| 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 | 49.2 | Very low | 54.5 | Low | 159 Ų | 159 | 98.9 Ų | 98.9 | 78% | 0.783 | 58% | 0.575 | S | S | * | * | 0 | -22.5 | 0 | -63.9 | -123.7 | -101.9 | 0 | 0 | 114.6 | L66 | M1-L66 HydrophobicContact CE-CD1 3.51Š| |||
| 2 | K | 41.2 | Very low | 54.8 | Low | 127 Ų | 127 | 104.1 Ų | 104.1 | 55% | 0.552 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -75.7 | -23.7 | 173.8 | -64.4 | -175.9 | 179.8 | -177.7 | 0 | 114.5 | ||
| 3 | A | 53.4 | Low | 54.7 | Low | 74 Ų | 74 | 106.5 Ų | 106.5 | 61% | 0.612 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -74 | -26.2 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | T7 | A3-T7 WeakPolarHBondContact O-CB 3.5Å; A3-T7 WeakPolarHBondContact O-CG2 3.36Å; A3-T7 PolarHBondContact O-N 3.4Å; A3-T7 VanDerWaalsContact O-N 3.14Å; A3-T7 PolarHBondContact O-OG1 3Å |
| 4 | A | 56.2 | Low | 55 | Low | 59 Ų | 59 | 105 Ų | 105 | 49% | 0.488 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -77.2 | -32.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 113 | T7 L8 | A4-T7 WeakPolarHBondContact CA-OG1 3.19Å; A4-T7 PolarHBondContact O-OG1 3.42Å; A4-L8 PolarHBondContact O-N 2.94Å |
| 5 | V | 54.9 | Low | 54.3 | Low | 110 Ų | 110 | 101.6 Ų | 101.6 | 67% | 0.667 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -79.3 | -34.8 | 178.3 | -178.5 | 0 | 0 | 0 | 0 | 111.1 | L8 A9 | V5-L8 PolarHBondContact O-N 2.88Å; V5-A9 PolarHBondContact O-N 3.28Å; V5-A9 VanDerWaalsContact O-N 3.15Å |
| 6 | L | 54.1 | Low | 54.1 | Low | 119 Ų | 119 | 100.8 Ų | 100.8 | 62% | 0.623 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.5 | -34.1 | 175 | -84 | 163.3 | 0 | 0 | 0 | 112.7 | V10 | L6-V10 VanDerWaalsContact O-CG2 3.28Å; L6-V10 WeakPolarHBondContact O-CG2 3.38Å; L6-V10 PolarHBondContact O-N 3.06Å; L6-V10 VanDerWaalsContact O-N 3.12Å |
| 7 | T | 60.1 | Low | 53.7 | Low | 82 Ų | 82 | 103.9 Ų | 103.9 | 50% | 0.503 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -69.9 | -34.2 | 174.3 | 41.6 | 0 | 0 | 0 | 0 | 112.4 | A3 A4 L11 | A3-T7 WeakPolarHBondContact O-CB 3.5Å; A3-T7 WeakPolarHBondContact O-CG2 3.36Å; A3-T7 PolarHBondContact O-N 3.4Å; A3-T7 VanDerWaalsContact O-N 3.14Å; A3-T7 PolarHBondContact O-OG1 3Å; A4-T7 WeakPolarHBondContact CA-OG1 3.19Å; A4-T7 PolarHBondContact O-OG1 3.42Å; T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 PolarHBondContact O-N 3.45Å |
| 8 | L | 54 | Low | 53.4 | Low | 108 Ų | 108 | 101.9 Ų | 101.9 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -70.4 | -36.2 | 176.1 | -126.6 | 136.7 | 0 | 0 | 0 | 112.6 | A4 V5 F12 | A4-L8 PolarHBondContact O-N 2.94Å; V5-L8 PolarHBondContact O-N 2.88Å; L8-F12 HydrophobicContact CD2-CD2 4.3Å; L8-F12 HydrophobicContact CD2-CE2 4.09Å; L8-F12 WeakPolarHBondContact O-CD2 3.2Å; L8-F12 PolarHBondContact O-N 2.98Å |
| 9 | A | 59.1 | Low | 53 | Low | 49 Ų | 49 | 109.4 Ų | 109.4 | 41% | 0.405 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -70.3 | -37.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V5 F12 L13 | V5-A9 PolarHBondContact O-N 3.28Å; V5-A9 VanDerWaalsContact O-N 3.15Å; A9-F12 PolarHBondContact O-N 3.42Å; A9-L13 PolarHBondContact O-N 3.13Å |
| 10 | V | 59.7 | Low | 52.9 | Low | 86 Ų | 86 | 113.2 Ų | 113.2 | 52% | 0.521 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -69.8 | -33.9 | 175.5 | 174.4 | 0 | 0 | 0 | 0 | 111.5 | L6 L13 T14 | L6-V10 VanDerWaalsContact O-CG2 3.28Å; L6-V10 WeakPolarHBondContact O-CG2 3.38Å; L6-V10 PolarHBondContact O-N 3.06Å; L6-V10 VanDerWaalsContact O-N 3.12Å; V10-L13 PolarHBondContact O-N 2.87Å; V10-T14 HydrophobicContact CG1-CG2 4.1Å; V10-T14 WeakPolarHBondContact O-CB 3.43Å; V10-T14 WeakPolarHBondContact O-CG2 3.4Å; V10-T14 PolarHBondContact O-N 2.69Å; V10-T14 PolarHBondContact O-OG1 3.23Å |
| 11 | L | 58.1 | Low | 52.6 | Low | 115 Ų | 115 | 116.3 Ų | 116.3 | 60% | 0.602 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -65.8 | -34.9 | 175 | -103.8 | 153.5 | 0 | 0 | 0 | 113.3 | T7 G15 | T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 PolarHBondContact O-N 3.45Å; L11-G15 PolarHBondContact O-N 2.92Å |
| 12 | F | 57.7 | Low | 52.5 | Low | 161 Ų | 161 | 119.8 Ų | 119.8 | 71% | 0.706 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -75.2 | -31.6 | 175.6 | -93.9 | -90 | 0 | 0 | 0 | 113.3 | L8 A9 | L8-F12 HydrophobicContact CD2-CD2 4.3Å; L8-F12 HydrophobicContact CD2-CE2 4.09Å; L8-F12 WeakPolarHBondContact O-CD2 3.2Å; L8-F12 PolarHBondContact O-N 2.98Å; A9-F12 PolarHBondContact O-N 3.42Å |
| 13 | L | 53.9 | Low | 52.7 | Low | 135 Ų | 135 | 122.9 Ų | 122.9 | 71% | 0.707 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -82.2 | -27.4 | 177.2 | -89.4 | 140.4 | 0 | 0 | 0 | 113.5 | A9 V10 | A9-L13 PolarHBondContact O-N 3.13Å; V10-L13 PolarHBondContact O-N 2.87Å |
| 14 | T | 57.8 | Low | 52.1 | Low | 86 Ų | 86 | 127.3 Ų | 127.3 | 53% | 0.528 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -89.9 | -20.8 | 175.1 | 54.1 | 0 | 0 | 0 | 0 | 113.2 | V10 | V10-T14 HydrophobicContact CG1-CG2 4.1Å; V10-T14 WeakPolarHBondContact O-CB 3.43Å; V10-T14 WeakPolarHBondContact O-CG2 3.4Å; V10-T14 PolarHBondContact O-N 2.69Å; V10-T14 PolarHBondContact O-OG1 3.23Å |
| 15 | G | 44.7 | Very low | 51.4 | Low | 54 Ų | 54 | 131.6 Ų | 131.6 | 56% | 0.557 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.1 | -19.5 | 176 | 0 | 0 | 0 | 0 | 0 | 115.3 | L11 | L11-G15 PolarHBondContact O-N 2.92Š|
| 16 | S | 51.8 | Low | 51.3 | Low | 89 Ų | 89 | 135.2 Ų | 135.2 | 62% | 0.622 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.4 | -12 | -179.8 | 77.8 | 0 | 0 | 0 | 0 | 114.5 | ||
| 17 | Q | 46.8 | Very low | 51.4 | Low | 153 Ų | 153 | 134.8 Ų | 134.8 | 72% | 0.715 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -101.4 | -8 | -179.7 | -68.2 | -73.2 | -4.6 | 0 | 0 | 113.8 | R19 | Q17-R19 PolarHBondContact O-N 3.49Š|
| 18 | A | 47.9 | Very low | 50.9 | Low | 69 Ų | 69 | 137.1 Ų | 137.1 | 57% | 0.57 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.6 | -4.3 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 19 | R | 47.5 | Very low | 50.9 | Low | 243 Ų | 243 | 138.4 Ų | 138.4 | 92% | 0.917 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.4 | -4.9 | -174.5 | -151.8 | 172 | -174 | 162.7 | 2 | 114.6 | Q17 | Q17-R19 PolarHBondContact O-N 3.49Š|
| 20 | H | 50.9 | Low | 50.9 | Low | 186 Ų | 186 | 138.8 Ų | 138.8 | 86% | 0.861 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -108.1 | -0.9 | -172.2 | -134.4 | -68.9 | 0 | 0 | 0 | 115.3 | ||
| 21 | F | 46.6 | Very low | 50.8 | Low | 179 Ų | 179 | 139.7 Ų | 139.7 | 79% | 0.785 | 72% | 0.717 | S | S | * | * | S | Bend | trans | -114.9 | -6 | -169.2 | -157 | -98.2 | 0 | 0 | 0 | 116.4 | ||
| 22 | W | 45.6 | Very low | 50.8 | Low | 232 Ų | 232 | 142.3 Ų | 142.3 | 88% | 0.879 | 72% | 0.719 | S | S | * | * | trans | -110 | 45.6 | -174.1 | -87.4 | 81.9 | 0 | 0 | 0 | 114.3 | ||||
| 23 | Q | 46.4 | Very low | 51.4 | Low | 191 Ų | 191 | 139.7 Ų | 139.7 | 89% | 0.893 | 71% | 0.713 | S | S | * | * | trans | -89.7 | 87.8 | 159.6 | -85.4 | -179.4 | -11 | 0 | 0 | 109 | ||||
| 24 | Q | 39.8 | Very low | 51.7 | Low | 167 Ų | 167 | 140 Ų | 140 | 78% | 0.78 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -165.9 | 114.3 | 154.5 | -111.2 | 162.9 | -4.4 | 0 | 0 | 110 | ||
| 25 | D | 42.5 | Very low | 52.3 | Low | 149 Ų | 149 | 139.6 Ų | 139.6 | 80% | 0.797 | 70% | 0.701 | S | S | * | * | trans | 49.5 | 90.9 | 151.9 | -67 | -58.2 | 0 | 0 | 0 | 119 | ||||
| 26 | E | 52.2 | Low | 53.6 | Low | 187 Ų | 187 | 142.7 Ų | 142.7 | 87% | 0.874 | 70% | 0.7 | S | S | * | * | trans | -173.8 | 144.2 | 138.3 | -103.6 | 172.4 | 170.1 | 0 | 0 | 111.1 | ||||
| 27 | P | 55.6 | Low | 54.6 | Low | 109 Ų | 109 | 143.8 Ų | 143.8 | 71% | 0.708 | 70% | 0.699 | S | S | * | * | trans | -66.5 | 147.8 | -167.7 | 25.5 | -32.2 | 0 | 0 | 0 | 113.1 | Q29 | P27-Q29 PolarHBondContact O-N 3.44Š| ||
| 28 | P | 50.2 | Low | 55.6 | Low | 131 Ų | 131 | 142.2 Ų | 142.2 | 85% | 0.851 | 69% | 0.694 | S | S | * | * | trans | -73.7 | 101.4 | -159.3 | 29 | -34.1 | 0 | 0 | 0 | 112.2 | S30 | P28-S30 PolarHBondContact O-N 3.01Š| ||
| 29 | Q | 53.8 | Low | 56.8 | Low | 135 Ų | 135 | 141.2 Ų | 141.2 | 63% | 0.631 | 69% | 0.686 | S | S | * | * | trans | -68.6 | 121.4 | 156.9 | -75.1 | -174.3 | -33.8 | 0 | 0 | 109.2 | P27 P31 R34 | P27-Q29 PolarHBondContact O-N 3.44Å; Q29-P31 VanDerWaalsContact O-N 3.1Å; Q29-R34 VanDerWaalsContact OE1-NH2 3.14Å | ||
| 30 | S | 58.9 | Low | 57.9 | Low | 58 Ų | 58 | 133.6 Ų | 133.6 | 41% | 0.406 | 67% | 0.667 | S | S | . | * | trans | 20.2 | 81.1 | 136.7 | 176 | 0 | 0 | 0 | 0 | 116.5 | P28 W32 D33 R34 | P28-S30 PolarHBondContact O-N 3.01Å; S30-W32 PolarHBondContact O-N 3.02Å; S30-D33 PolarHBondContact O-N 3.39Å; S30-R34 PolarHBondContact O-N 3.03Å | ||
| 31 | P | 58.2 | Low | 58.9 | Low | 104 Ų | 104 | 128.9 Ų | 128.9 | 68% | 0.675 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -56.2 | -17.8 | 177.8 | 21.1 | -32.3 | 0 | 0 | 0 | 112.4 | Q29 V35 | Q29-P31 VanDerWaalsContact O-N 3.1Å; P31-V35 WeakPolarHBondContact O-CG2 3.4Å |
| 32 | W | 59.1 | Low | 59.6 | Low | 170 Ų | 170 | 128.7 Ų | 128.7 | 64% | 0.644 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -82.4 | -32.2 | 176 | -143 | -138.6 | 0 | 0 | 0 | 114.9 | S30 V35 K36 | S30-W32 PolarHBondContact O-N 3.02Å; W32-V35 HydrophobicContact CE3-CB 4.39Å; W32-V35 HydrophobicContact CZ3-CG1 4.23Å; W32-K36 WeakPolarHBondContact O-CB 3.39Å; W32-K36 WeakPolarHBondContact O-CG 3.47Å; W32-K36 PolarHBondContact O-N 3.41Å |
| 33 | D | 69.5 | Low | 60.6 | Low | 106 Ų | 106 | 122 Ų | 122 | 57% | 0.567 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -71.1 | -40.3 | 178 | -76.5 | -73.2 | 0 | 0 | 0 | 111.2 | S30 V35 K36 D37 | S30-D33 PolarHBondContact O-N 3.39Å; D33-V35 VanDerWaalsContact C-N 3.35Å; D33-V35 PolarHBondContact O-N 2.91Å; D33-K36 PolarHBondContact O-N 2.66Å; D33-D37 PolarHBondContact O-N 3.06Å |
| 34 | R | 60.9 | Low | 61.7 | Low | 143 Ų | 143 | 117.2 Ų | 117.2 | 54% | 0.54 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.5 | -33.9 | 178.9 | -149.1 | 177.1 | -73.4 | 176.7 | -6.9 | 112.5 | Q29 S30 L38 | Q29-R34 VanDerWaalsContact OE1-NH2 3.14Å; S30-R34 PolarHBondContact O-N 3.03Å; R34-L38 WeakPolarHBondContact O-CB 3.27Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 3.24Å; R34-L38 VanDerWaalsContact O-N 3.13Å |
| 35 | V | 69.9 | Low | 63 | Low | 76 Ų | 76 | 113.4 Ų | 113.4 | 46% | 0.461 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -71 | -39.5 | 173.9 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | P31 W32 D33 A39 | P31-V35 WeakPolarHBondContact O-CG2 3.4Å; W32-V35 HydrophobicContact CE3-CB 4.39Å; W32-V35 HydrophobicContact CZ3-CG1 4.23Å; D33-V35 VanDerWaalsContact C-N 3.35Å; D33-V35 PolarHBondContact O-N 2.91Å; V35-A39 WeakPolarHBondContact O-CB 3.4Å; V35-A39 PolarHBondContact O-N 3.26Å |
| 36 | K | 71.8 | Confident | 63.9 | Low | 120 Ų | 120 | 111.9 Ų | 111.9 | 52% | 0.522 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.1 | -43.3 | 175.7 | -80.3 | 179.7 | 178.2 | -179.7 | 0 | 112 | W32 D33 A39 T40 | W32-K36 WeakPolarHBondContact O-CB 3.39Å; W32-K36 WeakPolarHBondContact O-CG 3.47Å; W32-K36 PolarHBondContact O-N 3.41Å; D33-K36 PolarHBondContact O-N 2.66Å; K36-A39 PolarHBondContact O-N 2.68Å; K36-T40 WeakPolarHBondContact O-CB 3.14Å; K36-T40 PolarHBondContact O-N 3.49Å; K36-T40 PolarHBondContact O-OG1 3Å |
| 37 | D | 72 | Confident | 64.4 | Low | 112 Ų | 112 | 110.4 Ų | 110.4 | 60% | 0.599 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.6 | -46.1 | 179.7 | -148.2 | -94.5 | 0 | 0 | 0 | 110.9 | D33 A39 T40 V41 | D33-D37 PolarHBondContact O-N 3.06Å; D37-A39 PolarHBondContact O-N 2.93Å; D37-T40 PolarHBondContact O-N 2.86Å; D37-V41 WeakPolarHBondContact O-CG2 3.49Å; D37-V41 PolarHBondContact O-N 3.45Å |
| 38 | L | 69 | Low | 64.8 | Low | 119 Ų | 119 | 110.5 Ų | 110.5 | 62% | 0.623 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -61.7 | -42.6 | 174.5 | -79.2 | 167.9 | 0 | 0 | 0 | 113 | R34 T40 Y42 | R34-L38 WeakPolarHBondContact O-CB 3.27Å; R34-L38 WeakPolarHBondContact O-CG 3.45Å; R34-L38 PolarHBondContact O-N 3.24Å; R34-L38 VanDerWaalsContact O-N 3.13Å; L38-T40 VanDerWaalsContact C-N 3.32Å; L38-T40 PolarHBondContact O-N 3.26Å; L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.4Å |
| 39 | A | 73.1 | Confident | 65.3 | Low | 49 Ų | 49 | 106.7 Ų | 106.7 | 41% | 0.405 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.2 | -39.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | V35 K36 D37 Y42 V43 | V35-A39 WeakPolarHBondContact O-CB 3.4Å; V35-A39 PolarHBondContact O-N 3.26Å; K36-A39 PolarHBondContact O-N 2.68Å; D37-A39 PolarHBondContact O-N 2.93Å; A39-Y42 PolarHBondContact O-N 3.44Å; A39-V43 VanDerWaalsContact O-CB 3.31Å; A39-V43 WeakPolarHBondContact O-CB 3.4Å; A39-V43 WeakPolarHBondContact O-CG2 3.39Å; A39-V43 PolarHBondContact O-N 3.28Å |
| 40 | T | 69.4 | Low | 65.5 | Low | 83 Ų | 83 | 101.8 Ų | 101.8 | 51% | 0.509 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -68.1 | -45.7 | -179.2 | -50.5 | 0 | 0 | 0 | 0 | 110.8 | K36 D37 L38 Y42 V43 D44 | K36-T40 WeakPolarHBondContact O-CB 3.14Å; K36-T40 PolarHBondContact O-N 3.49Å; K36-T40 PolarHBondContact O-OG1 3Å; D37-T40 PolarHBondContact O-N 2.86Å; L38-T40 VanDerWaalsContact C-N 3.32Å; L38-T40 PolarHBondContact O-N 3.26Å; T40-Y42 VanDerWaalsContact C-N 3.33Å; T40-Y42 PolarHBondContact O-N 3.46Å; T40-V43 PolarHBondContact O-N 3.43Å; T40-D44 PolarHBondContact O-N 3.34Å |
| 41 | V | 72.5 | Confident | 65.5 | Low | 86 Ų | 86 | 108.7 Ų | 108.7 | 52% | 0.521 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62 | -41.1 | 176.4 | 175 | 0 | 0 | 0 | 0 | 111.4 | D37 V45 | D37-V41 WeakPolarHBondContact O-CG2 3.49Å; D37-V41 PolarHBondContact O-N 3.45Å; V41-V45 WeakPolarHBondContact O-CB 3.31Å; V41-V45 VanDerWaalsContact O-CG2 3.27Å; V41-V45 WeakPolarHBondContact O-CG2 3.25Å; V41-V45 PolarHBondContact O-N 2.92Å |
| 42 | Y | 61.7 | Low | 65.7 | Low | 175 Ų | 175 | 109.8 Ų | 109.8 | 69% | 0.686 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -68.5 | -36.9 | 178.4 | -140.4 | -91.5 | 0 | 0 | 0 | 112.2 | L38 A39 T40 L46 | L38-Y42 WeakPolarHBondContact O-CB 3.39Å; L38-Y42 PolarHBondContact O-N 3.4Å; A39-Y42 PolarHBondContact O-N 3.44Å; T40-Y42 VanDerWaalsContact C-N 3.33Å; T40-Y42 PolarHBondContact O-N 3.46Å; Y42-L46 WeakPolarHBondContact O-CB 3.21Å; Y42-L46 PolarHBondContact O-N 3.36Å |
| 43 | V | 67.1 | Low | 65.7 | Low | 92 Ų | 92 | 109.3 Ų | 109.3 | 56% | 0.558 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -70.1 | -39.9 | 177.5 | 168.8 | 0 | 0 | 0 | 0 | 111.5 | A39 T40 L46 K47 | A39-V43 VanDerWaalsContact O-CB 3.31Å; A39-V43 WeakPolarHBondContact O-CB 3.4Å; A39-V43 WeakPolarHBondContact O-CG2 3.39Å; A39-V43 PolarHBondContact O-N 3.28Å; T40-V43 PolarHBondContact O-N 3.43Å; V43-L46 PolarHBondContact O-N 3.36Å; V43-K47 VanDerWaalsContact O-CB 3.25Å; V43-K47 WeakPolarHBondContact O-CB 3.22Å; V43-K47 PolarHBondContact O-N 2.91Å |
| 44 | D | 69.3 | Low | 65.1 | Low | 91 Ų | 91 | 108.3 Ų | 108.3 | 49% | 0.487 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -65.9 | -46.6 | 176.3 | -109.9 | -89.5 | 0 | 0 | 0 | 111.5 | T40 L46 K47 D48 | T40-D44 PolarHBondContact O-N 3.34Å; D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 2.83Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.16Å; D44-D48 PolarHBondContact O-N 3.01Å |
| 45 | V | 65.4 | Low | 65.1 | Low | 86 Ų | 86 | 105.2 Ų | 105.2 | 52% | 0.521 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61.6 | -38.8 | 176.4 | 172.6 | 0 | 0 | 0 | 0 | 111.3 | V41 S49 | V41-V45 WeakPolarHBondContact O-CB 3.31Å; V41-V45 VanDerWaalsContact O-CG2 3.27Å; V41-V45 WeakPolarHBondContact O-CG2 3.25Å; V41-V45 PolarHBondContact O-N 2.92Å; V45-S49 WeakPolarHBondContact O-CB 3.09Å; V45-S49 PolarHBondContact O-N 2.79Å; V45-S49 PolarHBondContact O-OG 2.65Å |
| 46 | L | 62.7 | Low | 64.5 | Low | 117 Ų | 117 | 108.6 Ų | 108.6 | 61% | 0.613 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -71.7 | -32.3 | 178.1 | -161 | 74.8 | 0 | 0 | 0 | 112.4 | Y42 V43 D44 G50 | Y42-L46 WeakPolarHBondContact O-CB 3.21Å; Y42-L46 PolarHBondContact O-N 3.36Å; V43-L46 PolarHBondContact O-N 3.36Å; D44-L46 VanDerWaalsContact C-N 3.3Å; D44-L46 PolarHBondContact O-N 2.83Å; L46-G50 WeakPolarHBondContact O-CA 3.16Å; L46-G50 PolarHBondContact O-N 2.83Å |
| 47 | K | 62.9 | Low | 63.7 | Low | 156 Ų | 156 | 108.3 Ų | 108.3 | 68% | 0.678 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -73 | -41.8 | 179.4 | -171.7 | 177.4 | 178.7 | -176.3 | 0 | 112.1 | V43 D44 | V43-K47 VanDerWaalsContact O-CB 3.25Å; V43-K47 WeakPolarHBondContact O-CB 3.22Å; V43-K47 PolarHBondContact O-N 2.91Å; D44-K47 PolarHBondContact O-N 3.08Å; D44-K47 VanDerWaalsContact O-N 3.16Å |
| 48 | D | 63.5 | Low | 62.8 | Low | 112 Ų | 112 | 111.1 Ų | 111.1 | 60% | 0.599 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -74.9 | -41.6 | 175.4 | -83.5 | -26.1 | 0 | 0 | 0 | 111.8 | D44 G50 R51 D52 | D44-D48 PolarHBondContact O-N 3.01Å; D48-G50 VanDerWaalsContact C-N 3.32Å; D48-G50 PolarHBondContact O-N 3.31Å; D48-R51 PolarHBondContact O-N 2.68Å; D48-D52 PolarHBondContact O-N 2.94Å |
| 49 | S | 61.2 | Low | 62.2 | Low | 51 Ų | 51 | 109 Ų | 109 | 36% | 0.357 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -65.5 | -36.6 | 175.7 | -57 | 0 | 0 | 0 | 0 | 111.7 | V45 R51 Y53 | V45-S49 WeakPolarHBondContact O-CB 3.09Å; V45-S49 PolarHBondContact O-N 2.79Å; V45-S49 PolarHBondContact O-OG 2.65Å; S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.01Å; S49-Y53 WeakPolarHBondContact O-CB 3.28Å; S49-Y53 VanDerWaalsContact O-CD2 3.27Å; S49-Y53 WeakPolarHBondContact O-CD2 3.28Å; S49-Y53 PolarHBondContact O-N 2.77Å |
| 50 | G | 57.4 | Low | 61.3 | Low | 32 Ų | 32 | 109.4 Ų | 109.4 | 33% | 0.33 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -63.6 | -33.9 | -180 | 0 | 0 | 0 | 0 | 0 | 113.5 | L46 D48 V54 | L46-G50 WeakPolarHBondContact O-CA 3.16Å; L46-G50 PolarHBondContact O-N 2.83Å; D48-G50 VanDerWaalsContact C-N 3.32Å; D48-G50 PolarHBondContact O-N 3.31Å; G50-V54 VanDerWaalsContact O-CB 3.25Å; G50-V54 WeakPolarHBondContact O-CB 3.49Å; G50-V54 WeakPolarHBondContact O-CG2 3.39Å; G50-V54 PolarHBondContact O-N 3.4Å |
| 51 | R | 58.8 | Low | 60.5 | Low | 202 Ų | 202 | 108.3 Ų | 108.3 | 76% | 0.762 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -78.5 | -38.1 | -176.8 | -159.1 | 174.7 | -172.2 | 166.5 | 1.4 | 112.7 | D48 S49 S55 | D48-R51 PolarHBondContact O-N 2.68Å; S49-R51 VanDerWaalsContact C-N 3.31Å; S49-R51 PolarHBondContact O-N 3.01Å; R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 PolarHBondContact O-OG 3.49Å |
| 52 | D | 63.5 | Low | 59.4 | Low | 127 Ų | 127 | 106.4 Ų | 106.4 | 68% | 0.679 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -71.3 | -41.6 | 174.5 | -109.7 | -32 | 0 | 0 | 0 | 111.6 | D48 S55 Q56 | D48-D52 PolarHBondContact O-N 2.94Å; D52-S55 PolarHBondContact O-N 3.4Å; D52-Q56 PolarHBondContact O-N 2.99Å; D52-Q56 VanDerWaalsContact O-N 3.16Å |
| 53 | Y | 58.3 | Low | 59 | Low | 161 Ų | 161 | 101.6 Ų | 101.6 | 63% | 0.631 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -66.5 | -40.8 | 176.7 | -89.9 | -84.8 | 0 | 0 | 0 | 112.4 | S49 S55 Q56 F57 | S49-Y53 WeakPolarHBondContact O-CB 3.28Å; S49-Y53 VanDerWaalsContact O-CD2 3.27Å; S49-Y53 WeakPolarHBondContact O-CD2 3.28Å; S49-Y53 PolarHBondContact O-N 2.77Å; Y53-S55 PolarHBondContact O-N 3.45Å; Y53-Q56 PolarHBondContact O-N 2.91Å; Y53-F57 VanDerWaalsContact O-CB 3.28Å; Y53-F57 WeakPolarHBondContact O-CB 3.33Å; Y53-F57 PolarHBondContact O-N 2.75Å |
| 54 | V | 57 | Low | 58.5 | Low | 84 Ų | 84 | 105.5 Ų | 105.5 | 51% | 0.509 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -61.6 | -42.7 | 177.3 | 158.9 | 0 | 0 | 0 | 0 | 111.7 | G50 Q56 F57 E58 | G50-V54 VanDerWaalsContact O-CB 3.25Å; G50-V54 WeakPolarHBondContact O-CB 3.49Å; G50-V54 WeakPolarHBondContact O-CG2 3.39Å; G50-V54 PolarHBondContact O-N 3.4Å; V54-Q56 VanDerWaalsContact C-N 3.29Å; V54-Q56 PolarHBondContact O-N 3.44Å; V54-F57 PolarHBondContact O-N 2.62Å; V54-E58 PolarHBondContact O-N 3.36Å |
| 55 | S | 60.7 | Low | 57.6 | Low | 79 Ų | 79 | 105.8 Ų | 105.8 | 55% | 0.552 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -64.8 | -34.6 | 178.5 | -50.5 | 0 | 0 | 0 | 0 | 112.2 | R51 D52 Y53 | R51-S55 PolarHBondContact O-N 3.19Å; R51-S55 PolarHBondContact O-OG 3.49Å; D52-S55 PolarHBondContact O-N 3.4Å; Y53-S55 PolarHBondContact O-N 3.45Å |
| 56 | Q | 57.5 | Low | 57.2 | Low | 146 Ų | 146 | 104.5 Ų | 104.5 | 68% | 0.682 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -81.6 | -23.2 | 177.3 | -150 | 176.2 | 55.4 | 0 | 0 | 112.8 | D52 Y53 V54 S60 | D52-Q56 PolarHBondContact O-N 2.99Å; D52-Q56 VanDerWaalsContact O-N 3.16Å; Y53-Q56 PolarHBondContact O-N 2.91Å; V54-Q56 VanDerWaalsContact C-N 3.29Å; V54-Q56 PolarHBondContact O-N 3.44Å; Q56-S60 WeakPolarHBondContact O-CB 3.23Å; Q56-S60 PolarHBondContact O-N 3.34Å |
| 57 | F | 54.1 | Low | 56.4 | Low | 115 Ų | 115 | 105.8 Ų | 105.8 | 50% | 0.504 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -83.1 | -31.2 | 177.7 | -138.7 | -88.9 | 0 | 0 | 0 | 112.6 | Y53 V54 G59 S60 L62 | Y53-F57 VanDerWaalsContact O-CB 3.28Å; Y53-F57 WeakPolarHBondContact O-CB 3.33Å; Y53-F57 PolarHBondContact O-N 2.75Å; V54-F57 PolarHBondContact O-N 2.62Å; F57-G59 VanDerWaalsContact C-N 3.27Å; F57-G59 PolarHBondContact O-N 2.92Å; F57-S60 PolarHBondContact O-N 3.08Å; F57-L62 HydrophobicContact CD1-CD1 4.02Å; F57-L62 HydrophobicContact CD2-CD1 3.52Å; F57-L62 HydrophobicContact CE1-CB 4.21Å; F57-L62 HydrophobicContact CE1-CD1 3.82Å; F57-L62 HydrophobicContact CE2-CD1 3.32Å; F57-L62 HydrophobicContact CG-CD1 3.9Å; F57-L62 HydrophobicContact CZ-CB 4.31Å; F57-L62 HydrophobicContact CZ-CD1 3.48Å; F57-L62 VanDerWaalsContact CZ-CD1 3.48Å; F57-L62 HydrophobicContact CZ-CG 4.36Å |
| 58 | E | 53.8 | Low | 55.8 | Low | 171 Ų | 171 | 104.4 Ų | 104.4 | 80% | 0.799 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.4 | -22.9 | 175.5 | -76.9 | -172.3 | 158.2 | 0 | 0 | 113.1 | V54 | V54-E58 PolarHBondContact O-N 3.36Å |
| 59 | G | 56.5 | Low | 55.5 | Low | 75 Ų | 75 | 104.4 Ų | 104.4 | 77% | 0.773 | 57% | 0.567 | S | S | * | * | S | Bend | trans | -96.8 | -12.7 | 174.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | F57 | F57-G59 VanDerWaalsContact C-N 3.27Å; F57-G59 PolarHBondContact O-N 2.92Å |
| 60 | S | 53.5 | Low | 55.2 | Low | 56 Ų | 56 | 105.6 Ų | 105.6 | 39% | 0.392 | 57% | 0.569 | S | S | . | * | S | Bend | trans | -103.2 | 123.5 | -170.8 | -172.3 | 0 | 0 | 0 | 0 | 111.2 | Q56 F57 L62 | Q56-S60 WeakPolarHBondContact O-CB 3.23Å; Q56-S60 PolarHBondContact O-N 3.34Å; F57-S60 PolarHBondContact O-N 3.08Å; S60-L62 PolarHBondContact O-N 3.3Å |
| 61 | A | 52.8 | Low | 55 | Low | 60 Ų | 60 | 110.8 Ų | 110.8 | 50% | 0.496 | 59% | 0.589 | S | S | . | * | trans | -64.5 | 43.9 | -178 | 0 | 0 | 0 | 0 | 0 | 114.9 | G63 K64 Q65 | A61-G63 PolarHBondContact O-N 2.85Å; A61-K64 PolarHBondContact O-N 3.29Å; A61-Q65 PolarHBondContact O-N 2.78Å | ||
| 62 | L | 50.4 | Low | 55.1 | Low | 46 Ų | 46 | 106.9 Ų | 106.9 | 24% | 0.241 | 58% | 0.583 | C | S | . | * | H | α-helix | trans | -62.5 | -30.1 | -179.8 | -85.8 | 153.2 | 0 | 0 | 0 | 112.4 | F57 S60 K64 L66 | F57-L62 HydrophobicContact CD1-CD1 4.02Å; F57-L62 HydrophobicContact CD2-CD1 3.52Å; F57-L62 HydrophobicContact CE1-CB 4.21Å; F57-L62 HydrophobicContact CE1-CD1 3.82Å; F57-L62 HydrophobicContact CE2-CD1 3.32Å; F57-L62 HydrophobicContact CG-CD1 3.9Å; F57-L62 HydrophobicContact CZ-CB 4.31Å; F57-L62 HydrophobicContact CZ-CD1 3.48Å; F57-L62 VanDerWaalsContact CZ-CD1 3.48Å; F57-L62 HydrophobicContact CZ-CG 4.36Å; S60-L62 PolarHBondContact O-N 3.3Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 3.47Å; L62-L66 HydrophobicContact CD2-CD1 4.42Å; L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 VanDerWaalsContact O-CD1 3.24Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.24Å; L62-L66 PolarHBondContact O-N 3.24Å |
| 63 | G | 53 | Low | 54.9 | Low | 74 Ų | 74 | 104.9 Ų | 104.9 | 76% | 0.763 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -67.8 | -25.4 | 171.7 | 0 | 0 | 0 | 0 | 0 | 114.9 | A61 | A61-G63 PolarHBondContact O-N 2.85Å |
| 64 | K | 55.3 | Low | 54.9 | Low | 174 Ų | 174 | 105.4 Ų | 105.4 | 76% | 0.757 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -97.4 | -26.8 | 179.3 | -73.1 | -175.7 | 177.6 | 179.3 | 0 | 113.3 | A61 L62 | A61-K64 PolarHBondContact O-N 3.29Å; L62-K64 VanDerWaalsContact C-N 3.33Å; L62-K64 PolarHBondContact O-N 3.47Å |
| 65 | Q | 52.2 | Low | 55.2 | Low | 98 Ų | 98 | 107.4 Ų | 107.4 | 46% | 0.458 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -87.1 | -22.9 | -178.7 | -114.5 | -178.9 | -19.1 | 0 | 0 | 114.3 | A61 K69 | A61-Q65 PolarHBondContact O-N 2.78Å; Q65-K69 HydrophobicContact CG-CD 4.44Å |
| 66 | L | 55.5 | Low | 55.4 | Low | 59 Ų | 59 | 106 Ų | 106 | 31% | 0.309 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -72.3 | -32.8 | -179.4 | -79.9 | 165 | 0 | 0 | 0 | 112.8 | M1 L62 L68 L70 | M1-L66 HydrophobicContact CE-CD1 3.51Å; L62-L66 HydrophobicContact CD2-CD1 4.42Å; L62-L66 WeakPolarHBondContact O-CB 3.21Å; L62-L66 VanDerWaalsContact O-CD1 3.24Å; L62-L66 WeakPolarHBondContact O-CD1 3.47Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.24Å; L62-L66 PolarHBondContact O-N 3.24Å; L66-L68 PolarHBondContact O-N 3.43Å; L66-L70 HydrophobicContact CD2-CD1 4.48Å; L66-L70 WeakPolarHBondContact O-CD1 3.12Å |
| 67 | N | 46.2 | Very low | 55.6 | Low | 144 Ų | 144 | 103.2 Ų | 103.2 | 77% | 0.77 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -82.5 | -8.3 | -172.9 | -127.4 | 26.9 | 0 | 0 | 0 | 115.2 | ||
| 68 | L | 51.2 | Low | 56.1 | Low | 126 Ų | 126 | 101.1 Ų | 101.1 | 66% | 0.66 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -111.4 | -38 | -180 | -73.6 | 159.6 | 0 | 0 | 0 | 112.4 | L66 L70 | L66-L68 PolarHBondContact O-N 3.43Å; L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 2.78Å |
| 69 | K | 56.7 | Low | 56.7 | Low | 112 Ų | 112 | 95.6 Ų | 95.6 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -78.2 | -9.5 | -178.4 | -68.7 | -173.8 | 171 | -179.6 | 0 | 114.9 | Q65 N73 | Q65-K69 HydrophobicContact CG-CD 4.44Å; K69-N73 VanDerWaalsContact O-CB 3.23Å; K69-N73 WeakPolarHBondContact O-CB 3.43Å; K69-N73 VanDerWaalsContact O-CG 3.25Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-ND2 3.47Å; K69-N73 VanDerWaalsContact O-ND2 3.1Å |
| 70 | L | 55.5 | Low | 56.9 | Low | 76 Ų | 76 | 95.7 Ų | 95.7 | 40% | 0.398 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -81.7 | -28.2 | 179.9 | -98 | 159.6 | 0 | 0 | 0 | 112.7 | L66 L68 | L66-L70 HydrophobicContact CD2-CD1 4.48Å; L66-L70 WeakPolarHBondContact O-CD1 3.12Å; L68-L70 VanDerWaalsContact C-N 3.31Å; L68-L70 PolarHBondContact O-N 2.78Å |
| 71 | L | 52.8 | Low | 57.6 | Low | 142 Ų | 142 | 99.2 Ų | 99.2 | 74% | 0.743 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -82.8 | -46 | 172.2 | -102.7 | 78.4 | 0 | 0 | 0 | 111.6 | N73 W74 | L71-N73 PolarHBondContact O-N 3.37Å; L71-W74 PolarHBondContact O-N 3.47Å; L71-W74 VanDerWaalsContact O-N 3.16Å |
| 72 | D | 60.8 | Low | 58.1 | Low | 120 Ų | 120 | 99.2 Ų | 99.2 | 64% | 0.642 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.6 | -28 | 179.1 | -85.1 | -45.4 | 0 | 0 | 0 | 113.6 | W74 | D72-W74 VanDerWaalsContact C-N 3.3Å; D72-W74 PolarHBondContact O-N 2.78Å |
| 73 | N | 59.9 | Low | 58.9 | Low | 84 Ų | 84 | 103.9 Ų | 103.9 | 45% | 0.449 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -81.2 | -2.6 | 179.3 | -82 | -22.7 | 0 | 0 | 0 | 114.3 | K69 L71 S76 V77 | K69-N73 VanDerWaalsContact O-CB 3.23Å; K69-N73 WeakPolarHBondContact O-CB 3.43Å; K69-N73 VanDerWaalsContact O-CG 3.25Å; K69-N73 PolarHBondContact O-N 3.33Å; K69-N73 PolarHBondContact O-ND2 3.47Å; K69-N73 VanDerWaalsContact O-ND2 3.1Å; L71-N73 PolarHBondContact O-N 3.37Å; N73-S76 PolarHBondContact O-OG 2.83Å; N73-S76 VanDerWaalsContact O-OG 3.12Å; N73-V77 VanDerWaalsContact O-CG2 3.26Å; N73-V77 WeakPolarHBondContact O-CG2 3.4Å; N73-V77 PolarHBondContact O-N 2.85Å |
| 74 | W | 57.1 | Low | 59.6 | Low | 172 Ų | 172 | 105.1 Ų | 105.1 | 65% | 0.652 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -76.6 | -36 | 175.2 | -112.1 | 108.6 | 0 | 0 | 0 | 112 | L71 D72 T78 | L71-W74 PolarHBondContact O-N 3.47Å; L71-W74 VanDerWaalsContact O-N 3.16Å; D72-W74 VanDerWaalsContact C-N 3.3Å; D72-W74 PolarHBondContact O-N 2.78Å; W74-T78 PolarHBondContact O-N 3.21Å; W74-T78 VanDerWaalsContact O-N 3.13Å; W74-T78 PolarHBondContact O-OG1 3.4Å |
| 75 | D | 62.9 | Low | 60 | Low | 127 Ų | 127 | 105.7 Ų | 105.7 | 68% | 0.679 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -67.8 | -35.2 | 173.4 | -82.8 | -73 | 0 | 0 | 0 | 112.5 | S79 | D75-S79 WeakPolarHBondContact O-CB 3.37Å; D75-S79 PolarHBondContact O-N 2.99Å; D75-S79 PolarHBondContact O-OG 3.02Å |
| 76 | S | 65.5 | Low | 60.6 | Low | 49 Ų | 49 | 108.8 Ų | 108.8 | 34% | 0.343 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -71.2 | -35.2 | 177.5 | 72.6 | 0 | 0 | 0 | 0 | 112.9 | N73 S79 T80 | N73-S76 PolarHBondContact O-OG 2.83Å; N73-S76 VanDerWaalsContact O-OG 3.12Å; S76-S79 WeakPolarHBondContact CA-OG 3.18Å; S76-S79 PolarHBondContact O-OG 2.79Å; S76-T80 WeakPolarHBondContact O-CB 3.45Å; S76-T80 PolarHBondContact O-N 3.46Å; S76-T80 PolarHBondContact O-OG1 3.32Å |
| 77 | V | 62.8 | Low | 61 | Low | 87 Ų | 87 | 114.3 Ų | 114.3 | 53% | 0.527 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -69.2 | -42.6 | 174.8 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | N73 T80 F81 | N73-V77 VanDerWaalsContact O-CG2 3.26Å; N73-V77 WeakPolarHBondContact O-CG2 3.4Å; N73-V77 PolarHBondContact O-N 2.85Å; V77-T80 PolarHBondContact O-N 3.12Å; V77-F81 WeakPolarHBondContact O-CB 3.17Å; V77-F81 PolarHBondContact O-N 3.05Å |
| 78 | T | 63.4 | Low | 61.6 | Low | 72 Ų | 72 | 110.7 Ų | 110.7 | 44% | 0.442 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -64.1 | -44.9 | 178.6 | -50.7 | 0 | 0 | 0 | 0 | 110.8 | W74 T80 F81 S82 | W74-T78 PolarHBondContact O-N 3.21Å; W74-T78 VanDerWaalsContact O-N 3.13Å; W74-T78 PolarHBondContact O-OG1 3.4Å; T78-T80 PolarHBondContact O-N 2.8Å; T78-F81 WeakPolarHBondContact O-CB 3.25Å; T78-F81 PolarHBondContact O-N 3.45Å; T78-S82 PolarHBondContact O-N 3.12Å; T78-S82 PolarHBondContact O-OG 3.31Å |
| 79 | S | 66.1 | Low | 62.1 | Low | 54 Ų | 54 | 106.8 Ų | 106.8 | 38% | 0.378 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.6 | -32.2 | 177.5 | 57.8 | 0 | 0 | 0 | 0 | 114.1 | D75 S76 S82 K83 | D75-S79 WeakPolarHBondContact O-CB 3.37Å; D75-S79 PolarHBondContact O-N 2.99Å; D75-S79 PolarHBondContact O-OG 3.02Å; S76-S79 WeakPolarHBondContact CA-OG 3.18Å; S76-S79 PolarHBondContact O-OG 2.79Å; S79-S82 PolarHBondContact O-N 3.49Å; S79-K83 WeakPolarHBondContact O-CG 3.24Å; S79-K83 PolarHBondContact O-N 2.91Å; S79-K83 VanDerWaalsContact O-N 3.1Å |
| 80 | T | 62.1 | Low | 62.5 | Low | 78 Ų | 78 | 106.5 Ų | 106.5 | 48% | 0.479 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.9 | -37.6 | 174.3 | -53 | 0 | 0 | 0 | 0 | 111 | S76 V77 T78 K83 L84 | S76-T80 WeakPolarHBondContact O-CB 3.45Å; S76-T80 PolarHBondContact O-N 3.46Å; S76-T80 PolarHBondContact O-OG1 3.32Å; V77-T80 PolarHBondContact O-N 3.12Å; T78-T80 PolarHBondContact O-N 2.8Å; T80-K83 PolarHBondContact O-N 3.16Å; T80-L84 HydrophobicContact CG2-CD1 4.14Å; T80-L84 WeakPolarHBondContact O-CD1 3.43Å; T80-L84 PolarHBondContact O-N 3.15Å |
| 81 | F | 66.7 | Low | 62.6 | Low | 130 Ų | 130 | 108.2 Ų | 108.2 | 57% | 0.57 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -64.1 | -39.8 | 173 | -166.1 | -96.8 | 0 | 0 | 0 | 111.8 | V77 T78 L84 R85 | V77-F81 WeakPolarHBondContact O-CB 3.17Å; V77-F81 PolarHBondContact O-N 3.05Å; T78-F81 WeakPolarHBondContact O-CB 3.25Å; T78-F81 PolarHBondContact O-N 3.45Å; F81-L84 PolarHBondContact O-N 2.85Å; F81-R85 WeakPolarHBondContact O-CB 3.45Å; F81-R85 PolarHBondContact O-N 3.36Å |
| 82 | S | 63.9 | Low | 63 | Low | 59 Ų | 59 | 102.2 Ų | 102.2 | 41% | 0.413 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 174.5 | -45.1 | 0 | 0 | 0 | 0 | 112.8 | T78 S79 R85 E86 | T78-S82 PolarHBondContact O-N 3.12Å; T78-S82 PolarHBondContact O-OG 3.31Å; S79-S82 PolarHBondContact O-N 3.49Å; S82-R85 WeakPolarHBondContact O-CB 3.45Å; S82-R85 PolarHBondContact O-N 3.04Å; S82-E86 PolarHBondContact O-N 3.38Å |
| 83 | K | 68.1 | Low | 63.1 | Low | 145 Ų | 145 | 103.5 Ų | 103.5 | 63% | 0.63 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -68.3 | -37.6 | 179.1 | -75.5 | 179.4 | 178.8 | 178.5 | 0 | 112.8 | S79 T80 R85 E86 Q87 | S79-K83 WeakPolarHBondContact O-CG 3.24Å; S79-K83 PolarHBondContact O-N 2.91Å; S79-K83 VanDerWaalsContact O-N 3.1Å; T80-K83 PolarHBondContact O-N 3.16Å; K83-R85 VanDerWaalsContact C-N 3.33Å; K83-E86 PolarHBondContact O-N 3.49Å; K83-Q87 PolarHBondContact O-N 3.04Å |
| 84 | L | 66.3 | Low | 63.5 | Low | 100 Ų | 100 | 107.1 Ų | 107.1 | 52% | 0.524 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -62.8 | -42.5 | 171.3 | -102.4 | 103 | 0 | 0 | 0 | 111 | T80 F81 E86 Q87 L88 | T80-L84 HydrophobicContact CG2-CD1 4.14Å; T80-L84 WeakPolarHBondContact O-CD1 3.43Å; T80-L84 PolarHBondContact O-N 3.15Å; F81-L84 PolarHBondContact O-N 2.85Å; L84-E86 PolarHBondContact O-N 3.41Å; L84-Q87 PolarHBondContact O-N 2.86Å; L84-L88 HydrophobicContact CD2-CD1 4.42Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.23Å; L84-L88 PolarHBondContact O-N 2.73Å |
| 85 | R | 63.9 | Low | 64.3 | Low | 186 Ų | 186 | 105 Ų | 105 | 70% | 0.702 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -61.7 | -39.8 | 178.1 | -176.3 | 175.5 | 178.8 | 151.1 | 2.1 | 112.8 | F81 S82 K83 | F81-R85 WeakPolarHBondContact O-CB 3.45Å; F81-R85 PolarHBondContact O-N 3.36Å; S82-R85 WeakPolarHBondContact O-CB 3.45Å; S82-R85 PolarHBondContact O-N 3.04Å; K83-R85 VanDerWaalsContact C-N 3.33Å |
| 86 | E | 64.9 | Low | 64.5 | Low | 162 Ų | 162 | 105.3 Ų | 105.3 | 76% | 0.757 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68.9 | -38.1 | 176.5 | -83.5 | -179.9 | 152.7 | 0 | 0 | 113.1 | S82 K83 L84 L88 | S82-E86 PolarHBondContact O-N 3.38Å; K83-E86 PolarHBondContact O-N 3.49Å; L84-E86 PolarHBondContact O-N 3.41Å; E86-L88 VanDerWaalsContact C-N 3.26Å; E86-L88 PolarHBondContact O-N 3.14Å |
| 87 | Q | 63.7 | Low | 64.9 | Low | 176 Ų | 176 | 107.3 Ų | 107.3 | 82% | 0.822 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -74 | -15.4 | -179.3 | -76 | -167.6 | -25.9 | 0 | 0 | 114.2 | K83 L84 | K83-Q87 PolarHBondContact O-N 3.04Å; L84-Q87 PolarHBondContact O-N 2.86Å |
| 88 | L | 59.1 | Low | 65.6 | Low | 67 Ų | 67 | 108.1 Ų | 108.1 | 35% | 0.351 | 55% | 0.549 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -100 | 5.3 | -175.9 | -68.2 | 162 | 0 | 0 | 0 | 113.9 | L84 E86 V91 T92 | L84-L88 HydrophobicContact CD2-CD1 4.42Å; L84-L88 WeakPolarHBondContact O-CD1 3.49Å; L84-L88 VanDerWaalsContact O-CG 3.24Å; L84-L88 WeakPolarHBondContact O-CG 3.23Å; L84-L88 PolarHBondContact O-N 2.73Å; E86-L88 VanDerWaalsContact C-N 3.26Å; E86-L88 PolarHBondContact O-N 3.14Å; L88-V91 PolarHBondContact O-N 3.25Å; L88-V91 VanDerWaalsContact O-N 3.08Å; L88-T92 HydrophobicContact CB-CG2 3.28Å; L88-T92 VanDerWaalsContact CB-OG1 3.23Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 HydrophobicContact CD1-CG2 3.61Å; L88-T92 HydrophobicContact CD2-CG2 3.99Å; L88-T92 HydrophobicContact CG-CG2 3.8Å; L88-T92 PolarHBondContact O-N 3Å; L88-T92 PolarHBondContact O-OG1 3.34Å |
| 89 | G | 63.2 | Low | 66.3 | Low | 45 Ų | 45 | 107.6 Ų | 107.6 | 46% | 0.464 | 54% | 0.543 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -32.3 | -50.3 | -165.7 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||
| 90 | P | 63.5 | Low | 66.7 | Low | 105 Ų | 105 | 110.9 Ų | 110.9 | 68% | 0.682 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.2 | -28.2 | 177.4 | 30.8 | -26 | 0 | 0 | 0 | 114.5 | T92 | P90-T92 VanDerWaalsContact C-N 3.34Š|
| 91 | V | 58 | Low | 67.5 | Low | 113 Ų | 113 | 113.4 Ų | 113.4 | 69% | 0.685 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -80.6 | -17.9 | -176.6 | -179.5 | 0 | 0 | 0 | 0 | 112 | L88 | L88-V91 PolarHBondContact O-N 3.25Å; L88-V91 VanDerWaalsContact O-N 3.08Å |
| 92 | T | 60.6 | Low | 67.9 | Low | 15 Ų | 15 | 114 Ų | 114 | 9% | 0.092 | 56% | 0.562 | C | S | . | * | H | α-helix | trans | -87.4 | -19.7 | 176.5 | 37.3 | 0 | 0 | 0 | 0 | 115.6 | L88 P90 F95 W96 | L88-T92 HydrophobicContact CB-CG2 3.28Å; L88-T92 VanDerWaalsContact CB-OG1 3.23Å; L88-T92 WeakPolarHBondContact CB-OG1 3.47Å; L88-T92 HydrophobicContact CD1-CG2 3.61Å; L88-T92 HydrophobicContact CD2-CG2 3.99Å; L88-T92 HydrophobicContact CG-CG2 3.8Å; L88-T92 PolarHBondContact O-N 3Å; L88-T92 PolarHBondContact O-OG1 3.34Å; P90-T92 VanDerWaalsContact C-N 3.34Å; T92-F95 PolarHBondContact O-N 3.46Å; T92-W96 VanDerWaalsContact CB-CD1 3.46Å; T92-W96 VanDerWaalsContact O-CB 3.32Å; T92-W96 WeakPolarHBondContact O-CB 3.26Å; T92-W96 PolarHBondContact O-N 3.02Å |
| 93 | Q | 64.2 | Low | 68.4 | Low | 148 Ų | 148 | 114.5 Ų | 114.5 | 69% | 0.692 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -64 | -49.6 | -178.6 | -94.1 | 179.9 | -17.1 | 0 | 0 | 111.4 | F95 W96 D97 | Q93-F95 VanDerWaalsContact C-N 3.31Å; Q93-F95 PolarHBondContact O-N 3.47Å; Q93-W96 PolarHBondContact O-N 3.48Å; Q93-D97 WeakPolarHBondContact O-CB 3.29Å; Q93-D97 PolarHBondContact O-N 3.18Å |
| 94 | E | 68.6 | Low | 68.9 | Low | 159 Ų | 159 | 113.2 Ų | 113.2 | 74% | 0.743 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -65.3 | -35.2 | 175.5 | -67.1 | -174.3 | 137.7 | 0 | 0 | 112.4 | N98 | E94-N98 WeakPolarHBondContact O-CB 3.07Å; E94-N98 PolarHBondContact O-N 2.7Å |
| 95 | F | 74.1 | Confident | 69.6 | Low | 128 Ų | 128 | 110 Ų | 110 | 56% | 0.561 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -67 | -45.6 | 176.4 | -171.2 | -101.5 | 0 | 0 | 0 | 111.8 | T92 Q93 N98 L99 | T92-F95 PolarHBondContact O-N 3.46Å; Q93-F95 VanDerWaalsContact C-N 3.31Å; Q93-F95 PolarHBondContact O-N 3.47Å; F95-N98 PolarHBondContact O-N 3.06Å; F95-L99 HydrophobicContact CD1-CD1 4.03Å; F95-L99 HydrophobicContact CE1-CD1 3.42Å; F95-L99 VanDerWaalsContact CE1-CD1 3.42Å; F95-L99 HydrophobicContact CZ-CD1 3.92Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 PolarHBondContact O-N 3.42Å |
| 96 | W | 66.1 | Low | 70.3 | Confident | 133 Ų | 133 | 106 Ų | 106 | 50% | 0.504 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -66.9 | -39.3 | 176.2 | -74 | 120.6 | 0 | 0 | 0 | 111.7 | T92 Q93 N98 L99 E100 | T92-W96 VanDerWaalsContact CB-CD1 3.46Å; T92-W96 VanDerWaalsContact O-CB 3.32Å; T92-W96 WeakPolarHBondContact O-CB 3.26Å; T92-W96 PolarHBondContact O-N 3.02Å; Q93-W96 PolarHBondContact O-N 3.48Å; W96-N98 VanDerWaalsContact C-N 3.34Å; W96-N98 PolarHBondContact O-N 2.91Å; W96-L99 PolarHBondContact O-N 2.84Å; W96-E100 WeakPolarHBondContact O-CB 3.43Å; W96-E100 PolarHBondContact O-N 3.47Å |
| 97 | D | 74.7 | Confident | 70.8 | Confident | 91 Ų | 91 | 107.5 Ų | 107.5 | 49% | 0.487 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.4 | -39.8 | 176.9 | -124.8 | 33.1 | 0 | 0 | 0 | 111.5 | Q93 K101 | Q93-D97 WeakPolarHBondContact O-CB 3.29Å; Q93-D97 PolarHBondContact O-N 3.18Å; D97-K101 WeakPolarHBondContact O-CB 3.45Å; D97-K101 WeakPolarHBondContact O-CG 3.43Å; D97-K101 PolarHBondContact O-N 3.22Å |
| 98 | N | 76.9 | Confident | 71.8 | Confident | 105 Ų | 105 | 105.4 Ų | 105.4 | 56% | 0.561 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -70.2 | -41.6 | 173.5 | -92.2 | 1.6 | 0 | 0 | 0 | 112.3 | E94 F95 W96 K101 E102 | E94-N98 WeakPolarHBondContact O-CB 3.07Å; E94-N98 PolarHBondContact O-N 2.7Å; F95-N98 PolarHBondContact O-N 3.06Å; W96-N98 VanDerWaalsContact C-N 3.34Å; W96-N98 PolarHBondContact O-N 2.91Å; N98-K101 PolarHBondContact O-N 3.36Å; N98-E102 WeakPolarHBondContact O-CB 3.35Å; N98-E102 WeakPolarHBondContact O-CG 3.27Å; N98-E102 PolarHBondContact O-N 2.91Å |
| 99 | L | 77 | Confident | 72.9 | Confident | 60 Ų | 60 | 108.5 Ų | 108.5 | 31% | 0.314 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.4 | -34.4 | -178.7 | -150.3 | 169.1 | 0 | 0 | 0 | 111.2 | F95 W96 T103 | F95-L99 HydrophobicContact CD1-CD1 4.03Å; F95-L99 HydrophobicContact CE1-CD1 3.42Å; F95-L99 VanDerWaalsContact CE1-CD1 3.42Å; F95-L99 HydrophobicContact CZ-CD1 3.92Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 PolarHBondContact O-N 3.42Å; W96-L99 PolarHBondContact O-N 2.84Å; L99-T103 VanDerWaalsContact CD2-OG1 3.28Å; L99-T103 WeakPolarHBondContact CD2-OG1 3.13Å; L99-T103 WeakPolarHBondContact O-CB 3.37Å; L99-T103 PolarHBondContact O-N 2.97Å; L99-T103 PolarHBondContact O-OG1 2.96Å |
| 100 | E | 75.8 | Confident | 73.5 | Confident | 123 Ų | 123 | 111.8 Ų | 111.8 | 58% | 0.575 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -67 | -44.9 | 173.6 | -171.3 | 160.9 | -163.2 | 0 | 0 | 110.6 | W96 T103 E104 | W96-E100 WeakPolarHBondContact O-CB 3.43Å; W96-E100 PolarHBondContact O-N 3.47Å; E100-T103 PolarHBondContact O-N 2.97Å; E100-E104 WeakPolarHBondContact O-CB 3.33Å; E100-E104 WeakPolarHBondContact O-CG 3.2Å; E100-E104 PolarHBondContact O-N 2.87Å |
| 101 | K | 77.8 | Confident | 74.3 | Confident | 132 Ų | 132 | 109.9 Ų | 109.9 | 57% | 0.574 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -63.1 | -44.1 | 173.5 | -74.6 | 175.9 | -171 | 165.5 | 0 | 113 | D97 N98 G105 | D97-K101 WeakPolarHBondContact O-CB 3.45Å; D97-K101 WeakPolarHBondContact O-CG 3.43Å; D97-K101 PolarHBondContact O-N 3.22Å; N98-K101 PolarHBondContact O-N 3.36Å; K101-G105 PolarHBondContact O-N 2.83Å; K101-G105 VanDerWaalsContact O-N 3.08Å |
| 102 | E | 76.7 | Confident | 75.6 | Confident | 143 Ų | 143 | 111.2 Ų | 111.2 | 67% | 0.668 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -65.3 | -41.7 | 175.8 | -80.7 | -170.9 | 161.1 | 0 | 0 | 111.2 | N98 G105 L106 | N98-E102 WeakPolarHBondContact O-CB 3.35Å; N98-E102 WeakPolarHBondContact O-CG 3.27Å; N98-E102 PolarHBondContact O-N 2.91Å; E102-G105 PolarHBondContact O-N 3.35Å; E102-L106 WeakPolarHBondContact O-CB 3.32Å; E102-L106 PolarHBondContact O-N 2.97Å |
| 103 | T | 74.4 | Confident | 76.6 | Confident | 69 Ų | 69 | 115.4 Ų | 115.4 | 42% | 0.423 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -67.4 | -38.5 | 178.4 | -59.1 | 0 | 0 | 0 | 0 | 111.5 | L99 E100 L106 R107 | L99-T103 VanDerWaalsContact CD2-OG1 3.28Å; L99-T103 WeakPolarHBondContact CD2-OG1 3.13Å; L99-T103 WeakPolarHBondContact O-CB 3.37Å; L99-T103 PolarHBondContact O-N 2.97Å; L99-T103 PolarHBondContact O-OG1 2.96Å; E100-T103 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.02Å; T103-R107 WeakPolarHBondContact O-CB 3.43Å; T103-R107 PolarHBondContact O-N 2.76Å |
| 104 | E | 77.2 | Confident | 77.4 | Confident | 117 Ų | 117 | 113.9 Ų | 113.9 | 55% | 0.547 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -63.1 | -45.3 | 174.2 | -79.7 | -167.6 | 151.8 | 0 | 0 | 111.6 | E100 R107 Q108 | E100-E104 WeakPolarHBondContact O-CB 3.33Å; E100-E104 WeakPolarHBondContact O-CG 3.2Å; E100-E104 PolarHBondContact O-N 2.87Å; E104-R107 PolarHBondContact O-N 3.3Å; E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.28Å |
| 105 | G | 80.8 | Confident | 78.2 | Confident | 34 Ų | 34 | 112.7 Ų | 112.7 | 35% | 0.351 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -59.8 | -48.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | K101 E102 R107 Q108 E109 | K101-G105 PolarHBondContact O-N 2.83Å; K101-G105 VanDerWaalsContact O-N 3.08Å; E102-G105 PolarHBondContact O-N 3.35Å; G105-R107 PolarHBondContact O-N 3.45Å; G105-Q108 PolarHBondContact O-N 2.83Å; G105-E109 PolarHBondContact O-N 3.16Å |
| 106 | L | 79.6 | Confident | 78.7 | Confident | 102 Ų | 102 | 111.3 Ų | 111.3 | 53% | 0.534 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.9 | -33.6 | -178.2 | -150.7 | 146.3 | 0 | 0 | 0 | 111.8 | E102 T103 E109 M110 | E102-L106 WeakPolarHBondContact O-CB 3.32Å; E102-L106 PolarHBondContact O-N 2.97Å; T103-L106 PolarHBondContact O-N 3.02Å; L106-E109 PolarHBondContact O-N 3.39Å; L106-M110 HydrophobicContact CD2-CG 3.98Å; L106-M110 HydrophobicContact CD2-SD 3.87Å; L106-M110 VanDerWaalsContact O-CB 3.29Å; L106-M110 WeakPolarHBondContact O-CB 3.26Å; L106-M110 VanDerWaalsContact O-CG 3.26Å; L106-M110 WeakPolarHBondContact O-CG 3.4Å; L106-M110 PolarHBondContact O-N 3.48Å |
| 107 | R | 75.7 | Confident | 79.6 | Confident | 192 Ų | 192 | 108.9 Ų | 108.9 | 73% | 0.725 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -69.4 | -37.9 | 174.3 | -167.9 | 177.9 | -167.1 | 167 | 3.7 | 111.7 | T103 E104 G105 S111 | T103-R107 WeakPolarHBondContact O-CB 3.43Å; T103-R107 PolarHBondContact O-N 2.76Å; E104-R107 PolarHBondContact O-N 3.3Å; G105-R107 PolarHBondContact O-N 3.45Å; R107-S111 WeakPolarHBondContact O-CB 3.21Å; R107-S111 PolarHBondContact O-N 3.46Å |
| 108 | Q | 83.1 | Confident | 79.9 | Confident | 132 Ų | 132 | 111.2 Ų | 111.2 | 62% | 0.617 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -67.7 | -43.3 | 173.2 | -73.9 | -176.7 | 10.7 | 0 | 0 | 111.7 | E104 G105 S111 K112 | E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.28Å; G105-Q108 PolarHBondContact O-N 2.83Å; Q108-S111 PolarHBondContact O-N 2.87Å; Q108-K112 WeakPolarHBondContact O-CG 3.46Å; Q108-K112 PolarHBondContact O-N 3.37Å |
| 109 | E | 82.2 | Confident | 80.4 | Confident | 133 Ų | 133 | 109.3 Ų | 109.3 | 62% | 0.621 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.5 | -47.4 | 173.5 | -79.7 | -166.5 | 144.3 | 0 | 0 | 111.7 | G105 L106 S111 K112 D113 | G105-E109 PolarHBondContact O-N 3.16Å; L106-E109 PolarHBondContact O-N 3.39Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.01Å; E109-K112 PolarHBondContact O-N 2.68Å; E109-K112 VanDerWaalsContact O-N 3.12Å; E109-D113 WeakPolarHBondContact O-CB 3.48Å; E109-D113 PolarHBondContact O-N 3.39Å |
| 110 | M | 76.8 | Confident | 80.8 | Confident | 113 Ų | 113 | 112.4 Ų | 112.4 | 56% | 0.557 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60.3 | -37.5 | 176.7 | -78.3 | -169.2 | 105.3 | 0 | 0 | 112.6 | L106 L114 | L106-M110 HydrophobicContact CD2-CG 3.98Å; L106-M110 HydrophobicContact CD2-SD 3.87Å; L106-M110 VanDerWaalsContact O-CB 3.29Å; L106-M110 WeakPolarHBondContact O-CB 3.26Å; L106-M110 VanDerWaalsContact O-CG 3.26Å; L106-M110 WeakPolarHBondContact O-CG 3.4Å; L106-M110 PolarHBondContact O-N 3.48Å; M110-L114 VanDerWaalsContact O-CB 3.23Å; M110-L114 WeakPolarHBondContact O-CB 3.48Å; M110-L114 WeakPolarHBondContact O-CG 3.5Å; M110-L114 PolarHBondContact O-N 3.46Å |
| 111 | S | 80 | Confident | 81.3 | Confident | 65 Ų | 65 | 109.6 Ų | 109.6 | 46% | 0.455 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.4 | -41.7 | 176.2 | -161.9 | 0 | 0 | 0 | 0 | 111.1 | R107 Q108 E109 L114 E115 | R107-S111 WeakPolarHBondContact O-CB 3.21Å; R107-S111 PolarHBondContact O-N 3.46Å; Q108-S111 PolarHBondContact O-N 2.87Å; E109-S111 VanDerWaalsContact C-N 3.29Å; E109-S111 PolarHBondContact O-N 3.01Å; S111-L114 PolarHBondContact O-N 3.05Å; S111-E115 WeakPolarHBondContact O-CG 3.15Å; S111-E115 PolarHBondContact O-N 3.42Å |
| 112 | K | 85.2 | Confident | 81.5 | Confident | 142 Ų | 142 | 108.2 Ų | 108.2 | 62% | 0.617 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.1 | -45.4 | 174.9 | -76 | 178.2 | 177.1 | 175.4 | 0 | 112 | Q108 E109 L114 E115 E116 | Q108-K112 WeakPolarHBondContact O-CG 3.46Å; Q108-K112 PolarHBondContact O-N 3.37Å; E109-K112 PolarHBondContact O-N 2.68Å; E109-K112 VanDerWaalsContact O-N 3.12Å; K112-L114 VanDerWaalsContact C-N 3.33Å; K112-L114 PolarHBondContact O-N 3.1Å; K112-E115 PolarHBondContact O-N 3.28Å; K112-E116 WeakPolarHBondContact O-CB 3.22Å; K112-E116 PolarHBondContact O-N 3.49Å |
| 113 | D | 82.8 | Confident | 82 | Confident | 102 Ų | 102 | 105 Ų | 105 | 55% | 0.545 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.5 | -40.7 | 176.7 | -92.3 | 11.1 | 0 | 0 | 0 | 111.2 | E109 E116 V117 | E109-D113 WeakPolarHBondContact O-CB 3.48Å; E109-D113 PolarHBondContact O-N 3.39Å; D113-E116 PolarHBondContact O-N 2.84Å; D113-V117 VanDerWaalsContact O-CB 3.25Å; D113-V117 WeakPolarHBondContact O-CB 3.27Å; D113-V117 WeakPolarHBondContact O-CG2 3.41Å; D113-V117 PolarHBondContact O-N 2.83Å |
| 114 | L | 79.7 | Confident | 82.6 | Confident | 117 Ų | 117 | 110 Ų | 110 | 61% | 0.613 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 174.4 | -89.4 | 160.2 | 0 | 0 | 0 | 111.9 | M110 S111 K112 K118 | M110-L114 VanDerWaalsContact O-CB 3.23Å; M110-L114 WeakPolarHBondContact O-CB 3.48Å; M110-L114 WeakPolarHBondContact O-CG 3.5Å; M110-L114 PolarHBondContact O-N 3.46Å; S111-L114 PolarHBondContact O-N 3.05Å; K112-L114 VanDerWaalsContact C-N 3.33Å; K112-L114 PolarHBondContact O-N 3.1Å; L114-K118 WeakPolarHBondContact O-CB 3.41Å; L114-K118 PolarHBondContact O-N 3.46Å |
| 115 | E | 85.1 | Confident | 82.8 | Confident | 133 Ų | 133 | 109.6 Ų | 109.6 | 62% | 0.621 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66 | -40.5 | 174.8 | -75.8 | -172.2 | 110.5 | 0 | 0 | 111.8 | S111 K112 K118 A119 | S111-E115 WeakPolarHBondContact O-CG 3.15Å; S111-E115 PolarHBondContact O-N 3.42Å; K112-E115 PolarHBondContact O-N 3.28Å; E115-K118 PolarHBondContact O-N 3Å; E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.19Å; E115-A119 PolarHBondContact O-N 3.03Å |
| 116 | E | 85 | Confident | 83.2 | Confident | 100 Ų | 100 | 112 Ų | 112 | 47% | 0.467 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.3 | -43.2 | 177.8 | -164.3 | -176.1 | 151 | 0 | 0 | 111.9 | K112 D113 A119 K120 | K112-E116 WeakPolarHBondContact O-CB 3.22Å; K112-E116 PolarHBondContact O-N 3.49Å; D113-E116 PolarHBondContact O-N 2.84Å; E116-A119 PolarHBondContact O-N 3.36Å; E116-K120 HydrophobicContact CG-CD 4.47Å; E116-K120 WeakPolarHBondContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CG 3.44Å; E116-K120 PolarHBondContact O-N 3.03Å; E116-K120 WeakPolarHBondContact OE1-CE 3.4Å; E116-K120 IonicContact OE1-NZ 2.68Å; E116-K120 PolarHBondContact OE1-NZ 2.84Å |
| 117 | V | 84.9 | Confident | 83.6 | Confident | 82 Ų | 82 | 110.6 Ų | 110.6 | 50% | 0.497 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.4 | -44.2 | 173.7 | 169.9 | 0 | 0 | 0 | 0 | 109.9 | D113 A119 K120 V121 | D113-V117 VanDerWaalsContact O-CB 3.25Å; D113-V117 WeakPolarHBondContact O-CB 3.27Å; D113-V117 WeakPolarHBondContact O-CG2 3.41Å; D113-V117 PolarHBondContact O-N 2.83Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 3.37Å; V117-K120 PolarHBondContact O-N 3.15Å; V117-V121 HydrophobicContact CG1-CG2 3.93Å; V117-V121 VanDerWaalsContact O-CB 3.24Å; V117-V121 WeakPolarHBondContact O-CB 3.09Å; V117-V121 WeakPolarHBondContact O-CG2 3.5Å; V117-V121 PolarHBondContact O-N 2.99Å |
| 118 | K | 81 | Confident | 84.3 | Confident | 139 Ų | 139 | 107.8 Ų | 107.8 | 60% | 0.604 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.4 | -45.6 | 175.5 | -174.5 | 178.2 | -179.7 | -177.7 | 0 | 110.8 | L114 E115 K120 V121 Q122 | L114-K118 WeakPolarHBondContact O-CB 3.41Å; L114-K118 PolarHBondContact O-N 3.46Å; E115-K118 PolarHBondContact O-N 3Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.49Å; K118-V121 PolarHBondContact O-N 3.4Å; K118-Q122 VanDerWaalsContact O-CB 3.22Å; K118-Q122 WeakPolarHBondContact O-CB 3.44Å; K118-Q122 PolarHBondContact O-N 3.43Å |
| 119 | A | 86.8 | Confident | 84.4 | Confident | 66 Ų | 66 | 107.1 Ų | 107.1 | 55% | 0.545 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.5 | -37.5 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | E115 E116 V117 P123 | E115-A119 VanDerWaalsContact O-CB 3.27Å; E115-A119 WeakPolarHBondContact O-CB 3.19Å; E115-A119 PolarHBondContact O-N 3.03Å; E116-A119 PolarHBondContact O-N 3.36Å; V117-A119 VanDerWaalsContact C-N 3.35Å; V117-A119 PolarHBondContact O-N 3.37Å; A119-P123 WeakPolarHBondContact O-CD 3.42Å |
| 120 | K | 86.9 | Confident | 84.8 | Confident | 125 Ų | 125 | 107.1 Ų | 107.1 | 54% | 0.543 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -72.8 | -37 | 175.3 | -80.2 | 173.9 | 171.8 | 161.1 | 0 | 112.9 | E116 V117 K118 P123 Y124 | E116-K120 HydrophobicContact CG-CD 4.47Å; E116-K120 WeakPolarHBondContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CG 3.44Å; E116-K120 PolarHBondContact O-N 3.03Å; E116-K120 WeakPolarHBondContact OE1-CE 3.4Å; E116-K120 IonicContact OE1-NZ 2.68Å; E116-K120 PolarHBondContact OE1-NZ 2.84Å; V117-K120 PolarHBondContact O-N 3.15Å; K118-K120 VanDerWaalsContact C-N 3.33Å; K118-K120 PolarHBondContact O-N 3.49Å; K120-P123 WeakPolarHBondContact O-CD 3.47Å; K120-P123 WeakPolarHBondContact O-CG 3.28Å; K120-Y124 WeakPolarHBondContact O-CD2 3.45Å; K120-Y124 WeakPolarHBondContact O-CE2 3.38Å |
| 121 | V | 85 | Confident | 85.4 | Confident | 63 Ų | 63 | 107 Ų | 107 | 38% | 0.382 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -82 | -33.4 | -175.6 | 170.5 | 0 | 0 | 0 | 0 | 112.2 | V117 K118 Y124 L125 | V117-V121 HydrophobicContact CG1-CG2 3.93Å; V117-V121 VanDerWaalsContact O-CB 3.24Å; V117-V121 WeakPolarHBondContact O-CB 3.09Å; V117-V121 WeakPolarHBondContact O-CG2 3.5Å; V117-V121 PolarHBondContact O-N 2.99Å; K118-V121 PolarHBondContact O-N 3.4Å; V121-Y124 WeakPolarHBondContact O-CA 3.37Å; V121-Y124 WeakPolarHBondContact O-CB 3.48Å; V121-Y124 PolarHBondContact O-N 3.44Å; V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 3.88Å; V121-L125 PolarHBondContact O-N 3.33Å |
| 122 | Q | 81.9 | Confident | 85.8 | Confident | 104 Ų | 104 | 110.5 Ų | 110.5 | 49% | 0.486 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -50.7 | -48.6 | -179.2 | -166 | 153.5 | -20.2 | 0 | 0 | 113.8 | K118 Y124 L125 D126 | K118-Q122 VanDerWaalsContact O-CB 3.22Å; K118-Q122 WeakPolarHBondContact O-CB 3.44Å; K118-Q122 PolarHBondContact O-N 3.43Å; Q122-Y124 VanDerWaalsContact C-N 3.32Å; Q122-Y124 PolarHBondContact O-N 3.1Å; Q122-L125 PolarHBondContact O-N 3.12Å; Q122-D126 PolarHBondContact O-N 3.21Å |
| 123 | P | 88.4 | Confident | 86 | Confident | 74 Ų | 74 | 108.8 Ų | 108.8 | 48% | 0.481 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.5 | -30.1 | 175.9 | 25.7 | -35.2 | 0 | 0 | 0 | 113.8 | A119 K120 D127 | A119-P123 WeakPolarHBondContact O-CD 3.42Å; K120-P123 WeakPolarHBondContact O-CD 3.47Å; K120-P123 WeakPolarHBondContact O-CG 3.28Å; P123-D127 WeakPolarHBondContact O-CB 3.25Å; P123-D127 PolarHBondContact O-N 3.13Å |
| 124 | Y | 86.2 | Confident | 86.4 | Confident | 174 Ų | 174 | 109.8 Ų | 109.8 | 68% | 0.682 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -72.5 | -36.4 | 174.4 | -70 | -74.2 | 0 | 0 | 0 | 112.1 | K120 V121 Q122 D127 F128 | K120-Y124 WeakPolarHBondContact O-CD2 3.45Å; K120-Y124 WeakPolarHBondContact O-CE2 3.38Å; V121-Y124 WeakPolarHBondContact O-CA 3.37Å; V121-Y124 WeakPolarHBondContact O-CB 3.48Å; V121-Y124 PolarHBondContact O-N 3.44Å; Q122-Y124 VanDerWaalsContact C-N 3.32Å; Q122-Y124 PolarHBondContact O-N 3.1Å; Y124-D127 PolarHBondContact O-N 3.03Å; Y124-F128 WeakPolarHBondContact O-CB 3.32Å; Y124-F128 PolarHBondContact O-N 2.88Å |
| 125 | L | 82.3 | Confident | 86.9 | Confident | 110 Ų | 110 | 110.3 Ų | 110.3 | 58% | 0.576 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.8 | -42.1 | 172.8 | -77.7 | 171.9 | 0 | 0 | 0 | 111 | V121 Q122 F128 Q129 | V121-L125 HydrophobicContact CG1-CD1 3.78Å; V121-L125 HydrophobicContact CG1-CG 3.88Å; V121-L125 PolarHBondContact O-N 3.33Å; Q122-L125 PolarHBondContact O-N 3.12Å; L125-F128 PolarHBondContact O-N 3.18Å; L125-Q129 VanDerWaalsContact O-CB 3.28Å; L125-Q129 WeakPolarHBondContact O-CB 3.2Å; L125-Q129 PolarHBondContact O-N 3.38Å |
| 126 | D | 87.8 | Confident | 87 | Confident | 83 Ų | 83 | 109.1 Ų | 109.1 | 44% | 0.444 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63.2 | -43.4 | 175.1 | -74.4 | -50.4 | 0 | 0 | 0 | 111.9 | Q122 Q129 K130 | Q122-D126 PolarHBondContact O-N 3.21Å; D126-Q129 PolarHBondContact O-N 2.83Å; D126-K130 VanDerWaalsContact O-CG 3.32Å; D126-K130 WeakPolarHBondContact O-CG 3.26Å; D126-K130 PolarHBondContact O-N 2.87Å |
| 127 | D | 89.9 | Confident | 87.3 | Confident | 73 Ų | 73 | 110 Ų | 110 | 39% | 0.39 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -65.1 | -42.6 | 175.7 | -170.3 | -105.1 | 0 | 0 | 0 | 111.9 | P123 Y124 K130 K131 | P123-D127 WeakPolarHBondContact O-CB 3.25Å; P123-D127 PolarHBondContact O-N 3.13Å; Y124-D127 PolarHBondContact O-N 3.03Å; D127-K130 PolarHBondContact O-N 2.93Å; D127-K131 WeakPolarHBondContact O-CB 3.41Å; D127-K131 WeakPolarHBondContact O-CG 3.42Å; D127-K131 PolarHBondContact O-N 2.99Å; D127-K131 VanDerWaalsContact OD1-CE 3.26Å; D127-K131 WeakPolarHBondContact OD1-CE 3.48Å; D127-K131 IonicContact OD1-NZ 2.7Å; D127-K131 PolarHBondContact OD1-NZ 3.46Å |
| 128 | F | 88.8 | Confident | 87.5 | Confident | 133 Ų | 133 | 110.8 Ų | 110.8 | 58% | 0.583 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.2 | -43.5 | 176.7 | -173.1 | -92.7 | 0 | 0 | 0 | 111.6 | Y124 L125 K130 K131 W132 | Y124-F128 WeakPolarHBondContact O-CB 3.32Å; Y124-F128 PolarHBondContact O-N 2.88Å; L125-F128 PolarHBondContact O-N 3.18Å; F128-K130 VanDerWaalsContact C-N 3.33Å; F128-K130 PolarHBondContact O-N 3.49Å; F128-K131 PolarHBondContact O-N 2.84Å; F128-W132 HydrophobicContact CZ-CE3 4.44Å; F128-W132 VanDerWaalsContact O-CB 3.25Å; F128-W132 WeakPolarHBondContact O-CB 3.28Å; F128-W132 PolarHBondContact O-N 3.44Å |
| 129 | Q | 85.5 | Confident | 87.8 | Confident | 118 Ų | 118 | 112 Ų | 112 | 55% | 0.551 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.4 | -38.5 | 177.9 | -169.1 | 178.3 | -55.3 | 0 | 0 | 111.5 | L125 D126 Q133 | L125-Q129 VanDerWaalsContact O-CB 3.28Å; L125-Q129 WeakPolarHBondContact O-CB 3.2Å; L125-Q129 PolarHBondContact O-N 3.38Å; D126-Q129 PolarHBondContact O-N 2.83Å; Q129-Q133 WeakPolarHBondContact O-CG 3.23Å; Q129-Q133 PolarHBondContact O-N 3.07Å |
| 130 | K | 90.4 | Very high | 87.8 | Confident | 134 Ų | 134 | 117.7 Ų | 117.7 | 58% | 0.583 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.8 | -50.5 | 173.1 | -75.3 | 175.6 | -177.2 | 178.4 | 0 | 111.9 | D126 D127 F128 W132 Q133 E134 | D126-K130 VanDerWaalsContact O-CG 3.32Å; D126-K130 WeakPolarHBondContact O-CG 3.26Å; D126-K130 PolarHBondContact O-N 2.87Å; D127-K130 PolarHBondContact O-N 2.93Å; F128-K130 VanDerWaalsContact C-N 3.33Å; F128-K130 PolarHBondContact O-N 3.49Å; K130-W132 VanDerWaalsContact C-N 3.29Å; K130-W132 PolarHBondContact O-N 2.82Å; K130-Q133 PolarHBondContact O-N 3.3Å; K130-Q133 VanDerWaalsContact O-N 3.15Å; K130-E134 PolarHBondContact O-N 3.41Å |
| 131 | K | 90.8 | Very high | 87.9 | Confident | 109 Ų | 109 | 117.8 Ų | 117.8 | 47% | 0.474 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -59.3 | -40.4 | 176.9 | -78.3 | 174.8 | 175.7 | 155.6 | 0 | 112.4 | D127 F128 E134 E135 | D127-K131 WeakPolarHBondContact O-CB 3.41Å; D127-K131 WeakPolarHBondContact O-CG 3.42Å; D127-K131 PolarHBondContact O-N 2.99Å; D127-K131 VanDerWaalsContact OD1-CE 3.26Å; D127-K131 WeakPolarHBondContact OD1-CE 3.48Å; D127-K131 IonicContact OD1-NZ 2.7Å; D127-K131 PolarHBondContact OD1-NZ 3.46Å; F128-K131 PolarHBondContact O-N 2.84Å; K131-E134 PolarHBondContact O-N 2.95Å; K131-E135 WeakPolarHBondContact O-CB 3.48Å; K131-E135 PolarHBondContact O-N 2.89Å |
| 132 | W | 88.2 | Confident | 88 | Confident | 140 Ų | 140 | 121.7 Ų | 121.7 | 53% | 0.53 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -64.1 | -40.6 | 176.6 | -177.7 | -92.3 | 0 | 0 | 0 | 112.2 | F128 K130 M136 | F128-W132 HydrophobicContact CZ-CE3 4.44Å; F128-W132 VanDerWaalsContact O-CB 3.25Å; F128-W132 WeakPolarHBondContact O-CB 3.28Å; F128-W132 PolarHBondContact O-N 3.44Å; K130-W132 VanDerWaalsContact C-N 3.29Å; K130-W132 PolarHBondContact O-N 2.82Å; W132-M136 HydrophobicContact CZ2-CG 4.48Å; W132-M136 VanDerWaalsContact O-CB 3.29Å; W132-M136 WeakPolarHBondContact O-CB 3.42Å; W132-M136 WeakPolarHBondContact O-CG 3.41Å; W132-M136 PolarHBondContact O-N 2.87Å |
| 133 | Q | 89.5 | Confident | 88.3 | Confident | 106 Ų | 106 | 119.7 Ų | 119.7 | 50% | 0.495 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -63.8 | -46 | 174.1 | -76.7 | 179.4 | -8.4 | 0 | 0 | 111.3 | Q129 K130 E135 M136 E137 | Q129-Q133 WeakPolarHBondContact O-CG 3.23Å; Q129-Q133 PolarHBondContact O-N 3.07Å; K130-Q133 PolarHBondContact O-N 3.3Å; K130-Q133 VanDerWaalsContact O-N 3.15Å; Q133-E135 PolarHBondContact O-N 3.37Å; Q133-M136 PolarHBondContact O-N 3.47Å; Q133-E137 WeakPolarHBondContact O-CG 3.24Å; Q133-E137 PolarHBondContact O-N 3.27Å |
| 134 | E | 91.4 | Very high | 88 | Confident | 123 Ų | 123 | 122.7 Ų | 122.7 | 58% | 0.575 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -60.5 | -44.9 | 176.1 | -72.3 | 177.4 | -177.6 | 0 | 0 | 112.2 | K130 K131 E137 L138 | K130-E134 PolarHBondContact O-N 3.41Å; K131-E134 PolarHBondContact O-N 2.95Å; E134-E137 PolarHBondContact O-N 2.95Å; E134-L138 WeakPolarHBondContact O-CB 3.43Å; E134-L138 WeakPolarHBondContact O-CG 3.29Å; E134-L138 PolarHBondContact O-N 2.9Å |
| 135 | E | 89.7 | Confident | 88.1 | Confident | 128 Ų | 128 | 117.3 Ų | 117.3 | 60% | 0.598 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -64.6 | -40.4 | 176.1 | -78.9 | -162.9 | 113.4 | 0 | 0 | 112.1 | K131 Q133 L138 Y139 | K131-E135 WeakPolarHBondContact O-CB 3.48Å; K131-E135 PolarHBondContact O-N 2.89Å; Q133-E135 PolarHBondContact O-N 3.37Å; E135-L138 PolarHBondContact O-N 3.3Å; E135-Y139 VanDerWaalsContact O-CB 3.29Å; E135-Y139 WeakPolarHBondContact O-CB 3.33Å; E135-Y139 PolarHBondContact O-N 3.29Å |
| 136 | M | 87.4 | Confident | 88.2 | Confident | 108 Ų | 108 | 116.8 Ų | 116.8 | 53% | 0.532 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.8 | -37.4 | 176.2 | -81.8 | -72.7 | -94.4 | 0 | 0 | 112.2 | W132 Q133 Y139 R140 | W132-M136 HydrophobicContact CZ2-CG 4.48Å; W132-M136 VanDerWaalsContact O-CB 3.29Å; W132-M136 WeakPolarHBondContact O-CB 3.42Å; W132-M136 WeakPolarHBondContact O-CG 3.41Å; W132-M136 PolarHBondContact O-N 2.87Å; Q133-M136 PolarHBondContact O-N 3.47Å; M136-Y139 PolarHBondContact O-N 2.71Å; M136-R140 VanDerWaalsContact O-CB 3.24Å; M136-R140 WeakPolarHBondContact O-CB 3.25Å; M136-R140 PolarHBondContact O-N 3.35Å |
| 137 | E | 90.3 | Very high | 88 | Confident | 119 Ų | 119 | 121.7 Ų | 121.7 | 56% | 0.556 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -65.5 | -44.9 | 173.7 | -76.1 | -175 | 91.4 | 0 | 0 | 111.4 | Q133 E134 Y139 R140 Q141 | Q133-E137 WeakPolarHBondContact O-CG 3.24Å; Q133-E137 PolarHBondContact O-N 3.27Å; E134-E137 PolarHBondContact O-N 2.95Å; E137-Y139 VanDerWaalsContact C-N 3.33Å; E137-Y139 PolarHBondContact O-N 3.01Å; E137-R140 PolarHBondContact O-N 3.38Å; E137-Q141 WeakPolarHBondContact O-CB 3.38Å; E137-Q141 WeakPolarHBondContact O-CG 3.35Å; E137-Q141 PolarHBondContact O-N 3.34Å |
| 138 | L | 89.4 | Confident | 87.9 | Confident | 98 Ų | 98 | 120.5 Ų | 120.5 | 51% | 0.513 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -61 | -41.9 | 173.7 | -76.4 | 164.4 | 0 | 0 | 0 | 112 | E134 E135 Q141 K142 | E134-L138 WeakPolarHBondContact O-CB 3.43Å; E134-L138 WeakPolarHBondContact O-CG 3.29Å; E134-L138 PolarHBondContact O-N 2.9Å; E135-L138 PolarHBondContact O-N 3.3Å; L138-Q141 PolarHBondContact O-N 3.44Å; L138-K142 WeakPolarHBondContact O-CG 3.41Å; L138-K142 PolarHBondContact O-N 3.16Å |
| 139 | Y | 87.9 | Confident | 87.9 | Confident | 163 Ų | 163 | 120.1 Ų | 120.1 | 64% | 0.639 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -66.1 | -42.9 | 177.5 | -159.4 | -93.2 | 0 | 0 | 0 | 110.9 | E135 M136 E137 Q141 K142 V143 | E135-Y139 VanDerWaalsContact O-CB 3.29Å; E135-Y139 WeakPolarHBondContact O-CB 3.33Å; E135-Y139 PolarHBondContact O-N 3.29Å; M136-Y139 PolarHBondContact O-N 2.71Å; E137-Y139 VanDerWaalsContact C-N 3.33Å; E137-Y139 PolarHBondContact O-N 3.01Å; Y139-Q141 PolarHBondContact O-N 3.03Å; Y139-K142 PolarHBondContact O-N 3.44Å; Y139-V143 HydrophobicContact CD1-CG2 3.62Å; Y139-V143 HydrophobicContact CE1-CG2 3.45Å; Y139-V143 VanDerWaalsContact CE1-CG2 3.45Å; Y139-V143 HydrophobicContact CG-CG2 4.45Å; Y139-V143 WeakPolarHBondContact O-CB 3.29Å; Y139-V143 VanDerWaalsContact O-CG2 3.24Å; Y139-V143 WeakPolarHBondContact O-CG2 3.24Å; Y139-V143 PolarHBondContact O-N 3.42Å |
| 140 | R | 86.6 | Confident | 88.1 | Confident | 186 Ų | 186 | 120.5 Ų | 120.5 | 70% | 0.702 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -62 | -43.5 | 176.1 | -168.1 | 177.3 | -167.7 | 168.4 | 3.3 | 111.8 | M136 E137 K142 V143 E144 | M136-R140 VanDerWaalsContact O-CB 3.24Å; M136-R140 WeakPolarHBondContact O-CB 3.25Å; M136-R140 PolarHBondContact O-N 3.35Å; E137-R140 PolarHBondContact O-N 3.38Å; R140-K142 VanDerWaalsContact C-N 3.28Å; R140-K142 PolarHBondContact O-N 3.24Å; R140-V143 PolarHBondContact O-N 2.79Å; R140-E144 PolarHBondContact O-N 3.05Å |
| 141 | Q | 88.3 | Confident | 88 | Confident | 127 Ų | 127 | 118.8 Ų | 118.8 | 59% | 0.593 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -62.2 | -32.7 | 175 | -75.5 | 178.7 | 19.9 | 0 | 0 | 112.9 | E137 L138 Y139 P145 | E137-Q141 WeakPolarHBondContact O-CB 3.38Å; E137-Q141 WeakPolarHBondContact O-CG 3.35Å; E137-Q141 PolarHBondContact O-N 3.34Å; L138-Q141 PolarHBondContact O-N 3.44Å; Y139-Q141 PolarHBondContact O-N 3.03Å; Q141-P145 WeakPolarHBondContact O-CD 3.35Å; Q141-P145 WeakPolarHBondContact O-CG 2.94Å |
| 142 | K | 86.7 | Confident | 88 | Confident | 146 Ų | 146 | 120 Ų | 120 | 64% | 0.635 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -77.8 | -34.8 | 174.2 | -73.2 | 179.6 | 179.9 | 179.3 | 0 | 112.8 | L138 Y139 R140 P145 L146 | L138-K142 WeakPolarHBondContact O-CG 3.41Å; L138-K142 PolarHBondContact O-N 3.16Å; Y139-K142 PolarHBondContact O-N 3.44Å; R140-K142 VanDerWaalsContact C-N 3.28Å; R140-K142 PolarHBondContact O-N 3.24Å; K142-P145 WeakPolarHBondContact O-CD 3.45Å; K142-P145 WeakPolarHBondContact O-CG 3.48Å; K142-L146 WeakPolarHBondContact O-CD1 3.19Å |
| 143 | V | 88.3 | Confident | 88.1 | Confident | 62 Ų | 62 | 114.7 Ų | 114.7 | 38% | 0.376 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -81.5 | -34 | -175.5 | 171.8 | 0 | 0 | 0 | 0 | 112.7 | Y139 R140 L146 R147 | Y139-V143 HydrophobicContact CD1-CG2 3.62Å; Y139-V143 HydrophobicContact CE1-CG2 3.45Å; Y139-V143 VanDerWaalsContact CE1-CG2 3.45Å; Y139-V143 HydrophobicContact CG-CG2 4.45Å; Y139-V143 WeakPolarHBondContact O-CB 3.29Å; Y139-V143 VanDerWaalsContact O-CG2 3.24Å; Y139-V143 WeakPolarHBondContact O-CG2 3.24Å; Y139-V143 PolarHBondContact O-N 3.42Å; R140-V143 PolarHBondContact O-N 2.79Å; V143-L146 PolarHBondContact O-N 2.93Å; V143-R147 WeakPolarHBondContact O-CB 3.48Å; V143-R147 PolarHBondContact O-N 2.9Å |
| 144 | E | 83.2 | Confident | 88.1 | Confident | 137 Ų | 137 | 112.1 Ų | 112.1 | 64% | 0.64 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -52.9 | -53.7 | 175.9 | -105.5 | -165.1 | 116.6 | 0 | 0 | 113.8 | R140 R147 A148 | R140-E144 PolarHBondContact O-N 3.05Å; E144-R147 PolarHBondContact O-N 3.22Å; E144-A148 PolarHBondContact O-N 2.73Å; E144-A148 VanDerWaalsContact O-N 3.11Å |
| 145 | P | 87.7 | Confident | 88 | Confident | 60 Ų | 60 | 114 Ų | 114 | 39% | 0.39 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -66.9 | -40.3 | 179 | 25.2 | -33 | 0 | 0 | 0 | 111.6 | Q141 K142 R147 A148 E149 | Q141-P145 WeakPolarHBondContact O-CD 3.35Å; Q141-P145 WeakPolarHBondContact O-CG 2.94Å; K142-P145 WeakPolarHBondContact O-CD 3.45Å; K142-P145 WeakPolarHBondContact O-CG 3.48Å; P145-R147 PolarHBondContact O-N 3.24Å; P145-A148 CarbonylContact O-C 3.59Å; P145-A148 WeakPolarHBondContact O-CB 3.46Å; P145-A148 PolarHBondContact O-N 3.3Å; P145-E149 WeakPolarHBondContact O-CB 3.24Å; P145-E149 WeakPolarHBondContact O-CG 3.48Å; P145-E149 PolarHBondContact O-N 2.92Å |
| 146 | L | 83.8 | Confident | 88.1 | Confident | 99 Ų | 99 | 114.2 Ų | 114.2 | 52% | 0.518 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -58.1 | -37.9 | 176.1 | -103.4 | 70 | 0 | 0 | 0 | 112.2 | K142 V143 L150 | K142-L146 WeakPolarHBondContact O-CD1 3.19Å; V143-L146 PolarHBondContact O-N 2.93Å; L146-L150 VanDerWaalsContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.36Å |
| 147 | R | 83.6 | Confident | 88.2 | Confident | 187 Ų | 187 | 114.9 Ų | 114.9 | 71% | 0.706 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -68.6 | -40.8 | 176.3 | -166.8 | -177.2 | -162.4 | 176.9 | 5.9 | 111.6 | V143 E144 P145 Q151 | V143-R147 WeakPolarHBondContact O-CB 3.48Å; V143-R147 PolarHBondContact O-N 2.9Å; E144-R147 PolarHBondContact O-N 3.22Å; P145-R147 PolarHBondContact O-N 3.24Å; R147-Q151 VanDerWaalsContact O-CB 3.28Å; R147-Q151 WeakPolarHBondContact O-CB 3.28Å; R147-Q151 PolarHBondContact O-N 3.44Å |
| 148 | A | 88.2 | Confident | 88.2 | Confident | 48 Ų | 48 | 114.9 Ų | 114.9 | 40% | 0.397 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -64.1 | -48.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | E144 P145 L150 Q151 E152 | E144-A148 PolarHBondContact O-N 2.73Å; E144-A148 VanDerWaalsContact O-N 3.11Å; P145-A148 CarbonylContact O-C 3.59Å; P145-A148 WeakPolarHBondContact O-CB 3.46Å; P145-A148 PolarHBondContact O-N 3.3Å; A148-L150 PolarHBondContact O-N 2.82Å; A148-Q151 PolarHBondContact O-N 2.85Å; A148-Q151 VanDerWaalsContact O-N 3.15Å; A148-E152 WeakPolarHBondContact O-CG 3.45Å; A148-E152 PolarHBondContact O-N 3.15Å |
| 149 | E | 89.4 | Confident | 88.2 | Confident | 124 Ų | 124 | 115.5 Ų | 115.5 | 58% | 0.579 | 55% | 0.55 | S | S | * | * | H | α-helix | trans | -60.5 | -42.8 | 176.8 | -72.3 | -178.7 | 93.8 | 0 | 0 | 111.9 | P145 E152 G153 | P145-E149 WeakPolarHBondContact O-CB 3.24Å; P145-E149 WeakPolarHBondContact O-CG 3.48Å; P145-E149 PolarHBondContact O-N 2.92Å; E149-E152 PolarHBondContact O-N 2.87Å; E149-G153 PolarHBondContact O-N 2.97Å |
| 150 | L | 89.4 | Confident | 88.2 | Confident | 126 Ų | 126 | 110.9 Ų | 110.9 | 66% | 0.66 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -64.8 | -39.5 | 175 | -77 | 171.5 | 0 | 0 | 0 | 112.1 | L146 A148 A154 | L146-L150 VanDerWaalsContact O-CB 3.28Å; L146-L150 WeakPolarHBondContact O-CB 3.34Å; L146-L150 WeakPolarHBondContact O-CG 3.44Å; L146-L150 PolarHBondContact O-N 3.36Å; A148-L150 PolarHBondContact O-N 2.82Å; L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.78Å |
| 151 | Q | 88.8 | Confident | 88.4 | Confident | 99 Ų | 99 | 106.5 Ų | 106.5 | 46% | 0.463 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -69.4 | -40.3 | 178.8 | -176.5 | 174.7 | -18.7 | 0 | 0 | 111.8 | R147 A148 R155 | R147-Q151 VanDerWaalsContact O-CB 3.28Å; R147-Q151 WeakPolarHBondContact O-CB 3.28Å; R147-Q151 PolarHBondContact O-N 3.44Å; A148-Q151 PolarHBondContact O-N 2.85Å; A148-Q151 VanDerWaalsContact O-N 3.15Å; Q151-R155 WeakPolarHBondContact O-CB 3.37Å; Q151-R155 WeakPolarHBondContact O-CG 3.15Å; Q151-R155 PolarHBondContact O-N 3.46Å |
| 152 | E | 90 | Very high | 88.2 | Confident | 133 Ų | 133 | 106.8 Ų | 106.8 | 62% | 0.621 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.1 | -47.3 | 174.2 | -72.7 | -174.8 | 162.6 | 0 | 0 | 111.3 | A148 E149 A154 R155 Q156 | A148-E152 WeakPolarHBondContact O-CG 3.45Å; A148-E152 PolarHBondContact O-N 3.15Å; E149-E152 PolarHBondContact O-N 2.87Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 2.92Å; E152-R155 PolarHBondContact O-N 3.49Å; E152-Q156 WeakPolarHBondContact O-CB 3.28Å; E152-Q156 PolarHBondContact O-N 3.15Å |
| 153 | G | 90.2 | Very high | 88.2 | Confident | 29 Ų | 29 | 105.7 Ų | 105.7 | 30% | 0.299 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.3 | -40.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | E149 Q156 K157 | E149-G153 PolarHBondContact O-N 2.97Å; G153-Q156 PolarHBondContact O-N 2.9Å; G153-K157 WeakPolarHBondContact O-CB 3.44Å; G153-K157 VanDerWaalsContact O-CG 3.29Å; G153-K157 WeakPolarHBondContact O-CG 3.45Å; G153-K157 PolarHBondContact O-N 3.11Å |
| 154 | A | 90.4 | Very high | 88.1 | Confident | 52 Ų | 52 | 110 Ų | 110 | 43% | 0.43 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.4 | -40.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | L150 E152 K157 L158 | L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.78Å; E152-A154 VanDerWaalsContact C-N 3.33Å; E152-A154 PolarHBondContact O-N 2.92Å; A154-K157 PolarHBondContact O-N 3.2Å; A154-L158 WeakPolarHBondContact O-CB 3.47Å; A154-L158 WeakPolarHBondContact O-CG 3.29Å; A154-L158 PolarHBondContact O-N 3.4Å |
| 155 | R | 89.7 | Confident | 88.2 | Confident | 163 Ų | 163 | 108.1 Ų | 108.1 | 62% | 0.615 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -64.5 | -43.6 | 174.9 | -80.8 | 179.4 | 175.2 | 160.8 | -1.7 | 111.9 | Q151 E152 L158 H159 | Q151-R155 WeakPolarHBondContact O-CB 3.37Å; Q151-R155 WeakPolarHBondContact O-CG 3.15Å; Q151-R155 PolarHBondContact O-N 3.46Å; E152-R155 PolarHBondContact O-N 3.49Å; R155-L158 PolarHBondContact O-N 3.34Å; R155-H159 PolarHBondContact O-N 2.79Å |
| 156 | Q | 91.7 | Very high | 87.9 | Confident | 132 Ų | 132 | 109 Ų | 109 | 62% | 0.617 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -62.5 | -46.2 | 177.2 | -168.8 | 178.6 | 15.8 | 0 | 0 | 110.9 | E152 G153 L158 H159 E160 | E152-Q156 WeakPolarHBondContact O-CB 3.28Å; E152-Q156 PolarHBondContact O-N 3.15Å; G153-Q156 PolarHBondContact O-N 2.9Å; Q156-L158 PolarHBondContact O-N 3.44Å; Q156-H159 WeakPolarHBondContact O-CB 3.47Å; Q156-H159 PolarHBondContact O-N 2.89Å; Q156-H159 VanDerWaalsContact O-N 3.15Å; Q156-E160 WeakPolarHBondContact O-CG 3.48Å; Q156-E160 PolarHBondContact O-N 3.47Å |
| 157 | K | 89.5 | Confident | 88.1 | Confident | 122 Ų | 122 | 107.6 Ų | 107.6 | 53% | 0.53 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -62.8 | -39.3 | 176.5 | -75.1 | -73.7 | 163.6 | -138 | 0 | 112.9 | G153 A154 H159 E160 L161 | G153-K157 WeakPolarHBondContact O-CB 3.44Å; G153-K157 VanDerWaalsContact O-CG 3.29Å; G153-K157 WeakPolarHBondContact O-CG 3.45Å; G153-K157 PolarHBondContact O-N 3.11Å; A154-K157 PolarHBondContact O-N 3.2Å; K157-H159 VanDerWaalsContact C-N 3.33Å; K157-E160 WeakPolarHBondContact CD-OE2 3.31Å; K157-E160 WeakPolarHBondContact CE-OE2 3.43Å; K157-E160 IonicContact NZ-OE1 3.52Å; K157-E160 IonicContact NZ-OE2 3.61Å; K157-E160 PolarHBondContact NZ-OE2 3.03Å; K157-E160 PolarHBondContact O-N 3.4Å; K157-L161 WeakPolarHBondContact O-CB 3.27Å; K157-L161 VanDerWaalsContact O-CD1 3.27Å; K157-L161 WeakPolarHBondContact O-CD1 3.5Å; K157-L161 PolarHBondContact O-N 3.49Å |
| 158 | L | 89.5 | Confident | 88 | Confident | 119 Ų | 119 | 103.1 Ų | 103.1 | 62% | 0.623 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -64 | -39.5 | 174 | -80.6 | 169.8 | 0 | 0 | 0 | 111.7 | A154 R155 Q156 L161 Q162 | A154-L158 WeakPolarHBondContact O-CB 3.47Å; A154-L158 WeakPolarHBondContact O-CG 3.29Å; A154-L158 PolarHBondContact O-N 3.4Å; R155-L158 PolarHBondContact O-N 3.34Å; Q156-L158 PolarHBondContact O-N 3.44Å; L158-L161 PolarHBondContact O-N 3.36Å; L158-Q162 WeakPolarHBondContact O-CB 3.33Å; L158-Q162 PolarHBondContact O-N 3.49Å |
| 159 | H | 88.8 | Confident | 87.9 | Confident | 112 Ų | 112 | 102.8 Ų | 102.8 | 52% | 0.519 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -65.5 | -47.5 | 176.2 | -157.8 | 70.8 | 0 | 0 | 0 | 111.5 | R155 Q156 K157 L161 Q162 E163 | R155-H159 PolarHBondContact O-N 2.79Å; Q156-H159 WeakPolarHBondContact O-CB 3.47Å; Q156-H159 PolarHBondContact O-N 2.89Å; Q156-H159 VanDerWaalsContact O-N 3.15Å; K157-H159 VanDerWaalsContact C-N 3.33Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.91Å; H159-Q162 PolarHBondContact O-N 2.94Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; H159-E163 IonicContact CD2-OE2 3.83Å; H159-E163 PolarHBondContact O-N 3.05Å |
| 160 | E | 89.1 | Confident | 87.7 | Confident | 65 Ų | 65 | 103 Ų | 103 | 30% | 0.304 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -58.9 | -39.9 | 174.6 | -70.6 | -178.7 | 91.8 | 0 | 0 | 112 | Q156 K157 K164 | Q156-E160 WeakPolarHBondContact O-CG 3.48Å; Q156-E160 PolarHBondContact O-N 3.47Å; K157-E160 WeakPolarHBondContact CD-OE2 3.31Å; K157-E160 WeakPolarHBondContact CE-OE2 3.43Å; K157-E160 IonicContact NZ-OE1 3.52Å; K157-E160 IonicContact NZ-OE2 3.61Å; K157-E160 PolarHBondContact NZ-OE2 3.03Å; K157-E160 PolarHBondContact O-N 3.4Å; E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 VanDerWaalsContact O-CG 3.31Å; E160-K164 WeakPolarHBondContact O-CG 3.44Å; E160-K164 PolarHBondContact O-N 2.9Å |
| 161 | L | 89.4 | Confident | 87.6 | Confident | 95 Ų | 95 | 102 Ų | 102 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.4 | -43.6 | 175 | -104 | 83.2 | 0 | 0 | 0 | 111.4 | K157 L158 H159 E163 K164 L165 | K157-L161 WeakPolarHBondContact O-CB 3.27Å; K157-L161 VanDerWaalsContact O-CD1 3.27Å; K157-L161 WeakPolarHBondContact O-CD1 3.5Å; K157-L161 PolarHBondContact O-N 3.49Å; L158-L161 PolarHBondContact O-N 3.36Å; H159-L161 VanDerWaalsContact C-N 3.29Å; H159-L161 PolarHBondContact O-N 2.91Å; L161-E163 VanDerWaalsContact C-N 3.35Å; L161-K164 PolarHBondContact O-N 2.97Å; L161-L165 VanDerWaalsContact O-CB 3.22Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.36Å; L161-L165 PolarHBondContact O-N 3.08Å |
| 162 | Q | 84.4 | Confident | 87.6 | Confident | 133 Ų | 133 | 102.7 Ų | 102.7 | 62% | 0.621 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -62.1 | -44.1 | 178.4 | -176.1 | 179 | -1.8 | 0 | 0 | 111 | L158 H159 K164 L165 S166 | L158-Q162 WeakPolarHBondContact O-CB 3.33Å; L158-Q162 PolarHBondContact O-N 3.49Å; H159-Q162 PolarHBondContact O-N 2.94Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; Q162-K164 VanDerWaalsContact C-N 3.33Å; Q162-K164 PolarHBondContact O-N 3.44Å; Q162-L165 PolarHBondContact O-N 3.41Å; Q162-S166 PolarHBondContact O-N 3.1Å |
| 163 | E | 86.4 | Confident | 87.5 | Confident | 123 Ų | 123 | 103.7 Ų | 103.7 | 58% | 0.575 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.2 | -38.5 | 175.1 | -75.3 | -172.1 | 97.8 | 0 | 0 | 112.2 | H159 L161 P167 | H159-E163 IonicContact CD2-OE2 3.83Å; H159-E163 PolarHBondContact O-N 3.05Å; L161-E163 VanDerWaalsContact C-N 3.35Å; E163-P167 WeakPolarHBondContact O-CD 3.5Å |
| 164 | K | 86.2 | Confident | 87.5 | Confident | 152 Ų | 152 | 107 Ų | 107 | 66% | 0.661 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -75.6 | -30.8 | 176 | -73.6 | -179.9 | -178.5 | 179.6 | 0 | 113.6 | E160 L161 Q162 P167 | E160-K164 WeakPolarHBondContact O-CB 3.41Å; E160-K164 VanDerWaalsContact O-CG 3.31Å; E160-K164 WeakPolarHBondContact O-CG 3.44Å; E160-K164 PolarHBondContact O-N 2.9Å; L161-K164 PolarHBondContact O-N 2.97Å; Q162-K164 VanDerWaalsContact C-N 3.33Å; Q162-K164 PolarHBondContact O-N 3.44Å; K164-P167 WeakPolarHBondContact O-CD 3.46Å; K164-P167 WeakPolarHBondContact O-CG 3.46Å |
| 165 | L | 85.4 | Confident | 87.4 | Confident | 97 Ų | 97 | 110.8 Ų | 110.8 | 51% | 0.508 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -80.1 | -29.7 | -178.9 | -76.6 | 169.4 | 0 | 0 | 0 | 112.5 | L161 Q162 L168 G169 | L161-L165 VanDerWaalsContact O-CB 3.22Å; L161-L165 WeakPolarHBondContact O-CB 3.42Å; L161-L165 WeakPolarHBondContact O-CG 3.36Å; L161-L165 PolarHBondContact O-N 3.08Å; Q162-L165 PolarHBondContact O-N 3.41Å; L165-L168 HydrophobicContact CD2-CD2 4.33Å; L165-L168 PolarHBondContact O-N 3.4Å; L165-G169 PolarHBondContact O-N 3.44Å |
| 166 | S | 82.3 | Confident | 87.4 | Confident | 79 Ų | 79 | 105.6 Ų | 105.6 | 55% | 0.552 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -57.8 | -51.3 | 178.8 | -152.6 | 0 | 0 | 0 | 0 | 113.3 | Q162 L168 G169 E170 | Q162-S166 PolarHBondContact O-N 3.1Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 2.99Å; S166-G169 PolarHBondContact O-N 3.44Å; S166-E170 PolarHBondContact O-N 3.35Å; S166-E170 VanDerWaalsContact O-N 3.11Å |
| 167 | P | 86.8 | Confident | 87.3 | Confident | 69 Ų | 69 | 105.6 Ų | 105.6 | 45% | 0.448 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.2 | -33.2 | 176.8 | 27.6 | -34.6 | 0 | 0 | 0 | 112 | E163 K164 G169 E170 E171 | E163-P167 WeakPolarHBondContact O-CD 3.5Å; K164-P167 WeakPolarHBondContact O-CD 3.46Å; K164-P167 WeakPolarHBondContact O-CG 3.46Å; P167-G169 VanDerWaalsContact C-N 3.28Å; P167-G169 PolarHBondContact O-N 3.32Å; P167-E170 PolarHBondContact O-N 2.9Å; P167-E171 WeakPolarHBondContact O-CB 3.49Å; P167-E171 PolarHBondContact O-N 3.37Å |
| 168 | L | 82.8 | Confident | 87.3 | Confident | 93 Ų | 93 | 102.6 Ų | 102.6 | 49% | 0.487 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.7 | -36.3 | 176.5 | -158.1 | 76.2 | 0 | 0 | 0 | 111.4 | L165 S166 M172 | L165-L168 HydrophobicContact CD2-CD2 4.33Å; L165-L168 PolarHBondContact O-N 3.4Å; S166-L168 VanDerWaalsContact C-N 3.34Å; S166-L168 PolarHBondContact O-N 2.99Å; L168-M172 VanDerWaalsContact O-CB 3.29Å; L168-M172 WeakPolarHBondContact O-CB 2.95Å; L168-M172 WeakPolarHBondContact O-CG 3.46Å; L168-M172 PolarHBondContact O-N 2.94Å |
| 169 | G | 85.3 | Confident | 87.3 | Confident | 41 Ų | 41 | 102.6 Ų | 102.6 | 42% | 0.423 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -67.9 | -40 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L165 S166 P167 R173 | L165-G169 PolarHBondContact O-N 3.44Å; S166-G169 PolarHBondContact O-N 3.44Å; P167-G169 VanDerWaalsContact C-N 3.28Å; P167-G169 PolarHBondContact O-N 3.32Å; G169-R173 VanDerWaalsContact O-CB 3.24Å; G169-R173 WeakPolarHBondContact O-CB 3.17Å; G169-R173 PolarHBondContact O-N 2.98Å |
| 170 | E | 86.2 | Confident | 87.3 | Confident | 130 Ų | 130 | 101.9 Ų | 101.9 | 61% | 0.607 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.4 | -48.3 | 172.6 | -71.1 | -169.2 | 151 | 0 | 0 | 111.4 | S166 P167 M172 R173 D174 | S166-E170 PolarHBondContact O-N 3.35Å; S166-E170 VanDerWaalsContact O-N 3.11Å; P167-E170 PolarHBondContact O-N 2.9Å; E170-M172 VanDerWaalsContact C-N 3.31Å; E170-M172 PolarHBondContact O-N 3.29Å; E170-R173 WeakPolarHBondContact O-CB 3.22Å; E170-R173 PolarHBondContact O-N 3.31Å; E170-D174 PolarHBondContact O-N 3.5Å |
| 171 | E | 87.6 | Confident | 87.3 | Confident | 103 Ų | 103 | 103.1 Ų | 103.1 | 48% | 0.481 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -61.4 | -39.9 | 178.3 | -163.3 | -175.1 | 126.6 | 0 | 0 | 111.8 | P167 R175 | P167-E171 WeakPolarHBondContact O-CB 3.49Å; P167-E171 PolarHBondContact O-N 3.37Å; E171-R175 VanDerWaalsContact O-CB 3.23Å; E171-R175 WeakPolarHBondContact O-CB 3.33Å; E171-R175 PolarHBondContact O-N 2.85Å; E171-R175 IonicContact OE1-CZ 3.7Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.13Å |
| 172 | M | 88.1 | Confident | 87.2 | Confident | 115 Ų | 115 | 100.9 Ų | 100.9 | 57% | 0.567 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 173.1 | -79 | -69.7 | -154.8 | 0 | 0 | 112.1 | L168 E170 R175 A176 | L168-M172 VanDerWaalsContact O-CB 3.29Å; L168-M172 WeakPolarHBondContact O-CB 2.95Å; L168-M172 WeakPolarHBondContact O-CG 3.46Å; L168-M172 PolarHBondContact O-N 2.94Å; E170-M172 VanDerWaalsContact C-N 3.31Å; E170-M172 PolarHBondContact O-N 3.29Å; M172-R175 PolarHBondContact O-N 2.75Å; M172-A176 WeakPolarHBondContact O-CB 3.29Å; M172-A176 PolarHBondContact O-N 3.05Å |
| 173 | R | 87.1 | Confident | 87.3 | Confident | 154 Ų | 154 | 99.4 Ų | 99.4 | 58% | 0.581 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.5 | -40.8 | 178.9 | -176.8 | 179.2 | 174.9 | -175.4 | -1 | 111.5 | G169 E170 A176 R177 | G169-R173 VanDerWaalsContact O-CB 3.24Å; G169-R173 WeakPolarHBondContact O-CB 3.17Å; G169-R173 PolarHBondContact O-N 2.98Å; E170-R173 WeakPolarHBondContact O-CB 3.22Å; E170-R173 PolarHBondContact O-N 3.31Å; R173-A176 PolarHBondContact O-N 2.79Å; R173-R177 PolarHBondContact O-N 3.46Å |
| 174 | D | 90 | Very high | 87.2 | Confident | 97 Ų | 97 | 102.5 Ų | 102.5 | 52% | 0.519 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.2 | -42.6 | 174.9 | -81.5 | -47.3 | 0 | 0 | 0 | 111.5 | E170 A176 R177 A178 | E170-D174 PolarHBondContact O-N 3.5Å; D174-A176 VanDerWaalsContact C-N 3.32Å; D174-A176 PolarHBondContact O-N 3.26Å; D174-R177 PolarHBondContact O-N 2.87Å; D174-A178 WeakPolarHBondContact O-CB 3.35Å; D174-A178 PolarHBondContact O-N 3.13Å |
| 175 | R | 88.8 | Confident | 87.1 | Confident | 132 Ų | 132 | 99.8 Ų | 99.8 | 50% | 0.498 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.7 | -39.3 | 174.5 | -167.8 | 175.4 | -72.3 | 145.8 | 5.7 | 111.8 | E171 M172 A178 H179 | E171-R175 VanDerWaalsContact O-CB 3.23Å; E171-R175 WeakPolarHBondContact O-CB 3.33Å; E171-R175 PolarHBondContact O-N 2.85Å; E171-R175 IonicContact OE1-CZ 3.7Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 IonicContact OE1-NH2 2.73Å; E171-R175 PolarHBondContact OE1-NH2 3.13Å; M172-R175 PolarHBondContact O-N 2.75Å; R175-A178 PolarHBondContact O-N 2.93Å; R175-H179 WeakPolarHBondContact O-CB 3.19Å; R175-H179 PolarHBondContact O-N 2.82Å; R175-H179 PolarHBondContact O-ND1 3.49Å; R175-H179 VanDerWaalsContact O-ND1 3.1Å |
| 176 | A | 90.5 | Very high | 87 | Confident | 54 Ų | 54 | 101.9 Ų | 101.9 | 45% | 0.446 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | M172 R173 D174 H179 V180 | M172-A176 WeakPolarHBondContact O-CB 3.29Å; M172-A176 PolarHBondContact O-N 3.05Å; R173-A176 PolarHBondContact O-N 2.79Å; D174-A176 VanDerWaalsContact C-N 3.32Å; D174-A176 PolarHBondContact O-N 3.26Å; A176-H179 PolarHBondContact O-N 3Å; A176-V180 VanDerWaalsContact O-CG2 3.29Å; A176-V180 WeakPolarHBondContact O-CG2 3.42Å; A176-V180 PolarHBondContact O-N 3.03Å |
| 177 | R | 88.3 | Confident | 86.9 | Confident | 133 Ų | 133 | 102.4 Ų | 102.4 | 50% | 0.502 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -59.7 | -47.9 | 173.1 | -85.8 | 180 | 174.8 | 161 | -6.2 | 111.5 | R173 D174 H179 V180 D181 | R173-R177 PolarHBondContact O-N 3.46Å; D174-R177 PolarHBondContact O-N 2.87Å; R177-H179 VanDerWaalsContact C-N 3.29Å; R177-H179 PolarHBondContact O-N 2.7Å; R177-V180 PolarHBondContact O-N 3.46Å; R177-V180 VanDerWaalsContact O-N 3.11Å; R177-D181 PolarHBondContact O-N 2.86Å |
| 178 | A | 89.7 | Confident | 86.6 | Confident | 58 Ų | 58 | 101.3 Ų | 101.3 | 48% | 0.479 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59 | -40.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | D174 R175 A182 | D174-A178 WeakPolarHBondContact O-CB 3.35Å; D174-A178 PolarHBondContact O-N 3.13Å; R175-A178 PolarHBondContact O-N 2.93Å; A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.37Å; A178-A182 PolarHBondContact O-N 2.78Å |
| 179 | H | 89.1 | Confident | 86.3 | Confident | 119 Ų | 119 | 100.8 Ų | 100.8 | 55% | 0.551 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -66.6 | -41 | 174.7 | -83.2 | 46.6 | 0 | 0 | 0 | 112.3 | R175 A176 R177 A182 L183 | R175-H179 WeakPolarHBondContact O-CB 3.19Å; R175-H179 PolarHBondContact O-N 2.82Å; R175-H179 PolarHBondContact O-ND1 3.49Å; R175-H179 VanDerWaalsContact O-ND1 3.1Å; A176-H179 PolarHBondContact O-N 3Å; R177-H179 VanDerWaalsContact C-N 3.29Å; R177-H179 PolarHBondContact O-N 2.7Å; H179-A182 PolarHBondContact O-N 3.09Å; H179-L183 WeakPolarHBondContact O-CB 3.37Å; H179-L183 WeakPolarHBondContact O-CD1 3.47Å; H179-L183 PolarHBondContact O-N 2.86Å |
| 180 | V | 90.2 | Very high | 86 | Confident | 97 Ų | 97 | 105.8 Ų | 105.8 | 59% | 0.588 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.1 | -41.6 | 177.2 | 170.4 | 0 | 0 | 0 | 0 | 111.2 | A176 R177 L183 R184 | A176-V180 VanDerWaalsContact O-CG2 3.29Å; A176-V180 WeakPolarHBondContact O-CG2 3.42Å; A176-V180 PolarHBondContact O-N 3.03Å; R177-V180 PolarHBondContact O-N 3.46Å; R177-V180 VanDerWaalsContact O-N 3.11Å; V180-L183 PolarHBondContact O-N 3.27Å; V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 3.33Å |
| 181 | D | 88.1 | Confident | 85.6 | Confident | 92 Ų | 92 | 101.9 Ų | 101.9 | 49% | 0.492 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -67.6 | -40.6 | 176.1 | -90.4 | -63.7 | 0 | 0 | 0 | 112.1 | R177 R184 T185 | R177-D181 PolarHBondContact O-N 2.86Å; D181-R184 PolarHBondContact O-N 3.31Å; D181-T185 WeakPolarHBondContact O-CB 3.45Å; D181-T185 PolarHBondContact O-N 2.99Å; D181-T185 PolarHBondContact O-OG1 3.47Å |
| 182 | A | 87.3 | Confident | 85.3 | Confident | 47 Ų | 47 | 101.5 Ų | 101.5 | 39% | 0.388 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.1 | -46 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | A178 H179 T185 H186 | A178-A182 VanDerWaalsContact O-CB 3.26Å; A178-A182 WeakPolarHBondContact O-CB 3.37Å; A178-A182 PolarHBondContact O-N 2.78Å; H179-A182 PolarHBondContact O-N 3.09Å; A182-T185 PolarHBondContact O-N 3.42Å; A182-H186 WeakPolarHBondContact O-CB 3.21Å; A182-H186 PolarHBondContact O-N 2.93Å |
| 183 | L | 87.3 | Confident | 85.1 | Confident | 103 Ų | 103 | 100.5 Ų | 100.5 | 54% | 0.539 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 173.2 | -99.3 | 83 | 0 | 0 | 0 | 110.7 | H179 V180 T185 H186 L187 | H179-L183 WeakPolarHBondContact O-CB 3.37Å; H179-L183 WeakPolarHBondContact O-CD1 3.47Å; H179-L183 PolarHBondContact O-N 2.86Å; V180-L183 PolarHBondContact O-N 3.27Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.88Å; L183-H186 PolarHBondContact O-N 3.05Å; L183-L187 HydrophobicContact CB-CD1 4.19Å; L183-L187 HydrophobicContact CD2-CD1 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.21Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CD1 3.23Å; L183-L187 PolarHBondContact O-N 3.42Å |
| 184 | R | 84.6 | Confident | 85 | Confident | 187 Ų | 187 | 97.7 Ų | 97.7 | 71% | 0.706 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60 | -39.9 | 179.9 | -177 | 176.5 | 179.6 | 150.8 | 0.1 | 111.7 | V180 D181 A188 | V180-R184 WeakPolarHBondContact O-CB 3.24Å; V180-R184 PolarHBondContact O-N 3.33Å; D181-R184 PolarHBondContact O-N 3.31Å; R184-A188 WeakPolarHBondContact O-CB 3.5Å; R184-A188 PolarHBondContact O-N 3.11Å |
| 185 | T | 84.2 | Confident | 84.7 | Confident | 96 Ų | 96 | 101.3 Ų | 101.3 | 59% | 0.589 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -67.7 | -44.5 | 177.8 | -56.1 | 0 | 0 | 0 | 0 | 111.2 | D181 A182 L183 | D181-T185 WeakPolarHBondContact O-CB 3.45Å; D181-T185 PolarHBondContact O-N 2.99Å; D181-T185 PolarHBondContact O-OG1 3.47Å; A182-T185 PolarHBondContact O-N 3.42Å; L183-T185 VanDerWaalsContact C-N 3.28Å; L183-T185 PolarHBondContact O-N 2.88Å |
| 186 | H | 82.1 | Confident | 84.6 | Confident | 140 Ų | 140 | 101.7 Ų | 101.7 | 65% | 0.648 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -70.4 | -34 | 176.9 | -72.5 | -175.9 | 0 | 0 | 0 | 112.9 | A182 L183 P189 Y190 | A182-H186 WeakPolarHBondContact O-CB 3.21Å; A182-H186 PolarHBondContact O-N 2.93Å; L183-H186 PolarHBondContact O-N 3.05Å; H186-P189 WeakPolarHBondContact O-CD 3.28Å; H186-Y190 WeakPolarHBondContact O-CD2 3.17Å |
| 187 | L | 81.8 | Confident | 84.4 | Confident | 90 Ų | 90 | 107.3 Ų | 107.3 | 47% | 0.471 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -85 | -14.6 | 179.3 | -84.7 | 80.5 | 0 | 0 | 0 | 113 | L183 Y190 S191 | L183-L187 HydrophobicContact CB-CD1 4.19Å; L183-L187 HydrophobicContact CD2-CD1 4.48Å; L183-L187 HydrophobicContact CG-CD1 4.21Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.46Å; L183-L187 WeakPolarHBondContact O-CD1 3.23Å; L183-L187 PolarHBondContact O-N 3.42Å; L187-Y190 CarbonylContact O-C 3.5Å; L187-Y190 PolarHBondContact O-N 2.84Å; L187-Y190 VanDerWaalsContact O-N 3.15Å; L187-S191 WeakPolarHBondContact O-CB 3.37Å; L187-S191 PolarHBondContact O-N 2.91Å |
| 188 | A | 78.7 | Confident | 84.5 | Confident | 47 Ų | 47 | 106.5 Ų | 106.5 | 39% | 0.388 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -50.5 | -53.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | R184 Y190 S191 | R184-A188 WeakPolarHBondContact O-CB 3.5Å; R184-A188 PolarHBondContact O-N 3.11Å; A188-Y190 PolarHBondContact O-N 3.47Å; A188-S191 PolarHBondContact O-N 3.35Å; A188-S191 PolarHBondContact O-OG 2.85Å |
| 189 | P | 78.3 | Confident | 84.5 | Confident | 82 Ų | 82 | 106.2 Ų | 106.2 | 53% | 0.532 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.2 | -37.1 | 177.3 | 25.3 | -34.2 | 0 | 0 | 0 | 112.8 | H186 S191 D192 E193 | H186-P189 WeakPolarHBondContact O-CD 3.28Å; P189-S191 VanDerWaalsContact C-N 3.27Å; P189-S191 PolarHBondContact O-N 2.83Å; P189-D192 PolarHBondContact O-N 3.1Å; P189-E193 PolarHBondContact O-N 3.02Å |
| 190 | Y | 78.2 | Confident | 84.5 | Confident | 146 Ų | 146 | 103.2 Ų | 103.2 | 57% | 0.573 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -69 | -25.2 | 176.5 | -74.8 | -74 | 0 | 0 | 0 | 113 | H186 L187 A188 E193 L194 | H186-Y190 WeakPolarHBondContact O-CD2 3.17Å; L187-Y190 CarbonylContact O-C 3.5Å; L187-Y190 PolarHBondContact O-N 2.84Å; L187-Y190 VanDerWaalsContact O-N 3.15Å; A188-Y190 PolarHBondContact O-N 3.47Å; Y190-E193 PolarHBondContact O-N 3.18Å; Y190-L194 WeakPolarHBondContact O-CB 3.46Å; Y190-L194 WeakPolarHBondContact O-CD1 3.18Å; Y190-L194 VanDerWaalsContact O-CG 3.28Å; Y190-L194 WeakPolarHBondContact O-CG 3.49Å; Y190-L194 PolarHBondContact O-N 3.43Å |
| 191 | S | 77.3 | Confident | 84.3 | Confident | 47 Ų | 47 | 108.2 Ų | 108.2 | 33% | 0.329 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -69.8 | -35.7 | -179.6 | 78 | 0 | 0 | 0 | 0 | 111.7 | L187 A188 P189 R195 | L187-S191 WeakPolarHBondContact O-CB 3.37Å; L187-S191 PolarHBondContact O-N 2.91Å; A188-S191 PolarHBondContact O-N 3.35Å; A188-S191 PolarHBondContact O-OG 2.85Å; P189-S191 VanDerWaalsContact C-N 3.27Å; P189-S191 PolarHBondContact O-N 2.83Å; S191-R195 WeakPolarHBondContact O-CB 3.4Å; S191-R195 WeakPolarHBondContact O-CG 3.43Å; S191-R195 PolarHBondContact O-N 2.94Å |
| 192 | D | 81.4 | Confident | 84.4 | Confident | 96 Ų | 96 | 109.7 Ų | 109.7 | 51% | 0.513 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -71.3 | -43.5 | 173 | -81.4 | -52.2 | 0 | 0 | 0 | 111.1 | P189 L194 R195 Q196 | P189-D192 PolarHBondContact O-N 3.1Å; D192-L194 VanDerWaalsContact C-N 3.35Å; D192-L194 PolarHBondContact O-N 3.34Å; D192-R195 PolarHBondContact O-N 3.4Å; D192-Q196 WeakPolarHBondContact O-CG 3.3Å; D192-Q196 PolarHBondContact O-N 2.9Å |
| 193 | E | 83.4 | Confident | 84.4 | Confident | 94 Ų | 94 | 113.9 Ų | 113.9 | 44% | 0.439 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -60.4 | -42.5 | 172.2 | -81.2 | -165.4 | 130.9 | 0 | 0 | 112.4 | P189 Y190 Q196 R197 | P189-E193 PolarHBondContact O-N 3.02Å; Y190-E193 PolarHBondContact O-N 3.18Å; E193-Q196 PolarHBondContact O-N 3.47Å; E193-R197 WeakPolarHBondContact O-CB 3.41Å; E193-R197 WeakPolarHBondContact O-CG 3.49Å; E193-R197 PolarHBondContact O-N 3.03Å |
| 194 | L | 85 | Confident | 84.3 | Confident | 95 Ų | 95 | 110.8 Ų | 110.8 | 50% | 0.497 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -64.4 | -43.9 | 176.9 | -84.2 | 161.4 | 0 | 0 | 0 | 110.9 | Y190 D192 R197 L198 | Y190-L194 WeakPolarHBondContact O-CB 3.46Å; Y190-L194 WeakPolarHBondContact O-CD1 3.18Å; Y190-L194 VanDerWaalsContact O-CG 3.28Å; Y190-L194 WeakPolarHBondContact O-CG 3.49Å; Y190-L194 PolarHBondContact O-N 3.43Å; D192-L194 VanDerWaalsContact C-N 3.35Å; D192-L194 PolarHBondContact O-N 3.34Å; L194-R197 PolarHBondContact O-N 3.06Å; L194-L198 VanDerWaalsContact O-CB 3.26Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.26Å; L194-L198 PolarHBondContact O-N 3.3Å |
| 195 | R | 84.3 | Confident | 84.4 | Confident | 173 Ų | 173 | 107.6 Ų | 107.6 | 65% | 0.653 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.3 | -44.9 | 175.2 | -87.4 | 179.3 | 172.8 | 153 | -1.8 | 111.8 | S191 D192 L198 A199 | S191-R195 WeakPolarHBondContact O-CB 3.4Å; S191-R195 WeakPolarHBondContact O-CG 3.43Å; S191-R195 PolarHBondContact O-N 2.94Å; D192-R195 PolarHBondContact O-N 3.4Å; R195-L198 PolarHBondContact O-N 3.43Å; R195-A199 WeakPolarHBondContact O-CB 3.4Å; R195-A199 PolarHBondContact O-N 3.23Å |
| 196 | Q | 87.1 | Confident | 84.3 | Confident | 140 Ų | 140 | 111.1 Ų | 111.1 | 65% | 0.654 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -64.1 | -44.5 | 176.9 | -73.6 | -178.6 | -2.1 | 0 | 0 | 111.6 | D192 E193 L198 A199 A200 | D192-Q196 WeakPolarHBondContact O-CG 3.3Å; D192-Q196 PolarHBondContact O-N 2.9Å; E193-Q196 PolarHBondContact O-N 3.47Å; Q196-L198 VanDerWaalsContact C-N 3.34Å; Q196-L198 PolarHBondContact O-N 2.92Å; Q196-A199 PolarHBondContact O-N 2.92Å; Q196-A200 WeakPolarHBondContact O-CB 3.36Å; Q196-A200 PolarHBondContact O-N 3.45Å |
| 197 | R | 86.4 | Confident | 84.4 | Confident | 171 Ų | 171 | 111.7 Ų | 111.7 | 65% | 0.645 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -63 | -38.8 | 175.3 | -78 | -177.8 | 179.1 | 172.1 | 4.8 | 112.5 | E193 L194 R201 | E193-R197 WeakPolarHBondContact O-CB 3.41Å; E193-R197 WeakPolarHBondContact O-CG 3.49Å; E193-R197 PolarHBondContact O-N 3.03Å; L194-R197 PolarHBondContact O-N 3.06Å; R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.49Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 2.87Å |
| 198 | L | 89.2 | Confident | 84.3 | Confident | 116 Ų | 116 | 111.9 Ų | 111.9 | 61% | 0.607 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.8 | -45.1 | 176.1 | -81.3 | 157.9 | 0 | 0 | 0 | 111.1 | L194 R195 Q196 R201 L202 | L194-L198 VanDerWaalsContact O-CB 3.26Å; L194-L198 WeakPolarHBondContact O-CB 3.39Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 VanDerWaalsContact O-CG 3.27Å; L194-L198 WeakPolarHBondContact O-CG 3.26Å; L194-L198 PolarHBondContact O-N 3.3Å; R195-L198 PolarHBondContact O-N 3.43Å; Q196-L198 VanDerWaalsContact C-N 3.34Å; Q196-L198 PolarHBondContact O-N 2.92Å; L198-R201 PolarHBondContact O-N 3.47Å; L198-L202 VanDerWaalsContact O-CB 3.31Å; L198-L202 WeakPolarHBondContact O-CB 3.37Å; L198-L202 PolarHBondContact O-N 3.31Å |
| 199 | A | 89.8 | Confident | 84.3 | Confident | 53 Ų | 53 | 110.7 Ų | 110.7 | 44% | 0.438 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -59.8 | -49.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | R195 Q196 R201 L202 E203 | R195-A199 WeakPolarHBondContact O-CB 3.4Å; R195-A199 PolarHBondContact O-N 3.23Å; Q196-A199 PolarHBondContact O-N 2.92Å; A199-R201 VanDerWaalsContact C-N 3.34Å; A199-R201 PolarHBondContact O-N 3.34Å; A199-L202 PolarHBondContact O-N 3.48Å; A199-L202 VanDerWaalsContact O-N 3.11Å; A199-E203 PolarHBondContact O-N 2.92Å |
| 200 | A | 89.3 | Confident | 84.3 | Confident | 55 Ų | 55 | 108.9 Ų | 108.9 | 46% | 0.455 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -61.4 | -39.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q196 L202 A204 | Q196-A200 WeakPolarHBondContact O-CB 3.36Å; Q196-A200 PolarHBondContact O-N 3.45Å; A200-L202 VanDerWaalsContact C-N 3.34Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.04Å; A200-A204 PolarHBondContact O-N 2.96Å |
| 201 | R | 87.1 | Confident | 84.3 | Confident | 202 Ų | 202 | 104.6 Ų | 104.6 | 76% | 0.762 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -65.4 | -37.1 | 174.8 | -80.4 | -84.6 | -176.5 | 151.6 | 0 | 112.1 | R197 L198 A199 L205 | R197-R201 VanDerWaalsContact O-CB 3.28Å; R197-R201 WeakPolarHBondContact O-CB 3.49Å; R197-R201 WeakPolarHBondContact O-CG 3.4Å; R197-R201 PolarHBondContact O-N 2.87Å; L198-R201 PolarHBondContact O-N 3.47Å; A199-R201 VanDerWaalsContact C-N 3.34Å; A199-R201 PolarHBondContact O-N 3.34Å; R201-L205 WeakPolarHBondContact O-CB 3.04Å; R201-L205 PolarHBondContact O-N 3.36Å |
| 202 | L | 88.7 | Confident | 84.1 | Confident | 123 Ų | 123 | 110 Ų | 110 | 64% | 0.644 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -74.7 | -38.1 | -178.6 | -154.7 | 148.9 | 0 | 0 | 0 | 111.1 | L198 A199 A200 L205 K206 | L198-L202 VanDerWaalsContact O-CB 3.31Å; L198-L202 WeakPolarHBondContact O-CB 3.37Å; L198-L202 PolarHBondContact O-N 3.31Å; A199-L202 PolarHBondContact O-N 3.48Å; A199-L202 VanDerWaalsContact O-N 3.11Å; A200-L202 VanDerWaalsContact C-N 3.34Å; L202-L205 PolarHBondContact O-N 2.85Å; L202-K206 WeakPolarHBondContact O-CB 3.37Å; L202-K206 PolarHBondContact O-N 2.82Å |
| 203 | E | 88.4 | Confident | 83.9 | Confident | 136 Ų | 136 | 111.2 Ų | 111.2 | 64% | 0.636 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -62.9 | -50 | 169.1 | -78.1 | -173.5 | 111.6 | 0 | 0 | 111.5 | A199 L205 K206 E207 | A199-E203 PolarHBondContact O-N 2.92Å; E203-L205 VanDerWaalsContact C-N 3.25Å; E203-L205 PolarHBondContact O-N 3.47Å; E203-K206 WeakPolarHBondContact O-CB 3.23Å; E203-K206 PolarHBondContact O-N 3.11Å; E203-E207 PolarHBondContact O-N 2.89Å |
| 204 | A | 86 | Confident | 83.8 | Confident | 38 Ų | 38 | 109.9 Ų | 109.9 | 31% | 0.314 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -60.3 | -35.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | A200 N208 | A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.04Å; A200-A204 PolarHBondContact O-N 2.96Å; A204-N208 WeakPolarHBondContact O-CB 3.19Å; A204-N208 PolarHBondContact O-N 2.89Å; A204-N208 PolarHBondContact O-ND2 3.35Å |
| 205 | L | 85.3 | Confident | 83.5 | Confident | 120 Ų | 120 | 110.8 Ų | 110.8 | 63% | 0.628 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -71.3 | -33.9 | 175.4 | -174.1 | 66.7 | 0 | 0 | 0 | 111.8 | R201 L202 E203 G209 | R201-L205 WeakPolarHBondContact O-CB 3.04Å; R201-L205 PolarHBondContact O-N 3.36Å; L202-L205 PolarHBondContact O-N 2.85Å; E203-L205 VanDerWaalsContact C-N 3.25Å; E203-L205 PolarHBondContact O-N 3.47Å; L205-G209 WeakPolarHBondContact O-CA 3.4Å; L205-G209 PolarHBondContact O-N 3.3Å |
| 206 | K | 82.9 | Confident | 83.4 | Confident | 169 Ų | 169 | 110.7 Ų | 110.7 | 74% | 0.735 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -68.7 | -44.4 | 176.4 | -174.7 | 178.5 | 175.2 | -175.1 | 0 | 111.3 | L202 E203 G210 | L202-K206 WeakPolarHBondContact O-CB 3.37Å; L202-K206 PolarHBondContact O-N 2.82Å; E203-K206 WeakPolarHBondContact O-CB 3.23Å; E203-K206 PolarHBondContact O-N 3.11Å; K206-G210 PolarHBondContact O-N 3.5Å |
| 207 | E | 83.2 | Confident | 82.8 | Confident | 153 Ų | 153 | 111 Ų | 111 | 72% | 0.715 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -65.7 | -52 | 174.6 | -76.2 | -172.9 | 140.4 | 0 | 0 | 111.8 | E203 G209 G210 A211 | E203-E207 PolarHBondContact O-N 2.89Å; E207-G209 VanDerWaalsContact C-N 3.28Å; E207-G209 PolarHBondContact O-N 3.13Å; E207-G210 PolarHBondContact O-N 3.41Å; E207-A211 PolarHBondContact O-N 3.1Å; E207-A211 VanDerWaalsContact O-N 3.07Å |
| 208 | N | 80.6 | Confident | 82.7 | Confident | 93 Ų | 93 | 105.7 Ų | 105.7 | 50% | 0.497 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.6 | -32.2 | 179.2 | -71.7 | -48 | 0 | 0 | 0 | 112.2 | A204 R212 | A204-N208 WeakPolarHBondContact O-CB 3.19Å; A204-N208 PolarHBondContact O-N 2.89Å; A204-N208 PolarHBondContact O-ND2 3.35Å; N208-R212 VanDerWaalsContact O-CB 3.23Å; N208-R212 WeakPolarHBondContact O-CB 3.28Å; N208-R212 VanDerWaalsContact O-CG 3.28Å; N208-R212 WeakPolarHBondContact O-CG 3.4Å; N208-R212 PolarHBondContact O-N 2.86Å |
| 209 | G | 78.9 | Confident | 82.3 | Confident | 23 Ų | 23 | 106 Ų | 106 | 24% | 0.237 | 56% | 0.556 | C | S | . | * | H | α-helix | trans | -66.4 | -43.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | L205 E207 L213 | L205-G209 WeakPolarHBondContact O-CA 3.4Å; L205-G209 PolarHBondContact O-N 3.3Å; E207-G209 VanDerWaalsContact C-N 3.28Å; E207-G209 PolarHBondContact O-N 3.13Å; G209-L213 VanDerWaalsContact O-CB 3.27Å; G209-L213 WeakPolarHBondContact O-CB 3.46Å; G209-L213 WeakPolarHBondContact O-CD1 3.45Å; G209-L213 VanDerWaalsContact O-CG 3.25Å; G209-L213 WeakPolarHBondContact O-CG 3.34Å; G209-L213 PolarHBondContact O-N 2.87Å |
| 210 | G | 78.3 | Confident | 82 | Confident | 43 Ų | 43 | 106 Ų | 106 | 44% | 0.443 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.8 | -46.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | K206 E207 L213 A214 | K206-G210 PolarHBondContact O-N 3.5Å; E207-G210 PolarHBondContact O-N 3.41Å; G210-L213 PolarHBondContact O-N 2.73Å; G210-A214 PolarHBondContact O-N 2.77Å |
| 211 | A | 77.2 | Confident | 81.7 | Confident | 57 Ų | 57 | 107.3 Ų | 107.3 | 47% | 0.471 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -64 | -45.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | E207 L213 A214 E215 | E207-A211 PolarHBondContact O-N 3.1Å; E207-A211 VanDerWaalsContact O-N 3.07Å; A211-L213 PolarHBondContact O-N 2.77Å; A211-A214 PolarHBondContact O-N 3.47Å; A211-E215 PolarHBondContact O-N 2.99Å |
| 212 | R | 74.5 | Confident | 81.6 | Confident | 161 Ų | 161 | 104 Ų | 104 | 61% | 0.608 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -64.3 | -38.7 | 177.2 | -78 | -179.9 | 177.4 | -179.9 | -0.1 | 112.2 | N208 A214 E215 Y216 | N208-R212 VanDerWaalsContact O-CB 3.23Å; N208-R212 WeakPolarHBondContact O-CB 3.28Å; N208-R212 VanDerWaalsContact O-CG 3.28Å; N208-R212 WeakPolarHBondContact O-CG 3.4Å; N208-R212 PolarHBondContact O-N 2.86Å; R212-A214 VanDerWaalsContact C-N 3.3Å; R212-A214 PolarHBondContact O-N 3.33Å; R212-E215 PolarHBondContact O-N 3.25Å; R212-Y216 HydrophobicContact CB-CD2 4.43Å; R212-Y216 WeakPolarHBondContact O-CB 3.21Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.34Å |
| 213 | L | 76.9 | Confident | 81.2 | Confident | 121 Ų | 121 | 104.1 Ų | 104.1 | 63% | 0.634 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -60.6 | -41 | 176 | -83.8 | 161.8 | 0 | 0 | 0 | 111.5 | G209 G210 A211 Y216 H217 | G209-L213 VanDerWaalsContact O-CB 3.27Å; G209-L213 WeakPolarHBondContact O-CB 3.46Å; G209-L213 WeakPolarHBondContact O-CD1 3.45Å; G209-L213 VanDerWaalsContact O-CG 3.25Å; G209-L213 WeakPolarHBondContact O-CG 3.34Å; G209-L213 PolarHBondContact O-N 2.87Å; G210-L213 PolarHBondContact O-N 2.73Å; A211-L213 PolarHBondContact O-N 2.77Å; L213-Y216 PolarHBondContact O-N 3.27Å; L213-H217 PolarHBondContact O-N 3.45Å |
| 214 | A | 79.8 | Confident | 80.7 | Confident | 66 Ų | 66 | 103.6 Ų | 103.6 | 55% | 0.545 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -64.5 | -43.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112 | G210 A211 R212 H217 A218 | G210-A214 PolarHBondContact O-N 2.77Å; A211-A214 PolarHBondContact O-N 3.47Å; R212-A214 VanDerWaalsContact C-N 3.3Å; R212-A214 PolarHBondContact O-N 3.33Å; A214-H217 PolarHBondContact O-N 3.15Å; A214-A218 PolarHBondContact O-N 2.73Å |
| 215 | E | 80.4 | Confident | 80.3 | Confident | 113 Ų | 113 | 105 Ų | 105 | 53% | 0.528 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -64.8 | -39 | 175.5 | -71.5 | -167.3 | 111 | 0 | 0 | 113 | A211 R212 H217 A218 K219 | A211-E215 PolarHBondContact O-N 2.99Å; R212-E215 PolarHBondContact O-N 3.25Å; E215-H217 VanDerWaalsContact C-N 3.34Å; E215-A218 PolarHBondContact O-N 3.47Å; E215-K219 WeakPolarHBondContact O-CB 3.35Å; E215-K219 WeakPolarHBondContact O-CG 3.33Å; E215-K219 PolarHBondContact O-N 2.85Å |
| 216 | Y | 80.8 | Confident | 80.1 | Confident | 171 Ų | 171 | 102 Ų | 102 | 67% | 0.671 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -63.8 | -40 | 175.6 | -91.3 | -73.3 | 0 | 0 | 0 | 111.4 | R212 L213 A220 | R212-Y216 HydrophobicContact CB-CD2 4.43Å; R212-Y216 WeakPolarHBondContact O-CB 3.21Å; R212-Y216 WeakPolarHBondContact O-CD2 3.48Å; R212-Y216 PolarHBondContact O-N 3.34Å; L213-Y216 PolarHBondContact O-N 3.27Å; Y216-A220 WeakPolarHBondContact O-CB 3.2Å; Y216-A220 PolarHBondContact O-N 3.2Å |
| 217 | H | 76.2 | Confident | 79.8 | Confident | 146 Ų | 146 | 100 Ų | 100 | 68% | 0.676 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -65.1 | -42.9 | 175.5 | -121.3 | -98.2 | 0 | 0 | 0 | 111.9 | L213 A214 E215 T221 | L213-H217 PolarHBondContact O-N 3.45Å; A214-H217 PolarHBondContact O-N 3.15Å; E215-H217 VanDerWaalsContact C-N 3.34Å; H217-T221 PolarHBondContact O-N 2.72Å; H217-T221 VanDerWaalsContact O-N 3.12Å; H217-T221 PolarHBondContact O-OG1 3.39Å |
| 218 | A | 84.3 | Confident | 79.5 | Confident | 61 Ų | 61 | 96.4 Ų | 96.4 | 50% | 0.504 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.7 | -50.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | A214 E215 A220 T221 E222 | A214-A218 PolarHBondContact O-N 2.73Å; E215-A218 PolarHBondContact O-N 3.47Å; A218-A220 PolarHBondContact O-N 3.04Å; A218-T221 PolarHBondContact O-N 3.22Å; A218-E222 PolarHBondContact O-N 2.87Å; A218-E222 VanDerWaalsContact O-N 3.08Å |
| 219 | K | 80.5 | Confident | 79.4 | Confident | 121 Ų | 121 | 99.1 Ų | 99.1 | 53% | 0.526 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -63.9 | -39.3 | 178.3 | -76.6 | -178.3 | 178.6 | 174 | 0 | 113 | E215 T221 E222 H223 | E215-K219 WeakPolarHBondContact O-CB 3.35Å; E215-K219 WeakPolarHBondContact O-CG 3.33Å; E215-K219 PolarHBondContact O-N 2.85Å; K219-T221 VanDerWaalsContact C-N 3.3Å; K219-T221 PolarHBondContact O-N 3.35Å; K219-E222 PolarHBondContact O-N 3.35Å; K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-CD2 3.42Å; K219-H223 PolarHBondContact O-N 2.81Å |
| 220 | A | 82.5 | Confident | 79.2 | Confident | 53 Ų | 53 | 105.4 Ų | 105.4 | 44% | 0.438 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.4 | -40.2 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | Y216 A218 H223 L224 | Y216-A220 WeakPolarHBondContact O-CB 3.2Å; Y216-A220 PolarHBondContact O-N 3.2Å; A218-A220 PolarHBondContact O-N 3.04Å; A220-H223 PolarHBondContact O-N 3.45Å; A220-L224 WeakPolarHBondContact O-CB 3.4Å; A220-L224 PolarHBondContact O-N 2.9Å |
| 221 | T | 83.1 | Confident | 78.8 | Confident | 83 Ų | 83 | 105.6 Ų | 105.6 | 51% | 0.509 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -66.1 | -45 | 177.8 | -49.8 | 0 | 0 | 0 | 0 | 111 | H217 A218 K219 H223 L224 S225 | H217-T221 PolarHBondContact O-N 2.72Å; H217-T221 VanDerWaalsContact O-N 3.12Å; H217-T221 PolarHBondContact O-OG1 3.39Å; A218-T221 PolarHBondContact O-N 3.22Å; K219-T221 VanDerWaalsContact C-N 3.3Å; K219-T221 PolarHBondContact O-N 3.35Å; T221-H223 PolarHBondContact O-N 3.36Å; T221-L224 PolarHBondContact O-N 3.14Å; T221-S225 PolarHBondContact O-N 3.45Å; T221-S225 PolarHBondContact O-OG 3.48Å |
| 222 | E | 85.3 | Confident | 78.6 | Confident | 134 Ų | 134 | 110.8 Ų | 110.8 | 63% | 0.626 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -63.2 | -41.9 | 176.7 | -161.1 | -173.1 | 129 | 0 | 0 | 112.2 | A218 K219 S225 T226 | A218-E222 PolarHBondContact O-N 2.87Å; A218-E222 VanDerWaalsContact O-N 3.08Å; K219-E222 PolarHBondContact O-N 3.35Å; E222-S225 PolarHBondContact O-N 2.78Å; E222-T226 WeakPolarHBondContact O-CG2 3.2Å; E222-T226 PolarHBondContact O-N 3.44Å; E222-T226 PolarHBondContact O-OG1 2.89Å |
| 223 | H | 79.5 | Confident | 78.8 | Confident | 125 Ų | 125 | 106.3 Ų | 106.3 | 58% | 0.579 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -65.8 | -37.5 | 175.6 | -80.9 | -56.6 | 0 | 0 | 0 | 112.7 | K219 A220 T221 T226 L227 | K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-CD2 3.42Å; K219-H223 PolarHBondContact O-N 2.81Å; A220-H223 PolarHBondContact O-N 3.45Å; T221-H223 PolarHBondContact O-N 3.36Å; H223-T226 WeakPolarHBondContact CA-OG1 3.41Å; H223-T226 PolarHBondContact O-OG1 3.35Å; H223-L227 VanDerWaalsContact O-CB 3.31Å; H223-L227 WeakPolarHBondContact O-CB 3.35Å; H223-L227 PolarHBondContact O-N 2.88Å |
| 224 | L | 78.8 | Confident | 78.7 | Confident | 125 Ų | 125 | 103.2 Ų | 103.2 | 65% | 0.654 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -66.5 | -42 | 176.5 | -113.2 | 153.6 | 0 | 0 | 0 | 112.1 | A220 T221 L227 S228 | A220-L224 WeakPolarHBondContact O-CB 3.4Å; A220-L224 PolarHBondContact O-N 2.9Å; T221-L224 PolarHBondContact O-N 3.14Å; L224-L227 PolarHBondContact O-N 2.86Å; L224-S228 PolarHBondContact O-N 3.49Å |
| 225 | S | 77.9 | Confident | 78.3 | Confident | 66 Ų | 66 | 106.4 Ų | 106.4 | 46% | 0.462 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -61.7 | -50.4 | 176.2 | -62.1 | 0 | 0 | 0 | 0 | 111.2 | T221 E222 L227 S228 E229 | T221-S225 PolarHBondContact O-N 3.45Å; T221-S225 PolarHBondContact O-OG 3.48Å; E222-S225 PolarHBondContact O-N 2.78Å; S225-L227 VanDerWaalsContact C-N 3.32Å; S225-L227 PolarHBondContact O-N 3.15Å; S225-S228 PolarHBondContact O-N 3.11Å; S225-S228 PolarHBondContact O-OG 2.91Å; S225-E229 PolarHBondContact O-N 3.33Å |
| 226 | T | 80.4 | Confident | 78 | Confident | 58 Ų | 58 | 107.6 Ų | 107.6 | 36% | 0.356 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -64.5 | -33.9 | 178.4 | 52 | 0 | 0 | 0 | 0 | 112.9 | E222 H223 K230 | E222-T226 WeakPolarHBondContact O-CG2 3.2Å; E222-T226 PolarHBondContact O-N 3.44Å; E222-T226 PolarHBondContact O-OG1 2.89Å; H223-T226 WeakPolarHBondContact CA-OG1 3.41Å; H223-T226 PolarHBondContact O-OG1 3.35Å; T226-K230 WeakPolarHBondContact O-CB 3.27Å; T226-K230 WeakPolarHBondContact O-CG 3.26Å; T226-K230 PolarHBondContact O-N 3.36Å |
| 227 | L | 77.2 | Confident | 77.8 | Confident | 127 Ų | 127 | 105 Ų | 105 | 67% | 0.665 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67 | -43.2 | 173.7 | -138.5 | 84.4 | 0 | 0 | 0 | 111.5 | H223 L224 S225 E229 K230 A231 | H223-L227 VanDerWaalsContact O-CB 3.31Å; H223-L227 WeakPolarHBondContact O-CB 3.35Å; H223-L227 PolarHBondContact O-N 2.88Å; L224-L227 PolarHBondContact O-N 2.86Å; S225-L227 VanDerWaalsContact C-N 3.32Å; S225-L227 PolarHBondContact O-N 3.15Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.28Å; L227-K230 PolarHBondContact O-N 2.9Å; L227-A231 WeakPolarHBondContact O-CA 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.18Å; L227-A231 PolarHBondContact O-N 3.3Å |
| 228 | S | 75.9 | Confident | 78 | Confident | 77 Ų | 77 | 103.6 Ų | 103.6 | 54% | 0.538 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -65.3 | -36.3 | 179.4 | 84.2 | 0 | 0 | 0 | 0 | 112.3 | L224 S225 A231 | L224-S228 PolarHBondContact O-N 3.49Å; S225-S228 PolarHBondContact O-N 3.11Å; S225-S228 PolarHBondContact O-OG 2.91Å; S228-A231 PolarHBondContact O-N 3.35Å |
| 229 | E | 79.3 | Confident | 77.6 | Confident | 150 Ų | 150 | 110.3 Ų | 110.3 | 70% | 0.701 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -72.1 | -38.3 | -179.9 | -155.2 | 179.7 | 139.1 | 0 | 0 | 111.2 | S225 L227 P233 | S225-E229 PolarHBondContact O-N 3.33Å; L227-E229 VanDerWaalsContact C-N 3.3Å; L227-E229 PolarHBondContact O-N 3.28Å; E229-P233 WeakPolarHBondContact O-CD 3.34Å |
| 230 | K | 75.2 | Confident | 77.4 | Confident | 156 Ų | 156 | 111.4 Ų | 111.4 | 68% | 0.678 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -78.4 | -26.4 | 174 | -71.7 | -178.3 | 177.8 | -178.6 | 0 | 113.7 | T226 L227 P233 A234 | T226-K230 WeakPolarHBondContact O-CB 3.27Å; T226-K230 WeakPolarHBondContact O-CG 3.26Å; T226-K230 PolarHBondContact O-N 3.36Å; L227-K230 PolarHBondContact O-N 2.9Å; K230-P233 WeakPolarHBondContact O-CD 3.35Å; K230-P233 WeakPolarHBondContact O-CG 3.41Å; K230-A234 WeakPolarHBondContact O-CB 3.47Å; K230-A234 PolarHBondContact O-N 2.91Å; K230-A234 VanDerWaalsContact O-N 3.11Å |
| 231 | A | 70.4 | Confident | 77.2 | Confident | 47 Ų | 47 | 110.9 Ų | 110.9 | 39% | 0.388 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -70.3 | -35.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | L227 S228 L235 | L227-A231 WeakPolarHBondContact O-CA 3.28Å; L227-A231 WeakPolarHBondContact O-CB 3.18Å; L227-A231 PolarHBondContact O-N 3.3Å; S228-A231 PolarHBondContact O-N 3.35Å; A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 PolarHBondContact O-N 2.9Å |
| 232 | K | 72 | Confident | 77 | Confident | 166 Ų | 166 | 111 Ų | 111 | 72% | 0.722 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -58.9 | -56.9 | 176 | -93.4 | -176.8 | 174.9 | 179.9 | 0 | 113.3 | L235 E236 | K232-L235 PolarHBondContact O-N 3.11Å; K232-E236 PolarHBondContact O-N 2.84Å |
| 233 | P | 78.4 | Confident | 76.6 | Confident | 67 Ų | 67 | 110.5 Ų | 110.5 | 44% | 0.435 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67.7 | -36.4 | 178.5 | 25.2 | -32.4 | 0 | 0 | 0 | 111.6 | E229 K230 L235 E236 D237 | E229-P233 WeakPolarHBondContact O-CD 3.34Å; K230-P233 WeakPolarHBondContact O-CD 3.35Å; K230-P233 WeakPolarHBondContact O-CG 3.41Å; P233-L235 VanDerWaalsContact C-N 3.3Å; P233-L235 PolarHBondContact O-N 2.92Å; P233-E236 PolarHBondContact O-N 2.87Å; P233-E236 VanDerWaalsContact O-N 3.15Å; P233-D237 WeakPolarHBondContact O-CB 3.39Å; P233-D237 PolarHBondContact O-N 3.38Å |
| 234 | A | 74.4 | Confident | 76.6 | Confident | 55 Ų | 55 | 108.1 Ų | 108.1 | 46% | 0.455 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -63.9 | -32.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | K230 L238 | K230-A234 WeakPolarHBondContact O-CB 3.47Å; K230-A234 PolarHBondContact O-N 2.91Å; K230-A234 VanDerWaalsContact O-N 3.11Å; A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 3.35Å |
| 235 | L | 72.2 | Confident | 76.7 | Confident | 134 Ų | 134 | 106.1 Ų | 106.1 | 70% | 0.702 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -69.7 | -36.1 | 174.3 | -137.4 | 88.8 | 0 | 0 | 0 | 111.7 | A231 K232 P233 R239 | A231-L235 WeakPolarHBondContact O-CB 3.47Å; A231-L235 PolarHBondContact O-N 2.9Å; K232-L235 PolarHBondContact O-N 3.11Å; P233-L235 VanDerWaalsContact C-N 3.3Å; P233-L235 PolarHBondContact O-N 2.92Å; L235-R239 WeakPolarHBondContact O-CB 3.39Å; L235-R239 PolarHBondContact O-N 2.83Å |
| 236 | E | 73.3 | Confident | 76.7 | Confident | 138 Ų | 138 | 108.6 Ų | 108.6 | 65% | 0.645 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.3 | -43.6 | 174.8 | -78.6 | -176.3 | 112.4 | 0 | 0 | 111.8 | K232 P233 L238 R239 Q240 | K232-E236 PolarHBondContact O-N 2.84Å; P233-E236 PolarHBondContact O-N 2.87Å; P233-E236 VanDerWaalsContact O-N 3.15Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.88Å; E236-R239 WeakPolarHBondContact O-CB 3.39Å; E236-R239 PolarHBondContact O-N 2.93Å; E236-Q240 PolarHBondContact O-N 3.38Å |
| 237 | D | 77.5 | Confident | 76.6 | Confident | 117 Ų | 117 | 112.8 Ų | 112.8 | 63% | 0.626 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -60 | -44 | 175.1 | -128.3 | -77.8 | 0 | 0 | 0 | 110.9 | P233 R239 Q240 G241 | P233-D237 WeakPolarHBondContact O-CB 3.39Å; P233-D237 PolarHBondContact O-N 3.38Å; D237-R239 VanDerWaalsContact C-N 3.33Å; D237-R239 PolarHBondContact O-N 3.28Å; D237-Q240 PolarHBondContact O-N 3.41Å; D237-G241 PolarHBondContact O-N 2.92Å |
| 238 | L | 79.8 | Confident | 76.8 | Confident | 115 Ų | 115 | 109.9 Ų | 109.9 | 60% | 0.602 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -68.1 | -33.6 | 178.3 | -157.5 | 146.5 | 0 | 0 | 0 | 111.7 | A234 E236 L242 | A234-L238 WeakPolarHBondContact O-CB 3.31Å; A234-L238 PolarHBondContact O-N 3.35Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.88Å; L238-L242 HydrophobicContact CD2-CD1 3.57Å; L238-L242 HydrophobicContact CD2-CG 4.39Å; L238-L242 WeakPolarHBondContact O-CB 3.33Å; L238-L242 WeakPolarHBondContact O-CG 3.15Å; L238-L242 PolarHBondContact O-N 2.85Å; L238-L242 VanDerWaalsContact O-N 3.1Å |
| 239 | R | 75.5 | Confident | 77.3 | Confident | 202 Ų | 202 | 113 Ų | 113 | 76% | 0.762 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -67.8 | -43.5 | 171.7 | -117.7 | -169.4 | 176.8 | -163.6 | -0.1 | 112.2 | L235 E236 D237 L242 L243 | L235-R239 WeakPolarHBondContact O-CB 3.39Å; L235-R239 PolarHBondContact O-N 2.83Å; E236-R239 WeakPolarHBondContact O-CB 3.39Å; E236-R239 PolarHBondContact O-N 2.93Å; D237-R239 VanDerWaalsContact C-N 3.33Å; D237-R239 PolarHBondContact O-N 3.28Å; R239-L242 PolarHBondContact O-N 3.25Å; R239-L243 PolarHBondContact O-N 2.72Å |
| 240 | Q | 76.7 | Confident | 77.4 | Confident | 145 Ų | 145 | 112.7 Ų | 112.7 | 68% | 0.678 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66.3 | -39.4 | 177.9 | -86.3 | -175.2 | -9.4 | 0 | 0 | 111.9 | E236 D237 P244 | E236-Q240 PolarHBondContact O-N 3.38Å; D237-Q240 PolarHBondContact O-N 3.41Å; Q240-P244 WeakPolarHBondContact O-CD 3.2Å |
| 241 | G | 79.4 | Confident | 77.7 | Confident | 41 Ų | 41 | 110.1 Ų | 110.1 | 42% | 0.423 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -69.4 | -29.7 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | D237 P244 V245 | D237-G241 PolarHBondContact O-N 2.92Å; G241-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CG 3.26Å; G241-V245 WeakPolarHBondContact O-CG2 3.2Å |
| 242 | L | 78.8 | Confident | 78.2 | Confident | 86 Ų | 86 | 111.5 Ų | 111.5 | 45% | 0.45 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -76.4 | -32 | 179.4 | -88.5 | 168.6 | 0 | 0 | 0 | 114 | L238 R239 V245 L246 | L238-L242 HydrophobicContact CD2-CD1 3.57Å; L238-L242 HydrophobicContact CD2-CG 4.39Å; L238-L242 WeakPolarHBondContact O-CB 3.33Å; L238-L242 WeakPolarHBondContact O-CG 3.15Å; L238-L242 PolarHBondContact O-N 2.85Å; L238-L242 VanDerWaalsContact O-N 3.1Å; R239-L242 PolarHBondContact O-N 3.25Å; L242-V245 PolarHBondContact O-N 3.45Å; L242-L246 WeakPolarHBondContact O-CB 3.47Å; L242-L246 PolarHBondContact O-N 3.46Å |
| 243 | L | 77 | Confident | 79 | Confident | 124 Ų | 124 | 109.3 Ų | 109.3 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -55 | -51.7 | 179.7 | -75.4 | 173.5 | 0 | 0 | 0 | 113.8 | R239 V245 L246 E247 | R239-L243 PolarHBondContact O-N 2.72Å; L243-V245 PolarHBondContact O-N 3.44Å; L243-L246 PolarHBondContact O-N 2.88Å; L243-E247 PolarHBondContact O-N 3.5Å; L243-E247 VanDerWaalsContact O-N 3.13Å |
| 244 | P | 79.2 | Confident | 79.2 | Confident | 75 Ų | 75 | 111.3 Ų | 111.3 | 49% | 0.487 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.7 | -31.5 | 179.2 | 27.2 | -34 | 0 | 0 | 0 | 112.5 | Q240 G241 L246 E247 S248 | Q240-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CD 3.2Å; G241-P244 WeakPolarHBondContact O-CG 3.26Å; P244-L246 VanDerWaalsContact C-N 3.35Å; P244-E247 PolarHBondContact O-N 2.82Å; P244-S248 WeakPolarHBondContact O-CB 3.49Å; P244-S248 PolarHBondContact O-N 3.48Å; P244-S248 PolarHBondContact O-OG 3.39Å |
| 245 | V | 79.7 | Confident | 79.6 | Confident | 82 Ų | 82 | 111.6 Ų | 111.6 | 50% | 0.497 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -64.9 | -42.1 | 175.1 | 175.7 | 0 | 0 | 0 | 0 | 110.2 | G241 L242 L243 S248 F249 | G241-V245 WeakPolarHBondContact O-CG2 3.2Å; L242-V245 PolarHBondContact O-N 3.45Å; L243-V245 PolarHBondContact O-N 3.44Å; V245-S248 WeakPolarHBondContact CA-OG 3.28Å; V245-S248 PolarHBondContact O-N 3.36Å; V245-S248 PolarHBondContact O-OG 2.88Å; V245-F249 VanDerWaalsContact O-CB 3.28Å; V245-F249 WeakPolarHBondContact O-CB 3.23Å; V245-F249 PolarHBondContact O-N 2.85Å |
| 246 | L | 77.6 | Confident | 80.1 | Confident | 118 Ų | 118 | 107.5 Ų | 107.5 | 62% | 0.618 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67.5 | -37.4 | 179.1 | -134.8 | 133.9 | 0 | 0 | 0 | 112.1 | L242 L243 P244 K250 | L242-L246 WeakPolarHBondContact O-CB 3.47Å; L242-L246 PolarHBondContact O-N 3.46Å; L243-L246 PolarHBondContact O-N 2.88Å; P244-L246 VanDerWaalsContact C-N 3.35Å; L246-K250 WeakPolarHBondContact O-CB 3.13Å; L246-K250 PolarHBondContact O-N 3.02Å |
| 247 | E | 80 | Confident | 80.5 | Confident | 147 Ų | 147 | 105 Ų | 105 | 69% | 0.687 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -66.2 | -47.9 | 173 | -75.7 | -168.5 | 151.2 | 0 | 0 | 112 | L243 P244 F249 K250 V251 | L243-E247 PolarHBondContact O-N 3.5Å; L243-E247 VanDerWaalsContact O-N 3.13Å; P244-E247 PolarHBondContact O-N 2.82Å; E247-F249 VanDerWaalsContact C-N 3.27Å; E247-F249 PolarHBondContact O-N 2.95Å; E247-K250 PolarHBondContact O-N 3.44Å; E247-V251 WeakPolarHBondContact O-CG2 3.37Å; E247-V251 PolarHBondContact O-N 2.96Å |
| 248 | S | 81.1 | Confident | 80.7 | Confident | 66 Ų | 66 | 105.9 Ų | 105.9 | 46% | 0.462 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -61.6 | -36.3 | 177.9 | 69.6 | 0 | 0 | 0 | 0 | 112.4 | P244 V245 S252 | P244-S248 WeakPolarHBondContact O-CB 3.49Å; P244-S248 PolarHBondContact O-N 3.48Å; P244-S248 PolarHBondContact O-OG 3.39Å; V245-S248 WeakPolarHBondContact CA-OG 3.28Å; V245-S248 PolarHBondContact O-N 3.36Å; V245-S248 PolarHBondContact O-OG 2.88Å; S248-S252 WeakPolarHBondContact O-CB 3.37Å; S248-S252 PolarHBondContact O-N 3.05Å; S248-S252 PolarHBondContact O-OG 3.4Å; S248-S252 VanDerWaalsContact O-OG 3.13Å |
| 249 | F | 85.5 | Confident | 80.8 | Confident | 141 Ų | 141 | 105.7 Ų | 105.7 | 62% | 0.618 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -67.9 | -42.6 | 176.1 | -159.1 | -90.2 | 0 | 0 | 0 | 111.3 | V245 E247 V251 S252 F253 | V245-F249 VanDerWaalsContact O-CB 3.28Å; V245-F249 WeakPolarHBondContact O-CB 3.23Å; V245-F249 PolarHBondContact O-N 2.85Å; E247-F249 VanDerWaalsContact C-N 3.27Å; E247-F249 PolarHBondContact O-N 2.95Å; F249-V251 PolarHBondContact O-N 3.3Å; F249-S252 PolarHBondContact O-N 2.91Å; F249-F253 HydrophobicContact CE1-CD2 4.2Å; F249-F253 WeakPolarHBondContact O-CB 3.41Å; F249-F253 PolarHBondContact O-N 3.04Å |
| 250 | K | 81.2 | Confident | 80.9 | Confident | 144 Ų | 144 | 104.3 Ų | 104.3 | 63% | 0.626 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -63.8 | -40.8 | 178.6 | -150 | 175.5 | -172.6 | -176.8 | 0 | 111.8 | L246 E247 L254 | L246-K250 WeakPolarHBondContact O-CB 3.13Å; L246-K250 PolarHBondContact O-N 3.02Å; E247-K250 PolarHBondContact O-N 3.44Å; K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.3Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 3.19Å |
| 251 | V | 82.9 | Confident | 81 | Confident | 102 Ų | 102 | 101.2 Ų | 101.2 | 62% | 0.618 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -68 | -45.6 | 176.8 | 175.1 | 0 | 0 | 0 | 0 | 111.6 | E247 F249 F253 S255 | E247-V251 WeakPolarHBondContact O-CG2 3.37Å; E247-V251 PolarHBondContact O-N 2.96Å; F249-V251 PolarHBondContact O-N 3.3Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 3.03Å; V251-S255 PolarHBondContact O-N 2.96Å; V251-S255 VanDerWaalsContact O-N 3.09Å; V251-S255 PolarHBondContact O-OG 2.77Å |
| 252 | S | 80.9 | Confident | 80.9 | Confident | 76 Ų | 76 | 106.4 Ų | 106.4 | 53% | 0.531 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -64.6 | -37.1 | 177.1 | -67.3 | 0 | 0 | 0 | 0 | 112.3 | S248 F249 S255 A256 | S248-S252 WeakPolarHBondContact O-CB 3.37Å; S248-S252 PolarHBondContact O-N 3.05Å; S248-S252 PolarHBondContact O-OG 3.4Å; S248-S252 VanDerWaalsContact O-OG 3.13Å; F249-S252 PolarHBondContact O-N 2.91Å; S252-S255 WeakPolarHBondContact CA-OG 3.31Å; S252-S255 PolarHBondContact O-OG 3.39Å; S252-A256 WeakPolarHBondContact O-CB 3.37Å; S252-A256 PolarHBondContact O-N 3.42Å |
| 253 | F | 87.1 | Confident | 80.7 | Confident | 121 Ų | 121 | 108.9 Ų | 108.9 | 53% | 0.531 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -71.4 | -41.3 | -179.7 | -161.4 | -95.6 | 0 | 0 | 0 | 112.2 | F249 V251 L257 | F249-F253 HydrophobicContact CE1-CD2 4.2Å; F249-F253 WeakPolarHBondContact O-CB 3.41Å; F249-F253 PolarHBondContact O-N 3.04Å; V251-F253 VanDerWaalsContact C-N 3.32Å; V251-F253 PolarHBondContact O-N 3.03Å; F253-L257 HydrophobicContact CD1-CD1 3.84Å; F253-L257 HydrophobicContact CE1-CD1 3.52Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CZ-CD1 4.43Å; F253-L257 WeakPolarHBondContact O-CB 3.43Å; F253-L257 PolarHBondContact O-N 2.94Å |
| 254 | L | 83.4 | Confident | 80.3 | Confident | 108 Ų | 108 | 109.3 Ų | 109.3 | 57% | 0.565 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -65.6 | -43.1 | 176.2 | -74.2 | 173.2 | 0 | 0 | 0 | 112.1 | K250 L257 E258 | K250-L254 WeakPolarHBondContact O-CB 3.44Å; K250-L254 VanDerWaalsContact O-CG 3.3Å; K250-L254 WeakPolarHBondContact O-CG 3.36Å; K250-L254 PolarHBondContact O-N 3.19Å; L254-L257 PolarHBondContact O-N 2.92Å; L254-E258 PolarHBondContact O-N 3.31Å |
| 255 | S | 82.2 | Confident | 79.7 | Confident | 61 Ų | 61 | 112.7 Ų | 112.7 | 43% | 0.427 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.6 | -41.6 | 177.5 | 47.4 | 0 | 0 | 0 | 0 | 112.3 | V251 S252 L257 E258 E259 | V251-S255 PolarHBondContact O-N 2.96Å; V251-S255 VanDerWaalsContact O-N 3.09Å; V251-S255 PolarHBondContact O-OG 2.77Å; S252-S255 WeakPolarHBondContact CA-OG 3.31Å; S252-S255 PolarHBondContact O-OG 3.39Å; S255-L257 PolarHBondContact O-N 3.03Å; S255-E258 PolarHBondContact O-N 3.05Å; S255-E259 WeakPolarHBondContact O-CB 3.08Å; S255-E259 PolarHBondContact O-N 2.88Å |
| 256 | A | 83.3 | Confident | 78.8 | Confident | 48 Ų | 48 | 114.6 Ų | 114.6 | 40% | 0.397 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.2 | -40.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | S252 E259 Y260 | S252-A256 WeakPolarHBondContact O-CB 3.37Å; S252-A256 PolarHBondContact O-N 3.42Å; A256-E259 PolarHBondContact O-N 3.44Å; A256-Y260 WeakPolarHBondContact O-CB 3.39Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.05Å |
| 257 | L | 82 | Confident | 77.2 | Confident | 87 Ų | 87 | 120.6 Ų | 120.6 | 46% | 0.455 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -65.7 | -42.6 | 176.6 | -105.6 | 165.2 | 0 | 0 | 0 | 112.5 | F253 L254 S255 E259 Y260 T261 | F253-L257 HydrophobicContact CD1-CD1 3.84Å; F253-L257 HydrophobicContact CE1-CD1 3.52Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CZ-CD1 4.43Å; F253-L257 WeakPolarHBondContact O-CB 3.43Å; F253-L257 PolarHBondContact O-N 2.94Å; L254-L257 PolarHBondContact O-N 2.92Å; S255-L257 PolarHBondContact O-N 3.03Å; L257-E259 VanDerWaalsContact C-N 3.34Å; L257-Y260 PolarHBondContact O-N 3.02Å; L257-T261 WeakPolarHBondContact O-CB 3.07Å; L257-T261 PolarHBondContact O-N 3.34Å; L257-T261 PolarHBondContact O-OG1 3.07Å |
| 258 | E | 81.3 | Confident | 77.1 | Confident | 135 Ų | 135 | 119.3 Ų | 119.3 | 63% | 0.631 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -62.8 | -41.1 | 174.8 | -94.9 | -172 | 154.8 | 0 | 0 | 111.8 | L254 S255 T261 K262 | L254-E258 PolarHBondContact O-N 3.31Å; S255-E258 PolarHBondContact O-N 3.05Å; E258-T261 PolarHBondContact O-N 3.25Å; E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 3.43Å |
| 259 | E | 81.6 | Confident | 76.9 | Confident | 110 Ų | 110 | 122.1 Ų | 122.1 | 51% | 0.514 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -66.7 | -40.9 | 178.6 | -152.1 | -167.1 | 150.8 | 0 | 0 | 111.7 | S255 A256 L257 K263 | S255-E259 WeakPolarHBondContact O-CB 3.08Å; S255-E259 PolarHBondContact O-N 2.88Å; A256-E259 PolarHBondContact O-N 3.44Å; L257-E259 VanDerWaalsContact C-N 3.34Å; E259-K263 WeakPolarHBondContact O-CG 3.27Å; E259-K263 PolarHBondContact O-N 3.46Å; E259-K263 VanDerWaalsContact O-N 3.08Å; E259-K263 WeakPolarHBondContact OE1-CE 3.45Å; E259-K263 IonicContact OE1-NZ 2.75Å; E259-K263 PolarHBondContact OE1-NZ 3.18Å |
| 260 | Y | 77.2 | Confident | 76.4 | Confident | 174 Ų | 174 | 121 Ų | 121 | 68% | 0.682 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -63.9 | -42.6 | 173.2 | -100.6 | -89 | 0 | 0 | 0 | 112.3 | A256 L257 K263 L264 | A256-Y260 WeakPolarHBondContact O-CB 3.39Å; A256-Y260 WeakPolarHBondContact O-CD2 3.25Å; A256-Y260 PolarHBondContact O-N 3.05Å; L257-Y260 PolarHBondContact O-N 3.02Å; Y260-K263 PolarHBondContact O-N 3.26Å; Y260-L264 PolarHBondContact O-N 3.12Å; Y260-L264 VanDerWaalsContact O-N 3.1Å |
| 261 | T | 80.7 | Confident | 76.1 | Confident | 80 Ų | 80 | 119.6 Ų | 119.6 | 49% | 0.491 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.5 | -38.8 | -179.5 | -52.1 | 0 | 0 | 0 | 0 | 111.4 | L257 E258 L264 N265 | L257-T261 WeakPolarHBondContact O-CB 3.07Å; L257-T261 PolarHBondContact O-N 3.34Å; L257-T261 PolarHBondContact O-OG1 3.07Å; E258-T261 PolarHBondContact O-N 3.25Å; T261-L264 PolarHBondContact O-N 3.46Å; T261-N265 PolarHBondContact O-N 3.05Å |
| 262 | K | 76.5 | Confident | 75.7 | Confident | 149 Ų | 149 | 120.8 Ų | 120.8 | 65% | 0.648 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.8 | -40.8 | 173.9 | -84 | -177.7 | 176.6 | 173 | 0 | 112.8 | E258 L264 N265 T266 | E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 3.43Å; K262-L264 VanDerWaalsContact C-N 3.3Å; K262-L264 PolarHBondContact O-N 3.08Å; K262-N265 PolarHBondContact O-N 3.19Å; K262-T266 PolarHBondContact O-N 3.07Å; K262-T266 PolarHBondContact O-OG1 2.76Å |
| 263 | K | 74.6 | Confident | 75.4 | Confident | 139 Ų | 139 | 123.7 Ų | 123.7 | 60% | 0.604 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -66.1 | -31 | 177.6 | -76.1 | 179.6 | -174.9 | 162.4 | 0 | 112.8 | E259 Y260 | E259-K263 WeakPolarHBondContact O-CG 3.27Å; E259-K263 PolarHBondContact O-N 3.46Å; E259-K263 VanDerWaalsContact O-N 3.08Å; E259-K263 WeakPolarHBondContact OE1-CE 3.45Å; E259-K263 IonicContact OE1-NZ 2.75Å; E259-K263 PolarHBondContact OE1-NZ 3.18Å; Y260-K263 PolarHBondContact O-N 3.26Å |
| 264 | L | 67.4 | Low | 74.5 | Confident | 132 Ų | 132 | 123.9 Ų | 123.9 | 69% | 0.691 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -76.6 | -24.1 | 177.5 | -98.1 | 150.1 | 0 | 0 | 0 | 114.7 | Y260 T261 K262 | Y260-L264 PolarHBondContact O-N 3.12Å; Y260-L264 VanDerWaalsContact O-N 3.1Å; T261-L264 PolarHBondContact O-N 3.46Å; K262-L264 VanDerWaalsContact C-N 3.3Å; K262-L264 PolarHBondContact O-N 3.08Å |
| 265 | N | 67.6 | Low | 73.8 | Confident | 147 Ų | 147 | 125.2 Ų | 125.2 | 79% | 0.786 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -99.3 | -0.3 | -177.6 | -114.1 | 1.8 | 0 | 0 | 0 | 114.2 | T261 K262 | T261-N265 PolarHBondContact O-N 3.05Å; K262-N265 PolarHBondContact O-N 3.19Å |
| 266 | T | 60.4 | Low | 73.1 | Confident | 121 Ų | 121 | 130.5 Ų | 130.5 | 74% | 0.742 | 65% | 0.649 | S | S | * | * | trans | -114 | 7.4 | -177.2 | -38.7 | 0 | 0 | 0 | 0 | 112.7 | K262 | K262-T266 PolarHBondContact O-N 3.07Å; K262-T266 PolarHBondContact O-OG1 2.76Å | ||
| 267 | Q | 45 | Very low | 72.2 | Confident | 244 Ų | 244 | 138 Ų | 138 | 100% | 1.14 | 67% | 0.671 | S | S | * | * | trans | -113.9 | 0 | 167.5 | -88 | -154.9 | -21.3 | 0 | 0 | 109.9 |
Retrieved 267 of 267 residues in 730 ms
(Link to these results)