| 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 | 48.9 | Very low | 50.9 | Low | 221 Ų | 221 | 152.7 Ų | 152.7 | 100% | 1.089 | 82% | 0.82 | S | S | * | * | 0 | 48.8 | 0 | -51.6 | -54.5 | -176.2 | 0 | 0 | 108.2 | |||||
| 2 | D | 44.3 | Very low | 51.5 | Low | 141 Ų | 141 | 149.3 Ų | 149.3 | 75% | 0.754 | 81% | 0.808 | S | S | * | * | 71 | 118.1 | 73 | -59.8 | -43.5 | 0 | 0 | 0 | 113.5 | |||||
| 3 | D | 44.1 | Very low | 51.1 | Low | 143 Ų | 143 | 147.2 Ų | 147.2 | 77% | 0.765 | 81% | 0.807 | S | S | * | * | trans | 75.6 | 97.4 | 150.1 | -65.2 | -21.2 | 0 | 0 | 0 | 121.4 | ||||
| 4 | L | 58.4 | Low | 51.1 | Low | 182 Ų | 182 | 150.3 Ų | 150.3 | 95% | 0.953 | 81% | 0.809 | S | S | * | * | trans | -116.3 | 105.1 | 134.4 | -91 | 107.6 | 0 | 0 | 0 | 108.9 | ||||
| 5 | S | 55.9 | Low | 50.4 | Low | 109 Ų | 109 | 151 Ų | 151 | 76% | 0.762 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -83.1 | 133.6 | 178.3 | 42.3 | 0 | 0 | 0 | 0 | 111.8 | ||
| 6 | D | 54.5 | Low | 49.7 | Very low | 150 Ų | 150 | 155.8 Ų | 155.8 | 80% | 0.802 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 146.3 | 174 | -71.7 | -49 | 0 | 0 | 0 | 112.2 | V8 | D6-V8 PolarHBondContact O-N 3.45Š|
| 7 | P | 62.2 | Low | 49.3 | Very low | 126 Ų | 126 | 160.6 Ų | 160.6 | 82% | 0.818 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 122.4 | 174 | 30.2 | -30.3 | 0 | 0 | 0 | 111.9 | ||
| 8 | V | 57.3 | Low | 48.8 | Very low | 124 Ų | 124 | 163.6 Ų | 163.6 | 75% | 0.752 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -63.4 | 129.9 | 172.4 | 174.4 | 0 | 0 | 0 | 0 | 111 | D6 E10 | D6-V8 PolarHBondContact O-N 3.45Å; V8-E10 PolarHBondContact O-N 3.17Å |
| 9 | Y | 43.5 | Very low | 48.2 | Very low | 224 Ų | 224 | 168.3 Ų | 168.3 | 88% | 0.878 | 84% | 0.835 | S | S | * | * | trans | -88 | 95.5 | 173.9 | -150.8 | -90.1 | 0 | 0 | 0 | 109.5 | S11 | Y9-S11 PolarHBondContact O-N 3.41Š| ||
| 10 | E | 48 | Very low | 47.8 | Very low | 160 Ų | 160 | 165.3 Ų | 165.3 | 75% | 0.748 | 83% | 0.831 | S | S | * | * | trans | -78.8 | 109.8 | 176 | -160.8 | 84.2 | -147.7 | 0 | 0 | 110.2 | V8 | V8-E10 PolarHBondContact O-N 3.17Š| ||
| 11 | S | 43 | Very low | 47.6 | Very low | 100 Ų | 100 | 163.6 Ų | 163.6 | 70% | 0.699 | 83% | 0.829 | S | S | * | * | trans | -80.6 | 118.4 | 173.7 | 54.7 | 0 | 0 | 0 | 0 | 111.2 | Y9 | Y9-S11 PolarHBondContact O-N 3.41Š| ||
| 12 | T | 57.4 | Low | 47.2 | Very low | 111 Ų | 111 | 164.2 Ų | 164.2 | 68% | 0.681 | 82% | 0.82 | S | S | * | * | trans | -116.4 | 125.2 | 165.5 | 53.5 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 13 | P | 47.3 | Very low | 47.1 | Very low | 122 Ų | 122 | 167.4 Ų | 167.4 | 79% | 0.792 | 83% | 0.827 | S | S | * | * | trans | -89.2 | 109.9 | 175.1 | 32.4 | -26.8 | 0 | 0 | 0 | 109.5 | N15 | P13-N15 PolarHBondContact O-N 3.18Š| ||
| 14 | K | 49.9 | Very low | 47.4 | Very low | 191 Ų | 191 | 165.5 Ų | 165.5 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | trans | -81.8 | 112.6 | 168.6 | -77.1 | -176.2 | 179.2 | 176.1 | 0 | 110.3 | Y16 | K14-Y16 PolarHBondContact O-N 3.5Š| ||
| 15 | N | 40.6 | Very low | 46.6 | Very low | 161 Ų | 161 | 164.5 Ų | 164.5 | 86% | 0.861 | 82% | 0.816 | S | S | * | * | trans | -43.8 | 117.9 | 165.3 | -74 | -55.1 | 0 | 0 | 0 | 112.3 | P13 | P13-N15 PolarHBondContact O-N 3.18Š| ||
| 16 | Y | 39.1 | Very low | 45.9 | Very low | 228 Ų | 228 | 168.7 Ų | 168.7 | 89% | 0.894 | 82% | 0.821 | S | S | * | * | trans | -118.6 | 111.2 | 160.1 | -110.8 | -91.5 | 0 | 0 | 0 | 110.9 | K14 | K14-Y16 PolarHBondContact O-N 3.5Š| ||
| 17 | R | 43.4 | Very low | 45.4 | Very low | 238 Ų | 238 | 165.6 Ų | 165.6 | 90% | 0.898 | 82% | 0.816 | S | S | * | * | trans | -69.9 | 132.1 | -179.1 | -159.2 | 172.7 | 178 | 171.7 | -1.2 | 109.4 | R19 | R17-R19 PolarHBondContact O-N 3.28Š| ||
| 18 | K | 40.9 | Very low | 45 | Very low | 214 Ų | 214 | 165.7 Ų | 165.7 | 93% | 0.93 | 81% | 0.814 | S | S | * | * | trans | -45.2 | 118.5 | 176.2 | -70.5 | 173.4 | 177 | 175.1 | 0 | 111.8 | ||||
| 19 | R | 37 | Very low | 44.7 | Very low | 252 Ų | 252 | 165.5 Ų | 165.5 | 95% | 0.951 | 82% | 0.816 | S | S | * | * | trans | -106.8 | 129.4 | 164 | -149.3 | 173.5 | -168.2 | -166.8 | 3.2 | 110.3 | R17 | R17-R19 PolarHBondContact O-N 3.28Š| ||
| 20 | S | 40 | Very low | 44.6 | Very low | 109 Ų | 109 | 162.4 Ų | 162.4 | 76% | 0.762 | 81% | 0.809 | S | S | * | * | trans | -60.5 | 151.3 | -173.3 | -173.1 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 21 | T | 43.3 | Very low | 44.7 | Very low | 130 Ų | 130 | 160.2 Ų | 160.2 | 80% | 0.798 | 81% | 0.806 | S | S | * | * | trans | -54.6 | 123.9 | 177.6 | 52.5 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 22 | R | 40.6 | Very low | 44.8 | Very low | 234 Ų | 234 | 160.3 Ų | 160.3 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | trans | -124.3 | 122.1 | 149.1 | -101.6 | -175.6 | 176.4 | 177.1 | -0.9 | 108.1 | T24 | R22-T24 PolarHBondContact O-N 3.32Š| ||
| 23 | K | 43.7 | Very low | 44.2 | Very low | 207 Ų | 207 | 163.1 Ų | 163.1 | 90% | 0.9 | 81% | 0.814 | S | S | * | * | trans | -60.5 | 114.9 | 167.2 | -65.9 | 173 | 178.1 | 176.3 | 0 | 107.3 | ||||
| 24 | T | 48.7 | Very low | 44.1 | Very low | 103 Ų | 103 | 161.8 Ų | 161.8 | 63% | 0.632 | 81% | 0.814 | S | S | * | * | trans | -116.5 | 122.1 | 163.2 | 51.6 | 0 | 0 | 0 | 0 | 107.4 | R22 F26 | R22-T24 PolarHBondContact O-N 3.32Å; T24-F26 PolarHBondContact O-N 3.33Å; T24-F26 VanDerWaalsContact O-N 3.15Å | ||
| 25 | N | 42.6 | Very low | 43.4 | Very low | 162 Ų | 162 | 156.6 Ų | 156.6 | 87% | 0.866 | 82% | 0.815 | S | S | * | * | trans | -64.1 | 108.7 | 172.1 | -59.8 | -45.8 | 0 | 0 | 0 | 107.2 | A27 | N25-A27 VanDerWaalsContact C-N 3.26Å; N25-A27 PolarHBondContact O-N 2.96Å; N25-A27 VanDerWaalsContact O-N 3.09Å | ||
| 26 | F | 41.1 | Very low | 43.2 | Very low | 197 Ų | 197 | 152.8 Ų | 152.8 | 86% | 0.864 | 81% | 0.813 | S | S | * | * | trans | -78.3 | 89.5 | 162.4 | -89.6 | -85.8 | 0 | 0 | 0 | 107 | T24 T28 | T24-F26 PolarHBondContact O-N 3.33Å; T24-F26 VanDerWaalsContact O-N 3.15Å; F26-T28 PolarHBondContact O-N 3.24Å | ||
| 27 | A | 44.2 | Very low | 43.3 | Very low | 85 Ų | 85 | 145.1 Ų | 145.1 | 70% | 0.702 | 80% | 0.804 | S | S | * | * | trans | -62.5 | 124.7 | 162.3 | 0 | 0 | 0 | 0 | 0 | 108 | N25 | N25-A27 VanDerWaalsContact C-N 3.26Å; N25-A27 PolarHBondContact O-N 2.96Å; N25-A27 VanDerWaalsContact O-N 3.09Å | ||
| 28 | T | 53.9 | Low | 43.5 | Very low | 127 Ų | 127 | 140.2 Ų | 140.2 | 78% | 0.779 | 79% | 0.794 | S | S | * | * | trans | -51 | 134.4 | 160.8 | 22.3 | 0 | 0 | 0 | 0 | 109.2 | F26 H30 | F26-T28 PolarHBondContact O-N 3.24Å; T28-H30 PolarHBondContact O-N 3.16Å | ||
| 29 | P | 51.3 | Low | 43.9 | Very low | 120 Ų | 120 | 139.4 Ų | 139.4 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | trans | -68.5 | 104.2 | 168.1 | 28.2 | -29.4 | 0 | 0 | 0 | 107.3 | V31 | P29-V31 PolarHBondContact O-N 3.32Å; P29-V31 VanDerWaalsContact O-N 3.11Å | ||
| 30 | H | 41.1 | Very low | 44.6 | Very low | 159 Ų | 159 | 136.4 Ų | 136.4 | 74% | 0.736 | 78% | 0.784 | S | S | * | * | trans | -67.2 | 104 | 164.6 | -179.6 | -81.7 | 0 | 0 | 0 | 107 | T28 P32 | T28-H30 PolarHBondContact O-N 3.16Å; H30-P32 WeakPolarHBondContact O-CD 3.46Å | ||
| 31 | V | 50.6 | Low | 45.1 | Very low | 115 Ų | 115 | 133.7 Ų | 133.7 | 70% | 0.697 | 77% | 0.768 | S | S | * | * | trans | -61.7 | 119.9 | 168.6 | -178 | 0 | 0 | 0 | 0 | 106.7 | P29 L33 | P29-V31 PolarHBondContact O-N 3.32Å; P29-V31 VanDerWaalsContact O-N 3.11Å; V31-L33 PolarHBondContact O-N 3.1Å | ||
| 32 | P | 44 | Very low | 45.3 | Very low | 102 Ų | 102 | 137.1 Ų | 137.1 | 66% | 0.662 | 77% | 0.767 | S | S | * | * | trans | -64.4 | 111.1 | 173.2 | -11.6 | 26.4 | 0 | 0 | 0 | 107.2 | H30 A34 | H30-P32 WeakPolarHBondContact O-CD 3.46Å; P32-A34 PolarHBondContact O-N 2.93Å | ||
| 33 | L | 45.2 | Very low | 46 | Very low | 169 Ų | 169 | 129.8 Ų | 129.8 | 89% | 0.885 | 75% | 0.748 | S | S | * | * | trans | -64.6 | 85.9 | 157.4 | -83.1 | 159.5 | 0 | 0 | 0 | 106.1 | V31 G35 | V31-L33 PolarHBondContact O-N 3.1Å; L33-G35 PolarHBondContact O-N 3.48Å | ||
| 34 | A | 44.6 | Very low | 46.4 | Very low | 94 Ų | 94 | 122.7 Ų | 122.7 | 78% | 0.777 | 73% | 0.727 | S | S | * | * | trans | -58.6 | 111.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 107.3 | P32 G36 | P32-A34 PolarHBondContact O-N 2.93Å; A34-G36 PolarHBondContact O-N 3.33Å | ||
| 35 | G | 36.3 | Very low | 46.6 | Very low | 83 Ų | 83 | 123.9 Ų | 123.9 | 86% | 0.856 | 73% | 0.728 | S | S | * | * | trans | -64.4 | 126.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | L33 | L33-G35 PolarHBondContact O-N 3.48Š| ||
| 36 | G | 36.7 | Very low | 47 | Very low | 80 Ų | 80 | 122.6 Ų | 122.6 | 83% | 0.825 | 72% | 0.717 | S | S | * | * | trans | 155.5 | 92.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | A34 | A34-G36 PolarHBondContact O-N 3.33Š| ||
| 37 | G | 40.1 | Very low | 47.5 | Very low | 67 Ų | 67 | 120.4 Ų | 120.4 | 69% | 0.691 | 71% | 0.71 | S | S | * | * | S | Bend | trans | 138.9 | -21.8 | 156.9 | 0 | 0 | 0 | 0 | 0 | 118.7 | K39 | G37-K39 VanDerWaalsContact C-N 3.35Å; G37-K39 PolarHBondContact O-N 2.93Å |
| 38 | I | 47 | Very low | 47.7 | Very low | 135 Ų | 135 | 123.6 Ų | 123.6 | 69% | 0.692 | 71% | 0.714 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.8 | 1 | -163.6 | -53.6 | -179.1 | 0 | 0 | 0 | 114.1 | K40 A41 R42 | I38-K40 PolarHBondContact O-N 3.09Å; I38-K40 VanDerWaalsContact O-N 3.12Å; I38-A41 HydrophobicContact CG2-CB 3.86Å; I38-A41 PolarHBondContact O-N 3.15Å; I38-R42 PolarHBondContact O-N 3.24Å |
| 39 | K | 50.3 | Low | 47.6 | Very low | 197 Ų | 197 | 124 Ų | 124 | 86% | 0.857 | 71% | 0.712 | S | S | * | * | H | α-helix | trans | -62.3 | -20.3 | 174.4 | -70.1 | -170.9 | 179.5 | -176.9 | 0 | 113.8 | G37 | G37-K39 VanDerWaalsContact C-N 3.35Å; G37-K39 PolarHBondContact O-N 2.93Å |
| 40 | K | 50.9 | Low | 47.2 | Very low | 190 Ų | 190 | 126.2 Ų | 126.2 | 83% | 0.826 | 71% | 0.709 | S | S | * | * | H | α-helix | trans | -84.2 | -25.9 | 171.6 | -88.3 | -177.3 | 174.6 | 179.8 | 0 | 114.5 | I38 A44 | I38-K40 PolarHBondContact O-N 3.09Å; I38-K40 VanDerWaalsContact O-N 3.12Å; K40-A44 PolarHBondContact O-N 3.47Å |
| 41 | A | 50.3 | Low | 47.5 | Very low | 51 Ų | 51 | 123.9 Ų | 123.9 | 42% | 0.421 | 71% | 0.711 | S | S | . | * | H | α-helix | trans | -81.3 | -26.4 | -177.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | I38 | I38-A41 HydrophobicContact CG2-CB 3.86Å; I38-A41 PolarHBondContact O-N 3.15Å |
| 42 | R | 49.1 | Very low | 47.2 | Very low | 203 Ų | 203 | 126.7 Ų | 126.7 | 77% | 0.766 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -76.3 | -31.5 | 178.2 | -153.4 | 170 | -177.1 | 155.7 | -0.3 | 112.7 | I38 | I38-R42 PolarHBondContact O-N 3.24Å |
| 43 | V | 54.2 | Low | 47.2 | Very low | 80 Ų | 80 | 130.1 Ų | 130.1 | 49% | 0.485 | 73% | 0.729 | S | S | . | * | H | α-helix | trans | -75.5 | -30.4 | 175.2 | 178.9 | 0 | 0 | 0 | 0 | 111.8 | I45 E46 Q47 | V43-I45 VanDerWaalsContact C-N 3.34Å; V43-I45 PolarHBondContact O-N 3.34Å; V43-E46 PolarHBondContact O-N 2.7Å; V43-Q47 HydrophobicContact CG1-CG 4.12Å; V43-Q47 WeakPolarHBondContact O-CG 3.42Å; V43-Q47 PolarHBondContact O-N 2.76Å; V43-Q47 VanDerWaalsContact O-N 3.14Å |
| 44 | A | 51.9 | Low | 46.9 | Very low | 57 Ų | 57 | 126.9 Ų | 126.9 | 47% | 0.471 | 73% | 0.727 | S | S | . | * | H | α-helix | trans | -71.4 | -25.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114 | K40 | K40-A44 PolarHBondContact O-N 3.47Å |
| 45 | I | 52.7 | Low | 46.7 | Very low | 128 Ų | 128 | 126.6 Ų | 126.6 | 66% | 0.656 | 72% | 0.724 | S | S | * | * | H | α-helix | trans | -84.6 | -21.1 | 176.1 | -65.4 | 173.6 | 0 | 0 | 0 | 111.3 | V43 | V43-I45 VanDerWaalsContact C-N 3.34Å; V43-I45 PolarHBondContact O-N 3.34Å |
| 46 | E | 50.9 | Low | 46.9 | Very low | 135 Ų | 135 | 128.6 Ų | 128.6 | 63% | 0.631 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -86.9 | -24.5 | 177.2 | -134.7 | 161.3 | -163.9 | 0 | 0 | 112.7 | V43 | V43-E46 PolarHBondContact O-N 2.7Å |
| 47 | Q | 51.7 | Low | 47.3 | Very low | 151 Ų | 151 | 132.7 Ų | 132.7 | 71% | 0.706 | 72% | 0.724 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.1 | -12 | 179.2 | -69.3 | -96.2 | -37.9 | 0 | 0 | 114.5 | V43 | V43-Q47 HydrophobicContact CG1-CG 4.12Å; V43-Q47 WeakPolarHBondContact O-CG 3.42Å; V43-Q47 PolarHBondContact O-N 2.76Å; V43-Q47 VanDerWaalsContact O-N 3.14Å |
| 48 | L | 48.3 | Very low | 47.2 | Very low | 153 Ų | 153 | 137.3 Ų | 137.3 | 80% | 0.801 | 73% | 0.733 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -2.4 | 178.1 | -71.5 | 175.3 | 0 | 0 | 0 | 114.5 | ||
| 49 | N | 51.6 | Low | 46.9 | Very low | 136 Ų | 136 | 139 Ų | 139 | 73% | 0.727 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -102 | 10.7 | -179.3 | -84.6 | -16.4 | 0 | 0 | 0 | 114.6 | ||
| 50 | F | 44.3 | Very low | 46.2 | Very low | 166 Ų | 166 | 138.1 Ų | 138.1 | 73% | 0.728 | 74% | 0.737 | S | S | * | * | S | Bend | trans | -114.1 | 63.3 | 176.7 | -86 | -85.2 | 0 | 0 | 0 | 111.6 | ||
| 51 | S | 46.3 | Very low | 45.6 | Very low | 110 Ų | 110 | 134 Ų | 134 | 77% | 0.769 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -176 | 68.8 | 161.4 | -78.1 | 0 | 0 | 0 | 0 | 109.2 | ||
| 52 | N | 45.2 | Very low | 45.1 | Very low | 173 Ų | 173 | 137.6 Ų | 137.6 | 93% | 0.925 | 75% | 0.749 | S | S | * | * | trans | -171.5 | 62.3 | 157.5 | -90.8 | -22.2 | 0 | 0 | 0 | 107.3 | ||||
| 53 | Q | 44.7 | Very low | 44.9 | Very low | 175 Ų | 175 | 133.9 Ų | 133.9 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | trans | -99 | 144 | 159.6 | -77.2 | -178 | 21.8 | 0 | 0 | 107.7 | ||||
| 54 | A | 38.9 | Very low | 44.1 | Very low | 101 Ų | 101 | 135.6 Ų | 135.6 | 84% | 0.835 | 76% | 0.755 | S | S | * | * | trans | 81.4 | 93.6 | 165.9 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 55 | A | 39.7 | Very low | 43.9 | Very low | 88 Ų | 88 | 139.1 Ų | 139.1 | 73% | 0.727 | 77% | 0.77 | S | S | * | * | -158.4 | 116.7 | 125.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | |||||
| 56 | P | 39.8 | Very low | 43.1 | Very low | 125 Ų | 125 | 139.2 Ų | 139.2 | 81% | 0.812 | 77% | 0.772 | S | S | * | * | trans | -90.8 | 120.7 | 162.8 | 32.4 | -22.6 | 0 | 0 | 0 | 108.4 | ||||
| 57 | L | 44.5 | Very low | 42.7 | Very low | 166 Ų | 166 | 139.4 Ų | 139.4 | 87% | 0.869 | 78% | 0.782 | S | S | * | * | trans | -127.4 | 105.8 | 166.2 | -71.3 | 177.4 | 0 | 0 | 0 | 108.2 | ||||
| 58 | D | 40 | Very low | 42.1 | Very low | 163 Ų | 163 | 136.6 Ų | 136.6 | 87% | 0.872 | 78% | 0.779 | S | S | * | * | trans | -61.5 | 118.5 | 155.1 | -76.4 | -42.3 | 0 | 0 | 0 | 108.3 | ||||
| 59 | E | 38.8 | Very low | 41.8 | Very low | 170 Ų | 170 | 134.6 Ų | 134.6 | 79% | 0.794 | 78% | 0.778 | S | S | * | * | trans | -174.1 | 107.2 | 141.9 | -113.6 | 177.8 | 159.2 | 0 | 0 | 112.2 | ||||
| 60 | Q | 36.6 | Very low | 40.9 | Very low | 179 Ų | 179 | 133.7 Ų | 133.7 | 84% | 0.836 | 78% | 0.783 | S | S | * | * | trans | 35.9 | 95.5 | 131.2 | -55 | -176.5 | 33.2 | 0 | 0 | 118.8 | ||||
| 61 | S | 38.2 | Very low | 40.7 | Very low | 104 Ų | 104 | 137.9 Ų | 137.9 | 73% | 0.727 | 79% | 0.794 | S | S | * | * | trans | -161.1 | 90 | 132.7 | 69 | 0 | 0 | 0 | 0 | 110.4 | V63 | S61-V63 PolarHBondContact O-N 3.1Š| ||
| 62 | V | 39.5 | Very low | 40.4 | Very low | 127 Ų | 127 | 144 Ų | 144 | 77% | 0.77 | 80% | 0.8 | S | S | * | * | trans | -79.9 | 96.5 | 169.6 | -158.4 | 0 | 0 | 0 | 0 | 107.1 | N64 | V62-N64 PolarHBondContact O-N 3.44Å; V62-N64 VanDerWaalsContact O-N 3.1Å | ||
| 63 | V | 45.7 | Very low | 39.9 | Very low | 124 Ų | 124 | 140.6 Ų | 140.6 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | trans | -78.5 | 96.1 | 171.2 | -175.8 | 0 | 0 | 0 | 0 | 107.9 | S61 T65 | S61-V63 PolarHBondContact O-N 3.1Å; V63-T65 PolarHBondContact O-N 3.06Å | ||
| 64 | N | 35.8 | Very low | 40 | Very low | 117 Ų | 117 | 138.6 Ų | 138.6 | 63% | 0.626 | 79% | 0.789 | S | S | * | * | trans | -60.9 | 113.4 | 170.6 | -73.5 | -41.5 | 0 | 0 | 0 | 110.8 | V62 N66 | V62-N64 PolarHBondContact O-N 3.44Å; V62-N64 VanDerWaalsContact O-N 3.1Å; N64-N66 PolarHBondContact O-N 3.26Å | ||
| 65 | T | 47.8 | Very low | 39.9 | Very low | 130 Ų | 130 | 141 Ų | 141 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | trans | -95.1 | 78.5 | 153.3 | 56.9 | 0 | 0 | 0 | 0 | 108.6 | V63 V67 | V63-T65 PolarHBondContact O-N 3.06Å; T65-V67 PolarHBondContact O-N 3.08Å | ||
| 66 | N | 37 | Very low | 40.3 | Very low | 130 Ų | 130 | 145.7 Ų | 145.7 | 70% | 0.695 | 79% | 0.792 | S | S | * | * | trans | -72.6 | 103.4 | 162.1 | -81.3 | -30.3 | 0 | 0 | 0 | 108.3 | N64 | N64-N66 PolarHBondContact O-N 3.26Š| ||
| 67 | V | 43.1 | Very low | 40.1 | Very low | 139 Ų | 139 | 149.2 Ų | 149.2 | 84% | 0.842 | 80% | 0.798 | S | S | * | * | trans | -95.2 | 87.4 | 155.8 | -178.1 | 0 | 0 | 0 | 0 | 106.9 | T65 | T65-V67 PolarHBondContact O-N 3.08Š| ||
| 68 | S | 39 | Very low | 39.8 | Very low | 92 Ų | 92 | 149 Ų | 149 | 64% | 0.643 | 80% | 0.797 | S | S | * | * | trans | -49.5 | 137.6 | 153.2 | -56.4 | 0 | 0 | 0 | 0 | 108 | ||||
| 69 | S | 40.5 | Very low | 40 | Very low | 111 Ų | 111 | 145.9 Ų | 145.9 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | -175.1 | 154.3 | 66.7 | -67.9 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 70 | S | 32.8 | Very low | 40.1 | Very low | 118 Ų | 118 | 146.2 Ų | 146.2 | 83% | 0.825 | 80% | 0.795 | S | S | * | * | trans | 87.6 | 72.1 | 155.4 | -110 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 71 | R | 39.8 | Very low | 40.7 | Very low | 253 Ų | 253 | 143.6 Ų | 143.6 | 96% | 0.955 | 79% | 0.794 | S | S | * | * | trans | -99.6 | 105.8 | 145.2 | -78.4 | -173 | 177.8 | -157.5 | 0.6 | 109.1 | S73 | R71-S73 PolarHBondContact O-N 3.42Š| ||
| 72 | R | 40.1 | Very low | 40.9 | Very low | 239 Ų | 239 | 149.8 Ų | 149.8 | 90% | 0.902 | 80% | 0.801 | S | S | * | * | trans | -73.6 | 117.2 | 159.6 | -98.4 | -179.8 | 175.6 | 178.7 | -1.5 | 108.5 | ||||
| 73 | S | 36 | Very low | 40.7 | Very low | 102 Ų | 102 | 155 Ų | 155 | 71% | 0.713 | 81% | 0.807 | S | S | * | * | trans | -64.6 | 128.1 | 167.5 | 174.7 | 0 | 0 | 0 | 0 | 110.2 | R71 | R71-S73 PolarHBondContact O-N 3.42Š| ||
| 74 | V | 46.9 | Very low | 40.7 | Very low | 133 Ų | 133 | 155.1 Ų | 155.1 | 81% | 0.806 | 81% | 0.807 | S | S | * | * | trans | -135.3 | 105.3 | 154.5 | -164.4 | 0 | 0 | 0 | 0 | 107 | K76 | V74-K76 PolarHBondContact O-N 3.08Š| ||
| 75 | N | 36.3 | Very low | 40.8 | Very low | 152 Ų | 152 | 155.6 Ų | 155.6 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | -55.6 | 118.8 | 168.7 | -92.6 | -23.7 | 0 | 0 | 0 | 109.8 | ||||
| 76 | K | 47.6 | Very low | 40.8 | Very low | 185 Ų | 185 | 154.6 Ų | 154.6 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | trans | -142.1 | 105.5 | 157.9 | -130.9 | 169.5 | -173.1 | 175.2 | 0 | 108.6 | V74 L78 | V74-K76 PolarHBondContact O-N 3.08Å; K76-L78 PolarHBondContact O-N 3.35Å | ||
| 77 | Q | 35.9 | Very low | 41.4 | Very low | 199 Ų | 199 | 155.1 Ų | 155.1 | 93% | 0.93 | 82% | 0.821 | S | S | * | * | trans | -49.5 | 116.8 | 171.4 | -64.2 | 169.5 | 13.4 | 0 | 0 | 108.9 | ||||
| 78 | L | 39 | Very low | 41.1 | Very low | 163 Ų | 163 | 151.7 Ų | 151.7 | 85% | 0.853 | 81% | 0.814 | S | S | * | * | trans | -120.6 | 117.8 | 164.4 | -103.2 | 91.9 | 0 | 0 | 0 | 109.1 | K76 | K76-L78 PolarHBondContact O-N 3.35Š| ||
| 79 | A | 43.1 | Very low | 41.2 | Very low | 97 Ų | 97 | 155.3 Ų | 155.3 | 80% | 0.802 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 146 | -170.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 80 | Q | 41.3 | Very low | 41.2 | Very low | 177 Ų | 177 | 160.1 Ų | 160.1 | 83% | 0.827 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 134.1 | 164.9 | -62.7 | -92.8 | 0.4 | 0 | 0 | 110.4 | R82 | Q80-R82 PolarHBondContact O-N 2.96Š|
| 81 | P | 48.4 | Very low | 41.5 | Very low | 124 Ų | 124 | 159.3 Ų | 159.3 | 81% | 0.805 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 120.6 | 169.5 | 28.8 | -29.1 | 0 | 0 | 0 | 110 | ||
| 82 | R | 43.3 | Very low | 41.7 | Very low | 234 Ų | 234 | 158.1 Ų | 158.1 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 136.4 | 174 | -80.9 | -178.5 | 171.1 | -151 | -1.4 | 111.5 | Q80 V84 | Q80-R82 PolarHBondContact O-N 2.96Å; R82-V84 PolarHBondContact O-N 3.32Å |
| 83 | R | 35.1 | Very low | 41.9 | Very low | 237 Ų | 237 | 155.5 Ų | 155.5 | 89% | 0.894 | 82% | 0.821 | S | S | * | * | trans | -62.7 | 111.3 | 168.5 | -163.2 | -178.1 | -150.2 | 178.8 | 5.6 | 109.2 | ||||
| 84 | V | 45.9 | Very low | 42.1 | Very low | 125 Ų | 125 | 158.7 Ų | 158.7 | 76% | 0.758 | 83% | 0.83 | S | S | * | * | trans | -93.1 | 112.3 | 169.1 | -176.4 | 0 | 0 | 0 | 0 | 107.9 | R82 | R82-V84 PolarHBondContact O-N 3.32Š| ||
| 85 | T | 39 | Very low | 41.9 | Very low | 127 Ų | 127 | 158.8 Ų | 158.8 | 78% | 0.779 | 83% | 0.826 | S | S | * | * | trans | -76 | 116.8 | 163.6 | 49.9 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 86 | S | 47.7 | Very low | 42.5 | Very low | 109 Ų | 109 | 161.2 Ų | 161.2 | 76% | 0.762 | 82% | 0.824 | S | S | * | * | trans | -127.5 | 116 | 160.5 | 63 | 0 | 0 | 0 | 0 | 110 | ||||
| 87 | T | 47.7 | Very low | 42.6 | Very low | 141 Ų | 141 | 158.9 Ų | 158.9 | 87% | 0.865 | 82% | 0.818 | S | S | * | * | trans | -64.7 | 144.3 | 168.5 | 47 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 88 | G | 38.1 | Very low | 42.9 | Very low | 68 Ų | 68 | 157.5 Ų | 157.5 | 70% | 0.701 | 81% | 0.805 | S | S | * | * | trans | 81.7 | 86.5 | 149.2 | 0 | 0 | 0 | 0 | 0 | 117.1 | ||||
| 89 | N | 41.1 | Very low | 43.5 | Very low | 168 Ų | 168 | 155.5 Ų | 155.5 | 90% | 0.898 | 80% | 0.8 | S | S | * | * | -174.4 | 108 | 112.4 | -102.2 | -24.6 | 0 | 0 | 0 | 111 | S91 | N89-S91 PolarHBondContact O-N 2.89Š| |||
| 90 | K | 39.7 | Very low | 43.4 | Very low | 212 Ų | 212 | 159.2 Ų | 159.2 | 92% | 0.922 | 81% | 0.806 | S | S | * | * | trans | -71.4 | 97 | 167.9 | -76.4 | 171.4 | 174.2 | 171.2 | 0 | 108.5 | ||||
| 91 | S | 39.2 | Very low | 43.4 | Very low | 101 Ų | 101 | 160 Ų | 160 | 71% | 0.706 | 80% | 0.801 | S | S | * | * | trans | -173.1 | 130.2 | 153.2 | -143.6 | 0 | 0 | 0 | 0 | 111 | N89 | N89-S91 PolarHBondContact O-N 2.89Š| ||
| 92 | R | 45.4 | Very low | 43 | Very low | 227 Ų | 227 | 163.2 Ų | 163.2 | 86% | 0.857 | 80% | 0.803 | S | S | * | * | S | Bend | trans | 77.4 | 56.3 | 156.7 | -41.6 | 175.8 | 84.6 | 157.7 | 7.5 | 118.2 | ||
| 93 | Q | 43.3 | Very low | 42.8 | Very low | 184 Ų | 184 | 161.3 Ų | 161.3 | 86% | 0.86 | 80% | 0.804 | S | S | * | * | trans | -164 | 96.8 | 157.7 | -110.6 | 149.9 | 6.2 | 0 | 0 | 109.5 | ||||
| 94 | N | 41 | Very low | 43.1 | Very low | 170 Ų | 170 | 156.3 Ų | 156.3 | 91% | 0.909 | 80% | 0.8 | S | S | * | * | trans | 176 | 63.8 | 153.8 | -83.8 | -19.1 | 0 | 0 | 0 | 107.9 | ||||
| 95 | N | 41.6 | Very low | 42.8 | Very low | 135 Ų | 135 | 155.4 Ų | 155.4 | 72% | 0.722 | 80% | 0.799 | S | S | * | * | trans | -129.9 | 67.4 | 170.5 | -155.3 | 33.1 | 0 | 0 | 0 | 108.9 | M97 | N95-M97 PolarHBondContact OD1-O 3.3Š| ||
| 96 | W | 49.4 | Very low | 43 | Very low | 203 Ų | 203 | 159.8 Ų | 159.8 | 77% | 0.769 | 81% | 0.807 | S | S | * | * | trans | -91.7 | -3.2 | 166 | -98.3 | 44.1 | 0 | 0 | 0 | 111.9 | ||||
| 97 | M | 49.6 | Very low | 42.8 | Very low | 136 Ų | 136 | 160 Ų | 160 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | S | Bend | trans | -75.2 | 129 | 165.4 | -76.2 | -178.7 | 74.2 | 0 | 0 | 108.1 | N95 | N95-M97 PolarHBondContact OD1-O 3.3Š|
| 98 | Y | 42.4 | Very low | 42.2 | Very low | 169 Ų | 169 | 159.9 Ų | 159.9 | 66% | 0.663 | 80% | 0.802 | S | S | * | * | trans | 81.9 | 69.2 | 179.6 | -52.7 | -83.9 | 0 | 0 | 0 | 117.2 | ||||
| 99 | V | 51.8 | Low | 42.6 | Very low | 122 Ų | 122 | 161.5 Ų | 161.5 | 74% | 0.739 | 80% | 0.803 | S | S | * | * | S | Bend | trans | -120.1 | 3.8 | 158.7 | -142.3 | 0 | 0 | 0 | 0 | 114.1 | ||
| 100 | N | 40.9 | Very low | 42.6 | Very low | 174 Ų | 174 | 163.7 Ų | 163.7 | 93% | 0.93 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -120.8 | 30.9 | 176.8 | -85.6 | 4.7 | 0 | 0 | 0 | 114.1 | ||
| 101 | R | 41.6 | Very low | 42.5 | Very low | 193 Ų | 193 | 165.1 Ų | 165.1 | 73% | 0.728 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -140.2 | 82.2 | 179.2 | -171.8 | -176.1 | -70.3 | -132.6 | 1.1 | 110.7 | ||
| 102 | K | 39.1 | Very low | 43.1 | Very low | 193 Ų | 193 | 166.8 Ų | 166.8 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | trans | 154.7 | 77.5 | 151.8 | -85.9 | 169.7 | -178.5 | -173.2 | 0 | 110.3 | ||||
| 103 | E | 39.4 | Very low | 43.2 | Very low | 193 Ų | 193 | 160.8 Ų | 160.8 | 90% | 0.902 | 80% | 0.797 | S | S | * | * | trans | -115.6 | 43.3 | 160.5 | -70.8 | -160 | 165.4 | 0 | 0 | 110.9 | ||||
| 104 | T | 40.4 | Very low | 43.8 | Very low | 132 Ų | 132 | 158.2 Ų | 158.2 | 81% | 0.81 | 80% | 0.796 | S | S | * | * | S | Bend | trans | -152.2 | 67.6 | 171.5 | 61.7 | 0 | 0 | 0 | 0 | 111.5 | ||
| 105 | S | 39.3 | Very low | 44 | Very low | 107 Ų | 107 | 156.5 Ų | 156.5 | 75% | 0.748 | 79% | 0.791 | S | S | * | * | trans | 171.1 | 82.1 | 156.8 | 53 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 106 | K | 43.4 | Very low | 44.3 | Very low | 219 Ų | 219 | 160.8 Ų | 160.8 | 95% | 0.952 | 80% | 0.797 | S | S | * | * | trans | -87.6 | 104 | 159.7 | -85.5 | 177.3 | 175.9 | 172.2 | 0 | 106.9 | ||||
| 107 | S | 43.9 | Very low | 44 | Very low | 112 Ų | 112 | 157.8 Ų | 157.8 | 78% | 0.783 | 80% | 0.797 | S | S | * | * | trans | -73.7 | 139.3 | 166 | 79.3 | 0 | 0 | 0 | 0 | 109.4 | S109 | S107-S109 PolarHBondContact O-N 2.82Š| ||
| 108 | N | 35.8 | Very low | 43.7 | Very low | 139 Ų | 139 | 162.1 Ų | 162.1 | 74% | 0.743 | 81% | 0.805 | S | S | * | * | trans | -61.9 | 115.9 | 174 | -165 | 8.8 | 0 | 0 | 0 | 109.3 | ||||
| 109 | S | 45.8 | Very low | 43.9 | Very low | 102 Ų | 102 | 161.2 Ų | 161.2 | 71% | 0.713 | 81% | 0.811 | S | S | * | * | trans | -141.4 | 94.8 | 163.6 | -164.4 | 0 | 0 | 0 | 0 | 108.7 | S107 R111 | S107-S109 PolarHBondContact O-N 2.82Å; S109-R111 PolarHBondContact O-N 3.01Å | ||
| 110 | R | 41.2 | Very low | 43.7 | Very low | 215 Ų | 215 | 161.1 Ų | 161.1 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | trans | -49.4 | 116.2 | 163.7 | -64.3 | 174.4 | -169.9 | 162.5 | 1.4 | 107.9 | ||||
| 111 | R | 38.7 | Very low | 44.1 | Very low | 242 Ų | 242 | 161.3 Ų | 161.3 | 91% | 0.913 | 81% | 0.811 | S | S | * | * | trans | -94.5 | 107.7 | 166.6 | -114.5 | -174.6 | -158.5 | -153.6 | 4.6 | 107.2 | S109 | S109-R111 PolarHBondContact O-N 3.01Š| ||
| 112 | V | 50.9 | Low | 44.4 | Very low | 136 Ų | 136 | 157.4 Ų | 157.4 | 82% | 0.824 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 132.7 | 166.7 | 176.1 | 0 | 0 | 0 | 0 | 108 | ||
| 113 | S | 47.6 | Very low | 44.9 | Very low | 101 Ų | 101 | 153.3 Ų | 153.3 | 71% | 0.706 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 138.6 | 177.7 | -41 | 0 | 0 | 0 | 0 | 111.2 | ||
| 114 | P | 56.2 | Low | 45 | Very low | 130 Ų | 130 | 147.4 Ų | 147.4 | 84% | 0.844 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -86.3 | 126 | 168.2 | 31.6 | -27.7 | 0 | 0 | 0 | 110.7 | ||
| 115 | V | 45.2 | Very low | 45.1 | Very low | 133 Ų | 133 | 152.8 Ų | 152.8 | 81% | 0.806 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 129.4 | 170 | 171.3 | 0 | 0 | 0 | 0 | 109.3 | ||
| 116 | R | 46.8 | Very low | 45.3 | Very low | 225 Ų | 225 | 154.7 Ų | 154.7 | 85% | 0.849 | 81% | 0.807 | S | S | * | * | trans | -98.7 | 98 | 176 | -165.4 | 176.9 | -163.2 | 176.6 | 4.4 | 109.3 | R118 | R116-R118 PolarHBondContact O-N 3.2Š| ||
| 117 | N | 44.9 | Very low | 45.7 | Very low | 141 Ų | 141 | 150.3 Ų | 150.3 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | trans | -65.4 | 123.5 | 166.2 | -86.5 | -6.4 | 0 | 0 | 0 | 109.6 | ||||
| 118 | R | 43.4 | Very low | 45.7 | Very low | 226 Ų | 226 | 153.6 Ų | 153.6 | 85% | 0.853 | 79% | 0.794 | S | S | * | * | trans | -104.9 | 108.2 | 164.9 | -108.5 | -171.4 | -85 | -154.3 | -1.3 | 107.4 | R116 | R116-R118 PolarHBondContact O-N 3.2Š| ||
| 119 | L | 45.7 | Very low | 45.9 | Very low | 151 Ų | 151 | 154.7 Ų | 154.7 | 79% | 0.791 | 80% | 0.799 | S | S | * | * | trans | -76.8 | 123 | 159.6 | -84.5 | 77.2 | 0 | 0 | 0 | 107.5 | ||||
| 120 | S | 47.2 | Very low | 46.1 | Very low | 119 Ų | 119 | 156.2 Ų | 156.2 | 83% | 0.832 | 80% | 0.804 | S | S | * | * | trans | -125.2 | 106.9 | 158.7 | 56.1 | 0 | 0 | 0 | 0 | 107.2 | ||||
| 121 | Q | 49 | Very low | 46.1 | Very low | 178 Ų | 178 | 154.7 Ų | 154.7 | 83% | 0.832 | 81% | 0.806 | S | S | * | * | trans | -86.5 | 146.2 | 168.9 | -75.8 | -178.5 | -20 | 0 | 0 | 109.8 | ||||
| 122 | S | 47.8 | Very low | 46.5 | Very low | 112 Ų | 112 | 152.9 Ų | 152.9 | 78% | 0.783 | 80% | 0.804 | S | S | * | * | trans | 69.3 | 140.6 | 159.4 | 127.8 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 123 | S | 49.3 | Very low | 46.4 | Very low | 106 Ų | 106 | 154.8 Ų | 154.8 | 74% | 0.741 | 81% | 0.805 | S | S | * | * | cis | -177.8 | 137.1 | 0.7 | 37.2 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 124 | G | 43.3 | Very low | 46.2 | Very low | 69 Ų | 69 | 159.3 Ų | 159.3 | 71% | 0.711 | 81% | 0.814 | S | S | * | * | trans | 101.7 | 112.2 | 144 | 0 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 125 | R | 41.7 | Very low | 45.6 | Very low | 245 Ų | 245 | 158.8 Ų | 158.8 | 93% | 0.925 | 81% | 0.814 | S | S | * | * | trans | 72 | 92.1 | 139.5 | -58.9 | 176.8 | -171.8 | 144.1 | 0.6 | 115.8 | ||||
| 126 | N | 42.9 | Very low | 45.4 | Very low | 147 Ų | 147 | 157.4 Ų | 157.4 | 79% | 0.786 | 81% | 0.81 | S | S | * | * | 75.8 | 137.3 | 74.6 | -151.1 | -8.4 | 0 | 0 | 0 | 113.3 | |||||
| 127 | L | 51.7 | Low | 45.6 | Very low | 127 Ų | 127 | 155.2 Ų | 155.2 | 67% | 0.665 | 81% | 0.81 | S | S | * | * | trans | 102.5 | 102.5 | 161.4 | -58.7 | 130.8 | 0 | 0 | 0 | 120.1 | ||||
| 128 | K | 45.2 | Very low | 45.3 | Very low | 181 Ų | 181 | 154 Ų | 154 | 79% | 0.787 | 81% | 0.808 | S | S | * | * | 84.1 | 91.7 | 126.2 | -69.4 | 180 | 176.9 | 179.8 | 0 | 120.7 | |||||
| 129 | L | 39.1 | Very low | 45.1 | Very low | 163 Ų | 163 | 150.3 Ų | 150.3 | 85% | 0.853 | 81% | 0.81 | S | S | * | * | 9.1 | 111.5 | 116.1 | -156.8 | 81.4 | 0 | 0 | 0 | 117.3 | |||||
| 130 | V | 49.4 | Very low | 45 | Very low | 134 Ų | 134 | 146.5 Ų | 146.5 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | trans | -145.2 | 110.6 | 147.5 | 177.1 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 131 | Q | 42 | Very low | 44.7 | Very low | 183 Ų | 183 | 146.7 Ų | 146.7 | 86% | 0.855 | 80% | 0.804 | S | S | * | * | trans | -71 | 131.6 | 158.9 | -88.1 | 168.3 | -49.5 | 0 | 0 | 108.7 | ||||
| 132 | K | 46.8 | Very low | 44.6 | Very low | 203 Ų | 203 | 143 Ų | 143 | 88% | 0.883 | 80% | 0.804 | S | S | * | * | trans | -132.4 | 134.2 | 157.8 | -163.8 | 169.1 | -179.1 | 178.9 | 0 | 111 | ||||
| 133 | Q | 50.2 | Low | 44.7 | Very low | 177 Ų | 177 | 145.6 Ų | 145.6 | 83% | 0.827 | 80% | 0.803 | S | S | * | * | trans | -69.6 | 145.4 | -167.9 | -66 | 155.4 | -2 | 0 | 0 | 113.7 | ||||
| 134 | Q | 41.8 | Very low | 44.7 | Very low | 195 Ų | 195 | 147.5 Ų | 147.5 | 91% | 0.911 | 81% | 0.806 | S | S | * | * | trans | 12.7 | 118.7 | 138.5 | -62.3 | 174.2 | 2.4 | 0 | 0 | 118 | ||||
| 135 | S | 43.7 | Very low | 45 | Very low | 120 Ų | 120 | 150.3 Ų | 150.3 | 84% | 0.839 | 80% | 0.804 | S | S | * | * | trans | -152.4 | 132.4 | 138.8 | 55.3 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 136 | S | 42.1 | Very low | 45.6 | Very low | 104 Ų | 104 | 147 Ų | 147 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -60.2 | 137.5 | 175.2 | 47.5 | 0 | 0 | 0 | 0 | 113 | ||||
| 137 | Q | 51.5 | Low | 46.2 | Very low | 179 Ų | 179 | 146.4 Ų | 146.4 | 84% | 0.836 | 79% | 0.789 | S | S | * | * | trans | -172.8 | 109.8 | 143 | -103.2 | 160.9 | 57.4 | 0 | 0 | 111.2 | ||||
| 138 | T | 37.1 | Very low | 46.6 | Very low | 116 Ų | 116 | 148 Ų | 148 | 71% | 0.712 | 80% | 0.797 | S | S | * | * | 42.4 | 141.4 | 129.5 | 57 | 0 | 0 | 0 | 0 | 121.1 | |||||
| 139 | T | 39.9 | Very low | 47.3 | Very low | 147 Ų | 147 | 148.8 Ų | 148.8 | 90% | 0.902 | 80% | 0.795 | S | S | * | * | trans | 96.5 | 126.6 | 158.5 | 76.1 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 140 | G | 42.5 | Very low | 48.3 | Very low | 71 Ų | 71 | 146.5 Ų | 146.5 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | trans | 139.7 | 69.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | A142 | G140-A142 PolarHBondContact O-N 3.11Š| ||
| 141 | T | 42.8 | Very low | 49 | Very low | 124 Ų | 124 | 149.8 Ų | 149.8 | 76% | 0.761 | 79% | 0.793 | S | S | * | * | trans | -39.7 | 105.9 | 165.6 | 47.6 | 0 | 0 | 0 | 0 | 112.1 | Q143 | T141-Q143 PolarHBondContact O-N 2.97Š| ||
| 142 | A | 45 | Very low | 50.3 | Low | 101 Ų | 101 | 150.9 Ų | 150.9 | 84% | 0.835 | 80% | 0.795 | S | S | * | * | trans | -71.8 | 83.2 | 165.1 | 0 | 0 | 0 | 0 | 0 | 108 | G140 N144 | G140-A142 PolarHBondContact O-N 3.11Å; A142-N144 VanDerWaalsContact C-N 3.33Å; A142-N144 PolarHBondContact O-N 3.45Å | ||
| 143 | Q | 51.1 | Low | 51.3 | Low | 165 Ų | 165 | 153 Ų | 153 | 77% | 0.771 | 80% | 0.797 | S | S | * | * | trans | -57.9 | 101.8 | 166.7 | -70.4 | -177.4 | -17.6 | 0 | 0 | 107.1 | T141 D145 | T141-Q143 PolarHBondContact O-N 2.97Å; Q143-D145 PolarHBondContact O-N 2.79Å | ||
| 144 | N | 49.3 | Very low | 52.3 | Low | 147 Ų | 147 | 147.5 Ų | 147.5 | 79% | 0.786 | 78% | 0.782 | S | S | * | * | trans | -71.1 | 76.3 | 173.5 | -151.9 | -13.2 | 0 | 0 | 0 | 106.4 | A142 K146 | A142-N144 VanDerWaalsContact C-N 3.33Å; A142-N144 PolarHBondContact O-N 3.45Å; N144-K146 PolarHBondContact O-N 2.99Å | ||
| 145 | D | 50.3 | Low | 53.9 | Low | 127 Ų | 127 | 141.3 Ų | 141.3 | 68% | 0.679 | 76% | 0.764 | S | S | * | * | trans | -68.7 | 85.6 | -178.2 | -151.4 | 19.9 | 0 | 0 | 0 | 106.9 | Q143 Q147 | Q143-D145 PolarHBondContact O-N 2.79Å; D145-Q147 PolarHBondContact O-N 3.25Å | ||
| 146 | K | 53 | Low | 55.4 | Low | 177 Ų | 177 | 143.2 Ų | 143.2 | 77% | 0.77 | 76% | 0.76 | S | S | * | * | trans | -62.8 | 75.6 | 169.7 | -74.3 | 177 | 179.8 | 174.3 | 0 | 107.1 | N144 I148 | N144-K146 PolarHBondContact O-N 2.99Å; K146-I148 VanDerWaalsContact C-N 3.31Å; K146-I148 PolarHBondContact O-N 3.12Å | ||
| 147 | Q | 55 | Low | 57.2 | Low | 134 Ų | 134 | 146.6 Ų | 146.6 | 63% | 0.626 | 76% | 0.758 | S | S | * | * | trans | -57.7 | 100.3 | 166 | -73.2 | -174.3 | -3.5 | 0 | 0 | 106.9 | D145 R149 | D145-Q147 PolarHBondContact O-N 3.25Å; Q147-R149 PolarHBondContact O-N 3.27Å | ||
| 148 | I | 60.5 | Low | 58.9 | Low | 161 Ų | 161 | 141.5 Ų | 141.5 | 83% | 0.826 | 74% | 0.742 | S | S | * | * | trans | -63.1 | 83.7 | 168.1 | -59.2 | 172.4 | 0 | 0 | 0 | 105.5 | K146 P150 | K146-I148 VanDerWaalsContact C-N 3.31Å; K146-I148 PolarHBondContact O-N 3.12Å; I148-P150 WeakPolarHBondContact O-CD 3.29Å | ||
| 149 | R | 60.9 | Low | 61.4 | Low | 197 Ų | 197 | 138.8 Ų | 138.8 | 74% | 0.743 | 73% | 0.726 | S | S | * | * | trans | -58.8 | 123.5 | 173.6 | -69.1 | -178.5 | -178.9 | -120.2 | -1.2 | 106.3 | Q147 K151 | Q147-R149 PolarHBondContact O-N 3.27Å; R149-K151 PolarHBondContact O-N 3.24Å | ||
| 150 | P | 58.7 | Low | 63.9 | Low | 114 Ų | 114 | 133.9 Ų | 133.9 | 74% | 0.74 | 70% | 0.7 | S | S | * | * | trans | -57.2 | 120.2 | -179.7 | 21.5 | -31.2 | 0 | 0 | 0 | 108.1 | I148 K152 | I148-P150 WeakPolarHBondContact O-CD 3.29Å; P150-K152 PolarHBondContact O-N 2.94Å | ||
| 151 | K | 64.7 | Low | 66.3 | Low | 203 Ų | 203 | 134.1 Ų | 134.1 | 88% | 0.883 | 68% | 0.684 | S | S | * | * | trans | -56.3 | 106 | 177.4 | -76.7 | 179.4 | 179.3 | 174.6 | 0 | 107.5 | R149 R153 | R149-K151 PolarHBondContact O-N 3.24Å; K151-R153 PolarHBondContact O-N 3.25Å; K151-R153 VanDerWaalsContact O-N 3.07Å | ||
| 152 | K | 68.6 | Low | 68.7 | Low | 207 Ų | 207 | 136 Ų | 136 | 90% | 0.9 | 68% | 0.681 | S | S | * | * | trans | -58.5 | 115.4 | 178.2 | -69.1 | -175.4 | 178.7 | -177.4 | 0 | 107.9 | P150 A154 | P150-K152 PolarHBondContact O-N 2.94Å; K152-A154 PolarHBondContact O-N 3.43Å | ||
| 153 | R | 68.3 | Low | 71.1 | Confident | 246 Ų | 246 | 136 Ų | 136 | 93% | 0.928 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 128.4 | 174.8 | -67 | -178.9 | -177.8 | 178.1 | 0.4 | 107.9 | K151 A155 | K151-R153 PolarHBondContact O-N 3.25Å; K151-R153 VanDerWaalsContact O-N 3.07Å; R153-A155 PolarHBondContact O-N 3.3Å |
| 154 | A | 72 | Confident | 73.1 | Confident | 62 Ų | 62 | 132.1 Ų | 132.1 | 51% | 0.512 | 65% | 0.648 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 135.4 | 173 | 0 | 0 | 0 | 0 | 0 | 109 | K152 Q156 V159 | K152-A154 PolarHBondContact O-N 3.43Å; A154-Q156 PolarHBondContact O-N 3.37Å; A154-V159 HydrophobicContact CB-CG2 3.65Å |
| 155 | A | 74.6 | Confident | 75.3 | Confident | 66 Ų | 66 | 132.2 Ų | 132.2 | 55% | 0.545 | 64% | 0.637 | S | S | . | * | P | Polyproline II helix | trans | -54.4 | 132.2 | 172.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | R153 Y157 S158 V159 | R153-A155 PolarHBondContact O-N 3.3Å; A155-Y157 PolarHBondContact O-N 2.92Å; A155-Y157 VanDerWaalsContact O-N 3.08Å; A155-S158 WeakPolarHBondContact O-CA 3.46Å; A155-S158 WeakPolarHBondContact O-CB 3.42Å; A155-S158 PolarHBondContact O-N 3.13Å; A155-V159 PolarHBondContact O-N 3.13Å |
| 156 | Q | 76 | Confident | 77.5 | Confident | 160 Ų | 160 | 128.6 Ų | 128.6 | 75% | 0.748 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -50 | -41.4 | -171.6 | -68.5 | 170.6 | -19.7 | 0 | 0 | 112.7 | A154 S158 V159 A160 | A154-Q156 PolarHBondContact O-N 3.37Å; Q156-S158 VanDerWaalsContact C-N 3.3Å; Q156-S158 PolarHBondContact O-N 2.99Å; Q156-V159 PolarHBondContact O-N 3.26Å; Q156-A160 PolarHBondContact O-N 3.37Å; Q156-A160 VanDerWaalsContact O-N 3.15Å |
| 157 | Y | 79.1 | Confident | 79.6 | Confident | 174 Ų | 174 | 125.3 Ų | 125.3 | 68% | 0.682 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -63.6 | -31.1 | 177.1 | -54.2 | -72.9 | 0 | 0 | 0 | 113.8 | A155 L161 | A155-Y157 PolarHBondContact O-N 2.92Å; A155-Y157 VanDerWaalsContact O-N 3.08Å; Y157-L161 WeakPolarHBondContact O-CB 3.23Å; Y157-L161 VanDerWaalsContact O-CG 3.23Å; Y157-L161 WeakPolarHBondContact O-CG 3.39Å; Y157-L161 PolarHBondContact O-N 2.82Å |
| 158 | S | 87.1 | Confident | 81.5 | Confident | 73 Ų | 73 | 126.2 Ų | 126.2 | 51% | 0.51 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -67.5 | -39.2 | 176.5 | -172.9 | 0 | 0 | 0 | 0 | 111.4 | A155 Q156 K162 | A155-S158 WeakPolarHBondContact O-CA 3.46Å; A155-S158 WeakPolarHBondContact O-CB 3.42Å; A155-S158 PolarHBondContact O-N 3.13Å; Q156-S158 VanDerWaalsContact C-N 3.3Å; Q156-S158 PolarHBondContact O-N 2.99Å; S158-K162 WeakPolarHBondContact O-CB 3.28Å; S158-K162 PolarHBondContact O-N 2.88Å |
| 159 | V | 89.9 | Confident | 83.2 | Confident | 59 Ų | 59 | 127.9 Ų | 127.9 | 36% | 0.358 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.9 | -49.2 | 176.9 | -176.5 | 0 | 0 | 0 | 0 | 110.2 | A154 A155 Q156 L161 K162 E163 | A154-V159 HydrophobicContact CB-CG2 3.65Å; A155-V159 PolarHBondContact O-N 3.13Å; Q156-V159 PolarHBondContact O-N 3.26Å; V159-L161 VanDerWaalsContact C-N 3.35Å; V159-L161 PolarHBondContact O-N 3.46Å; V159-K162 WeakPolarHBondContact O-CB 3.42Å; V159-K162 PolarHBondContact O-N 3.1Å; V159-E163 WeakPolarHBondContact CG1-OE1 3.22Å; V159-E163 WeakPolarHBondContact O-CG 3.34Å; V159-E163 PolarHBondContact O-N 3.49Å |
| 160 | A | 91.7 | Very high | 84.9 | Confident | 43 Ų | 43 | 120.3 Ų | 120.3 | 36% | 0.355 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -58.7 | -43 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q156 K162 E163 I164 | Q156-A160 PolarHBondContact O-N 3.37Å; Q156-A160 VanDerWaalsContact O-N 3.15Å; A160-K162 VanDerWaalsContact C-N 3.32Å; A160-K162 PolarHBondContact O-N 2.88Å; A160-E163 PolarHBondContact O-N 3.39Å; A160-I164 WeakPolarHBondContact O-CD1 3.37Å; A160-I164 VanDerWaalsContact O-CG1 3.24Å; A160-I164 WeakPolarHBondContact O-CG1 3.35Å; A160-I164 PolarHBondContact O-N 3.04Å |
| 161 | L | 93.1 | Very high | 86.6 | Confident | 76 Ų | 76 | 121.6 Ų | 121.6 | 40% | 0.398 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -66 | -33.7 | 176.2 | -72.9 | 174 | 0 | 0 | 0 | 112.8 | Y157 V159 R165 | Y157-L161 WeakPolarHBondContact O-CB 3.23Å; Y157-L161 VanDerWaalsContact O-CG 3.23Å; Y157-L161 WeakPolarHBondContact O-CG 3.39Å; Y157-L161 PolarHBondContact O-N 2.82Å; V159-L161 VanDerWaalsContact C-N 3.35Å; V159-L161 PolarHBondContact O-N 3.46Å; L161-R165 WeakPolarHBondContact O-CB 3.36Å; L161-R165 VanDerWaalsContact O-CG 3.22Å; L161-R165 WeakPolarHBondContact O-CG 3.39Å; L161-R165 PolarHBondContact O-N 3.42Å; L161-R165 VanDerWaalsContact O-N 3.15Å |
| 162 | K | 93.9 | Very high | 88.1 | Confident | 163 Ų | 163 | 117.4 Ų | 117.4 | 71% | 0.709 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -66 | -44.2 | 174.8 | -173.7 | -177.9 | 177.4 | -175.2 | 0 | 110.8 | S158 V159 A160 R165 A166 | S158-K162 WeakPolarHBondContact O-CB 3.28Å; S158-K162 PolarHBondContact O-N 2.88Å; V159-K162 WeakPolarHBondContact O-CB 3.42Å; V159-K162 PolarHBondContact O-N 3.1Å; A160-K162 VanDerWaalsContact C-N 3.32Å; A160-K162 PolarHBondContact O-N 2.88Å; K162-R165 PolarHBondContact O-N 2.83Å; K162-A166 WeakPolarHBondContact O-CB 3.19Å; K162-A166 PolarHBondContact O-N 3.22Å |
| 163 | E | 94.4 | Very high | 89.4 | Confident | 102 Ų | 102 | 110.3 Ų | 110.3 | 48% | 0.477 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63.7 | -48.1 | 177.2 | -71.6 | 171.8 | -169.1 | 0 | 0 | 111.8 | V159 A160 R165 A166 F167 | V159-E163 WeakPolarHBondContact CG1-OE1 3.22Å; V159-E163 WeakPolarHBondContact O-CG 3.34Å; V159-E163 PolarHBondContact O-N 3.49Å; A160-E163 PolarHBondContact O-N 3.39Å; E163-R165 VanDerWaalsContact C-N 3.3Å; E163-R165 PolarHBondContact O-N 3.08Å; E163-A166 WeakPolarHBondContact O-CB 3.43Å; E163-A166 PolarHBondContact O-N 3.35Å; E163-F167 HydrophobicContact CB-CD2 4.3Å; E163-F167 HydrophobicContact CB-CE2 4.01Å; E163-F167 WeakPolarHBondContact O-CD2 3.31Å; E163-F167 PolarHBondContact O-N 3.31Å |
| 164 | I | 94.4 | Very high | 90.7 | Very high | 84 Ų | 84 | 103.4 Ų | 103.4 | 43% | 0.431 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -55.1 | -47.1 | 176.4 | -68.6 | 163.8 | 0 | 0 | 0 | 110.7 | A160 A166 F167 Q168 | A160-I164 WeakPolarHBondContact O-CD1 3.37Å; A160-I164 VanDerWaalsContact O-CG1 3.24Å; A160-I164 WeakPolarHBondContact O-CG1 3.35Å; A160-I164 PolarHBondContact O-N 3.04Å; I164-A166 VanDerWaalsContact C-N 3.29Å; I164-A166 PolarHBondContact O-N 3.22Å; I164-F167 PolarHBondContact O-N 2.94Å; I164-Q168 HydrophobicContact CG2-CG 4.35Å; I164-Q168 WeakPolarHBondContact O-CB 3.32Å; I164-Q168 VanDerWaalsContact O-CG 3.26Å; I164-Q168 WeakPolarHBondContact O-CG 3.26Å; I164-Q168 PolarHBondContact O-N 3.44Å |
| 165 | R | 96 | Very high | 91.8 | Very high | 149 Ų | 149 | 104.1 Ų | 104.1 | 56% | 0.562 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -68.6 | -24.8 | 178.5 | -70.7 | 175.4 | -172.1 | -161.3 | 2.2 | 113.7 | L161 K162 E163 R169 | L161-R165 WeakPolarHBondContact O-CB 3.36Å; L161-R165 VanDerWaalsContact O-CG 3.22Å; L161-R165 WeakPolarHBondContact O-CG 3.39Å; L161-R165 PolarHBondContact O-N 3.42Å; L161-R165 VanDerWaalsContact O-N 3.15Å; K162-R165 PolarHBondContact O-N 2.83Å; E163-R165 VanDerWaalsContact C-N 3.3Å; E163-R165 PolarHBondContact O-N 3.08Å; R165-R169 VanDerWaalsContact O-CG 3.31Å; R165-R169 WeakPolarHBondContact O-CG 3.46Å; R165-R169 PolarHBondContact O-NH1 3.15Å |
| 166 | A | 96 | Very high | 92.9 | Very high | 50 Ų | 50 | 110.8 Ų | 110.8 | 41% | 0.413 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -75.8 | -51.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | K162 E163 I164 Q168 R169 S170 | K162-A166 WeakPolarHBondContact O-CB 3.19Å; K162-A166 PolarHBondContact O-N 3.22Å; E163-A166 WeakPolarHBondContact O-CB 3.43Å; E163-A166 PolarHBondContact O-N 3.35Å; I164-A166 VanDerWaalsContact C-N 3.29Å; I164-A166 PolarHBondContact O-N 3.22Å; A166-Q168 PolarHBondContact O-N 2.97Å; A166-R169 PolarHBondContact O-N 3.07Å; A166-R169 VanDerWaalsContact O-N 3.1Å; A166-S170 PolarHBondContact O-N 3.43Å; A166-S170 VanDerWaalsContact O-N 3.16Å; A166-S170 PolarHBondContact O-OG 3.05Å |
| 167 | F | 96.4 | Very high | 93.8 | Very high | 109 Ų | 109 | 109.2 Ų | 109.2 | 48% | 0.478 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.2 | -35.1 | -178.6 | -64.5 | -48.2 | 0 | 0 | 0 | 113.4 | E163 I164 R169 S170 L174 | E163-F167 HydrophobicContact CB-CD2 4.3Å; E163-F167 HydrophobicContact CB-CE2 4.01Å; E163-F167 WeakPolarHBondContact O-CD2 3.31Å; E163-F167 PolarHBondContact O-N 3.31Å; I164-F167 PolarHBondContact O-N 2.94Å; F167-R169 VanDerWaalsContact C-N 3.25Å; F167-R169 PolarHBondContact O-N 2.93Å; F167-S170 WeakPolarHBondContact CA-OG 3.36Å; F167-S170 PolarHBondContact O-N 3.37Å; F167-S170 PolarHBondContact O-OG 3.32Å; F167-L174 HydrophobicContact CD1-CD1 4.41Å; F167-L174 HydrophobicContact CD1-CD2 3.75Å; F167-L174 HydrophobicContact CE1-CD2 3.77Å |
| 168 | Q | 96.2 | Very high | 94.6 | Very high | 153 Ų | 153 | 105.9 Ų | 105.9 | 72% | 0.715 | 52% | 0.524 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -18.4 | 175.1 | -74.5 | 179.6 | -22.4 | 0 | 0 | 114.1 | I164 A166 | I164-Q168 HydrophobicContact CG2-CG 4.35Å; I164-Q168 WeakPolarHBondContact O-CB 3.32Å; I164-Q168 VanDerWaalsContact O-CG 3.26Å; I164-Q168 WeakPolarHBondContact O-CG 3.26Å; I164-Q168 PolarHBondContact O-N 3.44Å; A166-Q168 PolarHBondContact O-N 2.97Å |
| 169 | R | 96.4 | Very high | 95.1 | Very high | 195 Ų | 195 | 106 Ų | 106 | 74% | 0.736 | 52% | 0.523 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92 | -28.8 | 176.4 | -72.6 | -176.9 | -173.7 | 114.5 | -8.5 | 112.7 | R165 A166 F167 | R165-R169 VanDerWaalsContact O-CG 3.31Å; R165-R169 WeakPolarHBondContact O-CG 3.46Å; R165-R169 PolarHBondContact O-NH1 3.15Å; A166-R169 PolarHBondContact O-N 3.07Å; A166-R169 VanDerWaalsContact O-N 3.1Å; F167-R169 VanDerWaalsContact C-N 3.25Å; F167-R169 PolarHBondContact O-N 2.93Å |
| 170 | S | 95.4 | Very high | 95.5 | Very high | 38 Ų | 38 | 104.5 Ų | 104.5 | 27% | 0.266 | 51% | 0.512 | S | S | . | . | trans | -88.2 | 155.5 | 177.8 | 60.4 | 0 | 0 | 0 | 0 | 111.6 | A166 F167 | A166-S170 PolarHBondContact O-N 3.43Å; A166-S170 VanDerWaalsContact O-N 3.16Å; A166-S170 PolarHBondContact O-OG 3.05Å; F167-S170 WeakPolarHBondContact CA-OG 3.36Å; F167-S170 PolarHBondContact O-N 3.37Å; F167-S170 PolarHBondContact O-OG 3.32Å | ||
| 171 | T | 95.5 | Very high | 95.6 | Very high | 141 Ų | 141 | 103 Ų | 103 | 87% | 0.865 | 50% | 0.499 | S | S | * | . | trans | -116.3 | 21.8 | 171.7 | 58.1 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 172 | N | 95.1 | Very high | 95.7 | Very high | 116 Ų | 116 | 107.4 Ų | 107.4 | 62% | 0.62 | 51% | 0.511 | S | S | * | . | trans | -75.9 | 139 | -175.9 | -47.5 | -32.6 | 0 | 0 | 0 | 109.5 | L174 | N172-L174 PolarHBondContact O-N 3.4Š| ||
| 173 | L | 95.5 | Very high | 95.8 | Very high | 58 Ų | 58 | 104.1 Ų | 104.1 | 30% | 0.304 | 50% | 0.5 | S | S | . | . | trans | -63.2 | 132.3 | 171.5 | -65.3 | 175.1 | 0 | 0 | 0 | 110.8 | Q210 E211 E214 | L173-Q210 HydrophobicContact CD1-CG 4.16Å; L173-Q210 HydrophobicContact CD2-CG 4.35Å; L173-E211 HydrophobicContact CD1-CG 4.38Å; L173-E211 HydrophobicContact CD2-CG 3.88Å; L173-E214 WeakPolarHBondContact CA-OE2 3.44Å | ||
| 174 | L | 96.2 | Very high | 95.8 | Very high | 101 Ų | 101 | 100 Ų | 100 | 53% | 0.529 | 48% | 0.482 | S | S | . | . | trans | -95.6 | -25.1 | -174 | -58.7 | -177.8 | 0 | 0 | 0 | 112.7 | F167 N172 E214 | F167-L174 HydrophobicContact CD1-CD1 4.41Å; F167-L174 HydrophobicContact CD1-CD2 3.75Å; F167-L174 HydrophobicContact CE1-CD2 3.77Å; N172-L174 PolarHBondContact O-N 3.4Å; L174-E214 PolarHBondContact N-OE1 3.28Å; L174-E214 PolarHBondContact N-OE2 2.86Å | ||
| 175 | L | 95.9 | Very high | 95.8 | Very high | 76 Ų | 76 | 101.4 Ų | 101.4 | 40% | 0.398 | 48% | 0.482 | S | S | . | . | S | Bend | trans | -79.7 | 141 | 177.1 | -59.9 | 175.7 | 0 | 0 | 0 | 111 | K177 F180 Q210 E214 | L175-K177 PolarHBondContact O-N 3.07Å; L175-F180 HydrophobicContact CD1-CD2 4.22Å; L175-Q210 PolarHBondContact O-NE2 3.4Å; L175-E214 VanDerWaalsContact CB-OE1 3.26Å; L175-E214 WeakPolarHBondContact CB-OE1 3.5Å; L175-E214 HydrophobicContact CD1-CG 3.73Å; L175-E214 HydrophobicContact CG-CG 3.9Å; L175-E214 WeakPolarHBondContact CG-OE1 3.24Å; L175-E214 PolarHBondContact N-OE1 3.32Å |
| 176 | R | 97 | Very high | 95.6 | Very high | 207 Ų | 207 | 97.4 Ų | 97.4 | 78% | 0.781 | 48% | 0.477 | S | S | * | . | trans | -67.9 | 127.5 | 174 | -66.8 | -176.6 | 178.9 | -173 | -0.4 | 109.7 | L178 P179 F180 | R176-L178 PolarHBondContact O-N 2.87Å; R176-P179 HydrophobicContact CB-CG 3.94Å; R176-P179 WeakPolarHBondContact O-CD 3.38Å; R176-F180 PolarHBondContact O-N 2.95Å | ||
| 177 | K | 95.2 | Very high | 95.4 | Very high | 127 Ų | 127 | 98.2 Ų | 98.2 | 55% | 0.552 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -57.9 | -46.4 | -174.9 | -61.6 | -178.7 | -175.2 | -110.2 | 0 | 113.7 | L175 F180 A181 | L175-K177 PolarHBondContact O-N 3.07Å; K177-F180 PolarHBondContact O-N 3.41Å; K177-A181 WeakPolarHBondContact O-CB 3.43Å; K177-A181 PolarHBondContact O-N 3.15Å |
| 178 | L | 95.5 | Very high | 95.1 | Very high | 104 Ų | 104 | 93.7 Ų | 93.7 | 55% | 0.545 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.8 | -49 | -175.2 | 176.5 | 65.9 | 0 | 0 | 0 | 113.6 | R176 F180 A181 R182 | R176-L178 PolarHBondContact O-N 2.87Å; L178-F180 VanDerWaalsContact C-N 3.31Å; L178-F180 PolarHBondContact O-N 3.31Å; L178-A181 PolarHBondContact O-N 3.46Å; L178-R182 WeakPolarHBondContact O-CG 3.5Å; L178-R182 PolarHBondContact O-N 3.39Å |
| 179 | P | 97.5 | Very high | 94.9 | Very high | 76 Ų | 76 | 89.5 Ų | 89.5 | 49% | 0.494 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -57.8 | -41 | 172.6 | -27.5 | 35.2 | 0 | 0 | 0 | 113.5 | R176 R182 L183 | R176-P179 HydrophobicContact CB-CG 3.94Å; R176-P179 WeakPolarHBondContact O-CD 3.38Å; P179-R182 PolarHBondContact O-N 3.01Å; P179-L183 PolarHBondContact O-N 3.1Å |
| 180 | F | 97.3 | Very high | 94.4 | Very high | 27 Ų | 27 | 88.4 Ų | 88.4 | 12% | 0.118 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -62.4 | -46.8 | 177.2 | -177.4 | -98.4 | 0 | 0 | 0 | 111.6 | L175 R176 K177 L178 R182 L183 V184 L209 Q210 A213 | L175-F180 HydrophobicContact CD1-CD2 4.22Å; R176-F180 PolarHBondContact O-N 2.95Å; K177-F180 PolarHBondContact O-N 3.41Å; L178-F180 VanDerWaalsContact C-N 3.31Å; L178-F180 PolarHBondContact O-N 3.31Å; F180-R182 VanDerWaalsContact C-N 3.32Å; F180-R182 PolarHBondContact O-N 3.45Å; F180-L183 WeakPolarHBondContact O-CB 3.26Å; F180-L183 PolarHBondContact O-N 3.02Å; F180-L183 VanDerWaalsContact O-N 3.12Å; F180-V184 HydrophobicContact CD1-CG2 4.09Å; F180-V184 HydrophobicContact CE1-CG2 3.67Å; F180-V184 HydrophobicContact CE2-CG2 4.43Å; F180-V184 HydrophobicContact CZ-CG2 3.86Å; F180-V184 WeakPolarHBondContact O-CG2 3.45Å; F180-V184 PolarHBondContact O-N 3.47Å; F180-L209 HydrophobicContact CE1-CB 4.02Å; F180-L209 HydrophobicContact CZ-CB 4.12Å; F180-Q210 HydrophobicContact CD1-CB 3.82Å; F180-Q210 HydrophobicContact CD1-CG 4.16Å; F180-Q210 HydrophobicContact CE1-CB 3.56Å; F180-Q210 HydrophobicContact CE1-CG 4.25Å; F180-Q210 HydrophobicContact CG-CB 4.49Å; F180-Q210 HydrophobicContact CG-CG 4.36Å; F180-Q210 HydrophobicContact CZ-CB 4.02Å; F180-A213 HydrophobicContact CE2-CB 4.03Å; F180-A213 HydrophobicContact CZ-CB 4.17Å |
| 181 | A | 95.3 | Very high | 94 | Very high | 12 Ų | 12 | 91.3 Ų | 91.3 | 10% | 0.099 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -60.9 | -38.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K177 L178 V184 R185 F206 | K177-A181 WeakPolarHBondContact O-CB 3.43Å; K177-A181 PolarHBondContact O-N 3.15Å; L178-A181 PolarHBondContact O-N 3.46Å; A181-V184 PolarHBondContact O-N 3.14Å; A181-R185 WeakPolarHBondContact O-CG 3.49Å; A181-R185 PolarHBondContact O-N 3.45Å; A181-R185 VanDerWaalsContact O-N 3.1Å; A181-F206 HydrophobicContact CB-CD1 3.84Å; A181-F206 HydrophobicContact CB-CE1 3.97Å; A181-F206 HydrophobicContact CB-CG 4.25Å; A181-F206 HydrophobicContact CB-CZ 4.47Å |
| 182 | R | 95.1 | Very high | 93.5 | Very high | 167 Ų | 167 | 88.1 Ų | 88.1 | 63% | 0.63 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -63.6 | -41.5 | 173.8 | -72.2 | 179.9 | 178.7 | -174.8 | -0.7 | 111.8 | L178 P179 F180 R185 S186 | L178-R182 WeakPolarHBondContact O-CG 3.5Å; L178-R182 PolarHBondContact O-N 3.39Å; P179-R182 PolarHBondContact O-N 3.01Å; F180-R182 VanDerWaalsContact C-N 3.32Å; F180-R182 PolarHBondContact O-N 3.45Å; R182-R185 PolarHBondContact O-N 3Å; R182-S186 WeakPolarHBondContact O-CB 3.48Å; R182-S186 PolarHBondContact O-N 3.05Å |
| 183 | L | 96.1 | Very high | 92.8 | Very high | 95 Ų | 95 | 83.9 Ų | 83.9 | 50% | 0.497 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -62.7 | -47.3 | 176.4 | 178.4 | 65.2 | 0 | 0 | 0 | 111.6 | P179 F180 R185 S186 I187 | P179-L183 PolarHBondContact O-N 3.1Å; F180-L183 WeakPolarHBondContact O-CB 3.26Å; F180-L183 PolarHBondContact O-N 3.02Å; F180-L183 VanDerWaalsContact O-N 3.12Å; L183-R185 VanDerWaalsContact C-N 3.32Å; L183-R185 PolarHBondContact O-N 3.31Å; L183-S186 WeakPolarHBondContact O-CB 3.33Å; L183-S186 PolarHBondContact O-N 3.37Å; L183-S186 VanDerWaalsContact O-N 3.13Å; L183-I187 HydrophobicContact CD1-CD1 4.16Å; L183-I187 HydrophobicContact CD1-CG1 4.34Å; L183-I187 HydrophobicContact CG-CD1 3.95Å; L183-I187 WeakPolarHBondContact O-CG1 3.31Å; L183-I187 PolarHBondContact O-N 2.92Å |
| 184 | V | 94.5 | Very high | 91.8 | Very high | 15 Ų | 15 | 86.4 Ų | 86.4 | 9% | 0.091 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -57.8 | -46.1 | 177.9 | 172.2 | 0 | 0 | 0 | 0 | 110.6 | F180 A181 S186 I187 T188 W201 F206 L209 | F180-V184 HydrophobicContact CD1-CG2 4.09Å; F180-V184 HydrophobicContact CE1-CG2 3.67Å; F180-V184 HydrophobicContact CE2-CG2 4.43Å; F180-V184 HydrophobicContact CZ-CG2 3.86Å; F180-V184 WeakPolarHBondContact O-CG2 3.45Å; F180-V184 PolarHBondContact O-N 3.47Å; A181-V184 PolarHBondContact O-N 3.14Å; V184-S186 PolarHBondContact O-N 3.19Å; V184-I187 PolarHBondContact O-N 2.77Å; V184-T188 WeakPolarHBondContact O-CB 3.15Å; V184-T188 PolarHBondContact O-N 3.5Å; V184-T188 PolarHBondContact O-OG1 3.34Å; V184-W201 HydrophobicContact CG1-CH2 3.84Å; V184-W201 HydrophobicContact CG1-CZ2 4.28Å; V184-W201 HydrophobicContact CG1-CZ3 3.99Å; V184-F206 HydrophobicContact CB-CD1 4.34Å; V184-F206 HydrophobicContact CB-CE1 4.13Å; V184-F206 HydrophobicContact CG1-CD1 4.32Å; V184-F206 HydrophobicContact CG1-CE1 4Å; V184-L209 HydrophobicContact CG1-CD1 3.83Å; V184-L209 HydrophobicContact CG2-CD1 4.37Å |
| 185 | R | 92.9 | Very high | 90.8 | Very high | 114 Ų | 114 | 84.4 Ų | 84.4 | 43% | 0.43 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -62.4 | -41.8 | 175.7 | -69.8 | -179.6 | -173.7 | 122.9 | -2 | 112.2 | A181 R182 L183 I187 T188 V189 F206 | A181-R185 WeakPolarHBondContact O-CG 3.49Å; A181-R185 PolarHBondContact O-N 3.45Å; A181-R185 VanDerWaalsContact O-N 3.1Å; R182-R185 PolarHBondContact O-N 3Å; L183-R185 VanDerWaalsContact C-N 3.32Å; L183-R185 PolarHBondContact O-N 3.31Å; R185-I187 PolarHBondContact O-N 3.19Å; R185-T188 WeakPolarHBondContact O-CB 3.32Å; R185-T188 PolarHBondContact O-N 2.92Å; R185-V189 VanDerWaalsContact O-CG2 3.3Å; R185-V189 WeakPolarHBondContact O-CG2 3.41Å; R185-V189 PolarHBondContact O-N 3.22Å; R185-F206 HydrophobicContact CG-CE1 4.45Å; R185-F206 HydrophobicContact CG-CZ 4.36Å |
| 186 | S | 92.1 | Very high | 89.9 | Confident | 64 Ų | 64 | 85.6 Ų | 85.6 | 45% | 0.448 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -61.4 | -41.8 | 176.2 | 175.6 | 0 | 0 | 0 | 0 | 112.6 | R182 L183 V184 R190 | R182-S186 WeakPolarHBondContact O-CB 3.48Å; R182-S186 PolarHBondContact O-N 3.05Å; L183-S186 WeakPolarHBondContact O-CB 3.33Å; L183-S186 PolarHBondContact O-N 3.37Å; L183-S186 VanDerWaalsContact O-N 3.13Å; V184-S186 PolarHBondContact O-N 3.19Å; S186-R190 PolarHBondContact O-N 3.36Å |
| 187 | I | 92 | Very high | 88.8 | Confident | 68 Ų | 68 | 81.8 Ų | 81.8 | 35% | 0.349 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.2 | -46.2 | 174.9 | -65.6 | 166.9 | 0 | 0 | 0 | 110 | L183 V184 R185 V189 R190 T191 | L183-I187 HydrophobicContact CD1-CD1 4.16Å; L183-I187 HydrophobicContact CD1-CG1 4.34Å; L183-I187 HydrophobicContact CG-CD1 3.95Å; L183-I187 WeakPolarHBondContact O-CG1 3.31Å; L183-I187 PolarHBondContact O-N 2.92Å; V184-I187 PolarHBondContact O-N 2.77Å; R185-I187 PolarHBondContact O-N 3.19Å; I187-V189 VanDerWaalsContact C-N 3.34Å; I187-V189 PolarHBondContact O-N 3.35Å; I187-R190 CarbonylContact O-C 3.58Å; I187-R190 WeakPolarHBondContact O-CA 3.37Å; I187-R190 WeakPolarHBondContact O-CB 3.24Å; I187-R190 PolarHBondContact O-N 2.92Å; I187-T191 HydrophobicContact CG2-CG2 4.12Å; I187-T191 WeakPolarHBondContact O-CG2 3.43Å; I187-T191 PolarHBondContact O-N 2.85Å; I187-T191 PolarHBondContact O-OG1 3.5Å |
| 188 | T | 91.4 | Very high | 88.1 | Confident | 14 Ų | 14 | 79.5 Ų | 79.5 | 9% | 0.086 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -56.7 | -46.8 | 179.7 | -57 | 0 | 0 | 0 | 0 | 111.7 | V184 R185 R190 T191 L192 W201 | V184-T188 WeakPolarHBondContact O-CB 3.15Å; V184-T188 PolarHBondContact O-N 3.5Å; V184-T188 PolarHBondContact O-OG1 3.34Å; R185-T188 WeakPolarHBondContact O-CB 3.32Å; R185-T188 PolarHBondContact O-N 2.92Å; T188-R190 VanDerWaalsContact C-N 3.29Å; T188-R190 PolarHBondContact O-N 3.22Å; T188-T191 WeakPolarHBondContact CA-OG1 3.28Å; T188-T191 PolarHBondContact O-N 3.35Å; T188-T191 PolarHBondContact O-OG1 2.9Å; T188-T191 VanDerWaalsContact O-OG1 3.09Å; T188-L192 HydrophobicContact CG2-CD1 3.39Å; T188-L192 WeakPolarHBondContact O-CB 3.32Å; T188-L192 PolarHBondContact O-N 2.97Å; T188-W201 HydrophobicContact CG2-CZ2 3.65Å; T188-W201 WeakPolarHBondContact OG1-CZ2 3.45Å |
| 189 | V | 90.5 | Very high | 87.5 | Confident | 64 Ų | 64 | 79.4 Ų | 79.4 | 39% | 0.388 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -59.8 | -41.1 | 176.1 | 171.9 | 0 | 0 | 0 | 0 | 110.9 | R185 I187 G193 Y196 | R185-V189 VanDerWaalsContact O-CG2 3.3Å; R185-V189 WeakPolarHBondContact O-CG2 3.41Å; R185-V189 PolarHBondContact O-N 3.22Å; I187-V189 VanDerWaalsContact C-N 3.34Å; I187-V189 PolarHBondContact O-N 3.35Å; V189-G193 WeakPolarHBondContact O-CA 3.49Å; V189-G193 PolarHBondContact O-N 3.34Å; V189-G193 VanDerWaalsContact O-N 3.13Å; V189-Y196 HydrophobicContact CG1-CD1 4.3Å; V189-Y196 HydrophobicContact CG2-CD1 4.26Å; V189-Y196 HydrophobicContact CG2-CD2 3.9Å; V189-Y196 HydrophobicContact CG2-CE2 4.39Å; V189-Y196 HydrophobicContact CG2-CG 3.84Å |
| 190 | R | 86.9 | Confident | 87.1 | Confident | 172 Ų | 172 | 84.3 Ų | 84.3 | 65% | 0.649 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -68.7 | -34 | 177.6 | -177.1 | 170.2 | 61 | -113.4 | 2 | 113.1 | S186 I187 T188 | S186-R190 PolarHBondContact O-N 3.36Å; I187-R190 CarbonylContact O-C 3.58Å; I187-R190 WeakPolarHBondContact O-CA 3.37Å; I187-R190 WeakPolarHBondContact O-CB 3.24Å; I187-R190 PolarHBondContact O-N 2.92Å; T188-R190 VanDerWaalsContact C-N 3.29Å; T188-R190 PolarHBondContact O-N 3.22Å |
| 191 | T | 85.6 | Confident | 86.8 | Confident | 99 Ų | 99 | 87.3 Ų | 87.3 | 61% | 0.607 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -86.6 | -36.3 | -176.4 | 53.6 | 0 | 0 | 0 | 0 | 113.6 | I187 T188 | I187-T191 HydrophobicContact CG2-CG2 4.12Å; I187-T191 WeakPolarHBondContact O-CG2 3.43Å; I187-T191 PolarHBondContact O-N 2.85Å; I187-T191 PolarHBondContact O-OG1 3.5Å; T188-T191 WeakPolarHBondContact CA-OG1 3.28Å; T188-T191 PolarHBondContact O-N 3.35Å; T188-T191 PolarHBondContact O-OG1 2.9Å; T188-T191 VanDerWaalsContact O-OG1 3.09Å |
| 192 | L | 85.1 | Confident | 86.7 | Confident | 74 Ų | 74 | 93.3 Ų | 93.3 | 39% | 0.387 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -99.4 | -9.5 | -174.8 | -73.3 | 139.7 | 0 | 0 | 0 | 113.3 | T188 S195 F199 | T188-L192 HydrophobicContact CG2-CD1 3.39Å; T188-L192 WeakPolarHBondContact O-CB 3.32Å; T188-L192 PolarHBondContact O-N 2.97Å; L192-S195 WeakPolarHBondContact O-CB 3.21Å; L192-S195 PolarHBondContact O-N 3.18Å; L192-F199 HydrophobicContact CD1-CE2 4.44Å; L192-F199 HydrophobicContact CD2-CE2 3.88Å; L192-F199 HydrophobicContact CD2-CZ 4.06Å |
| 193 | G | 80.7 | Confident | 86.6 | Confident | 28 Ų | 28 | 89.3 Ų | 89.3 | 29% | 0.289 | 47% | 0.472 | S | S | . | . | G | 310 helix | trans | 56.7 | -149.3 | -177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | V189 S195 Y196 | V189-G193 WeakPolarHBondContact O-CA 3.49Å; V189-G193 PolarHBondContact O-N 3.34Å; V189-G193 VanDerWaalsContact O-N 3.13Å; G193-S195 PolarHBondContact O-N 3.41Å; G193-Y196 WeakPolarHBondContact O-CB 3.46Å; G193-Y196 VanDerWaalsContact O-CD1 3.23Å; G193-Y196 WeakPolarHBondContact O-CD1 3.43Å; G193-Y196 PolarHBondContact O-N 3.01Å |
| 194 | P | 74.7 | Confident | 86.6 | Confident | 111 Ų | 111 | 90.4 Ų | 90.4 | 72% | 0.721 | 48% | 0.477 | S | S | * | . | G | 310 helix | trans | -60.3 | -15.7 | -173.8 | 25.4 | -33.8 | 0 | 0 | 0 | 114.2 | Y196 L197 | P194-Y196 PolarHBondContact O-N 2.88Å; P194-Y196 VanDerWaalsContact O-N 3.13Å; P194-L197 PolarHBondContact O-N 3.03Å |
| 195 | S | 76.5 | Confident | 86.6 | Confident | 59 Ų | 59 | 91.7 Ų | 91.7 | 41% | 0.413 | 49% | 0.486 | S | S | . | . | G | 310 helix | trans | -63.4 | -13 | 172 | -167.5 | 0 | 0 | 0 | 0 | 113.1 | L192 G193 L197 S198 F199 | L192-S195 WeakPolarHBondContact O-CB 3.21Å; L192-S195 PolarHBondContact O-N 3.18Å; G193-S195 PolarHBondContact O-N 3.41Å; S195-L197 PolarHBondContact O-N 3.17Å; S195-L197 VanDerWaalsContact O-N 3.16Å; S195-S198 PolarHBondContact O-N 3.45Å; S195-S198 PolarHBondContact O-OG 2.88Å; S195-F199 WeakPolarHBondContact O-CD2 3.45Å; S195-F199 WeakPolarHBondContact O-CE2 3.35Å |
| 196 | Y | 75.5 | Confident | 86.7 | Confident | 101 Ų | 101 | 87.4 Ų | 87.4 | 40% | 0.396 | 47% | 0.471 | S | S | . | . | G | 310 helix | trans | -57.6 | -29.2 | 178.3 | 84.3 | -92.7 | 0 | 0 | 0 | 113.4 | V189 G193 P194 S198 F199 | V189-Y196 HydrophobicContact CG1-CD1 4.3Å; V189-Y196 HydrophobicContact CG2-CD1 4.26Å; V189-Y196 HydrophobicContact CG2-CD2 3.9Å; V189-Y196 HydrophobicContact CG2-CE2 4.39Å; V189-Y196 HydrophobicContact CG2-CG 3.84Å; G193-Y196 WeakPolarHBondContact O-CB 3.46Å; G193-Y196 VanDerWaalsContact O-CD1 3.23Å; G193-Y196 WeakPolarHBondContact O-CD1 3.43Å; G193-Y196 PolarHBondContact O-N 3.01Å; P194-Y196 PolarHBondContact O-N 2.88Å; P194-Y196 VanDerWaalsContact O-N 3.13Å; Y196-S198 PolarHBondContact O-N 3.35Å; Y196-F199 PolarHBondContact O-N 2.74Å; Y196-F199 VanDerWaalsContact O-N 3.11Å |
| 197 | L | 74.5 | Confident | 86.9 | Confident | 126 Ų | 126 | 87.3 Ų | 87.3 | 66% | 0.66 | 47% | 0.465 | S | S | * | . | G | 310 helix | trans | -63.8 | -23 | -177 | -74.5 | 155.4 | 0 | 0 | 0 | 112.8 | P194 S195 | P194-L197 PolarHBondContact O-N 3.03Å; S195-L197 PolarHBondContact O-N 3.17Å; S195-L197 VanDerWaalsContact O-N 3.16Å |
| 198 | S | 80 | Confident | 87.1 | Confident | 79 Ų | 79 | 86.9 Ų | 86.9 | 55% | 0.552 | 47% | 0.472 | S | S | * | . | G | 310 helix | trans | -85.6 | -8.5 | 177.8 | 61.2 | 0 | 0 | 0 | 0 | 113.8 | S195 Y196 | S195-S198 PolarHBondContact O-N 3.45Å; S195-S198 PolarHBondContact O-OG 2.88Å; Y196-S198 PolarHBondContact O-N 3.35Å |
| 199 | F | 83.8 | Confident | 87.4 | Confident | 103 Ų | 103 | 89.6 Ų | 89.6 | 45% | 0.452 | 49% | 0.485 | S | S | . | . | trans | -95.9 | 126.7 | -173.6 | -72.5 | -83.7 | 0 | 0 | 0 | 113 | L192 S195 Y196 | L192-F199 HydrophobicContact CD1-CE2 4.44Å; L192-F199 HydrophobicContact CD2-CE2 3.88Å; L192-F199 HydrophobicContact CD2-CZ 4.06Å; S195-F199 WeakPolarHBondContact O-CD2 3.45Å; S195-F199 WeakPolarHBondContact O-CE2 3.35Å; Y196-F199 PolarHBondContact O-N 2.74Å; Y196-F199 VanDerWaalsContact O-N 3.11Å | ||
| 200 | H | 88.7 | Confident | 87.7 | Confident | 179 Ų | 179 | 86.7 Ų | 86.7 | 83% | 0.829 | 47% | 0.467 | S | S | * | . | trans | -105.6 | 129.4 | 170.5 | -61.2 | 81.5 | 0 | 0 | 0 | 109.4 | ||||
| 201 | W | 90.4 | Very high | 88.2 | Confident | 90 Ų | 90 | 84.2 Ų | 84.2 | 34% | 0.341 | 46% | 0.463 | S | S | . | . | trans | -92.7 | 127.9 | -179.4 | -72.2 | 84.1 | 0 | 0 | 0 | 111.4 | V184 T188 C205 F206 L209 | V184-W201 HydrophobicContact CG1-CH2 3.84Å; V184-W201 HydrophobicContact CG1-CZ2 4.28Å; V184-W201 HydrophobicContact CG1-CZ3 3.99Å; T188-W201 HydrophobicContact CG2-CZ2 3.65Å; T188-W201 WeakPolarHBondContact OG1-CZ2 3.45Å; W201-C205 HydrophobicContact CE3-CB 4.31Å; W201-C205 WeakPolarHBondContact CZ3-SG 3.3Å; W201-F206 HydrophobicContact CB-CE2 3.45Å; W201-F206 VanDerWaalsContact CB-CE2 3.45Å; W201-F206 HydrophobicContact CB-CZ 3.48Å; W201-F206 VanDerWaalsContact CB-CZ 3.48Å; W201-F206 HydrophobicContact CD2-CE1 4.16Å; W201-F206 HydrophobicContact CD2-CE2 4.49Å; W201-F206 AromaticContact CD2-CZ 3.79Å; W201-F206 HydrophobicContact CD2-CZ 3.79Å; W201-F206 HydrophobicContact CE3-CE1 4.07Å; W201-F206 AromaticContact CE3-CZ 4Å; W201-F206 HydrophobicContact CE3-CZ 4Å; W201-F206 HydrophobicContact CG-CE1 4.38Å; W201-F206 HydrophobicContact CG-CE2 4.07Å; W201-F206 AromaticContact CG-CZ 3.56Å; W201-F206 HydrophobicContact CG-CZ 3.56Å; W201-L209 HydrophobicContact CZ3-CD1 3.97Å | ||
| 202 | Q | 94.5 | Very high | 88.8 | Confident | 137 Ų | 137 | 82.6 Ų | 82.6 | 64% | 0.64 | 46% | 0.46 | S | S | * | . | trans | -73.7 | 143.9 | 166.8 | -67.2 | -179.7 | -17.1 | 0 | 0 | 110.7 | I204 C205 | Q202-I204 VanDerWaalsContact C-N 3.28Å; Q202-I204 HydrophobicContact CB-CG2 4.41Å; Q202-I204 PolarHBondContact O-N 2.83Å; Q202-C205 HydrophobicContact CB-CB 4.39Å; Q202-C205 WeakPolarHBondContact O-CB 3.42Å; Q202-C205 PolarHBondContact O-N 2.72Å | ||
| 203 | A | 92 | Very high | 89.3 | Confident | 83 Ų | 83 | 80.5 Ų | 80.5 | 69% | 0.686 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -60.5 | -37.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | C205 F206 | A203-C205 VanDerWaalsContact C-N 3.26Å; A203-C205 PolarHBondContact O-N 2.8Å; A203-F206 PolarHBondContact O-N 3.16Å |
| 204 | I | 95.5 | Very high | 90.1 | Very high | 119 Ų | 119 | 80.1 Ų | 80.1 | 61% | 0.61 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -66.5 | -28.5 | -179.3 | -147.8 | 162 | 0 | 0 | 0 | 112.5 | Q202 F206 L207 A208 | Q202-I204 VanDerWaalsContact C-N 3.28Å; Q202-I204 HydrophobicContact CB-CG2 4.41Å; Q202-I204 PolarHBondContact O-N 2.83Å; I204-F206 VanDerWaalsContact C-N 3.33Å; I204-F206 PolarHBondContact O-N 2.8Å; I204-L207 PolarHBondContact O-N 2.9Å; I204-A208 PolarHBondContact O-N 3.43Å |
| 205 | C | 95.3 | Very high | 91.2 | Very high | 42 Ų | 42 | 78 Ų | 78 | 28% | 0.284 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -63.4 | -41 | 178 | -176.7 | 0 | 0 | 0 | 0 | 111.2 | W201 Q202 A203 L207 A208 L209 | W201-C205 HydrophobicContact CE3-CB 4.31Å; W201-C205 WeakPolarHBondContact CZ3-SG 3.3Å; Q202-C205 HydrophobicContact CB-CB 4.39Å; Q202-C205 WeakPolarHBondContact O-CB 3.42Å; Q202-C205 PolarHBondContact O-N 2.72Å; A203-C205 VanDerWaalsContact C-N 3.26Å; A203-C205 PolarHBondContact O-N 2.8Å; C205-L207 VanDerWaalsContact C-N 3.3Å; C205-L207 PolarHBondContact O-N 2.88Å; C205-A208 PolarHBondContact O-N 3.32Å; C205-L209 WeakPolarHBondContact O-CB 3.45Å; C205-L209 WeakPolarHBondContact O-CG 3.47Å; C205-L209 PolarHBondContact O-N 3.46Å |
| 206 | F | 95.7 | Very high | 92.1 | Very high | 23 Ų | 23 | 79.8 Ų | 79.8 | 10% | 0.101 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -63.6 | -36.6 | 175.7 | -66.2 | -68.3 | 0 | 0 | 0 | 112.2 | A181 V184 R185 W201 A203 I204 Q210 | A181-F206 HydrophobicContact CB-CD1 3.84Å; A181-F206 HydrophobicContact CB-CE1 3.97Å; A181-F206 HydrophobicContact CB-CG 4.25Å; A181-F206 HydrophobicContact CB-CZ 4.47Å; V184-F206 HydrophobicContact CB-CD1 4.34Å; V184-F206 HydrophobicContact CB-CE1 4.13Å; V184-F206 HydrophobicContact CG1-CD1 4.32Å; V184-F206 HydrophobicContact CG1-CE1 4Å; R185-F206 HydrophobicContact CG-CE1 4.45Å; R185-F206 HydrophobicContact CG-CZ 4.36Å; W201-F206 HydrophobicContact CB-CE2 3.45Å; W201-F206 VanDerWaalsContact CB-CE2 3.45Å; W201-F206 HydrophobicContact CB-CZ 3.48Å; W201-F206 VanDerWaalsContact CB-CZ 3.48Å; W201-F206 HydrophobicContact CD2-CE1 4.16Å; W201-F206 HydrophobicContact CD2-CE2 4.49Å; W201-F206 AromaticContact CD2-CZ 3.79Å; W201-F206 HydrophobicContact CD2-CZ 3.79Å; W201-F206 HydrophobicContact CE3-CE1 4.07Å; W201-F206 AromaticContact CE3-CZ 4Å; W201-F206 HydrophobicContact CE3-CZ 4Å; W201-F206 HydrophobicContact CG-CE1 4.38Å; W201-F206 HydrophobicContact CG-CE2 4.07Å; W201-F206 AromaticContact CG-CZ 3.56Å; W201-F206 HydrophobicContact CG-CZ 3.56Å; A203-F206 PolarHBondContact O-N 3.16Å; I204-F206 VanDerWaalsContact C-N 3.33Å; I204-F206 PolarHBondContact O-N 2.8Å; F206-Q210 WeakPolarHBondContact O-CB 3.29Å; F206-Q210 PolarHBondContact O-N 2.88Å |
| 207 | L | 95.9 | Very high | 93 | Very high | 63 Ų | 63 | 78.3 Ų | 78.3 | 33% | 0.33 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -67 | -47.8 | 176.3 | -63.7 | 177.9 | 0 | 0 | 0 | 111.4 | I204 C205 L209 Q210 E211 | I204-L207 PolarHBondContact O-N 2.9Å; C205-L207 VanDerWaalsContact C-N 3.3Å; C205-L207 PolarHBondContact O-N 2.88Å; L207-L209 PolarHBondContact O-N 3.04Å; L207-Q210 PolarHBondContact O-N 3.01Å; L207-Q210 VanDerWaalsContact O-N 3.14Å; L207-E211 PolarHBondContact O-N 3.01Å |
| 208 | A | 96.9 | Very high | 94.1 | Very high | 59 Ų | 59 | 75.9 Ų | 75.9 | 49% | 0.488 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.8 | -44.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | I204 C205 Q210 E211 A212 | I204-A208 PolarHBondContact O-N 3.43Å; C205-A208 PolarHBondContact O-N 3.32Å; A208-Q210 VanDerWaalsContact C-N 3.32Å; A208-Q210 PolarHBondContact O-N 3.39Å; A208-E211 PolarHBondContact O-N 3.21Å; A208-A212 WeakPolarHBondContact O-CB 3.38Å; A208-A212 PolarHBondContact O-N 3.24Å |
| 209 | L | 96.9 | Very high | 94.8 | Very high | 71 Ų | 71 | 76.4 Ų | 76.4 | 37% | 0.372 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -63.6 | -38.5 | 175 | -73.2 | 175.9 | 0 | 0 | 0 | 111.9 | F180 V184 W201 C205 L207 A213 | F180-L209 HydrophobicContact CE1-CB 4.02Å; F180-L209 HydrophobicContact CZ-CB 4.12Å; V184-L209 HydrophobicContact CG1-CD1 3.83Å; V184-L209 HydrophobicContact CG2-CD1 4.37Å; W201-L209 HydrophobicContact CZ3-CD1 3.97Å; C205-L209 WeakPolarHBondContact O-CB 3.45Å; C205-L209 WeakPolarHBondContact O-CG 3.47Å; C205-L209 PolarHBondContact O-N 3.46Å; L207-L209 PolarHBondContact O-N 3.04Å; L209-A213 WeakPolarHBondContact O-CB 3.31Å; L209-A213 PolarHBondContact O-N 2.96Å |
| 210 | Q | 97.1 | Very high | 95.4 | Very high | 2 Ų | 2 | 72.5 Ų | 72.5 | 1% | 0.009 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -68.1 | -45.7 | 179 | -172.2 | 174.4 | -19.1 | 0 | 0 | 111.5 | L173 L175 F180 F206 L207 A208 A212 A213 E214 | L173-Q210 HydrophobicContact CD1-CG 4.16Å; L173-Q210 HydrophobicContact CD2-CG 4.35Å; L175-Q210 PolarHBondContact O-NE2 3.4Å; F180-Q210 HydrophobicContact CD1-CB 3.82Å; F180-Q210 HydrophobicContact CD1-CG 4.16Å; F180-Q210 HydrophobicContact CE1-CB 3.56Å; F180-Q210 HydrophobicContact CE1-CG 4.25Å; F180-Q210 HydrophobicContact CG-CB 4.49Å; F180-Q210 HydrophobicContact CG-CG 4.36Å; F180-Q210 HydrophobicContact CZ-CB 4.02Å; F206-Q210 WeakPolarHBondContact O-CB 3.29Å; F206-Q210 PolarHBondContact O-N 2.88Å; L207-Q210 PolarHBondContact O-N 3.01Å; L207-Q210 VanDerWaalsContact O-N 3.14Å; A208-Q210 VanDerWaalsContact C-N 3.32Å; A208-Q210 PolarHBondContact O-N 3.39Å; Q210-A212 PolarHBondContact O-N 3Å; Q210-A213 PolarHBondContact O-N 2.9Å; Q210-E214 HydrophobicContact CG-CG 4.42Å; Q210-E214 PolarHBondContact NE2-OE1 2.72Å; Q210-E214 WeakPolarHBondContact O-CB 3.4Å; Q210-E214 WeakPolarHBondContact O-CG 2.93Å; Q210-E214 PolarHBondContact O-N 2.79Å |
| 211 | E | 97.1 | Very high | 95.8 | Very high | 120 Ų | 120 | 69.1 Ų | 69.1 | 56% | 0.561 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -57.4 | -48.6 | 175.5 | -78 | 177.7 | -168.5 | 0 | 0 | 111.5 | L173 L207 A208 A213 E214 A215 | L173-E211 HydrophobicContact CD1-CG 4.38Å; L173-E211 HydrophobicContact CD2-CG 3.88Å; L207-E211 PolarHBondContact O-N 3.01Å; A208-E211 PolarHBondContact O-N 3.21Å; E211-A213 PolarHBondContact O-N 3.5Å; E211-E214 PolarHBondContact O-N 3.46Å; E211-A215 VanDerWaalsContact O-CB 3.29Å; E211-A215 WeakPolarHBondContact O-CB 3.37Å; E211-A215 PolarHBondContact O-N 3.4Å |
| 212 | A | 97.2 | Very high | 96 | Very high | 65 Ų | 65 | 69.8 Ų | 69.8 | 54% | 0.537 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.7 | -43.2 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | A208 Q210 F216 | A208-A212 WeakPolarHBondContact O-CB 3.38Å; A208-A212 PolarHBondContact O-N 3.24Å; Q210-A212 PolarHBondContact O-N 3Å; A212-F216 WeakPolarHBondContact O-CB 3.21Å; A212-F216 PolarHBondContact O-N 3.5Å |
| 213 | A | 97.1 | Very high | 96.1 | Very high | 30 Ų | 30 | 64.6 Ų | 64.6 | 25% | 0.248 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -65.8 | -44.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F180 L209 Q210 E211 F216 I217 | F180-A213 HydrophobicContact CE2-CB 4.03Å; F180-A213 HydrophobicContact CZ-CB 4.17Å; L209-A213 WeakPolarHBondContact O-CB 3.31Å; L209-A213 PolarHBondContact O-N 2.96Å; Q210-A213 PolarHBondContact O-N 2.9Å; E211-A213 PolarHBondContact O-N 3.5Å; A213-F216 PolarHBondContact O-N 2.88Å; A213-I217 VanDerWaalsContact O-CG1 3.3Å; A213-I217 WeakPolarHBondContact O-CG1 3.44Å; A213-I217 PolarHBondContact O-N 2.84Å |
| 214 | E | 97.3 | Very high | 96.4 | Very high | 21 Ų | 21 | 60.6 Ų | 60.6 | 10% | 0.098 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.2 | -42.7 | 177.5 | -72.1 | -169.7 | -152.4 | 0 | 0 | 111.4 | L173 L174 L175 Q210 E211 F216 I217 V218 | L173-E214 WeakPolarHBondContact CA-OE2 3.44Å; L174-E214 PolarHBondContact N-OE1 3.28Å; L174-E214 PolarHBondContact N-OE2 2.86Å; L175-E214 VanDerWaalsContact CB-OE1 3.26Å; L175-E214 WeakPolarHBondContact CB-OE1 3.5Å; L175-E214 HydrophobicContact CD1-CG 3.73Å; L175-E214 HydrophobicContact CG-CG 3.9Å; L175-E214 WeakPolarHBondContact CG-OE1 3.24Å; L175-E214 PolarHBondContact N-OE1 3.32Å; Q210-E214 HydrophobicContact CG-CG 4.42Å; Q210-E214 PolarHBondContact NE2-OE1 2.72Å; Q210-E214 WeakPolarHBondContact O-CB 3.4Å; Q210-E214 WeakPolarHBondContact O-CG 2.93Å; Q210-E214 PolarHBondContact O-N 2.79Å; E211-E214 PolarHBondContact O-N 3.46Å; E214-F216 VanDerWaalsContact C-N 3.31Å; E214-F216 PolarHBondContact O-N 3.21Å; E214-I217 PolarHBondContact O-N 3.2Å; E214-V218 WeakPolarHBondContact O-CB 3.22Å; E214-V218 VanDerWaalsContact O-CG2 3.28Å; E214-V218 WeakPolarHBondContact O-CG2 3.3Å; E214-V218 PolarHBondContact O-N 3.47Å |
| 215 | A | 96.5 | Very high | 96.5 | Very high | 65 Ų | 65 | 58.2 Ų | 58.2 | 54% | 0.537 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.6 | -42.9 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | E211 H219 | E211-A215 VanDerWaalsContact O-CB 3.29Å; E211-A215 WeakPolarHBondContact O-CB 3.37Å; E211-A215 PolarHBondContact O-N 3.4Å; A215-H219 WeakPolarHBondContact O-CB 3.42Å; A215-H219 PolarHBondContact O-N 3.42Å |
| 216 | F | 95.6 | Very high | 96.5 | Very high | 97 Ų | 97 | 65 Ų | 65 | 43% | 0.425 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.6 | -46.6 | 175.7 | 175.1 | -100 | 0 | 0 | 0 | 112.3 | A212 A213 E214 V218 H219 L220 I250 | A212-F216 WeakPolarHBondContact O-CB 3.21Å; A212-F216 PolarHBondContact O-N 3.5Å; A213-F216 PolarHBondContact O-N 2.88Å; E214-F216 VanDerWaalsContact C-N 3.31Å; E214-F216 PolarHBondContact O-N 3.21Å; F216-V218 PolarHBondContact O-N 3.49Å; F216-H219 PolarHBondContact O-N 2.99Å; F216-L220 HydrophobicContact CE1-CD2 4.39Å; F216-L220 WeakPolarHBondContact O-CB 3.44Å; F216-L220 PolarHBondContact O-N 3.44Å; F216-I250 HydrophobicContact CE2-CD1 3.95Å; F216-I250 HydrophobicContact CZ-CD1 3.83Å |
| 217 | I | 96.2 | Very high | 96.5 | Very high | 71 Ų | 71 | 65.1 Ų | 65.1 | 36% | 0.364 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -64.8 | -41.4 | 179.9 | -68.3 | 166.8 | 0 | 0 | 0 | 111 | A213 E214 L220 F221 | A213-I217 VanDerWaalsContact O-CG1 3.3Å; A213-I217 WeakPolarHBondContact O-CG1 3.44Å; A213-I217 PolarHBondContact O-N 2.84Å; E214-I217 PolarHBondContact O-N 3.2Å; I217-L220 PolarHBondContact O-N 3.23Å; I217-F221 HydrophobicContact CG2-CD2 3.65Å; I217-F221 HydrophobicContact CG2-CE2 3.57Å; I217-F221 VanDerWaalsContact O-CD2 3.24Å; I217-F221 WeakPolarHBondContact O-CD2 3.26Å; I217-F221 PolarHBondContact O-N 2.95Å |
| 218 | V | 96.4 | Very high | 96.6 | Very high | 74 Ų | 74 | 62.1 Ų | 62.1 | 45% | 0.448 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.3 | -48.1 | 175.9 | 171.6 | 0 | 0 | 0 | 0 | 110.5 | E214 F216 L220 F221 E222 | E214-V218 WeakPolarHBondContact O-CB 3.22Å; E214-V218 VanDerWaalsContact O-CG2 3.28Å; E214-V218 WeakPolarHBondContact O-CG2 3.3Å; E214-V218 PolarHBondContact O-N 3.47Å; F216-V218 PolarHBondContact O-N 3.49Å; V218-L220 VanDerWaalsContact C-N 3.33Å; V218-L220 PolarHBondContact O-N 3.26Å; V218-F221 PolarHBondContact O-N 3.49Å; V218-E222 WeakPolarHBondContact O-CG 3.33Å; V218-E222 PolarHBondContact O-N 3.31Å |
| 219 | H | 95.2 | Very high | 96.6 | Very high | 90 Ų | 90 | 64.5 Ų | 64.5 | 42% | 0.417 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -60 | -42.3 | 176.8 | -177 | 66.7 | 0 | 0 | 0 | 112.3 | A215 F216 F221 E222 C223 | A215-H219 WeakPolarHBondContact O-CB 3.42Å; A215-H219 PolarHBondContact O-N 3.42Å; F216-H219 PolarHBondContact O-N 2.99Å; H219-F221 VanDerWaalsContact C-N 3.32Å; H219-F221 PolarHBondContact O-N 2.91Å; H219-E222 PolarHBondContact O-N 2.89Å; H219-C223 PolarHBondContact O-N 3.05Å |
| 220 | L | 95.4 | Very high | 96.6 | Very high | 22 Ų | 22 | 69.1 Ų | 69.1 | 12% | 0.115 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -59.6 | -42.8 | 176 | -176.1 | 63.6 | 0 | 0 | 0 | 111.5 | F216 I217 V218 C223 A224 I241 V244 T245 | F216-L220 HydrophobicContact CE1-CD2 4.39Å; F216-L220 WeakPolarHBondContact O-CB 3.44Å; F216-L220 PolarHBondContact O-N 3.44Å; I217-L220 PolarHBondContact O-N 3.23Å; V218-L220 VanDerWaalsContact C-N 3.33Å; V218-L220 PolarHBondContact O-N 3.26Å; L220-C223 PolarHBondContact O-N 3.49Å; L220-A224 WeakPolarHBondContact O-CB 3.19Å; L220-A224 PolarHBondContact O-N 2.98Å; L220-I241 HydrophobicContact CD1-CG2 4.31Å; L220-I241 HydrophobicContact CD2-CG2 4.01Å; L220-I241 HydrophobicContact CG-CG2 4.29Å; L220-V244 HydrophobicContact CD1-CB 4.16Å; L220-V244 HydrophobicContact CD1-CG1 3.64Å; L220-T245 HydrophobicContact CD1-CG2 4.21Å |
| 221 | F | 96.9 | Very high | 96.6 | Very high | 107 Ų | 107 | 71.3 Ų | 71.3 | 47% | 0.469 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -69.1 | -35.1 | 176.1 | -84.1 | -63.6 | 0 | 0 | 0 | 113.3 | I217 V218 H219 A224 Q225 I241 | I217-F221 HydrophobicContact CG2-CD2 3.65Å; I217-F221 HydrophobicContact CG2-CE2 3.57Å; I217-F221 VanDerWaalsContact O-CD2 3.24Å; I217-F221 WeakPolarHBondContact O-CD2 3.26Å; I217-F221 PolarHBondContact O-N 2.95Å; V218-F221 PolarHBondContact O-N 3.49Å; H219-F221 VanDerWaalsContact C-N 3.32Å; H219-F221 PolarHBondContact O-N 2.91Å; F221-A224 PolarHBondContact O-N 3.45Å; F221-Q225 VanDerWaalsContact O-CB 3.26Å; F221-Q225 WeakPolarHBondContact O-CB 3.33Å; F221-Q225 PolarHBondContact O-N 3.49Å; F221-I241 HydrophobicContact CE1-CD1 4.25Å |
| 222 | E | 96.1 | Very high | 96.5 | Very high | 105 Ų | 105 | 75.3 Ų | 75.3 | 49% | 0.491 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.9 | -44.3 | 173.5 | -72.6 | -177.3 | -178.8 | 0 | 0 | 111.7 | V218 H219 R226 | V218-E222 WeakPolarHBondContact O-CG 3.33Å; V218-E222 PolarHBondContact O-N 3.31Å; H219-E222 PolarHBondContact O-N 2.89Å; E222-R226 WeakPolarHBondContact O-CG 3.42Å; E222-R226 PolarHBondContact O-N 2.87Å |
| 223 | C | 96.7 | Very high | 96.5 | Very high | 27 Ų | 27 | 74.6 Ų | 74.6 | 18% | 0.182 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -64.6 | -47 | 174.3 | -72 | 0 | 0 | 0 | 0 | 111.5 | H219 L220 Q225 R226 C227 V244 | H219-C223 PolarHBondContact O-N 3.05Å; L220-C223 PolarHBondContact O-N 3.49Å; C223-Q225 VanDerWaalsContact C-N 3.29Å; C223-Q225 PolarHBondContact O-N 3.47Å; C223-R226 WeakPolarHBondContact O-CB 3.23Å; C223-R226 PolarHBondContact O-N 3.14Å; C223-R226 VanDerWaalsContact O-N 3.08Å; C223-C227 PolarHBondContact O-N 3.24Å; C223-C227 VanDerWaalsContact O-N 3.08Å; C223-V244 HydrophobicContact CB-CB 4.33Å; C223-V244 HydrophobicContact CB-CG1 3.59Å; C223-V244 HydrophobicContact CB-CG2 3.7Å |
| 224 | A | 97.2 | Very high | 96.3 | Very high | 0 Ų | 0 | 78.3 Ų | 78.3 | 0% | 0 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -63.1 | -35.8 | 179.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L220 F221 R226 C227 A228 V236 D240 I241 V244 | L220-A224 WeakPolarHBondContact O-CB 3.19Å; L220-A224 PolarHBondContact O-N 2.98Å; F221-A224 PolarHBondContact O-N 3.45Å; A224-R226 VanDerWaalsContact C-N 3.35Å; A224-R226 PolarHBondContact O-N 2.94Å; A224-C227 WeakPolarHBondContact O-CB 3.44Å; A224-C227 PolarHBondContact O-N 2.83Å; A224-A228 PolarHBondContact O-N 3.37Å; A224-V236 HydrophobicContact CB-CG1 3.81Å; A224-D240 HydrophobicContact CB-CB 4.16Å; A224-I241 HydrophobicContact CB-CG1 3.97Å; A224-V244 HydrophobicContact CB-CG2 4.46Å |
| 225 | Q | 96.9 | Very high | 96.2 | Very high | 69 Ų | 69 | 82 Ų | 82 | 32% | 0.322 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.1 | -38.6 | 174 | -174.8 | 62.1 | 51.5 | 0 | 0 | 111.9 | F221 C223 C227 A228 I229 I234 V236 | F221-Q225 VanDerWaalsContact O-CB 3.26Å; F221-Q225 WeakPolarHBondContact O-CB 3.33Å; F221-Q225 PolarHBondContact O-N 3.49Å; C223-Q225 VanDerWaalsContact C-N 3.29Å; C223-Q225 PolarHBondContact O-N 3.47Å; Q225-C227 VanDerWaalsContact C-N 3.35Å; Q225-A228 PolarHBondContact O-N 3.46Å; Q225-I229 HydrophobicContact CG-CD1 4.11Å; Q225-I229 VanDerWaalsContact O-CG1 3.28Å; Q225-I229 WeakPolarHBondContact O-CG1 3.25Å; Q225-I229 PolarHBondContact O-N 2.95Å; Q225-I234 PolarHBondContact NE2-O 3.27Å; Q225-V236 HydrophobicContact CB-CG2 4.32Å |
| 226 | R | 96.3 | Very high | 96.2 | Very high | 185 Ų | 185 | 80.8 Ų | 80.8 | 70% | 0.698 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -64.1 | -40.3 | 174.1 | -69.3 | 173.1 | -175.1 | -88.5 | 1.5 | 111.5 | E222 C223 A224 I229 H230 | E222-R226 WeakPolarHBondContact O-CG 3.42Å; E222-R226 PolarHBondContact O-N 2.87Å; C223-R226 WeakPolarHBondContact O-CB 3.23Å; C223-R226 PolarHBondContact O-N 3.14Å; C223-R226 VanDerWaalsContact O-N 3.08Å; A224-R226 VanDerWaalsContact C-N 3.35Å; A224-R226 PolarHBondContact O-N 2.94Å; R226-I229 PolarHBondContact O-N 2.84Å; R226-H230 WeakPolarHBondContact O-CB 3.19Å; R226-H230 PolarHBondContact O-N 2.81Å |
| 227 | C | 96.4 | Very high | 96.3 | Very high | 24 Ų | 24 | 80.1 Ų | 80.1 | 16% | 0.162 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -63.6 | -41.1 | 173.5 | -65.4 | 0 | 0 | 0 | 0 | 112.2 | C223 A224 Q225 H230 A231 D240 L243 | C223-C227 PolarHBondContact O-N 3.24Å; C223-C227 VanDerWaalsContact O-N 3.08Å; A224-C227 WeakPolarHBondContact O-CB 3.44Å; A224-C227 PolarHBondContact O-N 2.83Å; Q225-C227 VanDerWaalsContact C-N 3.35Å; C227-H230 WeakPolarHBondContact O-CB 3.41Å; C227-H230 PolarHBondContact O-N 3.43Å; C227-A231 PolarHBondContact O-N 2.85Å; C227-A231 VanDerWaalsContact O-N 3.1Å; C227-D240 HydrophobicContact CB-CB 4.15Å; C227-L243 HydrophobicContact CB-CD2 4.32Å |
| 228 | A | 97.4 | Very high | 96.3 | Very high | 0 Ų | 0 | 81 Ų | 81 | 0% | 0 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | A224 Q225 H230 A231 K232 R233 V236 | A224-A228 PolarHBondContact O-N 3.37Å; Q225-A228 PolarHBondContact O-N 3.46Å; A228-H230 VanDerWaalsContact C-N 3.34Å; A228-H230 PolarHBondContact O-N 2.94Å; A228-A231 CarbonylContact O-C 3.44Å; A228-A231 PolarHBondContact O-N 3.44Å; A228-A231 VanDerWaalsContact O-N 3.16Å; A228-K232 PolarHBondContact O-N 2.85Å; A228-R233 CarbonylContact C-O 3.29Å; A228-R233 VanDerWaalsContact C-O 3.29Å; A228-R233 PolarHBondContact O-N 3.46Å; A228-R233 VanDerWaalsContact O-O 3.09Å; A228-V236 HydrophobicContact CB-CG2 4.26Å |
| 229 | I | 96.8 | Very high | 96.2 | Very high | 109 Ų | 109 | 82.9 Ų | 82.9 | 56% | 0.559 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.4 | -41.8 | 176.4 | -68.9 | 166.3 | 0 | 0 | 0 | 110.9 | Q225 R226 A231 K232 | Q225-I229 HydrophobicContact CG-CD1 4.11Å; Q225-I229 VanDerWaalsContact O-CG1 3.28Å; Q225-I229 WeakPolarHBondContact O-CG1 3.25Å; Q225-I229 PolarHBondContact O-N 2.95Å; R226-I229 PolarHBondContact O-N 2.84Å; I229-A231 PolarHBondContact O-N 2.86Å; I229-K232 PolarHBondContact O-N 3.31Å |
| 230 | H | 96.5 | Very high | 96.3 | Very high | 168 Ų | 168 | 78.9 Ų | 78.9 | 78% | 0.778 | 39% | 0.391 | S | S | * | . | H | α-helix | trans | -57.8 | -38.3 | 175.7 | -177.3 | 74.7 | 0 | 0 | 0 | 111.8 | R226 C227 A228 K232 | R226-H230 WeakPolarHBondContact O-CB 3.19Å; R226-H230 PolarHBondContact O-N 2.81Å; C227-H230 WeakPolarHBondContact O-CB 3.41Å; C227-H230 PolarHBondContact O-N 3.43Å; A228-H230 VanDerWaalsContact C-N 3.34Å; A228-H230 PolarHBondContact O-N 2.94Å; H230-K232 VanDerWaalsContact C-N 3.25Å; H230-K232 PolarHBondContact O-N 3.31Å |
| 231 | A | 96.5 | Very high | 96.3 | Very high | 49 Ų | 49 | 80.2 Ų | 80.2 | 41% | 0.405 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | 16.2 | 175 | 0 | 0 | 0 | 0 | 0 | 114.5 | C227 A228 I229 R233 | C227-A231 PolarHBondContact O-N 2.85Å; C227-A231 VanDerWaalsContact O-N 3.1Å; A228-A231 CarbonylContact O-C 3.44Å; A228-A231 PolarHBondContact O-N 3.44Å; A228-A231 VanDerWaalsContact O-N 3.16Å; I229-A231 PolarHBondContact O-N 2.86Å; A231-R233 VanDerWaalsContact CB-NH2 3.32Å; A231-R233 PolarHBondContact O-N 2.88Å |
| 232 | K | 96.9 | Very high | 96.1 | Very high | 203 Ų | 203 | 81.1 Ų | 81.1 | 88% | 0.883 | 40% | 0.404 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57.1 | 29.8 | -179 | -56.6 | 178.5 | -178.7 | 174.7 | 0 | 114.4 | A228 I229 H230 | A228-K232 PolarHBondContact O-N 2.85Å; I229-K232 PolarHBondContact O-N 3.31Å; H230-K232 VanDerWaalsContact C-N 3.25Å; H230-K232 PolarHBondContact O-N 3.31Å |
| 233 | R | 96.4 | Very high | 96 | Very high | 50 Ų | 50 | 80 Ų | 80 | 19% | 0.189 | 40% | 0.401 | C | S | . | . | trans | -112.4 | 153.9 | 174.8 | -71.2 | 177 | -71.4 | 106 | -2 | 110.8 | A228 A231 T235 K239 D240 | A228-R233 CarbonylContact C-O 3.29Å; A228-R233 VanDerWaalsContact C-O 3.29Å; A228-R233 PolarHBondContact O-N 3.46Å; A228-R233 VanDerWaalsContact O-O 3.09Å; A231-R233 VanDerWaalsContact CB-NH2 3.32Å; A231-R233 PolarHBondContact O-N 2.88Å; R233-T235 PolarHBondContact NH1-O 2.92Å; R233-T235 VanDerWaalsContact NH1-O 3.1Å; R233-K239 VanDerWaalsContact NH2-CE 3.34Å; R233-D240 IonicContact CZ-OD1 3.55Å; R233-D240 IonicContact CZ-OD2 3.61Å; R233-D240 IonicContact NH1-OD1 3.47Å; R233-D240 PolarHBondContact NH1-OD1 3.39Å; R233-D240 IonicContact NH1-OD2 2.76Å; R233-D240 PolarHBondContact NH1-OD2 2.9Å; R233-D240 IonicContact NH2-OD1 2.7Å; R233-D240 PolarHBondContact NH2-OD1 3.36Å; R233-D240 IonicContact NH2-OD2 3.52Å | ||
| 234 | I | 92.5 | Very high | 95.9 | Very high | 108 Ų | 108 | 79 Ų | 79 | 55% | 0.554 | 39% | 0.393 | S | S | * | . | S | Bend | trans | -96.4 | -37 | 171.3 | -58.4 | 174.1 | 0 | 0 | 0 | 110 | Q225 | Q225-I234 PolarHBondContact NE2-O 3.27Š|
| 235 | T | 95.7 | Very high | 95.7 | Very high | 100 Ų | 100 | 80 Ų | 80 | 61% | 0.613 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -78.7 | 123.1 | -180 | -46.7 | 0 | 0 | 0 | 0 | 111.6 | R233 | R233-T235 PolarHBondContact NH1-O 2.92Å; R233-T235 VanDerWaalsContact NH1-O 3.1Å |
| 236 | V | 96 | Very high | 95.4 | Very high | 39 Ų | 39 | 83.2 Ų | 83.2 | 24% | 0.236 | 41% | 0.414 | C | S | . | . | trans | -70.7 | 136.1 | 170.3 | 179.1 | 0 | 0 | 0 | 0 | 109.9 | A224 Q225 A228 D240 I241 | A224-V236 HydrophobicContact CB-CG1 3.81Å; Q225-V236 HydrophobicContact CB-CG2 4.32Å; A228-V236 HydrophobicContact CB-CG2 4.26Å; V236-D240 HydrophobicContact CG1-CB 4.28Å; V236-I241 HydrophobicContact CG1-CG1 4.47Å | ||
| 237 | M | 97.5 | Very high | 95.2 | Very high | 82 Ų | 82 | 80 Ų | 80 | 40% | 0.404 | 41% | 0.411 | S | S | . | . | trans | -122.1 | 162.6 | 179.7 | -64 | 176.8 | 175.4 | 0 | 0 | 110.4 | K239 D240 | M237-K239 HydrophobicContact CB-CG 3.93Å; M237-K239 PolarHBondContact O-N 3.43Å; M237-K239 VanDerWaalsContact O-N 3.13Å; M237-K239 VanDerWaalsContact SD-CE 3.54Å; M237-D240 PolarHBondContact N-OD2 3.41Å; M237-D240 WeakPolarHBondContact O-CB 3.43Å; M237-D240 PolarHBondContact O-N 3.41Å | ||
| 238 | S | 96 | Very high | 95 | Very high | 89 Ų | 89 | 82.3 Ų | 82.3 | 62% | 0.622 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -55.8 | -33.3 | 178.2 | -46.2 | 0 | 0 | 0 | 0 | 113.1 | D240 I241 Q242 | S238-D240 VanDerWaalsContact C-N 3.28Å; S238-D240 PolarHBondContact O-N 3.4Å; S238-I241 PolarHBondContact O-N 3.17Å; S238-Q242 WeakPolarHBondContact O-CG 3.29Å; S238-Q242 PolarHBondContact O-N 3.3Å |
| 239 | K | 95.3 | Very high | 94.6 | Very high | 114 Ų | 114 | 89.2 Ų | 89.2 | 50% | 0.496 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -62.9 | -30.3 | 175.3 | 65 | 178.2 | -179.3 | -176.4 | 0 | 113.9 | R233 M237 L243 | R233-K239 VanDerWaalsContact NH2-CE 3.34Å; M237-K239 HydrophobicContact CB-CG 3.93Å; M237-K239 PolarHBondContact O-N 3.43Å; M237-K239 VanDerWaalsContact O-N 3.13Å; M237-K239 VanDerWaalsContact SD-CE 3.54Å; K239-L243 WeakPolarHBondContact O-CB 3.4Å; K239-L243 PolarHBondContact O-N 2.98Å |
| 240 | D | 96.8 | Very high | 94.1 | Very high | 6 Ų | 6 | 86 Ų | 86 | 3% | 0.032 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -71.5 | -40.1 | 178.2 | -57.1 | -43.8 | 0 | 0 | 0 | 109.7 | A224 C227 R233 V236 M237 S238 V244 | A224-D240 HydrophobicContact CB-CB 4.16Å; C227-D240 HydrophobicContact CB-CB 4.15Å; R233-D240 IonicContact CZ-OD1 3.55Å; R233-D240 IonicContact CZ-OD2 3.61Å; R233-D240 IonicContact NH1-OD1 3.47Å; R233-D240 PolarHBondContact NH1-OD1 3.39Å; R233-D240 IonicContact NH1-OD2 2.76Å; R233-D240 PolarHBondContact NH1-OD2 2.9Å; R233-D240 IonicContact NH2-OD1 2.7Å; R233-D240 PolarHBondContact NH2-OD1 3.36Å; R233-D240 IonicContact NH2-OD2 3.52Å; V236-D240 HydrophobicContact CG1-CB 4.28Å; M237-D240 PolarHBondContact N-OD2 3.41Å; M237-D240 WeakPolarHBondContact O-CB 3.43Å; M237-D240 PolarHBondContact O-N 3.41Å; S238-D240 VanDerWaalsContact C-N 3.28Å; S238-D240 PolarHBondContact O-N 3.4Å; D240-V244 VanDerWaalsContact O-CG2 3.31Å; D240-V244 WeakPolarHBondContact O-CG2 3.46Å; D240-V244 PolarHBondContact O-N 3.36Å; D240-V244 VanDerWaalsContact O-N 3.1Å |
| 241 | I | 94.9 | Very high | 93.3 | Very high | 50 Ų | 50 | 81.8 Ų | 81.8 | 26% | 0.256 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -67 | -46.3 | 174.9 | -61.1 | 173.5 | 0 | 0 | 0 | 110.3 | L220 F221 A224 V236 S238 L243 V244 T245 | L220-I241 HydrophobicContact CD1-CG2 4.31Å; L220-I241 HydrophobicContact CD2-CG2 4.01Å; L220-I241 HydrophobicContact CG-CG2 4.29Å; F221-I241 HydrophobicContact CE1-CD1 4.25Å; A224-I241 HydrophobicContact CB-CG1 3.97Å; V236-I241 HydrophobicContact CG1-CG1 4.47Å; S238-I241 PolarHBondContact O-N 3.17Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 3.35Å; I241-V244 PolarHBondContact O-N 3.41Å; I241-V244 VanDerWaalsContact O-N 3.13Å; I241-T245 HydrophobicContact CG2-CG2 4.25Å; I241-T245 WeakPolarHBondContact O-CG2 3.36Å; I241-T245 PolarHBondContact O-N 3.22Å; I241-T245 PolarHBondContact O-OG1 3.1Å |
| 242 | Q | 93.5 | Very high | 92.6 | Very high | 127 Ų | 127 | 82 Ų | 82 | 59% | 0.593 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -56.4 | -44.9 | 177 | -74.3 | 170.3 | -14.1 | 0 | 0 | 111.6 | S238 V244 T245 H246 | S238-Q242 WeakPolarHBondContact O-CG 3.29Å; S238-Q242 PolarHBondContact O-N 3.3Å; Q242-V244 PolarHBondContact O-N 3.45Å; Q242-T245 WeakPolarHBondContact CA-OG1 3.42Å; Q242-T245 PolarHBondContact O-N 3.38Å; Q242-T245 PolarHBondContact O-OG1 3.32Å; Q242-H246 WeakPolarHBondContact O-CB 3.42Å; Q242-H246 PolarHBondContact O-N 3.5Å |
| 243 | L | 94 | Very high | 91.7 | Very high | 82 Ų | 82 | 77.1 Ų | 77.1 | 43% | 0.429 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -59.3 | -47.5 | 175.4 | 179.3 | 62.1 | 0 | 0 | 0 | 111.5 | C227 K239 I241 H246 L247 | C227-L243 HydrophobicContact CB-CD2 4.32Å; K239-L243 WeakPolarHBondContact O-CB 3.4Å; K239-L243 PolarHBondContact O-N 2.98Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 3.35Å; L243-H246 PolarHBondContact O-N 3.21Å; L243-L247 HydrophobicContact CD1-CD1 4.12Å; L243-L247 HydrophobicContact CD1-CG 4.23Å; L243-L247 HydrophobicContact CG-CD1 4.04Å; L243-L247 VanDerWaalsContact O-CG 3.29Å; L243-L247 WeakPolarHBondContact O-CG 3.37Å; L243-L247 PolarHBondContact O-N 2.85Å |
| 244 | V | 94.6 | Very high | 90.8 | Very high | 5 Ų | 5 | 78.6 Ų | 78.6 | 3% | 0.03 | 43% | 0.433 | C | S | . | . | H | α-helix | trans | -61.8 | -45.8 | 177.9 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | L220 C223 A224 D240 I241 Q242 H246 L247 Q248 | L220-V244 HydrophobicContact CD1-CB 4.16Å; L220-V244 HydrophobicContact CD1-CG1 3.64Å; C223-V244 HydrophobicContact CB-CB 4.33Å; C223-V244 HydrophobicContact CB-CG1 3.59Å; C223-V244 HydrophobicContact CB-CG2 3.7Å; A224-V244 HydrophobicContact CB-CG2 4.46Å; D240-V244 VanDerWaalsContact O-CG2 3.31Å; D240-V244 WeakPolarHBondContact O-CG2 3.46Å; D240-V244 PolarHBondContact O-N 3.36Å; D240-V244 VanDerWaalsContact O-N 3.1Å; I241-V244 PolarHBondContact O-N 3.41Å; I241-V244 VanDerWaalsContact O-N 3.13Å; Q242-V244 PolarHBondContact O-N 3.45Å; V244-H246 VanDerWaalsContact C-N 3.27Å; V244-H246 PolarHBondContact O-N 3.3Å; V244-L247 PolarHBondContact O-N 3.3Å; V244-Q248 HydrophobicContact CG1-CG 4.19Å; V244-Q248 WeakPolarHBondContact O-CB 3.34Å; V244-Q248 WeakPolarHBondContact O-CG 3.42Å; V244-Q248 PolarHBondContact O-N 3.48Å |
| 245 | T | 92.5 | Very high | 90.1 | Very high | 21 Ų | 21 | 77 Ų | 77 | 13% | 0.129 | 42% | 0.423 | C | S | . | . | H | α-helix | trans | -61.9 | -37.1 | 178.6 | 53.9 | 0 | 0 | 0 | 0 | 112.3 | L220 I241 Q242 N249 I250 | L220-T245 HydrophobicContact CD1-CG2 4.21Å; I241-T245 HydrophobicContact CG2-CG2 4.25Å; I241-T245 WeakPolarHBondContact O-CG2 3.36Å; I241-T245 PolarHBondContact O-N 3.22Å; I241-T245 PolarHBondContact O-OG1 3.1Å; Q242-T245 WeakPolarHBondContact CA-OG1 3.42Å; Q242-T245 PolarHBondContact O-N 3.38Å; Q242-T245 PolarHBondContact O-OG1 3.32Å; T245-N249 PolarHBondContact O-N 2.9Å; T245-I250 HydrophobicContact CG2-CB 4.39Å; T245-I250 HydrophobicContact CG2-CD1 4.34Å; T245-I250 HydrophobicContact CG2-CG2 4.5Å; T245-I250 PolarHBondContact O-N 3.34Å |
| 246 | H | 91.3 | Very high | 89.3 | Confident | 136 Ų | 136 | 78.7 Ų | 78.7 | 63% | 0.63 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -66.9 | -46.5 | 175.8 | -174.3 | 69.7 | 0 | 0 | 0 | 111.4 | Q242 L243 V244 Q248 N249 | Q242-H246 WeakPolarHBondContact O-CB 3.42Å; Q242-H246 PolarHBondContact O-N 3.5Å; L243-H246 PolarHBondContact O-N 3.21Å; V244-H246 VanDerWaalsContact C-N 3.27Å; V244-H246 PolarHBondContact O-N 3.3Å; H246-Q248 VanDerWaalsContact C-N 3.33Å; H246-Q248 PolarHBondContact O-N 2.87Å; H246-N249 PolarHBondContact O-N 3.43Å |
| 247 | L | 92.4 | Very high | 88.5 | Confident | 119 Ų | 119 | 81 Ų | 81 | 62% | 0.623 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -65.7 | -33.7 | 178.5 | -68.9 | 173.7 | 0 | 0 | 0 | 113 | L243 V244 N249 | L243-L247 HydrophobicContact CD1-CD1 4.12Å; L243-L247 HydrophobicContact CD1-CG 4.23Å; L243-L247 HydrophobicContact CG-CD1 4.04Å; L243-L247 VanDerWaalsContact O-CG 3.29Å; L243-L247 WeakPolarHBondContact O-CG 3.37Å; L243-L247 PolarHBondContact O-N 2.85Å; V244-L247 PolarHBondContact O-N 3.3Å; L247-N249 VanDerWaalsContact C-N 3.3Å |
| 248 | Q | 91.3 | Very high | 87.9 | Confident | 72 Ų | 72 | 82.9 Ų | 82.9 | 34% | 0.336 | 44% | 0.444 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -86.3 | 2.6 | 179.1 | -68.6 | -179.7 | -20.2 | 0 | 0 | 113.3 | V244 H246 I250 | V244-Q248 HydrophobicContact CG1-CG 4.19Å; V244-Q248 WeakPolarHBondContact O-CB 3.34Å; V244-Q248 WeakPolarHBondContact O-CG 3.42Å; V244-Q248 PolarHBondContact O-N 3.48Å; H246-Q248 VanDerWaalsContact C-N 3.33Å; H246-Q248 PolarHBondContact O-N 2.87Å; Q248-I250 HydrophobicContact CB-CD1 3.76Å; Q248-I250 HydrophobicContact CB-CG1 3.89Å; Q248-I250 PolarHBondContact O-N 2.88Å |
| 249 | N | 88.8 | Confident | 87.3 | Confident | 144 Ų | 144 | 84.9 Ų | 84.9 | 77% | 0.77 | 44% | 0.439 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.3 | 33.7 | -174.1 | -60.9 | -67.3 | 0 | 0 | 0 | 113.5 | T245 H246 L247 | T245-N249 PolarHBondContact O-N 2.9Å; H246-N249 PolarHBondContact O-N 3.43Å; L247-N249 VanDerWaalsContact C-N 3.3Å |
| 250 | I | 86.3 | Confident | 86.7 | Confident | 41 Ų | 41 | 83.9 Ų | 83.9 | 21% | 0.21 | 44% | 0.435 | C | S | . | . | P | Polyproline II helix | trans | -76.8 | 121.9 | 175.6 | -64.9 | 163.1 | 0 | 0 | 0 | 107.5 | F216 T245 Q248 T252 | F216-I250 HydrophobicContact CE2-CD1 3.95Å; F216-I250 HydrophobicContact CZ-CD1 3.83Å; T245-I250 HydrophobicContact CG2-CB 4.39Å; T245-I250 HydrophobicContact CG2-CD1 4.34Å; T245-I250 HydrophobicContact CG2-CG2 4.5Å; T245-I250 PolarHBondContact O-N 3.34Å; Q248-I250 HydrophobicContact CB-CD1 3.76Å; Q248-I250 HydrophobicContact CB-CG1 3.89Å; Q248-I250 PolarHBondContact O-N 2.88Å; I250-T252 PolarHBondContact O-N 3.29Å |
| 251 | P | 80.6 | Confident | 86.2 | Confident | 81 Ų | 81 | 89.6 Ų | 89.6 | 53% | 0.526 | 46% | 0.462 | S | S | . | . | P | Polyproline II helix | trans | -64 | 122.8 | -178.7 | 25.5 | -32.8 | 0 | 0 | 0 | 109.8 | ||
| 252 | T | 81 | Confident | 86 | Confident | 54 Ų | 54 | 89.1 Ų | 89.1 | 33% | 0.331 | 46% | 0.461 | S | S | . | . | P | Polyproline II helix | trans | -73.3 | 159.3 | 172.7 | 60.7 | 0 | 0 | 0 | 0 | 110.1 | I250 S254 Q255 F256 | I250-T252 PolarHBondContact O-N 3.29Å; T252-S254 PolarHBondContact O-N 2.86Å; T252-Q255 WeakPolarHBondContact O-CB 3.42Å; T252-Q255 PolarHBondContact O-N 3.49Å; T252-Q255 WeakPolarHBondContact OG1-CG 3.31Å; T252-Q255 PolarHBondContact OG1-N 2.9Å; T252-F256 PolarHBondContact O-N 3.35Å |
| 253 | S | 77.2 | Confident | 85.7 | Confident | 99 Ų | 99 | 87.2 Ų | 87.2 | 69% | 0.692 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -54.7 | -39.6 | 177.6 | 53.4 | 0 | 0 | 0 | 0 | 112.5 | F256 T257 | S253-F256 PolarHBondContact O-N 3.21Å; S253-T257 WeakPolarHBondContact O-CG2 3.42Å; S253-T257 PolarHBondContact O-N 3.41Å; S253-T257 PolarHBondContact O-OG1 3.22Å |
| 254 | S | 78.5 | Confident | 85.6 | Confident | 82 Ų | 82 | 87.5 Ų | 87.5 | 57% | 0.573 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -62.4 | -43 | 175.7 | 171.8 | 0 | 0 | 0 | 0 | 112.3 | T252 T257 H258 | T252-S254 PolarHBondContact O-N 2.86Å; S254-T257 WeakPolarHBondContact CA-OG1 3.37Å; S254-T257 PolarHBondContact O-N 3.03Å; S254-T257 PolarHBondContact O-OG1 2.89Å; S254-H258 WeakPolarHBondContact O-CB 3.25Å; S254-H258 PolarHBondContact O-N 3.2Å |
| 255 | Q | 78.5 | Confident | 85.4 | Confident | 75 Ų | 75 | 89.1 Ų | 89.1 | 35% | 0.35 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -63.9 | -44 | 174.3 | -72.2 | 173.3 | -9.2 | 0 | 0 | 110.8 | T252 T257 H258 Y259 | T252-Q255 WeakPolarHBondContact O-CB 3.42Å; T252-Q255 PolarHBondContact O-N 3.49Å; T252-Q255 WeakPolarHBondContact OG1-CG 3.31Å; T252-Q255 PolarHBondContact OG1-N 2.9Å; Q255-T257 PolarHBondContact O-N 3.26Å; Q255-H258 PolarHBondContact O-N 2.88Å; Q255-Y259 HydrophobicContact CB-CD2 4.27Å; Q255-Y259 HydrophobicContact CB-CE2 3.84Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.47Å; Q255-Y259 VanDerWaalsContact O-CG 3.3Å; Q255-Y259 PolarHBondContact O-N 3.26Å |
| 256 | F | 78.4 | Confident | 85.4 | Confident | 135 Ų | 135 | 92.9 Ų | 92.9 | 59% | 0.592 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -59.7 | -45.1 | 177.6 | -174.6 | -95.3 | 0 | 0 | 0 | 112.4 | T252 S253 H258 Y259 H260 | T252-F256 PolarHBondContact O-N 3.35Å; S253-F256 PolarHBondContact O-N 3.21Å; F256-H258 VanDerWaalsContact C-N 3.35Å; F256-H258 PolarHBondContact O-N 3.09Å; F256-Y259 PolarHBondContact O-N 3.31Å; F256-H260 WeakPolarHBondContact O-CB 3.48Å; F256-H260 PolarHBondContact O-N 2.89Å |
| 257 | T | 79.9 | Confident | 85.4 | Confident | 88 Ų | 88 | 92.1 Ų | 92.1 | 54% | 0.54 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -64.4 | -39.4 | 176.2 | 51 | 0 | 0 | 0 | 0 | 112.2 | S253 S254 Q255 H260 H261 | S253-T257 WeakPolarHBondContact O-CG2 3.42Å; S253-T257 PolarHBondContact O-N 3.41Å; S253-T257 PolarHBondContact O-OG1 3.22Å; S254-T257 WeakPolarHBondContact CA-OG1 3.37Å; S254-T257 PolarHBondContact O-N 3.03Å; S254-T257 PolarHBondContact O-OG1 2.89Å; Q255-T257 PolarHBondContact O-N 3.26Å; T257-H260 PolarHBondContact O-N 3.47Å; T257-H261 WeakPolarHBondContact O-CB 3.47Å; T257-H261 PolarHBondContact O-N 3.47Å |
| 258 | H | 83.2 | Confident | 85.4 | Confident | 120 Ų | 120 | 92.4 Ų | 92.4 | 56% | 0.556 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -65.4 | -44.4 | 177.1 | -179.7 | 72.2 | 0 | 0 | 0 | 111.3 | S254 Q255 F256 H260 H261 T262 | S254-H258 WeakPolarHBondContact O-CB 3.25Å; S254-H258 PolarHBondContact O-N 3.2Å; Q255-H258 PolarHBondContact O-N 2.88Å; F256-H258 VanDerWaalsContact C-N 3.35Å; F256-H258 PolarHBondContact O-N 3.09Å; H258-H260 PolarHBondContact O-N 3.16Å; H258-H261 PolarHBondContact O-N 3.4Å; H258-T262 VanDerWaalsContact O-CB 3.31Å; H258-T262 WeakPolarHBondContact O-CB 3.45Å; H258-T262 PolarHBondContact O-N 2.91Å; H258-T262 PolarHBondContact O-OG1 2.7Å |
| 259 | Y | 84.7 | Confident | 85.5 | Confident | 132 Ų | 132 | 95 Ų | 95 | 52% | 0.518 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 174.6 | -67.4 | -50.4 | 0 | 0 | 0 | 111.6 | Q255 F256 T262 I263 | Q255-Y259 HydrophobicContact CB-CD2 4.27Å; Q255-Y259 HydrophobicContact CB-CE2 3.84Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.47Å; Q255-Y259 VanDerWaalsContact O-CG 3.3Å; Q255-Y259 PolarHBondContact O-N 3.26Å; F256-Y259 PolarHBondContact O-N 3.31Å; Y259-T262 PolarHBondContact O-N 3.13Å; Y259-I263 WeakPolarHBondContact O-CB 3.42Å; Y259-I263 WeakPolarHBondContact O-CD1 3.33Å; Y259-I263 WeakPolarHBondContact O-CG1 3.38Å; Y259-I263 PolarHBondContact O-N 3.4Å |
| 260 | H | 82.9 | Confident | 85.6 | Confident | 92 Ų | 92 | 92.9 Ų | 92.9 | 43% | 0.426 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62 | -46.7 | 177.7 | -171.8 | -96.9 | 0 | 0 | 0 | 112.1 | F256 T257 H258 T262 I263 Q264 | F256-H260 WeakPolarHBondContact O-CB 3.48Å; F256-H260 PolarHBondContact O-N 2.89Å; T257-H260 PolarHBondContact O-N 3.47Å; H258-H260 PolarHBondContact O-N 3.16Å; H260-T262 VanDerWaalsContact C-N 3.33Å; H260-T262 PolarHBondContact O-N 2.93Å; H260-I263 PolarHBondContact O-N 3.49Å; H260-Q264 PolarHBondContact CE1-NE2 3.44Å; H260-Q264 PolarHBondContact CE1-OE1 3.33Å; H260-Q264 PolarHBondContact ND1-OE1 3.1Å; H260-Q264 WeakPolarHBondContact O-CB 3.45Å; H260-Q264 VanDerWaalsContact O-CG 3.29Å; H260-Q264 WeakPolarHBondContact O-CG 3.43Å; H260-Q264 PolarHBondContact O-N 3.12Å |
| 261 | H | 85 | Confident | 85.9 | Confident | 127 Ų | 127 | 93 Ų | 93 | 59% | 0.588 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -64.5 | -38 | 176.8 | -172.5 | -89 | 0 | 0 | 0 | 112.1 | T257 H258 Q264 S265 | T257-H261 WeakPolarHBondContact O-CB 3.47Å; T257-H261 PolarHBondContact O-N 3.47Å; H258-H261 PolarHBondContact O-N 3.4Å; H261-Q264 PolarHBondContact O-N 2.97Å; H261-S265 WeakPolarHBondContact O-CB 3.41Å; H261-S265 PolarHBondContact O-N 3.03Å; H261-S265 PolarHBondContact O-OG 3.35Å |
| 262 | T | 90.7 | Very high | 86.4 | Confident | 40 Ų | 40 | 94.4 Ų | 94.4 | 25% | 0.245 | 49% | 0.486 | C | S | . | . | H | α-helix | trans | -64.4 | -44.7 | 175.5 | -57 | 0 | 0 | 0 | 0 | 110.9 | H258 Y259 H260 S265 Q266 | H258-T262 VanDerWaalsContact O-CB 3.31Å; H258-T262 WeakPolarHBondContact O-CB 3.45Å; H258-T262 PolarHBondContact O-N 2.91Å; H258-T262 PolarHBondContact O-OG1 2.7Å; Y259-T262 PolarHBondContact O-N 3.13Å; H260-T262 VanDerWaalsContact C-N 3.33Å; H260-T262 PolarHBondContact O-N 2.93Å; T262-S265 WeakPolarHBondContact CA-OG 3.44Å; T262-S265 PolarHBondContact O-OG 3.34Å; T262-Q266 WeakPolarHBondContact O-CB 3.45Å; T262-Q266 WeakPolarHBondContact O-CG 3.49Å; T262-Q266 PolarHBondContact O-N 3.45Å |
| 263 | I | 88.8 | Confident | 86.9 | Confident | 86 Ų | 86 | 96.3 Ų | 96.3 | 44% | 0.441 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -64.8 | -44.1 | 176.9 | -68.8 | 163.9 | 0 | 0 | 0 | 110.5 | Y259 H260 Q266 Q267 | Y259-I263 WeakPolarHBondContact O-CB 3.42Å; Y259-I263 WeakPolarHBondContact O-CD1 3.33Å; Y259-I263 WeakPolarHBondContact O-CG1 3.38Å; Y259-I263 PolarHBondContact O-N 3.4Å; H260-I263 PolarHBondContact O-N 3.49Å; I263-Q266 PolarHBondContact O-N 3.24Å; I263-Q267 HydrophobicContact CG2-CG 4.44Å; I263-Q267 WeakPolarHBondContact O-CB 3.42Å; I263-Q267 VanDerWaalsContact O-CG 3.25Å; I263-Q267 WeakPolarHBondContact O-CG 3.41Å; I263-Q267 PolarHBondContact O-N 2.93Å |
| 264 | Q | 89.8 | Confident | 87.6 | Confident | 88 Ų | 88 | 98.3 Ų | 98.3 | 41% | 0.411 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.1 | -45.5 | 178.4 | -75.4 | -176.7 | -41.1 | 0 | 0 | 112.3 | H260 H261 Q267 L268 | H260-Q264 PolarHBondContact CE1-NE2 3.44Å; H260-Q264 PolarHBondContact CE1-OE1 3.33Å; H260-Q264 PolarHBondContact ND1-OE1 3.1Å; H260-Q264 WeakPolarHBondContact O-CB 3.45Å; H260-Q264 VanDerWaalsContact O-CG 3.29Å; H260-Q264 WeakPolarHBondContact O-CG 3.43Å; H260-Q264 PolarHBondContact O-N 3.12Å; H261-Q264 PolarHBondContact O-N 2.97Å; Q264-Q267 PolarHBondContact O-N 2.92Å; Q264-L268 WeakPolarHBondContact O-CG 3.45Å; Q264-L268 PolarHBondContact O-N 3.24Å |
| 265 | S | 91.2 | Very high | 88.1 | Confident | 39 Ų | 39 | 99.8 Ų | 99.8 | 27% | 0.273 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.7 | -41 | 176.6 | 55.1 | 0 | 0 | 0 | 0 | 111.9 | H261 T262 L268 Q269 | H261-S265 WeakPolarHBondContact O-CB 3.41Å; H261-S265 PolarHBondContact O-N 3.03Å; H261-S265 PolarHBondContact O-OG 3.35Å; T262-S265 WeakPolarHBondContact CA-OG 3.44Å; T262-S265 PolarHBondContact O-OG 3.34Å; S265-L268 PolarHBondContact O-N 2.93Å; S265-Q269 WeakPolarHBondContact O-CB 3.46Å; S265-Q269 VanDerWaalsContact O-CG 3.3Å; S265-Q269 WeakPolarHBondContact O-CG 3.33Å; S265-Q269 PolarHBondContact O-N 3.38Å |
| 266 | Q | 93 | Very high | 88.5 | Confident | 100 Ų | 100 | 99 Ų | 99 | 47% | 0.467 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.2 | -42.9 | 172.5 | -74.4 | 174.6 | -0.5 | 0 | 0 | 112.1 | T262 I263 L268 Q269 L270 | T262-Q266 WeakPolarHBondContact O-CB 3.45Å; T262-Q266 WeakPolarHBondContact O-CG 3.49Å; T262-Q266 PolarHBondContact O-N 3.45Å; I263-Q266 PolarHBondContact O-N 3.24Å; Q266-L268 PolarHBondContact O-N 3.41Å; Q266-Q269 PolarHBondContact O-N 2.94Å; Q266-L270 WeakPolarHBondContact O-CB 3.48Å; Q266-L270 VanDerWaalsContact O-CG 3.23Å; Q266-L270 WeakPolarHBondContact O-CG 3.41Å; Q266-L270 PolarHBondContact O-N 3.42Å |
| 267 | Q | 91.8 | Very high | 88.9 | Confident | 121 Ų | 121 | 100.1 Ų | 100.1 | 57% | 0.565 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -63.2 | -40.8 | 176.5 | -75.4 | 176.2 | 5.5 | 0 | 0 | 112.1 | I263 Q264 L270 A271 | I263-Q267 HydrophobicContact CG2-CG 4.44Å; I263-Q267 WeakPolarHBondContact O-CB 3.42Å; I263-Q267 VanDerWaalsContact O-CG 3.25Å; I263-Q267 WeakPolarHBondContact O-CG 3.41Å; I263-Q267 PolarHBondContact O-N 2.93Å; Q264-Q267 PolarHBondContact O-N 2.92Å; Q267-L270 PolarHBondContact O-N 2.91Å; Q267-A271 WeakPolarHBondContact O-CB 3.14Å; Q267-A271 PolarHBondContact O-N 2.91Å |
| 268 | L | 92.7 | Very high | 89.1 | Confident | 125 Ų | 125 | 104.7 Ų | 104.7 | 65% | 0.654 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -64.1 | -44.5 | 174.5 | -74.4 | 167.2 | 0 | 0 | 0 | 111.6 | Q264 S265 Q266 A271 H272 | Q264-L268 WeakPolarHBondContact O-CG 3.45Å; Q264-L268 PolarHBondContact O-N 3.24Å; S265-L268 PolarHBondContact O-N 2.93Å; Q266-L268 PolarHBondContact O-N 3.41Å; L268-A271 PolarHBondContact O-N 3.31Å; L268-H272 WeakPolarHBondContact O-CB 3.39Å; L268-H272 PolarHBondContact O-N 2.98Å |
| 269 | Q | 91.7 | Very high | 89 | Confident | 125 Ų | 125 | 106 Ų | 106 | 58% | 0.584 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.3 | -44.6 | 174.8 | -73.9 | 174.4 | -6.7 | 0 | 0 | 111.7 | S265 Q266 A271 H272 L273 | S265-Q269 WeakPolarHBondContact O-CB 3.46Å; S265-Q269 VanDerWaalsContact O-CG 3.3Å; S265-Q269 WeakPolarHBondContact O-CG 3.33Å; S265-Q269 PolarHBondContact O-N 3.38Å; Q266-Q269 PolarHBondContact O-N 2.94Å; Q269-A271 VanDerWaalsContact C-N 3.35Å; Q269-A271 PolarHBondContact O-N 3.49Å; Q269-H272 PolarHBondContact O-N 2.94Å; Q269-L273 WeakPolarHBondContact O-CB 3.49Å; Q269-L273 VanDerWaalsContact O-CG 3.31Å; Q269-L273 WeakPolarHBondContact O-CG 3.34Å; Q269-L273 PolarHBondContact O-N 3.14Å |
| 270 | L | 92.7 | Very high | 88.8 | Confident | 100 Ų | 100 | 104.9 Ų | 104.9 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -64.4 | -38.3 | 176.2 | -72.2 | 170.7 | 0 | 0 | 0 | 112.1 | Q266 Q267 K274 | Q266-L270 WeakPolarHBondContact O-CB 3.48Å; Q266-L270 VanDerWaalsContact O-CG 3.23Å; Q266-L270 WeakPolarHBondContact O-CG 3.41Å; Q266-L270 PolarHBondContact O-N 3.42Å; Q267-L270 PolarHBondContact O-N 2.91Å; L270-K274 WeakPolarHBondContact O-CB 3.43Å; L270-K274 VanDerWaalsContact O-CG 3.25Å; L270-K274 WeakPolarHBondContact O-CG 3.4Å; L270-K274 PolarHBondContact O-N 2.94Å |
| 271 | A | 91.9 | Very high | 88.4 | Confident | 44 Ų | 44 | 103.5 Ų | 103.5 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.4 | -44.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | Q267 L268 Q269 K274 Q275 | Q267-A271 WeakPolarHBondContact O-CB 3.14Å; Q267-A271 PolarHBondContact O-N 2.91Å; L268-A271 PolarHBondContact O-N 3.31Å; Q269-A271 VanDerWaalsContact C-N 3.35Å; Q269-A271 PolarHBondContact O-N 3.49Å; A271-K274 PolarHBondContact O-N 2.94Å; A271-Q275 WeakPolarHBondContact O-CG 3.48Å; A271-Q275 PolarHBondContact O-N 3.27Å |
| 272 | H | 91.7 | Very high | 87.9 | Confident | 111 Ų | 111 | 100.9 Ų | 100.9 | 51% | 0.514 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.5 | -46.1 | 175.4 | -174.2 | -115.1 | 0 | 0 | 0 | 111.8 | L268 Q269 K274 Q275 I276 | L268-H272 WeakPolarHBondContact O-CB 3.39Å; L268-H272 PolarHBondContact O-N 2.98Å; Q269-H272 PolarHBondContact O-N 2.94Å; H272-K274 VanDerWaalsContact C-N 3.33Å; H272-K274 PolarHBondContact O-N 3.39Å; H272-Q275 WeakPolarHBondContact O-CB 3.5Å; H272-Q275 PolarHBondContact O-N 3.13Å; H272-Q275 VanDerWaalsContact O-N 3.14Å; H272-I276 WeakPolarHBondContact CE1-CD1 3.49Å; H272-I276 WeakPolarHBondContact O-CG1 3.45Å; H272-I276 PolarHBondContact O-N 3.04Å |
| 273 | L | 91.2 | Very high | 87.1 | Confident | 93 Ų | 93 | 105.2 Ų | 105.2 | 49% | 0.487 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 175.1 | -72.3 | 170.7 | 0 | 0 | 0 | 112.4 | Q269 I276 K277 | Q269-L273 WeakPolarHBondContact O-CB 3.49Å; Q269-L273 VanDerWaalsContact O-CG 3.31Å; Q269-L273 WeakPolarHBondContact O-CG 3.34Å; Q269-L273 PolarHBondContact O-N 3.14Å; L273-I276 PolarHBondContact O-N 3.48Å; L273-K277 WeakPolarHBondContact O-CG 3.3Å; L273-K277 PolarHBondContact O-N 2.98Å |
| 274 | K | 91.3 | Very high | 86.1 | Confident | 141 Ų | 141 | 110.2 Ų | 110.2 | 61% | 0.613 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.8 | -39.7 | 173.9 | -76.5 | 174.2 | -178.9 | -178.2 | 0 | 111.8 | L270 A271 H272 K277 R278 | L270-K274 WeakPolarHBondContact O-CB 3.43Å; L270-K274 VanDerWaalsContact O-CG 3.25Å; L270-K274 WeakPolarHBondContact O-CG 3.4Å; L270-K274 PolarHBondContact O-N 2.94Å; A271-K274 PolarHBondContact O-N 2.94Å; H272-K274 VanDerWaalsContact C-N 3.33Å; H272-K274 PolarHBondContact O-N 3.39Å; K274-K277 PolarHBondContact O-N 3Å; K274-R278 WeakPolarHBondContact O-CB 3.45Å; K274-R278 WeakPolarHBondContact O-CG 3.4Å; K274-R278 PolarHBondContact O-N 3.32Å |
| 275 | Q | 88.9 | Confident | 84.9 | Confident | 114 Ų | 114 | 115.7 Ų | 115.7 | 53% | 0.533 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 174.9 | -72.2 | 177.3 | -5.9 | 0 | 0 | 111.6 | A271 H272 R278 K279 | A271-Q275 WeakPolarHBondContact O-CG 3.48Å; A271-Q275 PolarHBondContact O-N 3.27Å; H272-Q275 WeakPolarHBondContact O-CB 3.5Å; H272-Q275 PolarHBondContact O-N 3.13Å; H272-Q275 VanDerWaalsContact O-N 3.14Å; Q275-R278 PolarHBondContact O-N 3.06Å; Q275-K279 WeakPolarHBondContact O-CG 3.44Å; Q275-K279 PolarHBondContact O-N 3.4Å |
| 276 | I | 88.1 | Confident | 83.5 | Confident | 59 Ų | 59 | 123.2 Ų | 123.2 | 30% | 0.303 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -59.6 | -48.3 | 175.1 | -70.2 | 166.2 | 0 | 0 | 0 | 110.7 | H272 L273 R278 K279 H280 | H272-I276 WeakPolarHBondContact CE1-CD1 3.49Å; H272-I276 WeakPolarHBondContact O-CG1 3.45Å; H272-I276 PolarHBondContact O-N 3.04Å; L273-I276 PolarHBondContact O-N 3.48Å; I276-R278 VanDerWaalsContact C-N 3.34Å; I276-R278 PolarHBondContact O-N 2.97Å; I276-K279 PolarHBondContact O-N 2.96Å; I276-H280 VanDerWaalsContact CG2-CD2 3.43Å; I276-H280 WeakPolarHBondContact CG2-CD2 3.2Å; I276-H280 PolarHBondContact O-CD2 3.46Å; I276-H280 VanDerWaalsContact O-CD2 3.24Å; I276-H280 PolarHBondContact O-N 2.95Å |
| 277 | K | 86.5 | Confident | 82.2 | Confident | 158 Ų | 158 | 125.3 Ų | 125.3 | 69% | 0.687 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -60.8 | -41 | 177.2 | -75.1 | -174.3 | 178.1 | -172.5 | 0 | 112.5 | L273 K274 H280 S281 | L273-K277 WeakPolarHBondContact O-CG 3.3Å; L273-K277 PolarHBondContact O-N 2.98Å; K274-K277 PolarHBondContact O-N 3Å; K277-H280 PolarHBondContact O-N 2.97Å; K277-S281 WeakPolarHBondContact O-CB 3.23Å; K277-S281 PolarHBondContact O-N 3.23Å; K277-S281 PolarHBondContact O-OG 2.94Å |
| 278 | R | 82.9 | Confident | 80.8 | Confident | 184 Ų | 184 | 124.2 Ų | 124.2 | 69% | 0.694 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -61.3 | -48.8 | 174.2 | -76.3 | 176.8 | 175.6 | -178.4 | -2.4 | 111.2 | K274 Q275 I276 H280 S281 S282 | K274-R278 WeakPolarHBondContact O-CB 3.45Å; K274-R278 WeakPolarHBondContact O-CG 3.4Å; K274-R278 PolarHBondContact O-N 3.32Å; Q275-R278 PolarHBondContact O-N 3.06Å; I276-R278 VanDerWaalsContact C-N 3.34Å; I276-R278 PolarHBondContact O-N 2.97Å; R278-H280 PolarHBondContact O-N 3.42Å; R278-S281 WeakPolarHBondContact CA-OG 3.41Å; R278-S281 PolarHBondContact O-N 3.33Å; R278-S281 PolarHBondContact O-OG 3.13Å; R278-S282 PolarHBondContact O-N 3.22Å; R278-S282 PolarHBondContact O-OG 2.98Å |
| 279 | K | 82.5 | Confident | 79.1 | Confident | 146 Ų | 146 | 125.8 Ų | 125.8 | 64% | 0.635 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -57.4 | -46 | 176.6 | -73.6 | -178.6 | 178.9 | -176.5 | 0 | 112.2 | Q275 I276 S282 Q283 | Q275-K279 WeakPolarHBondContact O-CG 3.44Å; Q275-K279 PolarHBondContact O-N 3.4Å; I276-K279 PolarHBondContact O-N 2.96Å; K279-S282 PolarHBondContact O-N 3.36Å; K279-Q283 PolarHBondContact O-N 2.71Å |
| 280 | H | 79.1 | Confident | 77.6 | Confident | 109 Ų | 109 | 123.3 Ų | 123.3 | 51% | 0.505 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -65.4 | -37.9 | 176.6 | -74.2 | -58.8 | 0 | 0 | 0 | 113 | I276 K277 R278 Q283 R284 | I276-H280 VanDerWaalsContact CG2-CD2 3.43Å; I276-H280 WeakPolarHBondContact CG2-CD2 3.2Å; I276-H280 PolarHBondContact O-CD2 3.46Å; I276-H280 VanDerWaalsContact O-CD2 3.24Å; I276-H280 PolarHBondContact O-N 2.95Å; K277-H280 PolarHBondContact O-N 2.97Å; R278-H280 PolarHBondContact O-N 3.42Å; H280-Q283 PolarHBondContact O-N 3.19Å; H280-R284 WeakPolarHBondContact O-CG 3.5Å; H280-R284 PolarHBondContact O-N 2.83Å |
| 281 | S | 75.7 | Confident | 75.9 | Confident | 64 Ų | 64 | 125.3 Ų | 125.3 | 45% | 0.448 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -65.2 | -37.3 | 175.3 | 68.4 | 0 | 0 | 0 | 0 | 112.8 | K277 R278 R285 | K277-S281 WeakPolarHBondContact O-CB 3.23Å; K277-S281 PolarHBondContact O-N 3.23Å; K277-S281 PolarHBondContact O-OG 2.94Å; R278-S281 WeakPolarHBondContact CA-OG 3.41Å; R278-S281 PolarHBondContact O-N 3.33Å; R278-S281 PolarHBondContact O-OG 3.13Å; S281-R285 PolarHBondContact O-N 3.16Å; S281-R285 VanDerWaalsContact O-N 3.13Å |
| 282 | S | 73.6 | Confident | 74.2 | Confident | 71 Ų | 71 | 130.9 Ų | 130.9 | 50% | 0.497 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -70.2 | -36.4 | 174.8 | -59.7 | 0 | 0 | 0 | 0 | 112.4 | R278 K279 R286 | R278-S282 PolarHBondContact O-N 3.22Å; R278-S282 PolarHBondContact O-OG 2.98Å; K279-S282 PolarHBondContact O-N 3.36Å; S282-R286 WeakPolarHBondContact O-CG 3.48Å; S282-R286 PolarHBondContact O-N 3.11Å; S282-R286 VanDerWaalsContact O-N 3.14Å |
| 283 | Q | 73.5 | Confident | 72.6 | Confident | 131 Ų | 131 | 129.8 Ų | 129.8 | 61% | 0.612 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.4 | -38.9 | 174.5 | -76.7 | -170.6 | -15.7 | 0 | 0 | 112.5 | K279 H280 R286 K287 | K279-Q283 PolarHBondContact O-N 2.71Å; H280-Q283 PolarHBondContact O-N 3.19Å; Q283-R286 PolarHBondContact O-N 3.48Å; Q283-K287 PolarHBondContact O-N 3.13Å |
| 284 | R | 68.5 | Low | 71.1 | Confident | 191 Ų | 191 | 132.1 Ų | 132.1 | 72% | 0.721 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -60.5 | -49.5 | 173.8 | -78.3 | -174.8 | 166.2 | -155 | -5.2 | 111.5 | H280 R286 K287 D288 | H280-R284 WeakPolarHBondContact O-CG 3.5Å; H280-R284 PolarHBondContact O-N 2.83Å; R284-R286 VanDerWaalsContact C-N 3.27Å; R284-R286 PolarHBondContact O-N 3.25Å; R284-K287 PolarHBondContact O-N 3.23Å; R284-D288 VanDerWaalsContact O-CG 3.23Å; R284-D288 PolarHBondContact O-N 2.74Å |
| 285 | R | 64 | Low | 69.7 | Low | 203 Ų | 203 | 130.5 Ų | 130.5 | 77% | 0.766 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -57.5 | -36.4 | 176 | -76.9 | -173 | 168.3 | -164.8 | -4.8 | 113.8 | S281 H289 | S281-R285 PolarHBondContact O-N 3.16Å; S281-R285 VanDerWaalsContact O-N 3.13Å; R285-H289 PolarHBondContact O-N 3.49Å |
| 286 | R | 63.6 | Low | 68.1 | Low | 198 Ų | 198 | 132.5 Ų | 132.5 | 75% | 0.747 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -68.9 | -37.7 | 175.4 | -76.8 | -175.6 | 173.9 | -169.8 | -3.2 | 112.3 | S282 Q283 R284 H289 S290 | S282-R286 WeakPolarHBondContact O-CG 3.48Å; S282-R286 PolarHBondContact O-N 3.11Å; S282-R286 VanDerWaalsContact O-N 3.14Å; Q283-R286 PolarHBondContact O-N 3.48Å; R284-R286 VanDerWaalsContact C-N 3.27Å; R284-R286 PolarHBondContact O-N 3.25Å; R286-H289 PolarHBondContact O-N 3.26Å; R286-S290 PolarHBondContact O-N 3.27Å; R286-S290 PolarHBondContact O-OG 3.5Å |
| 287 | K | 63.9 | Low | 66.9 | Low | 144 Ų | 144 | 138.6 Ų | 138.6 | 63% | 0.626 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -69.5 | -40.4 | 179.3 | -162.6 | 173.8 | -176.8 | -179.3 | 0 | 111.7 | Q283 R284 H289 S290 Q291 | Q283-K287 PolarHBondContact O-N 3.13Å; R284-K287 PolarHBondContact O-N 3.23Å; K287-H289 VanDerWaalsContact C-N 3.32Å; K287-H289 PolarHBondContact O-N 3.16Å; K287-S290 PolarHBondContact O-N 3.47Å; K287-S290 VanDerWaalsContact O-N 3.16Å; K287-Q291 PolarHBondContact O-N 3.24Å |
| 288 | D | 62.5 | Low | 65.6 | Low | 97 Ų | 97 | 138.5 Ų | 138.5 | 52% | 0.519 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -63.4 | -40.7 | 176.9 | -55.4 | -25.7 | 0 | 0 | 0 | 110.6 | R284 S290 Q291 | R284-D288 VanDerWaalsContact O-CG 3.23Å; R284-D288 PolarHBondContact O-N 2.74Å; D288-S290 PolarHBondContact O-N 3.26Å; D288-Q291 PolarHBondContact O-N 3.14Å |
| 289 | H | 58.7 | Low | 64.4 | Low | 158 Ų | 158 | 138 Ų | 138 | 73% | 0.731 | 68% | 0.677 | S | S | * | * | H | α-helix | trans | -71.1 | -14.9 | 177.3 | -139.5 | 47.9 | 0 | 0 | 0 | 114.5 | R285 R286 K287 | R285-H289 PolarHBondContact O-N 3.49Å; R286-H289 PolarHBondContact O-N 3.26Å; K287-H289 VanDerWaalsContact C-N 3.32Å; K287-H289 PolarHBondContact O-N 3.16Å |
| 290 | S | 60.1 | Low | 63.3 | Low | 74 Ų | 74 | 137.4 Ų | 137.4 | 52% | 0.517 | 69% | 0.686 | S | S | . | * | H | α-helix | trans | -87.9 | -14.6 | 176.7 | -44.5 | 0 | 0 | 0 | 0 | 112.5 | R286 K287 D288 | R286-S290 PolarHBondContact O-N 3.27Å; R286-S290 PolarHBondContact O-OG 3.5Å; K287-S290 PolarHBondContact O-N 3.47Å; K287-S290 VanDerWaalsContact O-N 3.16Å; D288-S290 PolarHBondContact O-N 3.26Å |
| 291 | Q | 56.7 | Low | 62.3 | Low | 141 Ų | 141 | 139.6 Ų | 139.6 | 66% | 0.659 | 70% | 0.702 | S | S | * | * | H | α-helix | trans | -95.6 | -17.8 | 179.5 | -66.9 | -162.9 | -68.7 | 0 | 0 | 112.9 | K287 D288 | K287-Q291 PolarHBondContact O-N 3.24Å; D288-Q291 PolarHBondContact O-N 3.14Å |
| 292 | E | 55.1 | Low | 61.3 | Low | 162 Ų | 162 | 142.8 Ų | 142.8 | 76% | 0.757 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -85.3 | -13.6 | -179.1 | -148.1 | 86.5 | -150.9 | 0 | 0 | 113.2 | ||
| 293 | S | 58.8 | Low | 60.5 | Low | 88 Ų | 88 | 145.3 Ų | 145.3 | 62% | 0.615 | 73% | 0.727 | S | S | * | * | G | 310 helix | trans | -87 | -1.2 | -175.6 | 58.7 | 0 | 0 | 0 | 0 | 115.1 | ||
| 294 | D | 58.4 | Low | 59.4 | Low | 142 Ų | 142 | 148.4 Ų | 148.4 | 76% | 0.759 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -105.8 | 17.8 | -173.7 | -73.1 | -11.2 | 0 | 0 | 0 | 113.4 | ||
| 295 | V | 62 | Low | 58.9 | Low | 106 Ų | 106 | 146.3 Ų | 146.3 | 64% | 0.642 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -132.6 | 132.2 | 176.7 | -165.1 | 0 | 0 | 0 | 0 | 107.2 | ||
| 296 | D | 57 | Low | 58.7 | Low | 156 Ų | 156 | 143.3 Ų | 143.3 | 83% | 0.834 | 76% | 0.764 | S | S | * | * | trans | 104 | 61.1 | 175.2 | -47 | -28.7 | 0 | 0 | 0 | 116.5 | ||||
| 297 | E | 61.4 | Low | 58.4 | Low | 187 Ų | 187 | 140.2 Ų | 140.2 | 87% | 0.874 | 77% | 0.765 | S | S | * | * | trans | -137.1 | 91.8 | 149.1 | -85.4 | -172.4 | 176.4 | 0 | 0 | 108.1 | ||||
| 298 | D | 59.7 | Low | 58.1 | Low | 156 Ų | 156 | 140 Ų | 140 | 83% | 0.834 | 77% | 0.774 | S | S | * | * | trans | 178.6 | 99 | 153.8 | -95.4 | -24.8 | 0 | 0 | 0 | 107 | ||||
| 299 | D | 57.8 | Low | 57.8 | Low | 173 Ų | 173 | 142.7 Ų | 142.7 | 93% | 0.925 | 79% | 0.789 | S | S | * | * | trans | -179.4 | 79.1 | 151.5 | -88.2 | -26.3 | 0 | 0 | 0 | 108.4 | ||||
| 300 | T | 60.1 | Low | 57.8 | Low | 134 Ų | 134 | 141.7 Ų | 141.7 | 82% | 0.822 | 79% | 0.793 | S | S | * | * | trans | -111 | 105.6 | 158.5 | 49.4 | 0 | 0 | 0 | 0 | 107.9 | ||||
| 301 | D | 56.9 | Low | 57.6 | Low | 156 Ų | 156 | 146.5 Ų | 146.5 | 83% | 0.834 | 81% | 0.813 | S | S | * | * | trans | -166 | 111.7 | 149.4 | -103.2 | -16.7 | 0 | 0 | 0 | 106.3 | ||||
| 302 | D | 55.7 | Low | 57.7 | Low | 130 Ų | 130 | 146.9 Ų | 146.9 | 70% | 0.695 | 83% | 0.825 | S | S | * | * | 90 | 106.3 | 97.5 | -167.5 | 19 | 0 | 0 | 0 | 109.1 | |||||
| 303 | T | 55.3 | Low | 57.9 | Low | 125 Ų | 125 | 145.7 Ų | 145.7 | 77% | 0.767 | 83% | 0.831 | S | S | * | * | 171 | 115.4 | 128.4 | 32.6 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 304 | S | 51.2 | Low | 57.8 | Low | 195 Ų | 195 | 150.9 Ų | 150.9 | 100% | 1.364 | 85% | 0.85 | S | S | * | * | trans | 58.5 | 0 | 146.7 | -58.4 | 0 | 0 | 0 | 0 | 120.8 |
Retrieved 304 of 304 residues in 50.3 ms
(Link to these results)