| 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 | 52.9 | Low | 57.4 | Low | 215 Ų | 215 | 125.1 Ų | 125.1 | 100% | 1.059 | 64% | 0.644 | S | S | * | * | 0 | -19.1 | 0 | -72.8 | 175 | 141.3 | 0 | 0 | 113.9 | S3 | M1-S3 PolarHBondContact O-N 3.37Š| |||
| 2 | T | 52.7 | Low | 56.9 | Low | 122 Ų | 122 | 125.6 Ų | 125.6 | 75% | 0.748 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -69.5 | -24.9 | 175.7 | 47.3 | 0 | 0 | 0 | 0 | 114.8 | K6 | T2-K6 PolarHBondContact O-N 2.88Å |
| 3 | S | 56.1 | Low | 56.8 | Low | 82 Ų | 82 | 122.3 Ų | 122.3 | 57% | 0.573 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -70.5 | -39.1 | -178.6 | -165.1 | 0 | 0 | 0 | 0 | 113.5 | M1 V5 K6 L7 | M1-S3 PolarHBondContact O-N 3.37Å; S3-V5 PolarHBondContact O-N 2.81Å; S3-K6 PolarHBondContact O-N 2.96Å; S3-L7 PolarHBondContact O-N 3.22Å |
| 4 | F | 57.8 | Low | 56.6 | Low | 157 Ų | 157 | 118.2 Ų | 118.2 | 69% | 0.689 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.9 | -35 | 179.6 | -93.1 | -87.8 | 0 | 0 | 0 | 112.8 | L7 I8 | F4-L7 PolarHBondContact O-N 3.19Å; F4-I8 WeakPolarHBondContact O-CG1 3.14Å; F4-I8 PolarHBondContact O-N 2.92Å; F4-I8 VanDerWaalsContact O-N 3.15Å |
| 5 | V | 60.5 | Low | 56.4 | Low | 77 Ų | 77 | 115.2 Ų | 115.2 | 47% | 0.467 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -67.6 | -40.4 | 177.7 | -177.9 | 0 | 0 | 0 | 0 | 111.1 | S3 L7 I8 C9 | S3-V5 PolarHBondContact O-N 2.81Å; V5-L7 VanDerWaalsContact C-N 3.34Å; V5-L7 PolarHBondContact O-N 3.5Å; V5-I8 PolarHBondContact O-N 2.88Å; V5-C9 PolarHBondContact O-N 2.83Å; V5-C9 VanDerWaalsContact O-N 3.1Å |
| 6 | K | 59.9 | Low | 56.2 | Low | 157 Ų | 157 | 112.5 Ų | 112.5 | 68% | 0.683 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -62.4 | -39.2 | 174.4 | -86.2 | -175.5 | 177.1 | 176.8 | 0 | 112.7 | T2 S3 C9 F10 | T2-K6 PolarHBondContact O-N 2.88Å; S3-K6 PolarHBondContact O-N 2.96Å; K6-C9 PolarHBondContact O-N 2.99Å; K6-F10 WeakPolarHBondContact O-CB 3.37Å; K6-F10 PolarHBondContact O-N 3Å |
| 7 | L | 58.5 | Low | 55.9 | Low | 103 Ų | 103 | 115.2 Ų | 115.2 | 54% | 0.539 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -66.8 | -40 | 179.9 | -119.2 | 153.1 | 0 | 0 | 0 | 112.3 | S3 F4 V5 F10 Q11 | S3-L7 PolarHBondContact O-N 3.22Å; F4-L7 PolarHBondContact O-N 3.19Å; V5-L7 VanDerWaalsContact C-N 3.34Å; V5-L7 PolarHBondContact O-N 3.5Å; L7-F10 PolarHBondContact O-N 3.49Å; L7-Q11 PolarHBondContact O-N 2.98Å; L7-Q11 VanDerWaalsContact O-N 3.14Å |
| 8 | I | 61.9 | Low | 55.5 | Low | 106 Ų | 106 | 115.6 Ų | 115.6 | 54% | 0.544 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -68.4 | -40.5 | 177.2 | -66.4 | 167.3 | 0 | 0 | 0 | 110.8 | F4 V5 F12 | F4-I8 WeakPolarHBondContact O-CG1 3.14Å; F4-I8 PolarHBondContact O-N 2.92Å; F4-I8 VanDerWaalsContact O-N 3.15Å; V5-I8 PolarHBondContact O-N 2.88Å; I8-F12 PolarHBondContact O-N 2.72Å; I8-F12 VanDerWaalsContact O-N 3.14Å |
| 9 | C | 57.7 | Low | 55.2 | Low | 77 Ų | 77 | 114.2 Ų | 114.2 | 52% | 0.52 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -66.7 | -37.1 | 175.5 | -72.9 | 0 | 0 | 0 | 0 | 113.3 | V5 K6 S13 | V5-C9 PolarHBondContact O-N 2.83Å; V5-C9 VanDerWaalsContact O-N 3.1Å; K6-C9 PolarHBondContact O-N 2.99Å; C9-S13 PolarHBondContact O-N 2.95Å; C9-S13 VanDerWaalsContact O-N 3.14Å |
| 10 | F | 57 | Low | 55.1 | Low | 160 Ų | 160 | 112.4 Ų | 112.4 | 70% | 0.702 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -71.7 | -36.2 | -180 | -132.6 | -93.9 | 0 | 0 | 0 | 112.8 | K6 L7 S14 | K6-F10 WeakPolarHBondContact O-CB 3.37Å; K6-F10 PolarHBondContact O-N 3Å; L7-F10 PolarHBondContact O-N 3.49Å; F10-S14 PolarHBondContact O-N 3.23Å; F10-S14 PolarHBondContact O-OG 3.14Å |
| 11 | Q | 56.8 | Low | 54.9 | Low | 120 Ų | 120 | 110.8 Ų | 110.8 | 56% | 0.561 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -70.9 | -39.9 | 175.8 | -79.8 | -72.1 | -16.3 | 0 | 0 | 112 | L7 S14 S15 | L7-Q11 PolarHBondContact O-N 2.98Å; L7-Q11 VanDerWaalsContact O-N 3.14Å; Q11-S14 PolarHBondContact O-N 3.48Å; Q11-S15 PolarHBondContact O-N 3.28Å; Q11-S15 PolarHBondContact O-OG 3.49Å |
| 12 | F | 51 | Low | 54.9 | Low | 131 Ų | 131 | 109.7 Ų | 109.7 | 58% | 0.575 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -69.1 | -35.7 | 177.9 | -105.5 | -93.9 | 0 | 0 | 0 | 113.4 | I8 V16 | I8-F12 PolarHBondContact O-N 2.72Å; I8-F12 VanDerWaalsContact O-N 3.14Å; F12-V16 HydrophobicContact CD1-CG2 4.1Å; F12-V16 WeakPolarHBondContact O-CB 3.27Å; F12-V16 WeakPolarHBondContact O-CG2 3.14Å; F12-V16 PolarHBondContact O-N 3.03Å |
| 13 | S | 56.2 | Low | 54.8 | Low | 83 Ų | 83 | 112.6 Ų | 112.6 | 58% | 0.58 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -69.3 | -33.6 | 178.3 | -162.8 | 0 | 0 | 0 | 0 | 112.6 | C9 | C9-S13 PolarHBondContact O-N 2.95Å; C9-S13 VanDerWaalsContact O-N 3.14Å |
| 14 | S | 54.1 | Low | 54.7 | Low | 65 Ų | 65 | 116 Ų | 116 | 46% | 0.455 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -79.5 | -37.2 | -176 | -50.3 | 0 | 0 | 0 | 0 | 113.2 | F10 Q11 | F10-S14 PolarHBondContact O-N 3.23Å; F10-S14 PolarHBondContact O-OG 3.14Å; Q11-S14 PolarHBondContact O-N 3.48Å |
| 15 | S | 53.5 | Low | 54.5 | Low | 73 Ų | 73 | 113 Ų | 113 | 51% | 0.51 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -85.6 | -25 | -176.1 | -56.5 | 0 | 0 | 0 | 0 | 113.9 | Q11 | Q11-S15 PolarHBondContact O-N 3.28Å; Q11-S15 PolarHBondContact O-OG 3.49Å |
| 16 | V | 53.1 | Low | 54 | Low | 72 Ų | 72 | 119.2 Ų | 119.2 | 44% | 0.436 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -77.8 | -32.8 | -177.8 | 178.8 | 0 | 0 | 0 | 0 | 111.6 | F12 L18 S19 V20 | F12-V16 HydrophobicContact CD1-CG2 4.1Å; F12-V16 WeakPolarHBondContact O-CB 3.27Å; F12-V16 WeakPolarHBondContact O-CG2 3.14Å; F12-V16 PolarHBondContact O-N 3.03Å; V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 2.96Å; V16-S19 PolarHBondContact O-N 2.69Å; V16-V20 HydrophobicContact CG1-CG2 3.9Å; V16-V20 VanDerWaalsContact O-CG2 3.32Å; V16-V20 WeakPolarHBondContact O-CG2 3.41Å; V16-V20 PolarHBondContact O-N 2.87Å |
| 17 | Q | 50.7 | Low | 53.6 | Low | 159 Ų | 159 | 120.7 Ų | 120.7 | 74% | 0.743 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -63.2 | -32.2 | 178 | -73.1 | -117.3 | -21.5 | 0 | 0 | 113.6 | ||
| 18 | L | 47.9 | Very low | 52.6 | Low | 122 Ų | 122 | 127 Ų | 127 | 64% | 0.639 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -83.6 | -19.7 | -179.3 | -96.3 | 123.4 | 0 | 0 | 0 | 114.8 | V16 | V16-L18 VanDerWaalsContact C-N 3.31Å; V16-L18 PolarHBondContact O-N 2.96Å |
| 19 | S | 50.7 | Low | 52.4 | Low | 88 Ų | 88 | 126.7 Ų | 126.7 | 62% | 0.615 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -93.1 | -32.9 | 179 | -82.3 | 0 | 0 | 0 | 0 | 114.1 | V16 A21 R22 | V16-S19 PolarHBondContact O-N 2.69Å; S19-A21 VanDerWaalsContact C-N 3.31Å; S19-A21 PolarHBondContact O-N 2.77Å; S19-R22 PolarHBondContact O-N 2.84Å |
| 20 | V | 52.5 | Low | 52.2 | Low | 79 Ų | 79 | 129.8 Ų | 129.8 | 48% | 0.479 | 67% | 0.666 | S | S | . | * | H | α-helix | trans | -70.8 | -29.3 | -176.8 | -174 | 0 | 0 | 0 | 0 | 111.9 | V16 R22 F23 L24 | V16-V20 HydrophobicContact CG1-CG2 3.9Å; V16-V20 VanDerWaalsContact O-CG2 3.32Å; V16-V20 WeakPolarHBondContact O-CG2 3.41Å; V16-V20 PolarHBondContact O-N 2.87Å; V20-R22 PolarHBondContact O-N 2.84Å; V20-F23 PolarHBondContact O-N 3.1Å; V20-L24 HydrophobicContact CG1-CD1 4.34Å |
| 21 | A | 50.7 | Low | 52 | Low | 79 Ų | 79 | 132.8 Ų | 132.8 | 65% | 0.653 | 67% | 0.673 | S | S | * | * | H | α-helix | trans | -66.3 | -17.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | S19 | S19-A21 VanDerWaalsContact C-N 3.31Å; S19-A21 PolarHBondContact O-N 2.77Å |
| 22 | R | 52.7 | Low | 51.4 | Low | 192 Ų | 192 | 135 Ų | 135 | 73% | 0.725 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -98.9 | -10.4 | 178.6 | -62.6 | -170.8 | -164.2 | 165.9 | 5.4 | 114.3 | S19 V20 | S19-R22 PolarHBondContact O-N 2.84Å; V20-R22 PolarHBondContact O-N 2.84Å |
| 23 | F | 52.5 | Low | 51.5 | Low | 182 Ų | 182 | 136.8 Ų | 136.8 | 80% | 0.798 | 70% | 0.698 | S | S | * | * | H | α-helix | trans | -94 | -23.4 | -172.5 | -156.2 | -102.4 | 0 | 0 | 0 | 113.5 | V20 S25 | V20-F23 PolarHBondContact O-N 3.1Å; F23-S25 PolarHBondContact O-N 3.06Å |
| 24 | L | 52.7 | Low | 51.1 | Low | 154 Ų | 154 | 142.9 Ų | 142.9 | 81% | 0.806 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86 | -1.4 | -176.6 | -82.7 | 156.2 | 0 | 0 | 0 | 115.2 | V20 | V20-L24 HydrophobicContact CG1-CD1 4.34Š|
| 25 | S | 53.6 | Low | 50.4 | Low | 93 Ų | 93 | 145 Ų | 145 | 65% | 0.65 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.3 | 8.8 | -178.1 | 58.5 | 0 | 0 | 0 | 0 | 115.5 | F23 | F23-S25 PolarHBondContact O-N 3.06Š|
| 26 | R | 50.2 | Low | 50.4 | Low | 208 Ų | 208 | 148.1 Ų | 148.1 | 79% | 0.785 | 74% | 0.738 | S | S | * | * | trans | -115.2 | 78.3 | 176.4 | -70.4 | -173 | 176.9 | -98 | 0.5 | 112.4 | ||||
| 27 | Q | 52.6 | Low | 49.8 | Very low | 188 Ų | 188 | 150.2 Ų | 150.2 | 88% | 0.879 | 76% | 0.756 | S | S | * | * | trans | 12.3 | 110.1 | 137.1 | -132.7 | 163.4 | 18.4 | 0 | 0 | 116.9 | ||||
| 28 | W | 36.9 | Very low | 49.5 | Very low | 236 Ų | 236 | 148.5 Ų | 148.5 | 89% | 0.894 | 76% | 0.761 | S | S | * | * | trans | -127.8 | 120.1 | 155.5 | -78 | 65.9 | 0 | 0 | 0 | 108.4 | V30 | W28-V30 PolarHBondContact O-N 3.34Š| ||
| 29 | P | 56.4 | Low | 49.3 | Very low | 99 Ų | 99 | 147.2 Ų | 147.2 | 64% | 0.643 | 77% | 0.769 | S | S | * | * | trans | -75.3 | 124.6 | 177.2 | 29.5 | -30.9 | 0 | 0 | 0 | 109.8 | R31 | P29-R31 PolarHBondContact O-N 3.05Š| ||
| 30 | V | 54.3 | Low | 49.1 | Very low | 142 Ų | 142 | 148 Ų | 148 | 86% | 0.861 | 77% | 0.774 | S | S | * | * | trans | -66.4 | 111.9 | 166.8 | -179.2 | 0 | 0 | 0 | 0 | 107.6 | W28 | W28-V30 PolarHBondContact O-N 3.34Š| ||
| 31 | R | 52.8 | Low | 48.6 | Very low | 223 Ų | 223 | 151.8 Ų | 151.8 | 84% | 0.842 | 79% | 0.792 | S | S | * | * | trans | -121.1 | 108.5 | 169.2 | -128.8 | -172.1 | -76 | -114.1 | 4.9 | 108.6 | P29 | P29-R31 PolarHBondContact O-N 3.05Š| ||
| 32 | L | 44.2 | Very low | 48.4 | Very low | 166 Ų | 166 | 153.5 Ų | 153.5 | 87% | 0.869 | 80% | 0.799 | S | S | * | * | trans | -89.9 | 116.3 | 173 | -152.3 | 103.6 | 0 | 0 | 0 | 107.6 | ||||
| 33 | H | 52.1 | Low | 47.9 | Very low | 170 Ų | 170 | 149.6 Ų | 149.6 | 79% | 0.787 | 80% | 0.801 | S | S | * | * | trans | -152.1 | 105.2 | 162.5 | -158.8 | -105.2 | 0 | 0 | 0 | 113.2 | ||||
| 34 | R | 48.1 | Very low | 48 | Very low | 211 Ų | 211 | 147 Ų | 147 | 80% | 0.796 | 80% | 0.8 | S | S | * | * | trans | 40.3 | 124 | 132.9 | -166.6 | 175 | -98.8 | -144.5 | -3.9 | 119.8 | ||||
| 35 | S | 40.8 | Very low | 47.7 | Very low | 109 Ų | 109 | 146 Ų | 146 | 76% | 0.762 | 80% | 0.8 | S | S | * | * | trans | -60.6 | 143.8 | 168.9 | 44.2 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 36 | V | 51.7 | Low | 47.5 | Very low | 139 Ų | 139 | 147 Ų | 147 | 84% | 0.842 | 81% | 0.805 | S | S | * | * | trans | -142.1 | 128.4 | 151.7 | 176.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 37 | S | 42.2 | Very low | 47.3 | Very low | 116 Ų | 116 | 142 Ų | 142 | 81% | 0.811 | 81% | 0.808 | S | S | * | * | trans | -74.4 | 143.8 | 174.5 | 40.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 38 | S | 44.5 | Very low | 47 | Very low | 122 Ų | 122 | 138 Ų | 138 | 85% | 0.853 | 81% | 0.807 | S | S | * | * | trans | -142.8 | 122 | 159.9 | -176.5 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 39 | A | 43.9 | Very low | 47.3 | Very low | 96 Ų | 96 | 135.4 Ų | 135.4 | 79% | 0.793 | 80% | 0.802 | S | S | * | * | trans | -92.3 | 143.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 40 | S | 45.2 | Very low | 46.7 | Very low | 104 Ų | 104 | 140.7 Ų | 140.7 | 73% | 0.727 | 81% | 0.809 | S | S | * | * | trans | -152.7 | 111.1 | 151.4 | 80.9 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 41 | N | 43.2 | Very low | 46.3 | Very low | 158 Ų | 158 | 140.6 Ų | 140.6 | 85% | 0.845 | 80% | 0.799 | S | S | * | * | trans | 77.7 | 103 | 133.4 | -57.3 | -8.5 | 0 | 0 | 0 | 121 | ||||
| 42 | S | 46 | Very low | 46 | Very low | 115 Ų | 115 | 136.7 Ų | 136.7 | 80% | 0.804 | 80% | 0.795 | S | S | * | * | trans | -75.9 | 140.5 | 153.1 | 52.2 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 43 | S | 41.9 | Very low | 46.5 | Very low | 111 Ų | 111 | 136.6 Ų | 136.6 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -166.8 | 106.3 | 144.2 | 43.2 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 44 | V | 54 | Low | 46.5 | Very low | 128 Ų | 128 | 133.7 Ų | 133.7 | 78% | 0.776 | 79% | 0.79 | S | S | * | * | 54.7 | 115.9 | 100.3 | -172.6 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 45 | T | 47.1 | Very low | 46.4 | Very low | 131 Ų | 131 | 129.3 Ų | 129.3 | 80% | 0.804 | 79% | 0.79 | S | S | * | * | -170.6 | 140.4 | 81.1 | -36.3 | 0 | 0 | 0 | 0 | 111.1 | |||||
| 46 | P | 49.2 | Very low | 46.9 | Very low | 116 Ų | 116 | 126.9 Ų | 126.9 | 75% | 0.753 | 78% | 0.776 | S | S | * | * | trans | -103.9 | 150.5 | 172.2 | 37.2 | -28.2 | 0 | 0 | 0 | 112.4 | ||||
| 47 | A | 47.2 | Very low | 47.1 | Very low | 102 Ų | 102 | 126 Ų | 126 | 84% | 0.843 | 77% | 0.766 | S | S | * | * | trans | -176.9 | 110.2 | 149 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 48 | A | 44.9 | Very low | 47.7 | Very low | 104 Ų | 104 | 126 Ų | 126 | 86% | 0.86 | 76% | 0.761 | S | S | * | * | trans | 22.3 | 118.9 | 140.9 | 0 | 0 | 0 | 0 | 0 | 121.9 | ||||
| 49 | K | 42.9 | Very low | 48.2 | Very low | 181 Ų | 181 | 125.1 Ų | 125.1 | 79% | 0.787 | 75% | 0.751 | S | S | * | * | trans | -163.1 | 107.2 | 133.4 | -152.6 | 166.2 | -178.5 | -172.5 | 0 | 107.6 | ||||
| 50 | R | 45.5 | Very low | 48.7 | Very low | 210 Ų | 210 | 126.6 Ų | 126.6 | 79% | 0.792 | 74% | 0.741 | S | S | * | * | 43.5 | 134.5 | 107.3 | -57.7 | -172.1 | -179.6 | 146.9 | 1 | 112.6 | |||||
| 51 | E | 44.4 | Very low | 49.2 | Very low | 141 Ų | 141 | 128.3 Ų | 128.3 | 66% | 0.659 | 74% | 0.736 | S | S | * | * | cis | 174.4 | 145.6 | 17.8 | 40 | -152.2 | 124.4 | 0 | 0 | 105.8 | ||||
| 52 | N | 47.3 | Very low | 49.8 | Very low | 140 Ų | 140 | 125.5 Ų | 125.5 | 75% | 0.749 | 72% | 0.724 | S | S | * | * | trans | 87.8 | 135.1 | 167 | -56.9 | -74.4 | 0 | 0 | 0 | 120.6 | ||||
| 53 | L | 54 | Low | 50.1 | Low | 165 Ų | 165 | 127.6 Ų | 127.6 | 86% | 0.864 | 72% | 0.719 | S | S | * | * | trans | 96.4 | 150.4 | 159.7 | -53.1 | 169.5 | 0 | 0 | 0 | 117.2 | ||||
| 54 | P | 53.2 | Low | 50.8 | Low | 108 Ų | 108 | 129.4 Ų | 129.4 | 70% | 0.701 | 72% | 0.715 | S | S | * | * | -106.4 | -179.8 | -88.5 | 0.5 | 24.4 | 0 | 0 | 0 | 111.8 | A56 | P54-A56 PolarHBondContact O-N 3.23Š| |||
| 55 | P | 45.2 | Very low | 50.9 | Low | 120 Ų | 120 | 128.2 Ų | 128.2 | 78% | 0.779 | 71% | 0.708 | S | S | * | * | trans | -74.2 | 83.5 | -163.8 | 33.2 | -36.1 | 0 | 0 | 0 | 112.9 | N57 | P55-N57 PolarHBondContact O-N 2.77Š| ||
| 56 | A | 50.6 | Low | 51.4 | Low | 58 Ų | 58 | 126.5 Ų | 126.5 | 48% | 0.479 | 70% | 0.698 | S | S | . | * | trans | -81.9 | 2.1 | 173 | 0 | 0 | 0 | 0 | 0 | 113.7 | P54 V58 T59 E60 | P54-A56 PolarHBondContact O-N 3.23Å; A56-V58 PolarHBondContact O-N 2.8Å; A56-T59 PolarHBondContact O-N 3.01Å; A56-E60 PolarHBondContact O-N 3.46Å | ||
| 57 | N | 57.3 | Low | 51.9 | Low | 119 Ų | 119 | 129.6 Ų | 129.6 | 64% | 0.636 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -7.5 | -168.3 | -95.4 | -22.7 | 0 | 0 | 0 | 116.3 | P55 | P55-N57 PolarHBondContact O-N 2.77Š|
| 58 | V | 53.9 | Low | 52.9 | Low | 116 Ų | 116 | 129.2 Ų | 129.2 | 70% | 0.703 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.3 | -41.5 | 177.3 | -148 | 0 | 0 | 0 | 0 | 111.1 | A56 V62 | A56-V58 PolarHBondContact O-N 2.8Å; V58-V62 WeakPolarHBondContact O-CG2 3.41Å |
| 59 | T | 54.4 | Low | 54.4 | Low | 105 Ų | 105 | 128.1 Ų | 128.1 | 64% | 0.644 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -77.8 | -32 | -175.1 | -49.3 | 0 | 0 | 0 | 0 | 112.7 | A56 | A56-T59 PolarHBondContact O-N 3.01Å |
| 60 | E | 55.7 | Low | 56.1 | Low | 126 Ų | 126 | 121.6 Ų | 121.6 | 59% | 0.589 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -72.9 | -28.6 | 175 | -77.1 | -169.5 | 153.5 | 0 | 0 | 113.2 | A56 V62 K63 | A56-E60 PolarHBondContact O-N 3.46Å; E60-V62 VanDerWaalsContact C-N 3.3Å; E60-V62 PolarHBondContact O-N 3.43Å; E60-K63 PolarHBondContact O-N 3.07Å |
| 61 | K | 55.4 | Low | 58 | Low | 141 Ų | 141 | 120 Ų | 120 | 61% | 0.613 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -66.5 | -32 | 176.2 | -87.9 | -178.2 | 176.3 | -176.4 | 0 | 112.7 | K63 Q64 | K61-K63 VanDerWaalsContact C-N 3.28Å; K61-K63 PolarHBondContact O-N 3.47Å; K61-Q64 PolarHBondContact O-N 3.38Å |
| 62 | V | 54.9 | Low | 60 | Low | 99 Ų | 99 | 120.4 Ų | 120.4 | 60% | 0.6 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -67.5 | -31.9 | 177.6 | -164 | 0 | 0 | 0 | 0 | 111.5 | V58 E60 Q64 T65 | V58-V62 WeakPolarHBondContact O-CG2 3.41Å; E60-V62 VanDerWaalsContact C-N 3.3Å; E60-V62 PolarHBondContact O-N 3.43Å; V62-Q64 VanDerWaalsContact C-N 3.29Å; V62-Q64 PolarHBondContact O-N 3.4Å; V62-T65 PolarHBondContact O-N 3.3Å |
| 63 | K | 53.3 | Low | 62 | Low | 159 Ų | 159 | 117.8 Ų | 117.8 | 69% | 0.691 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -70.1 | -24.2 | 178.7 | -69.5 | -175.8 | 177.2 | 179 | 0 | 113.3 | E60 K61 | E60-K63 PolarHBondContact O-N 3.07Å; K61-K63 VanDerWaalsContact C-N 3.28Å; K61-K63 PolarHBondContact O-N 3.47Å |
| 64 | Q | 55.7 | Low | 63.7 | Low | 148 Ų | 148 | 115.9 Ų | 115.9 | 69% | 0.692 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -76.1 | -30 | 178.8 | -71 | -179.4 | -9.7 | 0 | 0 | 112.3 | K61 V62 T66 | K61-Q64 PolarHBondContact O-N 3.38Å; V62-Q64 VanDerWaalsContact C-N 3.29Å; V62-Q64 PolarHBondContact O-N 3.4Å; Q64-T66 VanDerWaalsContact C-N 3.27Å; Q64-T66 PolarHBondContact O-N 2.8Å |
| 65 | T | 56.6 | Low | 65.6 | Low | 104 Ų | 104 | 114.4 Ų | 114.4 | 64% | 0.638 | 61% | 0.612 | S | S | * | * | G | 310 helix | trans | -73.6 | -14.2 | -178.2 | -48.7 | 0 | 0 | 0 | 0 | 113.7 | V62 K67 | V62-T65 PolarHBondContact O-N 3.3Å; T65-K67 VanDerWaalsContact C-N 3.26Å; T65-K67 PolarHBondContact O-N 2.9Å |
| 66 | T | 58.1 | Low | 68 | Low | 94 Ų | 94 | 114.6 Ų | 114.6 | 58% | 0.577 | 61% | 0.606 | S | S | * | * | G | 310 helix | trans | -70.5 | -19.5 | -178.1 | -47.7 | 0 | 0 | 0 | 0 | 113.6 | Q64 D68 V69 | Q64-T66 VanDerWaalsContact C-N 3.27Å; Q64-T66 PolarHBondContact O-N 2.8Å; T66-D68 VanDerWaalsContact C-N 3.29Å; T66-D68 PolarHBondContact O-N 3.35Å; T66-V69 WeakPolarHBondContact O-CG2 3.38Å; T66-V69 PolarHBondContact O-N 3.42Å |
| 67 | K | 59.5 | Low | 70.1 | Confident | 181 Ų | 181 | 113.8 Ų | 113.8 | 79% | 0.787 | 60% | 0.603 | S | S | * | * | G | 310 helix | trans | -69.3 | -23.2 | -174.7 | -68 | -176.3 | -180 | 177.6 | 0 | 114 | T65 | T65-K67 VanDerWaalsContact C-N 3.26Å; T65-K67 PolarHBondContact O-N 2.9Å |
| 68 | D | 69 | Low | 71.9 | Confident | 95 Ų | 95 | 109.8 Ų | 109.8 | 51% | 0.508 | 59% | 0.59 | S | S | . | * | G | 310 helix | trans | -90.4 | -4.4 | -175.5 | -68 | -9.4 | 0 | 0 | 0 | 114 | T66 G70 Y71 F72 | T66-D68 VanDerWaalsContact C-N 3.29Å; T66-D68 PolarHBondContact O-N 3.35Å; D68-G70 PolarHBondContact O-N 3.35Å; D68-G70 VanDerWaalsContact O-N 3.14Å; D68-Y71 PolarHBondContact O-N 3.25Å; D68-F72 HydrophobicContact CB-CE2 4.35Å; D68-F72 WeakPolarHBondContact O-CD2 3.45Å |
| 69 | V | 74.9 | Confident | 74 | Confident | 81 Ų | 81 | 111.5 Ų | 111.5 | 49% | 0.491 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -59.5 | -30.5 | -175.2 | 176.9 | 0 | 0 | 0 | 0 | 112.4 | T66 Y71 F72 T73 | T66-V69 WeakPolarHBondContact O-CG2 3.38Å; T66-V69 PolarHBondContact O-N 3.42Å; V69-Y71 PolarHBondContact O-N 2.96Å; V69-F72 PolarHBondContact O-N 3.2Å; V69-T73 HydrophobicContact CG1-CG2 4.46Å; V69-T73 VanDerWaalsContact O-CG2 3.29Å; V69-T73 WeakPolarHBondContact O-CG2 3.28Å; V69-T73 PolarHBondContact O-N 3.07Å |
| 70 | G | 79.3 | Confident | 75.9 | Confident | 44 Ų | 44 | 109.3 Ų | 109.3 | 45% | 0.454 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -67.6 | -31.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | D68 T73 | D68-G70 PolarHBondContact O-N 3.35Å; D68-G70 VanDerWaalsContact O-N 3.14Å; G70-T73 PolarHBondContact O-OG1 2.89Å |
| 71 | Y | 84.6 | Confident | 77.8 | Confident | 175 Ų | 175 | 108 Ų | 108 | 69% | 0.686 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -76.7 | -38.4 | 176.4 | -65.2 | -65 | 0 | 0 | 0 | 111.2 | D68 V69 T73 I74 V75 | D68-Y71 PolarHBondContact O-N 3.25Å; V69-Y71 PolarHBondContact O-N 2.96Å; Y71-T73 VanDerWaalsContact C-N 3.28Å; Y71-T73 PolarHBondContact O-N 3.26Å; Y71-I74 PolarHBondContact O-N 3.24Å; Y71-V75 WeakPolarHBondContact O-CG2 3.15Å; Y71-V75 PolarHBondContact O-N 3.07Å; Y71-V75 VanDerWaalsContact O-N 3.12Å |
| 72 | F | 87.7 | Confident | 79.8 | Confident | 150 Ų | 150 | 105.6 Ų | 105.6 | 66% | 0.658 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -60.8 | -35.4 | 176.3 | -77.8 | -75.7 | 0 | 0 | 0 | 112.6 | D68 V69 V75 L76 | D68-F72 HydrophobicContact CB-CE2 4.35Å; D68-F72 WeakPolarHBondContact O-CD2 3.45Å; V69-F72 PolarHBondContact O-N 3.2Å; F72-V75 PolarHBondContact O-N 3.28Å; F72-L76 WeakPolarHBondContact O-CB 3.44Å; F72-L76 PolarHBondContact O-N 3.02Å |
| 73 | T | 88.2 | Confident | 81.8 | Confident | 85 Ų | 85 | 102.6 Ų | 102.6 | 52% | 0.521 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.6 | -42.7 | 179.8 | 60.1 | 0 | 0 | 0 | 0 | 112.3 | V69 G70 Y71 L76 G77 | V69-T73 HydrophobicContact CG1-CG2 4.46Å; V69-T73 VanDerWaalsContact O-CG2 3.29Å; V69-T73 WeakPolarHBondContact O-CG2 3.28Å; V69-T73 PolarHBondContact O-N 3.07Å; G70-T73 PolarHBondContact O-OG1 2.89Å; Y71-T73 VanDerWaalsContact C-N 3.28Å; Y71-T73 PolarHBondContact O-N 3.26Å; T73-L76 PolarHBondContact O-N 2.81Å; T73-G77 PolarHBondContact O-N 3Å |
| 74 | I | 91 | Very high | 83.7 | Confident | 125 Ų | 125 | 99.2 Ų | 99.2 | 64% | 0.641 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -65.4 | -45.5 | 177.8 | -63.7 | 163.2 | 0 | 0 | 0 | 110.1 | Y71 G77 G78 | Y71-I74 PolarHBondContact O-N 3.24Å; I74-G77 PolarHBondContact O-N 2.75Å; I74-G78 PolarHBondContact O-N 2.82Å |
| 75 | V | 93 | Very high | 85.6 | Confident | 77 Ų | 77 | 96.6 Ų | 96.6 | 47% | 0.467 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -62.1 | -46.9 | 178 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | Y71 F72 G77 G78 F79 | Y71-V75 WeakPolarHBondContact O-CG2 3.15Å; Y71-V75 PolarHBondContact O-N 3.07Å; Y71-V75 VanDerWaalsContact O-N 3.12Å; F72-V75 PolarHBondContact O-N 3.28Å; V75-G77 VanDerWaalsContact C-N 3.34Å; V75-G77 PolarHBondContact O-N 3.2Å; V75-G78 PolarHBondContact O-N 2.76Å; V75-F79 HydrophobicContact CG1-CD2 3.7Å; V75-F79 HydrophobicContact CG1-CE2 3.52Å; V75-F79 VanDerWaalsContact O-CD2 3.23Å; V75-F79 WeakPolarHBondContact O-CD2 3.41Å; V75-F79 PolarHBondContact O-N 2.8Å |
| 76 | L | 94.3 | Very high | 87.5 | Confident | 124 Ų | 124 | 96.4 Ų | 96.4 | 65% | 0.649 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -63.4 | -39.7 | 178.1 | -172.7 | 65.3 | 0 | 0 | 0 | 111.9 | F72 T73 F79 A80 | F72-L76 WeakPolarHBondContact O-CB 3.44Å; F72-L76 PolarHBondContact O-N 3.02Å; T73-L76 PolarHBondContact O-N 2.81Å; L76-F79 PolarHBondContact O-N 3.26Å; L76-A80 WeakPolarHBondContact O-CB 3.44Å; L76-A80 PolarHBondContact O-N 3.4Å |
| 77 | G | 95.3 | Very high | 89.1 | Confident | 41 Ų | 41 | 98.5 Ų | 98.5 | 42% | 0.423 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -61.5 | -41.9 | 173.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | T73 I74 V75 A80 L81 | T73-G77 PolarHBondContact O-N 3Å; I74-G77 PolarHBondContact O-N 2.75Å; V75-G77 VanDerWaalsContact C-N 3.34Å; V75-G77 PolarHBondContact O-N 3.2Å; G77-A80 PolarHBondContact O-N 3.43Å; G77-L81 PolarHBondContact O-N 3.31Å |
| 78 | G | 95.9 | Very high | 90.5 | Very high | 35 Ų | 35 | 92.2 Ų | 92.2 | 36% | 0.361 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -59.9 | -50.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | I74 V75 A80 L81 T82 | I74-G78 PolarHBondContact O-N 2.82Å; V75-G78 PolarHBondContact O-N 2.76Å; G78-A80 VanDerWaalsContact C-N 3.33Å; G78-A80 PolarHBondContact O-N 3.3Å; G78-L81 PolarHBondContact O-N 3.32Å; G78-T82 WeakPolarHBondContact O-CB 3.26Å; G78-T82 PolarHBondContact O-N 3.18Å; G78-T82 PolarHBondContact O-OG1 3.18Å; G78-T82 VanDerWaalsContact O-OG1 3.08Å |
| 79 | F | 96.6 | Very high | 91.5 | Very high | 152 Ų | 152 | 91.9 Ų | 91.9 | 67% | 0.667 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -62 | -37.1 | 176.7 | -81 | -69 | 0 | 0 | 0 | 113.1 | V75 L76 G83 | V75-F79 HydrophobicContact CG1-CD2 3.7Å; V75-F79 HydrophobicContact CG1-CE2 3.52Å; V75-F79 VanDerWaalsContact O-CD2 3.23Å; V75-F79 WeakPolarHBondContact O-CD2 3.41Å; V75-F79 PolarHBondContact O-N 2.8Å; L76-F79 PolarHBondContact O-N 3.26Å; F79-G83 WeakPolarHBondContact O-CA 3.01Å; F79-G83 PolarHBondContact O-N 3.42Å |
| 80 | A | 95.9 | Very high | 92 | Very high | 60 Ų | 60 | 91.7 Ų | 91.7 | 50% | 0.496 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.6 | -45.9 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L76 G77 G78 T84 | L76-A80 WeakPolarHBondContact O-CB 3.44Å; L76-A80 PolarHBondContact O-N 3.4Å; G77-A80 PolarHBondContact O-N 3.43Å; G78-A80 VanDerWaalsContact C-N 3.33Å; G78-A80 PolarHBondContact O-N 3.3Å; A80-T84 WeakPolarHBondContact O-CB 3.34Å; A80-T84 WeakPolarHBondContact O-CG2 3.06Å; A80-T84 PolarHBondContact O-N 3.42Å; A80-T84 PolarHBondContact O-OG1 3.48Å |
| 81 | L | 95.6 | Very high | 92.2 | Very high | 98 Ų | 98 | 94.4 Ų | 94.4 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.8 | -46.7 | 177.4 | -178.6 | 62 | 0 | 0 | 0 | 112.1 | G77 G78 T84 I85 | G77-L81 PolarHBondContact O-N 3.31Å; G78-L81 PolarHBondContact O-N 3.32Å; L81-T84 WeakPolarHBondContact CA-OG1 3.48Å; L81-T84 PolarHBondContact O-N 2.86Å; L81-T84 PolarHBondContact O-OG1 3.5Å; L81-I85 HydrophobicContact CD1-CD1 4.2Å; L81-I85 HydrophobicContact CG-CD1 4.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 2.78Å |
| 82 | T | 95.9 | Very high | 92.1 | Very high | 90 Ų | 90 | 92.8 Ų | 92.8 | 55% | 0.552 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -66 | -40.6 | 178.1 | -57.6 | 0 | 0 | 0 | 0 | 111.2 | G78 I85 L86 | G78-T82 WeakPolarHBondContact O-CB 3.26Å; G78-T82 PolarHBondContact O-N 3.18Å; G78-T82 PolarHBondContact O-OG1 3.18Å; G78-T82 VanDerWaalsContact O-OG1 3.08Å; T82-I85 PolarHBondContact O-N 3.36Å; T82-L86 VanDerWaalsContact O-CB 3.22Å; T82-L86 WeakPolarHBondContact O-CB 3.4Å; T82-L86 PolarHBondContact O-N 3.14Å |
| 83 | G | 96.3 | Very high | 91.6 | Very high | 36 Ų | 36 | 90.7 Ų | 90.7 | 37% | 0.371 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -64.8 | -39.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | F79 Y87 | F79-G83 WeakPolarHBondContact O-CA 3.01Å; F79-G83 PolarHBondContact O-N 3.42Å; G83-Y87 WeakPolarHBondContact O-CB 3.39Å; G83-Y87 PolarHBondContact O-N 3.27Å |
| 84 | T | 95.1 | Very high | 90.4 | Very high | 88 Ų | 88 | 94.1 Ų | 94.1 | 54% | 0.54 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.6 | -45.2 | 176.2 | 37.7 | 0 | 0 | 0 | 0 | 112.6 | A80 L81 Y87 A88 | A80-T84 WeakPolarHBondContact O-CB 3.34Å; A80-T84 WeakPolarHBondContact O-CG2 3.06Å; A80-T84 PolarHBondContact O-N 3.42Å; A80-T84 PolarHBondContact O-OG1 3.48Å; L81-T84 WeakPolarHBondContact CA-OG1 3.48Å; L81-T84 PolarHBondContact O-N 2.86Å; L81-T84 PolarHBondContact O-OG1 3.5Å; T84-Y87 PolarHBondContact O-N 3.08Å; T84-A88 PolarHBondContact O-N 3.49Å |
| 85 | I | 95.5 | Very high | 89.3 | Confident | 94 Ų | 94 | 89.8 Ų | 89.8 | 48% | 0.482 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.3 | -45.8 | 176.9 | -64.2 | 167 | 0 | 0 | 0 | 110.5 | L81 T82 Y87 A88 I89 | L81-I85 HydrophobicContact CD1-CD1 4.2Å; L81-I85 HydrophobicContact CG-CD1 4.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 2.78Å; T82-I85 PolarHBondContact O-N 3.36Å; I85-Y87 VanDerWaalsContact C-N 3.32Å; I85-Y87 PolarHBondContact O-N 2.95Å; I85-A88 PolarHBondContact O-N 3.22Å; I85-I89 HydrophobicContact CG2-CD1 3.93Å; I85-I89 WeakPolarHBondContact O-CG1 3.39Å; I85-I89 PolarHBondContact O-N 3.01Å; I85-I89 VanDerWaalsContact O-N 3.09Å |
| 86 | L | 94.7 | Very high | 87.9 | Confident | 99 Ų | 99 | 89.7 Ų | 89.7 | 52% | 0.518 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -59.8 | -44.1 | 178.1 | 180 | 62 | 0 | 0 | 0 | 111.4 | T82 I89 I90 | T82-L86 VanDerWaalsContact O-CB 3.22Å; T82-L86 WeakPolarHBondContact O-CB 3.4Å; T82-L86 PolarHBondContact O-N 3.14Å; L86-I89 PolarHBondContact O-N 3.48Å; L86-I90 HydrophobicContact CD1-CD1 3.99Å; L86-I90 HydrophobicContact CD1-CG1 4.36Å; L86-I90 HydrophobicContact CG-CD1 3.88Å; L86-I90 VanDerWaalsContact O-CG1 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.33Å; L86-I90 PolarHBondContact O-N 3.07Å |
| 87 | Y | 92 | Very high | 86.9 | Confident | 138 Ų | 138 | 88.3 Ų | 88.3 | 54% | 0.541 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 176.5 | -179.1 | -91.6 | 0 | 0 | 0 | 112 | G83 T84 I85 I89 I90 Q91 | G83-Y87 WeakPolarHBondContact O-CB 3.39Å; G83-Y87 PolarHBondContact O-N 3.27Å; T84-Y87 PolarHBondContact O-N 3.08Å; I85-Y87 VanDerWaalsContact C-N 3.32Å; I85-Y87 PolarHBondContact O-N 2.95Å; Y87-I89 VanDerWaalsContact C-N 3.34Å; Y87-I89 PolarHBondContact O-N 3.2Å; Y87-I90 PolarHBondContact O-N 3.37Å; Y87-Q91 HydrophobicContact CE1-CB 4.48Å; Y87-Q91 VanDerWaalsContact O-CB 3.3Å; Y87-Q91 WeakPolarHBondContact O-CB 3.41Å; Y87-Q91 PolarHBondContact O-N 2.91Å; Y87-Q91 PolarHBondContact OH-OE1 3.12Å |
| 88 | A | 90.4 | Very high | 86.3 | Confident | 50 Ų | 50 | 87.1 Ų | 87.1 | 41% | 0.413 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.2 | -43.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | T84 I85 Q91 E92 | T84-A88 PolarHBondContact O-N 3.49Å; I85-A88 PolarHBondContact O-N 3.22Å; A88-Q91 PolarHBondContact O-N 3.4Å; A88-E92 WeakPolarHBondContact O-CB 3.49Å; A88-E92 PolarHBondContact O-N 3.46Å |
| 89 | I | 89.2 | Confident | 85.8 | Confident | 87 Ų | 87 | 86.9 Ų | 86.9 | 45% | 0.446 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -66.2 | -44.5 | 178.4 | -64.1 | 165.7 | 0 | 0 | 0 | 110.9 | I85 L86 Y87 Q91 E92 L93 | I85-I89 HydrophobicContact CG2-CD1 3.93Å; I85-I89 WeakPolarHBondContact O-CG1 3.39Å; I85-I89 PolarHBondContact O-N 3.01Å; I85-I89 VanDerWaalsContact O-N 3.09Å; L86-I89 PolarHBondContact O-N 3.48Å; Y87-I89 VanDerWaalsContact C-N 3.34Å; Y87-I89 PolarHBondContact O-N 3.2Å; I89-Q91 VanDerWaalsContact C-N 3.34Å; I89-Q91 PolarHBondContact O-N 3.41Å; I89-E92 PolarHBondContact O-N 2.98Å; I89-L93 HydrophobicContact CG2-CD1 3.6Å; I89-L93 HydrophobicContact CG2-CG 4.05Å; I89-L93 WeakPolarHBondContact O-CB 3.33Å; I89-L93 VanDerWaalsContact O-CG 3.3Å; I89-L93 WeakPolarHBondContact O-CG 3.35Å; I89-L93 PolarHBondContact O-N 2.94Å |
| 90 | I | 85.8 | Confident | 85.3 | Confident | 78 Ų | 78 | 84.5 Ų | 84.5 | 40% | 0.4 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -61.5 | -45.5 | 177 | -69.3 | 170.5 | 0 | 0 | 0 | 110 | L86 Y87 E92 L93 F94 | L86-I90 HydrophobicContact CD1-CD1 3.99Å; L86-I90 HydrophobicContact CD1-CG1 4.36Å; L86-I90 HydrophobicContact CG-CD1 3.88Å; L86-I90 VanDerWaalsContact O-CG1 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.33Å; L86-I90 PolarHBondContact O-N 3.07Å; Y87-I90 PolarHBondContact O-N 3.37Å; I90-E92 VanDerWaalsContact C-N 3.27Å; I90-E92 PolarHBondContact O-N 3.46Å; I90-L93 PolarHBondContact O-N 3.41Å; I90-F94 HydrophobicContact CB-CD2 4.34Å; I90-F94 HydrophobicContact CG2-CD2 3.65Å; I90-F94 HydrophobicContact CG2-CE2 4.17Å; I90-F94 VanDerWaalsContact O-CB 3.3Å; I90-F94 WeakPolarHBondContact O-CB 3.21Å; I90-F94 WeakPolarHBondContact O-CD2 3.4Å; I90-F94 PolarHBondContact O-N 3.29Å |
| 91 | Q | 84.1 | Confident | 85 | Confident | 101 Ų | 101 | 82.4 Ų | 82.4 | 47% | 0.472 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61 | -37.2 | 178.5 | -171.1 | 87.7 | 50.9 | 0 | 0 | 111.8 | Y87 A88 I89 S95 | Y87-Q91 HydrophobicContact CE1-CB 4.48Å; Y87-Q91 VanDerWaalsContact O-CB 3.3Å; Y87-Q91 WeakPolarHBondContact O-CB 3.41Å; Y87-Q91 PolarHBondContact O-N 2.91Å; Y87-Q91 PolarHBondContact OH-OE1 3.12Å; A88-Q91 PolarHBondContact O-N 3.4Å; I89-Q91 VanDerWaalsContact C-N 3.34Å; I89-Q91 PolarHBondContact O-N 3.41Å; Q91-S95 WeakPolarHBondContact O-CA 3.04Å; Q91-S95 VanDerWaalsContact O-CB 3.28Å; Q91-S95 WeakPolarHBondContact O-CB 3.48Å; Q91-S95 PolarHBondContact O-N 3.1Å |
| 92 | E | 80.9 | Confident | 84.7 | Confident | 140 Ų | 140 | 78 Ų | 78 | 65% | 0.654 | 42% | 0.422 | S | S | * | . | H | α-helix | trans | -76.4 | -44.7 | 179.4 | -164 | 65.8 | -160.4 | 0 | 0 | 111.8 | A88 I89 I90 S95 | A88-E92 WeakPolarHBondContact O-CB 3.49Å; A88-E92 PolarHBondContact O-N 3.46Å; I89-E92 PolarHBondContact O-N 2.98Å; I90-E92 VanDerWaalsContact C-N 3.27Å; I90-E92 PolarHBondContact O-N 3.46Å; E92-S95 VanDerWaalsContact O-CB 3.28Å; E92-S95 WeakPolarHBondContact O-CB 3.22Å; E92-S95 PolarHBondContact O-N 2.93Å |
| 93 | L | 77.4 | Confident | 84.5 | Confident | 106 Ų | 106 | 75 Ų | 75 | 56% | 0.555 | 40% | 0.401 | S | S | * | . | H | α-helix | trans | -70.9 | -38.4 | -179.2 | -70.7 | 179.4 | 0 | 0 | 0 | 113 | I89 I90 S95 S98 | I89-L93 HydrophobicContact CG2-CD1 3.6Å; I89-L93 HydrophobicContact CG2-CG 4.05Å; I89-L93 WeakPolarHBondContact O-CB 3.33Å; I89-L93 VanDerWaalsContact O-CG 3.3Å; I89-L93 WeakPolarHBondContact O-CG 3.35Å; I89-L93 PolarHBondContact O-N 2.94Å; I90-L93 PolarHBondContact O-N 3.41Å; L93-S95 VanDerWaalsContact C-N 3.34Å; L93-S98 WeakPolarHBondContact O-CB 2.94Å; L93-S98 PolarHBondContact O-OG 2.91Å |
| 94 | F | 63.6 | Low | 84.3 | Confident | 158 Ų | 158 | 76.8 Ų | 76.8 | 69% | 0.693 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.7 | 9 | 175.5 | -64.9 | -79.9 | 0 | 0 | 0 | 112.6 | I90 S96 | I90-F94 HydrophobicContact CB-CD2 4.34Å; I90-F94 HydrophobicContact CG2-CD2 3.65Å; I90-F94 HydrophobicContact CG2-CE2 4.17Å; I90-F94 VanDerWaalsContact O-CB 3.3Å; I90-F94 WeakPolarHBondContact O-CB 3.21Å; I90-F94 WeakPolarHBondContact O-CD2 3.4Å; I90-F94 PolarHBondContact O-N 3.29Å; F94-S96 PolarHBondContact O-N 3.41Å |
| 95 | S | 67.8 | Low | 84.1 | Confident | 34 Ų | 34 | 75.2 Ų | 75.2 | 24% | 0.238 | 39% | 0.39 | C | S | . | . | S | Bend | trans | -59.5 | 133.9 | 160.9 | -169.5 | 0 | 0 | 0 | 0 | 106.8 | Q91 E92 L93 K97 S98 | Q91-S95 WeakPolarHBondContact O-CA 3.04Å; Q91-S95 VanDerWaalsContact O-CB 3.28Å; Q91-S95 WeakPolarHBondContact O-CB 3.48Å; Q91-S95 PolarHBondContact O-N 3.1Å; E92-S95 VanDerWaalsContact O-CB 3.28Å; E92-S95 WeakPolarHBondContact O-CB 3.22Å; E92-S95 PolarHBondContact O-N 2.93Å; L93-S95 VanDerWaalsContact C-N 3.34Å; S95-K97 PolarHBondContact O-N 2.86Å; S95-S98 PolarHBondContact O-N 2.88Å; S95-S98 PolarHBondContact O-OG 3.08Å |
| 96 | S | 64 | Low | 84 | Confident | 75 Ų | 75 | 70.8 Ų | 70.8 | 52% | 0.524 | 37% | 0.367 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.4 | -7.5 | 175.4 | -56.1 | 0 | 0 | 0 | 0 | 113.3 | F94 S98 F180 | F94-S96 PolarHBondContact O-N 3.41Å; S96-S98 VanDerWaalsContact C-N 3.29Å; S96-S98 PolarHBondContact O-N 2.86Å; S96-F180 WeakPolarHBondContact O-CD2 3.29Å |
| 97 | K | 73.8 | Confident | 83.9 | Confident | 94 Ų | 94 | 68 Ų | 68 | 41% | 0.409 | 35% | 0.351 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.2 | -9.7 | 171 | -65.2 | -170.3 | 169.4 | 64.8 | 0 | 115.5 | S95 K178 F180 | S95-K97 PolarHBondContact O-N 2.86Å; K97-K178 WeakPolarHBondContact CE-O 3.41Å; K97-K178 PolarHBondContact NZ-O 3.45Å; K97-F180 VanDerWaalsContact CA-CE2 3.45Å; K97-F180 HydrophobicContact CB-CE2 4.18Å; K97-F180 HydrophobicContact CG-CE2 4.44Å; K97-F180 WeakPolarHBondContact O-CE2 3.35Å |
| 98 | S | 81.6 | Confident | 84 | Confident | 17 Ų | 17 | 66.9 Ų | 66.9 | 12% | 0.119 | 35% | 0.349 | C | S | . | . | S | Bend | trans | -87.1 | 148.3 | -179.7 | 78.3 | 0 | 0 | 0 | 0 | 112.2 | L93 S95 S96 N100 G101 V102 | L93-S98 WeakPolarHBondContact O-CB 2.94Å; L93-S98 PolarHBondContact O-OG 2.91Å; S95-S98 PolarHBondContact O-N 2.88Å; S95-S98 PolarHBondContact O-OG 3.08Å; S96-S98 VanDerWaalsContact C-N 3.29Å; S96-S98 PolarHBondContact O-N 2.86Å; S98-N100 PolarHBondContact O-N 3.18Å; S98-N100 VanDerWaalsContact O-N 3.15Å; S98-G101 PolarHBondContact O-N 3.04Å; S98-G101 PolarHBondContact OG-N 3.15Å; S98-V102 PolarHBondContact O-N 3.07Å |
| 99 | P | 85 | Confident | 84.1 | Confident | 30 Ų | 30 | 65.8 Ų | 65.8 | 20% | 0.195 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -55.4 | -31.9 | 174.7 | -26.4 | 34.1 | 0 | 0 | 0 | 113.2 | Y103 Y141 M153 | P99-Y103 VanDerWaalsContact O-CB 3.32Å; P99-Y103 WeakPolarHBondContact O-CB 3.17Å; P99-Y103 PolarHBondContact O-N 3.02Å; P99-Y103 VanDerWaalsContact O-N 3.07Å; P99-Y141 HydrophobicContact CB-CD1 3.92Å; P99-Y141 HydrophobicContact CB-CE1 4.21Å; P99-Y141 HydrophobicContact CB-CG 4.15Å; P99-Y141 HydrophobicContact CG-CD1 4.13Å; P99-Y141 HydrophobicContact CG-CD2 4.22Å; P99-Y141 HydrophobicContact CG-CE1 4.03Å; P99-Y141 HydrophobicContact CG-CE2 4.12Å; P99-Y141 HydrophobicContact CG-CG 4.24Å; P99-M153 HydrophobicContact CB-SD 4.23Å; P99-M153 HydrophobicContact CG-SD 4.16Å |
| 100 | N | 87.2 | Confident | 84.3 | Confident | 102 Ų | 102 | 61.7 Ų | 61.7 | 55% | 0.545 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -70.9 | -39.5 | 177.7 | -68.5 | -1.4 | 0 | 0 | 0 | 111.8 | S98 Y103 D104 | S98-N100 PolarHBondContact O-N 3.18Å; S98-N100 VanDerWaalsContact O-N 3.15Å; N100-Y103 PolarHBondContact O-N 2.83Å; N100-D104 WeakPolarHBondContact O-CB 3.22Å; N100-D104 PolarHBondContact O-N 2.82Å |
| 101 | G | 88 | Confident | 84.6 | Confident | 15 Ų | 15 | 64 Ų | 64 | 16% | 0.155 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.9 | -47.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | S98 Y103 D104 D105 | S98-G101 PolarHBondContact O-N 3.04Å; S98-G101 PolarHBondContact OG-N 3.15Å; G101-Y103 VanDerWaalsContact C-N 3.31Å; G101-Y103 PolarHBondContact O-N 3.37Å; G101-D104 PolarHBondContact O-N 3.39Å; G101-D105 WeakPolarHBondContact O-CB 3.37Å; G101-D105 PolarHBondContact O-N 3.2Å |
| 102 | V | 90.7 | Very high | 85 | Confident | 5 Ų | 5 | 64.9 Ų | 64.9 | 3% | 0.03 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -62.1 | -39.9 | 177.4 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | S98 A106 M155 L170 V172 F180 Y182 | S98-V102 PolarHBondContact O-N 3.07Å; V102-A106 VanDerWaalsContact O-CB 3.25Å; V102-A106 WeakPolarHBondContact O-CB 3.47Å; V102-A106 PolarHBondContact O-N 3.23Å; V102-M155 HydrophobicContact CB-CE 3.67Å; V102-M155 HydrophobicContact CG1-CE 3.59Å; V102-M155 HydrophobicContact CG1-SD 4.31Å; V102-L170 HydrophobicContact CG1-CD1 3.54Å; V102-V172 HydrophobicContact CG1-CG1 3.69Å; V102-V172 HydrophobicContact CG1-CG2 4.01Å; V102-V172 HydrophobicContact CG2-CG2 4.19Å; V102-F180 HydrophobicContact CG2-CD2 3.91Å; V102-F180 HydrophobicContact CG2-CE2 4.46Å; V102-Y182 HydrophobicContact CG1-CE1 4.47Å; V102-Y182 PolarHBondContact O-OH 3.4Å |
| 103 | Y | 91.5 | Very high | 85.6 | Confident | 29 Ų | 29 | 59.9 Ų | 59.9 | 11% | 0.114 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -62 | -49.2 | 175 | 169.3 | -94.3 | 0 | 0 | 0 | 112.3 | P99 N100 G101 D105 A106 F107 A126 I139 F157 | P99-Y103 VanDerWaalsContact O-CB 3.32Å; P99-Y103 WeakPolarHBondContact O-CB 3.17Å; P99-Y103 PolarHBondContact O-N 3.02Å; P99-Y103 VanDerWaalsContact O-N 3.07Å; N100-Y103 PolarHBondContact O-N 2.83Å; G101-Y103 VanDerWaalsContact C-N 3.31Å; G101-Y103 PolarHBondContact O-N 3.37Å; Y103-D105 VanDerWaalsContact C-N 3.33Å; Y103-D105 PolarHBondContact O-N 3.46Å; Y103-A106 PolarHBondContact O-N 3.35Å; Y103-F107 WeakPolarHBondContact O-CB 3.33Å; Y103-F107 PolarHBondContact O-N 2.84Å; Y103-A126 HydrophobicContact CE2-CB 4.26Å; Y103-A126 WeakPolarHBondContact OH-CB 3.49Å; Y103-I139 HydrophobicContact CD1-CD1 4.06Å; Y103-I139 HydrophobicContact CD2-CD1 4.03Å; Y103-I139 HydrophobicContact CE2-CD1 4.48Å; Y103-I139 HydrophobicContact CG-CD1 3.78Å; Y103-F157 HydrophobicContact CD2-CB 4.04Å; Y103-F157 AromaticContact CD2-CD1 3.84Å; Y103-F157 HydrophobicContact CD2-CD1 3.84Å; Y103-F157 HydrophobicContact CD2-CD2 4.43Å; Y103-F157 HydrophobicContact CD2-CE1 4.36Å; Y103-F157 AromaticContact CD2-CG 3.88Å; Y103-F157 HydrophobicContact CD2-CG 3.88Å; Y103-F157 HydrophobicContact CE2-CB 3.62Å; Y103-F157 HydrophobicContact CE2-CD1 4.06Å; Y103-F157 AromaticContact CE2-CD2 3.85Å; Y103-F157 HydrophobicContact CE2-CD2 3.85Å; Y103-F157 HydrophobicContact CE2-CE2 4.48Å; Y103-F157 AromaticContact CE2-CG 3.59Å; Y103-F157 HydrophobicContact CE2-CG 3.59Å |
| 104 | D | 91.2 | Very high | 86.3 | Confident | 72 Ų | 72 | 58.5 Ų | 58.5 | 39% | 0.385 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.8 | -40.8 | -179.5 | -77.6 | -18.3 | 0 | 0 | 0 | 111.2 | N100 G101 F107 K108 | N100-D104 WeakPolarHBondContact O-CB 3.22Å; N100-D104 PolarHBondContact O-N 2.82Å; G101-D104 PolarHBondContact O-N 3.39Å; D104-F107 PolarHBondContact O-N 3.17Å; D104-K108 WeakPolarHBondContact O-CG 3.3Å; D104-K108 PolarHBondContact O-N 3.35Å |
| 105 | D | 91.3 | Very high | 87.6 | Confident | 56 Ų | 56 | 56.3 Ų | 56.3 | 30% | 0.299 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -69 | -42.1 | 178.6 | -71.4 | -16.5 | 0 | 0 | 0 | 111.9 | G101 Y103 F107 K108 I109 Y182 | G101-D105 WeakPolarHBondContact O-CB 3.37Å; G101-D105 PolarHBondContact O-N 3.2Å; Y103-D105 VanDerWaalsContact C-N 3.33Å; Y103-D105 PolarHBondContact O-N 3.46Å; D105-F107 VanDerWaalsContact C-N 3.3Å; D105-F107 PolarHBondContact O-N 2.95Å; D105-K108 PolarHBondContact O-N 2.89Å; D105-K108 IonicContact OD1-NZ 2.78Å; D105-K108 PolarHBondContact OD1-NZ 3.31Å; D105-I109 WeakPolarHBondContact O-CG1 3.33Å; D105-I109 PolarHBondContact O-N 3.39Å; D105-Y182 WeakPolarHBondContact CB-OH 3.33Å |
| 106 | A | 92.8 | Very high | 88.8 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.1 | -40.2 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | V102 Y103 I109 C110 F157 L170 Y182 L185 | V102-A106 VanDerWaalsContact O-CB 3.25Å; V102-A106 WeakPolarHBondContact O-CB 3.47Å; V102-A106 PolarHBondContact O-N 3.23Å; Y103-A106 PolarHBondContact O-N 3.35Å; A106-I109 PolarHBondContact O-N 2.9Å; A106-C110 PolarHBondContact O-N 2.78Å; A106-C110 VanDerWaalsContact O-N 3.07Å; A106-C110 PolarHBondContact O-SG 3Å; A106-F157 HydrophobicContact CB-CE1 4.04Å; A106-F157 HydrophobicContact CB-CZ 4.33Å; A106-L170 HydrophobicContact CB-CD2 3.53Å; A106-Y182 HydrophobicContact CB-CE1 4.14Å; A106-Y182 PolarHBondContact N-OH 3.47Å; A106-Y182 VanDerWaalsContact N-OH 3.1Å; A106-L185 HydrophobicContact CB-CD1 4.04Å |
| 107 | F | 93.7 | Very high | 90.1 | Very high | 40 Ų | 40 | 53.5 Ų | 53.5 | 18% | 0.175 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -67.6 | -38.9 | 176.7 | -178.9 | -120.3 | 0 | 0 | 0 | 112.5 | Y103 D104 D105 I109 C110 K111 L124 A126 F157 I159 | Y103-F107 WeakPolarHBondContact O-CB 3.33Å; Y103-F107 PolarHBondContact O-N 2.84Å; D104-F107 PolarHBondContact O-N 3.17Å; D105-F107 VanDerWaalsContact C-N 3.3Å; D105-F107 PolarHBondContact O-N 2.95Å; F107-I109 VanDerWaalsContact C-N 3.33Å; F107-I109 PolarHBondContact O-N 3.4Å; F107-C110 WeakPolarHBondContact O-CB 3.23Å; F107-C110 PolarHBondContact O-N 3.37Å; F107-K111 PolarHBondContact O-N 3.49Å; F107-L124 HydrophobicContact CD2-CD2 4.37Å; F107-L124 HydrophobicContact CE2-CB 4.41Å; F107-L124 HydrophobicContact CE2-CD2 3.78Å; F107-L124 HydrophobicContact CE2-CG 3.88Å; F107-A126 HydrophobicContact CD1-CB 4.4Å; F107-A126 HydrophobicContact CD2-CB 3.51Å; F107-A126 HydrophobicContact CE1-CB 4.45Å; F107-A126 HydrophobicContact CE2-CB 3.55Å; F107-A126 HydrophobicContact CG-CB 3.95Å; F107-A126 HydrophobicContact CZ-CB 4.05Å; F107-F157 HydrophobicContact CB-CZ 4.43Å; F107-F157 HydrophobicContact CD2-CE2 4.29Å; F107-I159 HydrophobicContact CD2-CG2 4.47Å; F107-I159 HydrophobicContact CE2-CG2 4.48Å |
| 108 | K | 93.8 | Very high | 91 | Very high | 116 Ų | 116 | 55.1 Ų | 55.1 | 50% | 0.504 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -60.4 | -41.8 | 172.8 | -73.9 | 168.4 | -157.3 | 158.6 | 0 | 111.7 | D104 D105 K111 T112 | D104-K108 WeakPolarHBondContact O-CG 3.3Å; D104-K108 PolarHBondContact O-N 3.35Å; D105-K108 PolarHBondContact O-N 2.89Å; D105-K108 IonicContact OD1-NZ 2.78Å; D105-K108 PolarHBondContact OD1-NZ 3.31Å; K108-K111 PolarHBondContact O-N 2.76Å; K108-T112 PolarHBondContact O-N 3.05Å; K108-T112 VanDerWaalsContact O-N 3.07Å; K108-T112 PolarHBondContact O-OG1 3.42Å |
| 109 | I | 92.9 | Very high | 91.4 | Very high | 27 Ų | 27 | 56 Ų | 56 | 14% | 0.138 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -59.7 | -49.5 | 175.3 | -64.5 | 163.9 | 0 | 0 | 0 | 109.6 | D105 A106 F107 K111 T112 D113 Y182 L185 L200 | D105-I109 WeakPolarHBondContact O-CG1 3.33Å; D105-I109 PolarHBondContact O-N 3.39Å; A106-I109 PolarHBondContact O-N 2.9Å; F107-I109 VanDerWaalsContact C-N 3.33Å; F107-I109 PolarHBondContact O-N 3.4Å; I109-K111 VanDerWaalsContact C-N 3.26Å; I109-K111 PolarHBondContact O-N 3.03Å; I109-T112 PolarHBondContact O-N 3.26Å; I109-T112 VanDerWaalsContact O-N 3.07Å; I109-D113 PolarHBondContact O-N 3.43Å; I109-Y182 HydrophobicContact CD1-CD2 4.45Å; I109-Y182 HydrophobicContact CD1-CE2 3.83Å; I109-L185 HydrophobicContact CB-CD2 3.93Å; I109-L185 HydrophobicContact CD1-CD2 4.02Å; I109-L185 HydrophobicContact CG2-CD2 3.67Å; I109-L200 HydrophobicContact CG2-CB 4.29Å; I109-L200 HydrophobicContact CG2-CD1 4.15Å |
| 110 | C | 92.6 | Very high | 91.8 | Very high | 0 Ų | 0 | 54.5 Ų | 54.5 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.9 | -34.8 | 177.7 | -64.4 | 0 | 0 | 0 | 0 | 113.4 | A106 F107 V116 L124 | A106-C110 PolarHBondContact O-N 2.78Å; A106-C110 VanDerWaalsContact O-N 3.07Å; A106-C110 PolarHBondContact O-SG 3Å; F107-C110 WeakPolarHBondContact O-CB 3.23Å; F107-C110 PolarHBondContact O-N 3.37Å; C110-V116 HydrophobicContact CB-CG1 4.32Å; C110-V116 WeakPolarHBondContact O-CB 3.47Å; C110-V116 WeakPolarHBondContact O-CG1 3.42Å; C110-L124 HydrophobicContact CB-CD2 4.01Å |
| 111 | K | 93 | Very high | 92 | Very high | 127 Ų | 127 | 50.1 Ų | 50.1 | 55% | 0.552 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -76.1 | -23.9 | 178.8 | -169.6 | 176.5 | 178.7 | -177.1 | 0 | 113 | F107 K108 I109 L117 | F107-K111 PolarHBondContact O-N 3.49Å; K108-K111 PolarHBondContact O-N 2.76Å; I109-K111 VanDerWaalsContact C-N 3.26Å; I109-K111 PolarHBondContact O-N 3.03Å; K111-L117 WeakPolarHBondContact O-CD1 3.22Å |
| 112 | T | 92.6 | Very high | 92 | Very high | 119 Ų | 119 | 54.9 Ų | 54.9 | 73% | 0.73 | 29% | 0.291 | S | S | * | . | H | α-helix | trans | -91.5 | -30.9 | -177.6 | -50.4 | 0 | 0 | 0 | 0 | 111.7 | K108 I109 S114 | K108-T112 PolarHBondContact O-N 3.05Å; K108-T112 VanDerWaalsContact O-N 3.07Å; K108-T112 PolarHBondContact O-OG1 3.42Å; I109-T112 PolarHBondContact O-N 3.26Å; I109-T112 VanDerWaalsContact O-N 3.07Å; T112-S114 PolarHBondContact O-N 2.88Å |
| 113 | D | 92.9 | Very high | 92 | Very high | 36 Ų | 36 | 57.4 Ų | 57.4 | 19% | 0.193 | 31% | 0.308 | C | S | . | . | trans | -68.6 | 118.8 | 179.3 | -113 | -69 | 0 | 0 | 0 | 112.2 | I109 R115 V116 L117 L200 | I109-D113 PolarHBondContact O-N 3.43Å; D113-R115 PolarHBondContact O-N 2.85Å; D113-R115 IonicContact OD1-CZ 3.68Å; D113-R115 IonicContact OD1-NE 2.95Å; D113-R115 PolarHBondContact OD1-NE 3.01Å; D113-R115 IonicContact OD1-NH2 3.53Å; D113-R115 PolarHBondContact OD1-NH2 3.37Å; D113-R115 IonicContact OD2-NH2 2.87Å; D113-V116 HydrophobicContact CB-CB 4.41Å; D113-V116 HydrophobicContact CB-CG2 4.02Å; D113-V116 PolarHBondContact O-N 3.42Å; D113-L117 PolarHBondContact O-N 2.85Å; D113-L117 VanDerWaalsContact O-N 3.14Å; D113-L200 HydrophobicContact CB-CD2 4.05Å; D113-L200 WeakPolarHBondContact OD2-CD2 3.25Å | ||
| 114 | S | 92 | Very high | 92 | Very high | 76 Ų | 76 | 56.8 Ų | 56.8 | 53% | 0.531 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.3 | -31.5 | 178.6 | 59.8 | 0 | 0 | 0 | 0 | 112.9 | T112 V116 L117 N118 | T112-S114 PolarHBondContact O-N 2.88Å; S114-V116 VanDerWaalsContact C-N 3.31Å; S114-V116 PolarHBondContact O-N 3.5Å; S114-L117 PolarHBondContact O-N 3.33Å; S114-N118 WeakPolarHBondContact O-CB 3.41Å; S114-N118 PolarHBondContact O-N 3.43Å; S114-N118 PolarHBondContact O-ND2 3.37Å |
| 115 | R | 91.6 | Very high | 92.1 | Very high | 113 Ų | 113 | 59.9 Ų | 59.9 | 43% | 0.426 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -60 | -41.8 | 177.1 | -65.2 | 175.2 | -70.2 | 168.4 | 0.5 | 111.7 | D113 I198 I199 | D113-R115 PolarHBondContact O-N 2.85Å; D113-R115 IonicContact OD1-CZ 3.68Å; D113-R115 IonicContact OD1-NE 2.95Å; D113-R115 PolarHBondContact OD1-NE 3.01Å; D113-R115 IonicContact OD1-NH2 3.53Å; D113-R115 PolarHBondContact OD1-NH2 3.37Å; D113-R115 IonicContact OD2-NH2 2.87Å; R115-I198 HydrophobicContact CB-CD1 4.02Å; R115-I198 HydrophobicContact CB-CG2 4.2Å; R115-I199 PolarHBondContact NH1-O 2.75Å; R115-I199 VanDerWaalsContact NH1-O 3.08Å |
| 116 | V | 92 | Very high | 92.2 | Very high | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -72.5 | -47.5 | 177.9 | -179.7 | 0 | 0 | 0 | 0 | 109.5 | C110 D113 S114 N118 L119 F120 L124 I159 V187 I198 L200 | C110-V116 HydrophobicContact CB-CG1 4.32Å; C110-V116 WeakPolarHBondContact O-CB 3.47Å; C110-V116 WeakPolarHBondContact O-CG1 3.42Å; D113-V116 HydrophobicContact CB-CB 4.41Å; D113-V116 HydrophobicContact CB-CG2 4.02Å; D113-V116 PolarHBondContact O-N 3.42Å; S114-V116 VanDerWaalsContact C-N 3.31Å; S114-V116 PolarHBondContact O-N 3.5Å; V116-N118 PolarHBondContact O-N 3.44Å; V116-L119 PolarHBondContact O-N 3.38Å; V116-F120 HydrophobicContact CB-CD2 4.49Å; V116-F120 HydrophobicContact CG1-CD2 3.49Å; V116-F120 VanDerWaalsContact CG1-CD2 3.49Å; V116-F120 HydrophobicContact CG1-CE2 3.9Å; V116-F120 VanDerWaalsContact O-CD2 3.28Å; V116-F120 WeakPolarHBondContact O-CD2 3.41Å; V116-F120 PolarHBondContact O-N 3.35Å; V116-L124 HydrophobicContact CG1-CD2 4.31Å; V116-I159 HydrophobicContact CG1-CD1 4.46Å; V116-V187 HydrophobicContact CG2-CG2 4.27Å; V116-I198 HydrophobicContact CG2-CD1 4.34Å; V116-L200 HydrophobicContact CG2-CD1 3.98Å; V116-L200 HydrophobicContact CG2-CD2 3.62Å; V116-L200 HydrophobicContact CG2-CG 4.39Å |
| 117 | L | 92.2 | Very high | 92 | Very high | 50 Ų | 50 | 60.8 Ų | 60.8 | 26% | 0.262 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -58.2 | -35 | 178.5 | -67.6 | 176.1 | 0 | 0 | 0 | 113.1 | K111 D113 S114 L119 G121 | K111-L117 WeakPolarHBondContact O-CD1 3.22Å; D113-L117 PolarHBondContact O-N 2.85Å; D113-L117 VanDerWaalsContact O-N 3.14Å; S114-L117 PolarHBondContact O-N 3.33Å; L117-L119 VanDerWaalsContact C-N 3.34Å; L117-L119 PolarHBondContact O-N 2.97Å; L117-G121 CarbonylContact O-C 3.55Å; L117-G121 WeakPolarHBondContact O-CA 3.32Å; L117-G121 PolarHBondContact O-N 2.87Å |
| 118 | N | 91.9 | Very high | 91.7 | Very high | 127 Ų | 127 | 60 Ų | 60 | 68% | 0.679 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -68.1 | -31.6 | 176.9 | -71.1 | -18.5 | 0 | 0 | 0 | 113.1 | S114 V116 | S114-N118 WeakPolarHBondContact O-CB 3.41Å; S114-N118 PolarHBondContact O-N 3.43Å; S114-N118 PolarHBondContact O-ND2 3.37Å; V116-N118 PolarHBondContact O-N 3.44Å |
| 119 | L | 90.6 | Very high | 91.3 | Very high | 35 Ų | 35 | 55.9 Ų | 55.9 | 18% | 0.183 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -82.1 | -44.7 | 177.5 | -66.9 | -171.1 | 0 | 0 | 0 | 112.5 | V116 L117 T189 K196 I198 | V116-L119 PolarHBondContact O-N 3.38Å; L117-L119 VanDerWaalsContact C-N 3.34Å; L117-L119 PolarHBondContact O-N 2.97Å; L119-T189 HydrophobicContact CD1-CG2 3.92Å; L119-K196 HydrophobicContact CD1-CB 3.99Å; L119-K196 HydrophobicContact CD1-CD 4.14Å; L119-K196 HydrophobicContact CD2-CD 3.68Å; L119-I198 HydrophobicContact CD1-CD1 3.36Å; L119-I198 HydrophobicContact CD1-CG1 4.05Å; L119-I198 HydrophobicContact CG-CD1 4.08Å |
| 120 | F | 92.3 | Very high | 90.7 | Very high | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -92 | -23.3 | -173.2 | -66.8 | -80.5 | 0 | 0 | 0 | 113.1 | V116 L124 I159 G161 N162 L163 E164 V187 T189 | V116-F120 HydrophobicContact CB-CD2 4.49Å; V116-F120 HydrophobicContact CG1-CD2 3.49Å; V116-F120 VanDerWaalsContact CG1-CD2 3.49Å; V116-F120 HydrophobicContact CG1-CE2 3.9Å; V116-F120 VanDerWaalsContact O-CD2 3.28Å; V116-F120 WeakPolarHBondContact O-CD2 3.41Å; V116-F120 PolarHBondContact O-N 3.35Å; F120-L124 HydrophobicContact CB-CD1 3.62Å; F120-L124 HydrophobicContact CD1-CD1 4.38Å; F120-L124 HydrophobicContact CD2-CD1 4.45Å; F120-L124 HydrophobicContact CG-CD1 3.9Å; F120-I159 HydrophobicContact CD1-CD1 4.07Å; F120-I159 HydrophobicContact CD1-CG1 4.27Å; F120-I159 HydrophobicContact CD2-CD1 3.87Å; F120-I159 HydrophobicContact CE1-CD1 3.69Å; F120-I159 HydrophobicContact CE1-CG1 3.82Å; F120-I159 HydrophobicContact CE2-CD1 3.47Å; F120-I159 VanDerWaalsContact CE2-CD1 3.47Å; F120-I159 HydrophobicContact CE2-CG1 4.48Å; F120-I159 HydrophobicContact CG-CD1 4.18Å; F120-I159 HydrophobicContact CZ-CD1 3.36Å; F120-I159 HydrophobicContact CZ-CG1 3.94Å; F120-G161 CarbonylContact O-C 3.59Å; F120-G161 WeakPolarHBondContact O-CA 3.39Å; F120-N162 PolarHBondContact O-N 2.81Å; F120-L163 PolarHBondContact O-N 3.05Å; F120-E164 HydrophobicContact CD1-CB 4.35Å; F120-E164 WeakPolarHBondContact CD1-O 3.16Å; F120-V187 HydrophobicContact CE2-CG1 3.49Å; F120-V187 VanDerWaalsContact CE2-CG1 3.49Å; F120-V187 HydrophobicContact CZ-CG1 3.69Å; F120-T189 HydrophobicContact CE1-CG2 4.29Å; F120-T189 HydrophobicContact CE2-CG2 4.26Å; F120-T189 HydrophobicContact CZ-CG2 3.73Å |
| 121 | G | 91.5 | Very high | 89.9 | Confident | 9 Ų | 9 | 60.8 Ų | 60.8 | 9% | 0.093 | 34% | 0.336 | C | S | . | . | trans | 99.6 | -178.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | L117 S123 | L117-G121 CarbonylContact O-C 3.55Å; L117-G121 WeakPolarHBondContact O-CA 3.32Å; L117-G121 PolarHBondContact O-N 2.87Å; G121-S123 VanDerWaalsContact C-N 3.33Å; G121-S123 PolarHBondContact O-N 3.48Å | ||
| 122 | S | 88.8 | Confident | 88.6 | Confident | 115 Ų | 115 | 59.4 Ų | 59.4 | 80% | 0.804 | 34% | 0.342 | S | S | * | . | S | Bend | trans | -67.5 | -27.5 | -174.4 | 56.2 | 0 | 0 | 0 | 0 | 114.8 | ||
| 123 | S | 90.9 | Very high | 87.5 | Confident | 58 Ų | 58 | 63.7 Ų | 63.7 | 41% | 0.406 | 35% | 0.345 | S | S | . | . | trans | -106.6 | 113.5 | 178.9 | 168.5 | 0 | 0 | 0 | 0 | 110.1 | G121 G161 N162 | G121-S123 VanDerWaalsContact C-N 3.33Å; G121-S123 PolarHBondContact O-N 3.48Å; S123-G161 WeakPolarHBondContact O-CA 3.3Å; S123-N162 PolarHBondContact O-N 2.85Å | ||
| 124 | L | 92 | Very high | 86.3 | Confident | 16 Ų | 16 | 70.9 Ų | 70.9 | 8% | 0.084 | 37% | 0.369 | C | S | . | . | trans | -110.6 | 130.2 | 174.7 | -161.9 | 68.1 | 0 | 0 | 0 | 110.5 | F107 C110 V116 F120 I159 | F107-L124 HydrophobicContact CD2-CD2 4.37Å; F107-L124 HydrophobicContact CE2-CB 4.41Å; F107-L124 HydrophobicContact CE2-CD2 3.78Å; F107-L124 HydrophobicContact CE2-CG 3.88Å; C110-L124 HydrophobicContact CB-CD2 4.01Å; V116-L124 HydrophobicContact CG1-CD2 4.31Å; F120-L124 HydrophobicContact CB-CD1 3.62Å; F120-L124 HydrophobicContact CD1-CD1 4.38Å; F120-L124 HydrophobicContact CD2-CD1 4.45Å; F120-L124 HydrophobicContact CG-CD1 3.9Å; L124-I159 HydrophobicContact CD1-CB 3.99Å; L124-I159 HydrophobicContact CD1-CD1 4.21Å; L124-I159 HydrophobicContact CG-CB 4.42Å | ||
| 125 | K | 93 | Very high | 85.1 | Confident | 138 Ų | 138 | 79.1 Ų | 79.1 | 60% | 0.6 | 39% | 0.389 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -123.2 | 124.6 | 174.2 | -65.4 | -179.1 | -179 | 177.3 | 0 | 109.5 | I159 K160 | K125-I159 CarbonylContact O-C 3.39Å; K125-I159 WeakPolarHBondContact O-CA 3.48Å; K125-K160 PolarHBondContact N-O 2.85Å; K125-K160 PolarHBondContact O-N 3.23Å |
| 126 | A | 92 | Very high | 83.9 | Confident | 25 Ų | 25 | 83.7 Ų | 83.7 | 21% | 0.207 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.1 | 145.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y103 F107 F157 Y158 I159 | Y103-A126 HydrophobicContact CE2-CB 4.26Å; Y103-A126 WeakPolarHBondContact OH-CB 3.49Å; F107-A126 HydrophobicContact CD1-CB 4.4Å; F107-A126 HydrophobicContact CD2-CB 3.51Å; F107-A126 HydrophobicContact CE1-CB 4.45Å; F107-A126 HydrophobicContact CE2-CB 3.55Å; F107-A126 HydrophobicContact CG-CB 3.95Å; F107-A126 HydrophobicContact CZ-CB 4.05Å; A126-F157 HydrophobicContact CB-CD2 4.1Å; A126-F157 HydrophobicContact CB-CE2 4.21Å; A126-Y158 CarbonylContact C-O 3.36Å; A126-Y158 WeakPolarHBondContact CA-O 3.42Å; A126-I159 HydrophobicContact CB-CG2 4.48Å |
| 127 | R | 89.9 | Confident | 82.9 | Confident | 50 Ų | 50 | 89.2 Ų | 89.2 | 19% | 0.189 | 43% | 0.432 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.8 | 146.7 | -178.3 | -64.9 | -171.4 | -62.7 | 131.4 | -9 | 108.5 | S129 P130 Y158 | R127-S129 PolarHBondContact NH1-O 2.99Å; R127-P130 PolarHBondContact NH1-O 3.36Å; R127-Y158 PolarHBondContact N-O 2.83Å; R127-Y158 WeakPolarHBondContact O-CA 3.25Å; R127-Y158 WeakPolarHBondContact O-CB 3.28Å; R127-Y158 PolarHBondContact O-N 2.94Å |
| 128 | T | 87.9 | Confident | 82.2 | Confident | 24 Ų | 24 | 93.2 Ų | 93.2 | 15% | 0.147 | 45% | 0.454 | C | S | . | . | S | Bend | trans | -90.1 | -19.9 | -178.1 | -41.6 | 0 | 0 | 0 | 0 | 113.4 | N138 I139 | T128-N138 WeakPolarHBondContact CG2-O 3.29Å; T128-I139 HydrophobicContact CG2-CB 4.13Å; T128-I139 HydrophobicContact CG2-CG1 3.79Å; T128-I139 VanDerWaalsContact CG2-N 3.29Å |
| 129 | S | 83.9 | Confident | 81.6 | Confident | 28 Ų | 28 | 88.6 Ų | 88.6 | 20% | 0.196 | 43% | 0.429 | C | S | . | . | S | Bend | trans | -133.3 | 146.3 | -177.9 | -167.7 | 0 | 0 | 0 | 0 | 109.6 | R127 D131 | R127-S129 PolarHBondContact NH1-O 2.99Å; S129-D131 VanDerWaalsContact C-N 3.26Å; S129-D131 PolarHBondContact O-N 3.09Å |
| 130 | P | 80.6 | Confident | 81.3 | Confident | 62 Ų | 62 | 89.5 Ų | 89.5 | 40% | 0.403 | 44% | 0.441 | S | S | . | . | S | Bend | trans | -69.3 | -28 | 177.5 | 27 | -31.5 | 0 | 0 | 0 | 111.7 | R127 Y158 | R127-P130 PolarHBondContact NH1-O 3.36Å; P130-Y158 HydrophobicContact CB-CD1 3.91Å; P130-Y158 HydrophobicContact CB-CE1 3.66Å; P130-Y158 HydrophobicContact CB-CE2 4.46Å; P130-Y158 HydrophobicContact CB-CG 4.41Å; P130-Y158 VanDerWaalsContact CD-CE2 3.47Å; P130-Y158 HydrophobicContact CG-CE1 4.07Å; P130-Y158 HydrophobicContact CG-CE2 4.27Å |
| 131 | D | 76.1 | Confident | 81.2 | Confident | 68 Ų | 68 | 95.5 Ų | 95.5 | 36% | 0.364 | 47% | 0.465 | S | S | . | . | trans | -96.1 | 133.4 | 178.2 | -167.3 | 0.1 | 0 | 0 | 0 | 111.4 | S129 R133 | S129-D131 VanDerWaalsContact C-N 3.26Å; S129-D131 PolarHBondContact O-N 3.09Å; D131-R133 VanDerWaalsContact C-N 3.25Å; D131-R133 PolarHBondContact O-N 3.28Å; D131-R133 PolarHBondContact OD1-N 2.85Å; D131-R133 IonicContact OD1-NE 3.62Å; D131-R133 IonicContact OD2-NE 3.93Å | ||
| 132 | S | 66.6 | Low | 81.2 | Confident | 99 Ų | 99 | 100.1 Ų | 100.1 | 69% | 0.692 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.7 | -21 | 172.9 | 64 | 0 | 0 | 0 | 0 | 113 | R134 | S132-R134 PolarHBondContact O-N 2.71Š|
| 133 | R | 68.9 | Low | 81.4 | Confident | 208 Ų | 208 | 97.5 Ų | 97.5 | 79% | 0.785 | 47% | 0.469 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -83 | -11.2 | -167.3 | -70.8 | -177.1 | -91.9 | -163.3 | -9 | 115.3 | D131 | D131-R133 VanDerWaalsContact C-N 3.25Å; D131-R133 PolarHBondContact O-N 3.28Å; D131-R133 PolarHBondContact OD1-N 2.85Å; D131-R133 IonicContact OD1-NE 3.62Å; D131-R133 IonicContact OD2-NE 3.93Å |
| 134 | R | 67.8 | Low | 81.4 | Confident | 187 Ų | 187 | 99.1 Ų | 99.1 | 71% | 0.706 | 47% | 0.466 | S | S | * | . | trans | -94.6 | 118.6 | -175.5 | -152.5 | 172.9 | -172.7 | -174.1 | 0.9 | 111.9 | S132 R136 | S132-R134 PolarHBondContact O-N 2.71Å; R134-R136 PolarHBondContact O-N 3.5Å | ||
| 135 | R | 67.1 | Low | 81.4 | Confident | 249 Ų | 249 | 106.3 Ų | 106.3 | 94% | 0.94 | 49% | 0.493 | S | S | * | . | S | Bend | trans | -74.7 | 26.2 | -178 | -70.4 | -174.4 | 177.2 | 167.8 | -0.5 | 115.8 | ||
| 136 | R | 65.3 | Low | 81.2 | Confident | 210 Ų | 210 | 102 Ų | 102 | 79% | 0.792 | 48% | 0.477 | S | S | * | . | trans | -141 | 102.1 | 172 | -67.8 | -175.1 | -176.6 | 146 | 0.9 | 108.5 | R134 | R134-R136 PolarHBondContact O-N 3.5Š| ||
| 137 | Q | 72.4 | Confident | 81.2 | Confident | 115 Ų | 115 | 108.8 Ų | 108.8 | 54% | 0.537 | 51% | 0.51 | S | S | . | . | trans | -107.8 | 80.3 | -179.6 | -67.4 | -179.6 | 0.6 | 0 | 0 | 107.9 | ||||
| 138 | N | 77.2 | Confident | 81 | Confident | 135 Ų | 135 | 111.8 Ų | 111.8 | 72% | 0.722 | 52% | 0.524 | S | S | * | . | trans | -101.7 | 133.1 | 172.9 | -67.4 | 18.6 | 0 | 0 | 0 | 108 | T128 A140 | T128-N138 WeakPolarHBondContact CG2-O 3.29Å; N138-A140 PolarHBondContact O-N 2.92Å | ||
| 139 | I | 78.6 | Confident | 81 | Confident | 30 Ų | 30 | 113 Ų | 113 | 15% | 0.154 | 54% | 0.542 | C | S | . | . | trans | -61.5 | 120.6 | 179.5 | -59.7 | 170.9 | 0 | 0 | 0 | 107.6 | Y103 T128 Y141 M155 | Y103-I139 HydrophobicContact CD1-CD1 4.06Å; Y103-I139 HydrophobicContact CD2-CD1 4.03Å; Y103-I139 HydrophobicContact CE2-CD1 4.48Å; Y103-I139 HydrophobicContact CG-CD1 3.78Å; T128-I139 HydrophobicContact CG2-CB 4.13Å; T128-I139 HydrophobicContact CG2-CG1 3.79Å; T128-I139 VanDerWaalsContact CG2-N 3.29Å; I139-Y141 VanDerWaalsContact O-CD1 3.28Å; I139-Y141 WeakPolarHBondContact O-CD1 3.42Å; I139-Y141 PolarHBondContact O-N 3.49Å; I139-M155 HydrophobicContact CG2-SD 4.39Å | ||
| 140 | A | 84.7 | Confident | 81.3 | Confident | 54 Ų | 54 | 114 Ų | 114 | 45% | 0.446 | 54% | 0.541 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 101.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | N138 M155 K156 | N138-A140 PolarHBondContact O-N 2.92Å; A140-M155 WeakPolarHBondContact O-CA 3.47Å; A140-M155 WeakPolarHBondContact O-CB 3.34Å; A140-K156 PolarHBondContact O-N 3.45Å |
| 141 | Y | 89.9 | Confident | 81.7 | Confident | 126 Ų | 126 | 112.6 Ų | 112.6 | 49% | 0.494 | 53% | 0.53 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.2 | 150.6 | 172.4 | 68.3 | -90.6 | 0 | 0 | 0 | 109 | P99 I139 A154 | P99-Y141 HydrophobicContact CB-CD1 3.92Å; P99-Y141 HydrophobicContact CB-CE1 4.21Å; P99-Y141 HydrophobicContact CB-CG 4.15Å; P99-Y141 HydrophobicContact CG-CD1 4.13Å; P99-Y141 HydrophobicContact CG-CD2 4.22Å; P99-Y141 HydrophobicContact CG-CE1 4.03Å; P99-Y141 HydrophobicContact CG-CE2 4.12Å; P99-Y141 HydrophobicContact CG-CG 4.24Å; I139-Y141 VanDerWaalsContact O-CD1 3.28Å; I139-Y141 WeakPolarHBondContact O-CD1 3.42Å; I139-Y141 PolarHBondContact O-N 3.49Å; Y141-A154 CarbonylContact C-O 3.58Å; Y141-A154 VanDerWaalsContact CA-O 3.29Å; Y141-A154 WeakPolarHBondContact CA-O 3.3Å |
| 142 | D | 92.2 | Very high | 82.5 | Confident | 106 Ų | 106 | 109.9 Ų | 109.9 | 57% | 0.567 | 52% | 0.515 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 141 | 170.9 | -166 | 10 | 0 | 0 | 0 | 108.3 | M153 A154 | D142-M153 CarbonylContact O-C 3.6Å; D142-M153 WeakPolarHBondContact O-CA 3.21Å; D142-A154 PolarHBondContact N-O 3.4Å; D142-A154 PolarHBondContact O-N 2.88Å |
| 143 | S | 91.9 | Very high | 83.7 | Confident | 60 Ų | 60 | 105.6 Ų | 105.6 | 42% | 0.42 | 48% | 0.484 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.6 | 127 | -176.9 | 61.9 | 0 | 0 | 0 | 0 | 110.1 | H152 | S143-H152 CarbonylContact C-O 3.49Å; S143-H152 WeakPolarHBondContact CA-O 3.48Å |
| 144 | W | 92.5 | Very high | 84.8 | Confident | 92 Ų | 92 | 96.6 Ų | 96.6 | 35% | 0.348 | 46% | 0.455 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 163.2 | -180 | 68.2 | 96.3 | 0 | 0 | 0 | 110.3 | H152 A154 E171 | W144-H152 HydrophobicContact CD2-CB 3.65Å; W144-H152 AromaticContact CE2-CG 3.8Å; W144-H152 AromaticContact CE2-ND1 3.99Å; W144-H152 HydrophobicContact CE3-CB 4.15Å; W144-H152 HydrophobicContact CG-CB 4.13Å; W144-H152 HydrophobicContact CH2-CB 4.05Å; W144-H152 HydrophobicContact CZ2-CB 3.54Å; W144-H152 AromaticContact CZ2-CG 3.95Å; W144-H152 AromaticContact CZ2-ND1 3.76Å; W144-H152 HydrophobicContact CZ3-CB 4.33Å; W144-H152 PolarHBondContact N-O 2.88Å; W144-H152 AromaticContact NE1-CG 3.67Å; W144-H152 AromaticContact NE1-ND1 3.94Å; W144-H152 PolarHBondContact O-N 3.35Å; W144-A154 HydrophobicContact CH2-CB 3.74Å; W144-A154 HydrophobicContact CZ3-CB 3.6Å; W144-E171 HydrophobicContact CH2-CG 4.05Å; W144-E171 VanDerWaalsContact CZ2-OE1 3.26Å; W144-E171 WeakPolarHBondContact CZ2-OE1 3.42Å |
| 145 | Y | 91.5 | Very high | 86 | Confident | 167 Ų | 167 | 88 Ų | 88 | 66% | 0.655 | 42% | 0.423 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.6 | 136.5 | 171.8 | -69 | -86.4 | 0 | 0 | 0 | 109.3 | R150 L151 | Y145-R150 WeakPolarHBondContact CA-O 3.45Å; Y145-L151 HydrophobicContact CD1-CB 4.33Å; Y145-L151 HydrophobicContact CD1-CD1 4.38Å; Y145-L151 HydrophobicContact CE1-CB 3.99Å; Y145-L151 HydrophobicContact CE1-CD1 3.96Å; Y145-L151 HydrophobicContact CE2-CD1 4.17Å |
| 146 | D | 89 | Confident | 87.2 | Confident | 47 Ų | 47 | 80.6 Ų | 80.6 | 25% | 0.251 | 40% | 0.397 | S | S | . | . | trans | -72.8 | 167.3 | 170.8 | -166 | 13.5 | 0 | 0 | 0 | 110.9 | K148 G149 R150 H152 | D146-K148 PolarHBondContact O-N 2.75Å; D146-K148 VanDerWaalsContact O-N 3.16Å; D146-G149 WeakPolarHBondContact O-CA 3.38Å; D146-G149 PolarHBondContact O-N 3.1Å; D146-R150 HydrophobicContact CB-CB 4.37Å; D146-R150 PolarHBondContact N-O 2.83Å; D146-R150 IonicContact OD2-CZ 3.74Å; D146-R150 IonicContact OD2-NE 3.77Å; D146-R150 IonicContact OD2-NH2 3.04Å; D146-R150 PolarHBondContact OD2-NH2 2.87Å; D146-H152 IonicContact OD2-NE2 3.2Å | ||
| 147 | D | 90.4 | Very high | 88.6 | Confident | 168 Ų | 168 | 70.6 Ų | 70.6 | 90% | 0.898 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.2 | -27.8 | 176.5 | -70.6 | -21.4 | 0 | 0 | 0 | 111.9 | G149 | D147-G149 PolarHBondContact O-N 2.92Š|
| 148 | K | 87.3 | Confident | 89.6 | Confident | 112 Ų | 112 | 67 Ų | 67 | 49% | 0.487 | 34% | 0.341 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -1.5 | 173.2 | -63.6 | 178.2 | -179.7 | 173.4 | 0 | 113.8 | D146 R150 D207 | D146-K148 PolarHBondContact O-N 2.75Å; D146-K148 VanDerWaalsContact O-N 3.16Å; K148-R150 HydrophobicContact CB-CG 4.4Å; K148-D207 PolarHBondContact NZ-O 3.2Å; K148-D207 IonicContact NZ-OD1 3.56Å; K148-D207 PolarHBondContact NZ-OD1 3.5Å |
| 149 | G | 87.9 | Confident | 90.3 | Very high | 51 Ų | 51 | 60.6 Ų | 60.6 | 53% | 0.526 | 31% | 0.307 | S | S | . | . | S | Bend | trans | 76.8 | 16.3 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115 | D146 D147 | D146-G149 WeakPolarHBondContact O-CA 3.38Å; D146-G149 PolarHBondContact O-N 3.1Å; D147-G149 PolarHBondContact O-N 2.92Å |
| 150 | R | 88.8 | Confident | 91 | Very high | 48 Ų | 48 | 63.9 Ų | 63.9 | 18% | 0.181 | 32% | 0.32 | C | S | . | . | P | Polyproline II helix | trans | -83.2 | 139.8 | 176 | -62.2 | -179 | -65.1 | -169.4 | 0.8 | 110.3 | Y145 D146 K148 H152 V173 D207 | Y145-R150 WeakPolarHBondContact CA-O 3.45Å; D146-R150 HydrophobicContact CB-CB 4.37Å; D146-R150 PolarHBondContact N-O 2.83Å; D146-R150 IonicContact OD2-CZ 3.74Å; D146-R150 IonicContact OD2-NE 3.77Å; D146-R150 IonicContact OD2-NH2 3.04Å; D146-R150 PolarHBondContact OD2-NH2 2.87Å; K148-R150 HydrophobicContact CB-CG 4.4Å; R150-H152 PolarHBondContact O-N 2.66Å; R150-V173 HydrophobicContact CB-CG1 4.21Å; R150-D207 IonicContact CZ-OD2 2.82Å; R150-D207 VanDerWaalsContact NH1-CG 3.29Å; R150-D207 IonicContact NH1-OD1 2.94Å; R150-D207 IonicContact NH1-OD2 3.7Å; R150-D207 PolarHBondContact NH1-OD2 2.82Å |
| 151 | L | 90.2 | Very high | 91.3 | Very high | 32 Ų | 32 | 61.9 Ų | 61.9 | 17% | 0.168 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.5 | 118.1 | 175.9 | -178.3 | 66.3 | 0 | 0 | 0 | 110 | Y145 E174 F180 | Y145-L151 HydrophobicContact CD1-CB 4.33Å; Y145-L151 HydrophobicContact CD1-CD1 4.38Å; Y145-L151 HydrophobicContact CE1-CB 3.99Å; Y145-L151 HydrophobicContact CE1-CD1 3.96Å; Y145-L151 HydrophobicContact CE2-CD1 4.17Å; L151-E174 HydrophobicContact CB-CB 4.12Å; L151-E174 WeakPolarHBondContact CB-OE2 3.43Å; L151-E174 PolarHBondContact O-N 2.66Å; L151-F180 HydrophobicContact CD2-CE1 4.14Å; L151-F180 HydrophobicContact CD2-CZ 3.8Å; L151-F180 HydrophobicContact CG-CE1 4.35Å; L151-F180 HydrophobicContact CG-CZ 4.45Å |
| 152 | H | 91.8 | Very high | 91.4 | Very high | 11 Ų | 11 | 62 Ų | 62 | 5% | 0.051 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 144.2 | 169.2 | -74.1 | -122.7 | 0 | 0 | 0 | 109.4 | S143 W144 D146 R150 E171 V172 V173 | S143-H152 CarbonylContact C-O 3.49Å; S143-H152 WeakPolarHBondContact CA-O 3.48Å; W144-H152 HydrophobicContact CD2-CB 3.65Å; W144-H152 AromaticContact CE2-CG 3.8Å; W144-H152 AromaticContact CE2-ND1 3.99Å; W144-H152 HydrophobicContact CE3-CB 4.15Å; W144-H152 HydrophobicContact CG-CB 4.13Å; W144-H152 HydrophobicContact CH2-CB 4.05Å; W144-H152 HydrophobicContact CZ2-CB 3.54Å; W144-H152 AromaticContact CZ2-CG 3.95Å; W144-H152 AromaticContact CZ2-ND1 3.76Å; W144-H152 HydrophobicContact CZ3-CB 4.33Å; W144-H152 PolarHBondContact N-O 2.88Å; W144-H152 AromaticContact NE1-CG 3.67Å; W144-H152 AromaticContact NE1-ND1 3.94Å; W144-H152 PolarHBondContact O-N 3.35Å; D146-H152 IonicContact OD2-NE2 3.2Å; R150-H152 PolarHBondContact O-N 2.66Å; H152-E171 IonicContact CE1-OE1 2.74Å; H152-E171 IonicContact CG-OE1 3.73Å; H152-E171 IonicContact ND1-OE1 3.95Å; H152-E171 PolarHBondContact ND1-OE1 3.1Å; H152-V172 WeakPolarHBondContact CA-O 3.46Å; H152-V173 WeakPolarHBondContact CE1-CG2 3.33Å; H152-V173 WeakPolarHBondContact ND1-CG2 3.14Å; H152-V173 WeakPolarHBondContact NE2-CG1 3.39Å |
| 153 | M | 91.9 | Very high | 91.3 | Very high | 9 Ų | 9 | 62.9 Ų | 62.9 | 4% | 0.044 | 32% | 0.318 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.1 | 114.2 | 173.3 | -171.5 | -172.4 | -44.6 | 0 | 0 | 109.4 | P99 D142 M155 E171 V172 F180 | P99-M153 HydrophobicContact CB-SD 4.23Å; P99-M153 HydrophobicContact CG-SD 4.16Å; D142-M153 CarbonylContact O-C 3.6Å; D142-M153 WeakPolarHBondContact O-CA 3.21Å; M153-M155 HydrophobicContact CG-CE 4.47Å; M153-M155 HydrophobicContact SD-CE 3.9Å; M153-E171 CarbonylContact O-C 3.58Å; M153-E171 WeakPolarHBondContact O-CA 3.21Å; M153-V172 HydrophobicContact CB-CG2 3.79Å; M153-V172 PolarHBondContact N-O 2.7Å; M153-V172 PolarHBondContact O-N 3.39Å; M153-F180 HydrophobicContact CE-CE1 4.39Å; M153-F180 HydrophobicContact CE-CE2 3.61Å; M153-F180 HydrophobicContact CE-CZ 3.52Å |
| 154 | A | 92.9 | Very high | 91.3 | Very high | 19 Ų | 19 | 62.3 Ų | 62.3 | 16% | 0.157 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 142.7 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | Y141 D142 W144 L170 E171 | Y141-A154 CarbonylContact C-O 3.58Å; Y141-A154 VanDerWaalsContact CA-O 3.29Å; Y141-A154 WeakPolarHBondContact CA-O 3.3Å; D142-A154 PolarHBondContact N-O 3.4Å; D142-A154 PolarHBondContact O-N 2.88Å; W144-A154 HydrophobicContact CH2-CB 3.74Å; W144-A154 HydrophobicContact CZ3-CB 3.6Å; A154-L170 WeakPolarHBondContact CA-O 3.3Å; A154-E171 HydrophobicContact CB-CB 4.3Å; A154-E171 HydrophobicContact CB-CG 4.25Å |
| 155 | M | 93.2 | Very high | 91.2 | Very high | 8 Ų | 8 | 59 Ų | 59 | 4% | 0.039 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144.5 | 157.8 | 170.2 | 65.6 | -179 | 73.4 | 0 | 0 | 110.6 | V102 I139 A140 M153 L170 | V102-M155 HydrophobicContact CB-CE 3.67Å; V102-M155 HydrophobicContact CG1-CE 3.59Å; V102-M155 HydrophobicContact CG1-SD 4.31Å; I139-M155 HydrophobicContact CG2-SD 4.39Å; A140-M155 WeakPolarHBondContact O-CA 3.47Å; A140-M155 WeakPolarHBondContact O-CB 3.34Å; M153-M155 HydrophobicContact CG-CE 4.47Å; M153-M155 HydrophobicContact SD-CE 3.9Å; M155-L170 HydrophobicContact CE-CD1 4.25Å; M155-L170 HydrophobicContact CG-CD1 3.54Å; M155-L170 HydrophobicContact CG-CD2 3.42Å; M155-L170 VanDerWaalsContact CG-CD2 3.42Å; M155-L170 HydrophobicContact CG-CG 3.36Å; M155-L170 PolarHBondContact N-O 2.9Å; M155-L170 PolarHBondContact O-N 3.45Å; M155-L170 HydrophobicContact SD-CD1 4.05Å; M155-L170 HydrophobicContact SD-CD2 3.81Å; M155-L170 HydrophobicContact SD-CG 4.21Å |
| 156 | K | 92.8 | Very high | 91.3 | Very high | 93 Ų | 93 | 51 Ų | 51 | 40% | 0.404 | 27% | 0.268 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 141.2 | 169.6 | 67.6 | -174.5 | 178.6 | -170.9 | 0 | 109.9 | A140 V167 V168 Y169 | A140-K156 PolarHBondContact O-N 3.45Å; K156-V167 HydrophobicContact CB-CG1 4.49Å; K156-V168 VanDerWaalsContact CA-O 3.25Å; K156-V168 WeakPolarHBondContact CA-O 3.47Å; K156-Y169 HydrophobicContact CB-CD1 3.93Å; K156-Y169 HydrophobicContact CB-CE1 4.17Å; K156-Y169 HydrophobicContact CD-CE1 4.18Å |
| 157 | F | 93.7 | Very high | 91.5 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -140.6 | 164.3 | 172.7 | 66.4 | -90.4 | 0 | 0 | 0 | 110.4 | Y103 A106 F107 A126 I159 V167 V168 L170 | Y103-F157 HydrophobicContact CD2-CB 4.04Å; Y103-F157 AromaticContact CD2-CD1 3.84Å; Y103-F157 HydrophobicContact CD2-CD1 3.84Å; Y103-F157 HydrophobicContact CD2-CD2 4.43Å; Y103-F157 HydrophobicContact CD2-CE1 4.36Å; Y103-F157 AromaticContact CD2-CG 3.88Å; Y103-F157 HydrophobicContact CD2-CG 3.88Å; Y103-F157 HydrophobicContact CE2-CB 3.62Å; Y103-F157 HydrophobicContact CE2-CD1 4.06Å; Y103-F157 AromaticContact CE2-CD2 3.85Å; Y103-F157 HydrophobicContact CE2-CD2 3.85Å; Y103-F157 HydrophobicContact CE2-CE2 4.48Å; Y103-F157 AromaticContact CE2-CG 3.59Å; Y103-F157 HydrophobicContact CE2-CG 3.59Å; A106-F157 HydrophobicContact CB-CE1 4.04Å; A106-F157 HydrophobicContact CB-CZ 4.33Å; F107-F157 HydrophobicContact CB-CZ 4.43Å; F107-F157 HydrophobicContact CD2-CE2 4.29Å; A126-F157 HydrophobicContact CB-CD2 4.1Å; A126-F157 HydrophobicContact CB-CE2 4.21Å; F157-I159 HydrophobicContact CD2-CG2 3.9Å; F157-I159 HydrophobicContact CE2-CG2 3.49Å; F157-I159 VanDerWaalsContact CE2-CG2 3.49Å; F157-V167 CarbonylContact O-C 3.55Å; F157-V167 WeakPolarHBondContact O-CA 3.43Å; F157-V168 HydrophobicContact CD1-CB 4.01Å; F157-V168 HydrophobicContact CD1-CG1 4.3Å; F157-V168 HydrophobicContact CD2-CB 4.11Å; F157-V168 HydrophobicContact CD2-CG2 4.18Å; F157-V168 HydrophobicContact CE1-CB 3.64Å; F157-V168 HydrophobicContact CE1-CG1 3.54Å; F157-V168 HydrophobicContact CE1-CG2 4.37Å; F157-V168 HydrophobicContact CE2-CB 3.75Å; F157-V168 HydrophobicContact CE2-CG1 4.27Å; F157-V168 HydrophobicContact CE2-CG2 3.61Å; F157-V168 HydrophobicContact CG-CB 4.24Å; F157-V168 HydrophobicContact CZ-CB 3.5Å; F157-V168 HydrophobicContact CZ-CG1 3.52Å; F157-V168 HydrophobicContact CZ-CG2 3.72Å; F157-V168 PolarHBondContact N-O 2.99Å; F157-V168 PolarHBondContact O-N 3.49Å; F157-L170 HydrophobicContact CD1-CD2 3.96Å; F157-L170 HydrophobicContact CE1-CD2 3.54Å |
| 158 | Y | 92.7 | Very high | 91.6 | Very high | 39 Ų | 39 | 41.5 Ų | 41.5 | 15% | 0.153 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -104.5 | 141 | -176.6 | -63.4 | -93.6 | 0 | 0 | 0 | 108.9 | A126 R127 P130 G166 V167 | A126-Y158 CarbonylContact C-O 3.36Å; A126-Y158 WeakPolarHBondContact CA-O 3.42Å; R127-Y158 PolarHBondContact N-O 2.83Å; R127-Y158 WeakPolarHBondContact O-CA 3.25Å; R127-Y158 WeakPolarHBondContact O-CB 3.28Å; R127-Y158 PolarHBondContact O-N 2.94Å; P130-Y158 HydrophobicContact CB-CD1 3.91Å; P130-Y158 HydrophobicContact CB-CE1 3.66Å; P130-Y158 HydrophobicContact CB-CE2 4.46Å; P130-Y158 HydrophobicContact CB-CG 4.41Å; P130-Y158 VanDerWaalsContact CD-CE2 3.47Å; P130-Y158 HydrophobicContact CG-CE1 4.07Å; P130-Y158 HydrophobicContact CG-CE2 4.27Å; Y158-G166 CarbonylContact C-O 3.5Å; Y158-G166 WeakPolarHBondContact CA-O 3.05Å; Y158-V167 HydrophobicContact CD1-CB 4.44Å; Y158-V167 HydrophobicContact CD1-CG1 4.39Å; Y158-V167 HydrophobicContact CD1-CG2 3.67Å; Y158-V167 HydrophobicContact CE1-CB 4.42Å; Y158-V167 HydrophobicContact CE1-CG1 4.17Å; Y158-V167 HydrophobicContact CE1-CG2 3.5Å; Y158-V167 VanDerWaalsContact CE1-CG2 3.5Å |
| 159 | I | 93.3 | Very high | 91.9 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 21% | 0.21 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -116.8 | 140.5 | 172.8 | 53.6 | 173.9 | 0 | 0 | 0 | 109.3 | F107 V116 F120 L124 K125 A126 F157 S165 G166 V168 V187 | F107-I159 HydrophobicContact CD2-CG2 4.47Å; F107-I159 HydrophobicContact CE2-CG2 4.48Å; V116-I159 HydrophobicContact CG1-CD1 4.46Å; F120-I159 HydrophobicContact CD1-CD1 4.07Å; F120-I159 HydrophobicContact CD1-CG1 4.27Å; F120-I159 HydrophobicContact CD2-CD1 3.87Å; F120-I159 HydrophobicContact CE1-CD1 3.69Å; F120-I159 HydrophobicContact CE1-CG1 3.82Å; F120-I159 HydrophobicContact CE2-CD1 3.47Å; F120-I159 VanDerWaalsContact CE2-CD1 3.47Å; F120-I159 HydrophobicContact CE2-CG1 4.48Å; F120-I159 HydrophobicContact CG-CD1 4.18Å; F120-I159 HydrophobicContact CZ-CD1 3.36Å; F120-I159 HydrophobicContact CZ-CG1 3.94Å; L124-I159 HydrophobicContact CD1-CB 3.99Å; L124-I159 HydrophobicContact CD1-CD1 4.21Å; L124-I159 HydrophobicContact CG-CB 4.42Å; K125-I159 CarbonylContact O-C 3.39Å; K125-I159 WeakPolarHBondContact O-CA 3.48Å; A126-I159 HydrophobicContact CB-CG2 4.48Å; F157-I159 HydrophobicContact CD2-CG2 3.9Å; F157-I159 HydrophobicContact CE2-CG2 3.49Å; F157-I159 VanDerWaalsContact CE2-CG2 3.49Å; I159-S165 CarbonylContact O-C 3.57Å; I159-S165 WeakPolarHBondContact O-CA 3.37Å; I159-G166 PolarHBondContact N-O 2.74Å; I159-G166 PolarHBondContact O-N 3.26Å; I159-V168 HydrophobicContact CB-CG2 4.44Å; I159-V168 HydrophobicContact CD1-CG2 3.71Å; I159-V168 HydrophobicContact CG1-CG2 3.92Å; I159-V168 HydrophobicContact CG2-CG2 3.71Å; I159-V187 HydrophobicContact CD1-CG1 3.54Å |
| 160 | K | 92 | Very high | 92.2 | Very high | 100 Ų | 100 | 37.6 Ų | 37.6 | 44% | 0.435 | 19% | 0.185 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 114.2 | 176.2 | -173.9 | 171.4 | -174.2 | 73 | 0 | 108.3 | K125 | K125-K160 PolarHBondContact N-O 2.85Å; K125-K160 PolarHBondContact O-N 3.23Å |
| 161 | G | 92.3 | Very high | 92.4 | Very high | 12 Ų | 12 | 35.6 Ų | 35.6 | 12% | 0.124 | 18% | 0.178 | C | C | . | . | trans | -88.3 | -178.7 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | F120 S123 E164 | F120-G161 CarbonylContact O-C 3.59Å; F120-G161 WeakPolarHBondContact O-CA 3.39Å; S123-G161 WeakPolarHBondContact O-CA 3.3Å; G161-E164 VanDerWaalsContact CA-O 3.27Å; G161-E164 WeakPolarHBondContact CA-O 3.34Å; G161-E164 PolarHBondContact N-O 3.43Å | ||
| 162 | N | 91.7 | Very high | 92.4 | Very high | 127 Ų | 127 | 34.1 Ų | 34.1 | 68% | 0.679 | 17% | 0.17 | S | C | * | . | S | Bend | trans | -75.7 | -34.3 | 165.9 | -171.1 | 31.4 | 0 | 0 | 0 | 111.4 | F120 S123 | F120-N162 PolarHBondContact O-N 2.81Å; S123-N162 PolarHBondContact O-N 2.85Å |
| 163 | L | 90.1 | Very high | 92.4 | Very high | 126 Ų | 126 | 34.2 Ų | 34.2 | 66% | 0.66 | 17% | 0.171 | S | C | * | . | S | Bend | trans | -91.8 | -54.3 | -176.5 | -59.5 | 177.3 | 0 | 0 | 0 | 111.6 | F120 | F120-L163 PolarHBondContact O-N 3.05Š|
| 164 | E | 90.8 | Very high | 92.2 | Very high | 47 Ų | 47 | 35.8 Ų | 35.8 | 22% | 0.22 | 18% | 0.178 | C | C | . | . | trans | -131.7 | 164 | -172.6 | -157.8 | 168.2 | -175.5 | 0 | 0 | 111.4 | F120 G161 T189 G191 | F120-E164 HydrophobicContact CD1-CB 4.35Å; F120-E164 WeakPolarHBondContact CD1-O 3.16Å; G161-E164 VanDerWaalsContact CA-O 3.27Å; G161-E164 WeakPolarHBondContact CA-O 3.34Å; G161-E164 PolarHBondContact N-O 3.43Å; E164-T189 WeakPolarHBondContact OE1-CB 3.28Å; E164-T189 PolarHBondContact OE1-OG1 3.04Å; E164-T189 WeakPolarHBondContact OE2-CG2 3.29Å; E164-G191 WeakPolarHBondContact OE1-CA 3.41Å; E164-G191 PolarHBondContact OE1-N 2.87Å | ||
| 165 | S | 91.6 | Very high | 91.9 | Very high | 22 Ų | 22 | 37.3 Ų | 37.3 | 15% | 0.154 | 18% | 0.184 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 155.6 | 168.8 | -59.8 | 0 | 0 | 0 | 0 | 109.1 | I159 E190 | I159-S165 CarbonylContact O-C 3.57Å; I159-S165 WeakPolarHBondContact O-CA 3.37Å; S165-E190 VanDerWaalsContact O-CB 3.26Å; S165-E190 WeakPolarHBondContact O-CB 3.29Å; S165-E190 PolarHBondContact O-N 3.39Å |
| 166 | G | 92.2 | Very high | 91.5 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -161.1 | 177.2 | -172.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y158 I159 E188 | Y158-G166 CarbonylContact C-O 3.5Å; Y158-G166 WeakPolarHBondContact CA-O 3.05Å; I159-G166 PolarHBondContact N-O 2.74Å; I159-G166 PolarHBondContact O-N 3.26Å; G166-E188 CarbonylContact C-O 3.56Å; G166-E188 WeakPolarHBondContact CA-O 3.33Å |
| 167 | V | 93.3 | Very high | 91.1 | Very high | 16 Ų | 16 | 46.6 Ų | 46.6 | 10% | 0.097 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.5 | 133.9 | 179.3 | -166.1 | 0 | 0 | 0 | 0 | 108.3 | K156 F157 Y158 Y169 E188 | K156-V167 HydrophobicContact CB-CG1 4.49Å; F157-V167 CarbonylContact O-C 3.55Å; F157-V167 WeakPolarHBondContact O-CA 3.43Å; Y158-V167 HydrophobicContact CD1-CB 4.44Å; Y158-V167 HydrophobicContact CD1-CG1 4.39Å; Y158-V167 HydrophobicContact CD1-CG2 3.67Å; Y158-V167 HydrophobicContact CE1-CB 4.42Å; Y158-V167 HydrophobicContact CE1-CG1 4.17Å; Y158-V167 HydrophobicContact CE1-CG2 3.5Å; Y158-V167 VanDerWaalsContact CE1-CG2 3.5Å; V167-Y169 HydrophobicContact CB-CE2 3.83Å; V167-Y169 HydrophobicContact CG1-CD2 4.32Å; V167-Y169 HydrophobicContact CG1-CE1 4.04Å; V167-Y169 HydrophobicContact CG1-CE2 3.71Å; V167-E188 PolarHBondContact N-O 3.36Å; V167-E188 PolarHBondContact O-N 3.15Å |
| 168 | V | 93.8 | Very high | 90.4 | Very high | 0 Ų | 0 | 52.7 Ų | 52.7 | 0% | 0 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.7 | 125.4 | 172.7 | -175 | 0 | 0 | 0 | 0 | 107.6 | K156 F157 I159 L185 I186 V187 | K156-V168 VanDerWaalsContact CA-O 3.25Å; K156-V168 WeakPolarHBondContact CA-O 3.47Å; F157-V168 HydrophobicContact CD1-CB 4.01Å; F157-V168 HydrophobicContact CD1-CG1 4.3Å; F157-V168 HydrophobicContact CD2-CB 4.11Å; F157-V168 HydrophobicContact CD2-CG2 4.18Å; F157-V168 HydrophobicContact CE1-CB 3.64Å; F157-V168 HydrophobicContact CE1-CG1 3.54Å; F157-V168 HydrophobicContact CE1-CG2 4.37Å; F157-V168 HydrophobicContact CE2-CB 3.75Å; F157-V168 HydrophobicContact CE2-CG1 4.27Å; F157-V168 HydrophobicContact CE2-CG2 3.61Å; F157-V168 HydrophobicContact CG-CB 4.24Å; F157-V168 HydrophobicContact CZ-CB 3.5Å; F157-V168 HydrophobicContact CZ-CG1 3.52Å; F157-V168 HydrophobicContact CZ-CG2 3.72Å; F157-V168 PolarHBondContact N-O 2.99Å; F157-V168 PolarHBondContact O-N 3.49Å; I159-V168 HydrophobicContact CB-CG2 4.44Å; I159-V168 HydrophobicContact CD1-CG2 3.71Å; I159-V168 HydrophobicContact CG1-CG2 3.92Å; I159-V168 HydrophobicContact CG2-CG2 3.71Å; V168-L185 HydrophobicContact CG1-CD1 3.56Å; V168-I186 CarbonylContact C-O 3.47Å; V168-I186 WeakPolarHBondContact CA-O 3.28Å; V168-V187 HydrophobicContact CG1-CG2 4.23Å; V168-V187 HydrophobicContact CG2-CG1 4.23Å; V168-V187 HydrophobicContact CG2-CG2 4.04Å |
| 169 | Y | 93.9 | Very high | 90 | Very high | 81 Ų | 81 | 57 Ų | 57 | 32% | 0.318 | 29% | 0.287 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 132.9 | 172.4 | -58.7 | -87.1 | 0 | 0 | 0 | 108.2 | K156 V167 I186 E188 | K156-Y169 HydrophobicContact CB-CD1 3.93Å; K156-Y169 HydrophobicContact CB-CE1 4.17Å; K156-Y169 HydrophobicContact CD-CE1 4.18Å; V167-Y169 HydrophobicContact CB-CE2 3.83Å; V167-Y169 HydrophobicContact CG1-CD2 4.32Å; V167-Y169 HydrophobicContact CG1-CE1 4.04Å; V167-Y169 HydrophobicContact CG1-CE2 3.71Å; Y169-I186 PolarHBondContact N-O 3.48Å; Y169-I186 PolarHBondContact O-N 3.42Å; Y169-E188 HydrophobicContact CD2-CG 4.12Å; Y169-E188 HydrophobicContact CE2-CB 4.3Å; Y169-E188 HydrophobicContact CE2-CG 3.92Å; Y169-E188 WeakPolarHBondContact CE2-OE2 3.49Å |
| 170 | L | 93.4 | Very high | 89.7 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -144 | 151.2 | 175.4 | 74.1 | 102 | 0 | 0 | 0 | 111.1 | V102 A106 A154 M155 F157 V172 Y182 Y184 L185 | V102-L170 HydrophobicContact CG1-CD1 3.54Å; A106-L170 HydrophobicContact CB-CD2 3.53Å; A154-L170 WeakPolarHBondContact CA-O 3.3Å; M155-L170 HydrophobicContact CE-CD1 4.25Å; M155-L170 HydrophobicContact CG-CD1 3.54Å; M155-L170 HydrophobicContact CG-CD2 3.42Å; M155-L170 VanDerWaalsContact CG-CD2 3.42Å; M155-L170 HydrophobicContact CG-CG 3.36Å; M155-L170 PolarHBondContact N-O 2.9Å; M155-L170 PolarHBondContact O-N 3.45Å; M155-L170 HydrophobicContact SD-CD1 4.05Å; M155-L170 HydrophobicContact SD-CD2 3.81Å; M155-L170 HydrophobicContact SD-CG 4.21Å; F157-L170 HydrophobicContact CD1-CD2 3.96Å; F157-L170 HydrophobicContact CE1-CD2 3.54Å; L170-V172 HydrophobicContact CD1-CG1 4.11Å; L170-Y182 HydrophobicContact CD1-CE1 4.2Å; L170-Y184 VanDerWaalsContact CA-O 3.29Å; L170-Y184 WeakPolarHBondContact CA-O 3.46Å; L170-L185 HydrophobicContact CB-CD1 3.62Å; L170-L185 HydrophobicContact CD2-CD1 4.26Å |
| 171 | E | 92.6 | Very high | 89.5 | Confident | 6 Ų | 6 | 56.7 Ų | 56.7 | 3% | 0.028 | 29% | 0.289 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.1 | 137.2 | 169.1 | -175.2 | -177.7 | 155.6 | 0 | 0 | 108.8 | W144 H152 M153 A154 R183 Y184 | W144-E171 HydrophobicContact CH2-CG 4.05Å; W144-E171 VanDerWaalsContact CZ2-OE1 3.26Å; W144-E171 WeakPolarHBondContact CZ2-OE1 3.42Å; H152-E171 IonicContact CE1-OE1 2.74Å; H152-E171 IonicContact CG-OE1 3.73Å; H152-E171 IonicContact ND1-OE1 3.95Å; H152-E171 PolarHBondContact ND1-OE1 3.1Å; M153-E171 CarbonylContact O-C 3.58Å; M153-E171 WeakPolarHBondContact O-CA 3.21Å; A154-E171 HydrophobicContact CB-CB 4.3Å; A154-E171 HydrophobicContact CB-CG 4.25Å; E171-R183 HydrophobicContact CB-CB 4.23Å; E171-R183 VanDerWaalsContact CD-NH1 3.26Å; E171-R183 HydrophobicContact CG-CB 4.3Å; E171-R183 PolarHBondContact O-N 3.32Å; E171-R183 WeakPolarHBondContact OE1-CD 3.46Å; E171-R183 IonicContact OE1-CZ 3.95Å; E171-R183 IonicContact OE1-NE 3.91Å; E171-R183 IonicContact OE1-NH1 2.75Å; E171-R183 PolarHBondContact OE1-NH1 3.46Å; E171-R183 IonicContact OE2-CZ 3.88Å; E171-R183 IonicContact OE2-NH1 3.72Å; E171-R183 PolarHBondContact OE2-NH1 2.9Å; E171-Y184 HydrophobicContact CB-CD1 4.01Å; E171-Y184 HydrophobicContact CB-CE1 3.46Å; E171-Y184 VanDerWaalsContact CB-CE1 3.46Å; E171-Y184 HydrophobicContact CB-CE2 4.06Å; E171-Y184 VanDerWaalsContact CB-CZ 3.46Å; E171-Y184 HydrophobicContact CG-CE1 4.35Å; E171-Y184 PolarHBondContact N-O 3.31Å; E171-Y184 VanDerWaalsContact N-O 3.1Å; E171-Y184 PolarHBondContact O-N 3.38Å; E171-Y184 WeakPolarHBondContact OE2-CE1 3.35Å; E171-Y184 PolarHBondContact OE2-OH 3.2Å |
| 172 | V | 91.4 | Very high | 89.4 | Confident | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.006 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.1 | 148.9 | 173.1 | -61.6 | 0 | 0 | 0 | 0 | 110.7 | V102 H152 M153 L170 F180 D181 Y182 | V102-V172 HydrophobicContact CG1-CG1 3.69Å; V102-V172 HydrophobicContact CG1-CG2 4.01Å; V102-V172 HydrophobicContact CG2-CG2 4.19Å; H152-V172 WeakPolarHBondContact CA-O 3.46Å; M153-V172 HydrophobicContact CB-CG2 3.79Å; M153-V172 PolarHBondContact N-O 2.7Å; M153-V172 PolarHBondContact O-N 3.39Å; L170-V172 HydrophobicContact CD1-CG1 4.11Å; V172-F180 HydrophobicContact CB-CB 4.02Å; V172-F180 HydrophobicContact CB-CD1 4.33Å; V172-F180 HydrophobicContact CB-CG 4.35Å; V172-F180 HydrophobicContact CG2-CB 4.07Å; V172-F180 HydrophobicContact CG2-CD1 3.87Å; V172-F180 HydrophobicContact CG2-CD2 4.43Å; V172-F180 HydrophobicContact CG2-CE1 4.42Å; V172-F180 HydrophobicContact CG2-CG 3.91Å; V172-D181 CarbonylContact C-O 3.41Å; V172-D181 WeakPolarHBondContact CA-O 3.4Å; V172-Y182 HydrophobicContact CG1-CD1 3.6Å; V172-Y182 HydrophobicContact CG1-CE1 3.73Å; V172-Y182 HydrophobicContact CG1-CG 4.09Å |
| 173 | V | 90.2 | Very high | 89.2 | Confident | 13 Ų | 13 | 56.2 Ų | 56.2 | 8% | 0.079 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.3 | 138.8 | 180 | -175.9 | 0 | 0 | 0 | 0 | 108.8 | R150 H152 N175 F180 D181 R183 | R150-V173 HydrophobicContact CB-CG1 4.21Å; H152-V173 WeakPolarHBondContact CE1-CG2 3.33Å; H152-V173 WeakPolarHBondContact ND1-CG2 3.14Å; H152-V173 WeakPolarHBondContact NE2-CG1 3.39Å; V173-N175 PolarHBondContact O-N 3.37Å; V173-F180 WeakPolarHBondContact O-CA 3.12Å; V173-D181 PolarHBondContact N-O 2.78Å; V173-D181 PolarHBondContact O-N 3.45Å; V173-R183 HydrophobicContact CG2-CB 4.07Å |
| 174 | E | 89 | Confident | 89.3 | Confident | 42 Ų | 42 | 53.4 Ų | 53.4 | 20% | 0.196 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.7 | 120.7 | 174.5 | -169.6 | 173.1 | -165 | 0 | 0 | 110.9 | L151 K178 F180 | L151-E174 HydrophobicContact CB-CB 4.12Å; L151-E174 WeakPolarHBondContact CB-OE2 3.43Å; L151-E174 PolarHBondContact O-N 2.66Å; E174-K178 WeakPolarHBondContact OE1-CA 3.33Å; E174-K178 VanDerWaalsContact OE1-CB 3.29Å; E174-K178 WeakPolarHBondContact OE1-CB 3.26Å; E174-F180 HydrophobicContact CB-CD1 4.18Å; E174-F180 HydrophobicContact CB-CE1 3.99Å |
| 175 | N | 86.4 | Confident | 89.4 | Confident | 51 Ų | 51 | 51.2 Ų | 51.2 | 27% | 0.273 | 25% | 0.245 | S | C | . | . | trans | -78 | 171 | 173.4 | -79.8 | -6.3 | 0 | 0 | 0 | 112.6 | V173 S177 K178 E179 D181 | V173-N175 PolarHBondContact O-N 3.37Å; N175-S177 PolarHBondContact O-N 2.72Å; N175-S177 VanDerWaalsContact O-N 3.1Å; N175-K178 WeakPolarHBondContact O-CA 3.19Å; N175-K178 PolarHBondContact O-N 3.14Å; N175-E179 PolarHBondContact N-O 3.39Å; N175-D181 PolarHBondContact ND2-OD1 3.33Å; N175-D181 PolarHBondContact ND2-OD2 3.37Å | ||
| 176 | E | 85.4 | Confident | 89.4 | Confident | 200 Ų | 200 | 51.6 Ų | 51.6 | 94% | 0.935 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | -31.8 | 172.3 | -60.1 | -175.4 | 169.4 | 0 | 0 | 113.1 | K178 | E176-K178 PolarHBondContact O-N 3.44Š|
| 177 | S | 82.8 | Confident | 89.5 | Confident | 95 Ų | 95 | 51.6 Ų | 51.6 | 66% | 0.664 | 25% | 0.245 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -76.5 | 0.6 | 176.4 | -64.7 | 0 | 0 | 0 | 0 | 114.1 | N175 E179 | N175-S177 PolarHBondContact O-N 2.72Å; N175-S177 VanDerWaalsContact O-N 3.1Å; S177-E179 PolarHBondContact O-N 2.89Å |
| 178 | K | 79.9 | Confident | 89.4 | Confident | 129 Ų | 129 | 52.1 Ų | 52.1 | 56% | 0.561 | 25% | 0.246 | S | C | * | . | S | Bend | trans | 59.7 | 31.6 | -173.3 | -53.1 | -173.1 | 177.8 | -166.5 | 0 | 113.4 | K97 E174 N175 E176 | K97-K178 WeakPolarHBondContact CE-O 3.41Å; K97-K178 PolarHBondContact NZ-O 3.45Å; E174-K178 WeakPolarHBondContact OE1-CA 3.33Å; E174-K178 VanDerWaalsContact OE1-CB 3.29Å; E174-K178 WeakPolarHBondContact OE1-CB 3.26Å; N175-K178 WeakPolarHBondContact O-CA 3.19Å; N175-K178 PolarHBondContact O-N 3.14Å; E176-K178 PolarHBondContact O-N 3.44Å |
| 179 | E | 83.2 | Confident | 89.4 | Confident | 129 Ų | 129 | 52.5 Ų | 52.5 | 60% | 0.603 | 25% | 0.248 | S | C | * | . | trans | -107.5 | 148.9 | 172.2 | -65.4 | -173.7 | 167 | 0 | 0 | 108.2 | N175 S177 | N175-E179 PolarHBondContact N-O 3.39Å; S177-E179 PolarHBondContact O-N 2.89Å | ||
| 180 | F | 87.6 | Confident | 88.9 | Confident | 29 Ų | 29 | 54.1 Ų | 54.1 | 13% | 0.127 | 26% | 0.259 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 119.1 | 179.3 | -80.4 | -48.2 | 0 | 0 | 0 | 110.3 | S96 K97 V102 L151 M153 V172 V173 E174 | S96-F180 WeakPolarHBondContact O-CD2 3.29Å; K97-F180 VanDerWaalsContact CA-CE2 3.45Å; K97-F180 HydrophobicContact CB-CE2 4.18Å; K97-F180 HydrophobicContact CG-CE2 4.44Å; K97-F180 WeakPolarHBondContact O-CE2 3.35Å; V102-F180 HydrophobicContact CG2-CD2 3.91Å; V102-F180 HydrophobicContact CG2-CE2 4.46Å; L151-F180 HydrophobicContact CD2-CE1 4.14Å; L151-F180 HydrophobicContact CD2-CZ 3.8Å; L151-F180 HydrophobicContact CG-CE1 4.35Å; L151-F180 HydrophobicContact CG-CZ 4.45Å; M153-F180 HydrophobicContact CE-CE1 4.39Å; M153-F180 HydrophobicContact CE-CE2 3.61Å; M153-F180 HydrophobicContact CE-CZ 3.52Å; V172-F180 HydrophobicContact CB-CB 4.02Å; V172-F180 HydrophobicContact CB-CD1 4.33Å; V172-F180 HydrophobicContact CB-CG 4.35Å; V172-F180 HydrophobicContact CG2-CB 4.07Å; V172-F180 HydrophobicContact CG2-CD1 3.87Å; V172-F180 HydrophobicContact CG2-CD2 4.43Å; V172-F180 HydrophobicContact CG2-CE1 4.42Å; V172-F180 HydrophobicContact CG2-CG 3.91Å; V173-F180 WeakPolarHBondContact O-CA 3.12Å; E174-F180 HydrophobicContact CB-CD1 4.18Å; E174-F180 HydrophobicContact CB-CE1 3.99Å |
| 181 | D | 88.8 | Confident | 88 | Confident | 64 Ų | 64 | 55.1 Ų | 55.1 | 34% | 0.342 | 27% | 0.269 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.3 | 139.4 | 174.9 | -91.3 | 15.3 | 0 | 0 | 0 | 111.1 | V172 V173 N175 R183 | V172-D181 CarbonylContact C-O 3.41Å; V172-D181 WeakPolarHBondContact CA-O 3.4Å; V173-D181 PolarHBondContact N-O 2.78Å; V173-D181 PolarHBondContact O-N 3.45Å; N175-D181 PolarHBondContact ND2-OD1 3.33Å; N175-D181 PolarHBondContact ND2-OD2 3.37Å; D181-R183 PolarHBondContact O-N 2.94Å |
| 182 | Y | 89.2 | Confident | 86.8 | Confident | 27 Ų | 27 | 58.5 Ų | 58.5 | 11% | 0.106 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.6 | 116.2 | 178.9 | -70.9 | -84.3 | 0 | 0 | 0 | 110.8 | V102 D105 A106 I109 L170 V172 L185 | V102-Y182 HydrophobicContact CG1-CE1 4.47Å; V102-Y182 PolarHBondContact O-OH 3.4Å; D105-Y182 WeakPolarHBondContact CB-OH 3.33Å; A106-Y182 HydrophobicContact CB-CE1 4.14Å; A106-Y182 PolarHBondContact N-OH 3.47Å; A106-Y182 VanDerWaalsContact N-OH 3.1Å; I109-Y182 HydrophobicContact CD1-CD2 4.45Å; I109-Y182 HydrophobicContact CD1-CE2 3.83Å; L170-Y182 HydrophobicContact CD1-CE1 4.2Å; V172-Y182 HydrophobicContact CG1-CD1 3.6Å; V172-Y182 HydrophobicContact CG1-CE1 3.73Å; V172-Y182 HydrophobicContact CG1-CG 4.09Å; Y182-L185 HydrophobicContact CD1-CB 4.4Å |
| 183 | R | 88.5 | Confident | 85.5 | Confident | 102 Ų | 102 | 68.5 Ų | 68.5 | 39% | 0.385 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.7 | -48.7 | 167 | -172.7 | 177.1 | 164.6 | -163.5 | 0.5 | 110.4 | E171 V173 D181 F203 | E171-R183 HydrophobicContact CB-CB 4.23Å; E171-R183 VanDerWaalsContact CD-NH1 3.26Å; E171-R183 HydrophobicContact CG-CB 4.3Å; E171-R183 PolarHBondContact O-N 3.32Å; E171-R183 WeakPolarHBondContact OE1-CD 3.46Å; E171-R183 IonicContact OE1-CZ 3.95Å; E171-R183 IonicContact OE1-NE 3.91Å; E171-R183 IonicContact OE1-NH1 2.75Å; E171-R183 PolarHBondContact OE1-NH1 3.46Å; E171-R183 IonicContact OE2-CZ 3.88Å; E171-R183 IonicContact OE2-NH1 3.72Å; E171-R183 PolarHBondContact OE2-NH1 2.9Å; V173-R183 HydrophobicContact CG2-CB 4.07Å; D181-R183 PolarHBondContact O-N 2.94Å; R183-F203 HydrophobicContact CG-CB 4.46Å; R183-F203 WeakPolarHBondContact O-CB 3.44Å; R183-F203 PolarHBondContact O-N 2.78Å |
| 184 | Y | 91.2 | Very high | 84.6 | Confident | 68 Ų | 68 | 71.7 Ų | 71.7 | 27% | 0.267 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.3 | 152.6 | 169 | 58.9 | -97.8 | 0 | 0 | 0 | 111.3 | L170 E171 I186 R201 | L170-Y184 VanDerWaalsContact CA-O 3.29Å; L170-Y184 WeakPolarHBondContact CA-O 3.46Å; E171-Y184 HydrophobicContact CB-CD1 4.01Å; E171-Y184 HydrophobicContact CB-CE1 3.46Å; E171-Y184 VanDerWaalsContact CB-CE1 3.46Å; E171-Y184 HydrophobicContact CB-CE2 4.06Å; E171-Y184 VanDerWaalsContact CB-CZ 3.46Å; E171-Y184 HydrophobicContact CG-CE1 4.35Å; E171-Y184 PolarHBondContact N-O 3.31Å; E171-Y184 VanDerWaalsContact N-O 3.1Å; E171-Y184 PolarHBondContact O-N 3.38Å; E171-Y184 WeakPolarHBondContact OE2-CE1 3.35Å; E171-Y184 PolarHBondContact OE2-OH 3.2Å; Y184-I186 HydrophobicContact CD2-CD1 3.8Å; Y184-I186 HydrophobicContact CD2-CG1 4.01Å; Y184-I186 HydrophobicContact CG-CD1 4.13Å; Y184-I186 HydrophobicContact CG-CG1 4.47Å; Y184-R201 CarbonylContact C-O 3.55Å; Y184-R201 WeakPolarHBondContact CA-O 3.49Å |
| 185 | L | 92.9 | Very high | 84 | Confident | 0 Ų | 0 | 75.7 Ų | 75.7 | 0% | 0 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.1 | 109.2 | 166.3 | 179.3 | 64.4 | 0 | 0 | 0 | 108 | A106 I109 V168 L170 Y182 L200 R201 | A106-L185 HydrophobicContact CB-CD1 4.04Å; I109-L185 HydrophobicContact CB-CD2 3.93Å; I109-L185 HydrophobicContact CD1-CD2 4.02Å; I109-L185 HydrophobicContact CG2-CD2 3.67Å; V168-L185 HydrophobicContact CG1-CD1 3.56Å; L170-L185 HydrophobicContact CB-CD1 3.62Å; L170-L185 HydrophobicContact CD2-CD1 4.26Å; Y182-L185 HydrophobicContact CD1-CB 4.4Å; L185-L200 HydrophobicContact CB-CB 4.28Å; L185-L200 HydrophobicContact CD2-CB 3.89Å; L185-L200 HydrophobicContact CD2-CD1 3.75Å; L185-L200 HydrophobicContact CD2-CG 4.38Å; L185-L200 HydrophobicContact CG-CB 4.05Å; L185-L200 HydrophobicContact CG-CD1 3.98Å; L185-L200 HydrophobicContact CG-CG 4.38Å; L185-L200 PolarHBondContact O-N 2.82Å; L185-R201 HydrophobicContact CB-CB 4.33Å; L185-R201 PolarHBondContact N-O 2.96Å |
| 186 | I | 92.6 | Very high | 83.7 | Confident | 30 Ų | 30 | 78.5 Ų | 78.5 | 15% | 0.154 | 40% | 0.399 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 131.3 | -170.8 | -62.7 | 172.4 | 0 | 0 | 0 | 108.7 | V168 Y169 Y184 E188 Q197 I198 I199 | V168-I186 CarbonylContact C-O 3.47Å; V168-I186 WeakPolarHBondContact CA-O 3.28Å; Y169-I186 PolarHBondContact N-O 3.48Å; Y169-I186 PolarHBondContact O-N 3.42Å; Y184-I186 HydrophobicContact CD2-CD1 3.8Å; Y184-I186 HydrophobicContact CD2-CG1 4.01Å; Y184-I186 HydrophobicContact CG-CD1 4.13Å; Y184-I186 HydrophobicContact CG-CG1 4.47Å; I186-E188 HydrophobicContact CG2-CG 4.16Å; I186-Q197 HydrophobicContact CG2-CG 3.46Å; I186-Q197 VanDerWaalsContact CG2-CG 3.46Å; I186-I198 WeakPolarHBondContact CA-O 3.32Å; I186-I199 HydrophobicContact CG1-CG1 4.39Å |
| 187 | V | 93.3 | Very high | 83.5 | Confident | 1 Ų | 1 | 74.3 Ų | 74.3 | 1% | 0.006 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.8 | 122.1 | 175.7 | -175.4 | 0 | 0 | 0 | 0 | 109.3 | V116 F120 I159 V168 Q197 I198 L200 | V116-V187 HydrophobicContact CG2-CG2 4.27Å; F120-V187 HydrophobicContact CE2-CG1 3.49Å; F120-V187 VanDerWaalsContact CE2-CG1 3.49Å; F120-V187 HydrophobicContact CZ-CG1 3.69Å; I159-V187 HydrophobicContact CD1-CG1 3.54Å; V168-V187 HydrophobicContact CG1-CG2 4.23Å; V168-V187 HydrophobicContact CG2-CG1 4.23Å; V168-V187 HydrophobicContact CG2-CG2 4.04Å; V187-Q197 CarbonylContact O-C 3.54Å; V187-Q197 WeakPolarHBondContact O-CA 3.48Å; V187-I198 PolarHBondContact N-O 3.14Å; V187-I198 PolarHBondContact O-N 3Å; V187-L200 HydrophobicContact CG2-CD1 3.66Å; V187-L200 HydrophobicContact CG2-CG 4.15Å |
| 188 | E | 92.6 | Very high | 83.4 | Confident | 27 Ų | 27 | 70.9 Ų | 70.9 | 13% | 0.126 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.3 | 137.2 | 176 | -59.8 | -169.4 | 147.4 | 0 | 0 | 110.3 | G166 V167 Y169 I186 K195 K196 Q197 | G166-E188 CarbonylContact C-O 3.56Å; G166-E188 WeakPolarHBondContact CA-O 3.33Å; V167-E188 PolarHBondContact N-O 3.36Å; V167-E188 PolarHBondContact O-N 3.15Å; Y169-E188 HydrophobicContact CD2-CG 4.12Å; Y169-E188 HydrophobicContact CE2-CB 4.3Å; Y169-E188 HydrophobicContact CE2-CG 3.92Å; Y169-E188 WeakPolarHBondContact CE2-OE2 3.49Å; I186-E188 HydrophobicContact CG2-CG 4.16Å; E188-K195 WeakPolarHBondContact OE1-CE 3.5Å; E188-K195 IonicContact OE1-NZ 2.82Å; E188-K195 PolarHBondContact OE1-NZ 3.35Å; E188-K195 WeakPolarHBondContact OE2-CE 3.33Å; E188-K195 IonicContact OE2-NZ 2.75Å; E188-K195 PolarHBondContact OE2-NZ 3.26Å; E188-K196 WeakPolarHBondContact CA-O 3.1Å; E188-Q197 HydrophobicContact CG-CG 4.23Å |
| 189 | T | 92.5 | Very high | 83.5 | Confident | 7 Ų | 7 | 69 Ų | 69 | 4% | 0.043 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.4 | 147.1 | 172.5 | 68.6 | 0 | 0 | 0 | 0 | 111.8 | L119 F120 E164 G191 K196 | L119-T189 HydrophobicContact CD1-CG2 3.92Å; F120-T189 HydrophobicContact CE1-CG2 4.29Å; F120-T189 HydrophobicContact CE2-CG2 4.26Å; F120-T189 HydrophobicContact CZ-CG2 3.73Å; E164-T189 WeakPolarHBondContact OE1-CB 3.28Å; E164-T189 PolarHBondContact OE1-OG1 3.04Å; E164-T189 WeakPolarHBondContact OE2-CG2 3.29Å; T189-G191 PolarHBondContact O-N 3.45Å; T189-K196 HydrophobicContact CG2-CB 4.23Å; T189-K196 PolarHBondContact N-O 3.2Å; T189-K196 PolarHBondContact OG1-N 3.14Å; T189-K196 VanDerWaalsContact OG1-N 3.1Å |
| 190 | E | 84.7 | Confident | 83.2 | Confident | 116 Ų | 116 | 63.7 Ų | 63.7 | 54% | 0.542 | 32% | 0.324 | S | S | . | . | trans | -82.1 | 6.3 | -178.3 | -159.3 | 176.7 | 174.1 | 0 | 0 | 112.6 | S165 G192 | S165-E190 VanDerWaalsContact O-CB 3.26Å; S165-E190 WeakPolarHBondContact O-CB 3.29Å; S165-E190 PolarHBondContact O-N 3.39Å; E190-G192 PolarHBondContact O-N 3.3Å | ||
| 191 | G | 74.1 | Confident | 82.6 | Confident | 21 Ų | 21 | 68.5 Ų | 68.5 | 22% | 0.216 | 34% | 0.342 | C | S | . | . | trans | -62.2 | 103.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | E164 T189 F193 S194 K195 | E164-G191 WeakPolarHBondContact OE1-CA 3.41Å; E164-G191 PolarHBondContact OE1-N 2.87Å; T189-G191 PolarHBondContact O-N 3.45Å; G191-F193 PolarHBondContact O-N 2.84Å; G191-S194 CarbonylContact O-C 3.59Å; G191-S194 PolarHBondContact O-N 3.1Å; G191-K195 PolarHBondContact O-N 3.48Å | ||
| 192 | G | 66.6 | Low | 81.6 | Confident | 77 Ų | 77 | 69.8 Ų | 69.8 | 79% | 0.794 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.1 | -28.6 | -171.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | E190 | E190-G192 PolarHBondContact O-N 3.3Š|
| 193 | F | 63.4 | Low | 80.2 | Confident | 211 Ų | 211 | 72 Ų | 72 | 93% | 0.925 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -115.3 | -2 | 179.4 | -59.1 | -74.4 | 0 | 0 | 0 | 114.4 | G191 | G191-F193 PolarHBondContact O-N 2.84Š|
| 194 | S | 71.4 | Confident | 78.6 | Confident | 80 Ų | 80 | 71.6 Ų | 71.6 | 56% | 0.559 | 38% | 0.379 | S | S | * | . | trans | -142.5 | 49.6 | -175 | -62.3 | 0 | 0 | 0 | 0 | 110.1 | G191 K196 | G191-S194 CarbonylContact O-C 3.59Å; G191-S194 PolarHBondContact O-N 3.1Å; S194-K196 PolarHBondContact O-N 3.46Å | ||
| 195 | K | 76.5 | Confident | 76.8 | Confident | 126 Ų | 126 | 74 Ų | 74 | 55% | 0.548 | 39% | 0.393 | S | S | . | . | trans | -58.6 | 112.7 | 176.5 | -171.1 | 179.8 | -177.7 | -171.7 | 0 | 108.7 | E188 G191 | E188-K195 WeakPolarHBondContact OE1-CE 3.5Å; E188-K195 IonicContact OE1-NZ 2.82Å; E188-K195 PolarHBondContact OE1-NZ 3.35Å; E188-K195 WeakPolarHBondContact OE2-CE 3.33Å; E188-K195 IonicContact OE2-NZ 2.75Å; E188-K195 PolarHBondContact OE2-NZ 3.26Å; G191-K195 PolarHBondContact O-N 3.48Å | ||
| 196 | K | 81 | Confident | 75 | Confident | 110 Ų | 110 | 79.7 Ų | 79.7 | 48% | 0.478 | 43% | 0.427 | S | S | . | . | trans | -104.2 | 130.8 | 173.7 | -69.1 | 171.7 | -172.9 | 169.9 | 0 | 108.2 | L119 E188 T189 S194 | L119-K196 HydrophobicContact CD1-CB 3.99Å; L119-K196 HydrophobicContact CD1-CD 4.14Å; L119-K196 HydrophobicContact CD2-CD 3.68Å; E188-K196 WeakPolarHBondContact CA-O 3.1Å; T189-K196 HydrophobicContact CG2-CB 4.23Å; T189-K196 PolarHBondContact N-O 3.2Å; T189-K196 PolarHBondContact OG1-N 3.14Å; T189-K196 VanDerWaalsContact OG1-N 3.1Å; S194-K196 PolarHBondContact O-N 3.46Å | ||
| 197 | Q | 81.9 | Confident | 73.3 | Confident | 112 Ų | 112 | 81.6 Ų | 81.6 | 52% | 0.523 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 126.5 | 177.3 | -172.5 | 179 | 3.2 | 0 | 0 | 109 | I186 V187 E188 | I186-Q197 HydrophobicContact CG2-CG 3.46Å; I186-Q197 VanDerWaalsContact CG2-CG 3.46Å; V187-Q197 CarbonylContact O-C 3.54Å; V187-Q197 WeakPolarHBondContact O-CA 3.48Å; E188-Q197 HydrophobicContact CG-CG 4.23Å |
| 198 | I | 79.1 | Confident | 71.4 | Confident | 22 Ų | 22 | 85 Ų | 85 | 11% | 0.113 | 46% | 0.456 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.6 | 126.4 | 174.4 | -56.1 | 169.8 | 0 | 0 | 0 | 108.4 | R115 V116 L119 I186 V187 L200 | R115-I198 HydrophobicContact CB-CD1 4.02Å; R115-I198 HydrophobicContact CB-CG2 4.2Å; V116-I198 HydrophobicContact CG2-CD1 4.34Å; L119-I198 HydrophobicContact CD1-CD1 3.36Å; L119-I198 HydrophobicContact CD1-CG1 4.05Å; L119-I198 HydrophobicContact CG-CD1 4.08Å; I186-I198 WeakPolarHBondContact CA-O 3.32Å; V187-I198 PolarHBondContact N-O 3.14Å; V187-I198 PolarHBondContact O-N 3Å; I198-L200 HydrophobicContact CB-CD2 4.43Å; I198-L200 HydrophobicContact CG2-CD2 3.53Å; I198-L200 HydrophobicContact CG2-CG 4.49Å |
| 199 | I | 81.5 | Confident | 69.6 | Low | 89 Ų | 89 | 88.5 Ų | 88.5 | 46% | 0.456 | 48% | 0.481 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.2 | 116 | 171.2 | -56 | 167.9 | 0 | 0 | 0 | 107.5 | R115 I186 | R115-I199 PolarHBondContact NH1-O 2.75Å; R115-I199 VanDerWaalsContact NH1-O 3.08Å; I186-I199 HydrophobicContact CG1-CG1 4.39Å |
| 200 | L | 78 | Confident | 67.8 | Low | 19 Ų | 19 | 94.7 Ų | 94.7 | 10% | 0.099 | 51% | 0.513 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.5 | -43.5 | -178.4 | -56.3 | -176.7 | 0 | 0 | 0 | 111.2 | I109 D113 V116 L185 V187 I198 | I109-L200 HydrophobicContact CG2-CB 4.29Å; I109-L200 HydrophobicContact CG2-CD1 4.15Å; D113-L200 HydrophobicContact CB-CD2 4.05Å; D113-L200 WeakPolarHBondContact OD2-CD2 3.25Å; V116-L200 HydrophobicContact CG2-CD1 3.98Å; V116-L200 HydrophobicContact CG2-CD2 3.62Å; V116-L200 HydrophobicContact CG2-CG 4.39Å; L185-L200 HydrophobicContact CB-CB 4.28Å; L185-L200 HydrophobicContact CD2-CB 3.89Å; L185-L200 HydrophobicContact CD2-CD1 3.75Å; L185-L200 HydrophobicContact CD2-CG 4.38Å; L185-L200 HydrophobicContact CG-CB 4.05Å; L185-L200 HydrophobicContact CG-CD1 3.98Å; L185-L200 HydrophobicContact CG-CG 4.38Å; L185-L200 PolarHBondContact O-N 2.82Å; V187-L200 HydrophobicContact CG2-CD1 3.66Å; V187-L200 HydrophobicContact CG2-CG 4.15Å; I198-L200 HydrophobicContact CB-CD2 4.43Å; I198-L200 HydrophobicContact CG2-CD2 3.53Å; I198-L200 HydrophobicContact CG2-CG 4.49Å |
| 201 | R | 75.5 | Confident | 65.9 | Low | 130 Ų | 130 | 98.5 Ų | 98.5 | 49% | 0.491 | 54% | 0.536 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.1 | 128.4 | 171.3 | -68.5 | -167.4 | -176 | -161.4 | 5.7 | 108.4 | Y184 L185 | Y184-R201 CarbonylContact C-O 3.55Å; Y184-R201 WeakPolarHBondContact CA-O 3.49Å; L185-R201 HydrophobicContact CB-CB 4.33Å; L185-R201 PolarHBondContact N-O 2.96Å |
| 202 | S | 67.2 | Low | 65.5 | Low | 91 Ų | 91 | 102.4 Ų | 102.4 | 64% | 0.636 | 55% | 0.552 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -112 | 132.1 | 164.8 | -172 | 0 | 0 | 0 | 0 | 106.4 | S204 | S202-S204 PolarHBondContact O-N 3.48Å |
| 203 | F | 60.6 | Low | 65.4 | Low | 73 Ų | 73 | 103.7 Ų | 103.7 | 32% | 0.32 | 54% | 0.54 | S | S | . | . | trans | -64.9 | 130.4 | 166.5 | -170.1 | -101.2 | 0 | 0 | 0 | 108.8 | R183 E205 D207 | R183-F203 HydrophobicContact CG-CB 4.46Å; R183-F203 WeakPolarHBondContact O-CB 3.44Å; R183-F203 PolarHBondContact O-N 2.78Å; F203-E205 PolarHBondContact O-N 3.39Å; F203-D207 HydrophobicContact CE1-CB 4.32Å | ||
| 204 | S | 53.5 | Low | 65.5 | Low | 93 Ų | 93 | 97.8 Ų | 97.8 | 65% | 0.65 | 52% | 0.518 | S | S | * | . | trans | -67.7 | 123.8 | 168.6 | -51.8 | 0 | 0 | 0 | 0 | 107.4 | S202 V206 | S202-S204 PolarHBondContact O-N 3.48Å; S204-V206 VanDerWaalsContact C-N 3.26Å; S204-V206 PolarHBondContact O-N 2.94Å | ||
| 205 | E | 54.9 | Low | 65.2 | Low | 120 Ų | 120 | 98.8 Ų | 98.8 | 56% | 0.561 | 52% | 0.516 | S | S | * | . | S | Bend | trans | -48.8 | 77.9 | 174.8 | -158.4 | 90.9 | -133.6 | 0 | 0 | 112.3 | F203 | F203-E205 PolarHBondContact O-N 3.39Š|
| 206 | V | 54 | Low | 64.5 | Low | 118 Ų | 118 | 97.1 Ų | 97.1 | 72% | 0.715 | 51% | 0.514 | S | S | * | . | S | Bend | trans | -120.9 | -2.2 | 178.4 | -177.7 | 0 | 0 | 0 | 0 | 111.6 | S204 | S204-V206 VanDerWaalsContact C-N 3.26Å; S204-V206 PolarHBondContact O-N 2.94Å |
| 207 | D | 56.4 | Low | 63.3 | Low | 71 Ų | 71 | 96.3 Ų | 96.3 | 38% | 0.38 | 52% | 0.516 | S | S | . | . | S | Bend | trans | -149.6 | 15.1 | -173.4 | -127.7 | -20 | 0 | 0 | 0 | 117.4 | K148 R150 F203 | K148-D207 PolarHBondContact NZ-O 3.2Å; K148-D207 IonicContact NZ-OD1 3.56Å; K148-D207 PolarHBondContact NZ-OD1 3.5Å; R150-D207 IonicContact CZ-OD2 2.82Å; R150-D207 VanDerWaalsContact NH1-CG 3.29Å; R150-D207 IonicContact NH1-OD1 2.94Å; R150-D207 IonicContact NH1-OD2 3.7Å; R150-D207 PolarHBondContact NH1-OD2 2.82Å; F203-D207 HydrophobicContact CE1-CB 4.32Å |
| 208 | N | 55.2 | Low | 62 | Low | 73 Ų | 73 | 95.1 Ų | 95.1 | 39% | 0.39 | 52% | 0.516 | S | S | . | . | trans | -114.8 | 108.1 | 172.7 | -169.2 | 30.7 | 0 | 0 | 0 | 109.9 | D210 | N208-D210 PolarHBondContact O-N 3.41Š| ||
| 209 | P | 54.2 | Low | 60.7 | Low | 100 Ų | 100 | 100.8 Ų | 100.8 | 65% | 0.649 | 55% | 0.547 | S | S | * | . | trans | -79.8 | -0.4 | 174.6 | 32.4 | -33.8 | 0 | 0 | 0 | 113.8 | L211 | P209-L211 PolarHBondContact O-N 3.16Š| ||
| 210 | D | 54.4 | Low | 59 | Low | 136 Ų | 136 | 101.8 Ų | 101.8 | 73% | 0.727 | 55% | 0.554 | S | S | * | * | trans | -103.1 | 41.4 | -170.5 | -60.9 | -35.7 | 0 | 0 | 0 | 114 | N208 | N208-D210 PolarHBondContact O-N 3.41Š| ||
| 211 | L | 44 | Very low | 57.3 | Low | 197 Ų | 197 | 109.3 Ų | 109.3 | 100% | 1.031 | 60% | 0.596 | S | S | * | * | trans | -129.2 | 0 | 164.8 | -127.2 | 158.7 | 0 | 0 | 0 | 110.7 | P209 | P209-L211 PolarHBondContact O-N 3.16Š|
Retrieved 211 of 211 residues in 39.5 ms
(Link to these results)