| 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 | 51.7 | Low | 55.3 | Low | 247 Ų | 247 | 171.3 Ų | 171.3 | 100% | 1.217 | 86% | 0.861 | S | S | * | * | 0 | 118.3 | 0 | -78.9 | -172.1 | 151.4 | 0 | 0 | 109.2 | A3 | M1-A3 PolarHBondContact O-N 3.26Š| |||
| 2 | R | 46.5 | Very low | 54.7 | Low | 253 Ų | 253 | 164.9 Ų | 164.9 | 96% | 0.955 | 84% | 0.844 | S | S | * | * | trans | -73.7 | 117.2 | -177.2 | -108.1 | 175.6 | 173 | 175.7 | -2.7 | 109.9 | K4 | R2-K4 PolarHBondContact O-N 3.13Š| ||
| 3 | A | 55.7 | Low | 54.2 | Low | 96 Ų | 96 | 162.2 Ų | 162.2 | 79% | 0.793 | 85% | 0.846 | S | S | * | * | trans | -67.9 | 120.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | M1 R5 | M1-A3 PolarHBondContact O-N 3.26Å; A3-R5 PolarHBondContact O-N 3.47Å | ||
| 4 | K | 62.8 | Low | 53.9 | Low | 195 Ų | 195 | 160.4 Ų | 160.4 | 85% | 0.848 | 84% | 0.839 | S | S | * | * | trans | -64.9 | 110 | 172.9 | -67.8 | -178.8 | 177 | -177.7 | 0 | 108.2 | R2 H6 | R2-K4 PolarHBondContact O-N 3.13Å; K4-H6 PolarHBondContact O-N 3.23Å | ||
| 5 | R | 57.6 | Low | 53.6 | Low | 242 Ų | 242 | 156.4 Ų | 156.4 | 91% | 0.913 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 120 | 170.3 | -70.7 | -177.7 | 176.2 | -175.9 | -2.2 | 107.6 | A3 | A3-R5 PolarHBondContact O-N 3.47Š|
| 6 | H | 54.2 | Low | 53.3 | Low | 173 Ų | 173 | 156.3 Ų | 156.3 | 80% | 0.801 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 141.3 | 173.9 | -76.3 | -82.3 | 0 | 0 | 0 | 109.9 | K4 S8 | K4-H6 PolarHBondContact O-N 3.23Å; H6-S8 PolarHBondContact O-N 2.94Å |
| 7 | P | 60.4 | Low | 52.9 | Low | 118 Ų | 118 | 158.7 Ų | 158.7 | 77% | 0.766 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 128 | -177 | 26.4 | -32.4 | 0 | 0 | 0 | 110.7 | V9 | P7-V9 PolarHBondContact O-N 2.94Š|
| 8 | S | 62.5 | Low | 52.5 | Low | 110 Ų | 110 | 159.1 Ų | 159.1 | 77% | 0.769 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 121.6 | 170.1 | 179.4 | 0 | 0 | 0 | 0 | 109.2 | H6 M10 | H6-S8 PolarHBondContact O-N 2.94Å; S8-M10 PolarHBondContact O-N 3.03Å |
| 9 | V | 54.9 | Low | 52.6 | Low | 124 Ų | 124 | 154.4 Ų | 154.4 | 75% | 0.752 | 82% | 0.818 | S | S | * | * | trans | -66.6 | 114.7 | 173.1 | -173.2 | 0 | 0 | 0 | 0 | 107.4 | P7 L11 | P7-V9 PolarHBondContact O-N 2.94Å; V9-L11 PolarHBondContact O-N 3.41Å | ||
| 10 | M | 51 | Low | 52.7 | Low | 178 Ų | 178 | 155.4 Ų | 155.4 | 88% | 0.877 | 82% | 0.824 | S | S | * | * | trans | -66.9 | 110.3 | 172 | -68.1 | -86.6 | -104.7 | 0 | 0 | 107.5 | S8 S12 | S8-M10 PolarHBondContact O-N 3.03Å; M10-S12 PolarHBondContact O-N 3.12Å | ||
| 11 | L | 50.6 | Low | 53 | Low | 148 Ų | 148 | 155.6 Ų | 155.6 | 78% | 0.775 | 82% | 0.818 | S | S | * | * | trans | -71.7 | 123.7 | 164.4 | -93.9 | 90.8 | 0 | 0 | 0 | 108 | V9 | V9-L11 PolarHBondContact O-N 3.41Š| ||
| 12 | S | 48 | Very low | 53.5 | Low | 95 Ų | 95 | 152.8 Ų | 152.8 | 66% | 0.664 | 80% | 0.802 | S | S | * | * | trans | -60.5 | 124.5 | 171.2 | 43.2 | 0 | 0 | 0 | 0 | 110.5 | M10 D14 | M10-S12 PolarHBondContact O-N 3.12Å; S12-D14 PolarHBondContact O-N 3.24Å | ||
| 13 | C | 48.5 | Very low | 54.5 | Low | 129 Ų | 129 | 148.8 Ų | 148.8 | 87% | 0.872 | 80% | 0.8 | S | S | * | * | trans | -85.6 | 96.8 | 165.3 | -62.8 | 0 | 0 | 0 | 0 | 107.3 | S15 | C13-S15 PolarHBondContact O-N 3.12Š| ||
| 14 | D | 50.3 | Low | 55.3 | Low | 138 Ų | 138 | 148.2 Ų | 148.2 | 74% | 0.738 | 79% | 0.789 | S | S | * | * | trans | -80.2 | 113.2 | 167.5 | -70.4 | -40.7 | 0 | 0 | 0 | 109.2 | S12 | S12-D14 PolarHBondContact O-N 3.24Š| ||
| 15 | S | 49.1 | Very low | 56.3 | Low | 100 Ų | 100 | 145.2 Ų | 145.2 | 70% | 0.699 | 79% | 0.787 | S | S | * | * | trans | 54.4 | 99.8 | 136.8 | -53.6 | 0 | 0 | 0 | 0 | 120 | C13 | C13-S15 PolarHBondContact O-N 3.12Š| ||
| 16 | D | 48.4 | Very low | 57.4 | Low | 154 Ų | 154 | 141 Ų | 141 | 82% | 0.824 | 78% | 0.777 | S | S | * | * | 29.8 | 100.4 | 122.8 | -55 | -36.4 | 0 | 0 | 0 | 117.8 | |||||
| 17 | H | 46.5 | Very low | 58.9 | Low | 198 Ų | 198 | 138.4 Ų | 138.4 | 92% | 0.917 | 78% | 0.776 | S | S | * | * | trans | -145 | 111.5 | 137.6 | -108.9 | -26.4 | 0 | 0 | 0 | 111.9 | S19 | H17-S19 PolarHBondContact O-N 3.21Š| ||
| 18 | D | 46 | Very low | 59.9 | Low | 166 Ų | 166 | 141.3 Ų | 141.3 | 89% | 0.888 | 78% | 0.776 | S | S | * | * | trans | -54.8 | 108.3 | 173.9 | -152.4 | -1 | 0 | 0 | 0 | 111.3 | ||||
| 19 | S | 53.9 | Low | 61 | Low | 69 Ų | 69 | 141.6 Ų | 141.6 | 48% | 0.483 | 78% | 0.775 | S | S | . | * | trans | -155.7 | 123.1 | 154.9 | 62.6 | 0 | 0 | 0 | 0 | 109.7 | H17 K21 | H17-S19 PolarHBondContact O-N 3.21Å; S19-K21 VanDerWaalsContact C-N 3.25Å; S19-K21 PolarHBondContact O-N 2.69Å; S19-K21 WeakPolarHBondContact OG-CE 3.46Å | ||
| 20 | N | 54.9 | Low | 62.4 | Low | 174 Ų | 174 | 143.3 Ų | 143.3 | 93% | 0.93 | 77% | 0.773 | S | S | * | * | trans | -60.2 | 74.5 | -175.8 | -155.5 | -2.1 | 0 | 0 | 0 | 111.9 | ||||
| 21 | K | 59.4 | Low | 64.1 | Low | 161 Ų | 161 | 138.4 Ų | 138.4 | 70% | 0.7 | 76% | 0.756 | S | S | * | * | trans | -113.8 | 119.3 | -178.2 | -67.6 | -179.1 | -175.4 | 174.9 | 0 | 108.6 | S19 N23 | S19-K21 VanDerWaalsContact C-N 3.25Å; S19-K21 PolarHBondContact O-N 2.69Å; S19-K21 WeakPolarHBondContact OG-CE 3.46Å; K21-N23 PolarHBondContact O-N 3.28Å | ||
| 22 | E | 63.2 | Low | 66 | Low | 187 Ų | 187 | 136.9 Ų | 136.9 | 87% | 0.874 | 74% | 0.743 | S | S | * | * | trans | -24.4 | 123.1 | 173.3 | -62.4 | 171.8 | 175.8 | 0 | 0 | 112.6 | C24 | E22-C24 PolarHBondContact O-N 3.23Š| ||
| 23 | N | 67 | Low | 68.1 | Low | 170 Ų | 170 | 138.5 Ų | 138.5 | 91% | 0.909 | 74% | 0.741 | S | S | * | * | trans | -64.8 | 67.6 | 179.7 | -71.9 | -13.9 | 0 | 0 | 0 | 111.4 | K21 T25 | K21-N23 PolarHBondContact O-N 3.28Å; N23-T25 PolarHBondContact O-N 3.2Å | ||
| 24 | C | 72.8 | Confident | 70.2 | Confident | 84 Ų | 84 | 139 Ų | 139 | 57% | 0.568 | 74% | 0.735 | S | S | * | * | trans | -83.2 | 106.3 | 169.6 | -167.5 | 0 | 0 | 0 | 0 | 107.5 | E22 H26 | E22-C24 PolarHBondContact O-N 3.23Å; C24-H26 PolarHBondContact O-N 3.08Å | ||
| 25 | T | 83.6 | Confident | 72.2 | Confident | 132 Ų | 132 | 140.5 Ų | 140.5 | 81% | 0.81 | 73% | 0.73 | S | S | * | * | trans | -70.6 | 98.1 | 172.8 | -58.5 | 0 | 0 | 0 | 0 | 108.2 | N23 P27 | N23-T25 PolarHBondContact O-N 3.2Å; T25-P27 WeakPolarHBondContact O-CD 3.48Å | ||
| 26 | H | 80.6 | Confident | 74.4 | Confident | 153 Ų | 153 | 141.4 Ų | 141.4 | 71% | 0.708 | 72% | 0.723 | S | S | * | * | trans | -67.8 | 121 | 173.2 | -66.3 | -67.2 | 0 | 0 | 0 | 109.2 | C24 K28 | C24-H26 PolarHBondContact O-N 3.08Å; H26-K28 PolarHBondContact O-N 3.47Å | ||
| 27 | P | 85.2 | Confident | 76.6 | Confident | 118 Ų | 118 | 139.3 Ų | 139.3 | 77% | 0.766 | 71% | 0.712 | S | S | * | * | trans | -64.8 | 113.3 | 179 | 26.2 | -32.7 | 0 | 0 | 0 | 108.7 | T25 P29 | T25-P27 WeakPolarHBondContact O-CD 3.48Å; P27-P29 WeakPolarHBondContact O-CD 3.4Å | ||
| 28 | K | 81.7 | Confident | 79 | Confident | 179 Ų | 179 | 133.3 Ų | 133.3 | 78% | 0.778 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 121.3 | 170.3 | -174.7 | 174.4 | -178.1 | 175 | 0 | 107.5 | H26 F30 | H26-K28 PolarHBondContact O-N 3.47Å; K28-F30 PolarHBondContact O-N 3.42Å |
| 29 | P | 84.8 | Confident | 81.4 | Confident | 116 Ų | 116 | 129.8 Ų | 129.8 | 75% | 0.753 | 67% | 0.672 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 126.8 | 175.6 | 24.3 | -32.1 | 0 | 0 | 0 | 108.7 | P27 | P27-P29 WeakPolarHBondContact O-CD 3.4Š|
| 30 | F | 84.6 | Confident | 83.4 | Confident | 161 Ų | 161 | 130.3 Ų | 130.3 | 71% | 0.706 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -86.8 | 130.8 | 175 | 57.9 | -82.8 | 0 | 0 | 0 | 108.5 | K28 F32 | K28-F30 PolarHBondContact O-N 3.42Å; F30-F32 HydrophobicContact CD2-CD2 4.39Å; F30-F32 HydrophobicContact CD2-CE1 4.31Å; F30-F32 AromaticContact CD2-CE2 3.72Å; F30-F32 HydrophobicContact CD2-CE2 3.72Å; F30-F32 AromaticContact CD2-CZ 3.68Å; F30-F32 HydrophobicContact CD2-CZ 3.68Å; F30-F32 HydrophobicContact CE2-CD2 4.38Å; F30-F32 HydrophobicContact CE2-CE1 4.41Å; F30-F32 AromaticContact CE2-CE2 3.37Å; F30-F32 HydrophobicContact CE2-CE2 3.37Å; F30-F32 AromaticContact CE2-CZ 3.39Å; F30-F32 HydrophobicContact CE2-CZ 3.39Å |
| 31 | S | 86.6 | Confident | 85.4 | Confident | 74 Ų | 74 | 128.4 Ų | 128.4 | 52% | 0.517 | 65% | 0.652 | S | S | . | * | P | Polyproline II helix | trans | -102.5 | 145.4 | 172 | 178.8 | 0 | 0 | 0 | 0 | 110 | E33 | S31-E33 WeakPolarHBondContact OG-CB 3.27Å; S31-E33 VanDerWaalsContact OG-CD 3.23Å; S31-E33 VanDerWaalsContact OG-CG 3.23Å; S31-E33 WeakPolarHBondContact OG-CG 3.38Å; S31-E33 PolarHBondContact OG-N 3.4Å; S31-E33 PolarHBondContact OG-OE1 3.14Å |
| 32 | F | 91 | Very high | 87.2 | Confident | 116 Ų | 116 | 127.6 Ų | 127.6 | 51% | 0.509 | 65% | 0.645 | S | S | . | * | trans | -98.4 | -0.3 | 174.1 | -68.1 | -72 | 0 | 0 | 0 | 113.1 | F30 D34 R35 E36 | F30-F32 HydrophobicContact CD2-CD2 4.39Å; F30-F32 HydrophobicContact CD2-CE1 4.31Å; F30-F32 AromaticContact CD2-CE2 3.72Å; F30-F32 HydrophobicContact CD2-CE2 3.72Å; F30-F32 AromaticContact CD2-CZ 3.68Å; F30-F32 HydrophobicContact CD2-CZ 3.68Å; F30-F32 HydrophobicContact CE2-CD2 4.38Å; F30-F32 HydrophobicContact CE2-CE1 4.41Å; F30-F32 AromaticContact CE2-CE2 3.37Å; F30-F32 HydrophobicContact CE2-CE2 3.37Å; F30-F32 AromaticContact CE2-CZ 3.39Å; F30-F32 HydrophobicContact CE2-CZ 3.39Å; F32-D34 VanDerWaalsContact C-N 3.31Å; F32-D34 PolarHBondContact O-N 3.03Å; F32-R35 WeakPolarHBondContact O-CA 3.31Å; F32-R35 WeakPolarHBondContact O-CB 3.13Å; F32-R35 PolarHBondContact O-N 3.16Å; F32-E36 WeakPolarHBondContact O-CB 3.31Å; F32-E36 PolarHBondContact O-N 3.34Å | ||
| 33 | E | 92 | Very high | 88.8 | Confident | 130 Ų | 130 | 127.1 Ų | 127.1 | 61% | 0.607 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -52.6 | -48.2 | -173.2 | -74.6 | 162.4 | -126.5 | 0 | 0 | 111.9 | S31 R35 E36 L37 | S31-E33 WeakPolarHBondContact OG-CB 3.27Å; S31-E33 VanDerWaalsContact OG-CD 3.23Å; S31-E33 VanDerWaalsContact OG-CG 3.23Å; S31-E33 WeakPolarHBondContact OG-CG 3.38Å; S31-E33 PolarHBondContact OG-N 3.4Å; S31-E33 PolarHBondContact OG-OE1 3.14Å; E33-R35 VanDerWaalsContact C-N 3.31Å; E33-R35 PolarHBondContact O-N 3.33Å; E33-E36 PolarHBondContact O-N 3.31Å; E33-L37 WeakPolarHBondContact O-CB 3.46Å; E33-L37 VanDerWaalsContact O-CG 3.25Å; E33-L37 WeakPolarHBondContact O-CG 3.32Å; E33-L37 PolarHBondContact O-N 2.77Å |
| 34 | D | 91.6 | Very high | 90.3 | Very high | 139 Ų | 139 | 123.1 Ų | 123.1 | 74% | 0.743 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -61.4 | -39.8 | 179.1 | -68.4 | -22.5 | 0 | 0 | 0 | 112.7 | F32 S38 | F32-D34 VanDerWaalsContact C-N 3.31Å; F32-D34 PolarHBondContact O-N 3.03Å; D34-S38 WeakPolarHBondContact O-CB 3.5Å; D34-S38 PolarHBondContact O-N 3.49Å; D34-S38 VanDerWaalsContact O-N 3.07Å |
| 35 | R | 92.7 | Very high | 91.5 | Very high | 169 Ų | 169 | 123.5 Ų | 123.5 | 64% | 0.638 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69 | -41.9 | 178.3 | -175 | -178.9 | 179.8 | -137.3 | 1.5 | 110.6 | F32 E33 S38 L39 | F32-R35 WeakPolarHBondContact O-CA 3.31Å; F32-R35 WeakPolarHBondContact O-CB 3.13Å; F32-R35 PolarHBondContact O-N 3.16Å; E33-R35 VanDerWaalsContact C-N 3.31Å; E33-R35 PolarHBondContact O-N 3.33Å; R35-S38 PolarHBondContact O-N 3.1Å; R35-L39 HydrophobicContact CG-CD1 4.46Å; R35-L39 WeakPolarHBondContact O-CG 3.39Å; R35-L39 PolarHBondContact O-N 3.49Å |
| 36 | E | 95.5 | Very high | 92.1 | Very high | 119 Ų | 119 | 125.2 Ų | 125.2 | 56% | 0.556 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66 | -46.7 | 179.4 | -175.4 | 162.8 | -152.6 | 0 | 0 | 111.3 | F32 E33 S38 L39 I40 | F32-E36 WeakPolarHBondContact O-CB 3.31Å; F32-E36 PolarHBondContact O-N 3.34Å; E33-E36 PolarHBondContact O-N 3.31Å; E36-S38 VanDerWaalsContact C-N 3.29Å; E36-S38 PolarHBondContact O-N 2.99Å; E36-L39 WeakPolarHBondContact O-CB 3.26Å; E36-L39 PolarHBondContact O-N 3.28Å; E36-L39 VanDerWaalsContact O-N 3.11Å; E36-I40 HydrophobicContact CG-CD1 3.95Å; E36-I40 VanDerWaalsContact O-CG1 3.31Å; E36-I40 WeakPolarHBondContact O-CG1 3.43Å; E36-I40 PolarHBondContact O-N 2.88Å |
| 37 | L | 95.7 | Very high | 92.9 | Very high | 111 Ų | 111 | 121.7 Ų | 121.7 | 58% | 0.581 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -57.7 | -41.7 | 174.1 | -70.6 | 173.2 | 0 | 0 | 0 | 111.8 | E33 I40 K41 | E33-L37 WeakPolarHBondContact O-CB 3.46Å; E33-L37 VanDerWaalsContact O-CG 3.25Å; E33-L37 WeakPolarHBondContact O-CG 3.32Å; E33-L37 PolarHBondContact O-N 2.77Å; L37-I40 PolarHBondContact O-N 2.89Å; L37-K41 WeakPolarHBondContact O-CB 3.39Å; L37-K41 PolarHBondContact O-N 3.32Å |
| 38 | S | 95.3 | Very high | 93.5 | Very high | 72 Ų | 72 | 120.4 Ų | 120.4 | 50% | 0.503 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -63.9 | -41 | 175.6 | -176.2 | 0 | 0 | 0 | 0 | 112.7 | D34 R35 E36 K41 R42 | D34-S38 WeakPolarHBondContact O-CB 3.5Å; D34-S38 PolarHBondContact O-N 3.49Å; D34-S38 VanDerWaalsContact O-N 3.07Å; R35-S38 PolarHBondContact O-N 3.1Å; E36-S38 VanDerWaalsContact C-N 3.29Å; E36-S38 PolarHBondContact O-N 2.99Å; S38-K41 PolarHBondContact O-N 3.46Å; S38-R42 WeakPolarHBondContact O-CB 3.34Å; S38-R42 PolarHBondContact O-N 2.92Å |
| 39 | L | 96.6 | Very high | 94.3 | Very high | 91 Ų | 91 | 118.1 Ų | 118.1 | 48% | 0.476 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -66.3 | -43.2 | 175.7 | -74.2 | 173.4 | 0 | 0 | 0 | 112.1 | R35 E36 K41 R42 R43 | R35-L39 HydrophobicContact CG-CD1 4.46Å; R35-L39 WeakPolarHBondContact O-CG 3.39Å; R35-L39 PolarHBondContact O-N 3.49Å; E36-L39 WeakPolarHBondContact O-CB 3.26Å; E36-L39 PolarHBondContact O-N 3.28Å; E36-L39 VanDerWaalsContact O-N 3.11Å; L39-K41 VanDerWaalsContact C-N 3.35Å; L39-R42 PolarHBondContact O-N 3.47Å; L39-R43 WeakPolarHBondContact O-CB 3.49Å; L39-R43 PolarHBondContact O-N 3.05Å |
| 40 | I | 96.1 | Very high | 94.8 | Very high | 80 Ų | 80 | 115.5 Ų | 115.5 | 41% | 0.41 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.2 | -47.3 | 176.1 | -68.6 | 166 | 0 | 0 | 0 | 109.8 | E36 L37 R42 R43 N44 | E36-I40 HydrophobicContact CG-CD1 3.95Å; E36-I40 VanDerWaalsContact O-CG1 3.31Å; E36-I40 WeakPolarHBondContact O-CG1 3.43Å; E36-I40 PolarHBondContact O-N 2.88Å; L37-I40 PolarHBondContact O-N 2.89Å; I40-R42 PolarHBondContact O-N 3.01Å; I40-R43 WeakPolarHBondContact O-CB 3.43Å; I40-R43 PolarHBondContact O-N 3.48Å; I40-N44 VanDerWaalsContact O-CG 3.25Å; I40-N44 PolarHBondContact O-N 2.87Å; I40-N44 PolarHBondContact O-ND2 3.42Å |
| 41 | K | 96.9 | Very high | 95.4 | Very high | 135 Ų | 135 | 113 Ų | 113 | 59% | 0.587 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -57.4 | -50.6 | 176.7 | -175.4 | 179.1 | 177.3 | -179 | 0 | 111.8 | L37 S38 L39 R43 N44 E45 | L37-K41 WeakPolarHBondContact O-CB 3.39Å; L37-K41 PolarHBondContact O-N 3.32Å; S38-K41 PolarHBondContact O-N 3.46Å; L39-K41 VanDerWaalsContact C-N 3.35Å; K41-R43 VanDerWaalsContact C-N 3.29Å; K41-R43 PolarHBondContact O-N 3.32Å; K41-N44 PolarHBondContact O-N 2.9Å; K41-E45 VanDerWaalsContact CE-OE1 3.23Å; K41-E45 WeakPolarHBondContact CE-OE1 3.45Å; K41-E45 WeakPolarHBondContact O-CG 3.49Å; K41-E45 PolarHBondContact O-N 3.03Å |
| 42 | R | 97.4 | Very high | 95.9 | Very high | 143 Ų | 143 | 114.2 Ų | 114.2 | 54% | 0.54 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -60.8 | -37 | 177.9 | -179.6 | -178.6 | -83 | 171.4 | -5.1 | 112.2 | S38 L39 I40 R46 | S38-R42 WeakPolarHBondContact O-CB 3.34Å; S38-R42 PolarHBondContact O-N 2.92Å; L39-R42 PolarHBondContact O-N 3.47Å; I40-R42 PolarHBondContact O-N 3.01Å; R42-R46 WeakPolarHBondContact O-CG 3.39Å; R42-R46 PolarHBondContact O-N 3.35Å |
| 43 | R | 97.2 | Very high | 96.1 | Very high | 178 Ų | 178 | 114.1 Ų | 114.1 | 67% | 0.672 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -64.8 | -46.8 | 176.5 | -171.3 | 179.9 | -164.9 | 150.9 | 3.4 | 111 | L39 I40 K41 R46 I47 | L39-R43 WeakPolarHBondContact O-CB 3.49Å; L39-R43 PolarHBondContact O-N 3.05Å; I40-R43 WeakPolarHBondContact O-CB 3.43Å; I40-R43 PolarHBondContact O-N 3.48Å; K41-R43 VanDerWaalsContact C-N 3.29Å; K41-R43 PolarHBondContact O-N 3.32Å; R43-R46 PolarHBondContact O-N 3.46Å; R43-I47 HydrophobicContact CG-CD1 4.32Å; R43-I47 WeakPolarHBondContact O-CG1 3.46Å; R43-I47 PolarHBondContact O-N 3.32Å; R43-I47 VanDerWaalsContact O-N 3.1Å |
| 44 | N | 97.7 | Very high | 96.3 | Very high | 85 Ų | 85 | 110.5 Ų | 110.5 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.5 | -42.2 | 179.2 | -66.5 | -14.3 | 0 | 0 | 0 | 111.6 | I40 K41 R46 I47 V48 | I40-N44 VanDerWaalsContact O-CG 3.25Å; I40-N44 PolarHBondContact O-N 2.87Å; I40-N44 PolarHBondContact O-ND2 3.42Å; K41-N44 PolarHBondContact O-N 2.9Å; N44-R46 VanDerWaalsContact C-N 3.31Å; N44-R46 PolarHBondContact O-N 3.22Å; N44-I47 PolarHBondContact O-N 2.85Å; N44-V48 WeakPolarHBondContact O-CG2 3.36Å; N44-V48 PolarHBondContact O-N 3.33Å |
| 45 | E | 97.8 | Very high | 96.4 | Very high | 92 Ų | 92 | 110.4 Ų | 110.4 | 43% | 0.43 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -57.4 | -42.5 | 174.5 | -72.9 | 169.2 | -177.9 | 0 | 0 | 112.2 | K41 V48 Q49 | K41-E45 VanDerWaalsContact CE-OE1 3.23Å; K41-E45 WeakPolarHBondContact CE-OE1 3.45Å; K41-E45 WeakPolarHBondContact O-CG 3.49Å; K41-E45 PolarHBondContact O-N 3.03Å; E45-V48 PolarHBondContact O-N 3.27Å; E45-Q49 WeakPolarHBondContact O-CB 3.29Å; E45-Q49 VanDerWaalsContact O-CG 3.31Å; E45-Q49 WeakPolarHBondContact O-CG 3.39Å; E45-Q49 PolarHBondContact O-N 2.9Å |
| 46 | R | 97.7 | Very high | 96.4 | Very high | 169 Ų | 169 | 107.4 Ų | 107.4 | 64% | 0.638 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.5 | -40.6 | 176.3 | -75.5 | 179 | 177.1 | 179.6 | -1.6 | 112.7 | R42 R43 N44 Q49 A50 | R42-R46 WeakPolarHBondContact O-CG 3.39Å; R42-R46 PolarHBondContact O-N 3.35Å; R43-R46 PolarHBondContact O-N 3.46Å; N44-R46 VanDerWaalsContact C-N 3.31Å; N44-R46 PolarHBondContact O-N 3.22Å; R46-Q49 PolarHBondContact O-N 3.35Å; R46-A50 WeakPolarHBondContact O-CB 3.44Å; R46-A50 PolarHBondContact O-N 2.93Å |
| 47 | I | 96.9 | Very high | 96.2 | Very high | 79 Ų | 79 | 106.5 Ų | 106.5 | 41% | 0.405 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.9 | -49.4 | 177.4 | -66.8 | 166.3 | 0 | 0 | 0 | 109.5 | R43 N44 Q49 A50 E51 | R43-I47 HydrophobicContact CG-CD1 4.32Å; R43-I47 WeakPolarHBondContact O-CG1 3.46Å; R43-I47 PolarHBondContact O-N 3.32Å; R43-I47 VanDerWaalsContact O-N 3.1Å; N44-I47 PolarHBondContact O-N 2.85Å; I47-Q49 VanDerWaalsContact C-N 3.34Å; I47-Q49 PolarHBondContact O-N 3.42Å; I47-A50 PolarHBondContact O-N 3.22Å; I47-E51 WeakPolarHBondContact O-CG 3.41Å; I47-E51 PolarHBondContact O-N 2.97Å |
| 48 | V | 97.6 | Very high | 95.8 | Very high | 90 Ų | 90 | 104.5 Ų | 104.5 | 55% | 0.545 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.4 | -44 | 178.6 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | N44 E45 E51 L52 | N44-V48 WeakPolarHBondContact O-CG2 3.36Å; N44-V48 PolarHBondContact O-N 3.33Å; E45-V48 PolarHBondContact O-N 3.27Å; V48-E51 PolarHBondContact O-N 3.4Å; V48-L52 PolarHBondContact O-N 3.49Å |
| 49 | Q | 97.8 | Very high | 95.3 | Very high | 131 Ų | 131 | 107.3 Ų | 107.3 | 61% | 0.612 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63 | -42.2 | 176.5 | -74.8 | 175.4 | -1.3 | 0 | 0 | 112.4 | E45 R46 I47 L52 H53 | E45-Q49 WeakPolarHBondContact O-CB 3.29Å; E45-Q49 VanDerWaalsContact O-CG 3.31Å; E45-Q49 WeakPolarHBondContact O-CG 3.39Å; E45-Q49 PolarHBondContact O-N 2.9Å; R46-Q49 PolarHBondContact O-N 3.35Å; I47-Q49 VanDerWaalsContact C-N 3.34Å; I47-Q49 PolarHBondContact O-N 3.42Å; Q49-L52 PolarHBondContact O-N 3.43Å; Q49-H53 WeakPolarHBondContact O-CB 3.26Å; Q49-H53 PolarHBondContact O-N 3.41Å |
| 50 | A | 97.1 | Very high | 94.9 | Very high | 61 Ų | 61 | 106.3 Ų | 106.3 | 50% | 0.504 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -63.9 | -42.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | R46 I47 H53 A54 | R46-A50 WeakPolarHBondContact O-CB 3.44Å; R46-A50 PolarHBondContact O-N 2.93Å; I47-A50 PolarHBondContact O-N 3.22Å; A50-H53 PolarHBondContact O-N 2.93Å; A50-A54 WeakPolarHBondContact O-CB 3.39Å; A50-A54 PolarHBondContact O-N 3.2Å |
| 51 | E | 96.6 | Very high | 94.3 | Very high | 108 Ų | 108 | 110.3 Ų | 110.3 | 51% | 0.505 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -63.1 | -43 | 175.4 | -73 | -180 | -179 | 0 | 0 | 112.4 | I47 V48 A54 K55 | I47-E51 WeakPolarHBondContact O-CG 3.41Å; I47-E51 PolarHBondContact O-N 2.97Å; V48-E51 PolarHBondContact O-N 3.4Å; E51-A54 PolarHBondContact O-N 3.21Å; E51-K55 WeakPolarHBondContact O-CG 3.45Å; E51-K55 PolarHBondContact O-N 2.92Å |
| 52 | L | 96.5 | Very high | 93.7 | Very high | 101 Ų | 101 | 111.7 Ų | 111.7 | 53% | 0.529 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -63.2 | -44.4 | 177.4 | -146 | -169.8 | 0 | 0 | 0 | 110.7 | V48 Q49 A54 K55 L56 | V48-L52 PolarHBondContact O-N 3.49Å; Q49-L52 PolarHBondContact O-N 3.43Å; L52-A54 PolarHBondContact O-N 3.27Å; L52-K55 WeakPolarHBondContact O-CB 3.46Å; L52-K55 PolarHBondContact O-N 3.38Å; L52-L56 HydrophobicContact CD2-CD1 4.11Å; L52-L56 HydrophobicContact CD2-CG 4.05Å; L52-L56 WeakPolarHBondContact O-CG 3.4Å; L52-L56 PolarHBondContact O-N 3.44Å |
| 53 | H | 96.1 | Very high | 93 | Very high | 113 Ų | 113 | 108.7 Ų | 108.7 | 52% | 0.523 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.3 | -42.5 | 176.4 | -174.8 | -100.7 | 0 | 0 | 0 | 112.1 | Q49 A50 K55 L56 L57 | Q49-H53 WeakPolarHBondContact O-CB 3.26Å; Q49-H53 PolarHBondContact O-N 3.41Å; A50-H53 PolarHBondContact O-N 2.93Å; H53-K55 VanDerWaalsContact C-N 3.33Å; H53-K55 PolarHBondContact O-N 2.99Å; H53-L56 PolarHBondContact O-N 3.36Å; H53-L57 VanDerWaalsContact CE1-CD1 3.45Å; H53-L57 WeakPolarHBondContact CE1-CD1 3.37Å; H53-L57 WeakPolarHBondContact O-CG 3.48Å; H53-L57 PolarHBondContact O-N 2.96Å |
| 54 | A | 95 | Very high | 92.4 | Very high | 55 Ų | 55 | 108.5 Ų | 108.5 | 46% | 0.455 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60.7 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | A50 E51 L52 L57 A58 | A50-A54 WeakPolarHBondContact O-CB 3.39Å; A50-A54 PolarHBondContact O-N 3.2Å; E51-A54 PolarHBondContact O-N 3.21Å; L52-A54 PolarHBondContact O-N 3.27Å; A54-L57 PolarHBondContact O-N 2.92Å; A54-A58 WeakPolarHBondContact O-CB 3.31Å; A54-A58 PolarHBondContact O-N 3.44Å |
| 55 | K | 93.3 | Very high | 91.9 | Very high | 136 Ų | 136 | 110.2 Ų | 110.2 | 59% | 0.591 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -62.3 | -42.1 | 174.4 | -73.2 | 174.9 | -177.5 | 175 | 0 | 112.3 | E51 L52 H53 A58 N59 | E51-K55 WeakPolarHBondContact O-CG 3.45Å; E51-K55 PolarHBondContact O-N 2.92Å; L52-K55 WeakPolarHBondContact O-CB 3.46Å; L52-K55 PolarHBondContact O-N 3.38Å; H53-K55 VanDerWaalsContact C-N 3.33Å; H53-K55 PolarHBondContact O-N 2.99Å; K55-A58 PolarHBondContact O-N 3.25Å; K55-N59 WeakPolarHBondContact O-CB 3.38Å; K55-N59 VanDerWaalsContact O-CG 3.32Å; K55-N59 PolarHBondContact O-N 3.22Å; K55-N59 PolarHBondContact O-ND2 2.95Å |
| 56 | L | 93.3 | Very high | 91.1 | Very high | 106 Ų | 106 | 113.9 Ų | 113.9 | 56% | 0.555 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -63.1 | -44.2 | 176.5 | -71 | 172.8 | 0 | 0 | 0 | 111.7 | L52 H53 N59 S60 | L52-L56 HydrophobicContact CD2-CD1 4.11Å; L52-L56 HydrophobicContact CD2-CG 4.05Å; L52-L56 WeakPolarHBondContact O-CG 3.4Å; L52-L56 PolarHBondContact O-N 3.44Å; H53-L56 PolarHBondContact O-N 3.36Å; L56-N59 PolarHBondContact O-N 3.01Å; L56-S60 VanDerWaalsContact O-CB 3.32Å; L56-S60 WeakPolarHBondContact O-CB 3.23Å; L56-S60 PolarHBondContact O-N 3.49Å; L56-S60 PolarHBondContact O-OG 3.03Å |
| 57 | L | 91.8 | Very high | 90.3 | Very high | 100 Ų | 100 | 116.8 Ų | 116.8 | 52% | 0.524 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -64.4 | -40.9 | 176.5 | -72.4 | 179.6 | 0 | 0 | 0 | 112.7 | H53 A54 N59 S60 F61 | H53-L57 VanDerWaalsContact CE1-CD1 3.45Å; H53-L57 WeakPolarHBondContact CE1-CD1 3.37Å; H53-L57 WeakPolarHBondContact O-CG 3.48Å; H53-L57 PolarHBondContact O-N 2.96Å; A54-L57 PolarHBondContact O-N 2.92Å; L57-N59 VanDerWaalsContact C-N 3.3Å; L57-N59 PolarHBondContact O-N 3.4Å; L57-S60 WeakPolarHBondContact CA-OG 3.43Å; L57-S60 PolarHBondContact O-N 3.38Å; L57-S60 PolarHBondContact O-OG 3.01Å; L57-F61 PolarHBondContact O-N 3.33Å |
| 58 | A | 88 | Confident | 89.5 | Confident | 70 Ų | 70 | 120.2 Ų | 120.2 | 58% | 0.579 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -62.6 | -40.3 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | A54 K55 | A54-A58 WeakPolarHBondContact O-CB 3.31Å; A54-A58 PolarHBondContact O-N 3.44Å; K55-A58 PolarHBondContact O-N 3.25Å |
| 59 | N | 84.4 | Confident | 88.8 | Confident | 130 Ų | 130 | 118.9 Ų | 118.9 | 70% | 0.695 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -76.7 | -22.1 | 177.5 | -70.5 | -18.1 | 0 | 0 | 0 | 113.4 | K55 L56 L57 | K55-N59 WeakPolarHBondContact O-CB 3.38Å; K55-N59 VanDerWaalsContact O-CG 3.32Å; K55-N59 PolarHBondContact O-N 3.22Å; K55-N59 PolarHBondContact O-ND2 2.95Å; L56-N59 PolarHBondContact O-N 3.01Å; L57-N59 VanDerWaalsContact C-N 3.3Å; L57-N59 PolarHBondContact O-N 3.4Å |
| 60 | S | 87.2 | Confident | 88 | Confident | 71 Ų | 71 | 118 Ų | 118 | 50% | 0.497 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -85.8 | -7.9 | 179.8 | 72.8 | 0 | 0 | 0 | 0 | 113.8 | L56 L57 K62 | L56-S60 VanDerWaalsContact O-CB 3.32Å; L56-S60 WeakPolarHBondContact O-CB 3.23Å; L56-S60 PolarHBondContact O-N 3.49Å; L56-S60 PolarHBondContact O-OG 3.03Å; L57-S60 WeakPolarHBondContact CA-OG 3.43Å; L57-S60 PolarHBondContact O-N 3.38Å; L57-S60 PolarHBondContact O-OG 3.01Å; S60-K62 PolarHBondContact O-N 3.43Å |
| 61 | F | 83.4 | Confident | 87 | Confident | 163 Ų | 163 | 120.9 Ų | 120.9 | 72% | 0.715 | 67% | 0.665 | S | S | * | * | trans | -59.4 | 110.5 | 175.5 | -178 | -100.9 | 0 | 0 | 0 | 110.3 | L57 | L57-F61 PolarHBondContact O-N 3.33Š| ||
| 62 | K | 84.4 | Confident | 86.2 | Confident | 165 Ų | 165 | 122.6 Ų | 122.6 | 72% | 0.717 | 68% | 0.678 | S | S | * | * | trans | -114.8 | 124.2 | 168.7 | -60.1 | -59.2 | -179.6 | -166.5 | 0 | 106.9 | S60 Q64 | S60-K62 PolarHBondContact O-N 3.43Å; K62-Q64 PolarHBondContact O-N 2.92Å | ||
| 63 | A | 84 | Confident | 85.6 | Confident | 80 Ų | 80 | 129.5 Ų | 129.5 | 66% | 0.661 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 124.3 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||
| 64 | Q | 84 | Confident | 85 | Confident | 174 Ų | 174 | 131.6 Ų | 131.6 | 81% | 0.813 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -68 | 136.7 | 169.8 | -68.7 | -173.7 | -13.6 | 0 | 0 | 108 | K62 M66 | K62-Q64 PolarHBondContact O-N 2.92Å; Q64-M66 PolarHBondContact O-N 3.24Å |
| 65 | P | 87.2 | Confident | 84.7 | Confident | 121 Ų | 121 | 134.2 Ų | 134.2 | 79% | 0.786 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 139.6 | 175.9 | 24.3 | -32.8 | 0 | 0 | 0 | 109.3 | R67 | P65-R67 PolarHBondContact O-N 2.92Š|
| 66 | M | 81.5 | Confident | 84.6 | Confident | 169 Ų | 169 | 133.5 Ų | 133.5 | 83% | 0.833 | 73% | 0.733 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 133.5 | 176.1 | -74.8 | -178.6 | 62.7 | 0 | 0 | 109.2 | Q64 V68 | Q64-M66 PolarHBondContact O-N 3.24Å; M66-V68 PolarHBondContact O-N 3.48Å |
| 67 | R | 79.8 | Confident | 84.4 | Confident | 230 Ų | 230 | 139.2 Ų | 139.2 | 87% | 0.868 | 75% | 0.747 | S | S | * | * | trans | -60.1 | 102.1 | 173.3 | -69 | -176.9 | -178.5 | 174.2 | 0.3 | 108 | P65 G69 | P65-R67 PolarHBondContact O-N 2.92Å; R67-G69 PolarHBondContact O-N 3.42Å | ||
| 68 | V | 80.8 | Confident | 84.4 | Confident | 151 Ų | 151 | 139.6 Ų | 139.6 | 92% | 0.915 | 75% | 0.754 | S | S | * | * | trans | -79.7 | 94.9 | 171.1 | -81.4 | 0 | 0 | 0 | 0 | 107.5 | M66 | M66-V68 PolarHBondContact O-N 3.48Š| ||
| 69 | G | 83 | Confident | 84.6 | Confident | 62 Ų | 62 | 141.9 Ų | 141.9 | 64% | 0.639 | 76% | 0.76 | S | S | * | * | S | Bend | trans | -166.3 | 165.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | R67 | R67-G69 PolarHBondContact O-N 3.42Š|
| 70 | S | 80.1 | Confident | 84.9 | Confident | 113 Ų | 113 | 143.3 Ų | 143.3 | 79% | 0.79 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 134.3 | 175 | -53.1 | 0 | 0 | 0 | 0 | 109.9 | ||
| 71 | P | 77.2 | Confident | 85 | Confident | 121 Ų | 121 | 144.7 Ų | 144.7 | 79% | 0.786 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 141.8 | -178.5 | 23.9 | -33.5 | 0 | 0 | 0 | 110.6 | R73 | P71-R73 PolarHBondContact O-N 3.33Š|
| 72 | D | 79.9 | Confident | 85.3 | Confident | 144 Ų | 144 | 141.7 Ų | 141.7 | 77% | 0.77 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -51.2 | 131.9 | 178.8 | -74.3 | -25.4 | 0 | 0 | 0 | 110 | L74 | D72-L74 PolarHBondContact O-N 3.46Å; D72-L74 VanDerWaalsContact O-N 3.15Å |
| 73 | R | 82.7 | Confident | 85.7 | Confident | 246 Ų | 246 | 140.6 Ų | 140.6 | 93% | 0.928 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 120.3 | -177.4 | -68.4 | -176.1 | -178.3 | -112.9 | 1.7 | 109.1 | P71 | P71-R73 PolarHBondContact O-N 3.33Š|
| 74 | L | 84.7 | Confident | 86 | Confident | 156 Ų | 156 | 143.8 Ų | 143.8 | 82% | 0.817 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 144.2 | 172.8 | -66.8 | 174.5 | 0 | 0 | 0 | 109.9 | D72 | D72-L74 PolarHBondContact O-N 3.46Å; D72-L74 VanDerWaalsContact O-N 3.15Å |
| 75 | P | 88.9 | Confident | 86.3 | Confident | 111 Ų | 111 | 141.6 Ų | 141.6 | 72% | 0.721 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 147 | 176.8 | 25.3 | -33.5 | 0 | 0 | 0 | 110.6 | ||
| 76 | P | 89.4 | Confident | 86.5 | Confident | 121 Ų | 121 | 143.1 Ų | 143.1 | 79% | 0.786 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 139.4 | -179.9 | 26.8 | -34 | 0 | 0 | 0 | 110.8 | V78 | P76-V78 PolarHBondContact O-N 3.45Š|
| 77 | R | 90 | Very high | 87 | Confident | 225 Ų | 225 | 140.2 Ų | 140.2 | 85% | 0.849 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 123.4 | 175.7 | -179 | 179.8 | 177.8 | -170.1 | -0.2 | 109.6 | V79 | R77-V79 HydrophobicContact CG-CG2 4.27Å; R77-V79 PolarHBondContact O-N 2.99Å |
| 78 | V | 91.2 | Very high | 87.6 | Confident | 109 Ų | 109 | 137.8 Ų | 137.8 | 66% | 0.661 | 77% | 0.77 | S | S | * | * | trans | -72 | 114.7 | 172.5 | -175.4 | 0 | 0 | 0 | 0 | 108.5 | P76 | P76-V78 PolarHBondContact O-N 3.45Š| ||
| 79 | V | 93.3 | Very high | 88.1 | Confident | 117 Ų | 117 | 138 Ų | 138 | 71% | 0.709 | 76% | 0.76 | S | S | * | * | trans | -110.6 | 112.3 | 174.2 | -176.5 | 0 | 0 | 0 | 0 | 107.2 | R77 | R77-V79 HydrophobicContact CG-CG2 4.27Å; R77-V79 PolarHBondContact O-N 2.99Å | ||
| 80 | H | 89.6 | Confident | 88.3 | Confident | 160 Ų | 160 | 138.9 Ų | 138.9 | 74% | 0.741 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -79.1 | 137.6 | 176.5 | -61.2 | -69.9 | 0 | 0 | 0 | 110.2 | ||
| 81 | S | 89.8 | Confident | 88.9 | Confident | 101 Ų | 101 | 139.6 Ų | 139.6 | 71% | 0.706 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -69.6 | 147.4 | 172 | 53.3 | 0 | 0 | 0 | 0 | 110.6 | V83 | S81-V83 PolarHBondContact O-N 2.87Š|
| 82 | P | 90.3 | Very high | 89.6 | Confident | 99 Ų | 99 | 137.2 Ų | 137.2 | 64% | 0.643 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 134.1 | 176.3 | 24.7 | -32.4 | 0 | 0 | 0 | 110.8 | H84 | P82-H84 PolarHBondContact O-N 3.3Š|
| 83 | V | 91.7 | Very high | 90.2 | Very high | 142 Ų | 142 | 136.6 Ų | 136.6 | 86% | 0.861 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -77.1 | 118.8 | 178.8 | -179 | 0 | 0 | 0 | 0 | 108.9 | S81 | S81-V83 PolarHBondContact O-N 2.87Š|
| 84 | H | 91.5 | Very high | 90.8 | Very high | 148 Ų | 148 | 131 Ų | 131 | 69% | 0.685 | 71% | 0.706 | S | S | * | * | P | Polyproline II helix | trans | -84.1 | 137.6 | 174.6 | -62 | -67 | 0 | 0 | 0 | 110.5 | P82 | P82-H84 PolarHBondContact O-N 3.3Š|
| 85 | P | 90.5 | Very high | 91.3 | Very high | 128 Ų | 128 | 132 Ų | 132 | 83% | 0.831 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 137 | 177.9 | 27.5 | -33.7 | 0 | 0 | 0 | 110.7 | ||
| 86 | I | 90.2 | Very high | 91.5 | Very high | 153 Ų | 153 | 130.3 Ų | 130.3 | 79% | 0.785 | 68% | 0.683 | S | S | * | * | P | Polyproline II helix | trans | -78.6 | 129.6 | 176 | -60.1 | 169.1 | 0 | 0 | 0 | 108.2 | F88 | I86-F88 PolarHBondContact O-N 3.17Š|
| 87 | S | 92.7 | Very high | 91.8 | Very high | 107 Ų | 107 | 127.2 Ų | 127.2 | 75% | 0.748 | 67% | 0.668 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 130.7 | 174.7 | 57.8 | 0 | 0 | 0 | 0 | 110.7 | ||
| 88 | F | 93.1 | Very high | 92 | Very high | 180 Ų | 180 | 122.3 Ų | 122.3 | 79% | 0.789 | 66% | 0.658 | S | S | * | * | trans | -127.9 | 149.3 | 175.8 | 69.1 | -83.9 | 0 | 0 | 0 | 110.8 | I86 | I86-F88 PolarHBondContact O-N 3.17Š| ||
| 89 | H | 89.6 | Confident | 92.1 | Very high | 154 Ų | 154 | 121.9 Ų | 121.9 | 71% | 0.713 | 65% | 0.648 | S | S | * | * | trans | -98.8 | 128.4 | 176.7 | -67.5 | 83.6 | 0 | 0 | 0 | 109.6 | F91 | H89-F91 PolarHBondContact O-N 2.96Š| ||
| 90 | S | 88.7 | Confident | 92.2 | Very high | 81 Ų | 81 | 123.9 Ų | 123.9 | 57% | 0.566 | 64% | 0.643 | S | S | * | * | trans | -85.6 | 108.2 | 177 | 59.4 | 0 | 0 | 0 | 0 | 110.7 | T92 | S90-T92 PolarHBondContact O-N 3.39Š| ||
| 91 | F | 91.8 | Very high | 92.3 | Very high | 128 Ų | 128 | 119.1 Ų | 119.1 | 56% | 0.561 | 63% | 0.628 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.8 | 25.3 | 174.9 | -57.4 | -74.3 | 0 | 0 | 0 | 113.8 | H89 E94 R95 | H89-F91 PolarHBondContact O-N 2.96Å; F91-E94 WeakPolarHBondContact CD1-OE2 3.41Å; F91-R95 PolarHBondContact O-N 2.9Å |
| 92 | T | 92.6 | Very high | 92.4 | Very high | 72 Ų | 72 | 123.6 Ų | 123.6 | 44% | 0.442 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68 | -42.7 | 179.9 | 40.2 | 0 | 0 | 0 | 0 | 111.2 | S90 R95 I96 | S90-T92 PolarHBondContact O-N 3.39Å; T92-R95 PolarHBondContact O-N 3.43Å; T92-I96 WeakPolarHBondContact O-CG1 3.36Å; T92-I96 PolarHBondContact O-N 2.94Å |
| 93 | E | 92.5 | Very high | 92.3 | Very high | 131 Ų | 131 | 126.7 Ų | 126.7 | 61% | 0.612 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -65 | -44.2 | -178 | -159.1 | 59.8 | -152.8 | 0 | 0 | 111.5 | R95 I96 A97 | E93-R95 VanDerWaalsContact C-N 3.32Å; E93-R95 PolarHBondContact O-N 2.97Å; E93-I96 PolarHBondContact O-N 3.43Å; E93-A97 PolarHBondContact O-N 3.15Å |
| 94 | E | 94.4 | Very high | 92.2 | Very high | 129 Ų | 129 | 126.1 Ų | 126.1 | 60% | 0.603 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -59.5 | -41.8 | 175.7 | -65.6 | 178.1 | -165.6 | 0 | 0 | 112.1 | F91 A97 L98 | F91-E94 WeakPolarHBondContact CD1-OE2 3.41Å; E94-A97 PolarHBondContact O-N 3.49Å; E94-L98 WeakPolarHBondContact O-CB 3.33Å; E94-L98 PolarHBondContact O-N 3.45Å |
| 95 | R | 95 | Very high | 91.9 | Very high | 176 Ų | 176 | 122.3 Ų | 122.3 | 66% | 0.664 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -65.9 | -40.6 | 178.3 | -168.1 | -174.1 | -54.4 | 159.8 | 5.4 | 112 | F91 T92 E93 H99 | F91-R95 PolarHBondContact O-N 2.9Å; T92-R95 PolarHBondContact O-N 3.43Å; E93-R95 VanDerWaalsContact C-N 3.32Å; E93-R95 PolarHBondContact O-N 2.97Å; R95-H99 WeakPolarHBondContact O-CB 3.38Å; R95-H99 PolarHBondContact O-N 2.99Å |
| 96 | I | 94.7 | Very high | 91.5 | Very high | 75 Ų | 75 | 118.5 Ų | 118.5 | 39% | 0.385 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65 | -45 | 177.8 | -68 | 166.1 | 0 | 0 | 0 | 109.8 | T92 E93 H99 R100 | T92-I96 WeakPolarHBondContact O-CG1 3.36Å; T92-I96 PolarHBondContact O-N 2.94Å; E93-I96 PolarHBondContact O-N 3.43Å; I96-H99 PolarHBondContact O-N 2.91Å; I96-R100 WeakPolarHBondContact O-CG 3.46Å; I96-R100 PolarHBondContact O-N 3.23Å |
| 97 | A | 94 | Very high | 90.9 | Very high | 57 Ų | 57 | 114.5 Ų | 114.5 | 47% | 0.471 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -59.8 | -46.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | E93 E94 H99 R100 S101 | E93-A97 PolarHBondContact O-N 3.15Å; E94-A97 PolarHBondContact O-N 3.49Å; A97-H99 VanDerWaalsContact C-N 3.33Å; A97-H99 PolarHBondContact O-N 3.27Å; A97-R100 PolarHBondContact O-N 3.44Å; A97-S101 PolarHBondContact O-N 3.19Å |
| 98 | L | 94.6 | Very high | 90.1 | Very high | 122 Ų | 122 | 113.2 Ų | 113.2 | 64% | 0.639 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -61.8 | -39.9 | 177.2 | -175.5 | 68.4 | 0 | 0 | 0 | 112.4 | E94 S101 R102 | E94-L98 WeakPolarHBondContact O-CB 3.33Å; E94-L98 PolarHBondContact O-N 3.45Å; L98-S101 PolarHBondContact O-OG 3.28Å; L98-R102 WeakPolarHBondContact O-CB 3.45Å; L98-R102 PolarHBondContact O-N 3.02Å; L98-R102 VanDerWaalsContact O-N 3.07Å |
| 99 | H | 94.7 | Very high | 89.2 | Confident | 100 Ų | 100 | 106.9 Ų | 106.9 | 46% | 0.463 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -68.6 | -37.2 | 178.4 | -175.3 | -83.2 | 0 | 0 | 0 | 112.1 | R95 I96 A97 R103 | R95-H99 WeakPolarHBondContact O-CB 3.38Å; R95-H99 PolarHBondContact O-N 2.99Å; I96-H99 PolarHBondContact O-N 2.91Å; A97-H99 VanDerWaalsContact C-N 3.33Å; A97-H99 PolarHBondContact O-N 3.27Å; H99-R103 PolarHBondContact CE1-NE 3.48Å; H99-R103 VanDerWaalsContact CE1-NE 3.34Å; H99-R103 PolarHBondContact O-N 2.96Å; H99-R103 VanDerWaalsContact O-N 3.09Å |
| 100 | R | 93.4 | Very high | 88.4 | Confident | 158 Ų | 158 | 105 Ų | 105 | 60% | 0.596 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -62.9 | -49.7 | 174 | -74.7 | -178.2 | -177.6 | 171.6 | 3.2 | 111.4 | I96 A97 R102 R103 E104 | I96-R100 WeakPolarHBondContact O-CG 3.46Å; I96-R100 PolarHBondContact O-N 3.23Å; A97-R100 PolarHBondContact O-N 3.44Å; R100-R102 VanDerWaalsContact C-N 3.31Å; R100-R102 PolarHBondContact O-N 3Å; R100-R103 PolarHBondContact O-N 3.48Å; R100-R103 VanDerWaalsContact O-N 3.11Å; R100-E104 WeakPolarHBondContact O-CG 3.45Å; R100-E104 PolarHBondContact O-N 2.97Å |
| 101 | S | 91.8 | Very high | 87.5 | Confident | 60 Ų | 60 | 107.5 Ų | 107.5 | 42% | 0.42 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.7 | -39.1 | 179.6 | 71.6 | 0 | 0 | 0 | 0 | 112.5 | A97 L98 R103 E104 A105 | A97-S101 PolarHBondContact O-N 3.19Å; L98-S101 PolarHBondContact O-OG 3.28Å; S101-R103 PolarHBondContact O-N 3.2Å; S101-E104 PolarHBondContact O-N 3.21Å; S101-A105 WeakPolarHBondContact O-CB 3.37Å; S101-A105 PolarHBondContact O-N 3.1Å |
| 102 | R | 92.3 | Very high | 86.2 | Confident | 196 Ų | 196 | 104.4 Ų | 104.4 | 74% | 0.74 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.3 | -42.8 | 174.9 | -179.5 | 177 | 169.8 | 179.6 | -2.5 | 112.1 | L98 R100 A105 S106 | L98-R102 WeakPolarHBondContact O-CB 3.45Å; L98-R102 PolarHBondContact O-N 3.02Å; L98-R102 VanDerWaalsContact O-N 3.07Å; R100-R102 VanDerWaalsContact C-N 3.31Å; R100-R102 PolarHBondContact O-N 3Å; R102-A105 PolarHBondContact O-N 3.38Å; R102-S106 PolarHBondContact O-N 3.24Å; R102-S106 PolarHBondContact O-OG 3.34Å; R102-S106 VanDerWaalsContact O-OG 3.12Å |
| 103 | R | 89.2 | Confident | 84.8 | Confident | 163 Ų | 163 | 106.4 Ų | 106.4 | 62% | 0.615 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.1 | -48.2 | 176.8 | -90.7 | -163.7 | -171.7 | 162.4 | 5.6 | 111.4 | H99 R100 S101 A105 S106 T107 | H99-R103 PolarHBondContact CE1-NE 3.48Å; H99-R103 VanDerWaalsContact CE1-NE 3.34Å; H99-R103 PolarHBondContact O-N 2.96Å; H99-R103 VanDerWaalsContact O-N 3.09Å; R100-R103 PolarHBondContact O-N 3.48Å; R100-R103 VanDerWaalsContact O-N 3.11Å; S101-R103 PolarHBondContact O-N 3.2Å; R103-A105 VanDerWaalsContact C-N 3.29Å; R103-A105 PolarHBondContact O-N 3.47Å; R103-S106 WeakPolarHBondContact CA-OG 3.4Å; R103-S106 PolarHBondContact O-N 3Å; R103-S106 VanDerWaalsContact O-N 3.11Å; R103-S106 PolarHBondContact O-OG 3.48Å; R103-T107 WeakPolarHBondContact O-CG2 3.43Å; R103-T107 PolarHBondContact O-N 2.93Å; R103-T107 PolarHBondContact O-OG1 3.36Å |
| 104 | E | 88.4 | Confident | 83.4 | Confident | 130 Ų | 130 | 106.2 Ų | 106.2 | 61% | 0.607 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -59.6 | -39.8 | 179.7 | -70.5 | 168.4 | -165.1 | 0 | 0 | 111.8 | R100 S101 T107 S108 | R100-E104 WeakPolarHBondContact O-CG 3.45Å; R100-E104 PolarHBondContact O-N 2.97Å; S101-E104 PolarHBondContact O-N 3.21Å; E104-T107 PolarHBondContact O-OG1 3.46Å; E104-S108 PolarHBondContact O-N 2.95Å |
| 105 | A | 86 | Confident | 81.8 | Confident | 68 Ų | 68 | 105.8 Ų | 105.8 | 56% | 0.562 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -65.3 | -41.1 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | S101 R102 R103 A109 | S101-A105 WeakPolarHBondContact O-CB 3.37Å; S101-A105 PolarHBondContact O-N 3.1Å; R102-A105 PolarHBondContact O-N 3.38Å; R103-A105 VanDerWaalsContact C-N 3.29Å; R103-A105 PolarHBondContact O-N 3.47Å; A105-A109 PolarHBondContact O-N 3.38Å |
| 106 | S | 81.3 | Confident | 80.2 | Confident | 48 Ų | 48 | 107.3 Ų | 107.3 | 34% | 0.336 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.8 | -39.1 | 178 | 50.5 | 0 | 0 | 0 | 0 | 113.3 | R102 R103 S108 A109 E110 | R102-S106 PolarHBondContact O-N 3.24Å; R102-S106 PolarHBondContact O-OG 3.34Å; R102-S106 VanDerWaalsContact O-OG 3.12Å; R103-S106 WeakPolarHBondContact CA-OG 3.4Å; R103-S106 PolarHBondContact O-N 3Å; R103-S106 VanDerWaalsContact O-N 3.11Å; R103-S106 PolarHBondContact O-OG 3.48Å; S106-S108 PolarHBondContact O-N 3.35Å; S106-A109 PolarHBondContact O-N 2.73Å; S106-E110 WeakPolarHBondContact O-CB 3.41Å; S106-E110 WeakPolarHBondContact O-CG 3.31Å; S106-E110 PolarHBondContact O-N 3.41Å |
| 107 | T | 77.8 | Confident | 78.5 | Confident | 69 Ų | 69 | 106.5 Ų | 106.5 | 42% | 0.423 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.1 | -41.8 | -179.7 | 48.8 | 0 | 0 | 0 | 0 | 111.3 | R103 E104 A109 E110 E111 | R103-T107 WeakPolarHBondContact O-CG2 3.43Å; R103-T107 PolarHBondContact O-N 2.93Å; R103-T107 PolarHBondContact O-OG1 3.36Å; E104-T107 PolarHBondContact O-OG1 3.46Å; T107-A109 VanDerWaalsContact C-N 3.33Å; T107-A109 PolarHBondContact O-N 3.2Å; T107-E110 PolarHBondContact O-N 3.44Å; T107-E111 WeakPolarHBondContact O-CG 3.38Å; T107-E111 PolarHBondContact O-N 2.94Å |
| 108 | S | 75.7 | Confident | 76.8 | Confident | 81 Ų | 81 | 114.7 Ų | 114.7 | 57% | 0.566 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64 | -37.8 | 176.1 | -173.3 | 0 | 0 | 0 | 0 | 112.3 | E104 S106 S112 | E104-S108 PolarHBondContact O-N 2.95Å; S106-S108 PolarHBondContact O-N 3.35Å; S108-S112 PolarHBondContact O-N 3.17Å |
| 109 | A | 75.5 | Confident | 75.2 | Confident | 47 Ų | 47 | 115.8 Ų | 115.8 | 39% | 0.388 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -68.1 | -43.3 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A105 S106 T107 S112 I113 | A105-A109 PolarHBondContact O-N 3.38Å; S106-A109 PolarHBondContact O-N 2.73Å; T107-A109 VanDerWaalsContact C-N 3.33Å; T107-A109 PolarHBondContact O-N 3.2Å; A109-S112 PolarHBondContact O-N 2.84Å; A109-S112 PolarHBondContact O-OG 2.87Å; A109-I113 WeakPolarHBondContact O-CG1 3.28Å; A109-I113 PolarHBondContact O-N 3.17Å |
| 110 | E | 71.1 | Confident | 73.8 | Confident | 115 Ų | 115 | 120.3 Ų | 120.3 | 54% | 0.537 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -67.4 | -39.9 | 179.9 | -74.7 | -178.9 | -176.9 | 0 | 0 | 112.6 | S106 T107 S112 I113 I114 | S106-E110 WeakPolarHBondContact O-CB 3.41Å; S106-E110 WeakPolarHBondContact O-CG 3.31Å; S106-E110 PolarHBondContact O-N 3.41Å; T107-E110 PolarHBondContact O-N 3.44Å; E110-S112 PolarHBondContact O-N 3.02Å; E110-I113 PolarHBondContact O-N 3.47Å; E110-I114 VanDerWaalsContact O-CG1 3.3Å; E110-I114 WeakPolarHBondContact O-CG1 3.47Å; E110-I114 PolarHBondContact O-N 2.9Å |
| 111 | E | 70.1 | Confident | 72.8 | Confident | 132 Ų | 132 | 117.5 Ų | 117.5 | 62% | 0.617 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -57.9 | -36.4 | 174.5 | -75.8 | 177.5 | -178.8 | 0 | 0 | 111.9 | T107 I113 T115 | T107-E111 WeakPolarHBondContact O-CG 3.38Å; T107-E111 PolarHBondContact O-N 2.94Å; E111-I113 VanDerWaalsContact C-N 3.31Å; E111-I113 PolarHBondContact O-N 3.48Å; E111-T115 WeakPolarHBondContact O-CG2 3.25Å; E111-T115 PolarHBondContact O-N 3.35Å; E111-T115 PolarHBondContact O-OG1 2.7Å |
| 112 | S | 65 | Low | 72 | Confident | 63 Ų | 63 | 118.4 Ų | 118.4 | 44% | 0.441 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -70.4 | -25.3 | 175.3 | 83.9 | 0 | 0 | 0 | 0 | 113.8 | S108 A109 E110 T115 | S108-S112 PolarHBondContact O-N 3.17Å; A109-S112 PolarHBondContact O-N 2.84Å; A109-S112 PolarHBondContact O-OG 2.87Å; E110-S112 PolarHBondContact O-N 3.02Å; S112-T115 PolarHBondContact O-OG1 3.5Å |
| 113 | I | 64 | Low | 71.2 | Confident | 114 Ų | 114 | 111.3 Ų | 111.3 | 59% | 0.585 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -86 | -41.7 | 179.6 | -64.1 | 165.1 | 0 | 0 | 0 | 110.4 | A109 E110 E111 T115 R116 G117 | A109-I113 WeakPolarHBondContact O-CG1 3.28Å; A109-I113 PolarHBondContact O-N 3.17Å; E110-I113 PolarHBondContact O-N 3.47Å; E111-I113 VanDerWaalsContact C-N 3.31Å; E111-I113 PolarHBondContact O-N 3.48Å; I113-T115 VanDerWaalsContact C-N 3.31Å; I113-T115 PolarHBondContact O-N 3.39Å; I113-R116 CarbonylContact O-C 3.51Å; I113-R116 PolarHBondContact O-N 3Å; I113-G117 PolarHBondContact O-N 3.42Å |
| 114 | I | 61.9 | Low | 70.5 | Confident | 128 Ų | 128 | 109.5 Ų | 109.5 | 66% | 0.656 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -62.5 | -40.1 | -179.8 | -64 | 164.7 | 0 | 0 | 0 | 110.5 | E110 R116 G117 | E110-I114 VanDerWaalsContact O-CG1 3.3Å; E110-I114 WeakPolarHBondContact O-CG1 3.47Å; E110-I114 PolarHBondContact O-N 2.9Å; I114-R116 PolarHBondContact O-N 2.9Å; I114-G117 PolarHBondContact O-N 3.11Å |
| 115 | T | 61.4 | Low | 70.2 | Confident | 119 Ų | 119 | 109.4 Ų | 109.4 | 73% | 0.73 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.6 | -22.1 | 175.8 | 47.1 | 0 | 0 | 0 | 0 | 113.3 | E111 S112 I113 G117 | E111-T115 WeakPolarHBondContact O-CG2 3.25Å; E111-T115 PolarHBondContact O-N 3.35Å; E111-T115 PolarHBondContact O-OG1 2.7Å; S112-T115 PolarHBondContact O-OG1 3.5Å; I113-T115 VanDerWaalsContact C-N 3.31Å; I113-T115 PolarHBondContact O-N 3.39Å; T115-G117 VanDerWaalsContact C-N 3.35Å |
| 116 | R | 61.9 | Low | 70.2 | Confident | 209 Ų | 209 | 115.5 Ų | 115.5 | 79% | 0.789 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.8 | 12.4 | 173.7 | -65.2 | -177.7 | 179 | -173.6 | 1.4 | 113.3 | I113 I114 R118 | I113-R116 CarbonylContact O-C 3.51Å; I113-R116 PolarHBondContact O-N 3Å; I114-R116 PolarHBondContact O-N 2.9Å; R116-R118 PolarHBondContact O-N 2.87Å |
| 117 | G | 57.8 | Low | 70.4 | Confident | 57 Ų | 57 | 122 Ų | 122 | 59% | 0.588 | 64% | 0.635 | S | S | * | * | trans | -57.9 | 82.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | I113 I114 T115 T119 | I113-G117 PolarHBondContact O-N 3.42Å; I114-G117 PolarHBondContact O-N 3.11Å; T115-G117 VanDerWaalsContact C-N 3.35Å; G117-T119 PolarHBondContact O-N 2.98Å | ||
| 118 | R | 59.9 | Low | 70.9 | Confident | 230 Ų | 230 | 124.9 Ų | 124.9 | 87% | 0.868 | 65% | 0.653 | S | S | * | * | trans | -49.8 | 115.3 | 169.7 | -70.2 | -179 | 173.5 | -151 | -2.5 | 107 | R116 K120 | R116-R118 PolarHBondContact O-N 2.87Å; R118-K120 VanDerWaalsContact C-N 3.34Å; R118-K120 PolarHBondContact O-N 3.34Å | ||
| 119 | T | 61 | Low | 71.5 | Confident | 144 Ų | 144 | 126.1 Ų | 126.1 | 88% | 0.883 | 66% | 0.659 | S | S | * | * | trans | -47.4 | 99.4 | 173 | 6.8 | 0 | 0 | 0 | 0 | 107.8 | G117 S121 | G117-T119 PolarHBondContact O-N 2.98Å; T119-S121 PolarHBondContact O-N 3.07Å | ||
| 120 | K | 64.8 | Low | 72.3 | Confident | 196 Ų | 196 | 132.4 Ų | 132.4 | 85% | 0.852 | 68% | 0.677 | S | S | * | * | trans | -64.6 | 124.2 | 176.7 | -67.2 | -172.3 | -178.4 | 179.1 | 0 | 105.6 | R118 | R118-K120 VanDerWaalsContact C-N 3.34Å; R118-K120 PolarHBondContact O-N 3.34Å | ||
| 121 | S | 71.6 | Confident | 73.2 | Confident | 99 Ų | 99 | 133.2 Ų | 133.2 | 69% | 0.692 | 68% | 0.684 | S | S | * | * | trans | -44.4 | 139.6 | 174.4 | 172.5 | 0 | 0 | 0 | 0 | 109.4 | T119 S123 | T119-S121 PolarHBondContact O-N 3.07Å; S121-S123 PolarHBondContact O-N 3.4Å | ||
| 122 | P | 75 | Confident | 74.3 | Confident | 79 Ų | 79 | 131.6 Ų | 131.6 | 51% | 0.513 | 69% | 0.685 | S | S | . | * | S | Bend | trans | -69.7 | 41.2 | -172 | 31.1 | -38.2 | 0 | 0 | 0 | 113.9 | V124 I125 | P122-V124 PolarHBondContact O-N 3.33Å; P122-I125 HydrophobicContact CB-CD1 3.77Å; P122-I125 HydrophobicContact CB-CG1 4.17Å; P122-I125 WeakPolarHBondContact O-CB 3.5Å; P122-I125 WeakPolarHBondContact O-CG1 3.4Å; P122-I125 PolarHBondContact O-N 3.25Å |
| 123 | S | 75.9 | Confident | 75.6 | Confident | 46 Ų | 46 | 134.5 Ų | 134.5 | 32% | 0.322 | 70% | 0.7 | S | S | . | * | G | 310 helix | trans | -54.3 | -23.4 | 173.2 | 167.9 | 0 | 0 | 0 | 0 | 112.9 | S121 I125 Y126 R127 | S121-S123 PolarHBondContact O-N 3.4Å; S123-I125 PolarHBondContact O-N 3.44Å; S123-Y126 PolarHBondContact O-N 3.4Å; S123-Y126 VanDerWaalsContact O-N 3.13Å; S123-R127 WeakPolarHBondContact O-CG 3.33Å; S123-R127 PolarHBondContact O-N 2.85Å; S123-R127 PolarHBondContact OG-NE 3.22Å |
| 124 | V | 75.5 | Confident | 76.7 | Confident | 126 Ų | 126 | 138.6 Ų | 138.6 | 76% | 0.764 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -58.2 | -31.4 | 175 | 173.9 | 0 | 0 | 0 | 0 | 111.7 | P122 Y126 | P122-V124 PolarHBondContact O-N 3.33Å; V124-Y126 VanDerWaalsContact C-N 3.26Å; V124-Y126 PolarHBondContact O-N 3.28Å |
| 125 | I | 81.8 | Confident | 77.9 | Confident | 127 Ų | 127 | 136.5 Ų | 136.5 | 65% | 0.651 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -65.3 | -32.6 | 179.3 | -55.6 | 178.2 | 0 | 0 | 0 | 111.3 | P122 S123 | P122-I125 HydrophobicContact CB-CD1 3.77Å; P122-I125 HydrophobicContact CB-CG1 4.17Å; P122-I125 WeakPolarHBondContact O-CB 3.5Å; P122-I125 WeakPolarHBondContact O-CG1 3.4Å; P122-I125 PolarHBondContact O-N 3.25Å; S123-I125 PolarHBondContact O-N 3.44Å |
| 126 | Y | 85.4 | Confident | 79.3 | Confident | 196 Ų | 196 | 140.7 Ų | 140.7 | 77% | 0.769 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.8 | -4.8 | -175.4 | -53.4 | -70.5 | 0 | 0 | 0 | 113.6 | S123 V124 | S123-Y126 PolarHBondContact O-N 3.4Å; S123-Y126 VanDerWaalsContact O-N 3.13Å; V124-Y126 VanDerWaalsContact C-N 3.26Å; V124-Y126 PolarHBondContact O-N 3.28Å |
| 127 | R | 86.1 | Confident | 80.6 | Confident | 186 Ų | 186 | 140.3 Ų | 140.3 | 70% | 0.702 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -85.6 | 133.2 | 177.2 | -80.2 | -176.9 | -175.2 | -146.9 | -3.1 | 109.7 | S123 | S123-R127 WeakPolarHBondContact O-CG 3.33Å; S123-R127 PolarHBondContact O-N 2.85Å; S123-R127 PolarHBondContact OG-NE 3.22Å |
| 128 | T | 87.2 | Confident | 82 | Confident | 129 Ų | 129 | 142.4 Ų | 142.4 | 79% | 0.791 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 138.4 | 168.3 | 47.9 | 0 | 0 | 0 | 0 | 109.5 | ||
| 129 | P | 87.9 | Confident | 83.3 | Confident | 107 Ų | 107 | 137 Ų | 137 | 70% | 0.695 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 150.9 | 179.4 | 27.2 | -34.3 | 0 | 0 | 0 | 110.2 | I131 | P129-I131 PolarHBondContact O-N 3.38Š|
| 130 | F | 92.3 | Very high | 84.6 | Confident | 178 Ų | 178 | 137.9 Ų | 137.9 | 78% | 0.781 | 72% | 0.717 | S | S | * | * | P | Polyproline II helix | trans | -63.2 | 123.9 | 174.9 | 170.7 | -103.2 | 0 | 0 | 0 | 110.2 | P132 | F130-P132 HydrophobicContact CE1-CB 3.87Å; F130-P132 HydrophobicContact CZ-CB 4.34Å |
| 131 | I | 91.6 | Very high | 85.8 | Confident | 132 Ų | 132 | 134.5 Ų | 134.5 | 68% | 0.677 | 71% | 0.712 | S | S | * | * | trans | -102.8 | 111.9 | 175 | -57.3 | 174.7 | 0 | 0 | 0 | 107.1 | P129 T133 | P129-I131 PolarHBondContact O-N 3.38Å; I131-T133 PolarHBondContact O-N 2.97Å | ||
| 132 | P | 92.8 | Very high | 86.7 | Confident | 99 Ų | 99 | 134.2 Ų | 134.2 | 64% | 0.643 | 72% | 0.716 | S | S | * | * | trans | -65.7 | 126.7 | 178.4 | 26.3 | -32.4 | 0 | 0 | 0 | 109.9 | F130 | F130-P132 HydrophobicContact CE1-CB 3.87Å; F130-P132 HydrophobicContact CZ-CB 4.34Å | ||
| 133 | T | 92.1 | Very high | 87.6 | Confident | 123 Ų | 123 | 136.6 Ų | 136.6 | 76% | 0.755 | 73% | 0.728 | S | S | * | * | trans | -104.6 | 142.8 | 175.1 | 51.8 | 0 | 0 | 0 | 0 | 110.4 | I131 | I131-T133 PolarHBondContact O-N 2.97Š| ||
| 134 | F | 86.5 | Confident | 88.3 | Confident | 200 Ų | 200 | 139.3 Ų | 139.3 | 88% | 0.877 | 75% | 0.745 | S | S | * | * | trans | -70.2 | 140.8 | 172.4 | -69 | -73.3 | 0 | 0 | 0 | 109.8 | ||||
| 135 | P | 88 | Confident | 89.2 | Confident | 84 Ų | 84 | 138.2 Ų | 138.2 | 55% | 0.545 | 74% | 0.741 | S | S | . | * | trans | -73.3 | 133 | 179.3 | 32.9 | -35.6 | 0 | 0 | 0 | 109.7 | R137 | P135-R137 HydrophobicContact CB-CG 4.08Å; P135-R137 HydrophobicContact CG-CG 4.38Å; P135-R137 PolarHBondContact O-N 3.16Å | ||
| 136 | E | 89.3 | Confident | 89.8 | Confident | 207 Ų | 207 | 141.4 Ų | 141.4 | 97% | 0.967 | 75% | 0.75 | S | S | * | * | trans | -64.5 | -10.3 | -178.7 | -77.2 | -176.8 | 155.8 | 0 | 0 | 114.7 | ||||
| 137 | R | 89.2 | Confident | 90.3 | Very high | 202 Ų | 202 | 136.6 Ų | 136.6 | 76% | 0.762 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -67.2 | 137.1 | -177.5 | 61.5 | -172 | 170.2 | 169.1 | -2.3 | 111.8 | P135 | P135-R137 HydrophobicContact CB-CG 4.08Å; P135-R137 HydrophobicContact CG-CG 4.38Å; P135-R137 PolarHBondContact O-N 3.16Å |
| 138 | S | 87.7 | Confident | 90.9 | Very high | 101 Ų | 101 | 131.1 Ų | 131.1 | 71% | 0.706 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 150.2 | 175.4 | 51.3 | 0 | 0 | 0 | 0 | 111.7 | I140 | S138-I140 PolarHBondContact O-N 2.93Š|
| 139 | P | 86.8 | Confident | 91.4 | Very high | 116 Ų | 116 | 129.7 Ų | 129.7 | 75% | 0.753 | 72% | 0.722 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 136 | 176.8 | -20.4 | 31.2 | 0 | 0 | 0 | 111.1 | V141 | P139-V141 PolarHBondContact O-N 3.35Å; P139-V141 VanDerWaalsContact O-N 3.16Å |
| 140 | I | 88.3 | Confident | 91.8 | Very high | 163 Ų | 163 | 128.7 Ų | 128.7 | 84% | 0.836 | 71% | 0.714 | S | S | * | * | trans | -67.1 | 114.5 | 175.8 | -61.2 | 169.1 | 0 | 0 | 0 | 108.1 | S138 A142 | S138-I140 PolarHBondContact O-N 2.93Å; I140-A142 PolarHBondContact O-N 3.48Å | ||
| 141 | V | 91.2 | Very high | 92.1 | Very high | 125 Ų | 125 | 125.8 Ų | 125.8 | 76% | 0.758 | 70% | 0.703 | S | S | * | * | trans | -76.6 | 118.1 | 173.7 | -178.7 | 0 | 0 | 0 | 0 | 108.5 | P139 V143 | P139-V141 PolarHBondContact O-N 3.35Å; P139-V141 VanDerWaalsContact O-N 3.16Å; V141-V143 PolarHBondContact O-N 2.92Å; V141-V143 VanDerWaalsContact O-N 3.15Å | ||
| 142 | A | 90.3 | Very high | 92.4 | Very high | 93 Ų | 93 | 128.9 Ų | 128.9 | 77% | 0.769 | 71% | 0.706 | S | S | * | * | trans | -67.6 | 111.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | I140 | I140-A142 PolarHBondContact O-N 3.48Š| ||
| 143 | V | 92.7 | Very high | 92.6 | Very high | 128 Ų | 128 | 127 Ų | 127 | 78% | 0.776 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 120.4 | 171.1 | 179.5 | 0 | 0 | 0 | 0 | 108 | V141 | V141-V143 PolarHBondContact O-N 2.92Å; V141-V143 VanDerWaalsContact O-N 3.15Å |
| 144 | P | 91.1 | Very high | 92.9 | Very high | 103 Ų | 103 | 126.7 Ų | 126.7 | 67% | 0.669 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 141.6 | 178.2 | 26.3 | -33.1 | 0 | 0 | 0 | 110.4 | ||
| 145 | P | 94.5 | Very high | 93.5 | Very high | 104 Ų | 104 | 120.8 Ų | 120.8 | 68% | 0.675 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -66.8 | 147 | 179.3 | 28.5 | -34.6 | 0 | 0 | 0 | 110.6 | L147 | P145-L147 HydrophobicContact CG-CD2 4.17Å; P145-L147 PolarHBondContact O-N 3.4Å; P145-L147 VanDerWaalsContact O-N 3.17Å |
| 146 | K | 94.8 | Very high | 94 | Very high | 194 Ų | 194 | 124.1 Ų | 124.1 | 84% | 0.843 | 68% | 0.676 | S | S | * | * | trans | -68.4 | 113.2 | 171.2 | -67.1 | -177.2 | -179.9 | 179.5 | 0 | 109 | ||||
| 147 | L | 96.9 | Very high | 94.4 | Very high | 95 Ų | 95 | 117.1 Ų | 117.1 | 50% | 0.497 | 65% | 0.65 | S | S | . | * | trans | -90.9 | 124.4 | 179.3 | -58.3 | -179.2 | 0 | 0 | 0 | 110.2 | P145 T149 V150 | P145-L147 HydrophobicContact CG-CD2 4.17Å; P145-L147 PolarHBondContact O-N 3.4Å; P145-L147 VanDerWaalsContact O-N 3.17Å; L147-T149 WeakPolarHBondContact CB-OG1 3.33Å; L147-T149 PolarHBondContact O-N 3.45Å; L147-T149 VanDerWaalsContact O-N 3.07Å; L147-V150 HydrophobicContact CB-CG2 4.16Å; L147-V150 WeakPolarHBondContact O-CB 3.44Å; L147-V150 PolarHBondContact O-N 3.32Å | ||
| 148 | A | 97.3 | Very high | 94.9 | Very high | 70 Ų | 70 | 114 Ų | 114 | 58% | 0.579 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -58.5 | -22.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | E151 R152 | A148-E151 PolarHBondContact O-N 2.9Å; A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 PolarHBondContact O-N 2.98Å |
| 149 | T | 97.2 | Very high | 95.4 | Very high | 99 Ų | 99 | 116 Ų | 116 | 61% | 0.607 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64.5 | -38.9 | 174.6 | 49.6 | 0 | 0 | 0 | 0 | 112.2 | L147 R152 A153 | L147-T149 WeakPolarHBondContact CB-OG1 3.33Å; L147-T149 PolarHBondContact O-N 3.45Å; L147-T149 VanDerWaalsContact O-N 3.07Å; T149-R152 PolarHBondContact O-N 2.83Å; T149-A153 WeakPolarHBondContact O-CB 3.49Å; T149-A153 PolarHBondContact O-N 2.99Å |
| 150 | V | 97.5 | Very high | 95.9 | Very high | 86 Ų | 86 | 113.4 Ų | 113.4 | 52% | 0.521 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -66.2 | -45.5 | 177.1 | 177.4 | 0 | 0 | 0 | 0 | 109.9 | L147 R152 A153 M154 | L147-V150 HydrophobicContact CB-CG2 4.16Å; L147-V150 WeakPolarHBondContact O-CB 3.44Å; L147-V150 PolarHBondContact O-N 3.32Å; V150-R152 VanDerWaalsContact C-N 3.34Å; V150-R152 PolarHBondContact O-N 3.21Å; V150-A153 PolarHBondContact O-N 3.25Å; V150-M154 WeakPolarHBondContact O-CG 3.36Å; V150-M154 PolarHBondContact O-N 3.19Å |
| 151 | E | 97.5 | Very high | 96.4 | Very high | 118 Ų | 118 | 109 Ų | 109 | 55% | 0.551 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.5 | -41.2 | 177.9 | -63.4 | -178.5 | 167.4 | 0 | 0 | 112.1 | A148 M154 S155 | A148-E151 PolarHBondContact O-N 2.9Å; E151-M154 PolarHBondContact O-N 3.43Å; E151-S155 WeakPolarHBondContact O-CB 3.23Å; E151-S155 PolarHBondContact O-N 3.1Å; E151-S155 PolarHBondContact O-OG 3.41Å |
| 152 | R | 98.2 | Very high | 96.8 | Very high | 197 Ų | 197 | 107.2 Ų | 107.2 | 74% | 0.743 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -63.8 | -43.7 | 175 | -174.8 | -177 | -62.4 | -154.7 | -0.3 | 111.7 | A148 T149 V150 S155 R156 | A148-R152 WeakPolarHBondContact O-CB 3.36Å; A148-R152 PolarHBondContact O-N 2.98Å; T149-R152 PolarHBondContact O-N 2.83Å; V150-R152 VanDerWaalsContact C-N 3.34Å; V150-R152 PolarHBondContact O-N 3.21Å; R152-S155 PolarHBondContact O-N 2.85Å; R152-R156 WeakPolarHBondContact O-CB 3.5Å; R152-R156 PolarHBondContact O-N 3.33Å |
| 153 | A | 98.2 | Very high | 97.1 | Very high | 60 Ų | 60 | 103.8 Ų | 103.8 | 50% | 0.496 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -61.9 | -45.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | T149 V150 S155 R156 S157 | T149-A153 WeakPolarHBondContact O-CB 3.49Å; T149-A153 PolarHBondContact O-N 2.99Å; V150-A153 PolarHBondContact O-N 3.25Å; A153-S155 PolarHBondContact O-N 2.91Å; A153-R156 PolarHBondContact O-N 3.27Å; A153-S157 PolarHBondContact O-N 3.06Å |
| 154 | M | 98.3 | Very high | 97.4 | Very high | 116 Ų | 116 | 102.4 Ų | 102.4 | 57% | 0.571 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -61.9 | -43.3 | 175.9 | -68.5 | -63.1 | -67 | 0 | 0 | 112.1 | V150 E151 R156 S157 K158 | V150-M154 WeakPolarHBondContact O-CG 3.36Å; V150-M154 PolarHBondContact O-N 3.19Å; E151-M154 PolarHBondContact O-N 3.43Å; M154-R156 VanDerWaalsContact C-N 3.33Å; M154-R156 PolarHBondContact O-N 3.46Å; M154-S157 PolarHBondContact O-N 3.45Å; M154-K158 WeakPolarHBondContact O-CG 3.46Å; M154-K158 PolarHBondContact O-N 3.46Å; M154-K158 VanDerWaalsContact O-N 3.13Å |
| 155 | S | 98.3 | Very high | 97.7 | Very high | 76 Ų | 76 | 105.1 Ų | 105.1 | 53% | 0.531 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -63.1 | -41 | 176.6 | -59.3 | 0 | 0 | 0 | 0 | 111.8 | E151 R152 A153 K158 Y159 | E151-S155 WeakPolarHBondContact O-CB 3.23Å; E151-S155 PolarHBondContact O-N 3.1Å; E151-S155 PolarHBondContact O-OG 3.41Å; R152-S155 PolarHBondContact O-N 2.85Å; A153-S155 PolarHBondContact O-N 2.91Å; S155-K158 PolarHBondContact O-N 3.4Å; S155-Y159 PolarHBondContact O-N 3.33Å; S155-Y159 VanDerWaalsContact O-N 3.11Å |
| 156 | R | 98.2 | Very high | 97.9 | Very high | 154 Ų | 154 | 106.6 Ų | 106.6 | 58% | 0.581 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -65.4 | -44.6 | 177.2 | -178.4 | 55.4 | 179.8 | -95.1 | -1.1 | 111.8 | R152 A153 M154 K158 Y159 D160 | R152-R156 WeakPolarHBondContact O-CB 3.5Å; R152-R156 PolarHBondContact O-N 3.33Å; A153-R156 PolarHBondContact O-N 3.27Å; M154-R156 VanDerWaalsContact C-N 3.33Å; M154-R156 PolarHBondContact O-N 3.46Å; R156-K158 VanDerWaalsContact C-N 3.33Å; R156-K158 PolarHBondContact O-N 3Å; R156-Y159 WeakPolarHBondContact O-CB 3.47Å; R156-Y159 PolarHBondContact O-N 3.16Å; R156-Y159 VanDerWaalsContact O-N 3.15Å; R156-D160 IonicContact CZ-OD1 3.9Å; R156-D160 IonicContact NE-OD1 3.6Å; R156-D160 PolarHBondContact NE-OD1 3.24Å; R156-D160 IonicContact NE-OD2 3.19Å; R156-D160 PolarHBondContact NE-OD2 2.99Å; R156-D160 IonicContact NH2-OD1 3.94Å; R156-D160 VanDerWaalsContact O-CG 3.32Å; R156-D160 PolarHBondContact O-N 3.16Å |
| 157 | S | 98.6 | Very high | 98 | Very high | 60 Ų | 60 | 104.5 Ų | 104.5 | 42% | 0.42 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -55.9 | -47.4 | 175.8 | -170.8 | 0 | 0 | 0 | 0 | 111.5 | A153 M154 Y159 D160 D161 | A153-S157 PolarHBondContact O-N 3.06Å; M154-S157 PolarHBondContact O-N 3.45Å; S157-Y159 VanDerWaalsContact C-N 3.33Å; S157-Y159 PolarHBondContact O-N 2.87Å; S157-D160 PolarHBondContact O-N 3.36Å; S157-D161 VanDerWaalsContact O-CG 3.23Å; S157-D161 PolarHBondContact O-N 2.86Å |
| 158 | K | 98.7 | Very high | 98.1 | Very high | 136 Ų | 136 | 103.1 Ų | 103.1 | 59% | 0.591 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.7 | -42.6 | 177.1 | -70.7 | 177.8 | -178.5 | -177.5 | 0 | 112.4 | M154 S155 R156 D161 E162 | M154-K158 WeakPolarHBondContact O-CG 3.46Å; M154-K158 PolarHBondContact O-N 3.46Å; M154-K158 VanDerWaalsContact O-N 3.13Å; S155-K158 PolarHBondContact O-N 3.4Å; R156-K158 VanDerWaalsContact C-N 3.33Å; R156-K158 PolarHBondContact O-N 3Å; K158-D161 PolarHBondContact O-N 2.96Å; K158-E162 WeakPolarHBondContact O-CG 3.29Å; K158-E162 PolarHBondContact O-N 3.43Å |
| 159 | Y | 98.7 | Very high | 98.2 | Very high | 142 Ų | 142 | 104 Ų | 104 | 56% | 0.557 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.8 | -44.8 | 177.6 | 177.2 | -90.3 | 0 | 0 | 0 | 111.8 | S155 R156 S157 D161 E162 A163 | S155-Y159 PolarHBondContact O-N 3.33Å; S155-Y159 VanDerWaalsContact O-N 3.11Å; R156-Y159 WeakPolarHBondContact O-CB 3.47Å; R156-Y159 PolarHBondContact O-N 3.16Å; R156-Y159 VanDerWaalsContact O-N 3.15Å; S157-Y159 VanDerWaalsContact C-N 3.33Å; S157-Y159 PolarHBondContact O-N 2.87Å; Y159-D161 VanDerWaalsContact C-N 3.33Å; Y159-D161 PolarHBondContact O-N 2.97Å; Y159-E162 PolarHBondContact O-N 2.97Å; Y159-A163 HydrophobicContact CE1-CB 4.36Å; Y159-A163 WeakPolarHBondContact O-CB 3.35Å; Y159-A163 PolarHBondContact O-N 3.21Å |
| 160 | D | 98.4 | Very high | 98.1 | Very high | 62 Ų | 62 | 104.6 Ų | 104.6 | 33% | 0.332 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64 | -40.6 | -179.6 | -67.8 | -22.2 | 0 | 0 | 0 | 110.6 | R156 S157 A163 Q164 | R156-D160 IonicContact CZ-OD1 3.9Å; R156-D160 IonicContact NE-OD1 3.6Å; R156-D160 PolarHBondContact NE-OD1 3.24Å; R156-D160 IonicContact NE-OD2 3.19Å; R156-D160 PolarHBondContact NE-OD2 2.99Å; R156-D160 IonicContact NH2-OD1 3.94Å; R156-D160 VanDerWaalsContact O-CG 3.32Å; R156-D160 PolarHBondContact O-N 3.16Å; S157-D160 PolarHBondContact O-N 3.36Å; D160-A163 PolarHBondContact O-N 3.33Å; D160-Q164 WeakPolarHBondContact O-CB 3.42Å; D160-Q164 PolarHBondContact O-N 3.43Å |
| 161 | D | 98.6 | Very high | 98.1 | Very high | 70 Ų | 70 | 106 Ų | 106 | 37% | 0.374 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.7 | -47.2 | 173.4 | -68.1 | -21.9 | 0 | 0 | 0 | 111.9 | S157 K158 Y159 Q164 R165 | S157-D161 VanDerWaalsContact O-CG 3.23Å; S157-D161 PolarHBondContact O-N 2.86Å; K158-D161 PolarHBondContact O-N 2.96Å; Y159-D161 VanDerWaalsContact C-N 3.33Å; Y159-D161 PolarHBondContact O-N 2.97Å; D161-Q164 PolarHBondContact O-N 3.03Å; D161-R165 WeakPolarHBondContact O-CG 3.33Å; D161-R165 PolarHBondContact O-N 2.97Å |
| 162 | E | 98.6 | Very high | 98.1 | Very high | 89 Ų | 89 | 106.5 Ų | 106.5 | 42% | 0.416 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64 | -43 | 176.8 | -75.5 | -175.9 | -164.7 | 0 | 0 | 112.3 | K158 Y159 Q164 R165 R166 | K158-E162 WeakPolarHBondContact O-CG 3.29Å; K158-E162 PolarHBondContact O-N 3.43Å; Y159-E162 PolarHBondContact O-N 2.97Å; E162-Q164 VanDerWaalsContact C-N 3.26Å; E162-Q164 PolarHBondContact O-N 3.31Å; E162-R165 PolarHBondContact O-N 3.48Å; E162-R166 WeakPolarHBondContact O-CG 3.38Å; E162-R166 PolarHBondContact O-N 3.49Å; E162-R166 IonicContact OE2-CZ 2.99Å; E162-R166 IonicContact OE2-NH1 2.97Å; E162-R166 IonicContact OE2-NH2 3.67Å; E162-R166 PolarHBondContact OE2-NH2 3.26Å |
| 163 | A | 97.6 | Very high | 98.1 | Very high | 20 Ų | 20 | 102 Ų | 102 | 17% | 0.165 | 49% | 0.485 | C | S | . | . | H | α-helix | trans | -64.2 | -34.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y159 D160 R167 | Y159-A163 HydrophobicContact CE1-CB 4.36Å; Y159-A163 WeakPolarHBondContact O-CB 3.35Å; Y159-A163 PolarHBondContact O-N 3.21Å; D160-A163 PolarHBondContact O-N 3.33Å; A163-R167 WeakPolarHBondContact O-CG 3.48Å; A163-R167 PolarHBondContact O-N 3.4Å; A163-R167 VanDerWaalsContact O-N 3.16Å; A163-R167 PolarHBondContact O-NE 2.9Å; A163-R167 VanDerWaalsContact O-NE 3.1Å |
| 164 | Q | 98.1 | Very high | 97.9 | Very high | 100 Ų | 100 | 102.2 Ų | 102.2 | 47% | 0.467 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -66.6 | -50.7 | 172.9 | -175 | 168.8 | -12.5 | 0 | 0 | 111.2 | D160 D161 E162 R166 R167 D168 | D160-Q164 WeakPolarHBondContact O-CB 3.42Å; D160-Q164 PolarHBondContact O-N 3.43Å; D161-Q164 PolarHBondContact O-N 3.03Å; E162-Q164 VanDerWaalsContact C-N 3.26Å; E162-Q164 PolarHBondContact O-N 3.31Å; Q164-R166 VanDerWaalsContact C-N 3.28Å; Q164-R166 PolarHBondContact O-N 3.19Å; Q164-R167 WeakPolarHBondContact O-CA 3.33Å; Q164-R167 WeakPolarHBondContact O-CB 3.27Å; Q164-R167 PolarHBondContact O-N 3.43Å; Q164-D168 VanDerWaalsContact O-CG 3.26Å; Q164-D168 PolarHBondContact O-N 3.15Å |
| 165 | R | 98.6 | Very high | 97.9 | Very high | 159 Ų | 159 | 100 Ų | 100 | 60% | 0.6 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -55 | -42.7 | 176.5 | -68.9 | 172.3 | -164.9 | 168.1 | 6.4 | 112.5 | D161 E162 D168 I169 | D161-R165 WeakPolarHBondContact O-CG 3.33Å; D161-R165 PolarHBondContact O-N 2.97Å; E162-R165 PolarHBondContact O-N 3.48Å; R165-D168 PolarHBondContact O-N 3.28Å; R165-I169 WeakPolarHBondContact O-CD1 3.49Å; R165-I169 VanDerWaalsContact O-CG1 3.27Å; R165-I169 WeakPolarHBondContact O-CG1 3.38Å; R165-I169 PolarHBondContact O-N 3.11Å |
| 166 | R | 98 | Very high | 97.9 | Very high | 136 Ų | 136 | 102.1 Ų | 102.1 | 51% | 0.513 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 176.5 | -71.8 | 179.7 | -170 | 115.4 | 4.7 | 111.9 | E162 Q164 L170 | E162-R166 WeakPolarHBondContact O-CG 3.38Å; E162-R166 PolarHBondContact O-N 3.49Å; E162-R166 IonicContact OE2-CZ 2.99Å; E162-R166 IonicContact OE2-NH1 2.97Å; E162-R166 IonicContact OE2-NH2 3.67Å; E162-R166 PolarHBondContact OE2-NH2 3.26Å; Q164-R166 VanDerWaalsContact C-N 3.28Å; Q164-R166 PolarHBondContact O-N 3.19Å; R166-L170 WeakPolarHBondContact O-CG 3.43Å; R166-L170 PolarHBondContact O-N 3.06Å; R166-L170 VanDerWaalsContact O-N 3.16Å |
| 167 | R | 97.5 | Very high | 97.9 | Very high | 149 Ų | 149 | 99 Ų | 99 | 56% | 0.562 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -63 | -45.2 | 176.2 | -77.9 | 178.3 | -78.2 | 147 | -7.5 | 111.5 | A163 Q164 I169 L170 Q171 | A163-R167 WeakPolarHBondContact O-CG 3.48Å; A163-R167 PolarHBondContact O-N 3.4Å; A163-R167 VanDerWaalsContact O-N 3.16Å; A163-R167 PolarHBondContact O-NE 2.9Å; A163-R167 VanDerWaalsContact O-NE 3.1Å; Q164-R167 WeakPolarHBondContact O-CA 3.33Å; Q164-R167 WeakPolarHBondContact O-CB 3.27Å; Q164-R167 PolarHBondContact O-N 3.43Å; R167-I169 PolarHBondContact O-N 2.9Å; R167-L170 PolarHBondContact O-N 3.4Å; R167-Q171 WeakPolarHBondContact O-CB 3.47Å; R167-Q171 PolarHBondContact O-N 3.42Å |
| 168 | D | 98.3 | Very high | 97.8 | Very high | 67 Ų | 67 | 102.6 Ų | 102.6 | 36% | 0.358 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -62.5 | -43.2 | -179.3 | -61.7 | -18.6 | 0 | 0 | 0 | 111.5 | Q164 R165 Q171 Q172 | Q164-D168 VanDerWaalsContact O-CG 3.26Å; Q164-D168 PolarHBondContact O-N 3.15Å; R165-D168 PolarHBondContact O-N 3.28Å; D168-Q171 PolarHBondContact O-N 2.68Å; D168-Q172 VanDerWaalsContact O-CG 3.29Å; D168-Q172 WeakPolarHBondContact O-CG 3.37Å; D168-Q172 PolarHBondContact O-N 3.25Å |
| 169 | I | 98.4 | Very high | 97.7 | Very high | 89 Ų | 89 | 100.7 Ų | 100.7 | 46% | 0.456 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -60.8 | -47.4 | 176 | -68.6 | 164.6 | 0 | 0 | 0 | 111.1 | R165 R167 Q171 Q172 Q173 | R165-I169 WeakPolarHBondContact O-CD1 3.49Å; R165-I169 VanDerWaalsContact O-CG1 3.27Å; R165-I169 WeakPolarHBondContact O-CG1 3.38Å; R165-I169 PolarHBondContact O-N 3.11Å; R167-I169 PolarHBondContact O-N 2.9Å; I169-Q171 VanDerWaalsContact C-N 3.31Å; I169-Q171 PolarHBondContact O-N 3.39Å; I169-Q172 PolarHBondContact O-N 2.93Å; I169-Q173 WeakPolarHBondContact O-CG 3.33Å; I169-Q173 PolarHBondContact O-N 2.87Å |
| 170 | L | 96.4 | Very high | 97.7 | Very high | 110 Ų | 110 | 100.3 Ų | 100.3 | 58% | 0.576 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.6 | -40.8 | 178.9 | -72.9 | 172.7 | 0 | 0 | 0 | 111.5 | R166 R167 Q173 S174 | R166-L170 WeakPolarHBondContact O-CG 3.43Å; R166-L170 PolarHBondContact O-N 3.06Å; R166-L170 VanDerWaalsContact O-N 3.16Å; R167-L170 PolarHBondContact O-N 3.4Å; L170-Q173 PolarHBondContact O-N 2.98Å; L170-S174 WeakPolarHBondContact O-CB 3.48Å; L170-S174 PolarHBondContact O-N 3.34Å; L170-S174 PolarHBondContact O-OG 2.97Å |
| 171 | Q | 97.3 | Very high | 97.6 | Very high | 117 Ų | 117 | 105 Ų | 105 | 55% | 0.547 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.1 | -48.5 | 176.3 | -174.7 | 176 | -7.9 | 0 | 0 | 111.1 | R167 D168 I169 Q173 S174 E175 | R167-Q171 WeakPolarHBondContact O-CB 3.47Å; R167-Q171 PolarHBondContact O-N 3.42Å; D168-Q171 PolarHBondContact O-N 2.68Å; I169-Q171 VanDerWaalsContact C-N 3.31Å; I169-Q171 PolarHBondContact O-N 3.39Å; Q171-Q173 VanDerWaalsContact C-N 3.34Å; Q171-Q173 PolarHBondContact O-N 2.76Å; Q171-S174 PolarHBondContact O-N 3.43Å; Q171-S174 VanDerWaalsContact O-N 3.16Å; Q171-S174 PolarHBondContact O-OG 3.5Å; Q171-E175 PolarHBondContact O-N 3.26Å |
| 172 | Q | 98.1 | Very high | 97.6 | Very high | 127 Ų | 127 | 106.8 Ų | 106.8 | 59% | 0.593 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -58 | -44.6 | 176.6 | -72.4 | 173.9 | 0.8 | 0 | 0 | 112.1 | D168 I169 S174 E175 L176 | D168-Q172 VanDerWaalsContact O-CG 3.29Å; D168-Q172 WeakPolarHBondContact O-CG 3.37Å; D168-Q172 PolarHBondContact O-N 3.25Å; I169-Q172 PolarHBondContact O-N 2.93Å; Q172-S174 VanDerWaalsContact C-N 3.35Å; Q172-S174 PolarHBondContact O-N 3.46Å; Q172-E175 PolarHBondContact O-N 3.45Å; Q172-L176 WeakPolarHBondContact O-CG 3.43Å; Q172-L176 PolarHBondContact O-N 3.47Å |
| 173 | Q | 97 | Very high | 97.5 | Very high | 103 Ų | 103 | 108.3 Ų | 108.3 | 48% | 0.481 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62 | -42.9 | 176.3 | -72 | 175.9 | -3.2 | 0 | 0 | 111.9 | I169 L170 Q171 E175 L176 I177 | I169-Q173 WeakPolarHBondContact O-CG 3.33Å; I169-Q173 PolarHBondContact O-N 2.87Å; L170-Q173 PolarHBondContact O-N 2.98Å; Q171-Q173 VanDerWaalsContact C-N 3.34Å; Q171-Q173 PolarHBondContact O-N 2.76Å; Q173-E175 VanDerWaalsContact C-N 3.34Å; Q173-E175 PolarHBondContact O-N 3.47Å; Q173-L176 PolarHBondContact O-N 2.98Å; Q173-I177 VanDerWaalsContact O-CG1 3.28Å; Q173-I177 WeakPolarHBondContact O-CG1 3.38Å; Q173-I177 PolarHBondContact O-N 3.44Å |
| 174 | S | 95 | Very high | 97.6 | Very high | 64 Ų | 64 | 110.7 Ų | 110.7 | 45% | 0.448 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 178.4 | 75.3 | 0 | 0 | 0 | 0 | 112.2 | L170 Q171 Q172 I177 R178 | L170-S174 WeakPolarHBondContact O-CB 3.48Å; L170-S174 PolarHBondContact O-N 3.34Å; L170-S174 PolarHBondContact O-OG 2.97Å; Q171-S174 PolarHBondContact O-N 3.43Å; Q171-S174 VanDerWaalsContact O-N 3.16Å; Q171-S174 PolarHBondContact O-OG 3.5Å; Q172-S174 VanDerWaalsContact C-N 3.35Å; Q172-S174 PolarHBondContact O-N 3.46Å; S174-I177 PolarHBondContact O-N 3.07Å; S174-R178 WeakPolarHBondContact O-CB 3.37Å; S174-R178 PolarHBondContact O-N 3Å |
| 175 | E | 97.7 | Very high | 97.5 | Very high | 70 Ų | 70 | 111.2 Ų | 111.2 | 33% | 0.327 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -66.7 | -43.3 | 176.1 | -75 | -63.5 | 163.3 | 0 | 0 | 111.8 | Q171 Q172 Q173 I177 R178 L179 | Q171-E175 PolarHBondContact O-N 3.26Å; Q172-E175 PolarHBondContact O-N 3.45Å; Q173-E175 VanDerWaalsContact C-N 3.34Å; Q173-E175 PolarHBondContact O-N 3.47Å; E175-I177 VanDerWaalsContact C-N 3.32Å; E175-I177 PolarHBondContact O-N 2.97Å; E175-R178 WeakPolarHBondContact O-CB 3.43Å; E175-R178 PolarHBondContact O-N 3.13Å; E175-R178 VanDerWaalsContact O-N 3.17Å; E175-R178 IonicContact OE1-NE 3.83Å; E175-R178 IonicContact OE1-NH2 3.72Å; E175-R178 IonicContact OE2-CZ 3.21Å; E175-R178 IonicContact OE2-NE 2.84Å; E175-R178 PolarHBondContact OE2-NE 3.47Å; E175-R178 IonicContact OE2-NH2 2.73Å; E175-R178 PolarHBondContact OE2-NH2 3.05Å; E175-L179 WeakPolarHBondContact O-CG 3.38Å; E175-L179 PolarHBondContact O-N 3.28Å |
| 176 | L | 98.2 | Very high | 97.5 | Very high | 120 Ų | 120 | 106 Ų | 106 | 63% | 0.628 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59.4 | -43.2 | 174.6 | -72.5 | 173.3 | 0 | 0 | 0 | 111.9 | Q172 Q173 K180 | Q172-L176 WeakPolarHBondContact O-CG 3.43Å; Q172-L176 PolarHBondContact O-N 3.47Å; Q173-L176 PolarHBondContact O-N 2.98Å; L176-K180 WeakPolarHBondContact O-CB 3.48Å; L176-K180 PolarHBondContact O-N 3.15Å |
| 177 | I | 97.4 | Very high | 97.5 | Very high | 90 Ų | 90 | 102.9 Ų | 102.9 | 46% | 0.462 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -41.7 | 176.2 | -68.4 | 164.8 | 0 | 0 | 0 | 110.7 | Q173 S174 E175 K180 R181 | Q173-I177 VanDerWaalsContact O-CG1 3.28Å; Q173-I177 WeakPolarHBondContact O-CG1 3.38Å; Q173-I177 PolarHBondContact O-N 3.44Å; S174-I177 PolarHBondContact O-N 3.07Å; E175-I177 VanDerWaalsContact C-N 3.32Å; E175-I177 PolarHBondContact O-N 2.97Å; I177-K180 PolarHBondContact O-N 3.42Å; I177-R181 WeakPolarHBondContact O-CG 3.33Å; I177-R181 PolarHBondContact O-N 3.47Å |
| 178 | R | 96.8 | Very high | 97.5 | Very high | 134 Ų | 134 | 101.8 Ų | 101.8 | 51% | 0.506 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.4 | -49 | 177.8 | -173.3 | 177.6 | 73.9 | 117.2 | -3.4 | 111.4 | S174 E175 K180 R181 M182 | S174-R178 WeakPolarHBondContact O-CB 3.37Å; S174-R178 PolarHBondContact O-N 3Å; E175-R178 WeakPolarHBondContact O-CB 3.43Å; E175-R178 PolarHBondContact O-N 3.13Å; E175-R178 VanDerWaalsContact O-N 3.17Å; E175-R178 IonicContact OE1-NE 3.83Å; E175-R178 IonicContact OE1-NH2 3.72Å; E175-R178 IonicContact OE2-CZ 3.21Å; E175-R178 IonicContact OE2-NE 2.84Å; E175-R178 PolarHBondContact OE2-NE 3.47Å; E175-R178 IonicContact OE2-NH2 2.73Å; E175-R178 PolarHBondContact OE2-NH2 3.05Å; R178-K180 PolarHBondContact O-N 2.83Å; R178-R181 PolarHBondContact O-N 3.17Å; R178-M182 WeakPolarHBondContact O-CG 3.46Å; R178-M182 PolarHBondContact O-N 2.93Å |
| 179 | L | 98 | Very high | 97.5 | Very high | 97 Ų | 97 | 102.6 Ų | 102.6 | 51% | 0.508 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -44.8 | 178.1 | -70.7 | 175 | 0 | 0 | 0 | 111.8 | E175 R181 M182 E183 | E175-L179 WeakPolarHBondContact O-CG 3.38Å; E175-L179 PolarHBondContact O-N 3.28Å; L179-R181 PolarHBondContact O-N 3.29Å; L179-M182 PolarHBondContact O-N 3.02Å; L179-E183 PolarHBondContact O-N 2.98Å |
| 180 | K | 97.8 | Very high | 97.4 | Very high | 133 Ų | 133 | 106.8 Ų | 106.8 | 58% | 0.578 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -60.1 | -43.7 | 176.3 | -174.5 | 177.4 | -178.9 | 177 | 0 | 112.3 | L176 I177 R178 M182 E183 D184 | L176-K180 WeakPolarHBondContact O-CB 3.48Å; L176-K180 PolarHBondContact O-N 3.15Å; I177-K180 PolarHBondContact O-N 3.42Å; R178-K180 PolarHBondContact O-N 2.83Å; K180-M182 PolarHBondContact O-N 3.38Å; K180-E183 PolarHBondContact O-N 3.42Å; K180-D184 VanDerWaalsContact O-CG 3.31Å; K180-D184 PolarHBondContact O-N 3.34Å |
| 181 | R | 97 | Very high | 97.5 | Very high | 161 Ų | 161 | 106.9 Ų | 106.9 | 61% | 0.608 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.7 | -44.3 | 176.1 | -74.7 | 176.3 | -178 | 179.5 | 1.9 | 111.8 | I177 R178 L179 E183 D184 E185 | I177-R181 WeakPolarHBondContact O-CG 3.33Å; I177-R181 PolarHBondContact O-N 3.47Å; R178-R181 PolarHBondContact O-N 3.17Å; L179-R181 PolarHBondContact O-N 3.29Å; R181-E183 VanDerWaalsContact C-N 3.32Å; R181-E183 PolarHBondContact O-N 2.97Å; R181-D184 PolarHBondContact O-N 3.23Å; R181-E185 WeakPolarHBondContact O-CB 3.33Å; R181-E185 VanDerWaalsContact O-CG 3.29Å; R181-E185 WeakPolarHBondContact O-CG 3.32Å; R181-E185 PolarHBondContact O-N 3.04Å |
| 182 | M | 97.1 | Very high | 97.5 | Very high | 107 Ų | 107 | 106 Ų | 106 | 53% | 0.527 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 176.7 | -70.8 | -175.6 | 70 | 0 | 0 | 112 | R178 L179 K180 E185 A186 | R178-M182 WeakPolarHBondContact O-CG 3.46Å; R178-M182 PolarHBondContact O-N 2.93Å; L179-M182 PolarHBondContact O-N 3.02Å; K180-M182 PolarHBondContact O-N 3.38Å; M182-E185 PolarHBondContact O-N 3.26Å; M182-A186 WeakPolarHBondContact O-CB 3.45Å; M182-A186 PolarHBondContact O-N 3.07Å |
| 183 | E | 98.1 | Very high | 97.4 | Very high | 121 Ų | 121 | 108.5 Ų | 108.5 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.9 | -46 | 175.6 | -175.1 | 176.8 | -166.9 | 0 | 0 | 111.8 | L179 K180 R181 E185 A186 N187 | L179-E183 PolarHBondContact O-N 2.98Å; K180-E183 PolarHBondContact O-N 3.42Å; R181-E183 VanDerWaalsContact C-N 3.32Å; R181-E183 PolarHBondContact O-N 2.97Å; E183-E185 VanDerWaalsContact C-N 3.32Å; E183-E185 PolarHBondContact O-N 2.98Å; E183-A186 PolarHBondContact O-N 3.03Å; E183-N187 WeakPolarHBondContact O-CB 3.46Å; E183-N187 VanDerWaalsContact O-CG 3.29Å; E183-N187 PolarHBondContact O-N 3.01Å; E183-N187 PolarHBondContact O-ND2 3.16Å |
| 184 | D | 97.9 | Very high | 97.3 | Very high | 70 Ų | 70 | 111.8 Ų | 111.8 | 37% | 0.374 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.9 | -42.2 | 176.5 | -72.2 | -26.9 | 0 | 0 | 0 | 111.5 | K180 R181 N187 K188 | K180-D184 VanDerWaalsContact O-CG 3.31Å; K180-D184 PolarHBondContact O-N 3.34Å; R181-D184 PolarHBondContact O-N 3.23Å; D184-N187 PolarHBondContact O-N 3.42Å; D184-K188 VanDerWaalsContact O-CG 3.26Å; D184-K188 WeakPolarHBondContact O-CG 3.41Å; D184-K188 PolarHBondContact O-N 3.35Å |
| 185 | E | 97.6 | Very high | 97.3 | Very high | 111 Ų | 111 | 115 Ų | 115 | 52% | 0.519 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 174.8 | -74.4 | 171 | -165.6 | 0 | 0 | 112 | R181 M182 E183 N187 K188 I189 | R181-E185 WeakPolarHBondContact O-CB 3.33Å; R181-E185 VanDerWaalsContact O-CG 3.29Å; R181-E185 WeakPolarHBondContact O-CG 3.32Å; R181-E185 PolarHBondContact O-N 3.04Å; M182-E185 PolarHBondContact O-N 3.26Å; E183-E185 VanDerWaalsContact C-N 3.32Å; E183-E185 PolarHBondContact O-N 2.98Å; E185-N187 VanDerWaalsContact C-N 3.31Å; E185-N187 PolarHBondContact O-N 3.09Å; E185-K188 PolarHBondContact O-N 3.42Å; E185-I189 WeakPolarHBondContact O-CG1 3.4Å; E185-I189 PolarHBondContact O-N 3.29Å |
| 186 | A | 97.9 | Very high | 97.1 | Very high | 49 Ų | 49 | 114.9 Ų | 114.9 | 41% | 0.405 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.8 | -39 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | M182 E183 I189 R190 | M182-A186 WeakPolarHBondContact O-CB 3.45Å; M182-A186 PolarHBondContact O-N 3.07Å; E183-A186 PolarHBondContact O-N 3.03Å; A186-I189 PolarHBondContact O-N 3.45Å; A186-R190 WeakPolarHBondContact O-CB 3.42Å; A186-R190 PolarHBondContact O-N 3.01Å |
| 187 | N | 98.1 | Very high | 96.9 | Very high | 71 Ų | 71 | 113.8 Ų | 113.8 | 38% | 0.38 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.4 | -42.6 | 176 | -74.6 | -27.5 | 0 | 0 | 0 | 111.9 | E183 D184 E185 R190 Q191 | E183-N187 WeakPolarHBondContact O-CB 3.46Å; E183-N187 VanDerWaalsContact O-CG 3.29Å; E183-N187 PolarHBondContact O-N 3.01Å; E183-N187 PolarHBondContact O-ND2 3.16Å; D184-N187 PolarHBondContact O-N 3.42Å; E185-N187 VanDerWaalsContact C-N 3.31Å; E185-N187 PolarHBondContact O-N 3.09Å; N187-R190 WeakPolarHBondContact O-CB 3.46Å; N187-R190 PolarHBondContact O-N 3.01Å; N187-Q191 PolarHBondContact O-N 3.11Å |
| 188 | K | 98 | Very high | 96.6 | Very high | 126 Ų | 126 | 118 Ų | 118 | 55% | 0.548 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -59.9 | -45.9 | 173.1 | -72.5 | 166.8 | -173.1 | 170.8 | 0 | 111.6 | D184 E185 R190 Q191 I192 | D184-K188 VanDerWaalsContact O-CG 3.26Å; D184-K188 WeakPolarHBondContact O-CG 3.41Å; D184-K188 PolarHBondContact O-N 3.35Å; E185-K188 PolarHBondContact O-N 3.42Å; K188-R190 VanDerWaalsContact C-N 3.29Å; K188-R190 PolarHBondContact O-N 3.22Å; K188-Q191 PolarHBondContact O-N 3.5Å; K188-I192 VanDerWaalsContact O-CG1 3.31Å; K188-I192 WeakPolarHBondContact O-CG1 3.47Å; K188-I192 PolarHBondContact O-N 2.74Å |
| 189 | I | 97.3 | Very high | 96.2 | Very high | 85 Ų | 85 | 120.6 Ų | 120.6 | 44% | 0.436 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -60.8 | -41.4 | 176.4 | -68.3 | 166.6 | 0 | 0 | 0 | 110.6 | E185 A186 Q191 I192 R193 | E185-I189 WeakPolarHBondContact O-CG1 3.4Å; E185-I189 PolarHBondContact O-N 3.29Å; A186-I189 PolarHBondContact O-N 3.45Å; I189-Q191 VanDerWaalsContact C-N 3.34Å; I189-Q191 PolarHBondContact O-N 3.05Å; I189-I192 PolarHBondContact O-N 3.47Å; I189-R193 HydrophobicContact CG2-CG 4.41Å; I189-R193 WeakPolarHBondContact O-CB 3.49Å; I189-R193 VanDerWaalsContact O-CG 3.27Å; I189-R193 WeakPolarHBondContact O-CG 3.35Å; I189-R193 PolarHBondContact O-N 3.12Å |
| 190 | R | 97.4 | Very high | 95.9 | Very high | 176 Ų | 176 | 121.9 Ų | 121.9 | 66% | 0.664 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -62.1 | -41.8 | 176.5 | -167.9 | -174.5 | -57.3 | -159.6 | 3.2 | 111.8 | A186 N187 K188 R193 K194 | A186-R190 WeakPolarHBondContact O-CB 3.42Å; A186-R190 PolarHBondContact O-N 3.01Å; N187-R190 WeakPolarHBondContact O-CB 3.46Å; N187-R190 PolarHBondContact O-N 3.01Å; K188-R190 VanDerWaalsContact C-N 3.29Å; K188-R190 PolarHBondContact O-N 3.22Å; R190-R193 PolarHBondContact O-N 3.31Å; R190-K194 PolarHBondContact O-N 3.11Å |
| 191 | Q | 97.1 | Very high | 95.6 | Very high | 113 Ų | 113 | 123.4 Ų | 123.4 | 53% | 0.528 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -64.6 | -49.4 | 176.1 | -179.3 | 173.6 | -3.4 | 0 | 0 | 111.6 | N187 K188 I189 R193 K194 E195 | N187-Q191 PolarHBondContact O-N 3.11Å; K188-Q191 PolarHBondContact O-N 3.5Å; I189-Q191 VanDerWaalsContact C-N 3.34Å; I189-Q191 PolarHBondContact O-N 3.05Å; Q191-R193 VanDerWaalsContact C-N 3.27Å; Q191-R193 PolarHBondContact O-N 2.9Å; Q191-K194 WeakPolarHBondContact O-CA 3.35Å; Q191-K194 WeakPolarHBondContact O-CB 3.39Å; Q191-K194 PolarHBondContact O-N 3.29Å; Q191-E195 HydrophobicContact CG-CG 4.49Å; Q191-E195 VanDerWaalsContact CG-OE1 3.26Å; Q191-E195 WeakPolarHBondContact CG-OE1 3.39Å; Q191-E195 PolarHBondContact NE2-OE1 3.43Å; Q191-E195 WeakPolarHBondContact O-CG 3.46Å; Q191-E195 PolarHBondContact O-N 3.06Å |
| 192 | I | 97.3 | Very high | 95.5 | Very high | 99 Ų | 99 | 121.4 Ų | 121.4 | 51% | 0.508 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -57.1 | -43.7 | 176.8 | -68.1 | 165.9 | 0 | 0 | 0 | 110.6 | K188 I189 K194 E195 S196 | K188-I192 VanDerWaalsContact O-CG1 3.31Å; K188-I192 WeakPolarHBondContact O-CG1 3.47Å; K188-I192 PolarHBondContact O-N 2.74Å; I189-I192 PolarHBondContact O-N 3.47Å; I192-K194 PolarHBondContact O-N 3.38Å; I192-E195 PolarHBondContact O-N 2.94Å; I192-S196 VanDerWaalsContact O-CB 3.31Å; I192-S196 WeakPolarHBondContact O-CB 3.46Å; I192-S196 PolarHBondContact O-N 3.47Å; I192-S196 PolarHBondContact O-OG 2.86Å |
| 193 | R | 96.3 | Very high | 95.3 | Very high | 178 Ų | 178 | 123.9 Ų | 123.9 | 67% | 0.672 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -58.8 | -46.9 | 175.5 | -77.5 | 176.1 | -179.7 | 169.5 | 1.8 | 111.2 | I189 R190 Q191 E195 S196 V197 | I189-R193 HydrophobicContact CG2-CG 4.41Å; I189-R193 WeakPolarHBondContact O-CB 3.49Å; I189-R193 VanDerWaalsContact O-CG 3.27Å; I189-R193 WeakPolarHBondContact O-CG 3.35Å; I189-R193 PolarHBondContact O-N 3.12Å; R190-R193 PolarHBondContact O-N 3.31Å; Q191-R193 VanDerWaalsContact C-N 3.27Å; Q191-R193 PolarHBondContact O-N 2.9Å; R193-E195 VanDerWaalsContact C-N 3.34Å; R193-E195 PolarHBondContact O-N 3.3Å; R193-S196 PolarHBondContact O-N 3.49Å; R193-V197 WeakPolarHBondContact O-CG2 3.3Å; R193-V197 PolarHBondContact O-N 3.33Å; R193-V197 VanDerWaalsContact O-N 3.1Å |
| 194 | K | 95.5 | Very high | 95.1 | Very high | 172 Ų | 172 | 126.5 Ų | 126.5 | 75% | 0.748 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -60.6 | -41.5 | 178.4 | -175.2 | -178.3 | 178.4 | -177.1 | 0 | 112.3 | R190 Q191 I192 V197 | R190-K194 PolarHBondContact O-N 3.11Å; Q191-K194 WeakPolarHBondContact O-CA 3.35Å; Q191-K194 WeakPolarHBondContact O-CB 3.39Å; Q191-K194 PolarHBondContact O-N 3.29Å; I192-K194 PolarHBondContact O-N 3.38Å; K194-V197 PolarHBondContact O-N 2.66Å |
| 195 | E | 94.2 | Very high | 94.9 | Very high | 132 Ų | 132 | 135 Ų | 135 | 62% | 0.617 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -70.8 | -34.4 | 178.4 | -69.9 | 170.6 | -172.6 | 0 | 0 | 112.1 | Q191 I192 R193 V197 | Q191-E195 HydrophobicContact CG-CG 4.49Å; Q191-E195 VanDerWaalsContact CG-OE1 3.26Å; Q191-E195 WeakPolarHBondContact CG-OE1 3.39Å; Q191-E195 PolarHBondContact NE2-OE1 3.43Å; Q191-E195 WeakPolarHBondContact O-CG 3.46Å; Q191-E195 PolarHBondContact O-N 3.06Å; I192-E195 PolarHBondContact O-N 2.94Å; R193-E195 VanDerWaalsContact C-N 3.34Å; R193-E195 PolarHBondContact O-N 3.3Å; E195-V197 VanDerWaalsContact C-N 3.31Å; E195-V197 PolarHBondContact O-N 3.32Å |
| 196 | S | 93.9 | Very high | 94.7 | Very high | 68 Ų | 68 | 137.9 Ų | 137.9 | 48% | 0.476 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -77.5 | -13.3 | 177.8 | -55 | 0 | 0 | 0 | 0 | 113.5 | I192 R193 H198 | I192-S196 VanDerWaalsContact O-CB 3.31Å; I192-S196 WeakPolarHBondContact O-CB 3.46Å; I192-S196 PolarHBondContact O-N 3.47Å; I192-S196 PolarHBondContact O-OG 2.86Å; R193-S196 PolarHBondContact O-N 3.49Å; S196-H198 PolarHBondContact O-CE1 3.33Å; S196-H198 PolarHBondContact O-N 3.27Å; S196-H198 PolarHBondContact O-ND1 3.33Å; S196-H198 VanDerWaalsContact O-ND1 3.16Å |
| 197 | V | 94.1 | Very high | 94.3 | Very high | 97 Ų | 97 | 145 Ų | 145 | 59% | 0.588 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -70.1 | 100.8 | 174.5 | -177.5 | 0 | 0 | 0 | 0 | 109 | R193 K194 E195 K199 | R193-V197 WeakPolarHBondContact O-CG2 3.3Å; R193-V197 PolarHBondContact O-N 3.33Å; R193-V197 VanDerWaalsContact O-N 3.1Å; K194-V197 PolarHBondContact O-N 2.66Å; E195-V197 VanDerWaalsContact C-N 3.31Å; E195-V197 PolarHBondContact O-N 3.32Å; V197-K199 PolarHBondContact O-N 2.99Å |
| 198 | H | 90.7 | Very high | 93.8 | Very high | 178 Ų | 178 | 148.4 Ų | 148.4 | 82% | 0.824 | 70% | 0.696 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 124.3 | 172.7 | -51.2 | 83.8 | 0 | 0 | 0 | 110.2 | S196 | S196-H198 PolarHBondContact O-CE1 3.33Å; S196-H198 PolarHBondContact O-N 3.27Å; S196-H198 PolarHBondContact O-ND1 3.33Å; S196-H198 VanDerWaalsContact O-ND1 3.16Å |
| 199 | K | 89 | Confident | 93.3 | Very high | 188 Ų | 188 | 150.2 Ų | 150.2 | 82% | 0.817 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -87.7 | 134.3 | 170.4 | -63.3 | -177.8 | -177.3 | 178.2 | 0 | 108.1 | V197 E201 | V197-K199 PolarHBondContact O-N 2.99Å; K199-E201 PolarHBondContact O-N 3.45Å |
| 200 | P | 91.8 | Very high | 92.6 | Very high | 125 Ų | 125 | 155.9 Ų | 155.9 | 81% | 0.812 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 133.8 | 176.4 | 26.1 | -33.4 | 0 | 0 | 0 | 109 | ||
| 201 | E | 90.7 | Very high | 91.9 | Very high | 165 Ų | 165 | 152.5 Ų | 152.5 | 77% | 0.771 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 142.6 | 171.4 | -67.4 | -173.9 | 173.8 | 0 | 0 | 109.3 | K199 I203 | K199-E201 PolarHBondContact O-N 3.45Å; E201-I203 PolarHBondContact O-N 2.89Å |
| 202 | P | 95.4 | Very high | 91 | Very high | 118 Ų | 118 | 152.7 Ų | 152.7 | 77% | 0.766 | 75% | 0.746 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 138.7 | 174.5 | 25.6 | -33.4 | 0 | 0 | 0 | 109.5 | R204 | P202-R204 PolarHBondContact O-N 2.96Š|
| 203 | I | 92.8 | Very high | 90.1 | Very high | 160 Ų | 160 | 153.7 Ų | 153.7 | 82% | 0.821 | 76% | 0.756 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 118.1 | 179.9 | -58.5 | 173.7 | 0 | 0 | 0 | 108.7 | E201 R205 | E201-I203 PolarHBondContact O-N 2.89Å; I203-R205 PolarHBondContact O-N 3.27Å; I203-R205 VanDerWaalsContact O-N 3.14Å |
| 204 | R | 94 | Very high | 89.2 | Confident | 175 Ų | 175 | 157.1 Ų | 157.1 | 66% | 0.66 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 116.8 | -178.3 | -63.8 | 179.1 | 74.4 | -175.6 | 5.3 | 109.1 | P202 Y206 | P202-R204 PolarHBondContact O-N 2.96Å; R204-Y206 HydrophobicContact CB-CE1 4.43Å; R204-Y206 HydrophobicContact CB-CE2 3.92Å; R204-Y206 WeakPolarHBondContact O-CD2 3.38Å; R204-Y206 WeakPolarHBondContact O-CE2 3.4Å; R204-Y206 PolarHBondContact O-N 3.15Å |
| 205 | R | 94.1 | Very high | 88.5 | Confident | 248 Ų | 248 | 157.3 Ų | 157.3 | 94% | 0.936 | 77% | 0.77 | S | S | * | * | trans | -85 | 107.2 | 173.3 | -58.6 | -177.1 | 86.2 | -170.7 | 6.7 | 108.4 | I203 | I203-R205 PolarHBondContact O-N 3.27Å; I203-R205 VanDerWaalsContact O-N 3.14Å | ||
| 206 | Y | 92.3 | Very high | 87.9 | Confident | 172 Ų | 172 | 156.1 Ų | 156.1 | 68% | 0.675 | 77% | 0.774 | S | S | * | * | trans | -81.1 | 150.9 | 176.2 | -60.6 | -80.8 | 0 | 0 | 0 | 110.8 | R204 T208 | R204-Y206 HydrophobicContact CB-CE1 4.43Å; R204-Y206 HydrophobicContact CB-CE2 3.92Å; R204-Y206 WeakPolarHBondContact O-CD2 3.38Å; R204-Y206 WeakPolarHBondContact O-CE2 3.4Å; R204-Y206 PolarHBondContact O-N 3.15Å; Y206-T208 PolarHBondContact O-N 3.29Å | ||
| 207 | K | 90.8 | Very high | 87.4 | Confident | 198 Ų | 198 | 158.7 Ų | 158.7 | 86% | 0.861 | 79% | 0.789 | S | S | * | * | trans | -61.1 | 136.1 | 170 | -64.7 | -178.4 | 179.6 | -179 | 0 | 108.5 | I209 | K207-I209 PolarHBondContact O-N 3.42Å; K207-I209 VanDerWaalsContact O-N 3.08Å | ||
| 208 | T | 87.8 | Confident | 87 | Confident | 144 Ų | 144 | 160.5 Ų | 160.5 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | trans | -61.2 | 114.1 | 173.3 | 42.3 | 0 | 0 | 0 | 0 | 108.9 | Y206 | Y206-T208 PolarHBondContact O-N 3.29Š| ||
| 209 | I | 87.1 | Confident | 86.7 | Confident | 163 Ų | 163 | 157.5 Ų | 157.5 | 84% | 0.836 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 130.6 | 171.2 | 34.3 | 171.6 | 0 | 0 | 0 | 108.2 | K207 S211 | K207-I209 PolarHBondContact O-N 3.42Å; K207-I209 VanDerWaalsContact O-N 3.08Å; I209-S211 PolarHBondContact O-N 2.99Å |
| 210 | K | 83.1 | Confident | 86.6 | Confident | 204 Ų | 204 | 154.4 Ų | 154.4 | 89% | 0.887 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 123.2 | 171 | -69 | -176.3 | 179.2 | -178.6 | 0 | 107.4 | ||
| 211 | S | 81.6 | Confident | 86.1 | Confident | 105 Ų | 105 | 157.7 Ų | 157.7 | 73% | 0.734 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 133.8 | 170.2 | 44.2 | 0 | 0 | 0 | 0 | 108.4 | I209 T213 | I209-S211 PolarHBondContact O-N 2.99Å; S211-T213 PolarHBondContact O-N 3.37Å |
| 212 | P | 78.8 | Confident | 85.7 | Confident | 118 Ų | 118 | 154.8 Ų | 154.8 | 77% | 0.766 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 131 | 175.8 | 24 | -31.9 | 0 | 0 | 0 | 107.9 | R214 | P212-R214 PolarHBondContact O-N 2.7Š|
| 213 | T | 77.5 | Confident | 85.1 | Confident | 119 Ų | 119 | 154.3 Ų | 154.3 | 73% | 0.73 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52 | 132.2 | 170.9 | 35.5 | 0 | 0 | 0 | 0 | 108 | S211 K215 | S211-T213 PolarHBondContact O-N 3.37Å; T213-K215 PolarHBondContact O-N 3.23Å |
| 214 | R | 78 | Confident | 84.2 | Confident | 251 Ų | 251 | 152.7 Ų | 152.7 | 95% | 0.947 | 79% | 0.787 | S | S | * | * | trans | -62.6 | 84.5 | 178.6 | -69.4 | -175.2 | 178.5 | -152.6 | 0.5 | 108.6 | P212 | P212-R214 PolarHBondContact O-N 2.7Š| ||
| 215 | K | 79.9 | Confident | 82.9 | Confident | 176 Ų | 176 | 151.4 Ų | 151.4 | 77% | 0.765 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 133.1 | 166.8 | -67.2 | -176.3 | -178.6 | 179.2 | 0 | 106.1 | T213 | T213-K215 PolarHBondContact O-N 3.23Š|
| 216 | P | 83.3 | Confident | 81.5 | Confident | 107 Ų | 107 | 144.3 Ų | 144.3 | 70% | 0.695 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 145 | 177.2 | 24.5 | -33.2 | 0 | 0 | 0 | 109.3 | T218 | P216-T218 PolarHBondContact O-N 3.04Š|
| 217 | P | 83.4 | Confident | 80 | Confident | 122 Ų | 122 | 142 Ų | 142 | 79% | 0.792 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 127.6 | 179.2 | 20.3 | -30.4 | 0 | 0 | 0 | 109.7 | V219 | P217-V219 PolarHBondContact O-N 3.27Å; P217-V219 VanDerWaalsContact O-N 3.12Å |
| 218 | T | 85 | Confident | 78.2 | Confident | 135 Ų | 135 | 139 Ų | 139 | 83% | 0.828 | 78% | 0.777 | S | S | * | * | trans | -65.8 | 114.1 | 179.8 | -54.6 | 0 | 0 | 0 | 0 | 108.7 | P216 P220 | P216-T218 PolarHBondContact O-N 3.04Å; T218-P220 WeakPolarHBondContact O-CD 3.43Å | ||
| 219 | V | 83.7 | Confident | 76.7 | Confident | 115 Ų | 115 | 144.1 Ų | 144.1 | 70% | 0.697 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 120.3 | 174 | -178.1 | 0 | 0 | 0 | 0 | 107.8 | P217 K221 | P217-V219 PolarHBondContact O-N 3.27Å; P217-V219 VanDerWaalsContact O-N 3.12Å; V219-K221 PolarHBondContact O-N 3.01Å |
| 220 | P | 87.2 | Confident | 75 | Confident | 123 Ų | 123 | 144.1 Ų | 144.1 | 80% | 0.799 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 123.5 | 179.4 | 26.5 | -33.4 | 0 | 0 | 0 | 109.4 | T218 | T218-P220 WeakPolarHBondContact O-CD 3.43Š|
| 221 | K | 82.5 | Confident | 73.6 | Confident | 193 Ų | 193 | 145.2 Ų | 145.2 | 84% | 0.839 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -103.5 | 119.2 | 171.3 | -69 | -175.7 | 177.9 | -178.7 | 0 | 108.3 | V219 | V219-K221 PolarHBondContact O-N 3.01Š|
| 222 | S | 81.6 | Confident | 72.4 | Confident | 104 Ų | 104 | 146.9 Ų | 146.9 | 73% | 0.727 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 137 | 172.2 | 53.4 | 0 | 0 | 0 | 0 | 110 | V224 | S222-V224 PolarHBondContact O-N 3.36Š|
| 223 | P | 82.5 | Confident | 71.4 | Confident | 109 Ų | 109 | 150.3 Ų | 150.3 | 71% | 0.708 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 134.2 | 175.3 | 25.7 | -33.2 | 0 | 0 | 0 | 110.4 | L225 | P223-L225 PolarHBondContact O-N 3.05Å; P223-L225 VanDerWaalsContact O-N 3.12Å |
| 224 | V | 74.1 | Confident | 70.4 | Confident | 126 Ų | 126 | 153.4 Ų | 153.4 | 76% | 0.764 | 79% | 0.788 | S | S | * | * | trans | -77.3 | 97.4 | 177.5 | 178.3 | 0 | 0 | 0 | 0 | 108.3 | S222 S226 | S222-V224 PolarHBondContact O-N 3.36Å; V224-S226 PolarHBondContact O-N 3Å | ||
| 225 | L | 66.5 | Low | 69.4 | Low | 147 Ų | 147 | 149.6 Ų | 149.6 | 77% | 0.77 | 78% | 0.78 | S | S | * | * | trans | -80.1 | 66.3 | 171.4 | -61.1 | 177.2 | 0 | 0 | 0 | 109.7 | P223 T227 | P223-L225 PolarHBondContact O-N 3.05Å; P223-L225 VanDerWaalsContact O-N 3.12Å; L225-T227 PolarHBondContact O-N 3.04Å | ||
| 226 | S | 65.3 | Low | 67.8 | Low | 99 Ų | 99 | 147.6 Ų | 147.6 | 69% | 0.692 | 78% | 0.778 | S | S | * | * | trans | -78.7 | 69.9 | 173.3 | 54.6 | 0 | 0 | 0 | 0 | 110.5 | V224 L228 | V224-S226 PolarHBondContact O-N 3Å; S226-L228 PolarHBondContact O-N 2.79Å | ||
| 227 | T | 59.6 | Low | 65.9 | Low | 124 Ų | 124 | 149 Ų | 149 | 76% | 0.761 | 78% | 0.78 | S | S | * | * | trans | -77.1 | 55.2 | 168.9 | 49.9 | 0 | 0 | 0 | 0 | 111.1 | L225 | L225-T227 PolarHBondContact O-N 3.04Š| ||
| 228 | L | 54.1 | Low | 64.3 | Low | 135 Ų | 135 | 154.8 Ų | 154.8 | 71% | 0.707 | 80% | 0.802 | S | S | * | * | trans | -138.9 | 49 | 176.6 | -121.4 | 92.9 | 0 | 0 | 0 | 112.9 | S226 | S226-L228 PolarHBondContact O-N 2.79Š| ||
| 229 | R | 55.7 | Low | 63.2 | Low | 251 Ų | 251 | 155.8 Ų | 155.8 | 95% | 0.947 | 80% | 0.8 | S | S | * | * | trans | -102.9 | 78.2 | 144.6 | -76.8 | -164.6 | 169.2 | -161.4 | -1.9 | 109 | R231 | R229-R231 PolarHBondContact O-N 3.13Š| ||
| 230 | K | 52.4 | Low | 62.2 | Low | 163 Ų | 163 | 157.9 Ų | 157.9 | 71% | 0.709 | 81% | 0.806 | S | S | * | * | trans | -55.5 | 127.6 | 157.8 | -77.4 | 176.8 | 174.6 | 176.1 | 0 | 108.4 | ||||
| 231 | R | 53.7 | Low | 60.8 | Low | 227 Ų | 227 | 159.9 Ų | 159.9 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | trans | 57.1 | 116 | 137.8 | -62.2 | 178.9 | 159.8 | -175.6 | -7.6 | 117.6 | R229 | R229-R231 PolarHBondContact O-N 3.13Š| ||
| 232 | T | 56.5 | Low | 59.5 | Low | 140 Ų | 140 | 157.9 Ų | 157.9 | 86% | 0.859 | 80% | 0.804 | S | S | * | * | -142.8 | 96.7 | 113.6 | 41.7 | 0 | 0 | 0 | 0 | 107.8 | K234 | T232-K234 PolarHBondContact O-N 3.07Š| |||
| 233 | H | 56.3 | Low | 58.1 | Low | 190 Ų | 190 | 161.3 Ų | 161.3 | 88% | 0.88 | 81% | 0.809 | S | S | * | * | trans | -69.4 | 112 | 166.6 | -133.9 | -73 | 0 | 0 | 0 | 105.6 | H235 | H233-H235 PolarHBondContact O-N 2.68Å; H233-H235 VanDerWaalsContact O-N 3.13Å | ||
| 234 | K | 57.6 | Low | 56.5 | Low | 185 Ų | 185 | 164.8 Ų | 164.8 | 80% | 0.804 | 82% | 0.816 | S | S | * | * | trans | -64.5 | 110.4 | 168.5 | -78.4 | -178.4 | 173.5 | -177.6 | 0 | 107.1 | T232 N236 | T232-K234 PolarHBondContact O-N 3.07Å; K234-N236 PolarHBondContact O-N 3.2Å | ||
| 235 | H | 56 | Low | 55.2 | Low | 170 Ų | 170 | 167.6 Ų | 167.6 | 79% | 0.787 | 82% | 0.819 | S | S | * | * | trans | -80.1 | 88.4 | 168 | -173.5 | -55.8 | 0 | 0 | 0 | 107 | H233 | H233-H235 PolarHBondContact O-N 2.68Å; H233-H235 VanDerWaalsContact O-N 3.13Å | ||
| 236 | N | 46.4 | Very low | 54.4 | Low | 135 Ų | 135 | 169.2 Ų | 169.2 | 72% | 0.722 | 82% | 0.823 | S | S | * | * | trans | -101.7 | 116.7 | 158.4 | -83.5 | 1.6 | 0 | 0 | 0 | 105.1 | K234 | K234-N236 PolarHBondContact O-N 3.2Š| ||
| 237 | D | 44.2 | Very low | 53.4 | Low | 136 Ų | 136 | 175 Ų | 175 | 73% | 0.727 | 83% | 0.834 | S | S | * | * | trans | 173.3 | 120.2 | 142.9 | -82.2 | -19.4 | 0 | 0 | 0 | 108.8 | ||||
| 238 | I | 48.9 | Very low | 52.9 | Low | 244 Ų | 244 | 179.6 Ų | 179.6 | 100% | 1.251 | 84% | 0.841 | S | S | * | * | trans | 79.6 | 0 | 169 | -45.9 | 170.9 | 0 | 0 | 0 | 117.1 |
Retrieved 238 of 238 residues in 112.4 ms
(Link to these results)