 | T174 I175 L181 C182 | T174-I178 HydrophobicContact CG2-CD1 4.02Å; T174-I178 VanDerWaalsContact O-CG1 3.32Å; T174-I178 WeakPolarHBondContact O-CG1 3.27Å; T174-I178 PolarHBondContact O-N 3.47Å; I175-I178 PolarHBondContact O-N 3.39Å; I178-L181 PolarHBondContact O-N 3.11Å; I178-C182 WeakPolarHBondContact O-CB 3.4Å; I178-C182 PolarHBondContact O-N 3.1Å; I178-C182 PolarHBondContact O-SG 3Å; I178-C182 VanDerWaalsContact O-SG 3.42Å |
| 179 | Q | 90.7 | Very high | 87.6 | Confident | 129 Ų | 129 | 89.5 Ų | 89.5 | 60% | 0.603 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -61.3 | -43.7 | 175.8 | -73.5 | 175.7 | -17.3 | 0 | 0 | 111.6 | I175 A176 V177 C182 Q183 | I175-Q179 HydrophobicContact CG2-CG 4.38Å; I175-Q179 WeakPolarHBondContact O-CG 3.42Å; I175-Q179 PolarHBondContact O-N 3.15Å; A176-Q179 PolarHBondContact O-N 3.48Å; V177-Q179 VanDerWaalsContact C-N 3.34Å; V177-Q179 PolarHBondContact O-N 2.89Å; Q179-C182 WeakPolarHBondContact O-CB 3.41Å; Q179-C182 PolarHBondContact O-N 3.37Å; Q179-Q183 PolarHBondContact O-N 3.35Å |
| 180 | L | 90.9 | Very high | 88 | Confident | 87 Ų | 87 | 85.6 Ų | 85.6 | 46% | 0.455 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 176.7 | -172.8 | 69.3 | 0 | 0 | 0 | 111.7 | A176 V177 C182 Q183 L184 L282 | A176-L180 PolarHBondContact O-N 3.42Å; V177-L180 PolarHBondContact O-N 3.2Å; L180-C182 VanDerWaalsContact C-N 3.33Å; L180-C182 PolarHBondContact O-N 2.9Å; L180-Q183 PolarHBondContact O-N 2.94Å; L180-Q183 VanDerWaalsContact O-N 3.14Å; L180-L184 PolarHBondContact O-N 2.74Å; L180-L282 HydrophobicContact CD1-CD2 4.39Å |
| 181 | L | 91 | Very high | 87.8 | Confident | 103 Ų | 103 | 85 Ų | 85 | 54% | 0.539 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.7 | -40.8 | 176 | -73.1 | 172 | 0 | 0 | 0 | 111.9 | V177 I178 Q183 L184 A185 | V177-L181 HydrophobicContact CG1-CD1 4.03Å; V177-L181 HydrophobicContact CG1-CG 4.43Å; V177-L181 WeakPolarHBondContact O-CG 3.38Å; V177-L181 PolarHBondContact O-N 3.4Å; I178-L181 PolarHBondContact O-N 3.11Å; L181-Q183 VanDerWaalsContact C-N 3.32Å; L181-Q183 PolarHBondContact O-N 3.42Å; L181-L184 PolarHBondContact O-N 2.98Å; L181-A185 WeakPolarHBondContact O-CB 3.47Å; L181-A185 PolarHBondContact O-N 2.99Å |
| 182 | C | 89.2 | Confident | 87.7 | Confident | 63 Ų | 63 | 86.8 Ų | 86.8 | 43% | 0.426 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.6 | -40.4 | 173.4 | -80.8 | 0 | 0 | 0 | 0 | 112 | I178 Q179 L180 A185 R186 | I178-C182 WeakPolarHBondContact O-CB 3.4Å; I178-C182 PolarHBondContact O-N 3.1Å; I178-C182 PolarHBondContact O-SG 3Å; I178-C182 VanDerWaalsContact O-SG 3.42Å; Q179-C182 WeakPolarHBondContact O-CB 3.41Å; Q179-C182 PolarHBondContact O-N 3.37Å; L180-C182 VanDerWaalsContact C-N 3.33Å; L180-C182 PolarHBondContact O-N 2.9Å; C182-A185 PolarHBondContact O-N 3.34Å; C182-R186 WeakPolarHBondContact O-CG 3.41Å; C182-R186 PolarHBondContact O-N 3.41Å; C182-R186 VanDerWaalsContact O-N 3.11Å |
| 183 | Q | 89.8 | Confident | 87.1 | Confident | 98 Ų | 98 | 83.7 Ų | 83.7 | 46% | 0.458 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -67.7 | -44.2 | 177.2 | -170.5 | 61.6 | 13.1 | 0 | 0 | 111.6 | Q179 L180 L181 A185 R186 C187 | Q179-Q183 PolarHBondContact O-N 3.35Å; L180-Q183 PolarHBondContact O-N 2.94Å; L180-Q183 VanDerWaalsContact O-N 3.14Å; L181-Q183 VanDerWaalsContact C-N 3.32Å; L181-Q183 PolarHBondContact O-N 3.42Å; Q183-A185 VanDerWaalsContact C-N 3.32Å; Q183-A185 PolarHBondContact O-N 3.31Å; Q183-R186 WeakPolarHBondContact O-CB 3.49Å; Q183-R186 PolarHBondContact O-N 3.05Å; Q183-R186 VanDerWaalsContact O-N 3.15Å; Q183-C187 PolarHBondContact O-N 2.95Å; Q183-C187 PolarHBondContact O-SG 3.22Å; Q183-C187 VanDerWaalsContact O-SG 3.4Å |
| 184 | L | 91.4 | Very high | 86.7 | Confident | 84 Ų | 84 | 84.2 Ų | 84.2 | 44% | 0.44 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.2 | -43.7 | 174.8 | -177.1 | 65.2 | 0 | 0 | 0 | 111.4 | L180 L181 R186 C187 L188 | L180-L184 PolarHBondContact O-N 2.74Å; L181-L184 PolarHBondContact O-N 2.98Å; L184-R186 VanDerWaalsContact C-N 3.3Å; L184-R186 PolarHBondContact O-N 3.03Å; L184-C187 PolarHBondContact O-N 3.42Å; L184-L188 HydrophobicContact CD1-CG 4.47Å; L184-L188 HydrophobicContact CG-CD1 4.05Å; L184-L188 HydrophobicContact CG-CG 4.43Å; L184-L188 WeakPolarHBondContact O-CB 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.32Å; L184-L188 PolarHBondContact O-N 3Å |
| 185 | A | 90.2 | Very high | 85.6 | Confident | 58 Ų | 58 | 86.3 Ų | 86.3 | 48% | 0.479 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.2 | -38.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | L181 C182 Q183 A189 | L181-A185 WeakPolarHBondContact O-CB 3.47Å; L181-A185 PolarHBondContact O-N 2.99Å; C182-A185 PolarHBondContact O-N 3.34Å; Q183-A185 VanDerWaalsContact C-N 3.32Å; Q183-A185 PolarHBondContact O-N 3.31Å; A185-A189 WeakPolarHBondContact O-CB 3.49Å; A185-A189 PolarHBondContact O-N 2.72Å |
| 186 | R | 89.4 | Confident | 84.9 | Confident | 156 Ų | 156 | 90.9 Ų | 90.9 | 59% | 0.589 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -64.5 | -46.4 | 172.7 | -73 | -176.4 | -172.8 | 112.3 | 1.9 | 111.8 | C182 Q183 L184 L188 A189 I190 | C182-R186 WeakPolarHBondContact O-CG 3.41Å; C182-R186 PolarHBondContact O-N 3.41Å; C182-R186 VanDerWaalsContact O-N 3.11Å; Q183-R186 WeakPolarHBondContact O-CB 3.49Å; Q183-R186 PolarHBondContact O-N 3.05Å; Q183-R186 VanDerWaalsContact O-N 3.15Å; L184-R186 VanDerWaalsContact C-N 3.3Å; L184-R186 PolarHBondContact O-N 3.03Å; R186-L188 VanDerWaalsContact C-N 3.34Å; R186-L188 PolarHBondContact O-N 3.46Å; R186-A189 PolarHBondContact O-N 2.77Å; R186-I190 WeakPolarHBondContact O-CG1 3.35Å; R186-I190 PolarHBondContact O-N 3.21Å |
| 187 | C | 87.4 | Confident | 83.5 | Confident | 53 Ų | 53 | 92 Ų | 92 | 36% | 0.358 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 178 | -66.3 | 0 | 0 | 0 | 0 | 111.7 | Q183 L184 A189 I190 L191 | Q183-C187 PolarHBondContact O-N 2.95Å; Q183-C187 PolarHBondContact O-SG 3.22Å; Q183-C187 VanDerWaalsContact O-SG 3.4Å; L184-C187 PolarHBondContact O-N 3.42Å; C187-A189 VanDerWaalsContact C-N 3.32Å; C187-A189 PolarHBondContact O-N 3.09Å; C187-I190 PolarHBondContact O-N 3.5Å; C187-L191 PolarHBondContact O-N 2.95Å |
| 188 | L | 84.3 | Confident | 82.1 | Confident | 99 Ų | 99 | 94.4 Ų | 94.4 | 52% | 0.518 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.5 | -38 | 175.5 | -72.2 | 171.5 | 0 | 0 | 0 | 112.2 | L184 R186 I190 L191 D192 | L184-L188 HydrophobicContact CD1-CG 4.47Å; L184-L188 HydrophobicContact CG-CD1 4.05Å; L184-L188 HydrophobicContact CG-CG 4.43Å; L184-L188 WeakPolarHBondContact O-CB 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.32Å; L184-L188 PolarHBondContact O-N 3Å; R186-L188 VanDerWaalsContact C-N 3.34Å; R186-L188 PolarHBondContact O-N 3.46Å; L188-I190 VanDerWaalsContact C-N 3.35Å; L188-L191 PolarHBondContact O-N 3.45Å; L188-D192 WeakPolarHBondContact O-CB 3.36Å; L188-D192 PolarHBondContact O-N 3.23Å |
| 189 | A | 83.8 | Confident | 80.8 | Confident | 63 Ų | 63 | 94.1 Ų | 94.1 | 52% | 0.521 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -66.4 | -35.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | A185 R186 C187 G193 | A185-A189 WeakPolarHBondContact O-CB 3.49Å; A185-A189 PolarHBondContact O-N 2.72Å; R186-A189 PolarHBondContact O-N 2.77Å; C187-A189 VanDerWaalsContact C-N 3.32Å; C187-A189 PolarHBondContact O-N 3.09Å; A189-G193 PolarHBondContact O-N 3.48Å |
| 190 | I | 85.6 | Confident | 79.1 | Confident | 104 Ų | 104 | 94.1 Ų | 94.1 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.5 | -45.4 | 173.3 | -65.6 | 166.1 | 0 | 0 | 0 | 109.9 | R186 C187 L188 G193 Q194 | R186-I190 WeakPolarHBondContact O-CG1 3.35Å; R186-I190 PolarHBondContact O-N 3.21Å; C187-I190 PolarHBondContact O-N 3.5Å; L188-I190 VanDerWaalsContact C-N 3.35Å; I190-G193 PolarHBondContact O-N 3.39Å; I190-Q194 WeakPolarHBondContact O-CG 3.39Å; I190-Q194 PolarHBondContact O-N 3.47Å |
| 191 | L | 79.8 | Confident | 77.4 | Confident | 80 Ų | 80 | 94.2 Ų | 94.2 | 42% | 0.419 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 178.5 | -161.6 | 92.7 | 0 | 0 | 0 | 111.6 | C187 L188 G193 Q194 L195 | C187-L191 PolarHBondContact O-N 2.95Å; L188-L191 PolarHBondContact O-N 3.45Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.43Å; L191-Q194 PolarHBondContact O-N 3.17Å; L191-L195 WeakPolarHBondContact O-CB 3.49Å; L191-L195 PolarHBondContact O-N 3.48Å |
| 192 | D | 80 | Confident | 75.3 | Confident | 111 Ų | 111 | 95.5 Ų | 95.5 | 59% | 0.594 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -62.6 | -40 | 175.9 | -170 | 47.2 | 0 | 0 | 0 | 111.2 | L188 L195 Y196 | L188-D192 WeakPolarHBondContact O-CB 3.36Å; L188-D192 PolarHBondContact O-N 3.23Å; D192-L195 PolarHBondContact O-N 3.19Å; D192-Y196 VanDerWaalsContact O-CB 3.31Å; D192-Y196 WeakPolarHBondContact O-CB 3.45Å; D192-Y196 PolarHBondContact O-N 3.4Å |
| 193 | G | 73.4 | Confident | 73.3 | Confident | 34 Ų | 34 | 100.5 Ų | 100.5 | 35% | 0.351 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61 | -43 | 171.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | A189 I190 L191 Y196 C197 | A189-G193 PolarHBondContact O-N 3.48Å; I190-G193 PolarHBondContact O-N 3.39Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.43Å; G193-Y196 PolarHBondContact O-N 2.9Å; G193-C197 PolarHBondContact O-N 2.95Å; G193-C197 PolarHBondContact O-SG 2.75Å |
| 194 | Q | 79.8 | Confident | 71.2 | Confident | 105 Ų | 105 | 99.9 Ų | 99.9 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -66.1 | -42.7 | 176.2 | -72.6 | 178.7 | -14.6 | 0 | 0 | 111.8 | I190 L191 Y196 C197 L198 | I190-Q194 WeakPolarHBondContact O-CG 3.39Å; I190-Q194 PolarHBondContact O-N 3.47Å; L191-Q194 PolarHBondContact O-N 3.17Å; Q194-Y196 VanDerWaalsContact C-N 3.33Å; Q194-Y196 PolarHBondContact O-N 2.9Å; Q194-C197 PolarHBondContact O-N 3.32Å; Q194-L198 WeakPolarHBondContact O-CB 3.34Å; Q194-L198 PolarHBondContact O-N 3.48Å |
| 195 | L | 66 | Low | 68.8 | Low | 111 Ų | 111 | 101 Ų | 101 | 58% | 0.581 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.2 | -41.1 | 177.2 | -158 | 83.5 | 0 | 0 | 0 | 111 | L191 D192 L198 N199 | L191-L195 WeakPolarHBondContact O-CB 3.49Å; L191-L195 PolarHBondContact O-N 3.48Å; D192-L195 PolarHBondContact O-N 3.19Å; L195-L198 PolarHBondContact O-N 2.96Å; L195-N199 WeakPolarHBondContact O-CB 3.47Å; L195-N199 PolarHBondContact O-N 2.9Å |
| 196 | Y | 71.9 | Confident | 66.3 | Low | 162 Ų | 162 | 103.5 Ų | 103.5 | 64% | 0.635 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.9 | -43.6 | 174.6 | -177.2 | -96.6 | 0 | 0 | 0 | 112 | D192 G193 Q194 K200 | D192-Y196 VanDerWaalsContact O-CB 3.31Å; D192-Y196 WeakPolarHBondContact O-CB 3.45Å; D192-Y196 PolarHBondContact O-N 3.4Å; G193-Y196 PolarHBondContact O-N 2.9Å; Q194-Y196 VanDerWaalsContact C-N 3.33Å; Q194-Y196 PolarHBondContact O-N 2.9Å; Y196-K200 WeakPolarHBondContact O-CB 3.48Å; Y196-K200 PolarHBondContact O-N 3.4Å |
| 197 | C | 60.8 | Low | 63.7 | Low | 73 Ų | 73 | 100.2 Ų | 100.2 | 49% | 0.493 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.5 | -43.6 | 175.2 | -71.5 | 0 | 0 | 0 | 0 | 112.5 | G193 Q194 K200 N201 | G193-C197 PolarHBondContact O-N 2.95Å; G193-C197 PolarHBondContact O-SG 2.75Å; Q194-C197 PolarHBondContact O-N 3.32Å; C197-K200 PolarHBondContact O-N 3.08Å; C197-N201 PolarHBondContact O-N 2.93Å |
| 198 | L | 59.2 | Low | 61.5 | Low | 113 Ų | 113 | 102.4 Ų | 102.4 | 59% | 0.592 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -61 | -46 | 176.6 | -101.6 | 152.2 | 0 | 0 | 0 | 112 | Q194 L195 K200 N201 Q202 | Q194-L198 WeakPolarHBondContact O-CB 3.34Å; Q194-L198 PolarHBondContact O-N 3.48Å; L195-L198 PolarHBondContact O-N 2.96Å; L198-K200 VanDerWaalsContact C-N 3.32Å; L198-K200 PolarHBondContact O-N 3.33Å; L198-N201 PolarHBondContact O-N 3.14Å; L198-Q202 PolarHBondContact O-N 3.23Å |
| 199 | N | 61.4 | Low | 59.3 | Low | 91 Ų | 91 | 104.9 Ų | 104.9 | 49% | 0.487 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.2 | -40.5 | 178.6 | -162.4 | -15 | 0 | 0 | 0 | 110.8 | L195 N201 Q202 Y203 | L195-N199 WeakPolarHBondContact O-CB 3.47Å; L195-N199 PolarHBondContact O-N 2.9Å; N199-N201 PolarHBondContact O-N 3.34Å; N199-Q202 WeakPolarHBondContact O-CB 3.43Å; N199-Q202 PolarHBondContact O-N 3.45Å; N199-Y203 WeakPolarHBondContact O-CD2 3.34Å; N199-Y203 PolarHBondContact O-N 2.86Å |
| 200 | K | 56.5 | Low | 56.9 | Low | 129 Ų | 129 | 109.1 Ų | 109.1 | 56% | 0.561 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.1 | -36 | 174.8 | -157.7 | -178.8 | -178.6 | -169.9 | 0 | 112.8 | Y196 C197 L198 Q202 Y203 N204 | Y196-K200 WeakPolarHBondContact O-CB 3.48Å; Y196-K200 PolarHBondContact O-N 3.4Å; C197-K200 PolarHBondContact O-N 3.08Å; L198-K200 VanDerWaalsContact C-N 3.32Å; L198-K200 PolarHBondContact O-N 3.33Å; K200-Q202 VanDerWaalsContact C-N 3.33Å; K200-Y203 PolarHBondContact O-N 2.99Å; K200-N204 PolarHBondContact O-N 3.42Å |
| 201 | N | 54 | Low | 54.3 | Low | 88 Ų | 88 | 108.8 Ų | 108.8 | 47% | 0.471 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -70.5 | -27.9 | 174.9 | -73.5 | -8.8 | 0 | 0 | 0 | 112.5 | C197 L198 N199 Y203 N204 N205 | C197-N201 PolarHBondContact O-N 2.93Å; L198-N201 PolarHBondContact O-N 3.14Å; N199-N201 PolarHBondContact O-N 3.34Å; N201-Y203 VanDerWaalsContact C-N 3.28Å; N201-Y203 PolarHBondContact O-N 3.36Å; N201-N204 PolarHBondContact O-N 3.17Å; N201-N204 VanDerWaalsContact O-N 3.16Å; N201-N205 PolarHBondContact O-N 3.01Å |
| 202 | Q | 48.2 | Very low | 51.9 | Low | 131 Ų | 131 | 111.8 Ų | 111.8 | 61% | 0.612 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.9 | -34.7 | 173.2 | -131.5 | -175.6 | 25.5 | 0 | 0 | 111.8 | L198 N199 K200 N206 | L198-Q202 PolarHBondContact O-N 3.23Å; N199-Q202 WeakPolarHBondContact O-CB 3.43Å; N199-Q202 PolarHBondContact O-N 3.45Å; K200-Q202 VanDerWaalsContact C-N 3.33Å; Q202-N206 WeakPolarHBondContact O-CB 3.4Å; Q202-N206 VanDerWaalsContact O-CG 3.31Å; Q202-N206 PolarHBondContact O-N 2.91Å; Q202-N206 PolarHBondContact O-ND2 2.78Å |
| 203 | Y | 46.5 | Very low | 49.7 | Very low | 167 Ų | 167 | 113.9 Ų | 113.9 | 66% | 0.655 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -68.8 | -36.9 | 171.4 | -79.8 | -84.3 | 0 | 0 | 0 | 112.4 | N199 K200 N201 V207 | N199-Y203 WeakPolarHBondContact O-CD2 3.34Å; N199-Y203 PolarHBondContact O-N 2.86Å; K200-Y203 PolarHBondContact O-N 2.99Å; N201-Y203 VanDerWaalsContact C-N 3.28Å; N201-Y203 PolarHBondContact O-N 3.36Å; Y203-V207 WeakPolarHBondContact O-CB 3.29Å; Y203-V207 WeakPolarHBondContact O-CG2 3.38Å; Y203-V207 PolarHBondContact O-N 3.23Å |
| 204 | N | 46.6 | Very low | 47.8 | Very low | 86 Ų | 86 | 119.4 Ų | 119.4 | 46% | 0.46 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -75 | -38.7 | 178.4 | -76.1 | -7.9 | 0 | 0 | 0 | 112.9 | K200 N201 N206 V207 I208 | K200-N204 PolarHBondContact O-N 3.42Å; N201-N204 PolarHBondContact O-N 3.17Å; N201-N204 VanDerWaalsContact O-N 3.16Å; N204-N206 VanDerWaalsContact C-N 3.33Å; N204-N206 PolarHBondContact O-N 2.65Å; N204-V207 PolarHBondContact O-N 3.44Å; N204-V207 VanDerWaalsContact O-N 3.14Å; N204-I208 VanDerWaalsContact O-CG1 3.24Å; N204-I208 WeakPolarHBondContact O-CG1 3.41Å; N204-I208 PolarHBondContact O-N 3.46Å |
| 205 | N | 40.6 | Very low | 45.6 | Very low | 106 Ų | 106 | 121 Ų | 121 | 57% | 0.567 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -67.2 | -35.7 | 178.5 | -77.1 | 8.5 | 0 | 0 | 0 | 111.8 | N201 V207 L209 | N201-N205 PolarHBondContact O-N 3.01Å; N205-V207 VanDerWaalsContact C-N 3.31Å; N205-V207 PolarHBondContact O-N 2.95Å; N205-L209 PolarHBondContact O-N 2.9Å |
| 206 | N | 36.7 | Very low | 44.1 | Very low | 112 Ų | 112 | 122.3 Ų | 122.3 | 60% | 0.599 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -70.5 | -27.5 | 173.6 | -68.9 | -6.8 | 0 | 0 | 0 | 112.7 | Q202 N204 | Q202-N206 WeakPolarHBondContact O-CB 3.4Å; Q202-N206 VanDerWaalsContact O-CG 3.31Å; Q202-N206 PolarHBondContact O-N 2.91Å; Q202-N206 PolarHBondContact O-ND2 2.78Å; N204-N206 VanDerWaalsContact C-N 3.33Å; N204-N206 PolarHBondContact O-N 2.65Å |
| 207 | V | 36 | Very low | 42.3 | Very low | 87 Ų | 87 | 121.3 Ų | 121.3 | 53% | 0.527 | 64% | 0.638 | S | S | . | * | H | α-helix | trans | -81.1 | -35.1 | 175.9 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | Y203 N204 N205 L209 L210 | Y203-V207 WeakPolarHBondContact O-CB 3.29Å; Y203-V207 WeakPolarHBondContact O-CG2 3.38Å; Y203-V207 PolarHBondContact O-N 3.23Å; N204-V207 PolarHBondContact O-N 3.44Å; N204-V207 VanDerWaalsContact O-N 3.14Å; N205-V207 VanDerWaalsContact C-N 3.31Å; N205-V207 PolarHBondContact O-N 2.95Å; V207-L209 VanDerWaalsContact C-N 3.28Å; V207-L209 PolarHBondContact O-N 2.82Å; V207-L210 PolarHBondContact O-N 3.24Å |
| 208 | I | 41.2 | Very low | 40.8 | Very low | 98 Ų | 98 | 125 Ų | 125 | 50% | 0.503 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -65.4 | -35.1 | 176.3 | -67.2 | 165.6 | 0 | 0 | 0 | 110.4 | N204 L210 C211 | N204-I208 VanDerWaalsContact O-CG1 3.24Å; N204-I208 WeakPolarHBondContact O-CG1 3.41Å; N204-I208 PolarHBondContact O-N 3.46Å; I208-L210 VanDerWaalsContact C-N 3.26Å; I208-L210 PolarHBondContact O-N 3.41Å; I208-C211 PolarHBondContact O-N 3.07Å |
| 209 | L | 36.9 | Very low | 39.4 | Very low | 151 Ų | 151 | 125.3 Ų | 125.3 | 79% | 0.791 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.4 | -19.4 | 178.7 | -136 | 83.1 | 0 | 0 | 0 | 114.2 | N205 V207 | N205-L209 PolarHBondContact O-N 2.9Å; V207-L209 VanDerWaalsContact C-N 3.28Å; V207-L209 PolarHBondContact O-N 2.82Å |
| 210 | L | 33.6 | Very low | 37.8 | Very low | 153 Ų | 153 | 127.9 Ų | 127.9 | 80% | 0.801 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.9 | -12.4 | -178.2 | -128.8 | 78.2 | 0 | 0 | 0 | 114.3 | V207 I208 | V207-L210 PolarHBondContact O-N 3.24Å; I208-L210 VanDerWaalsContact C-N 3.26Å; I208-L210 PolarHBondContact O-N 3.41Å |
| 211 | C | 31 | Very low | 36.4 | Very low | 96 Ų | 96 | 129.4 Ų | 129.4 | 65% | 0.649 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -99.2 | 2.4 | -175 | -72.3 | 0 | 0 | 0 | 0 | 114.6 | I208 N213 | I208-C211 PolarHBondContact O-N 3.07Å; C211-N213 VanDerWaalsContact C-N 3.26Å; C211-N213 PolarHBondContact O-N 2.98Å |
| 212 | N | 30.2 | Very low | 35.3 | Very low | 144 Ų | 144 | 130.2 Ų | 130.2 | 77% | 0.77 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.9 | 21.8 | -172.6 | -146.2 | 30.5 | 0 | 0 | 0 | 115.6 | ||
| 213 | N | 33.6 | Very low | 34.3 | Very low | 154 Ų | 154 | 129.8 Ų | 129.8 | 82% | 0.824 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -116.1 | 24 | 177.8 | -83 | -3.4 | 0 | 0 | 0 | 113.8 | C211 | C211-N213 VanDerWaalsContact C-N 3.26Å; C211-N213 PolarHBondContact O-N 2.98Å |
| 214 | N | 32.5 | Very low | 33.3 | Very low | 150 Ų | 150 | 128.2 Ų | 128.2 | 80% | 0.802 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -128.8 | 115.2 | 165.2 | -95.1 | -16 | 0 | 0 | 0 | 110.1 | ||
| 215 | D | 33.7 | Very low | 32.5 | Very low | 139 Ų | 139 | 132.4 Ų | 132.4 | 74% | 0.743 | 73% | 0.727 | S | S | * | * | trans | -41.8 | 151.7 | 167.7 | -59.9 | -63.3 | 0 | 0 | 0 | 112.6 | ||||
| 216 | N | 34.8 | Very low | 31.8 | Very low | 139 Ų | 139 | 137.9 Ų | 137.9 | 74% | 0.743 | 74% | 0.741 | S | S | * | * | trans | 101.1 | 92.9 | 166.9 | -48.8 | -62.5 | 0 | 0 | 0 | 116 | ||||
| 217 | N | 33.8 | Very low | 31.4 | Very low | 141 Ų | 141 | 138.7 Ų | 138.7 | 75% | 0.754 | 75% | 0.75 | S | S | * | * | 48.1 | 84.6 | 129.5 | -50.7 | -39.6 | 0 | 0 | 0 | 117 | |||||
| 218 | D | 28.9 | Very low | 31 | Very low | 149 Ų | 149 | 141 Ų | 141 | 80% | 0.797 | 76% | 0.764 | S | S | * | * | trans | -159.4 | 114.6 | 139 | -92.6 | -31.5 | 0 | 0 | 0 | 110.2 | L220 | D218-L220 PolarHBondContact O-N 2.84Š| ||
| 219 | P | 31.6 | Very low | 30.1 | Very low | 120 Ų | 120 | 140.7 Ų | 140.7 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | trans | -69.2 | 118.2 | -178.7 | 25.1 | -29.9 | 0 | 0 | 0 | 110.8 | I221 | P219-I221 PolarHBondContact O-N 2.98Å; P219-I221 VanDerWaalsContact O-N 3.15Å | ||
| 220 | L | 27.4 | Very low | 29.6 | Very low | 146 Ų | 146 | 140.5 Ų | 140.5 | 76% | 0.764 | 77% | 0.77 | S | S | * | * | trans | -57.1 | 115.9 | 177.7 | -95.1 | 81.5 | 0 | 0 | 0 | 111 | D218 P222 | D218-L220 PolarHBondContact O-N 2.84Å; L220-P222 WeakPolarHBondContact O-CD 3.45Å | ||
| 221 | I | 26.8 | Very low | 29.2 | Very low | 161 Ų | 161 | 139.1 Ų | 139.1 | 83% | 0.826 | 76% | 0.763 | S | S | * | * | trans | -59.8 | 122.6 | 172 | -60.2 | 173.2 | 0 | 0 | 0 | 109.1 | P219 C223 | P219-I221 PolarHBondContact O-N 2.98Å; P219-I221 VanDerWaalsContact O-N 3.15Å; I221-C223 PolarHBondContact O-N 3.16Å | ||
| 222 | P | 31.2 | Very low | 29 | Very low | 104 Ų | 104 | 141 Ų | 141 | 68% | 0.675 | 77% | 0.766 | S | S | * | * | trans | -65.2 | 124.7 | 175.9 | -18 | 30.6 | 0 | 0 | 0 | 110.7 | L220 N224 | L220-P222 WeakPolarHBondContact O-CD 3.45Å; P222-N224 PolarHBondContact O-N 3.21Å; P222-N224 VanDerWaalsContact O-N 3.1Å | ||
| 223 | C | 25.8 | Very low | 28.7 | Very low | 122 Ų | 122 | 140.3 Ų | 140.3 | 82% | 0.824 | 76% | 0.763 | S | S | * | * | trans | -72.5 | 103.9 | 178.2 | -166.9 | 0 | 0 | 0 | 0 | 109.7 | I221 H225 | I221-C223 PolarHBondContact O-N 3.16Å; C223-H225 PolarHBondContact O-N 2.8Å | ||
| 224 | N | 27.1 | Very low | 28.3 | Very low | 135 Ų | 135 | 139.9 Ų | 139.9 | 72% | 0.722 | 77% | 0.765 | S | S | * | * | trans | -51.3 | 125.9 | 177 | -78.2 | -29.7 | 0 | 0 | 0 | 112.7 | P222 Y226 | P222-N224 PolarHBondContact O-N 3.21Å; P222-N224 VanDerWaalsContact O-N 3.1Å; N224-Y226 PolarHBondContact O-N 3.19Å | ||
| 225 | H | 29.1 | Very low | 28 | Very low | 174 Ų | 174 | 138.7 Ų | 138.7 | 81% | 0.806 | 77% | 0.769 | S | S | * | * | trans | -70.8 | 115.1 | 166 | -65.3 | -62 | 0 | 0 | 0 | 109.4 | C223 T227 | C223-H225 PolarHBondContact O-N 2.8Å; H225-T227 VanDerWaalsContact C-N 3.3Å; H225-T227 PolarHBondContact O-N 3.17Å | ||
| 226 | Y | 26.9 | Very low | 27.5 | Very low | 221 Ų | 221 | 138.2 Ų | 138.2 | 87% | 0.867 | 77% | 0.771 | S | S | * | * | trans | -69.9 | 86.1 | 167.9 | -65.1 | -85.7 | 0 | 0 | 0 | 109.3 | N224 T228 | N224-Y226 PolarHBondContact O-N 3.19Å; Y226-T228 PolarHBondContact O-N 3.16Å | ||
| 227 | T | 27 | Very low | 27 | Very low | 128 Ų | 128 | 137.6 Ų | 137.6 | 79% | 0.785 | 77% | 0.773 | S | S | * | * | trans | -77 | 104.2 | 158.7 | 40.1 | 0 | 0 | 0 | 0 | 107.4 | H225 S229 | H225-T227 VanDerWaalsContact C-N 3.3Å; H225-T227 PolarHBondContact O-N 3.17Å; T227-S229 VanDerWaalsContact C-N 3.31Å; T227-S229 PolarHBondContact O-N 3.41Å | ||
| 228 | T | 27.1 | Very low | 26.5 | Very low | 135 Ų | 135 | 138.2 Ų | 138.2 | 83% | 0.828 | 77% | 0.773 | S | S | * | * | trans | -61.8 | 97.2 | 167 | 39.1 | 0 | 0 | 0 | 0 | 108.6 | Y226 L230 | Y226-T228 PolarHBondContact O-N 3.16Å; T228-L230 PolarHBondContact O-N 3.22Å; T228-L230 VanDerWaalsContact O-N 3.1Å | ||
| 229 | S | 23.2 | Very low | 26.2 | Very low | 93 Ų | 93 | 136 Ų | 136 | 65% | 0.65 | 77% | 0.769 | S | S | * | * | trans | -46.4 | 105 | 160 | 165.9 | 0 | 0 | 0 | 0 | 109.8 | T227 I231 | T227-S229 VanDerWaalsContact C-N 3.31Å; T227-S229 PolarHBondContact O-N 3.41Å; S229-I231 WeakPolarHBondContact OG-CG1 3.45Å | ||
| 230 | L | 26.2 | Very low | 26 | Very low | 147 Ų | 147 | 136.4 Ų | 136.4 | 77% | 0.77 | 77% | 0.765 | S | S | * | * | trans | -107.9 | 91.3 | 160.2 | -164.9 | 75.8 | 0 | 0 | 0 | 105.8 | T228 N232 | T228-L230 PolarHBondContact O-N 3.22Å; T228-L230 VanDerWaalsContact O-N 3.1Å; L230-N232 PolarHBondContact O-N 3.01Å; L230-N232 VanDerWaalsContact O-N 3.07Å | ||
| 231 | I | 25.1 | Very low | 26 | Very low | 124 Ų | 124 | 135.5 Ų | 135.5 | 64% | 0.636 | 76% | 0.756 | S | S | * | * | trans | -68.5 | 96.5 | 171.3 | -62.8 | 155.9 | 0 | 0 | 0 | 106 | S229 | S229-I231 WeakPolarHBondContact OG-CG1 3.45Š| ||
| 232 | N | 28 | Very low | 26.1 | Very low | 134 Ų | 134 | 135.8 Ų | 135.8 | 72% | 0.717 | 76% | 0.758 | S | S | * | * | trans | -106.4 | 103.4 | 159 | -83.1 | 7.6 | 0 | 0 | 0 | 106.6 | L230 | L230-N232 PolarHBondContact O-N 3.01Å; L230-N232 VanDerWaalsContact O-N 3.07Å | ||
| 233 | D | 23 | Very low | 26.1 | Very low | 131 Ų | 131 | 137.8 Ų | 137.8 | 70% | 0.701 | 76% | 0.763 | S | S | * | * | trans | -53.9 | 158.3 | 165.9 | -66.4 | -48.8 | 0 | 0 | 0 | 110.9 | ||||
| 234 | T | 25.3 | Very low | 26.4 | Very low | 144 Ų | 144 | 137.2 Ų | 137.2 | 88% | 0.883 | 75% | 0.752 | S | S | * | * | trans | 71 | 80.6 | 169.2 | 28.6 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 235 | S | 26.3 | Very low | 26.6 | Very low | 125 Ų | 125 | 136.8 Ų | 136.8 | 87% | 0.874 | 75% | 0.749 | S | S | * | * | -166.7 | 116.7 | 117.7 | -151.7 | 0 | 0 | 0 | 0 | 110.6 | |||||
| 236 | T | 22.4 | Very low | 26.9 | Very low | 130 Ų | 130 | 138.2 Ų | 138.2 | 80% | 0.798 | 75% | 0.753 | S | S | * | * | trans | -62.1 | 148.7 | 179.3 | -29.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 237 | T | 24.6 | Very low | 27.2 | Very low | 126 Ų | 126 | 133.7 Ų | 133.7 | 77% | 0.773 | 75% | 0.745 | S | S | * | * | trans | 86.2 | 72.6 | 158.2 | -32.5 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 238 | M | 24.1 | Very low | 27.6 | Very low | 154 Ų | 154 | 133.8 Ų | 133.8 | 76% | 0.759 | 74% | 0.74 | S | S | * | * | trans | -168.2 | 73.6 | 136.1 | -90.3 | -117.4 | 48.9 | 0 | 0 | 108.4 | N240 | M238-N240 PolarHBondContact O-N 2.94Å; M238-N240 VanDerWaalsContact O-N 3.16Å | ||
| 239 | S | 22.5 | Very low | 28.1 | Very low | 103 Ų | 103 | 135.4 Ų | 135.4 | 72% | 0.72 | 74% | 0.736 | S | S | * | * | trans | -66.2 | 103.2 | 164.3 | -174.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 240 | N | 27 | Very low | 28.7 | Very low | 127 Ų | 127 | 138.7 Ų | 138.7 | 68% | 0.679 | 75% | 0.746 | S | S | * | * | trans | -110 | 79.5 | 153.1 | -79.8 | -22.5 | 0 | 0 | 0 | 106.7 | M238 L242 | M238-N240 PolarHBondContact O-N 2.94Å; M238-N240 VanDerWaalsContact O-N 3.16Å; N240-L242 VanDerWaalsContact C-N 3.25Å; N240-L242 PolarHBondContact O-N 3.37Å | ||
| 241 | H | 26.7 | Very low | 29.2 | Very low | 128 Ų | 128 | 138.8 Ų | 138.8 | 59% | 0.593 | 75% | 0.747 | S | S | * | * | trans | -7.5 | 77.1 | 138.6 | -151.1 | -83.7 | 0 | 0 | 0 | 114.5 | L243 N244 | H241-L243 PolarHBondContact CE1-O 3.47Å; H241-L243 PolarHBondContact ND1-O 2.88Å; H241-N244 PolarHBondContact ND1-OD1 3.35Å; H241-N244 VanDerWaalsContact ND1-OD1 3.08Å | ||
| 242 | L | 29.1 | Very low | 30 | Very low | 166 Ų | 166 | 140 Ų | 140 | 87% | 0.869 | 76% | 0.755 | S | S | * | * | trans | -106.9 | 25.8 | 161.1 | -94.2 | 162.6 | 0 | 0 | 0 | 110.1 | N240 | N240-L242 VanDerWaalsContact C-N 3.25Å; N240-L242 PolarHBondContact O-N 3.37Å | ||
| 243 | L | 31.3 | Very low | 30.7 | Very low | 147 Ų | 147 | 140.5 Ų | 140.5 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | trans | -95 | 75.6 | 148 | -92.5 | 84.7 | 0 | 0 | 0 | 107.1 | H241 | H241-L243 PolarHBondContact CE1-O 3.47Å; H241-L243 PolarHBondContact ND1-O 2.88Å | ||
| 244 | N | 33.4 | Very low | 31.7 | Very low | 110 Ų | 110 | 142.2 Ų | 142.2 | 59% | 0.588 | 77% | 0.767 | S | S | * | * | trans | -92.7 | 92.6 | 149.4 | -72 | -1.4 | 0 | 0 | 0 | 103 | H241 F246 | H241-N244 PolarHBondContact ND1-OD1 3.35Å; H241-N244 VanDerWaalsContact ND1-OD1 3.08Å; N244-F246 PolarHBondContact O-N 2.98Å | ||
| 245 | D | 31 | Very low | 32.7 | Very low | 126 Ų | 126 | 141.5 Ų | 141.5 | 67% | 0.674 | 76% | 0.758 | S | S | * | * | 52.9 | 59.6 | 82.7 | -142.3 | 13 | 0 | 0 | 0 | 110.1 | N247 | D245-N247 VanDerWaalsContact C-N 3.26Å; D245-N247 PolarHBondContact O-N 3.49Å; D245-N247 PolarHBondContact OD1-ND2 3.5Å | |||
| 246 | F | 35.6 | Very low | 33.5 | Very low | 203 Ų | 203 | 138 Ų | 138 | 89% | 0.89 | 74% | 0.741 | S | S | * | * | trans | -92.8 | 72.1 | 157.3 | -74.2 | -75.2 | 0 | 0 | 0 | 107.6 | N244 | N244-F246 PolarHBondContact O-N 2.98Š| ||
| 247 | N | 33 | Very low | 34.9 | Very low | 127 Ų | 127 | 137 Ų | 137 | 68% | 0.679 | 73% | 0.731 | S | S | * | * | trans | -87.6 | 153.6 | 150.4 | -88.3 | -45.1 | 0 | 0 | 0 | 108.6 | D245 | D245-N247 VanDerWaalsContact C-N 3.26Å; D245-N247 PolarHBondContact O-N 3.49Å; D245-N247 PolarHBondContact OD1-ND2 3.5Å | ||
| 248 | D | 35 | Very low | 36.3 | Very low | 130 Ų | 130 | 134.5 Ų | 134.5 | 70% | 0.695 | 72% | 0.719 | S | S | * | * | trans | 90.1 | 114.2 | 161.6 | -88.1 | 6.4 | 0 | 0 | 0 | 120.6 | ||||
| 249 | K | 36.9 | Very low | 37.8 | Very low | 169 Ų | 169 | 133.8 Ų | 133.8 | 74% | 0.735 | 71% | 0.714 | S | S | * | * | trans | 88.4 | 101.3 | 135.5 | -69 | 172.4 | -176.3 | 167.6 | 0 | 118.5 | N251 | K249-N251 PolarHBondContact O-N 2.98Š| ||
| 250 | D | 36.4 | Very low | 39.6 | Very low | 162 Ų | 162 | 132 Ų | 132 | 87% | 0.866 | 70% | 0.7 | S | S | * | * | 14.3 | 97.4 | 120.8 | -56.8 | -26.2 | 0 | 0 | 0 | 115 | |||||
| 251 | N | 37.6 | Very low | 41.8 | Very low | 149 Ų | 149 | 130.8 Ų | 130.8 | 80% | 0.797 | 69% | 0.691 | S | S | * | * | trans | -151.7 | 111.2 | 143.5 | -141.5 | 4.1 | 0 | 0 | 0 | 108.7 | K249 N253 | K249-N251 PolarHBondContact O-N 2.98Å; N251-N253 PolarHBondContact O-N 3.09Å | ||
| 252 | D | 40.1 | Very low | 44.4 | Very low | 149 Ų | 149 | 129.3 Ų | 129.3 | 80% | 0.797 | 69% | 0.687 | S | S | * | * | trans | -50.5 | 120.3 | 161.9 | -64.7 | -51.2 | 0 | 0 | 0 | 108.5 | ||||
| 253 | N | 42.7 | Very low | 46.7 | Very low | 145 Ų | 145 | 124.5 Ų | 124.5 | 78% | 0.775 | 67% | 0.667 | S | S | * | * | trans | -178.4 | 139.2 | 142.3 | -87.1 | -42.7 | 0 | 0 | 0 | 110.2 | N251 D255 | N251-N253 PolarHBondContact O-N 3.09Å; N253-D255 PolarHBondContact O-N 2.96Å | ||
| 254 | D | 44.6 | Very low | 49.2 | Very low | 166 Ų | 166 | 122.7 Ų | 122.7 | 89% | 0.888 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63.4 | 21 | -164.2 | -151.6 | 8.1 | 0 | 0 | 0 | 116.7 | ||
| 255 | D | 46.3 | Very low | 51.7 | Low | 129 Ų | 129 | 121.9 Ų | 121.9 | 69% | 0.69 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.8 | -1.4 | 179.9 | -73.9 | -27 | 0 | 0 | 0 | 113.2 | N253 N257 S258 | N253-D255 PolarHBondContact O-N 2.96Å; D255-N257 VanDerWaalsContact C-N 3.31Å; D255-N257 PolarHBondContact O-N 3.29Å; D255-S258 PolarHBondContact O-OG 3.19Å |
| 256 | G | 44 | Very low | 54.4 | Low | 52 Ų | 52 | 119.3 Ų | 119.3 | 54% | 0.536 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66 | -25.8 | -174.4 | 0 | 0 | 0 | 0 | 0 | 115 | C260 | G256-C260 PolarHBondContact O-N 2.92Å |
| 257 | N | 51.7 | Low | 56.8 | Low | 108 Ų | 108 | 113.4 Ų | 113.4 | 58% | 0.578 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72.1 | -39.9 | -178.2 | -168.1 | 58.6 | 0 | 0 | 0 | 112.1 | D255 Q259 C260 E261 | D255-N257 VanDerWaalsContact C-N 3.31Å; D255-N257 PolarHBondContact O-N 3.29Å; N257-Q259 PolarHBondContact O-N 3.47Å; N257-C260 PolarHBondContact O-N 2.9Å; N257-E261 PolarHBondContact ND2-OE1 3.48Å; N257-E261 WeakPolarHBondContact O-CG 3.45Å; N257-E261 PolarHBondContact O-N 2.98Å; N257-E261 VanDerWaalsContact O-N 3.11Å |
| 258 | S | 53.4 | Low | 59.5 | Low | 75 Ų | 75 | 113.2 Ų | 113.2 | 52% | 0.524 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -69.8 | -32.6 | -178.8 | 63.2 | 0 | 0 | 0 | 0 | 112.7 | D255 L262 | D255-S258 PolarHBondContact O-OG 3.19Å; S258-L262 WeakPolarHBondContact O-CB 3.48Å; S258-L262 PolarHBondContact O-N 3.21Å |
| 259 | Q | 56.5 | Low | 62.2 | Low | 138 Ų | 138 | 112.6 Ų | 112.6 | 65% | 0.645 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -71 | -37.5 | 177.5 | -109.7 | -139.5 | 12.5 | 0 | 0 | 112.6 | N257 S263 | N257-Q259 PolarHBondContact O-N 3.47Å; Q259-S263 WeakPolarHBondContact O-CB 3.2Å; Q259-S263 PolarHBondContact O-N 3.38Å; Q259-S263 PolarHBondContact O-OG 2.96Å |
| 260 | C | 58.8 | Low | 64.9 | Low | 65 Ų | 65 | 109.7 Ų | 109.7 | 44% | 0.439 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -65.8 | -46 | 175.9 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | G256 N257 S263 Q264 | G256-C260 PolarHBondContact O-N 2.92Å; N257-C260 PolarHBondContact O-N 2.9Å; C260-S263 PolarHBondContact O-N 3.03Å; C260-Q264 WeakPolarHBondContact O-CG 3.47Å; C260-Q264 PolarHBondContact O-N 3.2Å; C260-Q264 PolarHBondContact SG-NE2 3.3Å |
| 261 | E | 74.3 | Confident | 67.5 | Low | 102 Ų | 102 | 109.3 Ų | 109.3 | 48% | 0.477 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -61.8 | -44.6 | 175.3 | -72.9 | 179.9 | -171.8 | 0 | 0 | 111.8 | N257 S263 Q264 I265 | N257-E261 PolarHBondContact ND2-OE1 3.48Å; N257-E261 WeakPolarHBondContact O-CG 3.45Å; N257-E261 PolarHBondContact O-N 2.98Å; N257-E261 VanDerWaalsContact O-N 3.11Å; E261-S263 VanDerWaalsContact C-N 3.34Å; E261-S263 PolarHBondContact O-N 3.42Å; E261-Q264 PolarHBondContact O-N 3.42Å; E261-I265 VanDerWaalsContact O-CG1 3.25Å; E261-I265 WeakPolarHBondContact O-CG1 3.48Å; E261-I265 PolarHBondContact O-N 2.9Å |
| 262 | L | 80.8 | Confident | 70.2 | Confident | 98 Ų | 98 | 106.8 Ų | 106.8 | 51% | 0.513 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.5 | -42.4 | 177.4 | -173.4 | 67.3 | 0 | 0 | 0 | 111.7 | S258 Q264 I265 I266 | S258-L262 WeakPolarHBondContact O-CB 3.48Å; S258-L262 PolarHBondContact O-N 3.21Å; L262-Q264 PolarHBondContact O-N 3.31Å; L262-I265 PolarHBondContact O-N 2.96Å; L262-I266 HydrophobicContact CD1-CD1 4.49Å; L262-I266 HydrophobicContact CG-CD1 3.97Å; L262-I266 WeakPolarHBondContact O-CB 3.07Å; L262-I266 VanDerWaalsContact O-CG1 3.25Å; L262-I266 WeakPolarHBondContact O-CG1 3.22Å; L262-I266 PolarHBondContact O-N 3.26Å |
| 263 | S | 78.3 | Confident | 72.8 | Confident | 64 Ų | 64 | 103.5 Ų | 103.5 | 45% | 0.448 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.1 | -40.4 | 177.2 | -62.6 | 0 | 0 | 0 | 0 | 111.9 | Q259 C260 E261 I266 E267 | Q259-S263 WeakPolarHBondContact O-CB 3.2Å; Q259-S263 PolarHBondContact O-N 3.38Å; Q259-S263 PolarHBondContact O-OG 2.96Å; C260-S263 PolarHBondContact O-N 3.03Å; E261-S263 VanDerWaalsContact C-N 3.34Å; E261-S263 PolarHBondContact O-N 3.42Å; S263-I266 PolarHBondContact O-N 3.48Å; S263-E267 WeakPolarHBondContact O-CB 3.41Å; S263-E267 PolarHBondContact O-N 3.08Å |
| 264 | Q | 82.7 | Confident | 75.2 | Confident | 109 Ų | 109 | 101.8 Ų | 101.8 | 51% | 0.509 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 174.8 | -71.1 | 177.8 | 40.6 | 0 | 0 | 111.9 | C260 E261 L262 E267 Q268 | C260-Q264 WeakPolarHBondContact O-CG 3.47Å; C260-Q264 PolarHBondContact O-N 3.2Å; C260-Q264 PolarHBondContact SG-NE2 3.3Å; E261-Q264 PolarHBondContact O-N 3.42Å; L262-Q264 PolarHBondContact O-N 3.31Å; Q264-E267 PolarHBondContact O-N 3.42Å; Q264-Q268 WeakPolarHBondContact O-CB 3.42Å; Q264-Q268 WeakPolarHBondContact O-CG 3.49Å; Q264-Q268 PolarHBondContact O-N 3.45Å |
| 265 | I | 87 | Confident | 77.5 | Confident | 94 Ų | 94 | 98.2 Ų | 98.2 | 48% | 0.482 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -45.7 | 176.8 | -68.6 | 163.9 | 0 | 0 | 0 | 110.5 | E261 L262 E267 Q268 Q269 | E261-I265 VanDerWaalsContact O-CG1 3.25Å; E261-I265 WeakPolarHBondContact O-CG1 3.48Å; E261-I265 PolarHBondContact O-N 2.9Å; L262-I265 PolarHBondContact O-N 2.96Å; I265-E267 VanDerWaalsContact C-N 3.32Å; I265-E267 PolarHBondContact O-N 3.05Å; I265-Q268 PolarHBondContact O-N 3.02Å; I265-Q269 WeakPolarHBondContact O-CB 3.35Å; I265-Q269 PolarHBondContact O-N 2.87Å |
| 266 | I | 86.3 | Confident | 79.7 | Confident | 71 Ų | 71 | 96 Ų | 96 | 36% | 0.364 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.8 | -43.5 | 177.1 | -70.5 | 166.2 | 0 | 0 | 0 | 110.6 | L262 S263 Q269 K270 | L262-I266 HydrophobicContact CD1-CD1 4.49Å; L262-I266 HydrophobicContact CG-CD1 3.97Å; L262-I266 WeakPolarHBondContact O-CB 3.07Å; L262-I266 VanDerWaalsContact O-CG1 3.25Å; L262-I266 WeakPolarHBondContact O-CG1 3.22Å; L262-I266 PolarHBondContact O-N 3.26Å; S263-I266 PolarHBondContact O-N 3.48Å; I266-Q269 PolarHBondContact O-N 2.88Å; I266-K270 WeakPolarHBondContact O-CG 3.33Å; I266-K270 PolarHBondContact O-N 2.85Å |
| 267 | E | 87.1 | Confident | 82.2 | Confident | 79 Ų | 79 | 100.1 Ų | 100.1 | 37% | 0.369 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -66.7 | -40.4 | 177.5 | -83.1 | -59.8 | 126.8 | 0 | 0 | 113 | S263 Q264 I265 Q269 K270 R271 | S263-E267 WeakPolarHBondContact O-CB 3.41Å; S263-E267 PolarHBondContact O-N 3.08Å; Q264-E267 PolarHBondContact O-N 3.42Å; I265-E267 VanDerWaalsContact C-N 3.32Å; I265-E267 PolarHBondContact O-N 3.05Å; E267-Q269 VanDerWaalsContact C-N 3.34Å; E267-K270 PolarHBondContact O-N 3.01Å; E267-K270 WeakPolarHBondContact OE1-CD 3.26Å; E267-K270 IonicContact OE1-NZ 2.85Å; E267-K270 PolarHBondContact OE1-NZ 3.2Å; E267-R271 WeakPolarHBondContact O-CG 3.44Å; E267-R271 PolarHBondContact O-N 3.43Å |
| 268 | Q | 89.3 | Confident | 84.1 | Confident | 123 Ų | 123 | 100 Ų | 100 | 58% | 0.575 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -63.1 | -41.7 | 173.3 | -73.9 | -179.9 | 5.1 | 0 | 0 | 111.5 | Q264 I265 R271 L272 | Q264-Q268 WeakPolarHBondContact O-CB 3.42Å; Q264-Q268 WeakPolarHBondContact O-CG 3.49Å; Q264-Q268 PolarHBondContact O-N 3.45Å; I265-Q268 PolarHBondContact O-N 3.02Å; Q268-R271 PolarHBondContact O-N 2.89Å; Q268-L272 WeakPolarHBondContact O-CB 3.43Å; Q268-L272 PolarHBondContact O-N 3.26Å |
| 269 | Q | 91.5 | Very high | 85.9 | Confident | 117 Ų | 117 | 99 Ų | 99 | 55% | 0.547 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.1 | -42.1 | 178.4 | -164.4 | 177.5 | 2.7 | 0 | 0 | 111.5 | I265 I266 E267 L272 I273 | I265-Q269 WeakPolarHBondContact O-CB 3.35Å; I265-Q269 PolarHBondContact O-N 2.87Å; I266-Q269 PolarHBondContact O-N 2.88Å; E267-Q269 VanDerWaalsContact C-N 3.34Å; Q269-L272 PolarHBondContact O-N 3.31Å; Q269-I273 HydrophobicContact CG-CD1 4.3Å; Q269-I273 WeakPolarHBondContact O-CD1 3.27Å; Q269-I273 VanDerWaalsContact O-CG1 3.26Å; Q269-I273 WeakPolarHBondContact O-CG1 3.43Å; Q269-I273 PolarHBondContact O-N 3.49Å |
| 270 | K | 92.8 | Very high | 87.6 | Confident | 108 Ų | 108 | 98.2 Ų | 98.2 | 47% | 0.47 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -60.1 | -46.9 | 172.7 | -73.2 | 176.2 | -169.2 | 166.3 | 0 | 112.1 | I266 E267 L272 I273 I274 | I266-K270 WeakPolarHBondContact O-CG 3.33Å; I266-K270 PolarHBondContact O-N 2.85Å; E267-K270 PolarHBondContact O-N 3.01Å; E267-K270 WeakPolarHBondContact OE1-CD 3.26Å; E267-K270 IonicContact OE1-NZ 2.85Å; E267-K270 PolarHBondContact OE1-NZ 3.2Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 3.47Å; K270-I273 PolarHBondContact O-N 3.06Å; K270-I274 WeakPolarHBondContact O-CG1 3.25Å; K270-I274 PolarHBondContact O-N 3.43Å; K270-I274 VanDerWaalsContact O-N 3.09Å |
| 271 | R | 91.4 | Very high | 89.3 | Confident | 154 Ų | 154 | 101 Ų | 101 | 58% | 0.581 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60 | -43.3 | 177.6 | -72 | 179.4 | -148.1 | -154 | 4.9 | 111.6 | E267 Q268 I274 Q275 | E267-R271 WeakPolarHBondContact O-CG 3.44Å; E267-R271 PolarHBondContact O-N 3.43Å; Q268-R271 PolarHBondContact O-N 2.89Å; R271-I274 PolarHBondContact O-N 3.19Å; R271-Q275 WeakPolarHBondContact O-CG 3.44Å; R271-Q275 PolarHBondContact O-N 3.25Å |
| 272 | L | 95.2 | Very high | 90.3 | Very high | 96 Ų | 96 | 99.2 Ų | 99.2 | 50% | 0.503 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.9 | -42.8 | 178.3 | -175.4 | 63.8 | 0 | 0 | 0 | 111.8 | Q268 Q269 K270 I274 Q275 I276 | Q268-L272 WeakPolarHBondContact O-CB 3.43Å; Q268-L272 PolarHBondContact O-N 3.26Å; Q269-L272 PolarHBondContact O-N 3.31Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 3.47Å; L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 2.96Å; L272-Q275 PolarHBondContact O-N 3.27Å; L272-I276 HydrophobicContact CD1-CD1 4.49Å; L272-I276 HydrophobicContact CG-CD1 4.03Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 2.69Å |
| 273 | I | 94.5 | Very high | 90.8 | Very high | 81 Ų | 81 | 104 Ų | 104 | 42% | 0.415 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -59.9 | -41.1 | 176.2 | -70.8 | 164.1 | 0 | 0 | 0 | 111.3 | Q269 K270 I276 K277 | Q269-I273 HydrophobicContact CG-CD1 4.3Å; Q269-I273 WeakPolarHBondContact O-CD1 3.27Å; Q269-I273 VanDerWaalsContact O-CG1 3.26Å; Q269-I273 WeakPolarHBondContact O-CG1 3.43Å; Q269-I273 PolarHBondContact O-N 3.49Å; K270-I273 PolarHBondContact O-N 3.06Å; I273-I276 PolarHBondContact O-N 3Å; I273-K277 HydrophobicContact CG2-CD 4.48Å; I273-K277 WeakPolarHBondContact O-CG 3.42Å; I273-K277 PolarHBondContact O-N 3.24Å |
| 274 | I | 92.2 | Very high | 91.2 | Very high | 109 Ų | 109 | 103.7 Ų | 103.7 | 56% | 0.559 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -62.1 | -47.2 | 176.3 | -67.1 | 165.3 | 0 | 0 | 0 | 110.3 | K270 R271 L272 I276 K277 E278 | K270-I274 WeakPolarHBondContact O-CG1 3.25Å; K270-I274 PolarHBondContact O-N 3.43Å; K270-I274 VanDerWaalsContact O-N 3.09Å; R271-I274 PolarHBondContact O-N 3.19Å; L272-I274 VanDerWaalsContact C-N 3.3Å; L272-I274 PolarHBondContact O-N 2.96Å; I274-I276 VanDerWaalsContact C-N 3.33Å; I274-I276 PolarHBondContact O-N 3.46Å; I274-K277 PolarHBondContact O-N 3.27Å; I274-E278 PolarHBondContact O-N 3.1Å |
| 275 | Q | 93.7 | Very high | 91.7 | Very high | 91 Ų | 91 | 103.3 Ų | 103.3 | 43% | 0.425 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.9 | -39.2 | 178.1 | -70.7 | 178.2 | 2 | 0 | 0 | 112.5 | R271 L272 E278 A279 | R271-Q275 WeakPolarHBondContact O-CG 3.44Å; R271-Q275 PolarHBondContact O-N 3.25Å; L272-Q275 PolarHBondContact O-N 3.27Å; Q275-E278 PolarHBondContact O-N 2.93Å; Q275-A279 WeakPolarHBondContact O-CB 3.32Å; Q275-A279 PolarHBondContact O-N 3.03Å |
| 276 | I | 92.6 | Very high | 91.7 | Very high | 82 Ų | 82 | 104.5 Ų | 104.5 | 42% | 0.421 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.3 | -44.8 | 175.9 | -70 | 167.2 | 0 | 0 | 0 | 110.5 | L272 I273 I274 A279 Q280 | L272-I276 HydrophobicContact CD1-CD1 4.49Å; L272-I276 HydrophobicContact CG-CD1 4.03Å; L272-I276 WeakPolarHBondContact O-CG1 3.41Å; L272-I276 PolarHBondContact O-N 2.69Å; I273-I276 PolarHBondContact O-N 3Å; I274-I276 VanDerWaalsContact C-N 3.33Å; I274-I276 PolarHBondContact O-N 3.46Å; I276-A279 PolarHBondContact O-N 2.98Å; I276-Q280 HydrophobicContact CG2-CG 4.47Å; I276-Q280 WeakPolarHBondContact O-CB 3.41Å; I276-Q280 VanDerWaalsContact O-CG 3.27Å; I276-Q280 WeakPolarHBondContact O-CG 3.44Å; I276-Q280 PolarHBondContact O-N 3.33Å |
| 277 | K | 94.9 | Very high | 91.8 | Very high | 138 Ų | 138 | 104.1 Ų | 104.1 | 60% | 0.6 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.6 | -42.3 | 177.4 | -75.4 | -178.1 | 177.6 | -175.7 | 0 | 112 | I273 I274 Q280 L281 | I273-K277 HydrophobicContact CG2-CD 4.48Å; I273-K277 WeakPolarHBondContact O-CG 3.42Å; I273-K277 PolarHBondContact O-N 3.24Å; I274-K277 PolarHBondContact O-N 3.27Å; K277-Q280 PolarHBondContact O-N 3.34Å; K277-L281 PolarHBondContact O-N 3.13Å |
| 278 | E | 92.9 | Very high | 91.9 | Very high | 105 Ų | 105 | 103.8 Ų | 103.8 | 49% | 0.491 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.1 | -45.6 | 176.1 | -173.1 | 179.8 | -177.7 | 0 | 0 | 111.5 | I274 Q275 Q280 L281 L282 | I274-E278 PolarHBondContact O-N 3.1Å; Q275-E278 PolarHBondContact O-N 2.93Å; E278-Q280 VanDerWaalsContact C-N 3.32Å; E278-Q280 PolarHBondContact O-N 3.42Å; E278-L281 WeakPolarHBondContact O-CB 3.49Å; E278-L281 PolarHBondContact O-N 2.76Å; E278-L282 HydrophobicContact CG-CD1 4.38Å; E278-L282 WeakPolarHBondContact O-CG 3.42Å; E278-L282 PolarHBondContact O-N 2.91Å |
| 279 | A | 90.5 | Very high | 91.7 | Very high | 56 Ų | 56 | 100.1 Ų | 100.1 | 46% | 0.463 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.1 | -36.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q275 I276 R283 | Q275-A279 WeakPolarHBondContact O-CB 3.32Å; Q275-A279 PolarHBondContact O-N 3.03Å; I276-A279 PolarHBondContact O-N 2.98Å; A279-R283 WeakPolarHBondContact O-CB 3.37Å; A279-R283 PolarHBondContact O-N 3.3Å |
| 280 | Q | 93.6 | Very high | 91.5 | Very high | 121 Ų | 121 | 100.6 Ų | 100.6 | 57% | 0.565 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.9 | -42.3 | 174.4 | -75.1 | 173 | -17.5 | 0 | 0 | 111.9 | I276 K277 E278 R283 A284 | I276-Q280 HydrophobicContact CG2-CG 4.47Å; I276-Q280 WeakPolarHBondContact O-CB 3.41Å; I276-Q280 VanDerWaalsContact O-CG 3.27Å; I276-Q280 WeakPolarHBondContact O-CG 3.44Å; I276-Q280 PolarHBondContact O-N 3.33Å; K277-Q280 PolarHBondContact O-N 3.34Å; E278-Q280 VanDerWaalsContact C-N 3.32Å; E278-Q280 PolarHBondContact O-N 3.42Å; Q280-R283 PolarHBondContact O-N 3.46Å; Q280-A284 PolarHBondContact O-N 2.84Å |
| 281 | L | 94 | Very high | 90.8 | Very high | 122 Ų | 122 | 100.5 Ų | 100.5 | 64% | 0.639 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -60.9 | -48.5 | 175.4 | -174.9 | 71 | 0 | 0 | 0 | 111.1 | K277 E278 R283 A284 E285 | K277-L281 PolarHBondContact O-N 3.13Å; E278-L281 WeakPolarHBondContact O-CB 3.49Å; E278-L281 PolarHBondContact O-N 2.76Å; L281-R283 VanDerWaalsContact C-N 3.28Å; L281-R283 PolarHBondContact O-N 3.22Å; L281-A284 PolarHBondContact O-N 2.62Å; L281-A284 VanDerWaalsContact O-N 3.16Å; L281-E285 PolarHBondContact O-N 2.91Å |
| 282 | L | 94.1 | Very high | 90.4 | Very high | 65 Ų | 65 | 99.9 Ų | 99.9 | 34% | 0.34 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.2 | -37.8 | 177.2 | -72.4 | 171.1 | 0 | 0 | 0 | 112.2 | L180 E278 E285 L286 | L180-L282 HydrophobicContact CD1-CD2 4.39Å; E278-L282 HydrophobicContact CG-CD1 4.38Å; E278-L282 WeakPolarHBondContact O-CG 3.42Å; E278-L282 PolarHBondContact O-N 2.91Å; L282-E285 PolarHBondContact O-N 3.4Å; L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 PolarHBondContact O-N 2.99Å |
| 283 | R | 91.3 | Very high | 89.6 | Confident | 200 Ų | 200 | 100 Ų | 100 | 76% | 0.755 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -65.9 | -40.9 | 176.3 | -166.9 | 175.8 | -166.2 | 159 | 3.5 | 112 | A279 Q280 L281 L286 E287 | A279-R283 WeakPolarHBondContact O-CB 3.37Å; A279-R283 PolarHBondContact O-N 3.3Å; Q280-R283 PolarHBondContact O-N 3.46Å; L281-R283 VanDerWaalsContact C-N 3.28Å; L281-R283 PolarHBondContact O-N 3.22Å; R283-L286 PolarHBondContact O-N 3.32Å; R283-E287 WeakPolarHBondContact O-CB 3.37Å; R283-E287 PolarHBondContact O-N 2.84Å |
| 284 | A | 88.4 | Confident | 88.5 | Confident | 56 Ų | 56 | 100.5 Ų | 100.5 | 46% | 0.463 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q280 L281 E287 T288 | Q280-A284 PolarHBondContact O-N 2.84Å; L281-A284 PolarHBondContact O-N 2.62Å; L281-A284 VanDerWaalsContact O-N 3.16Å; A284-E287 PolarHBondContact O-N 3.5Å; A284-T288 PolarHBondContact O-N 3.15Å; A284-T288 PolarHBondContact O-OG1 3.46Å |
| 285 | E | 92 | Very high | 87.8 | Confident | 102 Ų | 102 | 103.3 Ų | 103.3 | 48% | 0.477 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -67.1 | -41.6 | 176.1 | -170.6 | 174.3 | -171.5 | 0 | 0 | 112.1 | L281 L282 T288 C289 | L281-E285 PolarHBondContact O-N 2.91Å; L282-E285 PolarHBondContact O-N 3.4Å; E285-T288 WeakPolarHBondContact O-CB 3.38Å; E285-T288 PolarHBondContact O-N 3.49Å; E285-C289 WeakPolarHBondContact O-CB 3.41Å; E285-C289 PolarHBondContact O-N 3.22Å |
| 286 | L | 88.3 | Confident | 86.9 | Confident | 118 Ų | 118 | 102.6 Ų | 102.6 | 62% | 0.618 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -64.1 | -40.3 | 175.4 | -171.1 | 145.3 | 0 | 0 | 0 | 111.6 | L282 R283 T288 C289 R290 | L282-L286 WeakPolarHBondContact O-CB 3.38Å; L282-L286 PolarHBondContact O-N 2.99Å; R283-L286 PolarHBondContact O-N 3.32Å; L286-T288 VanDerWaalsContact C-N 3.33Å; L286-C289 WeakPolarHBondContact O-CB 3.46Å; L286-C289 PolarHBondContact O-N 3.43Å; L286-R290 WeakPolarHBondContact O-CB 3.49Å; L286-R290 PolarHBondContact O-N 3.03Å |
| 287 | E | 87 | Confident | 85.7 | Confident | 63 Ų | 63 | 102.7 Ų | 102.7 | 29% | 0.294 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 175 | -169 | 56.8 | -136.8 | 0 | 0 | 111.4 | R283 A284 C289 R290 H291 | R283-E287 WeakPolarHBondContact O-CB 3.37Å; R283-E287 PolarHBondContact O-N 2.84Å; A284-E287 PolarHBondContact O-N 3.5Å; E287-C289 VanDerWaalsContact C-N 3.34Å; E287-C289 PolarHBondContact O-N 2.88Å; E287-R290 WeakPolarHBondContact O-CB 3.42Å; E287-R290 PolarHBondContact O-N 3.33Å; E287-R290 IonicContact OE1-CZ 3Å; E287-R290 IonicContact OE1-NE 2.78Å; E287-R290 PolarHBondContact OE1-NE 2.88Å; E287-R290 IonicContact OE1-NH2 2.65Å; E287-R290 PolarHBondContact OE1-NH2 2.92Å; E287-R290 IonicContact OE2-CZ 3.76Å; E287-R290 IonicContact OE2-NE 3.51Å; E287-R290 IonicContact OE2-NH2 3.89Å; E287-H291 PolarHBondContact O-CD2 3.25Å; E287-H291 PolarHBondContact O-N 2.92Å; E287-H291 IonicContact OE1-CD2 2.79Å; E287-H291 IonicContact OE1-CE1 3.25Å; E287-H291 IonicContact OE1-NE2 2.84Å; E287-H291 PolarHBondContact OE1-NE2 3.4Å |
| 288 | T | 88.7 | Confident | 84.1 | Confident | 72 Ų | 72 | 98 Ų | 98 | 44% | 0.442 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.2 | -41.3 | 173.5 | -56.5 | 0 | 0 | 0 | 0 | 111.4 | A284 E285 L286 H291 R292 | A284-T288 PolarHBondContact O-N 3.15Å; A284-T288 PolarHBondContact O-OG1 3.46Å; E285-T288 WeakPolarHBondContact O-CB 3.38Å; E285-T288 PolarHBondContact O-N 3.49Å; L286-T288 VanDerWaalsContact C-N 3.33Å; T288-H291 PolarHBondContact O-N 3.4Å; T288-R292 WeakPolarHBondContact O-CG 3.49Å; T288-R292 PolarHBondContact O-N 2.94Å |
| 289 | C | 86.3 | Confident | 82.4 | Confident | 47 Ų | 47 | 97.3 Ų | 97.3 | 32% | 0.318 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -44.8 | 174.1 | -168.7 | 0 | 0 | 0 | 0 | 111.4 | E285 L286 E287 H291 R292 L293 | E285-C289 WeakPolarHBondContact O-CB 3.41Å; E285-C289 PolarHBondContact O-N 3.22Å; L286-C289 WeakPolarHBondContact O-CB 3.46Å; L286-C289 PolarHBondContact O-N 3.43Å; E287-C289 VanDerWaalsContact C-N 3.34Å; E287-C289 PolarHBondContact O-N 2.88Å; C289-H291 PolarHBondContact O-N 3.08Å; C289-R292 PolarHBondContact O-N 2.92Å; C289-L293 WeakPolarHBondContact O-CB 3.33Å; C289-L293 PolarHBondContact O-N 3.35Å |
| 290 | R | 86.6 | Confident | 80.9 | Confident | 126 Ų | 126 | 100.1 Ų | 100.1 | 48% | 0.475 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -58.4 | -47 | 175.5 | -170.6 | -174.6 | 80.2 | 145.8 | 3.1 | 111.4 | L286 E287 L293 L294 | L286-R290 WeakPolarHBondContact O-CB 3.49Å; L286-R290 PolarHBondContact O-N 3.03Å; E287-R290 WeakPolarHBondContact O-CB 3.42Å; E287-R290 PolarHBondContact O-N 3.33Å; E287-R290 IonicContact OE1-CZ 3Å; E287-R290 IonicContact OE1-NE 2.78Å; E287-R290 PolarHBondContact OE1-NE 2.88Å; E287-R290 IonicContact OE1-NH2 2.65Å; E287-R290 PolarHBondContact OE1-NH2 2.92Å; E287-R290 IonicContact OE2-CZ 3.76Å; E287-R290 IonicContact OE2-NE 3.51Å; E287-R290 IonicContact OE2-NH2 3.89Å; R290-L293 PolarHBondContact O-N 3.25Å; R290-L294 HydrophobicContact CG-CD1 4.19Å; R290-L294 WeakPolarHBondContact O-CG 3.49Å; R290-L294 PolarHBondContact O-N 3.36Å |
| 291 | H | 78.4 | Confident | 79 | Confident | 107 Ų | 107 | 99.4 Ų | 99.4 | 50% | 0.495 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.3 | -45.9 | 177.2 | -81.5 | -64.1 | 0 | 0 | 0 | 112.4 | E287 T288 C289 L293 L294 E295 | E287-H291 PolarHBondContact O-CD2 3.25Å; E287-H291 PolarHBondContact O-N 2.92Å; E287-H291 IonicContact OE1-CD2 2.79Å; E287-H291 IonicContact OE1-CE1 3.25Å; E287-H291 IonicContact OE1-NE2 2.84Å; E287-H291 PolarHBondContact OE1-NE2 3.4Å; T288-H291 PolarHBondContact O-N 3.4Å; C289-H291 PolarHBondContact O-N 3.08Å; H291-L293 VanDerWaalsContact C-N 3.3Å; H291-L293 PolarHBondContact O-N 2.8Å; H291-L294 PolarHBondContact O-N 2.97Å; H291-E295 WeakPolarHBondContact O-CB 3.3Å; H291-E295 PolarHBondContact O-N 2.81Å |
| 292 | R | 82.9 | Confident | 77 | Confident | 140 Ų | 140 | 101.2 Ų | 101.2 | 53% | 0.528 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -61.5 | -38.3 | 175.3 | -72.6 | -174.5 | -63.2 | -153.6 | -0.2 | 112.4 | T288 C289 S296 | T288-R292 WeakPolarHBondContact O-CG 3.49Å; T288-R292 PolarHBondContact O-N 2.94Å; C289-R292 PolarHBondContact O-N 2.92Å; R292-S296 WeakPolarHBondContact O-CB 3.3Å; R292-S296 PolarHBondContact O-N 3.06Å |
| 293 | L | 78.9 | Confident | 74.9 | Confident | 99 Ų | 99 | 102 Ų | 102 | 52% | 0.518 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.6 | -46.7 | 176.2 | -171.9 | 68.6 | 0 | 0 | 0 | 110.5 | C289 R290 H291 E295 S296 I297 | C289-L293 WeakPolarHBondContact O-CB 3.33Å; C289-L293 PolarHBondContact O-N 3.35Å; R290-L293 PolarHBondContact O-N 3.25Å; H291-L293 VanDerWaalsContact C-N 3.3Å; H291-L293 PolarHBondContact O-N 2.8Å; L293-E295 VanDerWaalsContact C-N 3.34Å; L293-E295 PolarHBondContact O-N 2.89Å; L293-S296 WeakPolarHBondContact O-CB 3.32Å; L293-S296 PolarHBondContact O-N 3.39Å; L293-S296 VanDerWaalsContact O-N 3.15Å; L293-S296 PolarHBondContact O-OG 3.19Å; L293-I297 WeakPolarHBondContact O-CG1 3.4Å; L293-I297 PolarHBondContact O-N 3.43Å |
| 294 | L | 72 | Confident | 73.1 | Confident | 91 Ų | 91 | 97.5 Ų | 97.5 | 48% | 0.476 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.5 | -38.1 | 177 | -70 | 174.3 | 0 | 0 | 0 | 112.4 | R290 H291 S296 I297 | R290-L294 HydrophobicContact CG-CD1 4.19Å; R290-L294 WeakPolarHBondContact O-CG 3.49Å; R290-L294 PolarHBondContact O-N 3.36Å; H291-L294 PolarHBondContact O-N 2.97Å; L294-S296 VanDerWaalsContact C-N 3.3Å; L294-S296 PolarHBondContact O-N 3.44Å; L294-I297 HydrophobicContact CD2-CD1 4.02Å; L294-I297 WeakPolarHBondContact O-CB 3.26Å; L294-I297 PolarHBondContact O-N 3.17Å |
| 295 | E | 77 | Confident | 71.2 | Confident | 168 Ų | 168 | 99.4 Ų | 99.4 | 79% | 0.785 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.7 | -31.9 | 174.4 | -171.7 | -179.4 | -176.8 | 0 | 0 | 112 | H291 L293 I297 | H291-E295 WeakPolarHBondContact O-CB 3.3Å; H291-E295 PolarHBondContact O-N 2.81Å; L293-E295 VanDerWaalsContact C-N 3.34Å; L293-E295 PolarHBondContact O-N 2.89Å; E295-I297 PolarHBondContact O-N 2.93Å |
| 296 | S | 74.3 | Confident | 69.1 | Low | 77 Ų | 77 | 97.5 Ų | 97.5 | 54% | 0.538 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -71.3 | -17.1 | 174.1 | 77.6 | 0 | 0 | 0 | 0 | 113.4 | R292 L293 L294 P298 | R292-S296 WeakPolarHBondContact O-CB 3.3Å; R292-S296 PolarHBondContact O-N 3.06Å; L293-S296 WeakPolarHBondContact O-CB 3.32Å; L293-S296 PolarHBondContact O-N 3.39Å; L293-S296 VanDerWaalsContact O-N 3.15Å; L293-S296 PolarHBondContact O-OG 3.19Å; L294-S296 VanDerWaalsContact C-N 3.3Å; L294-S296 PolarHBondContact O-N 3.44Å; S296-P298 VanDerWaalsContact O-CD 3.3Å; S296-P298 WeakPolarHBondContact O-CD 3.48Å |
| 297 | I | 68.2 | Low | 67.2 | Low | 83 Ų | 83 | 98.3 Ų | 98.3 | 43% | 0.426 | 52% | 0.522 | S | S | . | . | S | Bend | trans | -77.1 | 117 | 173.2 | -61.2 | 170.7 | 0 | 0 | 0 | 108 | L293 L294 E295 G299 I301 | L293-I297 WeakPolarHBondContact O-CG1 3.4Å; L293-I297 PolarHBondContact O-N 3.43Å; L294-I297 HydrophobicContact CD2-CD1 4.02Å; L294-I297 WeakPolarHBondContact O-CB 3.26Å; L294-I297 PolarHBondContact O-N 3.17Å; E295-I297 PolarHBondContact O-N 2.93Å; I297-G299 PolarHBondContact O-N 3.28Å; I297-I301 HydrophobicContact CG2-CD1 4.29Å |
| 298 | P | 60.2 | Low | 65.3 | Low | 41 Ų | 41 | 99.8 Ų | 99.8 | 27% | 0.266 | 53% | 0.532 | S | S | . | . | trans | -61.5 | 128.6 | 175.8 | -17.7 | 29.7 | 0 | 0 | 0 | 110.8 | S296 H300 I301 | S296-P298 VanDerWaalsContact O-CD 3.3Å; S296-P298 WeakPolarHBondContact O-CD 3.48Å; P298-H300 WeakPolarHBondContact CB-CE1 3.35Å; P298-H300 PolarHBondContact O-N 3.48Å; P298-I301 HydrophobicContact CB-CG1 4.5Å; P298-I301 HydrophobicContact CG-CD1 4.31Å; P298-I301 PolarHBondContact O-N 2.92Å | ||
| 299 | G | 58.3 | Low | 63.4 | Low | 90 Ų | 90 | 100.9 Ų | 100.9 | 93% | 0.928 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.9 | -3.7 | -176.9 | 0 | 0 | 0 | 0 | 0 | 116.2 | I297 | I297-G299 PolarHBondContact O-N 3.28Š|
| 300 | H | 59.4 | Low | 61.5 | Low | 114 Ų | 114 | 104 Ų | 104 | 53% | 0.528 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100.7 | 2.3 | 176.5 | 59.7 | -94.9 | 0 | 0 | 0 | 113.8 | F153 P298 K302 | F153-H300 AromaticContact CE1-CD2 3.93Å; F153-H300 AromaticContact CE1-NE2 3.28Å; F153-H300 VanDerWaalsContact CE1-NE2 3.28Å; F153-H300 WeakPolarHBondContact CE1-NE2 3.38Å; F153-H300 AromaticContact CZ-NE2 3.84Å; P298-H300 WeakPolarHBondContact CB-CE1 3.35Å; P298-H300 PolarHBondContact O-N 3.48Å; H300-K302 PolarHBondContact O-N 3.31Å |
| 301 | I | 53.6 | Low | 59.7 | Low | 106 Ų | 106 | 102.1 Ų | 102.1 | 54% | 0.544 | 55% | 0.546 | S | S | . | . | trans | -71.5 | 79.3 | 164.4 | -57.4 | 179.6 | 0 | 0 | 0 | 106.8 | I297 P298 C303 | I297-I301 HydrophobicContact CG2-CD1 4.29Å; P298-I301 HydrophobicContact CB-CG1 4.5Å; P298-I301 HydrophobicContact CG-CD1 4.31Å; P298-I301 PolarHBondContact O-N 2.92Å; I301-C303 PolarHBondContact O-N 3.34Å; I301-C303 VanDerWaalsContact O-N 3.13Å | ||
| 302 | K | 51.5 | Low | 58.4 | Low | 161 Ų | 161 | 102.9 Ų | 102.9 | 70% | 0.7 | 55% | 0.548 | S | S | * | . | trans | -59.3 | 115.7 | 161.5 | -77.8 | -171.2 | 174.2 | -170.8 | 0 | 106.4 | H300 D304 | H300-K302 PolarHBondContact O-N 3.31Å; K302-D304 PolarHBondContact O-N 3.44Å | ||
| 303 | C | 50 | Low | 56.7 | Low | 82 Ų | 82 | 100.9 Ų | 100.9 | 55% | 0.554 | 55% | 0.547 | S | S | * | . | trans | -75.2 | 54.9 | 174 | -148.2 | 0 | 0 | 0 | 0 | 109.2 | I301 V305 T306 | I301-C303 PolarHBondContact O-N 3.34Å; I301-C303 VanDerWaalsContact O-N 3.13Å; C303-V305 PolarHBondContact O-N 2.81Å; C303-T306 PolarHBondContact O-OG1 3.14Å; C303-T306 PolarHBondContact SG-OG1 3.4Å | ||
| 304 | D | 52.4 | Low | 55.2 | Low | 105 Ų | 105 | 98.1 Ų | 98.1 | 56% | 0.561 | 54% | 0.542 | S | S | * | . | trans | -75.8 | -15.9 | 179.1 | -69.2 | -17.8 | 0 | 0 | 0 | 110.7 | K302 | K302-D304 PolarHBondContact O-N 3.44Š| ||
| 305 | V | 48.8 | Very low | 54.1 | Low | 96 Ų | 96 | 100.3 Ų | 100.3 | 58% | 0.582 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -82.1 | -26 | -175.3 | -175.1 | 0 | 0 | 0 | 0 | 113.1 | C303 H307 N308 I309 | C303-V305 PolarHBondContact O-N 2.81Å; V305-H307 PolarHBondContact O-N 2.99Å; V305-N308 PolarHBondContact O-N 2.95Å; V305-N308 VanDerWaalsContact O-N 3.1Å; V305-I309 HydrophobicContact CG1-CD1 3.92Å; V305-I309 HydrophobicContact CG1-CG1 4.16Å; V305-I309 PolarHBondContact O-N 3.23Å |
| 306 | T | 48.5 | Very low | 52.7 | Low | 62 Ų | 62 | 98 Ų | 98 | 38% | 0.38 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.3 | -29.4 | 174.9 | 29.5 | 0 | 0 | 0 | 0 | 111.9 | C303 N308 I310 | C303-T306 PolarHBondContact O-OG1 3.14Å; C303-T306 PolarHBondContact SG-OG1 3.4Å; T306-N308 VanDerWaalsContact C-N 3.35Å; T306-I310 WeakPolarHBondContact O-CB 3.26Å; T306-I310 WeakPolarHBondContact O-CG1 3.49Å; T306-I310 PolarHBondContact O-N 2.78Å |
| 307 | H | 48 | Very low | 51.3 | Low | 135 Ų | 135 | 103.2 Ų | 103.2 | 63% | 0.625 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.5 | -38.6 | 172.8 | -75.5 | 56.9 | 0 | 0 | 0 | 111 | V305 D311 | V305-H307 PolarHBondContact O-N 2.99Å; H307-D311 WeakPolarHBondContact O-CB 3.44Å; H307-D311 PolarHBondContact O-N 3.34Å |
| 308 | N | 47 | Very low | 50.2 | Low | 94 Ų | 94 | 104.5 Ų | 104.5 | 50% | 0.503 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -72.7 | -38.1 | 178.2 | -98 | -60.6 | 0 | 0 | 0 | 114.5 | V305 T306 K312 | V305-N308 PolarHBondContact O-N 2.95Å; V305-N308 VanDerWaalsContact O-N 3.1Å; T306-N308 VanDerWaalsContact C-N 3.35Å; N308-K312 VanDerWaalsContact O-CB 3.26Å; N308-K312 WeakPolarHBondContact O-CB 3.32Å; N308-K312 VanDerWaalsContact O-CG 3.25Å; N308-K312 WeakPolarHBondContact O-CG 3.38Å; N308-K312 PolarHBondContact O-N 2.87Å |
| 309 | I | 49.2 | Very low | 49.2 | Very low | 95 Ų | 95 | 108.9 Ų | 108.9 | 49% | 0.487 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -75.6 | -41.7 | 179.9 | -60.4 | 174.7 | 0 | 0 | 0 | 110.3 | V305 K312 L313 | V305-I309 HydrophobicContact CG1-CD1 3.92Å; V305-I309 HydrophobicContact CG1-CG1 4.16Å; V305-I309 PolarHBondContact O-N 3.23Å; I309-K312 PolarHBondContact O-N 3.12Å; I309-L313 HydrophobicContact CG2-CD1 3.92Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CB 3.28Å; I309-L313 VanDerWaalsContact O-CG 3.29Å; I309-L313 WeakPolarHBondContact O-CG 3.44Å; I309-L313 PolarHBondContact O-N 3.35Å |
| 310 | I | 46.3 | Very low | 48.2 | Very low | 113 Ų | 113 | 111.9 Ų | 111.9 | 58% | 0.579 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -66.5 | -39 | 176 | -64.4 | 171.4 | 0 | 0 | 0 | 110.3 | T306 L313 G314 | T306-I310 WeakPolarHBondContact O-CB 3.26Å; T306-I310 WeakPolarHBondContact O-CG1 3.49Å; T306-I310 PolarHBondContact O-N 2.78Å; I310-L313 PolarHBondContact O-N 2.82Å; I310-G314 WeakPolarHBondContact O-CA 3.39Å; I310-G314 PolarHBondContact O-N 3.23Å |
| 311 | D | 48.8 | Very low | 46.9 | Very low | 85 Ų | 85 | 113.2 Ų | 113.2 | 46% | 0.455 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -69.3 | -36.3 | 175.3 | -74.2 | -15.9 | 0 | 0 | 0 | 112.7 | H307 G314 R315 | H307-D311 WeakPolarHBondContact O-CB 3.44Å; H307-D311 PolarHBondContact O-N 3.34Å; D311-G314 PolarHBondContact O-N 3.47Å; D311-R315 WeakPolarHBondContact O-CG 3.26Å; D311-R315 PolarHBondContact O-N 3.43Å |
| 312 | K | 51.4 | Low | 45.9 | Very low | 124 Ų | 124 | 116.4 Ų | 116.4 | 54% | 0.539 | 60% | 0.602 | S | S | . | * | H | α-helix | trans | -64.5 | -48.5 | 173.6 | -82.3 | 175.1 | 177.5 | -117.5 | 0 | 110.9 | N308 I309 G314 R315 D316 | N308-K312 VanDerWaalsContact O-CB 3.26Å; N308-K312 WeakPolarHBondContact O-CB 3.32Å; N308-K312 VanDerWaalsContact O-CG 3.25Å; N308-K312 WeakPolarHBondContact O-CG 3.38Å; N308-K312 PolarHBondContact O-N 2.87Å; I309-K312 PolarHBondContact O-N 3.12Å; K312-G314 VanDerWaalsContact C-N 3.28Å; K312-G314 PolarHBondContact O-N 2.83Å; K312-R315 PolarHBondContact O-N 3.05Å; K312-D316 PolarHBondContact O-N 3.14Å |
| 313 | L | 46.5 | Very low | 44.7 | Very low | 97 Ų | 97 | 116.7 Ų | 116.7 | 51% | 0.508 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -62.6 | -36.6 | 175.2 | -70.7 | 170.5 | 0 | 0 | 0 | 111.7 | I309 I310 R315 D316 F317 | I309-L313 HydrophobicContact CG2-CD1 3.92Å; I309-L313 HydrophobicContact CG2-CG 4.37Å; I309-L313 WeakPolarHBondContact O-CB 3.28Å; I309-L313 VanDerWaalsContact O-CG 3.29Å; I309-L313 WeakPolarHBondContact O-CG 3.44Å; I309-L313 PolarHBondContact O-N 3.35Å; I310-L313 PolarHBondContact O-N 2.82Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 3.46Å; L313-D316 PolarHBondContact O-N 3.31Å; L313-F317 VanDerWaalsContact O-CD2 3.29Å; L313-F317 WeakPolarHBondContact O-CD2 3.19Å |
| 314 | G | 47.6 | Very low | 43.7 | Very low | 41 Ų | 41 | 118.1 Ų | 118.1 | 42% | 0.423 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -65.5 | -33.5 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | I310 D311 K312 | I310-G314 WeakPolarHBondContact O-CA 3.39Å; I310-G314 PolarHBondContact O-N 3.23Å; D311-G314 PolarHBondContact O-N 3.47Å; K312-G314 VanDerWaalsContact C-N 3.28Å; K312-G314 PolarHBondContact O-N 2.83Å |
| 315 | R | 49.1 | Very low | 42.3 | Very low | 138 Ų | 138 | 118 Ų | 118 | 52% | 0.521 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -77.5 | -31.4 | 176.3 | -73 | -165.6 | -60.2 | -93.3 | 2.1 | 113.4 | D311 K312 L313 F317 V318 | D311-R315 WeakPolarHBondContact O-CG 3.26Å; D311-R315 PolarHBondContact O-N 3.43Å; K312-R315 PolarHBondContact O-N 3.05Å; L313-R315 VanDerWaalsContact C-N 3.34Å; L313-R315 PolarHBondContact O-N 3.46Å; R315-F317 PolarHBondContact O-N 2.84Å; R315-V318 PolarHBondContact O-N 2.79Å; R315-V318 VanDerWaalsContact O-N 3.09Å |
| 316 | D | 48.8 | Very low | 41.2 | Very low | 120 Ų | 120 | 120 Ų | 120 | 64% | 0.642 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -64.3 | -22.8 | 177.9 | -67.4 | -16.2 | 0 | 0 | 0 | 112.2 | K312 L313 | K312-D316 PolarHBondContact O-N 3.14Å; L313-D316 PolarHBondContact O-N 3.31Å |
| 317 | F | 44.5 | Very low | 40 | Very low | 186 Ų | 186 | 121.7 Ų | 121.7 | 82% | 0.816 | 64% | 0.643 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.5 | -11 | 174.7 | -77.5 | -73.8 | 0 | 0 | 0 | 115.3 | L313 R315 | L313-F317 VanDerWaalsContact O-CD2 3.29Å; L313-F317 WeakPolarHBondContact O-CD2 3.19Å; R315-F317 PolarHBondContact O-N 2.84Å |
| 318 | V | 44.9 | Very low | 39 | Very low | 110 Ų | 110 | 120.3 Ų | 120.3 | 67% | 0.667 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.2 | -18.2 | -171.7 | -178.1 | 0 | 0 | 0 | 0 | 114.2 | R315 | R315-V318 PolarHBondContact O-N 2.79Å; R315-V318 VanDerWaalsContact O-N 3.09Å |
| 319 | N | 38.2 | Very low | 37.9 | Very low | 132 Ų | 132 | 122.1 Ų | 122.1 | 71% | 0.706 | 66% | 0.658 | S | S | * | * | trans | -112.5 | 45.2 | -169.3 | -93.7 | 0.5 | 0 | 0 | 0 | 116.5 | N321 | N319-N321 VanDerWaalsContact C-N 3.25Å; N319-N321 PolarHBondContact O-N 2.98Å | ||
| 320 | N | 38.1 | Very low | 36.9 | Very low | 153 Ų | 153 | 125.1 Ų | 125.1 | 82% | 0.818 | 68% | 0.675 | S | S | * | * | trans | -83.1 | 7.6 | 167.4 | -83.6 | -9.1 | 0 | 0 | 0 | 114.8 | ||||
| 321 | N | 32.4 | Very low | 36 | Very low | 142 Ų | 142 | 126.2 Ų | 126.2 | 76% | 0.759 | 69% | 0.687 | S | S | * | * | S | Bend | trans | -121.6 | 76.4 | 177.8 | -71.8 | -14.6 | 0 | 0 | 0 | 111.3 | N319 | N319-N321 VanDerWaalsContact C-N 3.25Å; N319-N321 PolarHBondContact O-N 2.98Å |
| 322 | Q | 32 | Very low | 34.8 | Very low | 173 Ų | 173 | 126.3 Ų | 126.3 | 81% | 0.808 | 70% | 0.7 | S | S | * | * | trans | 173 | 89.3 | 136.2 | -94.9 | 172.3 | 85 | 0 | 0 | 110.4 | T324 | Q322-T324 PolarHBondContact O-N 2.87Š| ||
| 323 | L | 26.7 | Very low | 33.7 | Very low | 167 Ų | 167 | 128.4 Ų | 128.4 | 87% | 0.874 | 72% | 0.716 | S | S | * | * | trans | -71.3 | 94.1 | 158.8 | 180 | 69.9 | 0 | 0 | 0 | 108 | ||||
| 324 | T | 27.8 | Very low | 32.7 | Very low | 112 Ų | 112 | 134.2 Ų | 134.2 | 69% | 0.687 | 74% | 0.738 | S | S | * | * | trans | -109.2 | 94.4 | 161 | 43.9 | 0 | 0 | 0 | 0 | 109.2 | Q322 T326 | Q322-T324 PolarHBondContact O-N 2.87Å; T324-T326 PolarHBondContact O-N 3.15Å | ||
| 325 | T | 24.4 | Very low | 31.8 | Very low | 104 Ų | 104 | 136.1 Ų | 136.1 | 64% | 0.638 | 75% | 0.749 | S | S | * | * | trans | -26.7 | 118.6 | 154.8 | -40.1 | 0 | 0 | 0 | 0 | 113.7 | T327 | T325-T327 VanDerWaalsContact CG2-OG1 3.27Å; T325-T327 WeakPolarHBondContact CG2-OG1 3.35Å | ||
| 326 | T | 24.7 | Very low | 30.7 | Very low | 138 Ų | 138 | 136 Ų | 136 | 85% | 0.847 | 76% | 0.764 | S | S | * | * | trans | -125 | 87.1 | 148 | -21.3 | 0 | 0 | 0 | 0 | 107.8 | T324 S328 | T324-T326 PolarHBondContact O-N 3.15Å; T326-S328 PolarHBondContact O-N 3.45Å | ||
| 327 | T | 23.9 | Very low | 29.5 | Very low | 97 Ų | 97 | 139.7 Ų | 139.7 | 60% | 0.595 | 77% | 0.77 | S | S | * | * | trans | -62.3 | 107.3 | 167.8 | -58.7 | 0 | 0 | 0 | 0 | 108.8 | T325 N329 | T325-T327 VanDerWaalsContact CG2-OG1 3.27Å; T325-T327 WeakPolarHBondContact CG2-OG1 3.35Å; T327-N329 WeakPolarHBondContact CG2-OD1 3.35Å | ||
| 328 | S | 26 | Very low | 28.6 | Very low | 105 Ų | 105 | 139.2 Ų | 139.2 | 73% | 0.734 | 77% | 0.768 | S | S | * | * | trans | -108.2 | 90.1 | 161.6 | 56.6 | 0 | 0 | 0 | 0 | 108.5 | T326 N330 | T326-S328 PolarHBondContact O-N 3.45Å; S328-N330 PolarHBondContact O-N 3.1Å | ||
| 329 | N | 24.8 | Very low | 27.7 | Very low | 133 Ų | 133 | 141.7 Ų | 141.7 | 71% | 0.711 | 77% | 0.772 | S | S | * | * | trans | -67.5 | 110.8 | 162.6 | -65.5 | -26.9 | 0 | 0 | 0 | 107.3 | T327 | T327-N329 WeakPolarHBondContact CG2-OD1 3.35Š| ||
| 330 | N | 28.9 | Very low | 27.2 | Very low | 158 Ų | 158 | 141.1 Ų | 141.1 | 85% | 0.845 | 77% | 0.769 | S | S | * | * | trans | -132.6 | 111.4 | 161.2 | -83.3 | -35.2 | 0 | 0 | 0 | 109.3 | S328 | S328-N330 PolarHBondContact O-N 3.1Š| ||
| 331 | T | 25.6 | Very low | 26.7 | Very low | 136 Ų | 136 | 140.1 Ų | 140.1 | 83% | 0.834 | 76% | 0.762 | S | S | * | * | trans | -56.1 | 150.9 | 175.1 | -48.6 | 0 | 0 | 0 | 0 | 111.4 | D333 | T331-D333 PolarHBondContact O-N 2.88Š| ||
| 332 | A | 24.7 | Very low | 26.5 | Very low | 87 Ų | 87 | 138.8 Ų | 138.8 | 72% | 0.719 | 76% | 0.76 | S | S | * | * | trans | -44.2 | 126.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 333 | D | 27.9 | Very low | 26.1 | Very low | 167 Ų | 167 | 138.7 Ų | 138.7 | 89% | 0.893 | 76% | 0.759 | S | S | * | * | trans | -149.4 | 121.1 | 145.7 | -96.7 | -34.1 | 0 | 0 | 0 | 111.4 | T331 A335 | T331-D333 PolarHBondContact O-N 2.88Å; D333-A335 PolarHBondContact O-N 3.31Å | ||
| 334 | K | 25.2 | Very low | 26 | Very low | 220 Ų | 220 | 138 Ų | 138 | 96% | 0.957 | 76% | 0.756 | S | S | * | * | trans | -82.7 | 83.8 | -177 | -133.6 | -178 | -174.3 | 179.5 | 0 | 107.7 | ||||
| 335 | A | 28.8 | Very low | 25.9 | Very low | 80 Ų | 80 | 141.1 Ų | 141.1 | 66% | 0.661 | 76% | 0.76 | S | S | * | * | trans | -154.8 | 104.5 | 171.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | D333 Y337 | D333-A335 PolarHBondContact O-N 3.31Å; A335-Y337 PolarHBondContact O-N 3.03Å; A335-Y337 VanDerWaalsContact O-N 3.11Å | ||
| 336 | T | 27.1 | Very low | 26 | Very low | 136 Ų | 136 | 143.5 Ų | 143.5 | 83% | 0.834 | 77% | 0.768 | S | S | * | * | trans | 30.1 | 71.2 | 139.7 | -41.7 | 0 | 0 | 0 | 0 | 116.8 | K338 | T336-K338 PolarHBondContact O-N 3.41Š| ||
| 337 | Y | 23.8 | Very low | 25.9 | Very low | 197 Ų | 197 | 141.8 Ų | 141.8 | 77% | 0.773 | 76% | 0.757 | S | S | * | * | trans | -85.7 | 91.4 | 168 | -156 | -98.5 | 0 | 0 | 0 | 109.8 | A335 Q339 | A335-Y337 PolarHBondContact O-N 3.03Å; A335-Y337 VanDerWaalsContact O-N 3.11Å; Y337-Q339 PolarHBondContact O-N 3.13Å | ||
| 338 | K | 25.6 | Very low | 25.9 | Very low | 176 Ų | 176 | 143 Ų | 143 | 77% | 0.765 | 77% | 0.77 | S | S | * | * | trans | -62.5 | 127.3 | 165.7 | -89.2 | -177.8 | 172.1 | -178.8 | 0 | 109.6 | T336 | T336-K338 PolarHBondContact O-N 3.41Š| ||
| 339 | Q | 26.2 | Very low | 25.9 | Very low | 162 Ų | 162 | 143.3 Ų | 143.3 | 76% | 0.757 | 77% | 0.772 | S | S | * | * | trans | 23.5 | 96.9 | 146.8 | -68.2 | -172.9 | -27.3 | 0 | 0 | 117.1 | Y337 | Y337-Q339 PolarHBondContact O-N 3.13Š| ||
| 340 | N | 26.5 | Very low | 25.8 | Very low | 121 Ų | 121 | 141.7 Ų | 141.7 | 65% | 0.647 | 77% | 0.771 | S | S | * | * | trans | -118.5 | 74.7 | 141.9 | -95.2 | -37.4 | 0 | 0 | 0 | 107.6 | T342 | N340-T342 PolarHBondContact O-N 2.84Å; N340-T342 VanDerWaalsContact O-N 3.09Å | ||
| 341 | I | 27.6 | Very low | 25.7 | Very low | 131 Ų | 131 | 140 Ų | 140 | 67% | 0.672 | 77% | 0.771 | S | S | * | * | trans | -76 | 86.9 | 159.7 | -63.8 | 171.8 | 0 | 0 | 0 | 104.7 | Q343 | I341-Q343 HydrophobicContact CG2-CG 4.32Å; I341-Q343 PolarHBondContact O-N 3.43Å | ||
| 342 | T | 27.8 | Very low | 25.7 | Very low | 115 Ų | 115 | 138.2 Ų | 138.2 | 71% | 0.706 | 77% | 0.771 | S | S | * | * | trans | -67.6 | 95.5 | 165.6 | -36 | 0 | 0 | 0 | 0 | 105.7 | N340 L344 | N340-T342 PolarHBondContact O-N 2.84Å; N340-T342 VanDerWaalsContact O-N 3.09Å; T342-L344 VanDerWaalsContact C-N 3.33Å; T342-L344 PolarHBondContact O-N 3.01Å | ||
| 343 | Q | 24.8 | Very low | 25.8 | Very low | 171 Ų | 171 | 138.1 Ų | 138.1 | 80% | 0.799 | 77% | 0.765 | S | S | * | * | trans | -55.4 | 99.6 | 170.9 | -70.6 | -177.2 | -1.8 | 0 | 0 | 107.7 | I341 K345 | I341-Q343 HydrophobicContact CG2-CG 4.32Å; I341-Q343 PolarHBondContact O-N 3.43Å; Q343-K345 PolarHBondContact O-N 2.72Å | ||
| 344 | L | 24.7 | Very low | 25.8 | Very low | 152 Ų | 152 | 135.5 Ų | 135.5 | 80% | 0.796 | 76% | 0.76 | S | S | * | * | trans | -66.8 | 94.7 | 164.8 | -117.6 | 104.7 | 0 | 0 | 0 | 106.2 | T342 L346 | T342-L344 VanDerWaalsContact C-N 3.33Å; T342-L344 PolarHBondContact O-N 3.01Å; L344-L346 PolarHBondContact O-N 3.46Å | ||
| 345 | K | 24.6 | Very low | 26.2 | Very low | 178 Ų | 178 | 134.2 Ų | 134.2 | 77% | 0.774 | 75% | 0.75 | S | S | * | * | trans | -65 | 82.4 | 174.2 | -174.4 | 178.6 | 180 | 177 | 0 | 108.3 | Q343 T347 | Q343-K345 PolarHBondContact O-N 2.72Å; K345-T347 HydrophobicContact CD-CG2 4.49Å; K345-T347 HydrophobicContact CG-CG2 4.11Å; K345-T347 PolarHBondContact O-N 3.33Å | ||
| 346 | L | 26.2 | Very low | 26.5 | Very low | 153 Ų | 153 | 136.3 Ų | 136.3 | 80% | 0.801 | 76% | 0.755 | S | S | * | * | trans | -72.6 | 89.4 | 164.7 | -79.6 | 160.1 | 0 | 0 | 0 | 106.8 | L344 S348 | L344-L346 PolarHBondContact O-N 3.46Å; L346-S348 PolarHBondContact O-N 2.86Å | ||
| 347 | T | 24.2 | Very low | 27.6 | Very low | 103 Ų | 103 | 133.9 Ų | 133.9 | 63% | 0.632 | 74% | 0.74 | S | S | * | * | trans | -57.3 | 117.4 | 170.4 | 41.4 | 0 | 0 | 0 | 0 | 109.1 | K345 S349 | K345-T347 HydrophobicContact CD-CG2 4.49Å; K345-T347 HydrophobicContact CG-CG2 4.11Å; K345-T347 PolarHBondContact O-N 3.33Å; T347-S349 VanDerWaalsContact C-N 3.3Å; T347-S349 PolarHBondContact O-N 3.47Å | ||
| 348 | S | 23.2 | Very low | 28.6 | Very low | 123 Ų | 123 | 129.6 Ų | 129.6 | 86% | 0.86 | 73% | 0.73 | S | S | * | * | trans | -57.2 | 86.8 | 169.2 | -42.6 | 0 | 0 | 0 | 0 | 110.3 | L346 S350 | L346-S348 PolarHBondContact O-N 2.86Å; S348-S350 PolarHBondContact O-N 3.19Å | ||
| 349 | S | 25.7 | Very low | 29.6 | Very low | 111 Ų | 111 | 129.8 Ų | 129.8 | 78% | 0.776 | 73% | 0.731 | S | S | * | * | trans | -80.9 | 96.6 | 162.3 | 54.9 | 0 | 0 | 0 | 0 | 107.6 | T347 | T347-S349 VanDerWaalsContact C-N 3.3Å; T347-S349 PolarHBondContact O-N 3.47Å | ||
| 350 | S | 23.8 | Very low | 30.6 | Very low | 98 Ų | 98 | 129.5 Ų | 129.5 | 69% | 0.685 | 73% | 0.73 | S | S | * | * | trans | -37.7 | 131 | 163.7 | 46.7 | 0 | 0 | 0 | 0 | 113.6 | S348 | S348-S350 PolarHBondContact O-N 3.19Š| ||
| 351 | S | 25.5 | Very low | 31.7 | Very low | 122 Ų | 122 | 129.4 Ų | 129.4 | 85% | 0.853 | 73% | 0.729 | S | S | * | * | trans | 62.8 | 72.9 | 138.8 | -42 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 352 | A | 26.7 | Very low | 32.7 | Very low | 100 Ų | 100 | 129.6 Ų | 129.6 | 83% | 0.826 | 73% | 0.727 | S | S | * | * | trans | -153.8 | 135.7 | 152.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 353 | S | 25.6 | Very low | 34.1 | Very low | 85 Ų | 85 | 129.1 Ų | 129.1 | 59% | 0.594 | 72% | 0.717 | S | S | * | * | trans | 93.1 | 69.3 | 155.8 | -164.9 | 0 | 0 | 0 | 0 | 118.3 | Y355 | S353-Y355 PolarHBondContact O-N 2.9Å; S353-Y355 VanDerWaalsContact OG-CD2 3.3Å; S353-Y355 WeakPolarHBondContact OG-CD2 3.41Å | ||
| 354 | S | 28.3 | Very low | 35.5 | Very low | 112 Ų | 112 | 123.7 Ų | 123.7 | 78% | 0.783 | 70% | 0.698 | S | S | * | * | trans | -68.5 | 53.6 | 156.8 | -46.8 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 355 | Y | 32.6 | Very low | 37.3 | Very low | 193 Ų | 193 | 122.9 Ų | 122.9 | 76% | 0.757 | 69% | 0.688 | S | S | * | * | trans | -124.8 | 38.3 | -175.3 | -58.7 | -62.5 | 0 | 0 | 0 | 115.2 | S353 | S353-Y355 PolarHBondContact O-N 2.9Å; S353-Y355 VanDerWaalsContact OG-CD2 3.3Å; S353-Y355 WeakPolarHBondContact OG-CD2 3.41Å | ||
| 356 | T | 36.2 | Very low | 39.2 | Very low | 124 Ų | 124 | 119.3 Ų | 119.3 | 76% | 0.761 | 68% | 0.677 | S | S | * | * | S | Bend | trans | -116.2 | -6.9 | 171.1 | 43 | 0 | 0 | 0 | 0 | 115.5 | ||
| 357 | T | 49 | Very low | 41.1 | Very low | 84 Ų | 84 | 115.8 Ų | 115.8 | 52% | 0.515 | 66% | 0.659 | S | S | . | * | S | Bend | trans | -92.4 | -12.3 | -172.8 | 44.8 | 0 | 0 | 0 | 0 | 116.5 | ||
| 358 | N | 46.2 | Very low | 42.9 | Very low | 108 Ų | 108 | 117 Ų | 117 | 58% | 0.578 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -80.2 | -37.2 | -174.3 | -72.8 | -17 | 0 | 0 | 0 | 114 | E360 L361 E362 | N358-E360 VanDerWaalsContact C-N 3.34Å; N358-E360 PolarHBondContact O-N 2.91Å; N358-L361 PolarHBondContact O-N 3.2Å; N358-E362 PolarHBondContact O-N 3.44Å |
| 359 | K | 46.1 | Very low | 44.8 | Very low | 179 Ų | 179 | 114.5 Ų | 114.5 | 78% | 0.778 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -67.3 | -34.8 | -178.5 | -74 | -172.1 | 176.3 | -177.9 | 0 | 112.8 | Q363 | K359-Q363 WeakPolarHBondContact O-CB 3.47Å; K359-Q363 PolarHBondContact O-N 3.16Å |
| 360 | E | 47 | Very low | 47.1 | Very low | 156 Ų | 156 | 112.4 Ų | 112.4 | 73% | 0.729 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -71 | -37.4 | -179.9 | -125.9 | 173.1 | -175.6 | 0 | 0 | 111.8 | N358 S364 | N358-E360 VanDerWaalsContact C-N 3.34Å; N358-E360 PolarHBondContact O-N 2.91Å; E360-S364 PolarHBondContact O-N 3.44Å; E360-S364 VanDerWaalsContact O-N 3.08Å |
| 361 | L | 49 | Very low | 49.2 | Very low | 120 Ų | 120 | 113 Ų | 113 | 63% | 0.628 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -70.1 | -40.2 | 174.5 | -71.9 | 173.4 | 0 | 0 | 0 | 112.2 | N358 S364 F365 | N358-L361 PolarHBondContact O-N 3.2Å; L361-S364 PolarHBondContact O-N 3.25Å; L361-F365 WeakPolarHBondContact O-CB 3.32Å; L361-F365 PolarHBondContact O-N 3.46Å |
| 362 | E | 50.3 | Low | 51.3 | Low | 134 Ų | 134 | 111.8 Ų | 111.8 | 63% | 0.626 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -64.2 | -40.2 | 175.3 | -77.3 | -177.8 | 170.5 | 0 | 0 | 112.1 | N358 F365 N366 | N358-E362 PolarHBondContact O-N 3.44Å; E362-F365 PolarHBondContact O-N 2.86Å; E362-N366 PolarHBondContact O-N 3.46Å |
| 363 | Q | 56.4 | Low | 53.7 | Low | 106 Ų | 106 | 111.6 Ų | 111.6 | 50% | 0.495 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.6 | -45.4 | 177.1 | -169.2 | 63 | 40.8 | 0 | 0 | 111.4 | K359 F365 N366 D367 | K359-Q363 WeakPolarHBondContact O-CB 3.47Å; K359-Q363 PolarHBondContact O-N 3.16Å; Q363-F365 VanDerWaalsContact C-N 3.27Å; Q363-F365 PolarHBondContact O-N 2.9Å; Q363-N366 PolarHBondContact O-N 2.87Å; Q363-D367 PolarHBondContact NE2-OD1 3.23Å; Q363-D367 VanDerWaalsContact NE2-OD1 3.08Å; Q363-D367 VanDerWaalsContact O-CG 3.24Å; Q363-D367 PolarHBondContact O-N 2.86Å |
| 364 | S | 53.2 | Low | 56.1 | Low | 57 Ų | 57 | 111.1 Ų | 111.1 | 40% | 0.399 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -60.2 | -37 | 176 | 179.2 | 0 | 0 | 0 | 0 | 112.5 | E360 L361 Q368 | E360-S364 PolarHBondContact O-N 3.44Å; E360-S364 VanDerWaalsContact O-N 3.08Å; L361-S364 PolarHBondContact O-N 3.25Å; S364-Q368 WeakPolarHBondContact O-CG 3.25Å; S364-Q368 PolarHBondContact O-N 2.69Å; S364-Q368 VanDerWaalsContact O-N 3.17Å |
| 365 | F | 63.4 | Low | 58 | Low | 135 Ų | 135 | 108.2 Ų | 108.2 | 59% | 0.592 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -70.3 | -41.3 | 177.8 | -171.3 | -97.1 | 0 | 0 | 0 | 111.7 | L361 E362 Q363 Q368 Q369 | L361-F365 WeakPolarHBondContact O-CB 3.32Å; L361-F365 PolarHBondContact O-N 3.46Å; E362-F365 PolarHBondContact O-N 2.86Å; Q363-F365 VanDerWaalsContact C-N 3.27Å; Q363-F365 PolarHBondContact O-N 2.9Å; F365-Q368 PolarHBondContact O-N 3Å; F365-Q369 WeakPolarHBondContact O-CB 3.45Å; F365-Q369 PolarHBondContact O-N 3.08Å |
| 366 | N | 65.1 | Low | 60.1 | Low | 102 Ų | 102 | 104.4 Ų | 104.4 | 55% | 0.545 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.8 | -42.1 | 175 | -99.4 | -19.8 | 0 | 0 | 0 | 112.5 | E362 Q363 Q369 S370 | E362-N366 PolarHBondContact O-N 3.46Å; Q363-N366 PolarHBondContact O-N 2.87Å; N366-Q369 PolarHBondContact O-N 3.03Å; N366-S370 WeakPolarHBondContact O-CB 3.21Å; N366-S370 PolarHBondContact O-N 3.22Å |
| 367 | D | 66.4 | Low | 62.3 | Low | 79 Ų | 79 | 104.2 Ų | 104.2 | 42% | 0.422 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.7 | -40.9 | 179.5 | -66.7 | -16.5 | 0 | 0 | 0 | 111 | Q363 S370 I371 | Q363-D367 PolarHBondContact NE2-OD1 3.23Å; Q363-D367 VanDerWaalsContact NE2-OD1 3.08Å; Q363-D367 VanDerWaalsContact O-CG 3.24Å; Q363-D367 PolarHBondContact O-N 2.86Å; D367-S370 PolarHBondContact O-N 3.09Å; D367-I371 WeakPolarHBondContact O-CD1 3.23Å; D367-I371 VanDerWaalsContact O-CG1 3.27Å; D367-I371 WeakPolarHBondContact O-CG1 3.42Å; D367-I371 PolarHBondContact O-N 3.2Å |
| 368 | Q | 60.3 | Low | 64 | Low | 128 Ų | 128 | 105 Ų | 105 | 60% | 0.598 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -63.6 | -42.9 | 174.8 | -75.3 | -178.3 | -11 | 0 | 0 | 112.5 | S364 F365 S370 I371 M372 | S364-Q368 WeakPolarHBondContact O-CG 3.25Å; S364-Q368 PolarHBondContact O-N 2.69Å; S364-Q368 VanDerWaalsContact O-N 3.17Å; F365-Q368 PolarHBondContact O-N 3Å; Q368-S370 VanDerWaalsContact C-N 3.34Å; Q368-I371 PolarHBondContact O-N 2.86Å; Q368-M372 PolarHBondContact O-N 2.99Å |
| 369 | Q | 64.4 | Low | 65.5 | Low | 71 Ų | 71 | 107.2 Ų | 107.2 | 33% | 0.332 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.8 | -38.1 | 177.3 | -169.5 | 64.2 | 48.8 | 0 | 0 | 111.8 | F365 N366 M372 N373 | F365-Q369 WeakPolarHBondContact O-CB 3.45Å; F365-Q369 PolarHBondContact O-N 3.08Å; N366-Q369 PolarHBondContact O-N 3.03Å; Q369-M372 PolarHBondContact O-N 3.08Å; Q369-N373 PolarHBondContact NE2-OD1 3.47Å; Q369-N373 VanDerWaalsContact O-CG 3.3Å; Q369-N373 PolarHBondContact O-N 3.31Å |
| 370 | S | 73 | Confident | 67.2 | Low | 68 Ų | 68 | 104.6 Ų | 104.6 | 48% | 0.476 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 175.6 | -177.6 | 0 | 0 | 0 | 0 | 112.4 | N366 D367 Q368 M372 N373 T374 | N366-S370 WeakPolarHBondContact O-CB 3.21Å; N366-S370 PolarHBondContact O-N 3.22Å; D367-S370 PolarHBondContact O-N 3.09Å; Q368-S370 VanDerWaalsContact C-N 3.34Å; S370-M372 PolarHBondContact O-N 2.86Å; S370-N373 PolarHBondContact O-N 2.87Å; S370-T374 WeakPolarHBondContact O-CB 3.39Å; S370-T374 PolarHBondContact O-N 2.97Å; S370-T374 PolarHBondContact O-OG1 2.86Å |
| 371 | I | 68.4 | Low | 68.7 | Low | 110 Ų | 110 | 104.5 Ų | 104.5 | 56% | 0.564 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -64.1 | -41.8 | 176.7 | -67.8 | 164.1 | 0 | 0 | 0 | 110.7 | D367 Q368 T374 T375 | D367-I371 WeakPolarHBondContact O-CD1 3.23Å; D367-I371 VanDerWaalsContact O-CG1 3.27Å; D367-I371 WeakPolarHBondContact O-CG1 3.42Å; D367-I371 PolarHBondContact O-N 3.2Å; Q368-I371 PolarHBondContact O-N 2.86Å; I371-T374 PolarHBondContact O-N 3.2Å; I371-T375 WeakPolarHBondContact O-CB 3.48Å; I371-T375 PolarHBondContact O-N 3.13Å; I371-T375 PolarHBondContact O-OG1 2.86Å |
| 372 | M | 68.7 | Low | 70 | Confident | 97 Ų | 97 | 102.9 Ų | 102.9 | 48% | 0.478 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 177.6 | -175.7 | 166.2 | 61.7 | 0 | 0 | 111.7 | Q368 Q369 S370 T374 T375 Q376 | Q368-M372 PolarHBondContact O-N 2.99Å; Q369-M372 PolarHBondContact O-N 3.08Å; S370-M372 PolarHBondContact O-N 2.86Å; M372-T374 PolarHBondContact O-N 3.43Å; M372-T375 PolarHBondContact O-N 2.9Å; M372-Q376 WeakPolarHBondContact O-CG 3.47Å; M372-Q376 PolarHBondContact O-N 3.04Å |
| 373 | N | 78.1 | Confident | 71.2 | Confident | 95 Ų | 95 | 99.6 Ų | 99.6 | 51% | 0.508 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.5 | -43.3 | 177.7 | -71.9 | -13.1 | 0 | 0 | 0 | 111.9 | Q369 S370 T375 Q376 F377 | Q369-N373 PolarHBondContact NE2-OD1 3.47Å; Q369-N373 VanDerWaalsContact O-CG 3.3Å; Q369-N373 PolarHBondContact O-N 3.31Å; S370-N373 PolarHBondContact O-N 2.87Å; N373-T375 VanDerWaalsContact C-N 3.33Å; N373-T375 PolarHBondContact O-N 2.65Å; N373-Q376 PolarHBondContact O-N 3.38Å; N373-F377 WeakPolarHBondContact O-CB 3.4Å; N373-F377 PolarHBondContact O-N 3.12Å |
| 374 | T | 75 | Confident | 72.2 | Confident | 75 Ų | 75 | 98.9 Ų | 98.9 | 46% | 0.46 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64 | -40.2 | 178.5 | -54.9 | 0 | 0 | 0 | 0 | 111.5 | S370 I371 M372 F377 L378 | S370-T374 WeakPolarHBondContact O-CB 3.39Å; S370-T374 PolarHBondContact O-N 2.97Å; S370-T374 PolarHBondContact O-OG1 2.86Å; I371-T374 PolarHBondContact O-N 3.2Å; M372-T374 PolarHBondContact O-N 3.43Å; T374-F377 PolarHBondContact O-N 2.98Å; T374-L378 HydrophobicContact CG2-CD1 4.2Å; T374-L378 WeakPolarHBondContact O-CG 3.46Å; T374-L378 PolarHBondContact O-N 2.73Å |
| 375 | T | 70 | Confident | 72.8 | Confident | 51 Ų | 51 | 98.6 Ų | 98.6 | 31% | 0.313 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -66.9 | -41.4 | 178.8 | -54.3 | 0 | 0 | 0 | 0 | 111.5 | I371 M372 N373 L378 R379 | I371-T375 WeakPolarHBondContact O-CB 3.48Å; I371-T375 PolarHBondContact O-N 3.13Å; I371-T375 PolarHBondContact O-OG1 2.86Å; M372-T375 PolarHBondContact O-N 2.9Å; N373-T375 VanDerWaalsContact C-N 3.33Å; N373-T375 PolarHBondContact O-N 2.65Å; T375-L378 PolarHBondContact O-N 2.92Å; T375-R379 WeakPolarHBondContact O-CG 2.91Å; T375-R379 PolarHBondContact O-N 3.34Å |
| 376 | Q | 76.8 | Confident | 73 | Confident | 114 Ų | 114 | 97.8 Ų | 97.8 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65 | -42.8 | 175.7 | -69.2 | -68 | 9.5 | 0 | 0 | 111.7 | M372 N373 L378 R379 Q380 | M372-Q376 WeakPolarHBondContact O-CG 3.47Å; M372-Q376 PolarHBondContact O-N 3.04Å; N373-Q376 PolarHBondContact O-N 3.38Å; Q376-L378 PolarHBondContact O-N 3.22Å; Q376-R379 PolarHBondContact O-N 3.21Å; Q376-Q380 PolarHBondContact O-N 2.73Å |
| 377 | F | 82.4 | Confident | 73.1 | Confident | 120 Ų | 120 | 99.4 Ų | 99.4 | 53% | 0.526 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.8 | -42.6 | 176 | -179 | -102.7 | 0 | 0 | 0 | 112.5 | N373 T374 Q380 R381 | N373-F377 WeakPolarHBondContact O-CB 3.4Å; N373-F377 PolarHBondContact O-N 3.12Å; T374-F377 PolarHBondContact O-N 2.98Å; F377-Q380 PolarHBondContact O-N 3.49Å; F377-R381 HydrophobicContact CE1-CG 4.19Å; F377-R381 HydrophobicContact CE2-CG 4.48Å; F377-R381 HydrophobicContact CZ-CG 4.13Å; F377-R381 PolarHBondContact O-N 3.31Å |
| 378 | L | 82.9 | Confident | 72.8 | Confident | 100 Ų | 100 | 102.6 Ų | 102.6 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.2 | -41 | 176.1 | -72.7 | 170.2 | 0 | 0 | 0 | 112 | T374 T375 Q376 R381 V382 | T374-L378 HydrophobicContact CG2-CD1 4.2Å; T374-L378 WeakPolarHBondContact O-CG 3.46Å; T374-L378 PolarHBondContact O-N 2.73Å; T375-L378 PolarHBondContact O-N 2.92Å; Q376-L378 PolarHBondContact O-N 3.22Å; L378-R381 PolarHBondContact O-N 2.99Å; L378-V382 VanDerWaalsContact O-CG2 3.26Å; L378-V382 WeakPolarHBondContact O-CG2 3.47Å; L378-V382 PolarHBondContact O-N 2.69Å |
| 379 | R | 79.1 | Confident | 72.4 | Confident | 155 Ų | 155 | 103.3 Ų | 103.3 | 59% | 0.585 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61 | -46.5 | 174.2 | -72.5 | -177.2 | -146 | -88 | 1.2 | 111.3 | T375 Q376 R381 V382 T383 | T375-R379 WeakPolarHBondContact O-CG 2.91Å; T375-R379 PolarHBondContact O-N 3.34Å; Q376-R379 PolarHBondContact O-N 3.21Å; R379-R381 PolarHBondContact O-N 3.27Å; R379-V382 PolarHBondContact O-N 2.85Å; R379-T383 PolarHBondContact O-N 2.92Å; R379-T383 PolarHBondContact O-OG1 3.13Å; R379-T383 VanDerWaalsContact O-OG1 3.04Å |
| 380 | Q | 80.6 | Confident | 71.6 | Confident | 123 Ų | 123 | 111.6 Ų | 111.6 | 58% | 0.575 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -55 | -50.6 | 176.7 | -172.9 | 95.5 | 29.7 | 0 | 0 | 111.2 | Q376 F377 V382 T383 E384 | Q376-Q380 PolarHBondContact O-N 2.73Å; F377-Q380 PolarHBondContact O-N 3.49Å; Q380-V382 VanDerWaalsContact C-N 3.34Å; Q380-V382 PolarHBondContact O-N 3.11Å; Q380-T383 PolarHBondContact O-N 3.28Å; Q380-E384 WeakPolarHBondContact O-CG 3.08Å; Q380-E384 PolarHBondContact O-N 2.98Å |
| 381 | R | 79.7 | Confident | 71.5 | Confident | 155 Ų | 155 | 113.8 Ų | 113.8 | 59% | 0.585 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65.1 | -35.7 | 179.5 | -69.5 | -161.9 | 97.4 | 169.5 | 9.4 | 113.4 | F377 L378 R379 A385 | F377-R381 HydrophobicContact CE1-CG 4.19Å; F377-R381 HydrophobicContact CE2-CG 4.48Å; F377-R381 HydrophobicContact CZ-CG 4.13Å; F377-R381 PolarHBondContact O-N 3.31Å; L378-R381 PolarHBondContact O-N 2.99Å; R379-R381 PolarHBondContact O-N 3.27Å; R381-A385 VanDerWaalsContact O-CB 3.25Å; R381-A385 WeakPolarHBondContact O-CB 3.31Å; R381-A385 PolarHBondContact O-N 3.09Å |
| 382 | V | 77 | Confident | 71.7 | Confident | 85 Ų | 85 | 114 Ų | 114 | 52% | 0.515 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -66 | -42.4 | 175.6 | 170.1 | 0 | 0 | 0 | 0 | 110 | L378 R379 Q380 A385 M386 | L378-V382 VanDerWaalsContact O-CG2 3.26Å; L378-V382 WeakPolarHBondContact O-CG2 3.47Å; L378-V382 PolarHBondContact O-N 2.69Å; R379-V382 PolarHBondContact O-N 2.85Å; Q380-V382 VanDerWaalsContact C-N 3.34Å; Q380-V382 PolarHBondContact O-N 3.11Å; V382-A385 PolarHBondContact O-N 3.2Å; V382-M386 WeakPolarHBondContact O-CG 3.1Å; V382-M386 PolarHBondContact O-N 3.49Å |
| 383 | T | 74.7 | Confident | 71.9 | Confident | 65 Ų | 65 | 114.9 Ų | 114.9 | 40% | 0.399 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -62.9 | -48.2 | 175.8 | -54.9 | 0 | 0 | 0 | 0 | 111.6 | R379 Q380 A385 M386 E387 | R379-T383 PolarHBondContact O-N 2.92Å; R379-T383 PolarHBondContact O-OG1 3.13Å; R379-T383 VanDerWaalsContact O-OG1 3.04Å; Q380-T383 PolarHBondContact O-N 3.28Å; T383-A385 VanDerWaalsContact C-N 3.3Å; T383-A385 PolarHBondContact O-N 3.39Å; T383-M386 PolarHBondContact O-N 3.22Å; T383-E387 PolarHBondContact O-N 3.37Å |
| 384 | E | 77.6 | Confident | 71.5 | Confident | 92 Ų | 92 | 116.1 Ų | 116.1 | 43% | 0.43 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -59.3 | -39.3 | 176 | -73.3 | 170.8 | -169.4 | 0 | 0 | 112.1 | Q380 M386 E387 L388 | Q380-E384 WeakPolarHBondContact O-CG 3.08Å; Q380-E384 PolarHBondContact O-N 2.98Å; E384-M386 VanDerWaalsContact C-N 3.32Å; E384-M386 PolarHBondContact O-N 3.25Å; E384-E387 PolarHBondContact O-N 3.29Å; E384-L388 WeakPolarHBondContact O-CB 3.39Å; E384-L388 PolarHBondContact O-N 3.37Å |
| 385 | A | 64.7 | Low | 71.3 | Confident | 50 Ų | 50 | 118.7 Ų | 118.7 | 41% | 0.413 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -70.5 | -27.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | R381 V382 T383 N389 | R381-A385 VanDerWaalsContact O-CB 3.25Å; R381-A385 WeakPolarHBondContact O-CB 3.31Å; R381-A385 PolarHBondContact O-N 3.09Å; V382-A385 PolarHBondContact O-N 3.2Å; T383-A385 VanDerWaalsContact C-N 3.3Å; T383-A385 PolarHBondContact O-N 3.39Å; A385-N389 PolarHBondContact O-ND2 3.17Å |
| 386 | M | 68.5 | Low | 71.4 | Confident | 118 Ų | 118 | 123.2 Ų | 123.2 | 58% | 0.581 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -76.6 | -39.9 | 171.9 | -71.2 | -164.4 | -49.3 | 0 | 0 | 111.4 | V382 T383 E384 L388 N389 | V382-M386 WeakPolarHBondContact O-CG 3.1Å; V382-M386 PolarHBondContact O-N 3.49Å; T383-M386 PolarHBondContact O-N 3.22Å; E384-M386 VanDerWaalsContact C-N 3.32Å; E384-M386 PolarHBondContact O-N 3.25Å; M386-L388 VanDerWaalsContact C-N 3.34Å; M386-N389 PolarHBondContact O-N 3.48Å |
| 387 | E | 67.4 | Low | 71 | Confident | 137 Ų | 137 | 123.9 Ų | 123.9 | 64% | 0.64 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -66.5 | -33.5 | 176.5 | -73.7 | -178.3 | 179.4 | 0 | 0 | 112.4 | T383 E384 N389 F390 | T383-E387 PolarHBondContact O-N 3.37Å; E384-E387 PolarHBondContact O-N 3.29Å; E387-N389 VanDerWaalsContact C-N 3.28Å; E387-N389 PolarHBondContact O-N 3.26Å; E387-F390 PolarHBondContact O-N 3.16Å; E387-F390 VanDerWaalsContact O-OXT 3.07Å |
| 388 | L | 59.7 | Low | 70.1 | Confident | 145 Ų | 145 | 124.2 Ų | 124.2 | 76% | 0.759 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.7 | -12 | 175.5 | -83.3 | 163.1 | 0 | 0 | 0 | 114.6 | E384 M386 | E384-L388 WeakPolarHBondContact O-CB 3.39Å; E384-L388 PolarHBondContact O-N 3.37Å; M386-L388 VanDerWaalsContact C-N 3.34Å |
| 389 | N | 52.7 | Low | 69 | Low | 143 Ų | 143 | 126.2 Ų | 126.2 | 77% | 0.765 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.4 | 3 | 177.1 | -81.4 | -56 | 0 | 0 | 0 | 113.3 | A385 M386 E387 | A385-N389 PolarHBondContact O-ND2 3.17Å; M386-N389 PolarHBondContact O-N 3.48Å; E387-N389 VanDerWaalsContact C-N 3.28Å; E387-N389 PolarHBondContact O-N 3.26Å |
| 390 | F | 46.7 | Very low | 68.1 | Low | 246 Ų | 246 | 123.5 Ų | 123.5 | 100% | 1.079 | 61% | 0.613 | S | S | * | * | trans | -112.6 | 0 | 166.6 | -85.4 | -83.1 | 0 | 0 | 0 | 109.3 | E387 | E387-F390 PolarHBondContact O-N 3.16Å; E387-F390 VanDerWaalsContact O-OXT 3.07Å |
Retrieved 390 of 390 residues in 248.7 ms
(Link to these results)