| 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 | P | 56.3 | Low | 61.2 | Low | 180 Ų | 180 | 113.5 Ų | 113.5 | 100% | 1.169 | 68% | 0.681 | S | S | * | * | 0 | 85.2 | 0 | 29.8 | -8.7 | 0 | 0 | 0 | 111.7 | |||||
| 2 | L | 55.8 | Low | 61.1 | Low | 155 Ų | 155 | 116.2 Ų | 116.2 | 81% | 0.812 | 68% | 0.681 | S | S | * | * | trans | -159.1 | 31.9 | 179.4 | -120.6 | 170.1 | 0 | 0 | 0 | 113.5 | ||||
| 3 | L | 54.3 | Low | 60.9 | Low | 161 Ų | 161 | 115.2 Ų | 115.2 | 84% | 0.843 | 67% | 0.67 | S | S | * | * | trans | -114.6 | -7.1 | -172.4 | -101 | 153.6 | 0 | 0 | 0 | 115 | ||||
| 4 | G | 56.8 | Low | 61 | Low | 54 Ų | 54 | 113.5 Ų | 113.5 | 56% | 0.557 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -71.8 | -53.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | L6 | G4-L6 VanDerWaalsContact C-N 3.35Å; G4-L6 PolarHBondContact O-N 3.22Å |
| 5 | P | 61 | Low | 60.8 | Low | 84 Ų | 84 | 111.9 Ų | 111.9 | 55% | 0.545 | 65% | 0.654 | S | S | . | * | H | α-helix | trans | -78 | -13.8 | -165 | 29.9 | -35.6 | 0 | 0 | 0 | 114.8 | T8 V9 | P5-T8 PolarHBondContact O-OG1 3.3Å; P5-V9 WeakPolarHBondContact O-CG2 3.45Å |
| 6 | L | 60.9 | Low | 60.2 | Low | 134 Ų | 134 | 115.9 Ų | 115.9 | 70% | 0.702 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -78.5 | -34.1 | -179.1 | -146.8 | 80.6 | 0 | 0 | 0 | 112.3 | G4 L10 | G4-L6 VanDerWaalsContact C-N 3.35Å; G4-L6 PolarHBondContact O-N 3.22Å; L6-L10 PolarHBondContact O-N 2.84Å |
| 7 | A | 63 | Low | 59.6 | Low | 65 Ų | 65 | 116.9 Ų | 116.9 | 54% | 0.537 | 66% | 0.663 | S | S | . | * | H | α-helix | trans | -71.7 | -36.6 | -176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | L11 | A7-L11 PolarHBondContact O-N 3.2Å; A7-L11 VanDerWaalsContact O-N 3.14Å |
| 8 | T | 64.9 | Low | 58.9 | Low | 90 Ų | 90 | 115.4 Ų | 115.4 | 55% | 0.552 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -68.6 | -37 | 178.3 | 38.3 | 0 | 0 | 0 | 0 | 112.8 | P5 L11 Q12 | P5-T8 PolarHBondContact O-OG1 3.3Å; T8-L11 PolarHBondContact O-N 3.45Å; T8-Q12 PolarHBondContact O-N 3.28Å |
| 9 | V | 69.9 | Low | 58.2 | Low | 87 Ų | 87 | 117 Ų | 117 | 53% | 0.527 | 66% | 0.664 | S | S | . | * | H | α-helix | trans | -66.6 | -42.9 | 175.8 | 176.8 | 0 | 0 | 0 | 0 | 111.1 | P5 L11 Q12 L13 | P5-V9 WeakPolarHBondContact O-CG2 3.45Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 2.82Å; V9-Q12 PolarHBondContact O-N 3.44Å; V9-L13 PolarHBondContact O-N 3.28Å |
| 10 | L | 65.3 | Low | 57.4 | Low | 117 Ų | 117 | 117.9 Ų | 117.9 | 61% | 0.613 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -60.3 | -42 | 175.1 | -117.3 | 77.9 | 0 | 0 | 0 | 112.1 | L6 L13 V14 | L6-L10 PolarHBondContact O-N 2.84Å; L10-L13 PolarHBondContact O-N 3.49Å; L10-V14 PolarHBondContact O-N 3.21Å |
| 11 | L | 65.1 | Low | 56.4 | Low | 121 Ų | 121 | 116.3 Ų | 116.3 | 63% | 0.634 | 68% | 0.682 | S | S | * | * | H | α-helix | trans | -65.8 | -39.9 | -176.7 | -163.2 | 72 | 0 | 0 | 0 | 112.5 | A7 T8 V9 V15 | A7-L11 PolarHBondContact O-N 3.2Å; A7-L11 VanDerWaalsContact O-N 3.14Å; T8-L11 PolarHBondContact O-N 3.45Å; V9-L11 VanDerWaalsContact C-N 3.32Å; V9-L11 PolarHBondContact O-N 2.82Å; L11-V15 WeakPolarHBondContact O-CG2 3.31Å; L11-V15 PolarHBondContact O-N 3.39Å |
| 12 | Q | 59.4 | Low | 55.2 | Low | 146 Ų | 146 | 111.6 Ų | 111.6 | 68% | 0.682 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -66.3 | -37.7 | 176.1 | -74.6 | -168.9 | -30.4 | 0 | 0 | 112.6 | T8 V9 V14 V15 F16 | T8-Q12 PolarHBondContact O-N 3.28Å; V9-Q12 PolarHBondContact O-N 3.44Å; Q12-V14 PolarHBondContact O-N 3.32Å; Q12-V15 PolarHBondContact O-N 3.46Å; Q12-F16 PolarHBondContact O-N 3.09Å; Q12-F16 VanDerWaalsContact O-N 3.16Å |
| 13 | L | 58.6 | Low | 54.1 | Low | 103 Ų | 103 | 108.8 Ų | 108.8 | 54% | 0.539 | 67% | 0.665 | S | S | . | * | H | α-helix | trans | -63.2 | -40.2 | 178.5 | -112.5 | 161.4 | 0 | 0 | 0 | 112.5 | V9 L10 I17 | V9-L13 PolarHBondContact O-N 3.28Å; L10-L13 PolarHBondContact O-N 3.49Å; L13-I17 HydrophobicContact CD2-CD1 4.4Å; L13-I17 WeakPolarHBondContact O-CD1 3.16Å; L13-I17 WeakPolarHBondContact O-CG1 3.22Å; L13-I17 PolarHBondContact O-N 3.28Å |
| 14 | V | 62.6 | Low | 53.1 | Low | 92 Ų | 92 | 110.6 Ų | 110.6 | 56% | 0.558 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -67.7 | -39.6 | 177.5 | 174.5 | 0 | 0 | 0 | 0 | 112.2 | L10 Q12 I17 S18 | L10-V14 PolarHBondContact O-N 3.21Å; Q12-V14 PolarHBondContact O-N 3.32Å; V14-I17 PolarHBondContact O-N 3.23Å; V14-S18 PolarHBondContact O-N 3.35Å; V14-S18 PolarHBondContact O-OG 3.09Å |
| 15 | V | 57.6 | Low | 51.9 | Low | 90 Ų | 90 | 118.2 Ų | 118.2 | 55% | 0.545 | 68% | 0.675 | S | S | . | * | H | α-helix | trans | -66 | -40.6 | 179.3 | 172.9 | 0 | 0 | 0 | 0 | 111.4 | L11 Q12 I17 S18 | L11-V15 WeakPolarHBondContact O-CG2 3.31Å; L11-V15 PolarHBondContact O-N 3.39Å; Q12-V15 PolarHBondContact O-N 3.46Å; V15-I17 VanDerWaalsContact C-N 3.33Å; V15-I17 PolarHBondContact O-N 3.19Å; V15-S18 PolarHBondContact O-N 3.33Å |
| 16 | F | 51.2 | Low | 50.5 | Low | 176 Ų | 176 | 117 Ų | 117 | 77% | 0.772 | 68% | 0.678 | S | S | * | * | H | α-helix | trans | -64.7 | -34.2 | 179.3 | -115 | -85.2 | 0 | 0 | 0 | 113.6 | Q12 S18 | Q12-F16 PolarHBondContact O-N 3.09Å; Q12-F16 VanDerWaalsContact O-N 3.16Å; F16-S18 VanDerWaalsContact C-N 3.25Å; F16-S18 PolarHBondContact O-N 3.49Å |
| 17 | I | 50.8 | Low | 49.2 | Very low | 132 Ų | 132 | 119.2 Ų | 119.2 | 68% | 0.677 | 69% | 0.685 | S | S | * | * | H | α-helix | trans | -72.5 | -20.7 | 179.4 | -66.7 | 167.6 | 0 | 0 | 0 | 111.8 | L13 V14 V15 | L13-I17 HydrophobicContact CD2-CD1 4.4Å; L13-I17 WeakPolarHBondContact O-CD1 3.16Å; L13-I17 WeakPolarHBondContact O-CG1 3.22Å; L13-I17 PolarHBondContact O-N 3.28Å; V14-I17 PolarHBondContact O-N 3.23Å; V15-I17 VanDerWaalsContact C-N 3.33Å; V15-I17 PolarHBondContact O-N 3.19Å |
| 18 | S | 46.5 | Very low | 47.6 | Very low | 90 Ų | 90 | 121.7 Ų | 121.7 | 63% | 0.629 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | 2.1 | -170.3 | -57 | 0 | 0 | 0 | 0 | 115 | V14 V15 F16 | V14-S18 PolarHBondContact O-N 3.35Å; V14-S18 PolarHBondContact O-OG 3.09Å; V15-S18 PolarHBondContact O-N 3.33Å; F16-S18 VanDerWaalsContact C-N 3.25Å; F16-S18 PolarHBondContact O-N 3.49Å |
| 19 | M | 45.2 | Very low | 45.9 | Very low | 146 Ų | 146 | 124.6 Ų | 124.6 | 72% | 0.719 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -104.4 | -12.2 | -170.1 | -78.7 | -98 | 61.8 | 0 | 0 | 116.5 | ||
| 20 | T | 43.8 | Very low | 44.1 | Very low | 134 Ų | 134 | 127.9 Ų | 127.9 | 82% | 0.822 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -136.5 | 73 | -177.3 | 55.8 | 0 | 0 | 0 | 0 | 113 | ||
| 21 | G | 36.3 | Very low | 43 | Very low | 86 Ų | 86 | 127.3 Ų | 127.3 | 89% | 0.887 | 71% | 0.713 | S | S | * | * | trans | -176.5 | 80.2 | 176 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 22 | G | 30.5 | Very low | 41.2 | Very low | 81 Ų | 81 | 128.8 Ų | 128.8 | 84% | 0.835 | 72% | 0.717 | S | S | * | * | trans | -164.3 | 148 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 23 | A | 32 | Very low | 40.4 | Very low | 96 Ų | 96 | 127 Ų | 127 | 79% | 0.793 | 72% | 0.718 | S | S | * | * | trans | -132.4 | 167.9 | -161.4 | 0 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 24 | Y | 33.6 | Very low | 38.8 | Very low | 198 Ų | 198 | 131.2 Ų | 131.2 | 78% | 0.776 | 73% | 0.728 | S | S | * | * | trans | -20.1 | 161 | 159.3 | -69.9 | -96 | 0 | 0 | 0 | 118.2 | ||||
| 25 | Y | 31.3 | Very low | 37 | Very low | 214 Ų | 214 | 134.5 Ų | 134.5 | 84% | 0.839 | 74% | 0.738 | S | S | * | * | cis | -165.1 | 165.3 | 26.2 | -131.7 | -60.1 | 0 | 0 | 0 | 111.4 | ||||
| 26 | G | 31.5 | Very low | 36.4 | Very low | 59 Ų | 59 | 135 Ų | 135 | 61% | 0.608 | 74% | 0.743 | S | S | * | * | trans | 144.5 | 151.8 | 150.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 27 | H | 34.9 | Very low | 35.2 | Very low | 181 Ų | 181 | 134 Ų | 134 | 84% | 0.838 | 74% | 0.742 | S | S | * | * | cis | -163.9 | 177.1 | -7.4 | -144 | -76.4 | 0 | 0 | 0 | 112.6 | ||||
| 28 | T | 29.4 | Very low | 34.2 | Very low | 116 Ų | 116 | 135.2 Ų | 135.2 | 71% | 0.712 | 75% | 0.745 | S | S | * | * | trans | 98.6 | 147.3 | 172.4 | 71.5 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 29 | Q | 29.3 | Very low | 33.3 | Very low | 151 Ų | 151 | 138.6 Ų | 138.6 | 71% | 0.706 | 75% | 0.75 | S | S | * | * | cis | -157.9 | 134.6 | -13.5 | -116.7 | -173 | -16.7 | 0 | 0 | 110.1 | ||||
| 30 | H | 30.7 | Very low | 32.5 | Very low | 157 Ų | 157 | 137 Ų | 137 | 73% | 0.727 | 74% | 0.744 | S | S | * | * | 79.9 | 152.4 | 102.5 | -82.1 | 6.5 | 0 | 0 | 0 | 118.5 | |||||
| 31 | P | 43.3 | Very low | 31.8 | Very low | 105 Ų | 105 | 137.7 Ų | 137.7 | 68% | 0.682 | 74% | 0.738 | S | S | * | * | cis | -140.5 | 149.6 | -11.7 | 33.7 | -13.3 | 0 | 0 | 0 | 118.8 | ||||
| 32 | Q | 26.4 | Very low | 31.6 | Very low | 151 Ų | 151 | 140.8 Ų | 140.8 | 71% | 0.706 | 73% | 0.729 | S | S | * | * | trans | 62.5 | 168.7 | 139.6 | -66.5 | -66.7 | -5.4 | 0 | 0 | 121.5 | ||||
| 33 | P | 42 | Very low | 31.7 | Very low | 110 Ų | 110 | 143.3 Ų | 143.3 | 71% | 0.714 | 72% | 0.722 | S | S | * | * | cis | -136.6 | 156.3 | -17.2 | 26.2 | -2.7 | 0 | 0 | 0 | 119.1 | ||||
| 34 | Y | 26.7 | Very low | 31.6 | Very low | 190 Ų | 190 | 144.9 Ų | 144.9 | 75% | 0.745 | 72% | 0.717 | S | S | * | * | trans | 50.8 | 115.4 | 140.4 | -85.3 | -112.5 | 0 | 0 | 0 | 126.6 | ||||
| 35 | Q | 24.4 | Very low | 31.4 | Very low | 162 Ų | 162 | 144.2 Ų | 144.2 | 76% | 0.757 | 72% | 0.723 | S | S | * | * | 59.2 | 167.5 | 110.7 | -70.8 | -128 | -24.4 | 0 | 0 | 123.8 | |||||
| 36 | P | 43.6 | Very low | 31.3 | Very low | 101 Ų | 101 | 137.5 Ų | 137.5 | 66% | 0.656 | 72% | 0.719 | S | S | * | * | cis | -146.1 | -179.4 | -27.4 | 36.5 | -15.6 | 0 | 0 | 0 | 118.6 | ||||
| 37 | M | 26.6 | Very low | 31.3 | Very low | 154 Ų | 154 | 144.2 Ų | 144.2 | 76% | 0.759 | 73% | 0.732 | S | S | * | * | trans | 92 | 156.9 | 135.6 | -106.1 | -67 | -166.6 | 0 | 0 | 125.9 | ||||
| 38 | H | 30 | Very low | 31.1 | Very low | 157 Ų | 157 | 142.8 Ų | 142.8 | 73% | 0.727 | 73% | 0.726 | S | S | * | * | trans | 78.8 | 127.3 | 174.3 | -64 | -80.4 | 0 | 0 | 0 | 119.9 | ||||
| 39 | H | 28.7 | Very low | 31.1 | Very low | 162 Ų | 162 | 144.1 Ų | 144.1 | 75% | 0.75 | 72% | 0.724 | S | S | * | * | cis | 81.5 | 142.1 | 48.1 | -111.3 | 39.6 | 0 | 0 | 0 | 113.5 | ||||
| 40 | L | 28.2 | Very low | 31.2 | Very low | 113 Ų | 113 | 146.8 Ų | 146.8 | 59% | 0.592 | 73% | 0.729 | S | S | * | * | cis | -170.3 | 151.1 | 24.5 | 170.7 | 63.7 | 0 | 0 | 0 | 112.5 | ||||
| 41 | Q | 28.7 | Very low | 31.1 | Very low | 148 Ų | 148 | 147.3 Ų | 147.3 | 69% | 0.692 | 74% | 0.736 | S | S | * | * | trans | 63.8 | 159.1 | 160.3 | -79.3 | 164.6 | -12.7 | 0 | 0 | 118.9 | ||||
| 42 | H | 32.5 | Very low | 30.5 | Very low | 151 Ų | 151 | 145.5 Ų | 145.5 | 70% | 0.699 | 74% | 0.737 | S | S | * | * | cis | -168.2 | 175 | -8.1 | -119.3 | -8.6 | 0 | 0 | 0 | 109.7 | ||||
| 43 | I | 31.7 | Very low | 30.8 | Very low | 134 Ų | 134 | 146.5 Ų | 146.5 | 69% | 0.687 | 74% | 0.739 | S | S | * | * | cis | -155.9 | -149.2 | -2.5 | -151.6 | 167.7 | 0 | 0 | 0 | 112.4 | ||||
| 44 | N | 29.7 | Very low | 30.2 | Very low | 128 Ų | 128 | 148.7 Ų | 148.7 | 68% | 0.684 | 74% | 0.739 | S | S | * | * | trans | -65.1 | 172 | -177.9 | -79.8 | -41.5 | 0 | 0 | 0 | 118.3 | ||||
| 45 | M | 29.8 | Very low | 30.4 | Very low | 184 Ų | 184 | 146.1 Ų | 146.1 | 91% | 0.906 | 74% | 0.743 | S | S | * | * | cis | -158.4 | 158.2 | 7 | -134.9 | 172.1 | -176.8 | 0 | 0 | 112.8 | ||||
| 46 | G | 29.9 | Very low | 31.3 | Very low | 74 Ų | 74 | 144.6 Ų | 144.6 | 76% | 0.763 | 75% | 0.747 | S | S | * | * | trans | 156.2 | 134.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 47 | K | 30.8 | Very low | 30.5 | Very low | 200 Ų | 200 | 149.6 Ų | 149.6 | 87% | 0.87 | 75% | 0.754 | S | S | * | * | trans | -117.4 | 174.9 | 169.5 | -69.6 | -175.7 | 175.8 | 178.2 | 0 | 108.3 | ||||
| 48 | Q | 30.9 | Very low | 30.6 | Very low | 151 Ų | 151 | 148.9 Ų | 148.9 | 71% | 0.706 | 75% | 0.751 | S | S | * | * | cis | -169.6 | 136.4 | 33.9 | -164.2 | 163.9 | -14.6 | 0 | 0 | 115.2 | ||||
| 49 | Q | 29.4 | Very low | 30.2 | Very low | 143 Ų | 143 | 149.8 Ų | 149.8 | 67% | 0.668 | 76% | 0.756 | S | S | * | * | trans | 33.1 | 135.6 | 149 | -59.1 | 170.3 | -89.6 | 0 | 0 | 124.6 | ||||
| 50 | Y | 31.3 | Very low | 30.3 | Very low | 207 Ų | 207 | 151.6 Ų | 151.6 | 81% | 0.812 | 76% | 0.762 | S | S | * | * | 160.6 | 117 | 122.3 | -96.2 | -81.8 | 0 | 0 | 0 | 107.3 | |||||
| 51 | L | 29.4 | Very low | 31.1 | Very low | 168 Ų | 168 | 150.9 Ų | 150.9 | 88% | 0.88 | 76% | 0.764 | S | S | * | * | 64.6 | 120.9 | 59.1 | -158.6 | 84.5 | 0 | 0 | 0 | 113.7 | |||||
| 52 | G | 29.9 | Very low | 31 | Very low | 68 Ų | 68 | 151.2 Ų | 151.2 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | cis | 170.3 | 150.4 | -11 | 0 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 53 | K | 32.8 | Very low | 30.9 | Very low | 172 Ų | 172 | 153.6 Ų | 153.6 | 75% | 0.748 | 77% | 0.769 | S | S | * | * | trans | 54.7 | 124.8 | 153.6 | -86.2 | 174.2 | 162.6 | -88.9 | 0 | 123.9 | ||||
| 54 | E | 29.9 | Very low | 30.7 | Very low | 156 Ų | 156 | 157.1 Ų | 157.1 | 73% | 0.729 | 77% | 0.774 | S | S | * | * | 89.2 | 157 | 127.5 | -77.2 | 159.6 | -175.5 | 0 | 0 | 123.4 | |||||
| 55 | V | 31.1 | Very low | 30.6 | Very low | 135 Ų | 135 | 158.5 Ų | 158.5 | 82% | 0.818 | 77% | 0.774 | S | S | * | * | trans | -146.4 | 150.2 | -165.7 | -152.3 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 56 | P | 41.3 | Very low | 30.6 | Very low | 131 Ų | 131 | 157.2 Ų | 157.2 | 85% | 0.851 | 77% | 0.766 | S | S | * | * | trans | -135.7 | -168.5 | 144.5 | 33.1 | -15.9 | 0 | 0 | 0 | 113.6 | ||||
| 57 | Y | 27.6 | Very low | 30.6 | Very low | 205 Ų | 205 | 160.4 Ų | 160.4 | 80% | 0.804 | 76% | 0.764 | S | S | * | * | trans | -138.3 | 154.1 | -141.2 | 178.1 | -116.6 | 0 | 0 | 0 | 115.3 | ||||
| 58 | M | 27.9 | Very low | 31.1 | Very low | 139 Ų | 139 | 156.3 Ų | 156.3 | 69% | 0.685 | 76% | 0.758 | S | S | * | * | trans | 82.9 | 145.5 | 157.6 | -119 | -159.9 | -42 | 0 | 0 | 123 | ||||
| 59 | Q | 23.3 | Very low | 30.9 | Very low | 177 Ų | 177 | 156.4 Ų | 156.4 | 83% | 0.827 | 76% | 0.759 | S | S | * | * | trans | 118.7 | 123.8 | 136.2 | -145.2 | 163 | 22.2 | 0 | 0 | 118.7 | ||||
| 60 | F | 30.6 | Very low | 31 | Very low | 199 Ų | 199 | 155.1 Ų | 155.1 | 87% | 0.873 | 76% | 0.761 | S | S | * | * | trans | -86.5 | 173.1 | 170.5 | -80.8 | -81.6 | 0 | 0 | 0 | 110.6 | ||||
| 61 | P | 43.9 | Very low | 31.5 | Very low | 98 Ų | 98 | 151 Ų | 151 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | cis | -150.9 | -177.5 | 24.9 | 44.8 | -23.9 | 0 | 0 | 0 | 120.1 | ||||
| 62 | H | 27.8 | Very low | 31.5 | Very low | 156 Ų | 156 | 150.6 Ų | 150.6 | 72% | 0.722 | 76% | 0.757 | S | S | * | * | trans | 83.4 | 131.6 | 140.4 | -82.6 | -48.6 | 0 | 0 | 0 | 125.9 | ||||
| 63 | Y | 28.9 | Very low | 31.6 | Very low | 200 Ų | 200 | 155.8 Ų | 155.8 | 78% | 0.784 | 77% | 0.768 | S | S | * | * | trans | 89.6 | 112.2 | 135.8 | -90.4 | -55.1 | 0 | 0 | 0 | 124.6 | ||||
| 64 | R | 27.8 | Very low | 31.5 | Very low | 209 Ų | 209 | 156.1 Ų | 156.1 | 79% | 0.789 | 77% | 0.769 | S | S | * | * | 115.7 | 130.4 | 112.7 | -163.2 | 173.9 | -161.6 | -158.7 | 8.1 | 120.5 | |||||
| 65 | K | 28.1 | Very low | 31.4 | Very low | 157 Ų | 157 | 152.2 Ų | 152.2 | 68% | 0.683 | 77% | 0.771 | S | S | * | * | trans | 74.1 | 149.6 | 153.8 | -91.6 | -173.3 | 167.1 | -139.1 | 0 | 118.4 | ||||
| 66 | E | 30 | Very low | 31.5 | Very low | 157 Ų | 157 | 154.2 Ų | 154.2 | 73% | 0.734 | 77% | 0.769 | S | S | * | * | cis | -135.9 | -170.1 | 1.5 | -70.8 | -136.3 | 129.3 | 0 | 0 | 114.3 | ||||
| 67 | L | 30.7 | Very low | 30.8 | Very low | 140 Ų | 140 | 157 Ų | 157 | 73% | 0.733 | 77% | 0.77 | S | S | * | * | trans | -125.4 | 161.3 | -174.5 | -109.6 | 164.6 | 0 | 0 | 0 | 111.3 | ||||
| 68 | P | 39.5 | Very low | 31 | Very low | 114 Ų | 114 | 154.5 Ų | 154.5 | 74% | 0.74 | 77% | 0.771 | S | S | * | * | -135.4 | 147.8 | 98.4 | 16.4 | 5.6 | 0 | 0 | 0 | 112.7 | |||||
| 69 | Q | 28.2 | Very low | 31.8 | Very low | 154 Ų | 154 | 153.5 Ų | 153.5 | 72% | 0.72 | 78% | 0.775 | S | S | * | * | 64.6 | 134.9 | 61.9 | -65.9 | -159.8 | 14.2 | 0 | 0 | 113.4 | |||||
| 70 | T | 30.5 | Very low | 32.1 | Very low | 116 Ų | 116 | 157 Ų | 157 | 71% | 0.712 | 78% | 0.781 | S | S | * | * | cis | -167 | -173.2 | 4.2 | 13.3 | 0 | 0 | 0 | 0 | 108 | ||||
| 71 | P | 41.8 | Very low | 32.4 | Very low | 119 Ų | 119 | 155.4 Ų | 155.4 | 77% | 0.773 | 77% | 0.773 | S | S | * | * | cis | -131.4 | 177.9 | 6.4 | 40.8 | -22.5 | 0 | 0 | 0 | 116.9 | ||||
| 72 | L | 30.3 | Very low | 31.8 | Very low | 161 Ų | 161 | 157.5 Ų | 157.5 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | trans | -97.4 | 160.3 | 168 | -84.4 | 89.7 | 0 | 0 | 0 | 112.5 | ||||
| 73 | L | 30.8 | Very low | 32.2 | Very low | 177 Ų | 177 | 157.5 Ų | 157.5 | 93% | 0.927 | 78% | 0.784 | S | S | * | * | trans | -103.2 | 157.2 | 149.5 | -99.1 | 167.6 | 0 | 0 | 0 | 110.6 | ||||
| 74 | K | 30.8 | Very low | 32.3 | Very low | 178 Ų | 178 | 151.9 Ų | 151.9 | 77% | 0.774 | 79% | 0.787 | S | S | * | * | trans | -145.1 | 128.3 | -160.5 | -177.8 | 175.1 | -175.1 | 168.8 | 0 | 113.3 | ||||
| 75 | G | 29.1 | Very low | 32.8 | Very low | 75 Ų | 75 | 147.1 Ų | 147.1 | 77% | 0.773 | 79% | 0.793 | S | S | * | * | trans | -100.1 | 156.6 | 162.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 76 | K | 32 | Very low | 33.1 | Very low | 176 Ų | 176 | 144.2 Ų | 144.2 | 77% | 0.765 | 80% | 0.798 | S | S | * | * | trans | -136.2 | 149 | 174.2 | -91.9 | -176.8 | 166 | -173.4 | 0 | 107.7 | ||||
| 77 | E | 27.6 | Very low | 33.4 | Very low | 189 Ų | 189 | 145 Ų | 145 | 88% | 0.883 | 81% | 0.806 | S | S | * | * | -169.4 | -173.6 | 102 | -102.1 | -168.2 | 174.8 | 0 | 0 | 113.3 | |||||
| 78 | N | 30.6 | Very low | 33.8 | Very low | 154 Ų | 154 | 142 Ų | 142 | 82% | 0.824 | 81% | 0.809 | S | S | * | * | trans | -108.7 | 162.2 | -150.9 | -97.3 | -1.5 | 0 | 0 | 0 | 114.7 | ||||
| 79 | P | 46.4 | Very low | 34 | Very low | 117 Ų | 117 | 146 Ų | 146 | 76% | 0.76 | 82% | 0.818 | S | S | * | * | trans | -84.2 | 163 | -173.1 | 34.7 | -37.6 | 0 | 0 | 0 | 114.5 | ||||
| 80 | R | 29.2 | Very low | 34.6 | Very low | 252 Ų | 252 | 148 Ų | 148 | 95% | 0.951 | 83% | 0.827 | S | S | * | * | trans | -133.1 | 150 | 160.1 | -77.3 | -172 | 171.9 | -177.2 | -1.8 | 110.7 | ||||
| 81 | K | 36.1 | Very low | 35.7 | Very low | 165 Ų | 165 | 145.3 Ų | 145.3 | 72% | 0.717 | 82% | 0.822 | S | S | * | * | trans | -111.1 | 131.1 | -179.7 | -176.9 | -163.2 | 177.9 | -153.9 | 0 | 109.3 | E83 | K81-E83 WeakPolarHBondContact CE-OE1 3.42Å; K81-E83 IonicContact NZ-OE1 3.21Å; K81-E83 PolarHBondContact NZ-OE1 3.19Å | ||
| 82 | V | 30.8 | Very low | 36.1 | Very low | 141 Ų | 141 | 145.9 Ų | 145.9 | 86% | 0.855 | 83% | 0.826 | S | S | * | * | trans | -142.6 | 141.7 | 165.2 | -173.6 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 83 | E | 36.7 | Very low | 36.9 | Very low | 157 Ų | 157 | 143 Ų | 143 | 73% | 0.734 | 83% | 0.826 | S | S | * | * | trans | -98.5 | 144 | 175.6 | -72.9 | 152.9 | 164.9 | 0 | 0 | 110.2 | K81 | K81-E83 WeakPolarHBondContact CE-OE1 3.42Å; K81-E83 IonicContact NZ-OE1 3.21Å; K81-E83 PolarHBondContact NZ-OE1 3.19Å | ||
| 84 | G | 32.2 | Very low | 38.2 | Very low | 82 Ų | 82 | 137.5 Ų | 137.5 | 85% | 0.845 | 81% | 0.812 | S | S | * | * | trans | 178.4 | 124.3 | 177 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 85 | A | 36.9 | Very low | 39.3 | Very low | 109 Ų | 109 | 134.9 Ų | 134.9 | 90% | 0.901 | 81% | 0.813 | S | S | * | * | trans | -100.8 | 138.8 | -178.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 86 | A | 35.3 | Very low | 40.7 | Very low | 96 Ų | 96 | 137.2 Ų | 137.2 | 79% | 0.793 | 82% | 0.815 | S | S | * | * | trans | -148 | 140.6 | 162.5 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 87 | L | 36.7 | Very low | 42.1 | Very low | 172 Ų | 172 | 131.9 Ų | 131.9 | 90% | 0.901 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -74 | 139.4 | 170.4 | -81.6 | 68.9 | 0 | 0 | 0 | 108.6 | ||
| 88 | G | 38.2 | Very low | 43.4 | Very low | 78 Ų | 78 | 129.1 Ų | 129.1 | 80% | 0.804 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 130.4 | 163.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 89 | E | 43.2 | Very low | 45.1 | Very low | 199 Ų | 199 | 131.1 Ų | 131.1 | 93% | 0.93 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 140.7 | 176.1 | -66.3 | -167.6 | 114 | 0 | 0 | 111.2 | ||
| 90 | Q | 41.7 | Very low | 45.7 | Very low | 195 Ų | 195 | 128.2 Ų | 128.2 | 91% | 0.911 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 126.8 | 176.7 | -162.3 | 169.9 | 15.8 | 0 | 0 | 108.9 | ||
| 91 | G | 52.9 | Low | 46.9 | Very low | 59 Ų | 59 | 122.1 Ų | 122.1 | 61% | 0.608 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 151.7 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | A93 | G91-A93 PolarHBondContact O-N 3.39Š|
| 92 | P | 49.9 | Very low | 48.3 | Very low | 131 Ų | 131 | 120.4 Ų | 120.4 | 85% | 0.851 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 137.2 | -178.3 | 26 | -34.5 | 0 | 0 | 0 | 111 | ||
| 93 | A | 48.8 | Very low | 49.5 | Very low | 101 Ų | 101 | 116.7 Ų | 116.7 | 84% | 0.835 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 140.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.2 | G91 | G91-A93 PolarHBondContact O-N 3.39Š|
| 94 | G | 57.7 | Low | 50.3 | Low | 62 Ų | 62 | 115 Ų | 115 | 64% | 0.639 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 155.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 95 | P | 52.9 | Low | 52 | Low | 122 Ų | 122 | 117.2 Ų | 117.2 | 79% | 0.792 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 146.9 | 176.7 | 27.4 | -34.8 | 0 | 0 | 0 | 110.7 | ||
| 96 | P | 59.7 | Low | 52.8 | Low | 125 Ų | 125 | 114.9 Ų | 114.9 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54 | 140.8 | 172 | -25.3 | 34.7 | 0 | 0 | 0 | 111.6 | ||
| 97 | G | 60.2 | Low | 53.7 | Low | 64 Ų | 64 | 116.2 Ų | 116.2 | 66% | 0.66 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 152.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 98 | P | 55.6 | Low | 55 | Low | 131 Ų | 131 | 114.1 Ų | 114.1 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 145.8 | 177.5 | 27.4 | -34.8 | 0 | 0 | 0 | 111.2 | ||
| 99 | E | 66.8 | Low | 55.7 | Low | 195 Ų | 195 | 113.4 Ų | 113.4 | 91% | 0.911 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 137.9 | 177.5 | -169 | 170.7 | -165.6 | 0 | 0 | 110.9 | ||
| 100 | G | 57.5 | Low | 56.3 | Low | 57 Ų | 57 | 109.7 Ų | 109.7 | 59% | 0.588 | 77% | 0.765 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 147.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 101 | P | 55 | Low | 57.3 | Low | 123 Ų | 123 | 106.6 Ų | 106.6 | 80% | 0.799 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 141.4 | 178.5 | 26.7 | -34.4 | 0 | 0 | 0 | 110.8 | G103 | P101-G103 PolarHBondContact O-N 3.39Š|
| 102 | P | 65.4 | Low | 57.3 | Low | 129 Ų | 129 | 106.8 Ų | 106.8 | 84% | 0.838 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -54 | 137.1 | 176 | -27.4 | 35.2 | 0 | 0 | 0 | 112.1 | ||
| 103 | G | 56.4 | Low | 57.5 | Low | 63 Ų | 63 | 106.4 Ų | 106.4 | 65% | 0.649 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 150.6 | 178 | 0 | 0 | 0 | 0 | 0 | 112.4 | P101 | P101-G103 PolarHBondContact O-N 3.39Š|
| 104 | P | 53.8 | Low | 58 | Low | 121 Ų | 121 | 107.5 Ų | 107.5 | 79% | 0.786 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -60 | 141.7 | -177.4 | 25.4 | -34.4 | 0 | 0 | 0 | 111.2 | G106 | P104-G106 PolarHBondContact O-N 3.38Š|
| 105 | P | 66.5 | Low | 57.5 | Low | 129 Ų | 129 | 108.2 Ų | 108.2 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 135.8 | 175.7 | -26.3 | 34.8 | 0 | 0 | 0 | 111.9 | ||
| 106 | G | 55.1 | Low | 57.6 | Low | 61 Ų | 61 | 110.4 Ų | 110.4 | 63% | 0.629 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 150.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | P104 | P104-G106 PolarHBondContact O-N 3.38Š|
| 107 | P | 54.3 | Low | 56.9 | Low | 124 Ų | 124 | 107.9 Ų | 107.9 | 81% | 0.805 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 141.4 | -178.8 | 25.5 | -34.4 | 0 | 0 | 0 | 111 | G109 | P107-G109 PolarHBondContact O-N 3.38Š|
| 108 | P | 64 | Low | 56.3 | Low | 128 Ų | 128 | 112.8 Ų | 112.8 | 83% | 0.831 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 136.5 | 175.8 | -26 | 34.8 | 0 | 0 | 0 | 111.9 | ||
| 109 | G | 53.1 | Low | 56.5 | Low | 62 Ų | 62 | 112.4 Ų | 112.4 | 64% | 0.639 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 150.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | P107 | P107-G109 PolarHBondContact O-N 3.38Š|
| 110 | P | 55.3 | Low | 55.7 | Low | 122 Ų | 122 | 106.8 Ų | 106.8 | 79% | 0.792 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 143.6 | -179.3 | 25.8 | -34.5 | 0 | 0 | 0 | 111.1 | G112 | P110-G112 PolarHBondContact O-N 2.96Š|
| 111 | P | 63.1 | Low | 55.5 | Low | 130 Ų | 130 | 107.9 Ų | 107.9 | 84% | 0.844 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 134.9 | 176.3 | -25.7 | 34.7 | 0 | 0 | 0 | 111.9 | ||
| 112 | G | 52.4 | Low | 55.7 | Low | 63 Ų | 63 | 111.5 Ų | 111.5 | 65% | 0.649 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 151.6 | 173 | 0 | 0 | 0 | 0 | 0 | 111.8 | P110 | P110-G112 PolarHBondContact O-N 2.96Š|
| 113 | P | 53.1 | Low | 55.1 | Low | 123 Ų | 123 | 109 Ų | 109 | 80% | 0.799 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -61 | 146.2 | 179.7 | 26.1 | -34.5 | 0 | 0 | 0 | 111.3 | G115 | P113-G115 PolarHBondContact O-N 3.42Š|
| 114 | P | 59.3 | Low | 54.7 | Low | 123 Ų | 123 | 115.5 Ų | 115.5 | 80% | 0.799 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 137.5 | 174.5 | -24 | 34.3 | 0 | 0 | 0 | 111.8 | ||
| 115 | G | 48.6 | Very low | 54.7 | Low | 78 Ų | 78 | 118 Ų | 118 | 80% | 0.804 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 122.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | P113 G117 | P113-G115 PolarHBondContact O-N 3.42Å; G115-G117 VanDerWaalsContact C-N 3.31Å; G115-G117 PolarHBondContact O-N 3.29Å |
| 116 | D | 54.5 | Low | 54.1 | Low | 168 Ų | 168 | 114.6 Ų | 114.6 | 90% | 0.898 | 79% | 0.794 | S | S | * | * | trans | -70.7 | 78.7 | 177.9 | -71.3 | -51.2 | 0 | 0 | 0 | 112.5 | L118 | D116-L118 PolarHBondContact O-N 3.39Š| ||
| 117 | G | 44.3 | Very low | 54 | Low | 71 Ų | 71 | 117.7 Ų | 117.7 | 73% | 0.732 | 80% | 0.803 | S | S | * | * | trans | -79.3 | 101.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | G115 | G115-G117 VanDerWaalsContact C-N 3.31Å; G115-G117 PolarHBondContact O-N 3.29Å | ||
| 118 | L | 48.8 | Very low | 54.5 | Low | 167 Ų | 167 | 118 Ų | 118 | 87% | 0.874 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 134.6 | 171.1 | -71.9 | 173.3 | 0 | 0 | 0 | 111.1 | D116 | D116-L118 PolarHBondContact O-N 3.39Š|
| 119 | P | 58.8 | Low | 53.9 | Low | 123 Ų | 123 | 115.1 Ų | 115.1 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 141.4 | 175 | -24.8 | 34.7 | 0 | 0 | 0 | 112.8 | ||
| 120 | G | 50.9 | Low | 53.6 | Low | 77 Ų | 77 | 118.1 Ų | 118.1 | 79% | 0.794 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 138.8 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 121 | G | 53.1 | Low | 53.6 | Low | 80 Ų | 80 | 118.5 Ų | 118.5 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 152.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 122 | E | 59.9 | Low | 52.8 | Low | 199 Ų | 199 | 116 Ų | 116 | 93% | 0.93 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 141.4 | -178.5 | -62.1 | -176.1 | 123.8 | 0 | 0 | 112.5 | ||
| 123 | G | 52.1 | Low | 52.4 | Low | 78 Ų | 78 | 121.2 Ų | 121.2 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 140.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 124 | Q | 47.8 | Very low | 52.1 | Low | 199 Ų | 199 | 121.4 Ų | 121.4 | 93% | 0.93 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -67.6 | 139.8 | 179.2 | -71.3 | -175.8 | -15.1 | 0 | 0 | 112.4 | ||
| 125 | L | 54 | Low | 51.2 | Low | 174 Ų | 174 | 119.1 Ų | 119.1 | 91% | 0.911 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 129.9 | 177.6 | -168.6 | 72.3 | 0 | 0 | 0 | 111 | ||
| 126 | G | 53.2 | Low | 50.9 | Low | 56 Ų | 56 | 124.2 Ų | 124.2 | 58% | 0.577 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -68 | 149.6 | 178 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 127 | P | 53.2 | Low | 50.3 | Low | 126 Ų | 126 | 119.4 Ų | 119.4 | 82% | 0.818 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -70 | 148.9 | -178.2 | 28.8 | -35.1 | 0 | 0 | 0 | 112.6 | ||
| 128 | P | 64.2 | Low | 50 | Low | 131 Ų | 131 | 125.9 Ų | 125.9 | 85% | 0.851 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 143.4 | 177.7 | -23 | 34.2 | 0 | 0 | 0 | 113.8 | ||
| 129 | G | 51.3 | Low | 49.9 | Very low | 67 Ų | 67 | 126.7 Ų | 126.7 | 69% | 0.691 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -74 | 154.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 130 | P | 48.4 | Very low | 48.9 | Very low | 125 Ų | 125 | 124.1 Ų | 124.1 | 81% | 0.812 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -73.8 | 152.7 | -176.9 | 30.3 | -35.7 | 0 | 0 | 0 | 113.3 | ||
| 131 | P | 55.5 | Low | 48.7 | Very low | 131 Ų | 131 | 128.6 Ų | 128.6 | 85% | 0.851 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -65 | 145.8 | 177.1 | -21.4 | 33.8 | 0 | 0 | 0 | 113.9 | ||
| 132 | G | 45.6 | Very low | 48.5 | Very low | 77 Ų | 77 | 130.8 Ų | 130.8 | 79% | 0.794 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -83.6 | 153.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 133 | L | 43.3 | Very low | 48 | Very low | 173 Ų | 173 | 124.9 Ų | 124.9 | 91% | 0.906 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -84.8 | 145.2 | 176 | -75.4 | 161.5 | 0 | 0 | 0 | 112.2 | ||
| 134 | P | 47.5 | Very low | 48.2 | Very low | 127 Ų | 127 | 127.7 Ų | 127.7 | 83% | 0.825 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 142.7 | 175.6 | 31.6 | -34.4 | 0 | 0 | 0 | 111.8 | ||
| 135 | G | 40.9 | Very low | 48.9 | Very low | 74 Ų | 74 | 124 Ų | 124 | 76% | 0.763 | 82% | 0.816 | S | S | * | * | trans | -118.3 | 176.1 | -173.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 136 | I | 41.8 | Very low | 48.7 | Very low | 185 Ų | 185 | 119.2 Ų | 119.2 | 95% | 0.949 | 81% | 0.808 | S | S | * | * | trans | -142.1 | 138.5 | 176 | -58.7 | 178 | 0 | 0 | 0 | 108.7 | ||||
| 137 | G | 40.9 | Very low | 48.7 | Very low | 68 Ų | 68 | 126.1 Ų | 126.1 | 70% | 0.701 | 82% | 0.822 | S | S | * | * | trans | 123.3 | 76.3 | 151.6 | 0 | 0 | 0 | 0 | 0 | 120.3 | ||||
| 138 | K | 38.9 | Very low | 49.1 | Very low | 206 Ų | 206 | 126 Ų | 126 | 90% | 0.896 | 82% | 0.821 | S | S | * | * | trans | 56.1 | 99.2 | 146.6 | -64.4 | -174.1 | 176.2 | -178.5 | 0 | 121.1 | ||||
| 139 | L | 46.3 | Very low | 48.4 | Very low | 185 Ų | 185 | 123 Ų | 123 | 97% | 0.969 | 81% | 0.814 | S | S | * | * | 46.1 | 118.5 | 124.6 | -155.8 | 79.8 | 0 | 0 | 0 | 120.9 | |||||
| 140 | G | 38.8 | Very low | 48.3 | Very low | 69 Ų | 69 | 126.9 Ų | 126.9 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | -168.4 | 116.4 | 160.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 141 | L | 45.9 | Very low | 48.7 | Very low | 170 Ų | 170 | 128.6 Ų | 128.6 | 89% | 0.89 | 83% | 0.825 | S | S | * | * | trans | 58.8 | 144.7 | 168.2 | -68.2 | 162.7 | 0 | 0 | 0 | 119.1 | G143 | L141-G143 PolarHBondContact O-N 3.22Š| ||
| 142 | P | 49 | Very low | 48.5 | Very low | 126 Ų | 126 | 125.3 Ų | 125.3 | 82% | 0.818 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 126.8 | 172.2 | -20.1 | 33.3 | 0 | 0 | 0 | 112.2 | ||
| 143 | G | 49.5 | Very low | 49 | Very low | 75 Ų | 75 | 130.7 Ų | 130.7 | 77% | 0.773 | 82% | 0.82 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 136.1 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | L141 | L141-G143 PolarHBondContact O-N 3.22Š|
| 144 | V | 56.7 | Low | 50 | Low | 138 Ų | 138 | 128.3 Ų | 128.3 | 84% | 0.836 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 140 | 172.5 | -148.9 | 0 | 0 | 0 | 0 | 109.5 | G146 | V144-G146 PolarHBondContact O-N 3.14Š|
| 145 | P | 62.2 | Low | 50.3 | Low | 121 Ų | 121 | 125.3 Ų | 125.3 | 79% | 0.786 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -51 | 134.2 | 179.1 | -31 | 36.8 | 0 | 0 | 0 | 113.2 | ||
| 146 | G | 50.6 | Low | 51 | Low | 73 Ų | 73 | 128 Ų | 128 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -59.1 | 137.5 | -174.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | V144 | V144-G146 PolarHBondContact O-N 3.14Š|
| 147 | K | 52 | Low | 51.7 | Low | 201 Ų | 201 | 128 Ų | 128 | 87% | 0.874 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.5 | 137.3 | 173 | -62.8 | -176.8 | -179.1 | -178.4 | 0 | 109.2 | ||
| 148 | P | 61.3 | Low | 52.4 | Low | 124 Ų | 124 | 127.9 Ų | 127.9 | 81% | 0.805 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 144.5 | 169.1 | -26.5 | 35.2 | 0 | 0 | 0 | 111 | ||
| 149 | G | 49.7 | Very low | 52.9 | Low | 68 Ų | 68 | 128.1 Ų | 128.1 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 143.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.1 | I151 | G149-I151 PolarHBondContact O-N 3.17Å; G149-I151 VanDerWaalsContact O-N 3.16Å |
| 150 | V | 50.4 | Low | 53.2 | Low | 148 Ų | 148 | 128 Ų | 128 | 90% | 0.897 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 122.1 | 173.7 | -93.8 | 0 | 0 | 0 | 0 | 109.4 | G152 | V150-G152 PolarHBondContact O-N 2.97Š|
| 151 | I | 56.5 | Low | 54 | Low | 162 Ų | 162 | 127 Ų | 127 | 83% | 0.831 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 127.1 | 165 | -59.6 | 173.9 | 0 | 0 | 0 | 106 | G149 | G149-I151 PolarHBondContact O-N 3.17Å; G149-I151 VanDerWaalsContact O-N 3.16Å |
| 152 | G | 51.2 | Low | 54.2 | Low | 62 Ų | 62 | 125.1 Ų | 125.1 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 144.4 | 177.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | V150 | V150-G152 PolarHBondContact O-N 2.97Š|
| 153 | E | 56 | Low | 54.8 | Low | 190 Ų | 190 | 128.7 Ų | 128.7 | 89% | 0.888 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 135.3 | -177 | -64.3 | -164.8 | 138.1 | 0 | 0 | 110.8 | G155 | E153-G155 PolarHBondContact O-N 3.1Š|
| 154 | P | 63.7 | Low | 54.8 | Low | 123 Ų | 123 | 128.1 Ų | 128.1 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 127.3 | 175.9 | -26.4 | 34.9 | 0 | 0 | 0 | 110.4 | ||
| 155 | G | 54.4 | Low | 54.8 | Low | 64 Ų | 64 | 130.8 Ų | 130.8 | 66% | 0.66 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 139.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | E153 Q157 | E153-G155 PolarHBondContact O-N 3.1Å; G155-Q157 PolarHBondContact O-N 3.43Å; G155-Q157 VanDerWaalsContact O-N 3.15Å |
| 156 | P | 54.3 | Low | 54.6 | Low | 130 Ų | 130 | 132.6 Ų | 132.6 | 84% | 0.844 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 123.4 | -166.6 | 20.5 | -33.2 | 0 | 0 | 0 | 110.8 | G158 | P156-G158 PolarHBondContact O-N 3.22Š|
| 157 | Q | 58 | Low | 54.6 | Low | 186 Ų | 186 | 131.8 Ų | 131.8 | 87% | 0.869 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 126.7 | -173.6 | -178.2 | 176.7 | -10.3 | 0 | 0 | 110.4 | G155 K159 | G155-Q157 PolarHBondContact O-N 3.43Å; G155-Q157 VanDerWaalsContact O-N 3.15Å; Q157-K159 PolarHBondContact O-N 3.33Å |
| 158 | G | 54.3 | Low | 54.6 | Low | 65 Ų | 65 | 128.2 Ų | 128.2 | 67% | 0.67 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -50.4 | 127.8 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | P156 M160 | P156-G158 PolarHBondContact O-N 3.22Å; G158-M160 PolarHBondContact O-N 3.17Å; G158-M160 VanDerWaalsContact O-N 3.09Å |
| 159 | K | 49.4 | Very low | 54.8 | Low | 211 Ų | 211 | 128.9 Ų | 128.9 | 92% | 0.917 | 78% | 0.775 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 118.9 | -175.8 | -50.6 | 178.9 | -168.3 | 177.6 | 0 | 108.4 | Q157 G161 | Q157-K159 PolarHBondContact O-N 3.33Å; K159-G161 PolarHBondContact O-N 2.88Å |
| 160 | M | 53.5 | Low | 54.5 | Low | 181 Ų | 181 | 128.7 Ų | 128.7 | 89% | 0.892 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 126 | 176.1 | -176.8 | 166.3 | 63.6 | 0 | 0 | 108.4 | G158 | G158-M160 PolarHBondContact O-N 3.17Å; G158-M160 VanDerWaalsContact O-N 3.09Å |
| 161 | G | 54.5 | Low | 54.4 | Low | 49 Ų | 49 | 130.6 Ų | 130.6 | 51% | 0.505 | 77% | 0.771 | S | S | . | * | P | Polyproline II helix | trans | -56.3 | 150.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | K159 R163 | K159-G161 PolarHBondContact O-N 2.88Å; G161-R163 PolarHBondContact O-N 3.21Å |
| 162 | P | 51.6 | Low | 55.1 | Low | 131 Ų | 131 | 128.8 Ų | 128.8 | 85% | 0.851 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 127.6 | 178.5 | 23.9 | -33.3 | 0 | 0 | 0 | 109.4 | G164 | P162-G164 PolarHBondContact O-N 3.06Å; P162-G164 VanDerWaalsContact O-N 3.15Å |
| 163 | R | 61.1 | Low | 55 | Low | 200 Ų | 200 | 128.8 Ų | 128.8 | 76% | 0.755 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 122.9 | 172.5 | 173.3 | 178.6 | 168.7 | -170.6 | -7.8 | 107 | G161 E165 E166 | G161-R163 PolarHBondContact O-N 3.21Å; R163-E165 PolarHBondContact O-N 3.08Å; R163-E166 IonicContact NH2-OE1 2.71Å; R163-E166 PolarHBondContact NH2-OE1 3.45Å |
| 164 | G | 50.4 | Low | 54.9 | Low | 63 Ų | 63 | 126 Ų | 126 | 65% | 0.649 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 137.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | P162 | P162-G164 PolarHBondContact O-N 3.06Å; P162-G164 VanDerWaalsContact O-N 3.15Å |
| 165 | E | 55 | Low | 55.1 | Low | 195 Ų | 195 | 128.5 Ų | 128.5 | 91% | 0.911 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 140 | -174.9 | -63 | -173.6 | 152 | 0 | 0 | 110.5 | R163 G167 | R163-E165 PolarHBondContact O-N 3.08Å; E165-G167 PolarHBondContact O-N 2.97Å |
| 166 | E | 59.3 | Low | 54.9 | Low | 158 Ų | 158 | 127.9 Ų | 127.9 | 74% | 0.738 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 120 | -177.9 | -166 | 148.3 | -119.5 | 0 | 0 | 108.5 | R163 | R163-E166 IonicContact NH2-OE1 2.71Å; R163-E166 PolarHBondContact NH2-OE1 3.45Å |
| 167 | G | 49.8 | Very low | 54.7 | Low | 56 Ų | 56 | 127.9 Ų | 127.9 | 58% | 0.577 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 138.8 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111 | E165 T169 | E165-G167 PolarHBondContact O-N 2.97Å; G167-T169 PolarHBondContact O-N 3.49Å |
| 168 | P | 51.8 | Low | 55.2 | Low | 127 Ų | 127 | 124.1 Ų | 124.1 | 83% | 0.825 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 128.5 | -171.4 | 23 | -33.9 | 0 | 0 | 0 | 110.3 | G170 | P168-G170 PolarHBondContact O-N 3.34Š|
| 169 | T | 65.4 | Low | 55 | Low | 138 Ų | 138 | 123.9 Ų | 123.9 | 85% | 0.847 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 124.7 | 179.4 | -48.3 | 0 | 0 | 0 | 0 | 109.3 | G167 Q171 | G167-T169 PolarHBondContact O-N 3.49Å; T169-Q171 PolarHBondContact O-N 3.31Å |
| 170 | G | 44.8 | Very low | 55.1 | Low | 64 Ų | 64 | 119.6 Ų | 119.6 | 66% | 0.66 | 75% | 0.749 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 131.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | P168 | P168-G170 PolarHBondContact O-N 3.34Š|
| 171 | Q | 48.2 | Very low | 55.1 | Low | 187 Ų | 187 | 117.2 Ų | 117.2 | 87% | 0.874 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 132.8 | -178.9 | -65 | -175.6 | 9.7 | 0 | 0 | 109 | T169 G173 | T169-Q171 PolarHBondContact O-N 3.31Å; Q171-G173 PolarHBondContact O-N 3.05Å |
| 172 | P | 70.3 | Confident | 54.5 | Low | 125 Ų | 125 | 118.3 Ų | 118.3 | 81% | 0.812 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -52.6 | 134.5 | 172.2 | -26.1 | 34.8 | 0 | 0 | 0 | 110 | ||
| 173 | G | 49.4 | Very low | 54.2 | Low | 61 Ų | 61 | 120 Ų | 120 | 63% | 0.629 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 144.8 | 177.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q171 Q175 | Q171-G173 PolarHBondContact O-N 3.05Å; G173-Q175 PolarHBondContact O-N 3.18Å; G173-Q175 VanDerWaalsContact O-N 3.14Å |
| 174 | P | 54.3 | Low | 53.5 | Low | 131 Ų | 131 | 116.9 Ų | 116.9 | 85% | 0.851 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 123.7 | -175.7 | 23.1 | -33.5 | 0 | 0 | 0 | 109.9 | G176 | P174-G176 PolarHBondContact O-N 2.81Å; P174-G176 VanDerWaalsContact O-N 3.17Å |
| 175 | Q | 66.3 | Low | 53 | Low | 177 Ų | 177 | 117.1 Ų | 117.1 | 83% | 0.827 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 123.9 | 179.5 | -178.8 | 177.2 | -11.9 | 0 | 0 | 109 | G173 | G173-Q175 PolarHBondContact O-N 3.18Å; G173-Q175 VanDerWaalsContact O-N 3.14Å |
| 176 | G | 52.2 | Low | 52.8 | Low | 50 Ų | 50 | 116.9 Ų | 116.9 | 52% | 0.515 | 77% | 0.77 | S | S | . | * | P | Polyproline II helix | trans | -53.8 | 145.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | P174 S178 | P174-G176 PolarHBondContact O-N 2.81Å; P174-G176 VanDerWaalsContact O-N 3.17Å; G176-S178 PolarHBondContact O-N 3.02Å |
| 177 | P | 50.2 | Low | 51.9 | Low | 131 Ų | 131 | 112.5 Ų | 112.5 | 85% | 0.851 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 126.9 | -174.1 | 23.1 | -33.8 | 0 | 0 | 0 | 110.5 | G179 | P177-G179 PolarHBondContact O-N 3.41Š|
| 178 | S | 67.8 | Low | 51.9 | Low | 107 Ų | 107 | 119.6 Ų | 119.6 | 75% | 0.748 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 125.6 | 179.5 | -63 | 0 | 0 | 0 | 0 | 110.4 | G176 | G176-S178 PolarHBondContact O-N 3.02Š|
| 179 | G | 50.1 | Low | 51.7 | Low | 60 Ų | 60 | 120 Ų | 120 | 62% | 0.619 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 145.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | P177 | P177-G179 PolarHBondContact O-N 3.41Š|
| 180 | P | 50.7 | Low | 50.9 | Low | 121 Ų | 121 | 116.9 Ų | 116.9 | 79% | 0.786 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 139.6 | -176.2 | 23.9 | -33.9 | 0 | 0 | 0 | 110.8 | G182 | P180-G182 PolarHBondContact O-N 3.09Š|
| 181 | P | 55.1 | Low | 51.1 | Low | 131 Ų | 131 | 123 Ų | 123 | 85% | 0.851 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 124.5 | -178.5 | -28.2 | 35.5 | 0 | 0 | 0 | 112.3 | L183 | P181-L183 PolarHBondContact O-N 2.78Š|
| 182 | G | 41.7 | Very low | 51.3 | Low | 71 Ų | 71 | 123.2 Ų | 123.2 | 73% | 0.732 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 135.6 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | P180 | P180-G182 PolarHBondContact O-N 3.09Š|
| 183 | L | 44.7 | Very low | 50.4 | Low | 167 Ų | 167 | 120.2 Ų | 120.2 | 87% | 0.874 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 137.1 | 174.4 | -74 | 162.4 | 0 | 0 | 0 | 110.3 | P181 G185 | P181-L183 PolarHBondContact O-N 2.78Å; L183-G185 PolarHBondContact O-N 3.25Å |
| 184 | P | 46.7 | Very low | 50.6 | Low | 135 Ų | 135 | 125.3 Ų | 125.3 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | trans | -72 | 86.3 | -176.1 | 28.5 | -34.9 | 0 | 0 | 0 | 111.9 | ||||
| 185 | G | 38.6 | Very low | 50.9 | Low | 68 Ų | 68 | 124.8 Ų | 124.8 | 70% | 0.701 | 80% | 0.795 | S | S | * | * | trans | -92.9 | 133.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L183 G187 | L183-G185 PolarHBondContact O-N 3.25Å; G185-G187 PolarHBondContact O-N 3.06Å | ||
| 186 | I | 52.3 | Low | 50.2 | Low | 189 Ų | 189 | 119.8 Ų | 119.8 | 97% | 0.969 | 79% | 0.791 | S | S | * | * | trans | -74.3 | 113.5 | -177 | -62.8 | 167.4 | 0 | 0 | 0 | 110.3 | ||||
| 187 | G | 40.4 | Very low | 50.3 | Low | 67 Ų | 67 | 126.1 Ų | 126.1 | 69% | 0.691 | 81% | 0.807 | S | S | * | * | trans | -133.1 | 148.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | G185 | G185-G187 PolarHBondContact O-N 3.06Š| ||
| 188 | K | 48.1 | Very low | 51 | Low | 204 Ų | 204 | 125.8 Ų | 125.8 | 89% | 0.887 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -77 | 153.1 | -174.3 | -64 | 175.2 | -176.7 | 173.6 | 0 | 111.8 | G190 | K188-G190 PolarHBondContact O-N 3.16Š|
| 189 | P | 48.9 | Very low | 50.2 | Low | 135 Ų | 135 | 124.1 Ų | 124.1 | 88% | 0.877 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 121.1 | 177.6 | -24.1 | 34.4 | 0 | 0 | 0 | 112.6 | ||
| 190 | G | 48.2 | Very low | 50.6 | Low | 73 Ų | 73 | 125 Ų | 125 | 75% | 0.753 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 153.3 | 168 | 0 | 0 | 0 | 0 | 0 | 111.5 | K188 | K188-G190 PolarHBondContact O-N 3.16Š|
| 191 | M | 50.1 | Low | 51.1 | Low | 192 Ų | 192 | 129 Ų | 129 | 95% | 0.946 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -65.6 | 147.7 | -179.3 | -67 | 174 | 65.5 | 0 | 0 | 111.8 | G193 | M191-G193 PolarHBondContact O-N 3.42Š|
| 192 | Q | 52.2 | Low | 51 | Low | 193 Ų | 193 | 125.8 Ų | 125.8 | 90% | 0.902 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 118.9 | 177.4 | -177.3 | 176.8 | 2.2 | 0 | 0 | 110.7 | ||
| 193 | G | 51.2 | Low | 51.6 | Low | 61 Ų | 61 | 130.1 Ų | 130.1 | 63% | 0.629 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -63 | 145.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | M191 | M191-G193 PolarHBondContact O-N 3.42Š|
| 194 | L | 52.6 | Low | 52.7 | Low | 168 Ų | 168 | 128 Ų | 128 | 88% | 0.88 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 143.5 | 174.5 | -71.3 | 167.9 | 0 | 0 | 0 | 110.5 | G196 | L194-G196 PolarHBondContact O-N 3.18Š|
| 195 | P | 62.1 | Low | 53 | Low | 120 Ų | 120 | 125 Ų | 125 | 78% | 0.779 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 128.5 | 173.5 | -24.6 | 34.3 | 0 | 0 | 0 | 111 | Q197 | P195-Q197 PolarHBondContact O-N 3.02Š|
| 196 | G | 50.3 | Low | 53.6 | Low | 73 Ų | 73 | 129.9 Ų | 129.9 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 135.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | L194 | L194-G196 PolarHBondContact O-N 3.18Š|
| 197 | Q | 54.3 | Low | 54.1 | Low | 182 Ų | 182 | 130.5 Ų | 130.5 | 85% | 0.85 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 139.7 | 176.4 | -67.2 | -172.8 | 5.2 | 0 | 0 | 109.9 | P195 G199 | P195-Q197 PolarHBondContact O-N 3.02Å; Q197-G199 PolarHBondContact O-N 3.37Å |
| 198 | P | 65.4 | Low | 54.7 | Low | 124 Ų | 124 | 130.8 Ų | 130.8 | 81% | 0.805 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 129.3 | 172.7 | -25.6 | 34.8 | 0 | 0 | 0 | 110.6 | G200 | P198-G200 PolarHBondContact O-N 2.96Š|
| 199 | G | 51 | Low | 54.9 | Low | 72 Ų | 72 | 129 Ų | 129 | 74% | 0.742 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 136.6 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q197 K201 | Q197-G199 PolarHBondContact O-N 3.37Å; G199-K201 PolarHBondContact O-N 3.14Å |
| 200 | G | 57.9 | Low | 55.8 | Low | 78 Ų | 78 | 128.2 Ų | 128.2 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 130.1 | -178 | 0 | 0 | 0 | 0 | 0 | 111.5 | P198 G202 | P198-G200 PolarHBondContact O-N 2.96Å; G200-G202 PolarHBondContact O-N 3.23Å; G200-G202 VanDerWaalsContact O-N 3.09Å |
| 201 | K | 62.3 | Low | 56 | Low | 205 Ų | 205 | 128.3 Ų | 128.3 | 89% | 0.891 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -59 | 116.4 | 176.9 | -178.8 | -178 | 179.3 | -178.6 | 0 | 108.8 | G199 | G199-K201 PolarHBondContact O-N 3.14Š|
| 202 | G | 53.2 | Low | 56 | Low | 64 Ų | 64 | 127.2 Ų | 127.2 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -50.5 | 138.5 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | G200 | G200-G202 PolarHBondContact O-N 3.23Å; G200-G202 VanDerWaalsContact O-N 3.09Å |
| 203 | E | 53.6 | Low | 56.6 | Low | 163 Ų | 163 | 123.5 Ų | 123.5 | 76% | 0.762 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 138.8 | -173.8 | -61 | -163.6 | 137.6 | 0 | 0 | 111.4 | G205 | E203-G205 PolarHBondContact O-N 3.24Å; E203-G205 VanDerWaalsContact O-N 3.09Å |
| 204 | P | 67.6 | Low | 56.5 | Low | 121 Ų | 121 | 124.1 Ų | 124.1 | 79% | 0.786 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 116.4 | 173.1 | -21.9 | 33.5 | 0 | 0 | 0 | 110.1 | H206 | P204-H206 PolarHBondContact O-N 3.15Š|
| 205 | G | 53.9 | Low | 56.3 | Low | 72 Ų | 72 | 124 Ų | 124 | 74% | 0.742 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -49 | 133 | -175 | 0 | 0 | 0 | 0 | 0 | 112.8 | E203 K207 | E203-G205 PolarHBondContact O-N 3.24Å; E203-G205 VanDerWaalsContact O-N 3.09Å; G205-K207 PolarHBondContact O-N 3.18Å |
| 206 | H | 50.3 | Low | 56.3 | Low | 171 Ų | 171 | 124 Ų | 124 | 79% | 0.792 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 127.1 | -170 | -50.5 | -64.1 | 0 | 0 | 0 | 111.7 | P204 G208 | P204-H206 PolarHBondContact O-N 3.15Å; H206-G208 PolarHBondContact O-N 3.44Å |
| 207 | K | 62.7 | Low | 56.3 | Low | 202 Ų | 202 | 123.8 Ų | 123.8 | 88% | 0.878 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 131.5 | 167.6 | -75.3 | -175.6 | 175.7 | -179.8 | 0 | 108.7 | G205 | G205-K207 PolarHBondContact O-N 3.18Š|
| 208 | G | 53 | Low | 56.3 | Low | 73 Ų | 73 | 121.4 Ų | 121.4 | 75% | 0.753 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 140.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | H206 | H206-G208 PolarHBondContact O-N 3.44Š|
| 209 | L | 53.1 | Low | 55.6 | Low | 167 Ų | 167 | 124.7 Ų | 124.7 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 137 | -177.5 | -66.7 | 171.2 | 0 | 0 | 0 | 110.8 | ||
| 210 | P | 66.9 | Low | 55.7 | Low | 119 Ų | 119 | 124.9 Ų | 124.9 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 141.6 | 170.3 | -24.3 | 34.4 | 0 | 0 | 0 | 111.1 | L212 | P210-L212 PolarHBondContact O-N 3.48Š|
| 211 | G | 51.8 | Low | 55.1 | Low | 74 Ų | 74 | 128.9 Ų | 128.9 | 76% | 0.763 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 133.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 212 | L | 51.1 | Low | 54.5 | Low | 169 Ų | 169 | 129.2 Ų | 129.2 | 89% | 0.885 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 130.3 | -178.3 | -75.3 | 165.5 | 0 | 0 | 0 | 110.9 | P210 | P210-L212 PolarHBondContact O-N 3.48Š|
| 213 | P | 64.3 | Low | 53.9 | Low | 115 Ų | 115 | 129.8 Ų | 129.8 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 139.9 | 172.7 | -25.5 | 34.9 | 0 | 0 | 0 | 111.6 | L215 | P213-L215 PolarHBondContact O-N 2.75Š|
| 214 | G | 50.1 | Low | 53.2 | Low | 74 Ų | 74 | 131.4 Ų | 131.4 | 76% | 0.763 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 131.4 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 215 | L | 48.1 | Very low | 51.8 | Low | 167 Ų | 167 | 129.3 Ų | 129.3 | 87% | 0.874 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 128.7 | -177.5 | -69.6 | 171.4 | 0 | 0 | 0 | 111.1 | P213 G217 | P213-L215 PolarHBondContact O-N 2.75Å; L215-G217 PolarHBondContact O-N 3.12Å |
| 216 | P | 62 | Low | 51.1 | Low | 120 Ų | 120 | 134 Ų | 134 | 78% | 0.779 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 135.6 | 173.1 | -25.6 | 35.1 | 0 | 0 | 0 | 111.6 | ||
| 217 | G | 50.7 | Low | 51 | Low | 67 Ų | 67 | 132.2 Ų | 132.2 | 69% | 0.691 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 136 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | L215 K219 | L215-G217 PolarHBondContact O-N 3.12Å; G217-K219 PolarHBondContact O-N 3.25Å |
| 218 | P | 52.9 | Low | 50.1 | Low | 132 Ų | 132 | 126 Ų | 126 | 86% | 0.857 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 124.6 | -174.8 | 25.8 | -34.1 | 0 | 0 | 0 | 111.4 | G220 | P218-G220 PolarHBondContact O-N 2.68Š|
| 219 | K | 51.9 | Low | 49.8 | Very low | 194 Ų | 194 | 131.5 Ų | 131.5 | 84% | 0.843 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 126 | 170.3 | -175 | 178.6 | 177.9 | -177 | 0 | 108.5 | G217 D221 | G217-K219 PolarHBondContact O-N 3.25Å; K219-D221 PolarHBondContact O-N 3.09Å |
| 220 | G | 52.1 | Low | 50.2 | Low | 75 Ų | 75 | 129.9 Ų | 129.9 | 77% | 0.773 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 121.1 | -172.5 | 0 | 0 | 0 | 0 | 0 | 113.7 | P218 | P218-G220 PolarHBondContact O-N 2.68Š|
| 221 | D | 45.5 | Very low | 49.3 | Very low | 162 Ų | 162 | 127.6 Ų | 127.6 | 87% | 0.866 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 154 | 171.5 | -76.9 | -47.3 | 0 | 0 | 0 | 112.6 | K219 | K219-D221 PolarHBondContact O-N 3.09Š|
| 222 | K | 50.6 | Low | 49.1 | Very low | 212 Ų | 212 | 133.4 Ų | 133.4 | 92% | 0.922 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 124.4 | -176.2 | -68.2 | 176.9 | 177.9 | 176.4 | 0 | 110.8 | ||
| 223 | G | 39.8 | Very low | 49.4 | Very low | 76 Ų | 76 | 135.1 Ų | 135.1 | 78% | 0.784 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -76.8 | 150.5 | -178 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 224 | M | 38.9 | Very low | 48.7 | Very low | 197 Ų | 197 | 132.7 Ų | 132.7 | 97% | 0.97 | 83% | 0.825 | S | S | * | * | trans | -117.5 | 130.7 | 148 | -68.3 | -165.5 | -66.5 | 0 | 0 | 107.1 | ||||
| 225 | G | 38.5 | Very low | 48.6 | Very low | 77 Ų | 77 | 137.3 Ų | 137.3 | 79% | 0.794 | 83% | 0.832 | S | S | * | * | trans | -106.3 | 144.6 | -163.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 226 | L | 38.9 | Very low | 49.6 | Very low | 171 Ų | 171 | 135 Ų | 135 | 90% | 0.895 | 83% | 0.827 | S | S | * | * | trans | -120.3 | 136.2 | 152.2 | -73.5 | 170.8 | 0 | 0 | 0 | 107.5 | G228 | L226-G228 PolarHBondContact O-N 3.42Å; L226-G228 VanDerWaalsContact O-N 3.14Å | ||
| 227 | P | 49.3 | Very low | 49.4 | Very low | 134 Ų | 134 | 132.1 Ų | 132.1 | 87% | 0.87 | 82% | 0.819 | S | S | * | * | trans | -66.7 | 113.2 | -175.5 | -22.6 | 34.6 | 0 | 0 | 0 | 112.9 | ||||
| 228 | G | 43.3 | Very low | 49.6 | Very low | 70 Ų | 70 | 134.8 Ų | 134.8 | 72% | 0.722 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 154.2 | 167 | 0 | 0 | 0 | 0 | 0 | 111.9 | L226 | L226-G228 PolarHBondContact O-N 3.42Å; L226-G228 VanDerWaalsContact O-N 3.14Å |
| 229 | Q | 45.8 | Very low | 50.3 | Low | 189 Ų | 189 | 134.6 Ų | 134.6 | 88% | 0.883 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 148.5 | 179.3 | -64.3 | 179.5 | 1.1 | 0 | 0 | 111.7 | G231 | Q229-G231 PolarHBondContact O-N 2.83Å; Q229-G231 VanDerWaalsContact O-N 3.16Å |
| 230 | P | 60.9 | Low | 50.6 | Low | 133 Ų | 133 | 128.4 Ų | 128.4 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 117.9 | 176.8 | -24 | 34.6 | 0 | 0 | 0 | 112.1 | ||
| 231 | G | 48.2 | Very low | 50.8 | Low | 71 Ų | 71 | 131.1 Ų | 131.1 | 73% | 0.732 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -64.7 | 148.2 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q229 K233 | Q229-G231 PolarHBondContact O-N 2.83Å; Q229-G231 VanDerWaalsContact O-N 3.16Å; G231-K233 PolarHBondContact O-N 3.39Å |
| 232 | H | 47.9 | Very low | 51.4 | Low | 196 Ų | 196 | 128.3 Ų | 128.3 | 91% | 0.907 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -58.4 | 128.3 | 178.2 | -71.1 | -88.1 | 0 | 0 | 0 | 111.3 | G234 | H232-G234 PolarHBondContact O-N 2.81Š|
| 233 | K | 57.2 | Low | 51.7 | Low | 206 Ų | 206 | 121.3 Ų | 121.3 | 90% | 0.896 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -66.1 | 123.6 | 178.2 | -161.2 | 173.7 | -173.5 | 177.3 | 0 | 109.1 | G231 | G231-K233 PolarHBondContact O-N 3.39Š|
| 234 | G | 50.4 | Low | 52.2 | Low | 63 Ų | 63 | 124.2 Ų | 124.2 | 65% | 0.649 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -56.3 | 145.4 | -180 | 0 | 0 | 0 | 0 | 0 | 112.3 | H232 | H232-G234 PolarHBondContact O-N 2.81Š|
| 235 | L | 48.3 | Very low | 52.9 | Low | 171 Ų | 171 | 126.4 Ų | 126.4 | 90% | 0.895 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 132.5 | 176.7 | -70.9 | 170.3 | 0 | 0 | 0 | 110.1 | ||
| 236 | P | 67.9 | Low | 53.2 | Low | 119 Ų | 119 | 125.8 Ų | 125.8 | 77% | 0.773 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 141 | 171.9 | -23.5 | 34.1 | 0 | 0 | 0 | 111.1 | ||
| 237 | G | 58.6 | Low | 53.6 | Low | 60 Ų | 60 | 125.9 Ų | 125.9 | 62% | 0.619 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 150 | 171.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 238 | P | 54.6 | Low | 53.6 | Low | 123 Ų | 123 | 125.4 Ų | 125.4 | 80% | 0.799 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -59 | 138.1 | -179.2 | 24.8 | -34 | 0 | 0 | 0 | 110.8 | G240 | P238-G240 PolarHBondContact O-N 2.88Š|
| 239 | P | 67.6 | Low | 53.4 | Low | 127 Ų | 127 | 125.7 Ų | 125.7 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -57 | 137.3 | 177 | -25.6 | 34.8 | 0 | 0 | 0 | 112.1 | ||
| 240 | G | 57.8 | Low | 53.4 | Low | 65 Ų | 65 | 126.6 Ų | 126.6 | 67% | 0.67 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 150 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | P238 | P238-G240 PolarHBondContact O-N 2.88Š|
| 241 | P | 56.7 | Low | 52.2 | Low | 132 Ų | 132 | 123.9 Ų | 123.9 | 86% | 0.857 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 138.9 | -178.6 | 25.4 | -34.3 | 0 | 0 | 0 | 111.4 | G243 | P241-G243 PolarHBondContact O-N 3.47Š|
| 242 | A | 58.8 | Low | 52 | Low | 102 Ų | 102 | 129.6 Ų | 129.6 | 84% | 0.843 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 132.2 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 243 | G | 56 | Low | 51.8 | Low | 65 Ų | 65 | 126.8 Ų | 126.8 | 67% | 0.67 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 151.7 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | P241 R245 | P241-G243 PolarHBondContact O-N 3.47Å; G243-R245 PolarHBondContact O-N 3.12Å |
| 244 | P | 51.6 | Low | 50.9 | Low | 137 Ų | 137 | 120.5 Ų | 120.5 | 89% | 0.89 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -63.3 | 133.7 | -177.3 | 25.8 | -34.2 | 0 | 0 | 0 | 112 | ||
| 245 | R | 53.8 | Low | 50.9 | Low | 243 Ų | 243 | 125.6 Ų | 125.6 | 92% | 0.917 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 127 | -177.4 | -176.8 | 175.8 | 179.1 | 167.8 | -0.2 | 111.3 | G243 | G243-R245 PolarHBondContact O-N 3.12Š|
| 246 | G | 44.6 | Very low | 50.4 | Low | 64 Ų | 64 | 125.6 Ų | 125.6 | 66% | 0.66 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -65.1 | 151.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 247 | L | 47.6 | Very low | 49 | Very low | 174 Ų | 174 | 123.3 Ų | 123.3 | 91% | 0.911 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -78.9 | 130.2 | -179.9 | -71.3 | 164.8 | 0 | 0 | 0 | 112.1 | ||
| 248 | P | 48 | Very low | 48.6 | Very low | 123 Ų | 123 | 129.1 Ų | 129.1 | 80% | 0.799 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 157.2 | 169.8 | -20.9 | 34.6 | 0 | 0 | 0 | 113.9 | ||
| 249 | G | 39.5 | Very low | 48.2 | Very low | 76 Ų | 76 | 129 Ų | 129 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | -85.8 | -176.4 | -170.4 | 0 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 250 | F | 44.7 | Very low | 47.2 | Very low | 209 Ų | 209 | 126.3 Ų | 126.3 | 92% | 0.917 | 82% | 0.818 | S | S | * | * | trans | -79.1 | 155.7 | -165.9 | -96 | -114.1 | 0 | 0 | 0 | 116.9 | ||||
| 251 | G | 37.2 | Very low | 46.8 | Very low | 76 Ų | 76 | 129.8 Ų | 129.8 | 78% | 0.784 | 83% | 0.829 | S | S | * | * | trans | -161.3 | 123.4 | 159.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 252 | K | 42.7 | Very low | 46.7 | Very low | 190 Ų | 190 | 132.6 Ų | 132.6 | 83% | 0.826 | 83% | 0.831 | S | S | * | * | trans | -142.4 | 149.4 | 168.9 | -71.5 | -174.9 | 179.3 | -178.5 | 0 | 105.9 | ||||
| 253 | P | 45.6 | Very low | 46.4 | Very low | 137 Ų | 137 | 130.6 Ų | 130.6 | 89% | 0.89 | 82% | 0.82 | S | S | * | * | cis | -131.2 | -171.3 | 41.5 | 35.7 | -14.7 | 0 | 0 | 0 | 113.3 | ||||
| 254 | G | 37.6 | Very low | 46.4 | Very low | 75 Ų | 75 | 133 Ų | 133 | 77% | 0.773 | 82% | 0.824 | S | S | * | * | cis | -156.2 | -164.1 | 8.3 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 255 | L | 49.7 | Very low | 47 | Very low | 169 Ų | 169 | 132 Ų | 132 | 89% | 0.885 | 82% | 0.818 | S | S | * | * | trans | -111.1 | 146 | -164 | -77.9 | 162.6 | 0 | 0 | 0 | 114.9 | ||||
| 256 | N | 38.2 | Very low | 46.8 | Very low | 172 Ų | 172 | 124.2 Ų | 124.2 | 92% | 0.92 | 81% | 0.812 | S | S | * | * | trans | 151.5 | 133.8 | 146.7 | -79.4 | -14.5 | 0 | 0 | 0 | 108.7 | ||||
| 257 | G | 38.8 | Very low | 46.8 | Very low | 71 Ų | 71 | 130.1 Ų | 130.1 | 73% | 0.732 | 82% | 0.822 | S | S | * | * | cis | -167.3 | 154.1 | -9.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 258 | L | 49.7 | Very low | 47.3 | Very low | 182 Ų | 182 | 131.6 Ų | 131.6 | 95% | 0.953 | 82% | 0.822 | S | S | * | * | trans | -80.2 | 136.3 | -171.4 | -70.6 | 168.8 | 0 | 0 | 0 | 113.2 | ||||
| 259 | P | 46.1 | Very low | 47.3 | Very low | 121 Ų | 121 | 128.7 Ų | 128.7 | 79% | 0.786 | 81% | 0.814 | S | S | * | * | -145.8 | 143.7 | 117.9 | 33.9 | -18 | 0 | 0 | 0 | 115.5 | |||||
| 260 | G | 47.2 | Very low | 47.6 | Very low | 70 Ų | 70 | 133.3 Ų | 133.3 | 72% | 0.722 | 82% | 0.815 | S | S | * | * | trans | 75.3 | 107.8 | 152 | 0 | 0 | 0 | 0 | 0 | 118.9 | Q262 | G260-Q262 PolarHBondContact O-N 3.15Š| ||
| 261 | P | 48.2 | Very low | 48.6 | Very low | 138 Ų | 138 | 129.3 Ų | 129.3 | 90% | 0.896 | 81% | 0.809 | S | S | * | * | trans | -78.3 | 108.5 | 170.7 | 31.2 | -32.2 | 0 | 0 | 0 | 111.7 | ||||
| 262 | Q | 55 | Low | 49.4 | Very low | 191 Ų | 191 | 129 Ų | 129 | 89% | 0.893 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -83.8 | 122.1 | 165.9 | -172.7 | 173.8 | 6.2 | 0 | 0 | 109.6 | G260 | G260-Q262 PolarHBondContact O-N 3.15Š|
| 263 | G | 53.8 | Low | 49.7 | Very low | 60 Ų | 60 | 129.5 Ų | 129.5 | 62% | 0.619 | 81% | 0.812 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 138.5 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 264 | P | 55.4 | Low | 50.4 | Low | 115 Ų | 115 | 128.6 Ų | 128.6 | 75% | 0.747 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 141.8 | 176.2 | 28.7 | -34.1 | 0 | 0 | 0 | 111.1 | ||
| 265 | P | 62.9 | Low | 51.2 | Low | 117 Ų | 117 | 128.4 Ų | 128.4 | 76% | 0.76 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 139.7 | 173 | -24.9 | 34.8 | 0 | 0 | 0 | 112.3 | H267 | P265-H267 PolarHBondContact O-N 2.86Š|
| 266 | G | 49.5 | Very low | 51.3 | Low | 78 Ų | 78 | 128.5 Ų | 128.5 | 80% | 0.804 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 127.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | K268 | G266-K268 PolarHBondContact O-N 3.14Š|
| 267 | H | 45.7 | Very low | 52.7 | Low | 188 Ų | 188 | 126.1 Ų | 126.1 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 130.1 | 177 | -70.6 | -87.3 | 0 | 0 | 0 | 110.9 | P265 G269 | P265-H267 PolarHBondContact O-N 2.86Å; H267-G269 PolarHBondContact O-N 2.81Å |
| 268 | K | 58.8 | Low | 53.7 | Low | 206 Ų | 206 | 125.7 Ų | 125.7 | 90% | 0.896 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 132.1 | 171.1 | -166.6 | 174.2 | -174.1 | 177.1 | 0 | 109 | G266 H270 | G266-K268 PolarHBondContact O-N 3.14Å; K268-H270 PolarHBondContact O-N 2.77Å |
| 269 | G | 46.8 | Very low | 54.3 | Low | 62 Ų | 62 | 123.4 Ų | 123.4 | 64% | 0.639 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -53.2 | 135.3 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | H267 | H267-G269 PolarHBondContact O-N 2.81Š|
| 270 | H | 46.3 | Very low | 55.2 | Low | 173 Ų | 173 | 122.3 Ų | 122.3 | 80% | 0.801 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 134.9 | 174 | 29.1 | -100.6 | 0 | 0 | 0 | 110.2 | K268 | K268-H270 PolarHBondContact O-N 2.77Š|
| 271 | P | 64.6 | Low | 55.6 | Low | 124 Ų | 124 | 122.5 Ų | 122.5 | 81% | 0.805 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 141.4 | 162.1 | -22.4 | 34 | 0 | 0 | 0 | 109.7 | ||
| 272 | G | 54.9 | Low | 55.8 | Low | 70 Ų | 70 | 125.9 Ų | 125.9 | 72% | 0.722 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 149.9 | -179.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | S274 | G272-S274 PolarHBondContact O-N 3.21Š|
| 273 | E | 49.2 | Very low | 56 | Low | 201 Ų | 201 | 120.3 Ų | 120.3 | 94% | 0.939 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 132.8 | -179.1 | -66.3 | -175.4 | 118 | 0 | 0 | 111.7 | G275 | E273-G275 PolarHBondContact O-N 2.87Š|
| 274 | S | 59.2 | Low | 56.2 | Low | 117 Ų | 117 | 120.5 Ų | 120.5 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 129.8 | 168 | -62.4 | 0 | 0 | 0 | 0 | 109.5 | G272 | G272-S274 PolarHBondContact O-N 3.21Š|
| 275 | G | 54.7 | Low | 56.1 | Low | 71 Ų | 71 | 121 Ų | 121 | 73% | 0.732 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 143.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | E273 | E273-G275 PolarHBondContact O-N 2.87Š|
| 276 | L | 52.2 | Low | 56 | Low | 171 Ų | 171 | 121.5 Ų | 121.5 | 90% | 0.895 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 132 | -177.3 | -67.6 | 172.6 | 0 | 0 | 0 | 111.4 | G278 | L276-G278 PolarHBondContact O-N 2.71Š|
| 277 | P | 68.1 | Low | 56.3 | Low | 122 Ų | 122 | 120.8 Ų | 120.8 | 79% | 0.792 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 137.9 | 173 | -26.2 | 34.9 | 0 | 0 | 0 | 111.5 | ||
| 278 | G | 60.1 | Low | 56.6 | Low | 63 Ų | 63 | 117.7 Ų | 117.7 | 65% | 0.649 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 148.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | L276 A280 | L276-G278 PolarHBondContact O-N 2.71Å; G278-A280 PolarHBondContact O-N 2.84Å |
| 279 | P | 61.4 | Low | 56.6 | Low | 133 Ų | 133 | 114 Ų | 114 | 86% | 0.864 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 133 | -177 | 24.5 | -34.2 | 0 | 0 | 0 | 110.8 | G281 | P279-G281 PolarHBondContact O-N 3.33Š|
| 280 | A | 64.6 | Low | 56.6 | Low | 99 Ų | 99 | 114.7 Ų | 114.7 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 129.7 | -176.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | G278 K282 | G278-A280 PolarHBondContact O-N 2.84Å; A280-K282 PolarHBondContact O-N 2.88Å |
| 281 | G | 57.3 | Low | 56.6 | Low | 74 Ų | 74 | 114.5 Ų | 114.5 | 76% | 0.763 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 136 | 177.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | P279 G283 | P279-G281 PolarHBondContact O-N 3.33Å; G281-G283 PolarHBondContact O-N 3.19Å; G281-G283 VanDerWaalsContact O-N 3.14Å |
| 282 | K | 52.4 | Low | 55.9 | Low | 208 Ų | 208 | 114.7 Ų | 114.7 | 90% | 0.904 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 121.6 | 177.1 | -69 | -176.2 | 178.3 | -179.1 | 0 | 109 | A280 G284 | A280-K282 PolarHBondContact O-N 2.88Å; K282-G284 PolarHBondContact O-N 3.42Å |
| 283 | G | 58.8 | Low | 55.4 | Low | 74 Ų | 74 | 114.9 Ų | 114.9 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 134.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | G281 | G281-G283 PolarHBondContact O-N 3.19Å; G281-G283 VanDerWaalsContact O-N 3.14Å |
| 284 | G | 57.1 | Low | 55 | Low | 64 Ų | 64 | 115.2 Ų | 115.2 | 66% | 0.66 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 153.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | K282 | K282-G284 PolarHBondContact O-N 3.42Š|
| 285 | P | 53.2 | Low | 54.2 | Low | 125 Ų | 125 | 113.2 Ų | 113.2 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 141.4 | 175.9 | 26.2 | -34.1 | 0 | 0 | 0 | 110.3 | G287 | P285-G287 PolarHBondContact O-N 3.45Š|
| 286 | P | 62 | Low | 53.5 | Low | 129 Ų | 129 | 119.3 Ų | 119.3 | 84% | 0.838 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 131.7 | 177.9 | -26.5 | 35.1 | 0 | 0 | 0 | 112 | ||
| 287 | G | 54.6 | Low | 53.6 | Low | 62 Ų | 62 | 117.8 Ų | 117.8 | 64% | 0.639 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 148.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | P285 | P285-G287 PolarHBondContact O-N 3.45Š|
| 288 | P | 52.5 | Low | 52.5 | Low | 123 Ų | 123 | 115.4 Ų | 115.4 | 80% | 0.799 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 147.3 | 178.5 | 27 | -34.6 | 0 | 0 | 0 | 111.3 | G290 | P288-G290 PolarHBondContact O-N 3.16Š|
| 289 | P | 58 | Low | 51.7 | Low | 130 Ų | 130 | 121.7 Ų | 121.7 | 84% | 0.844 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 128.3 | -179.3 | -26.5 | 35.4 | 0 | 0 | 0 | 113.1 | ||
| 290 | G | 48.4 | Very low | 51.2 | Low | 75 Ų | 75 | 123.2 Ų | 123.2 | 77% | 0.773 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -72.4 | 144.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | P288 | P288-G290 PolarHBondContact O-N 3.16Š|
| 291 | L | 46.2 | Very low | 50.2 | Low | 169 Ų | 169 | 122 Ų | 122 | 89% | 0.885 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -69.8 | 150.9 | 176.9 | -72.9 | 166.1 | 0 | 0 | 0 | 112.1 | G293 | L291-G293 PolarHBondContact O-N 3.19Š|
| 292 | P | 50.1 | Low | 49.8 | Very low | 129 Ų | 129 | 126.3 Ų | 126.3 | 84% | 0.838 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 119.8 | -168.9 | -13.3 | 30.5 | 0 | 0 | 0 | 114.2 | ||
| 293 | G | 43 | Very low | 50.2 | Low | 74 Ų | 74 | 122.3 Ų | 122.3 | 76% | 0.763 | 81% | 0.813 | S | S | * | * | trans | 76 | 103.5 | 134.1 | 0 | 0 | 0 | 0 | 0 | 119.9 | L291 | L291-G293 PolarHBondContact O-N 3.19Š| ||
| 294 | Q | 40.8 | Very low | 49.7 | Very low | 207 Ų | 207 | 122.1 Ų | 122.1 | 97% | 0.967 | 81% | 0.812 | S | S | * | * | -147.2 | 134.8 | 126.9 | -110.6 | -178.9 | 22.4 | 0 | 0 | 109.3 | |||||
| 295 | G | 43.3 | Very low | 49.5 | Very low | 76 Ų | 76 | 127.6 Ų | 127.6 | 78% | 0.784 | 82% | 0.82 | S | S | * | * | trans | -110.2 | 156.7 | -167.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 296 | K | 39.5 | Very low | 49.8 | Very low | 199 Ų | 199 | 127.6 Ų | 127.6 | 87% | 0.865 | 82% | 0.82 | S | S | * | * | trans | -139.1 | 134.9 | 155.8 | -66.8 | -172.6 | -179.8 | -179.8 | 0 | 108 | G298 | K296-G298 PolarHBondContact O-N 2.9Š| ||
| 297 | P | 55.4 | Low | 49.2 | Very low | 139 Ų | 139 | 125 Ų | 125 | 90% | 0.903 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 121.6 | 174.7 | -22.5 | 34.2 | 0 | 0 | 0 | 111.1 | ||
| 298 | G | 44.4 | Very low | 49.1 | Very low | 71 Ų | 71 | 133 Ų | 133 | 73% | 0.732 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -85.4 | 153.8 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | K296 | K296-G298 PolarHBondContact O-N 2.9Š|
| 299 | Q | 42.7 | Very low | 49.4 | Very low | 196 Ų | 196 | 133.7 Ų | 133.7 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 155 | -179.6 | -68 | 167.6 | -54.4 | 0 | 0 | 112.4 | G301 | Q299-G301 PolarHBondContact O-N 2.75Š|
| 300 | N | 50.3 | Low | 48.9 | Very low | 165 Ų | 165 | 130.8 Ų | 130.8 | 88% | 0.882 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 127.6 | 166 | -70.3 | -8.8 | 0 | 0 | 0 | 109.6 | ||
| 301 | G | 44.4 | Very low | 49 | Very low | 72 Ų | 72 | 136 Ų | 136 | 74% | 0.742 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 144.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112 | Q299 | Q299-G301 PolarHBondContact O-N 2.75Š|
| 302 | L | 48.8 | Very low | 49.7 | Very low | 165 Ų | 165 | 137.2 Ų | 137.2 | 86% | 0.864 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 146.5 | 169.7 | -66.9 | 167.6 | 0 | 0 | 0 | 109.9 | G304 | L302-G304 PolarHBondContact O-N 3.19Š|
| 303 | P | 59.8 | Low | 50 | Low | 124 Ų | 124 | 133.7 Ų | 133.7 | 81% | 0.805 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 132.5 | 167.8 | -23 | 33.8 | 0 | 0 | 0 | 110.2 | ||
| 304 | G | 49.2 | Very low | 50.5 | Low | 71 Ų | 71 | 136.3 Ų | 136.3 | 73% | 0.732 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 139.4 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L302 | L302-G304 PolarHBondContact O-N 3.19Š|
| 305 | E | 53.8 | Low | 51.7 | Low | 178 Ų | 178 | 132.8 Ų | 132.8 | 83% | 0.832 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 140.1 | 175.3 | -66.1 | -166.7 | 133.1 | 0 | 0 | 110.7 | G307 | E305-G307 PolarHBondContact O-N 2.84Š|
| 306 | P | 59.6 | Low | 52.4 | Low | 125 Ų | 125 | 131.8 Ų | 131.8 | 81% | 0.812 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 126.6 | 168.9 | -25 | 34.8 | 0 | 0 | 0 | 110.4 | R308 | P306-R308 PolarHBondContact O-N 3.28Š|
| 307 | G | 48.1 | Very low | 53 | Low | 74 Ų | 74 | 128.1 Ų | 128.1 | 76% | 0.763 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 128.8 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | E305 T309 | E305-G307 PolarHBondContact O-N 2.84Å; G307-T309 PolarHBondContact O-N 2.91Å |
| 308 | R | 52.5 | Low | 53.7 | Low | 231 Ų | 231 | 127.4 Ų | 127.4 | 87% | 0.872 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 126.4 | -177.9 | -70.9 | -174.6 | 176.9 | -166 | -0.8 | 110.6 | P306 G310 | P306-R308 PolarHBondContact O-N 3.28Å; R308-G310 PolarHBondContact O-N 2.87Å |
| 309 | T | 58.8 | Low | 54.3 | Low | 137 Ų | 137 | 127.4 Ų | 127.4 | 84% | 0.84 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 124.5 | 171 | -46.1 | 0 | 0 | 0 | 0 | 109.2 | G307 E311 | G307-T309 PolarHBondContact O-N 2.91Å; T309-E311 PolarHBondContact O-N 3.23Å |
| 310 | G | 47.8 | Very low | 54.6 | Low | 69 Ų | 69 | 126 Ų | 126 | 71% | 0.711 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -55 | 131.7 | -177.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | R308 K312 | R308-G310 PolarHBondContact O-N 2.87Å; G310-K312 PolarHBondContact O-N 2.91Å |
| 311 | E | 51.6 | Low | 55.4 | Low | 186 Ų | 186 | 123.9 Ų | 123.9 | 87% | 0.869 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 131.3 | -178.3 | -64.4 | -175.5 | 158.8 | 0 | 0 | 110.1 | T309 G313 | T309-E311 PolarHBondContact O-N 3.23Å; E311-G313 PolarHBondContact O-N 3.47Å; E311-G313 VanDerWaalsContact O-N 3.08Å |
| 312 | K | 60.1 | Low | 55.9 | Low | 194 Ų | 194 | 123.9 Ų | 123.9 | 84% | 0.843 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 117.3 | 173.7 | 177.6 | -177.5 | -70.1 | -177 | 0 | 107.6 | G310 | G310-K312 PolarHBondContact O-N 2.91Š|
| 313 | G | 57 | Low | 56.1 | Low | 55 Ų | 55 | 125.6 Ų | 125.6 | 57% | 0.567 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -49.4 | 139.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | E311 T315 | E311-G313 PolarHBondContact O-N 3.47Å; E311-G313 VanDerWaalsContact O-N 3.08Å; G313-T315 PolarHBondContact O-N 2.9Å |
| 314 | P | 51.7 | Low | 56.3 | Low | 128 Ų | 128 | 125.9 Ų | 125.9 | 83% | 0.831 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -59 | 131.4 | -167.6 | 23 | -33.9 | 0 | 0 | 0 | 111.2 | G316 | P314-G316 PolarHBondContact O-N 2.88Š|
| 315 | T | 66.8 | Low | 56.4 | Low | 134 Ų | 134 | 125.8 Ų | 125.8 | 82% | 0.822 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -52.4 | 126.5 | 170.2 | -52.6 | 0 | 0 | 0 | 0 | 108.7 | G313 | G313-T315 PolarHBondContact O-N 2.9Š|
| 316 | G | 58.6 | Low | 56 | Low | 55 Ų | 55 | 125.6 Ų | 125.6 | 57% | 0.567 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -53 | 139.8 | 179 | 0 | 0 | 0 | 0 | 0 | 111.1 | P314 | P314-G316 PolarHBondContact O-N 2.88Š|
| 317 | P | 52.4 | Low | 55.6 | Low | 121 Ų | 121 | 124.9 Ų | 124.9 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 136 | -173.6 | 23.7 | -33.8 | 0 | 0 | 0 | 110.5 | G319 | P317-G319 PolarHBondContact O-N 2.88Š|
| 318 | P | 69.8 | Low | 55.5 | Low | 124 Ų | 124 | 124.9 Ų | 124.9 | 81% | 0.805 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -53 | 137.6 | 172.7 | -26.3 | 34.9 | 0 | 0 | 0 | 110.9 | L320 | P318-L320 PolarHBondContact O-N 2.92Š|
| 319 | G | 55.6 | Low | 55.1 | Low | 72 Ų | 72 | 123.6 Ų | 123.6 | 74% | 0.742 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 129.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | P317 | P317-G319 PolarHBondContact O-N 2.88Š|
| 320 | L | 50.4 | Low | 54.6 | Low | 166 Ų | 166 | 120.5 Ų | 120.5 | 87% | 0.869 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127.1 | -177.8 | -70.2 | 171.5 | 0 | 0 | 0 | 110.4 | P318 G322 | P318-L320 PolarHBondContact O-N 2.92Å; L320-G322 PolarHBondContact O-N 2.86Å |
| 321 | P | 67.5 | Low | 54.4 | Low | 120 Ų | 120 | 126.8 Ų | 126.8 | 78% | 0.779 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 138.3 | 173.9 | -27.5 | 35.6 | 0 | 0 | 0 | 111.4 | K323 | P321-K323 PolarHBondContact O-N 3.12Š|
| 322 | G | 54.2 | Low | 54 | Low | 72 Ų | 72 | 127.2 Ų | 127.2 | 74% | 0.742 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 131.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | L320 | L320-G322 PolarHBondContact O-N 2.86Š|
| 323 | K | 52.7 | Low | 53.3 | Low | 202 Ų | 202 | 121.4 Ų | 121.4 | 88% | 0.878 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -55 | 128.2 | 179.2 | -64.6 | -179.5 | -179.3 | 179.4 | 0 | 109.5 | P321 G325 | P321-K323 PolarHBondContact O-N 3.12Å; K323-G325 PolarHBondContact O-N 2.98Å |
| 324 | P | 63.8 | Low | 52.6 | Low | 129 Ų | 129 | 127.2 Ų | 127.2 | 84% | 0.838 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -54 | 139.6 | 173 | -27.1 | 35.5 | 0 | 0 | 0 | 111.3 | ||
| 325 | G | 51.5 | Low | 52.3 | Low | 69 Ų | 69 | 127.3 Ų | 127.3 | 71% | 0.711 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 142.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | K323 | K323-G325 PolarHBondContact O-N 2.98Š|
| 326 | L | 46.3 | Very low | 51.4 | Low | 174 Ų | 174 | 124.2 Ų | 124.2 | 91% | 0.911 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 127.1 | 175.3 | -78.2 | 162.9 | 0 | 0 | 0 | 110.1 | G328 | L326-G328 PolarHBondContact O-N 3.24Š|
| 327 | P | 50.7 | Low | 51.1 | Low | 111 Ų | 111 | 128 Ų | 128 | 72% | 0.721 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 130.3 | 178.1 | -25.7 | 35.1 | 0 | 0 | 0 | 112.1 | F329 | P327-F329 PolarHBondContact O-N 3.29Š|
| 328 | G | 46.1 | Very low | 50.9 | Low | 74 Ų | 74 | 132.1 Ų | 132.1 | 76% | 0.763 | 82% | 0.821 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 129.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | L326 G330 | L326-G328 PolarHBondContact O-N 3.24Å; G328-G330 PolarHBondContact O-N 2.57Å |
| 329 | F | 44.9 | Very low | 49.9 | Very low | 204 Ų | 204 | 129.6 Ų | 129.6 | 90% | 0.895 | 82% | 0.817 | S | S | * | * | trans | -73.8 | 62.9 | 178.1 | -89.1 | -91.2 | 0 | 0 | 0 | 112.8 | P327 K331 | P327-F329 PolarHBondContact O-N 3.29Å; F329-K331 PolarHBondContact O-N 2.93Å | ||
| 330 | G | 47.5 | Very low | 49.3 | Very low | 72 Ų | 72 | 134.5 Ų | 134.5 | 74% | 0.742 | 83% | 0.827 | S | S | * | * | trans | -76.7 | 101.3 | 167.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | G328 Q332 | G328-G330 PolarHBondContact O-N 2.57Å; G330-Q332 PolarHBondContact O-N 3.36Å | ||
| 331 | K | 43.7 | Very low | 49.4 | Very low | 201 Ų | 201 | 136.7 Ų | 136.7 | 87% | 0.874 | 83% | 0.829 | S | S | * | * | trans | -71.3 | 111.4 | 170.7 | -71.3 | -172.5 | 178.2 | -177.9 | 0 | 109.7 | F329 | F329-K331 PolarHBondContact O-N 2.93Š| ||
| 332 | Q | 43.9 | Very low | 48.4 | Very low | 195 Ų | 195 | 134.4 Ų | 134.4 | 91% | 0.911 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 139.9 | 173.6 | -161.2 | 167.7 | 3.5 | 0 | 0 | 110.1 | G330 | G330-Q332 PolarHBondContact O-N 3.36Š|
| 333 | G | 44.9 | Very low | 47.6 | Very low | 71 Ų | 71 | 139.7 Ų | 139.7 | 73% | 0.732 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -78.4 | 158.9 | -165.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 334 | L | 42.4 | Very low | 47.6 | Very low | 177 Ų | 177 | 138 Ų | 138 | 93% | 0.927 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -101.5 | 133.3 | 165 | -70.7 | 169.7 | 0 | 0 | 0 | 109.4 | ||
| 335 | S | 44.1 | Very low | 46.9 | Very low | 131 Ų | 131 | 135.1 Ų | 135.1 | 92% | 0.916 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 131.1 | 176 | -58.8 | 0 | 0 | 0 | 0 | 111.1 | ||
| 336 | G | 49.1 | Very low | 46.9 | Very low | 68 Ų | 68 | 137.6 Ų | 137.6 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 171.3 | -170.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 337 | P | 52.8 | Low | 47.5 | Very low | 136 Ų | 136 | 135.5 Ų | 135.5 | 88% | 0.883 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -80.3 | 169.7 | 169.3 | 34.8 | -34.7 | 0 | 0 | 0 | 112.7 | ||
| 338 | K | 47.4 | Very low | 47.6 | Very low | 206 Ų | 206 | 133.3 Ų | 133.3 | 90% | 0.896 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 143.7 | -177.8 | -170.3 | 177.5 | -179.4 | -178.6 | 0 | 112.1 | ||
| 339 | G | 48.9 | Very low | 47.7 | Very low | 71 Ų | 71 | 135.7 Ų | 135.7 | 73% | 0.732 | 83% | 0.829 | S | S | * | * | P | Polyproline II helix | trans | -90.9 | 156.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||
| 340 | D | 43.6 | Very low | 47.9 | Very low | 175 Ų | 175 | 132.3 Ų | 132.3 | 94% | 0.936 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -101.2 | 171.8 | 176.2 | -76.4 | -54.1 | 0 | 0 | 0 | 113.2 | ||
| 341 | K | 52.2 | Low | 47.9 | Very low | 213 Ų | 213 | 132.5 Ų | 132.5 | 93% | 0.926 | 83% | 0.829 | S | S | * | * | trans | -126.6 | 127.6 | -164.3 | 176 | -173.9 | 175.1 | -176.2 | 0 | 113.2 | ||||
| 342 | G | 45.8 | Very low | 47.8 | Very low | 71 Ų | 71 | 131.7 Ų | 131.7 | 73% | 0.732 | 83% | 0.833 | S | S | * | * | trans | 135.6 | 155.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 343 | M | 37.9 | Very low | 48.1 | Very low | 184 Ų | 184 | 132.6 Ų | 132.6 | 91% | 0.906 | 83% | 0.834 | S | S | * | * | cis | -136.7 | 159.7 | 3.7 | -73.9 | 162.7 | 49.9 | 0 | 0 | 110.5 | ||||
| 344 | N | 51.3 | Low | 48.4 | Very low | 166 Ų | 166 | 132.4 Ų | 132.4 | 89% | 0.888 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 143.4 | 170.7 | -74.7 | 1.3 | 0 | 0 | 0 | 111.2 | ||
| 345 | G | 50.3 | Low | 48.3 | Very low | 69 Ų | 69 | 131.9 Ų | 131.9 | 71% | 0.711 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 153.2 | 165.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 346 | P | 50.7 | Low | 48.6 | Very low | 121 Ų | 121 | 134.7 Ų | 134.7 | 79% | 0.786 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -76 | 155.3 | -176.4 | 31.3 | -35.8 | 0 | 0 | 0 | 113.2 | ||
| 347 | P | 58.9 | Low | 48.3 | Very low | 130 Ų | 130 | 135.1 Ų | 135.1 | 84% | 0.844 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 141 | 175.4 | -18.3 | 32.1 | 0 | 0 | 0 | 113.2 | ||
| 348 | G | 53.1 | Low | 47.9 | Very low | 65 Ų | 65 | 139.3 Ų | 139.3 | 67% | 0.67 | 83% | 0.831 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 154.1 | 166.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 349 | P | 48.8 | Very low | 48.1 | Very low | 123 Ų | 123 | 133 Ų | 133 | 80% | 0.799 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 150.2 | -173.2 | 29.3 | -35.5 | 0 | 0 | 0 | 113.5 | ||
| 350 | P | 48.5 | Very low | 47.9 | Very low | 134 Ų | 134 | 133.3 Ų | 133.3 | 87% | 0.87 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -59.4 | 141 | 170.9 | -23.6 | 34.8 | 0 | 0 | 0 | 112.7 | ||
| 351 | G | 47.7 | Very low | 48.1 | Very low | 75 Ų | 75 | 132.8 Ų | 132.8 | 77% | 0.773 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -84.9 | 169.3 | -168.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 352 | L | 42.2 | Very low | 48.7 | Very low | 184 Ų | 184 | 128.5 Ų | 128.5 | 96% | 0.963 | 82% | 0.817 | S | S | * | * | P | Polyproline II helix | trans | -79 | 140.5 | 165.1 | -70.4 | 173.4 | 0 | 0 | 0 | 110.5 | ||
| 353 | K | 50.2 | Low | 49 | Very low | 214 Ų | 214 | 128.7 Ų | 128.7 | 93% | 0.93 | 82% | 0.819 | S | S | * | * | trans | -97.4 | 108.1 | -172.1 | 179.9 | -173.1 | 172.2 | -176.6 | 0 | 112.2 | ||||
| 354 | G | 49.5 | Very low | 49.5 | Very low | 67 Ų | 67 | 128.8 Ų | 128.8 | 69% | 0.691 | 82% | 0.819 | S | S | * | * | trans | 94.3 | 124.5 | 143.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 355 | D | 42.2 | Very low | 49.8 | Very low | 166 Ų | 166 | 128.6 Ų | 128.6 | 89% | 0.888 | 82% | 0.817 | S | S | * | * | trans | -136.2 | 158.3 | 140.2 | -128.4 | -36.2 | 0 | 0 | 0 | 109.2 | G357 | D355-G357 PolarHBondContact O-N 3.44Š| ||
| 356 | K | 49.9 | Very low | 50.3 | Low | 191 Ų | 191 | 127.7 Ų | 127.7 | 83% | 0.83 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -77.5 | 124.9 | -169.6 | -167.1 | 173.5 | 179.2 | -179.6 | 0 | 110.7 | Y358 | K356-Y358 PolarHBondContact O-N 3.16Š|
| 357 | G | 42.2 | Very low | 50.7 | Low | 77 Ų | 77 | 127.7 Ų | 127.7 | 79% | 0.794 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 127.4 | -166.8 | 0 | 0 | 0 | 0 | 0 | 115.3 | D355 | D355-G357 PolarHBondContact O-N 3.44Š|
| 358 | Y | 45.4 | Very low | 51.4 | Low | 224 Ų | 224 | 127.1 Ų | 127.1 | 88% | 0.878 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -73.6 | 148.8 | 163.5 | -69.1 | -91.2 | 0 | 0 | 0 | 110.2 | K356 G360 | K356-Y358 PolarHBondContact O-N 3.16Å; Y358-G360 PolarHBondContact O-N 3.18Å |
| 359 | G | 51.8 | Low | 51.9 | Low | 74 Ų | 74 | 127 Ų | 127 | 76% | 0.763 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -61.5 | 134.1 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.2 | L361 | G359-L361 PolarHBondContact O-N 3.33Š|
| 360 | G | 44.6 | Very low | 52.4 | Low | 76 Ų | 76 | 127.2 Ų | 127.2 | 78% | 0.784 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 129.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y358 | Y358-G360 PolarHBondContact O-N 3.18Š|
| 361 | L | 46.8 | Very low | 53.3 | Low | 165 Ų | 165 | 126.6 Ų | 126.6 | 86% | 0.864 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 140.5 | 166.9 | -71.2 | 167.9 | 0 | 0 | 0 | 109.2 | G359 G363 | G359-L361 PolarHBondContact O-N 3.33Å; L361-G363 PolarHBondContact O-N 2.88Å |
| 362 | P | 64.8 | Low | 53.9 | Low | 123 Ų | 123 | 125.8 Ų | 125.8 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -53 | 131.1 | 169.2 | -24.9 | 34.5 | 0 | 0 | 0 | 110 | M364 | P362-M364 PolarHBondContact O-N 3.47Š|
| 363 | G | 52.7 | Low | 54.9 | Low | 74 Ų | 74 | 122.8 Ų | 122.8 | 76% | 0.763 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -57 | 136.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.7 | L361 L365 | L361-G363 PolarHBondContact O-N 2.88Å; G363-L365 PolarHBondContact O-N 2.82Å |
| 364 | M | 47.5 | Very low | 56 | Low | 187 Ų | 187 | 118.6 Ų | 118.6 | 92% | 0.921 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 125.4 | 174.1 | -80.8 | 173.7 | 56.9 | 0 | 0 | 109.5 | P362 G366 | P362-M364 PolarHBondContact O-N 3.47Å; M364-G366 PolarHBondContact O-N 3.45Å; M364-G366 VanDerWaalsContact O-N 3.15Å |
| 365 | L | 57.3 | Low | 56.4 | Low | 161 Ų | 161 | 118.4 Ų | 118.4 | 84% | 0.843 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 122.3 | 169.1 | -177.4 | 65.7 | 0 | 0 | 0 | 107.6 | G363 | G363-L365 PolarHBondContact O-N 2.82Š|
| 366 | G | 61.1 | Low | 57.4 | Low | 51 Ų | 51 | 116.1 Ų | 116.1 | 53% | 0.526 | 77% | 0.773 | S | S | . | * | P | Polyproline II helix | trans | -55.6 | 142.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.9 | M364 | M364-G366 PolarHBondContact O-N 3.45Å; M364-G366 VanDerWaalsContact O-N 3.15Å |
| 367 | P | 60.2 | Low | 58.2 | Low | 120 Ų | 120 | 113 Ų | 113 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 135.2 | 179.2 | 23.8 | -33.6 | 0 | 0 | 0 | 109.1 | G369 | P367-G369 PolarHBondContact O-N 2.85Š|
| 368 | P | 72.3 | Confident | 59 | Low | 119 Ų | 119 | 112.2 Ų | 112.2 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -49.9 | 129.5 | 177.3 | -28.4 | 35.4 | 0 | 0 | 0 | 110.1 | ||
| 369 | G | 63.4 | Low | 59.7 | Low | 61 Ų | 61 | 107.5 Ų | 107.5 | 63% | 0.629 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 140.7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | P367 S371 | P367-G369 PolarHBondContact O-N 2.85Å; G369-S371 PolarHBondContact O-N 3.24Å; G369-S371 VanDerWaalsContact O-N 3.16Å |
| 370 | P | 61 | Low | 59.9 | Low | 128 Ų | 128 | 111.6 Ų | 111.6 | 83% | 0.831 | 76% | 0.764 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 127.5 | -177 | 23.3 | -33.8 | 0 | 0 | 0 | 109 | G372 | P370-G372 PolarHBondContact O-N 3.15Å; P370-G372 VanDerWaalsContact O-N 3.16Å |
| 371 | S | 66 | Low | 60.2 | Low | 121 Ų | 121 | 111 Ų | 111 | 85% | 0.846 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 126 | -179.8 | -57.5 | 0 | 0 | 0 | 0 | 109 | G369 | G369-S371 PolarHBondContact O-N 3.24Å; G369-S371 VanDerWaalsContact O-N 3.16Å |
| 372 | G | 61.2 | Low | 60.5 | Low | 59 Ų | 59 | 114.5 Ų | 114.5 | 61% | 0.608 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -53 | 142 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110 | P370 | P370-G372 PolarHBondContact O-N 3.15Å; P370-G372 VanDerWaalsContact O-N 3.16Å |
| 373 | P | 63.5 | Low | 60.2 | Low | 120 Ų | 120 | 114.5 Ų | 114.5 | 78% | 0.779 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 136.5 | -179.9 | 23.5 | -33.8 | 0 | 0 | 0 | 109 | G375 | P373-G375 PolarHBondContact O-N 2.91Š|
| 374 | P | 71.7 | Confident | 59.9 | Low | 127 Ų | 127 | 114.5 Ų | 114.5 | 83% | 0.825 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -48.5 | 128.5 | 179.5 | -29.2 | 35.3 | 0 | 0 | 0 | 110.3 | ||
| 375 | G | 59.7 | Low | 59.9 | Low | 62 Ų | 62 | 111.1 Ų | 111.1 | 64% | 0.639 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -52.5 | 137 | 179.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | P373 | P373-G375 PolarHBondContact O-N 2.91Š|
| 376 | P | 62.8 | Low | 59.2 | Low | 118 Ų | 118 | 110.3 Ų | 110.3 | 77% | 0.766 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 134.3 | -176.6 | 22.8 | -33.6 | 0 | 0 | 0 | 109 | G378 | P376-G378 PolarHBondContact O-N 3.31Å; P376-G378 VanDerWaalsContact O-N 3.12Å |
| 377 | P | 67.2 | Low | 58.2 | Low | 126 Ų | 126 | 111 Ų | 111 | 82% | 0.818 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 124 | -176 | -30.6 | 35.5 | 0 | 0 | 0 | 110.8 | ||
| 378 | G | 58.8 | Low | 57.5 | Low | 60 Ų | 60 | 109.6 Ų | 109.6 | 62% | 0.619 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 134.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | P376 I380 | P376-G378 PolarHBondContact O-N 3.31Å; P376-G378 VanDerWaalsContact O-N 3.12Å; G378-I380 PolarHBondContact O-N 2.83Å; G378-I380 VanDerWaalsContact O-N 3.1Å |
| 379 | P | 60.4 | Low | 56.4 | Low | 126 Ų | 126 | 110 Ų | 110 | 82% | 0.818 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 123.6 | -172.4 | 22.5 | -33.6 | 0 | 0 | 0 | 109.1 | G381 | P379-G381 PolarHBondContact O-N 2.84Š|
| 380 | I | 55 | Low | 55.2 | Low | 160 Ų | 160 | 110.5 Ų | 110.5 | 82% | 0.821 | 77% | 0.768 | S | S | * | * | P | Polyproline II helix | trans | -48.8 | 117.1 | -174.4 | -65.8 | 174.7 | 0 | 0 | 0 | 108.3 | G378 R382 | G378-I380 PolarHBondContact O-N 2.83Å; G378-I380 VanDerWaalsContact O-N 3.1Å; I380-R382 PolarHBondContact O-N 3.4Å |
| 381 | G | 50 | Low | 54.3 | Low | 62 Ų | 62 | 110.7 Ų | 110.7 | 64% | 0.639 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 125.6 | 179.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | P379 | P379-G381 PolarHBondContact O-N 2.84Š|
| 382 | R | 53.5 | Low | 53.1 | Low | 240 Ų | 240 | 114.3 Ų | 114.3 | 91% | 0.906 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -50.3 | 129.9 | -178.9 | -68.9 | -174.4 | 178.4 | -163.3 | -0.1 | 108.4 | I380 G384 | I380-R382 PolarHBondContact O-N 3.4Å; R382-G384 PolarHBondContact O-N 2.82Å; R382-G384 VanDerWaalsContact O-N 3.15Å |
| 383 | P | 59.3 | Low | 52.4 | Low | 123 Ų | 123 | 114.4 Ų | 114.4 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -47.8 | 126 | 179.5 | -30.3 | 35.6 | 0 | 0 | 0 | 110.3 | S385 | P383-S385 PolarHBondContact O-N 3.06Å; P383-S385 VanDerWaalsContact O-N 3.13Å |
| 384 | G | 45.1 | Very low | 51.2 | Low | 73 Ų | 73 | 116 Ų | 116 | 75% | 0.753 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -55.7 | 120.9 | -172.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | R382 V386 | R382-G384 PolarHBondContact O-N 2.82Å; R382-G384 VanDerWaalsContact O-N 3.15Å; G384-V386 PolarHBondContact O-N 2.86Å; G384-V386 VanDerWaalsContact O-N 3.14Å |
| 385 | S | 48.2 | Very low | 49.4 | Very low | 116 Ų | 116 | 116.3 Ų | 116.3 | 81% | 0.811 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 120.4 | 175.4 | 52.1 | 0 | 0 | 0 | 0 | 108.8 | P383 G387 | P383-S385 PolarHBondContact O-N 3.06Å; P383-S385 VanDerWaalsContact O-N 3.13Å; S385-G387 PolarHBondContact O-N 2.89Å; S385-G387 VanDerWaalsContact O-N 3.16Å |
| 386 | V | 43.3 | Very low | 48.7 | Very low | 145 Ų | 145 | 116 Ų | 116 | 88% | 0.879 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 123.6 | 177.4 | 178.4 | 0 | 0 | 0 | 0 | 108.7 | G384 A388 | G384-V386 PolarHBondContact O-N 2.86Å; G384-V386 VanDerWaalsContact O-N 3.14Å; V386-A388 PolarHBondContact O-N 3.48Å |
| 387 | G | 38.8 | Very low | 47.4 | Very low | 64 Ų | 64 | 118.8 Ų | 118.8 | 66% | 0.66 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 121.5 | -171.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | S385 | S385-G387 PolarHBondContact O-N 2.89Å; S385-G387 VanDerWaalsContact O-N 3.16Å |
| 388 | A | 46.4 | Very low | 46.1 | Very low | 91 Ų | 91 | 116.5 Ų | 116.5 | 75% | 0.752 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 129.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 109.8 | V386 G390 | V386-A388 PolarHBondContact O-N 3.48Å; A388-G390 PolarHBondContact O-N 3.11Å |
| 389 | P | 48.3 | Very low | 45.2 | Very low | 128 Ų | 128 | 117.3 Ų | 117.3 | 83% | 0.831 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 121.4 | 170.2 | -24.4 | 35.1 | 0 | 0 | 0 | 110.4 | ||
| 390 | G | 39 | Very low | 44.9 | Very low | 71 Ų | 71 | 117.2 Ų | 117.2 | 73% | 0.732 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -77.3 | 129.4 | -169.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | A388 | A388-G390 PolarHBondContact O-N 3.11Š|
| 391 | P | 42.4 | Very low | 44.1 | Very low | 133 Ų | 133 | 119.3 Ų | 119.3 | 86% | 0.864 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -73 | 148.7 | 162 | 31.8 | -33.2 | 0 | 0 | 0 | 110.5 | ||
| 392 | K | 40.1 | Very low | 43.6 | Very low | 197 Ų | 197 | 119.5 Ų | 119.5 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | trans | -117 | 121.6 | -177.3 | 175.7 | -161.6 | 167.9 | -170.8 | 0 | 111 | ||||
| 393 | G | 47.2 | Very low | 42.8 | Very low | 60 Ų | 60 | 115.9 Ų | 115.9 | 62% | 0.619 | 79% | 0.792 | S | S | * | * | trans | 72 | 167.7 | 162 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 394 | D | 37.6 | Very low | 42.3 | Very low | 155 Ų | 155 | 117.7 Ų | 117.7 | 83% | 0.829 | 80% | 0.795 | S | S | * | * | cis | -160.9 | 157.7 | -12.4 | -79.6 | -47.3 | 0 | 0 | 0 | 106.8 | ||||
| 395 | C | 34.3 | Very low | 41.9 | Very low | 133 Ų | 133 | 118.1 Ų | 118.1 | 90% | 0.899 | 80% | 0.799 | S | S | * | * | cis | -126.8 | -117.1 | 0.2 | -161.4 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 396 | G | 45.6 | Very low | 42.4 | Very low | 56 Ų | 56 | 117.6 Ų | 117.6 | 58% | 0.577 | 80% | 0.802 | S | S | * | * | cis | 176.1 | 163.7 | -3.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 397 | D | 35.4 | Very low | 42.2 | Very low | 176 Ų | 176 | 120.8 Ų | 120.8 | 94% | 0.941 | 80% | 0.804 | S | S | * | * | trans | 33.7 | 133.4 | 163.9 | -54.7 | -27 | 0 | 0 | 0 | 121.7 | ||||
| 398 | G | 38.6 | Very low | 42.5 | Very low | 77 Ų | 77 | 120.4 Ų | 120.4 | 79% | 0.794 | 80% | 0.8 | S | S | * | * | cis | -171.2 | 176.2 | 1 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 399 | G | 41.6 | Very low | 42.9 | Very low | 77 Ų | 77 | 123.7 Ų | 123.7 | 79% | 0.794 | 81% | 0.805 | S | S | * | * | trans | -100.6 | -145.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 400 | P | 53.8 | Low | 42.5 | Very low | 125 Ų | 125 | 126.1 Ų | 126.1 | 81% | 0.812 | 81% | 0.809 | S | S | * | * | cis | -138.5 | -174 | -7.9 | 42.7 | -25.7 | 0 | 0 | 0 | 115 | ||||
| 401 | K | 37.5 | Very low | 42.4 | Very low | 203 Ų | 203 | 125.7 Ų | 125.7 | 88% | 0.883 | 81% | 0.805 | S | S | * | * | trans | 73.5 | 142.5 | 154.8 | -163 | -178.7 | -176.4 | -177.9 | 0 | 117.8 | ||||
| 402 | G | 39 | Very low | 43.4 | Very low | 67 Ų | 67 | 125.5 Ų | 125.5 | 69% | 0.691 | 80% | 0.804 | S | S | * | * | cis | 160.8 | 161.9 | -13.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 403 | L | 37.6 | Very low | 43.8 | Very low | 163 Ų | 163 | 122.6 Ų | 122.6 | 85% | 0.853 | 81% | 0.805 | S | S | * | * | trans | 74.5 | 145.9 | 163.4 | -62.6 | 178.1 | 0 | 0 | 0 | 122.2 | ||||
| 404 | D | 47.8 | Very low | 43.4 | Very low | 162 Ų | 162 | 122.9 Ų | 122.9 | 87% | 0.866 | 81% | 0.808 | S | S | * | * | trans | -74.7 | 170.9 | -162 | -48.5 | -53.9 | 0 | 0 | 0 | 118.4 | ||||
| 405 | G | 38.7 | Very low | 43.8 | Very low | 82 Ų | 82 | 123 Ų | 123 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | trans | -161.4 | 124.8 | 157.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 406 | A | 57.4 | Low | 44.5 | Very low | 104 Ų | 104 | 122.8 Ų | 122.8 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -120.6 | 143 | -168.1 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 407 | K | 39.9 | Very low | 44.4 | Very low | 213 Ų | 213 | 123.8 Ų | 123.8 | 93% | 0.926 | 82% | 0.815 | S | S | * | * | trans | -172.5 | 148 | 162 | -132.8 | 172.1 | 179.5 | -179.9 | 0 | 110.3 | ||||
| 408 | G | 43.6 | Very low | 44.8 | Very low | 56 Ų | 56 | 124.5 Ų | 124.5 | 58% | 0.577 | 81% | 0.81 | S | S | * | * | cis | 157.7 | 102.1 | -11.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 409 | D | 55.2 | Low | 44.9 | Very low | 159 Ų | 159 | 127.9 Ų | 127.9 | 85% | 0.85 | 82% | 0.815 | S | S | * | * | trans | 52.4 | 144.8 | 150.3 | -50.1 | -35.4 | 0 | 0 | 0 | 124.4 | ||||
| 410 | I | 40.8 | Very low | 44.9 | Very low | 179 Ų | 179 | 127.8 Ų | 127.8 | 92% | 0.918 | 81% | 0.814 | S | S | * | * | trans | 155.3 | 130.1 | 134.2 | -80.5 | 157.2 | 0 | 0 | 0 | 108.8 | ||||
| 411 | G | 37.6 | Very low | 44.2 | Very low | 63 Ų | 63 | 129.7 Ų | 129.7 | 65% | 0.649 | 82% | 0.816 | S | S | * | * | cis | -177.6 | 154.6 | -7.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 412 | P | 62.3 | Low | 44.8 | Very low | 129 Ų | 129 | 126.6 Ų | 126.6 | 84% | 0.838 | 82% | 0.815 | S | S | * | * | trans | -100.7 | 146.2 | -173.5 | 37.4 | -34.2 | 0 | 0 | 0 | 114.8 | ||||
| 413 | P | 47.8 | Very low | 45.2 | Very low | 135 Ų | 135 | 127 Ų | 127 | 88% | 0.877 | 82% | 0.818 | S | S | * | * | -151 | 166.1 | 120.6 | 37.2 | -20.7 | 0 | 0 | 0 | 115 | |||||
| 414 | G | 39.6 | Very low | 45.5 | Very low | 66 Ų | 66 | 126.6 Ų | 126.6 | 68% | 0.68 | 82% | 0.817 | S | S | * | * | cis | 158.5 | 92.4 | -12.2 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 415 | L | 45.8 | Very low | 45.6 | Very low | 159 Ų | 159 | 127 Ų | 127 | 83% | 0.832 | 82% | 0.819 | S | S | * | * | trans | 66.8 | 177.3 | 153.3 | -56.6 | 177 | 0 | 0 | 0 | 117.1 | ||||
| 416 | P | 48.8 | Very low | 46.1 | Very low | 128 Ų | 128 | 126.2 Ų | 126.2 | 83% | 0.831 | 81% | 0.81 | S | S | * | * | cis | -129.3 | 171.5 | -4 | 41.2 | -25.3 | 0 | 0 | 0 | 116.6 | ||||
| 417 | G | 42.9 | Very low | 45.8 | Very low | 77 Ų | 77 | 130.6 Ų | 130.6 | 79% | 0.794 | 81% | 0.813 | S | S | * | * | trans | 165.3 | 84.9 | 167.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 418 | K | 45.7 | Very low | 46.9 | Very low | 191 Ų | 191 | 126.5 Ų | 126.5 | 83% | 0.83 | 81% | 0.808 | S | S | * | * | trans | -115.6 | 141.8 | -172.2 | -63.7 | -176.1 | 179.6 | -176.7 | 0 | 113 | ||||
| 419 | T | 39.7 | Very low | 47.5 | Very low | 148 Ų | 148 | 126.9 Ų | 126.9 | 91% | 0.908 | 81% | 0.812 | S | S | * | * | trans | -121.5 | 146.1 | 149.9 | -50.9 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 420 | G | 41.9 | Very low | 47.5 | Very low | 75 Ų | 75 | 125.9 Ų | 125.9 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -74.8 | 148.1 | -159.9 | 0 | 0 | 0 | 0 | 0 | 116.6 | ||
| 421 | L | 39.7 | Very low | 48.3 | Very low | 164 Ų | 164 | 128.8 Ų | 128.8 | 86% | 0.859 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 148.8 | 166.4 | -70 | 166.6 | 0 | 0 | 0 | 110.6 | ||
| 422 | T | 49.6 | Very low | 49.3 | Very low | 139 Ų | 139 | 128.2 Ų | 128.2 | 85% | 0.853 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -87 | 139.5 | 157.5 | -57.3 | 0 | 0 | 0 | 0 | 107.6 | ||
| 423 | G | 46.2 | Very low | 48.8 | Very low | 74 Ų | 74 | 128.1 Ų | 128.1 | 76% | 0.763 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 142.7 | -163.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 424 | D | 45.2 | Very low | 49.7 | Very low | 155 Ų | 155 | 127.5 Ų | 127.5 | 83% | 0.829 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -73.3 | 147.1 | 176.1 | -61.2 | -67.8 | 0 | 0 | 0 | 113 | ||
| 425 | L | 49.3 | Very low | 50.4 | Low | 172 Ų | 172 | 127.2 Ų | 127.2 | 90% | 0.901 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -86.1 | 130.1 | 173.8 | -175.8 | 66.5 | 0 | 0 | 0 | 109.7 | ||
| 426 | G | 49.8 | Very low | 50.8 | Low | 65 Ų | 65 | 126.2 Ų | 126.2 | 67% | 0.67 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 143 | -173.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 427 | E | 51.4 | Low | 51.3 | Low | 195 Ų | 195 | 126 Ų | 126 | 91% | 0.911 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 130.5 | 179.5 | -64.8 | -169.9 | 118.2 | 0 | 0 | 112.6 | ||
| 428 | P | 61.9 | Low | 51.8 | Low | 127 Ų | 127 | 125.4 Ų | 125.4 | 83% | 0.825 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -68.1 | 139.2 | 171.3 | -21.1 | 34 | 0 | 0 | 0 | 112.7 | ||
| 429 | G | 57.3 | Low | 52.1 | Low | 65 Ų | 65 | 122.8 Ų | 122.8 | 67% | 0.67 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 157.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | R431 | G429-R431 PolarHBondContact O-N 2.71Š|
| 430 | P | 54.8 | Low | 53.2 | Low | 137 Ų | 137 | 123.7 Ų | 123.7 | 89% | 0.89 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -64.9 | 133.9 | -173.4 | 25.8 | -34.7 | 0 | 0 | 0 | 113.1 | ||
| 431 | R | 57.7 | Low | 53.6 | Low | 240 Ų | 240 | 122.9 Ų | 122.9 | 91% | 0.906 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -72.9 | 130.4 | 179.8 | -176.1 | 179.5 | 179.1 | -179.9 | 1 | 111.3 | G429 | G429-R431 PolarHBondContact O-N 2.71Š|
| 432 | G | 58.4 | Low | 53.9 | Low | 52 Ų | 52 | 120.2 Ų | 120.2 | 54% | 0.536 | 79% | 0.786 | S | S | . | * | P | Polyproline II helix | trans | -63.7 | 159 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||
| 433 | P | 52 | Low | 54.3 | Low | 127 Ų | 127 | 119.6 Ų | 119.6 | 83% | 0.825 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 143 | -175.2 | 26.9 | -34.9 | 0 | 0 | 0 | 112.6 | ||
| 434 | P | 65.3 | Low | 54.3 | Low | 122 Ų | 122 | 119.6 Ų | 119.6 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -63 | 144.8 | 174.3 | -22.4 | 34 | 0 | 0 | 0 | 113.3 | ||
| 435 | G | 55.9 | Low | 54.4 | Low | 60 Ų | 60 | 123.6 Ų | 123.6 | 62% | 0.619 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 160.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||
| 436 | P | 52.5 | Low | 54.5 | Low | 137 Ų | 137 | 125.3 Ų | 125.3 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | P | Polyproline II helix | trans | -69.5 | 136.9 | -177.5 | 28.5 | -35 | 0 | 0 | 0 | 112.7 | ||
| 437 | S | 60.2 | Low | 54.4 | Low | 123 Ų | 123 | 125.9 Ų | 125.9 | 86% | 0.86 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -72.6 | 142.4 | 176.7 | -59.2 | 0 | 0 | 0 | 0 | 112.6 | ||
| 438 | G | 53.1 | Low | 54.2 | Low | 65 Ų | 65 | 124.9 Ų | 124.9 | 67% | 0.67 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -70.8 | 162.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 439 | P | 52.7 | Low | 53.9 | Low | 136 Ų | 136 | 124.7 Ų | 124.7 | 88% | 0.883 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -67.7 | 137.9 | -177.3 | 27.8 | -34.8 | 0 | 0 | 0 | 112.5 | ||
| 440 | K | 62 | Low | 53.5 | Low | 168 Ų | 168 | 125.2 Ų | 125.2 | 73% | 0.73 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 135.8 | 177.1 | -167.4 | -160.8 | 164.5 | -168.3 | 0 | 110.8 | D443 | K440-D443 WeakPolarHBondContact CE-OD2 3.38Å; K440-D443 IonicContact NZ-OD1 3.86Å; K440-D443 IonicContact NZ-OD2 2.61Å; K440-D443 PolarHBondContact NZ-OD2 2.87Å |
| 441 | G | 50.8 | Low | 53.3 | Low | 57 Ų | 57 | 127.5 Ų | 127.5 | 59% | 0.588 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 160.2 | 169.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||
| 442 | A | 45 | Very low | 53 | Low | 108 Ų | 108 | 120.8 Ų | 120.8 | 89% | 0.893 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 136 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 443 | D | 58.1 | Low | 52.4 | Low | 126 Ų | 126 | 121.5 Ų | 121.5 | 67% | 0.674 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -83.9 | 145.1 | 178.7 | -61 | -58.6 | 0 | 0 | 0 | 111.9 | K440 | K440-D443 WeakPolarHBondContact CE-OD2 3.38Å; K440-D443 IonicContact NZ-OD1 3.86Å; K440-D443 IonicContact NZ-OD2 2.61Å; K440-D443 PolarHBondContact NZ-OD2 2.87Å |
| 444 | G | 46 | Very low | 52.4 | Low | 74 Ų | 74 | 121.6 Ų | 121.6 | 76% | 0.763 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -89.6 | 150.2 | -176 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 445 | Y | 47.8 | Very low | 52 | Low | 239 Ų | 239 | 121.8 Ų | 121.8 | 94% | 0.937 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 143.1 | -178.7 | -58.1 | -83.6 | 0 | 0 | 0 | 113.7 | ||
| 446 | K | 51.6 | Low | 51.4 | Low | 209 Ų | 209 | 122.3 Ų | 122.3 | 91% | 0.909 | 81% | 0.806 | S | S | * | * | trans | -112.5 | 147.4 | 165.7 | -84 | -174.9 | 174.5 | -180 | 0 | 110.9 | ||||
| 447 | G | 49.1 | Very low | 51.5 | Low | 76 Ų | 76 | 122.6 Ų | 122.6 | 78% | 0.784 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -78.2 | 167.1 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 448 | L | 46 | Very low | 50.9 | Low | 174 Ų | 174 | 122.8 Ų | 122.8 | 91% | 0.911 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -77.4 | 137 | -176.4 | -68.2 | 165.9 | 0 | 0 | 0 | 112.9 | ||
| 449 | P | 55 | Low | 50.6 | Low | 124 Ų | 124 | 123.3 Ų | 123.3 | 81% | 0.805 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 153.5 | 167.9 | -18.9 | 33.1 | 0 | 0 | 0 | 113.4 | ||
| 450 | G | 49.7 | Very low | 50.6 | Low | 76 Ų | 76 | 125.8 Ų | 125.8 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 161.6 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||
| 451 | I | 50.7 | Low | 50.2 | Low | 184 Ų | 184 | 129.6 Ų | 129.6 | 94% | 0.944 | 82% | 0.823 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 140.6 | 179.8 | 0.6 | 175.2 | 0 | 0 | 0 | 111.7 | ||
| 452 | A | 50.9 | Low | 50.2 | Low | 99 Ų | 99 | 130.4 Ų | 130.4 | 82% | 0.818 | 83% | 0.832 | S | S | * | * | trans | -115.3 | 153.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 453 | G | 47.1 | Very low | 50.6 | Low | 68 Ų | 68 | 132.4 Ų | 132.4 | 70% | 0.701 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -79 | 173.7 | -168 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 454 | P | 50.4 | Low | 50.6 | Low | 128 Ų | 128 | 130.5 Ų | 130.5 | 83% | 0.831 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -71.3 | 144.9 | -173 | 29 | -35.5 | 0 | 0 | 0 | 113.4 | ||
| 455 | P | 57.1 | Low | 50.8 | Low | 127 Ų | 127 | 130.6 Ų | 130.6 | 83% | 0.825 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -70.2 | 140.5 | 177.1 | -18.3 | 32 | 0 | 0 | 0 | 113.6 | ||
| 456 | G | 44.5 | Very low | 50.8 | Low | 70 Ų | 70 | 127.4 Ų | 127.4 | 72% | 0.722 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -81.3 | 146.3 | 164.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | P458 | G456-P458 WeakPolarHBondContact O-CD 3.3Š|
| 457 | T | 52.9 | Low | 51.4 | Low | 144 Ų | 144 | 123.3 Ų | 123.3 | 88% | 0.883 | 83% | 0.828 | S | S | * | * | P | Polyproline II helix | trans | -98.1 | 122 | -173.2 | 43.7 | 0 | 0 | 0 | 0 | 113.2 | ||
| 458 | P | 49.3 | Very low | 51.6 | Low | 126 Ų | 126 | 123.4 Ų | 123.4 | 82% | 0.818 | 83% | 0.83 | S | S | * | * | trans | -116 | 121 | 176.6 | 13.2 | 9.6 | 0 | 0 | 0 | 114.4 | G456 | G456-P458 WeakPolarHBondContact O-CD 3.3Š| ||
| 459 | G | 45.1 | Very low | 51.8 | Low | 76 Ų | 76 | 124.9 Ų | 124.9 | 78% | 0.784 | 83% | 0.832 | S | S | * | * | trans | 68.3 | 102.9 | 141.7 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 460 | L | 54.1 | Low | 52 | Low | 189 Ų | 189 | 128.8 Ų | 128.8 | 99% | 0.99 | 84% | 0.836 | S | S | * | * | trans | -64.1 | 138.9 | 159.8 | -67.6 | 172.2 | 0 | 0 | 0 | 111 | ||||
| 461 | R | 52.4 | Low | 51.9 | Low | 247 Ų | 247 | 128.6 Ų | 128.6 | 93% | 0.932 | 84% | 0.835 | S | S | * | * | trans | -118.5 | 145.4 | 171.5 | -179.5 | 168.2 | -85.4 | -163.2 | -5.8 | 109.9 | ||||
| 462 | G | 52 | Low | 51.7 | Low | 74 Ų | 74 | 128.2 Ų | 128.2 | 76% | 0.763 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 160.8 | -158.6 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||
| 463 | V | 52.5 | Low | 51.8 | Low | 150 Ų | 150 | 131.8 Ų | 131.8 | 91% | 0.909 | 83% | 0.832 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 140.6 | -175.9 | -158 | 0 | 0 | 0 | 0 | 111.4 | ||
| 464 | A | 57.9 | Low | 51.8 | Low | 87 Ų | 87 | 131.2 Ų | 131.2 | 72% | 0.719 | 83% | 0.826 | S | S | * | * | P | Polyproline II helix | trans | -89.1 | 149.6 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 465 | G | 51.1 | Low | 51.4 | Low | 76 Ų | 76 | 131.7 Ų | 131.7 | 78% | 0.784 | 83% | 0.83 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 148.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 466 | L | 47.1 | Very low | 51 | Low | 172 Ų | 172 | 133.6 Ų | 133.6 | 90% | 0.901 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -75.6 | 132.2 | 179.3 | -66.6 | 169.9 | 0 | 0 | 0 | 112 | ||
| 467 | P | 64.4 | Low | 51 | Low | 122 Ų | 122 | 133.2 Ų | 133.2 | 79% | 0.792 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -64.6 | 147.5 | 162.4 | -19.6 | 33.5 | 0 | 0 | 0 | 111.6 | ||
| 468 | G | 52.6 | Low | 50.4 | Low | 79 Ų | 79 | 134.5 Ų | 134.5 | 81% | 0.814 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -69.4 | 151.5 | -176 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 469 | E | 52.1 | Low | 50.4 | Low | 204 Ų | 204 | 133.2 Ų | 133.2 | 95% | 0.953 | 82% | 0.815 | S | S | * | * | P | Polyproline II helix | trans | -66.5 | 144.8 | -177.4 | -62.5 | -171 | 132.1 | 0 | 0 | 113.3 | ||
| 470 | K | 57.2 | Low | 50.3 | Low | 206 Ų | 206 | 132.8 Ų | 132.8 | 90% | 0.896 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -95.4 | 130.4 | 173 | -171.3 | 179.8 | 179.3 | -173.8 | 0 | 109 | ||
| 471 | G | 48 | Very low | 49.7 | Very low | 73 Ų | 73 | 132.1 Ų | 132.1 | 75% | 0.753 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 142.7 | -171.9 | 0 | 0 | 0 | 0 | 0 | 114.9 | Q473 | G471-Q473 PolarHBondContact O-N 2.89Š|
| 472 | I | 47.1 | Very low | 49.5 | Very low | 176 Ų | 176 | 127.8 Ų | 127.8 | 90% | 0.903 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -58.8 | 126 | -178.3 | 46.2 | 173.2 | 0 | 0 | 0 | 112.9 | ||
| 473 | Q | 53.8 | Low | 49.2 | Very low | 173 Ų | 173 | 127.8 Ų | 127.8 | 81% | 0.808 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -88.4 | 143.5 | 166.6 | -176.7 | 171.8 | -30.8 | 0 | 0 | 108.9 | G471 | G471-Q473 PolarHBondContact O-N 2.89Š|
| 474 | G | 47.4 | Very low | 48.7 | Very low | 56 Ų | 56 | 127.3 Ų | 127.3 | 58% | 0.577 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 152.3 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q476 | G474-Q476 PolarHBondContact O-N 2.96Š|
| 475 | P | 41.3 | Very low | 48.1 | Very low | 138 Ų | 138 | 127.9 Ų | 127.9 | 90% | 0.896 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -64.3 | 117.4 | -172.1 | 26 | -34.5 | 0 | 0 | 0 | 111.8 | ||
| 476 | Q | 49.3 | Very low | 48 | Very low | 167 Ų | 167 | 127.2 Ų | 127.2 | 78% | 0.78 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -77.8 | 139.4 | 168.5 | -173.8 | 169 | -23.9 | 0 | 0 | 109.1 | G474 | G474-Q476 PolarHBondContact O-N 2.96Š|
| 477 | G | 42.6 | Very low | 48 | Very low | 63 Ų | 63 | 125.3 Ų | 125.3 | 65% | 0.649 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 141.4 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | P479 | G477-P479 WeakPolarHBondContact O-CD 3.36Å; G477-P479 VanDerWaalsContact O-N 3.17Å |
| 478 | I | 40.8 | Very low | 47.1 | Very low | 171 Ų | 171 | 128 Ų | 128 | 88% | 0.877 | 80% | 0.799 | S | S | * | * | trans | -56.5 | 112.3 | -169.8 | -53.2 | 173.3 | 0 | 0 | 0 | 110.7 | ||||
| 479 | P | 50.7 | Low | 46.9 | Very low | 98 Ų | 98 | 127.4 Ų | 127.4 | 64% | 0.636 | 79% | 0.793 | S | S | * | * | trans | -69.9 | 156 | 168.1 | -14.2 | 31.3 | 0 | 0 | 0 | 110.2 | G477 | G477-P479 WeakPolarHBondContact O-CD 3.36Å; G477-P479 VanDerWaalsContact O-N 3.17Å | ||
| 480 | G | 42.2 | Very low | 46.5 | Very low | 67 Ų | 67 | 122.9 Ų | 122.9 | 69% | 0.691 | 78% | 0.784 | S | S | * | * | trans | -56.6 | 146.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | D482 | G480-D482 PolarHBondContact O-N 2.94Š| ||
| 481 | I | 41 | Very low | 46.4 | Very low | 175 Ų | 175 | 118.8 Ų | 118.8 | 90% | 0.897 | 78% | 0.778 | S | S | * | * | trans | -66.9 | 99.9 | 179.8 | 46.3 | 165.8 | 0 | 0 | 0 | 110.9 | G483 | I481-G483 PolarHBondContact O-N 2.89Š| ||
| 482 | D | 47.6 | Very low | 46.2 | Very low | 157 Ų | 157 | 118.3 Ų | 118.3 | 84% | 0.84 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -54.6 | 130.8 | 168.6 | -81.9 | -37.9 | 0 | 0 | 0 | 109.7 | G480 T484 | G480-D482 PolarHBondContact O-N 2.94Å; D482-T484 PolarHBondContact O-N 2.84Å |
| 483 | G | 46.5 | Very low | 46.1 | Very low | 73 Ų | 73 | 116.1 Ų | 116.1 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 132.2 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111 | I481 A485 | I481-G483 PolarHBondContact O-N 2.89Å; G483-A485 PolarHBondContact O-N 2.89Å; G483-A485 VanDerWaalsContact O-N 3.1Å |
| 484 | T | 42.6 | Very low | 46.1 | Very low | 140 Ų | 140 | 114.6 Ų | 114.6 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -50.7 | 119.5 | -174.9 | 49 | 0 | 0 | 0 | 0 | 111 | D482 G486 | D482-T484 PolarHBondContact O-N 2.84Å; T484-G486 PolarHBondContact O-N 3.26Å |
| 485 | A | 45.8 | Very low | 45.8 | Very low | 99 Ų | 99 | 114.5 Ų | 114.5 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -53.5 | 127.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 110.3 | G483 | G483-A485 PolarHBondContact O-N 2.89Å; G483-A485 VanDerWaalsContact O-N 3.1Å |
| 486 | G | 48.5 | Very low | 46.1 | Very low | 63 Ų | 63 | 114.1 Ų | 114.1 | 65% | 0.649 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55 | 143.9 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.1 | T484 M488 | T484-G486 PolarHBondContact O-N 3.26Å; G486-M488 PolarHBondContact O-N 3.25Å |
| 487 | P | 45.8 | Very low | 46.4 | Very low | 131 Ų | 131 | 115 Ų | 115 | 85% | 0.851 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 126.3 | -172.9 | 22.2 | -33.5 | 0 | 0 | 0 | 110.3 | G489 | P487-G489 PolarHBondContact O-N 2.76Š|
| 488 | M | 46.8 | Very low | 46.6 | Very low | 180 Ų | 180 | 114.9 Ų | 114.9 | 89% | 0.887 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -55 | 123.8 | -179.4 | -173.9 | -179.4 | -64 | 0 | 0 | 109.3 | G486 S490 | G486-M488 PolarHBondContact O-N 3.25Å; M488-S490 PolarHBondContact O-N 3.24Å |
| 489 | G | 47.7 | Very low | 46.9 | Very low | 66 Ų | 66 | 115.9 Ų | 115.9 | 68% | 0.68 | 77% | 0.771 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 128.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | P487 | P487-G489 PolarHBondContact O-N 2.76Š|
| 490 | S | 44.4 | Very low | 47 | Very low | 109 Ų | 109 | 118.1 Ų | 118.1 | 76% | 0.762 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 131.4 | -177.4 | 55.5 | 0 | 0 | 0 | 0 | 111.1 | M488 G492 | M488-S490 PolarHBondContact O-N 3.24Å; S490-G492 PolarHBondContact O-N 2.82Å |
| 491 | P | 54.8 | Low | 47.1 | Very low | 120 Ų | 120 | 118.5 Ų | 118.5 | 78% | 0.779 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 133.6 | 177.3 | -29.3 | 35.4 | 0 | 0 | 0 | 111.5 | ||
| 492 | G | 42.7 | Very low | 47.5 | Very low | 63 Ų | 63 | 118.1 Ų | 118.1 | 65% | 0.649 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 136.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | S490 T494 | S490-G492 PolarHBondContact O-N 2.82Å; G492-T494 PolarHBondContact O-N 3.09Å |
| 493 | P | 45.3 | Very low | 48 | Very low | 130 Ų | 130 | 116.5 Ų | 116.5 | 84% | 0.844 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 128.2 | -174.6 | 23.8 | -33.7 | 0 | 0 | 0 | 110 | G495 | P493-G495 PolarHBondContact O-N 2.79Š|
| 494 | T | 53.8 | Low | 48.2 | Very low | 140 Ų | 140 | 116 Ų | 116 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -54 | 125.6 | 179.1 | -49.5 | 0 | 0 | 0 | 0 | 109.5 | G492 | G492-T494 PolarHBondContact O-N 3.09Š|
| 495 | G | 41.5 | Very low | 48.6 | Very low | 55 Ų | 55 | 115.1 Ų | 115.1 | 57% | 0.567 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 142.4 | -176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | P493 K497 | P493-G495 PolarHBondContact O-N 2.79Å; G495-K497 PolarHBondContact O-N 3.33Å |
| 496 | P | 47.3 | Very low | 48.8 | Very low | 129 Ų | 129 | 116.8 Ų | 116.8 | 84% | 0.838 | 77% | 0.772 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 126.2 | -173.8 | 23.3 | -33.7 | 0 | 0 | 0 | 110.2 | G498 | P496-G498 PolarHBondContact O-N 3.31Š|
| 497 | K | 55.2 | Low | 48.7 | Very low | 187 Ų | 187 | 117.4 Ų | 117.4 | 81% | 0.813 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -58.1 | 123 | 174.4 | -178 | -179.4 | 177.5 | -177.7 | 0 | 108.1 | G495 E499 | G495-K497 PolarHBondContact O-N 3.33Å; K497-E499 PolarHBondContact O-N 3.48Å |
| 498 | G | 47.3 | Very low | 48.9 | Very low | 60 Ų | 60 | 117.7 Ų | 117.7 | 62% | 0.619 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 137.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | P496 N500 | P496-G498 PolarHBondContact O-N 3.31Å; G498-N500 PolarHBondContact O-N 3.18Å |
| 499 | E | 47 | Very low | 48.8 | Very low | 192 Ų | 192 | 114.2 Ų | 114.2 | 90% | 0.897 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 135.6 | -177.6 | -61.6 | -176.8 | 135.4 | 0 | 0 | 110.3 | K497 G501 | K497-E499 PolarHBondContact O-N 3.48Å; E499-G501 PolarHBondContact O-N 2.94Å |
| 500 | N | 52.4 | Low | 48.6 | Very low | 145 Ų | 145 | 117.5 Ų | 117.5 | 78% | 0.775 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -63 | 130.1 | 169.9 | -85.2 | 1.9 | 0 | 0 | 0 | 108.4 | G498 L502 | G498-N500 PolarHBondContact O-N 3.18Å; N500-L502 PolarHBondContact O-N 2.89Å |
| 501 | G | 45.6 | Very low | 49 | Very low | 74 Ų | 74 | 121 Ų | 121 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 139.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | E499 | E499-G501 PolarHBondContact O-N 2.94Š|
| 502 | L | 49.5 | Very low | 48.7 | Very low | 167 Ų | 167 | 118.5 Ų | 118.5 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -55.4 | 138 | -176.9 | -68.8 | 169.6 | 0 | 0 | 0 | 111.2 | N500 G504 | N500-L502 PolarHBondContact O-N 2.89Å; L502-G504 PolarHBondContact O-N 2.8Å |
| 503 | P | 56.6 | Low | 48.9 | Very low | 123 Ų | 123 | 120.8 Ų | 120.8 | 80% | 0.799 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -54.8 | 133.5 | 172.8 | -25.3 | 34.6 | 0 | 0 | 0 | 111.3 | ||
| 504 | G | 51.4 | Low | 49.3 | Very low | 64 Ų | 64 | 120.8 Ų | 120.8 | 66% | 0.66 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 147.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L502 | L502-G504 PolarHBondContact O-N 2.8Š|
| 505 | P | 51.8 | Low | 49.4 | Very low | 121 Ų | 121 | 117.6 Ų | 117.6 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 147.1 | -179.5 | 26 | -34.5 | 0 | 0 | 0 | 111.3 | G507 | P505-G507 PolarHBondContact O-N 2.91Š|
| 506 | P | 49.3 | Very low | 49.9 | Very low | 134 Ų | 134 | 123 Ų | 123 | 87% | 0.87 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -57 | 120.5 | -178.1 | -26 | 35.1 | 0 | 0 | 0 | 112.5 | ||
| 507 | G | 46.7 | Very low | 50.6 | Low | 75 Ų | 75 | 122.8 Ų | 122.8 | 77% | 0.773 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 134.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | P505 | P505-G507 PolarHBondContact O-N 2.91Š|
| 508 | T | 49.4 | Very low | 50.5 | Low | 137 Ų | 137 | 117 Ų | 117 | 84% | 0.84 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -68 | 144.6 | 168.7 | 42.7 | 0 | 0 | 0 | 0 | 110.4 | V510 | T508-V510 PolarHBondContact O-N 3.34Š|
| 509 | A | 45.6 | Very low | 50.7 | Low | 108 Ų | 108 | 120.4 Ų | 120.4 | 89% | 0.893 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -73.9 | 94.2 | -165 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||
| 510 | V | 42.7 | Very low | 51.1 | Low | 134 Ų | 134 | 116.1 Ų | 116.1 | 81% | 0.812 | 81% | 0.806 | S | S | * | * | trans | -132.1 | 142.8 | 157.3 | -175.7 | 0 | 0 | 0 | 0 | 108.1 | T508 G512 | T508-V510 PolarHBondContact O-N 3.34Å; V510-G512 PolarHBondContact O-N 2.86Å | ||
| 511 | I | 53.6 | Low | 51 | Low | 182 Ų | 182 | 112.3 Ų | 112.3 | 93% | 0.933 | 80% | 0.801 | S | S | * | * | trans | -68 | 119.5 | -171.4 | -62.4 | 168.4 | 0 | 0 | 0 | 110.7 | ||||
| 512 | G | 48.3 | Very low | 51.2 | Low | 68 Ų | 68 | 115.1 Ų | 115.1 | 70% | 0.701 | 81% | 0.806 | S | S | * | * | trans | -162.7 | 148.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | V510 | V510-G512 PolarHBondContact O-N 2.86Š| ||
| 513 | S | 45.8 | Very low | 51.6 | Low | 112 Ų | 112 | 116 Ų | 116 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -61.2 | 151.7 | -173.1 | 49.6 | 0 | 0 | 0 | 0 | 114.6 | G515 | S513-G515 PolarHBondContact O-N 2.78Š|
| 514 | P | 54.3 | Low | 51.2 | Low | 129 Ų | 129 | 113.1 Ų | 113.1 | 84% | 0.838 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 136.5 | 173.8 | -25 | 34.4 | 0 | 0 | 0 | 113.1 | ||
| 515 | G | 55.4 | Low | 51.1 | Low | 74 Ų | 74 | 121.9 Ų | 121.9 | 76% | 0.763 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -68.3 | 145.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | S513 | S513-G515 PolarHBondContact O-N 2.78Š|
| 516 | L | 53.8 | Low | 51.7 | Low | 169 Ų | 169 | 125.1 Ų | 125.1 | 89% | 0.885 | 82% | 0.816 | S | S | * | * | P | Polyproline II helix | trans | -64.8 | 144.1 | 176.8 | -72.5 | 168.4 | 0 | 0 | 0 | 111.4 | ||
| 517 | P | 61.6 | Low | 51.7 | Low | 123 Ų | 123 | 121.7 Ų | 121.7 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -56.9 | 139 | 172.7 | -24.4 | 34.4 | 0 | 0 | 0 | 112.1 | ||
| 518 | G | 51.7 | Low | 52 | Low | 66 Ų | 66 | 124.3 Ų | 124.3 | 68% | 0.68 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 148.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||
| 519 | P | 52.4 | Low | 52.4 | Low | 132 Ų | 132 | 123.6 Ų | 123.6 | 86% | 0.857 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -62.7 | 143.2 | -179.9 | 27.1 | -34.8 | 0 | 0 | 0 | 111.3 | G521 | P519-G521 PolarHBondContact O-N 2.86Š|
| 520 | A | 55.3 | Low | 52.6 | Low | 101 Ų | 101 | 121.9 Ų | 121.9 | 84% | 0.835 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -62.2 | 136.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 521 | G | 50.8 | Low | 53.1 | Low | 66 Ų | 66 | 123.4 Ų | 123.4 | 68% | 0.68 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -61.8 | 149.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | P519 | P519-G521 PolarHBondContact O-N 2.86Š|
| 522 | P | 49.8 | Very low | 53.6 | Low | 132 Ų | 132 | 120.4 Ų | 120.4 | 86% | 0.857 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -62.3 | 140.6 | -177.8 | 26.5 | -34.7 | 0 | 0 | 0 | 111.5 | G524 | P522-G524 PolarHBondContact O-N 2.86Š|
| 523 | Q | 56.6 | Low | 53.7 | Low | 186 Ų | 186 | 120.6 Ų | 120.6 | 87% | 0.869 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 128.5 | 177 | -177.5 | 175.4 | -12.1 | 0 | 0 | 110.6 | ||
| 524 | G | 49.9 | Very low | 54.1 | Low | 62 Ų | 62 | 124.1 Ų | 124.1 | 64% | 0.639 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 136.9 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111 | P522 | P522-G524 PolarHBondContact O-N 2.86Š|
| 525 | R | 48.5 | Very low | 54.5 | Low | 248 Ų | 248 | 124 Ų | 124 | 94% | 0.936 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 142.4 | 174.5 | -71.9 | -176.5 | 172.9 | -174.5 | -3.2 | 110.1 | ||
| 526 | E | 63.5 | Low | 54.3 | Low | 189 Ų | 189 | 123.8 Ų | 123.8 | 88% | 0.883 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 145.2 | 170 | -65.9 | -179.6 | 121.3 | 0 | 0 | 110.7 | ||
| 527 | G | 50.9 | Low | 54.4 | Low | 63 Ų | 63 | 124.6 Ų | 124.6 | 65% | 0.649 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -70 | 153.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | S529 | G527-S529 PolarHBondContact O-N 2.91Š|
| 528 | P | 51.3 | Low | 54.7 | Low | 130 Ų | 130 | 124.9 Ų | 124.9 | 84% | 0.844 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 134.8 | 175.3 | 27.6 | -34.4 | 0 | 0 | 0 | 110.5 | G530 | P528-G530 PolarHBondContact O-N 2.8Š|
| 529 | S | 59.4 | Low | 54.6 | Low | 121 Ų | 121 | 124.7 Ų | 124.7 | 85% | 0.846 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -54.9 | 136.5 | 175.7 | -55.1 | 0 | 0 | 0 | 0 | 111.2 | G527 | G527-S529 PolarHBondContact O-N 2.91Š|
| 530 | G | 48.9 | Very low | 55.1 | Low | 72 Ų | 72 | 123.8 Ų | 123.8 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 145.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | P528 | P528-G530 PolarHBondContact O-N 2.8Š|
| 531 | L | 53.8 | Low | 55.9 | Low | 166 Ų | 166 | 125 Ų | 125 | 87% | 0.869 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 139 | 174.7 | -68.7 | 174.4 | 0 | 0 | 0 | 110 | G533 | L531-G533 PolarHBondContact O-N 2.8Š|
| 532 | P | 63.4 | Low | 55.9 | Low | 120 Ų | 120 | 124.7 Ų | 124.7 | 78% | 0.779 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -55 | 134.5 | 171.6 | -25.1 | 34.5 | 0 | 0 | 0 | 111 | ||
| 533 | G | 50.9 | Low | 56.3 | Low | 72 Ų | 72 | 124.1 Ų | 124.1 | 74% | 0.742 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 141.5 | 171.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | L531 | L531-G533 PolarHBondContact O-N 2.8Š|
| 534 | Q | 55 | Low | 57 | Low | 186 Ų | 186 | 119.1 Ų | 119.1 | 87% | 0.869 | 77% | 0.77 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 140.5 | 173.1 | -67.9 | -174.6 | -2.1 | 0 | 0 | 109.5 | G536 | Q534-G536 PolarHBondContact O-N 2.98Š|
| 535 | P | 61.8 | Low | 56.9 | Low | 125 Ų | 125 | 119.1 Ų | 119.1 | 81% | 0.812 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -54.2 | 132.8 | 171 | -25 | 34.5 | 0 | 0 | 0 | 110.5 | ||
| 536 | G | 51.2 | Low | 57.3 | Low | 71 Ų | 71 | 112.9 Ų | 112.9 | 73% | 0.732 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -60 | 144.3 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | Q534 | Q534-G536 PolarHBondContact O-N 2.98Š|
| 537 | Q | 56.3 | Low | 57.2 | Low | 186 Ų | 186 | 109.3 Ų | 109.3 | 87% | 0.869 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 141.4 | 169.7 | -68.2 | -173.6 | -5.1 | 0 | 0 | 109.1 | G539 | Q537-G539 PolarHBondContact O-N 2.89Š|
| 538 | P | 66.3 | Low | 56.8 | Low | 128 Ų | 128 | 109.6 Ų | 109.6 | 83% | 0.831 | 76% | 0.757 | S | S | * | * | P | Polyproline II helix | trans | -53 | 131.2 | 171 | -25.1 | 34.6 | 0 | 0 | 0 | 110.1 | ||
| 539 | G | 50.8 | Low | 56.5 | Low | 62 Ų | 62 | 112 Ų | 112 | 64% | 0.639 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -62.5 | 151.6 | 171.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | Q537 | Q537-G539 PolarHBondContact O-N 2.89Š|
| 540 | P | 63.2 | Low | 55.7 | Low | 113 Ų | 113 | 110.6 Ų | 110.6 | 73% | 0.734 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 150.6 | 168.7 | 27.8 | -34.6 | 0 | 0 | 0 | 109.7 | G542 | P540-G542 PolarHBondContact O-N 3.14Š|
| 541 | P | 71.6 | Confident | 55.1 | Low | 126 Ų | 126 | 114.1 Ų | 114.1 | 82% | 0.818 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 136.1 | 171.3 | -25.6 | 34.9 | 0 | 0 | 0 | 110.6 | ||
| 542 | G | 51.5 | Low | 54.4 | Low | 61 Ų | 61 | 112.7 Ų | 112.7 | 63% | 0.629 | 74% | 0.739 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 145.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | P540 | P540-G542 PolarHBondContact O-N 3.14Š|
| 543 | P | 58.2 | Low | 53.3 | Low | 119 Ų | 119 | 109.5 Ų | 109.5 | 77% | 0.773 | 72% | 0.72 | S | S | * | * | P | Polyproline II helix | trans | -56.7 | 149.2 | 172.6 | 26.6 | -34.7 | 0 | 0 | 0 | 109.5 | G545 | P543-G545 PolarHBondContact O-N 3.18Š|
| 544 | P | 70.1 | Confident | 53 | Low | 82 Ų | 82 | 112 Ų | 112 | 53% | 0.532 | 72% | 0.723 | S | S | . | * | P | Polyproline II helix | trans | -49.4 | 135.4 | 175.2 | -27.4 | 35.1 | 0 | 0 | 0 | 110.9 | ||
| 545 | G | 48.6 | Very low | 52.5 | Low | 61 Ų | 61 | 111.6 Ų | 111.6 | 63% | 0.629 | 72% | 0.721 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 150.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | P543 | P543-G545 PolarHBondContact O-N 3.18Š|
| 546 | P | 57.6 | Low | 51.9 | Low | 118 Ų | 118 | 109.2 Ų | 109.2 | 77% | 0.766 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -54.3 | 146.4 | 172.3 | 26.2 | -34.6 | 0 | 0 | 0 | 109.4 | G548 | P546-G548 PolarHBondContact O-N 3.09Å; P546-G548 VanDerWaalsContact O-N 3.16Å |
| 547 | P | 60.1 | Low | 51.3 | Low | 113 Ų | 113 | 108.8 Ų | 108.8 | 73% | 0.734 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -49.2 | 125.9 | 177.8 | -27.8 | 35.1 | 0 | 0 | 0 | 110.4 | E549 | P547-E549 PolarHBondContact O-N 2.92Š|
| 548 | G | 42.4 | Very low | 50.5 | Low | 69 Ų | 69 | 103 Ų | 103 | 71% | 0.711 | 68% | 0.68 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 140.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.3 | P546 | P546-G548 PolarHBondContact O-N 3.09Å; P546-G548 VanDerWaalsContact O-N 3.16Å |
| 549 | E | 46.2 | Very low | 49.4 | Very low | 182 Ų | 182 | 102.7 Ų | 102.7 | 85% | 0.85 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -55.2 | 136.6 | -180 | -67.4 | -168.7 | 150.2 | 0 | 0 | 110.2 | P547 V551 | P547-E549 PolarHBondContact O-N 2.92Å; E549-V551 PolarHBondContact O-N 2.93Å |
| 550 | P | 42.2 | Very low | 48.9 | Very low | 90 Ų | 90 | 105.7 Ų | 105.7 | 58% | 0.584 | 68% | 0.676 | S | S | * | * | trans | -60.5 | 113.8 | -174.2 | 23.2 | -34 | 0 | 0 | 0 | 110.7 | F552 | P550-F552 HydrophobicContact CB-CD2 4.18Å; P550-F552 HydrophobicContact CB-CE1 4.5Å; P550-F552 HydrophobicContact CB-CE2 3.82Å; P550-F552 HydrophobicContact CB-CZ 3.99Å; P550-F552 HydrophobicContact CG-CD2 4.11Å; P550-F552 HydrophobicContact CG-CE2 3.45Å; P550-F552 VanDerWaalsContact CG-CE2 3.45Å; P550-F552 HydrophobicContact CG-CZ 3.86Å; P550-F552 VanDerWaalsContact O-CD2 3.31Å; P550-F552 WeakPolarHBondContact O-CD2 3.35Å; P550-F552 PolarHBondContact O-N 2.87Å | ||
| 551 | V | 36.5 | Very low | 47.6 | Very low | 147 Ų | 147 | 105.4 Ų | 105.4 | 89% | 0.891 | 68% | 0.677 | S | S | * | * | trans | -72.1 | 79.6 | 173 | -175.9 | 0 | 0 | 0 | 0 | 108.4 | E549 S553 | E549-V551 PolarHBondContact O-N 2.93Å; V551-S553 PolarHBondContact O-N 3.32Å | ||
| 552 | F | 38.8 | Very low | 46 | Very low | 136 Ų | 136 | 108.2 Ų | 108.2 | 60% | 0.596 | 68% | 0.679 | S | S | * | * | trans | -63.6 | 116 | 172.8 | -69.4 | -71.4 | 0 | 0 | 0 | 109.4 | P550 | P550-F552 HydrophobicContact CB-CD2 4.18Å; P550-F552 HydrophobicContact CB-CE1 4.5Å; P550-F552 HydrophobicContact CB-CE2 3.82Å; P550-F552 HydrophobicContact CB-CZ 3.99Å; P550-F552 HydrophobicContact CG-CD2 4.11Å; P550-F552 HydrophobicContact CG-CE2 3.45Å; P550-F552 VanDerWaalsContact CG-CE2 3.45Å; P550-F552 HydrophobicContact CG-CZ 3.86Å; P550-F552 VanDerWaalsContact O-CD2 3.31Å; P550-F552 WeakPolarHBondContact O-CD2 3.35Å; P550-F552 PolarHBondContact O-N 2.87Å | ||
| 553 | S | 40 | Very low | 45.2 | Very low | 53 Ų | 53 | 114 Ų | 114 | 37% | 0.371 | 69% | 0.692 | S | S | . | * | trans | -65.7 | 143.5 | 165.9 | 55.8 | 0 | 0 | 0 | 0 | 109.4 | V551 E555 M556 | V551-S553 PolarHBondContact O-N 3.32Å; S553-E555 PolarHBondContact O-N 3.18Å; S553-M556 PolarHBondContact O-N 3.25Å; S553-M556 VanDerWaalsContact O-N 3.1Å | ||
| 554 | P | 43.7 | Very low | 44 | Very low | 125 Ų | 125 | 111 Ų | 111 | 81% | 0.812 | 68% | 0.683 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -20.3 | -177.6 | -28.9 | 36.5 | 0 | 0 | 0 | 115.1 | ||
| 555 | E | 45.4 | Very low | 42.4 | Very low | 176 Ų | 176 | 113.6 Ų | 113.6 | 82% | 0.822 | 70% | 0.699 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.7 | -23.7 | -179.9 | -66.2 | 175.3 | 121.1 | 0 | 0 | 113.7 | S553 | S553-E555 PolarHBondContact O-N 3.18Š|
| 556 | M | 48.4 | Very low | 41.6 | Very low | 76 Ų | 76 | 114 Ų | 114 | 37% | 0.374 | 70% | 0.703 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -85.3 | -17 | 177.9 | -77.2 | -169.5 | 171.6 | 0 | 0 | 114.1 | S553 G558 V559 M725 | S553-M556 PolarHBondContact O-N 3.25Å; S553-M556 VanDerWaalsContact O-N 3.1Å; M556-G558 PolarHBondContact O-N 3.36Å; M556-V559 PolarHBondContact O-N 3.25Å; M556-M725 HydrophobicContact CE-CE 4.05Å; M556-M725 HydrophobicContact CE-SD 3.73Å |
| 557 | A | 39.5 | Very low | 40.8 | Very low | 62 Ų | 62 | 117 Ų | 117 | 51% | 0.512 | 71% | 0.712 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -62.7 | -26 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | V559 | A557-V559 PolarHBondContact O-N 3.1Š|
| 558 | G | 38.7 | Very low | 39.5 | Very low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 72% | 0.717 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.2 | -23.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | M556 | M556-G558 PolarHBondContact O-N 3.36Š|
| 559 | V | 44.4 | Very low | 39.3 | Very low | 121 Ų | 121 | 119 Ų | 119 | 73% | 0.733 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -86.2 | -24 | -171.2 | -173 | 0 | 0 | 0 | 0 | 112.4 | M556 A557 S561 | M556-V559 PolarHBondContact O-N 3.25Å; A557-V559 PolarHBondContact O-N 3.1Å; V559-S561 VanDerWaalsContact C-N 3.3Å; V559-S561 PolarHBondContact O-N 3.35Å |
| 560 | L | 38.9 | Very low | 38.6 | Very low | 125 Ų | 125 | 117.1 Ų | 117.1 | 65% | 0.654 | 72% | 0.717 | S | S | * | * | G | 310 helix | trans | -80.4 | -1.1 | -174.5 | -75.7 | 167.2 | 0 | 0 | 0 | 115 | ||
| 561 | S | 37.3 | Very low | 37.9 | Very low | 107 Ų | 107 | 122 Ų | 122 | 75% | 0.748 | 73% | 0.729 | S | S | * | * | G | 310 helix | trans | -97.7 | -9.6 | -173.2 | -65.3 | 0 | 0 | 0 | 0 | 115.6 | V559 | V559-S561 VanDerWaalsContact C-N 3.3Å; V559-S561 PolarHBondContact O-N 3.35Å |
| 562 | E | 38.1 | Very low | 37.9 | Very low | 185 Ų | 185 | 120.4 Ų | 120.4 | 86% | 0.864 | 73% | 0.731 | S | S | * | * | trans | -111 | 88.3 | 179.9 | -164.8 | 161.7 | -154.7 | 0 | 0 | 111 | G564 | E562-G564 PolarHBondContact O-N 2.96Š| ||
| 563 | M | 33.4 | Very low | 37.4 | Very low | 183 Ų | 183 | 117.2 Ų | 117.2 | 90% | 0.901 | 74% | 0.736 | S | S | * | * | trans | -68.8 | 110.7 | 178.7 | -71.8 | -177.4 | 173.3 | 0 | 0 | 111.7 | ||||
| 564 | G | 33.9 | Very low | 36.8 | Very low | 56 Ų | 56 | 120.7 Ų | 120.7 | 58% | 0.577 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -60 | 158.4 | 160.1 | 0 | 0 | 0 | 0 | 0 | 112 | E562 G566 | E562-G564 PolarHBondContact O-N 2.96Å; G564-G566 PolarHBondContact O-N 3.37Å |
| 565 | P | 36.8 | Very low | 36.4 | Very low | 136 Ų | 136 | 125.9 Ų | 125.9 | 88% | 0.883 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -59.3 | 133.5 | -174.8 | 24.4 | -34.1 | 0 | 0 | 0 | 111.8 | ||
| 566 | G | 32.3 | Very low | 35.8 | Very low | 69 Ų | 69 | 121 Ų | 121 | 71% | 0.711 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 137.7 | -164.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | G564 D568 | G564-G566 PolarHBondContact O-N 3.37Å; G566-D568 PolarHBondContact O-N 2.84Å |
| 567 | L | 39.9 | Very low | 34.9 | Very low | 181 Ų | 181 | 127.4 Ų | 127.4 | 95% | 0.948 | 79% | 0.788 | S | S | * | * | trans | -76.6 | 71.8 | 167.5 | -69.6 | 172.8 | 0 | 0 | 0 | 110.3 | G569 | L567-G569 PolarHBondContact O-N 2.89Š| ||
| 568 | D | 32.3 | Very low | 34.9 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 83% | 0.834 | 81% | 0.808 | S | S | * | * | trans | -59.2 | 118.3 | 169.3 | -103.3 | -40.1 | 0 | 0 | 0 | 109.8 | G566 V570 | G566-D568 PolarHBondContact O-N 2.84Å; D568-V570 PolarHBondContact O-N 2.92Å; D568-V570 VanDerWaalsContact O-N 3.08Å | ||
| 569 | G | 37.9 | Very low | 34.5 | Very low | 67 Ų | 67 | 137.1 Ų | 137.1 | 69% | 0.691 | 82% | 0.815 | S | S | * | * | trans | -61.2 | 112.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L567 K571 | L567-G569 PolarHBondContact O-N 2.89Å; G569-K571 PolarHBondContact O-N 2.91Å | ||
| 570 | V | 32.1 | Very low | 34.1 | Very low | 144 Ų | 144 | 140.9 Ų | 140.9 | 87% | 0.873 | 82% | 0.821 | S | S | * | * | trans | -62.2 | 106.9 | -177 | -178.6 | 0 | 0 | 0 | 0 | 110.2 | D568 A572 | D568-V570 PolarHBondContact O-N 2.92Å; D568-V570 VanDerWaalsContact O-N 3.08Å; V570-A572 PolarHBondContact O-N 3.49Å | ||
| 571 | K | 28.5 | Very low | 33.8 | Very low | 191 Ų | 191 | 146.3 Ų | 146.3 | 83% | 0.83 | 84% | 0.835 | S | S | * | * | trans | -55.9 | 129.8 | 178.1 | -72.8 | 174.1 | 177.3 | 168.2 | 0 | 110.9 | G569 G573 | G569-K571 PolarHBondContact O-N 2.91Å; K571-G573 PolarHBondContact O-N 3.09Å | ||
| 572 | A | 34.9 | Very low | 33.5 | Very low | 115 Ų | 115 | 145.1 Ų | 145.1 | 95% | 0.95 | 84% | 0.84 | S | S | * | * | trans | -60.2 | 103.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.1 | V570 | V570-A572 PolarHBondContact O-N 3.49Š| ||
| 573 | G | 29.3 | Very low | 33.2 | Very low | 68 Ų | 68 | 140.2 Ų | 140.2 | 70% | 0.701 | 84% | 0.839 | S | S | * | * | trans | -124.1 | 95.2 | -162.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | K571 | K571-G573 PolarHBondContact O-N 3.09Š| ||
| 574 | S | 27.1 | Very low | 33 | Very low | 127 Ų | 127 | 135.6 Ų | 135.6 | 89% | 0.888 | 84% | 0.838 | S | S | * | * | trans | 70.7 | 147.8 | 162.7 | -154.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 575 | Y | 35.6 | Very low | 32.9 | Very low | 234 Ų | 234 | 136.4 Ų | 136.4 | 92% | 0.918 | 85% | 0.846 | S | S | * | * | trans | -79.6 | 145.5 | 175.2 | -88.3 | -117.3 | 0 | 0 | 0 | 111.8 | ||||
| 576 | G | 33.2 | Very low | 32.8 | Very low | 72 Ų | 72 | 135 Ų | 135 | 74% | 0.742 | 85% | 0.846 | S | S | * | * | trans | 117.2 | 84.5 | 133.9 | 0 | 0 | 0 | 0 | 0 | 119 | ||||
| 577 | K | 29 | Very low | 33.1 | Very low | 212 Ų | 212 | 139.2 Ų | 139.2 | 92% | 0.922 | 85% | 0.847 | S | S | * | * | trans | -157.6 | 138.3 | 134 | -115.4 | 167.5 | -174.2 | 174.5 | 0 | 111.3 | ||||
| 578 | K | 38.6 | Very low | 33.3 | Very low | 215 Ų | 215 | 137.6 Ų | 137.6 | 94% | 0.935 | 84% | 0.844 | S | S | * | * | trans | -83.8 | 114.9 | 170.9 | -72.2 | -178.4 | 176.2 | 179.8 | 0 | 109.4 | ||||
| 579 | S | 30.4 | Very low | 33.7 | Very low | 115 Ų | 115 | 136.7 Ų | 136.7 | 80% | 0.804 | 84% | 0.837 | S | S | * | * | trans | -91.4 | 130.1 | 159.1 | 40.1 | 0 | 0 | 0 | 0 | 109.4 | Y581 | S579-Y581 PolarHBondContact O-N 3.35Š| ||
| 580 | K | 37.5 | Very low | 33.8 | Very low | 201 Ų | 201 | 135.3 Ų | 135.3 | 87% | 0.874 | 82% | 0.823 | S | S | * | * | trans | -79.8 | 109.3 | 165.4 | -83.1 | -179.5 | 171.1 | -178.6 | 0 | 108.1 | ||||
| 581 | Y | 32.6 | Very low | 34.3 | Very low | 239 Ų | 239 | 135.2 Ų | 135.2 | 94% | 0.937 | 83% | 0.828 | S | S | * | * | trans | -172.7 | 147.6 | 133.8 | -95.2 | -68.9 | 0 | 0 | 0 | 106.3 | S579 | S579-Y581 PolarHBondContact O-N 3.35Š| ||
| 582 | G | 31.1 | Very low | 34.9 | Very low | 82 Ų | 82 | 129.8 Ų | 129.8 | 85% | 0.845 | 81% | 0.814 | S | S | * | * | trans | -110.3 | 141.4 | -167.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 583 | G | 30.2 | Very low | 35.4 | Very low | 82 Ų | 82 | 126.8 Ų | 126.8 | 85% | 0.845 | 80% | 0.795 | S | S | * | * | trans | 133.1 | 141.9 | 170.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 584 | G | 30.3 | Very low | 36.9 | Very low | 86 Ų | 86 | 129 Ų | 129 | 89% | 0.887 | 79% | 0.79 | S | S | * | * | trans | 89.9 | 148.6 | 171.4 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 585 | G | 32.2 | Very low | 39.2 | Very low | 73 Ų | 73 | 127.5 Ų | 127.5 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | trans | -87 | 178.9 | 165.8 | 0 | 0 | 0 | 0 | 0 | 111.5 | E587 | G585-E587 PolarHBondContact O-N 2.94Š| ||
| 586 | A | 34.8 | Very low | 41.6 | Very low | 105 Ų | 105 | 120.9 Ų | 120.9 | 87% | 0.868 | 75% | 0.747 | S | S | * | * | trans | -77.1 | 101.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | V588 | A586-V588 PolarHBondContact O-N 3.45Š| ||
| 587 | E | 37 | Very low | 44.3 | Very low | 158 Ų | 158 | 117.5 Ų | 117.5 | 74% | 0.738 | 71% | 0.712 | S | S | * | * | trans | -70.7 | 119.4 | 169.2 | -66.8 | -179.4 | 148.8 | 0 | 0 | 110.1 | G585 M589 | G585-E587 PolarHBondContact O-N 2.94Å; E587-M589 HydrophobicContact CB-CG 4.39Å; E587-M589 PolarHBondContact O-N 3.42Å | ||
| 588 | V | 44.3 | Very low | 47.5 | Very low | 148 Ų | 148 | 108.2 Ų | 108.2 | 90% | 0.897 | 68% | 0.675 | S | S | * | * | trans | -82.6 | 73.5 | 173.1 | -174.8 | 0 | 0 | 0 | 0 | 108.3 | A586 G590 | A586-V588 PolarHBondContact O-N 3.45Å; V588-G590 PolarHBondContact O-N 2.94Å | ||
| 589 | M | 40.4 | Very low | 50.4 | Low | 137 Ų | 137 | 98.1 Ų | 98.1 | 68% | 0.675 | 63% | 0.631 | S | S | * | * | trans | -66.8 | 113.8 | 179.5 | -81.7 | -164.7 | 172.5 | 0 | 0 | 111.7 | E587 | E587-M589 HydrophobicContact CB-CG 4.39Å; E587-M589 PolarHBondContact O-N 3.42Å | ||
| 590 | G | 40.6 | Very low | 53.6 | Low | 38 Ų | 38 | 94.4 Ų | 94.4 | 39% | 0.392 | 60% | 0.604 | S | S | . | * | trans | -64.7 | 157.7 | 155.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | V588 S592 G593 | V588-G590 PolarHBondContact O-N 2.94Å; G590-S592 PolarHBondContact O-N 2.98Å; G590-G593 PolarHBondContact O-N 3.18Å | ||
| 591 | S | 42.9 | Very low | 56.4 | Low | 142 Ų | 142 | 84.9 Ų | 84.9 | 99% | 0.993 | 56% | 0.562 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.8 | 1.1 | -170 | 48.5 | 0 | 0 | 0 | 0 | 116.5 | ||
| 592 | S | 40.2 | Very low | 59.5 | Low | 77 Ų | 77 | 73.7 Ų | 73.7 | 54% | 0.538 | 52% | 0.519 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.8 | -5 | 176.4 | 59.7 | 0 | 0 | 0 | 0 | 114.5 | G590 L594 | G590-S592 PolarHBondContact O-N 2.98Å; S592-L594 PolarHBondContact O-N 3.18Å; S592-L594 VanDerWaalsContact O-N 3.17Å |
| 593 | G | 47.2 | Very low | 62.6 | Low | 52 Ų | 52 | 69.9 Ų | 69.9 | 54% | 0.536 | 48% | 0.479 | S | S | . | . | S | Bend | trans | 69.5 | 2.5 | -176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | G590 | G590-G593 PolarHBondContact O-N 3.18Š|
| 594 | L | 59.2 | Low | 65.6 | Low | 115 Ų | 115 | 68.6 Ų | 68.6 | 60% | 0.602 | 46% | 0.458 | S | S | * | . | P | Polyproline II helix | trans | -87.8 | 117.5 | 169.8 | -69.5 | 172.3 | 0 | 0 | 0 | 109.2 | S592 M596 | S592-L594 PolarHBondContact O-N 3.18Å; S592-L594 VanDerWaalsContact O-N 3.17Å; L594-M596 PolarHBondContact O-N 2.94Å |
| 595 | E | 76.1 | Confident | 68.5 | Low | 94 Ų | 94 | 67.9 Ų | 67.9 | 44% | 0.439 | 44% | 0.436 | S | S | . | . | P | Polyproline II helix | trans | -63.7 | 129.1 | 171.4 | -168.9 | 174.3 | -145.1 | 0 | 0 | 109.8 | Y621 G623 R624 | E595-Y621 VanDerWaalsContact CG-OH 3.31Å; E595-Y621 WeakPolarHBondContact CG-OH 3.48Å; E595-Y621 PolarHBondContact OE1-OH 3.49Å; E595-G623 WeakPolarHBondContact OE2-CA 3.24Å; E595-R624 VanDerWaalsContact O-CD 3.25Å; E595-R624 WeakPolarHBondContact O-CD 3.29Å; E595-R624 WeakPolarHBondContact O-CG 3.33Å; E595-R624 PolarHBondContact O-NH1 3.45Å |
| 596 | M | 85 | Confident | 71.5 | Confident | 96 Ų | 96 | 67.3 Ų | 67.3 | 47% | 0.473 | 42% | 0.419 | S | S | . | . | P | Polyproline II helix | trans | -78.2 | 150.2 | -174.6 | -71 | -66 | -176 | 0 | 0 | 111.8 | L594 A598 L721 | L594-M596 PolarHBondContact O-N 2.94Å; M596-A598 PolarHBondContact O-N 3.49Å; M596-L721 HydrophobicContact SD-CD2 4.16Å |
| 597 | P | 91.9 | Very high | 74.4 | Confident | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 40% | 0.4 | C | S | . | . | S | Bend | trans | -61.5 | 105.5 | 175.1 | -21 | 32 | 0 | 0 | 0 | 111.5 | R624 I638 Y642 Y720 L721 | P597-R624 VanDerWaalsContact CA-CD 3.47Å; P597-R624 VanDerWaalsContact N-CD 3.3Å; P597-I638 HydrophobicContact CG-CB 4.08Å; P597-I638 HydrophobicContact CG-CD1 3.74Å; P597-I638 HydrophobicContact CG-CG1 4.04Å; P597-Y642 HydrophobicContact CB-CE1 3.81Å; P597-Y642 WeakPolarHBondContact CB-OH 3.37Å; P597-Y720 CarbonylContact O-C 3.55Å; P597-Y720 VanDerWaalsContact O-CA 3.31Å; P597-Y720 WeakPolarHBondContact O-CA 3.46Å; P597-L721 HydrophobicContact CB-CB 4.29Å; P597-L721 HydrophobicContact CG-CB 4.34Å; P597-L721 HydrophobicContact CG-CD2 4.18Å; P597-L721 PolarHBondContact O-N 3.29Å |
| 598 | A | 95.9 | Very high | 77.1 | Confident | 18 Ų | 18 | 60.3 Ų | 60.3 | 15% | 0.149 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -154.9 | 145.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | M596 Y621 G719 | M596-A598 PolarHBondContact O-N 3.49Å; A598-Y621 HydrophobicContact CB-CD1 4.34Å; A598-Y621 HydrophobicContact CB-CE1 3.74Å; A598-Y621 WeakPolarHBondContact O-CD1 3.24Å; A598-Y621 WeakPolarHBondContact O-CE1 3.08Å; A598-G719 CarbonylContact C-O 3.52Å; A598-G719 VanDerWaalsContact CA-O 3.29Å; A598-G719 WeakPolarHBondContact CA-O 3.36Å |
| 599 | F | 97.8 | Very high | 79.5 | Confident | 2 Ų | 2 | 57.3 Ų | 57.3 | 1% | 0.009 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -147.9 | 158.6 | 175.1 | 76.7 | -80.1 | 0 | 0 | 0 | 112 | Y621 N622 Y627 F634 F644 F717 T718 G719 | F599-Y621 CarbonylContact C-O 3.59Å; F599-Y621 VanDerWaalsContact CA-O 3.25Å; F599-Y621 WeakPolarHBondContact CA-O 3.31Å; F599-N622 HydrophobicContact CB-CB 4.32Å; F599-Y627 HydrophobicContact CD2-CD1 4.1Å; F599-Y627 AromaticContact CD2-CD2 3.71Å; F599-Y627 HydrophobicContact CD2-CD2 3.71Å; F599-Y627 HydrophobicContact CD2-CE2 4.43Å; F599-Y627 AromaticContact CD2-CG 3.52Å; F599-Y627 HydrophobicContact CD2-CG 3.52Å; F599-Y627 AromaticContact CE2-CD2 3.47Å; F599-Y627 HydrophobicContact CE2-CD2 3.47Å; F599-Y627 VanDerWaalsContact CE2-CD2 3.47Å; F599-Y627 AromaticContact CE2-CE2 3.97Å; F599-Y627 HydrophobicContact CE2-CE2 3.97Å; F599-Y627 AromaticContact CE2-CG 3.82Å; F599-Y627 HydrophobicContact CE2-CG 3.82Å; F599-Y627 HydrophobicContact CG-CD2 4.37Å; F599-Y627 AromaticContact CG-CG 3.98Å; F599-Y627 HydrophobicContact CG-CG 3.98Å; F599-Y627 AromaticContact CZ-CD2 3.93Å; F599-Y627 HydrophobicContact CZ-CD2 3.93Å; F599-Y627 HydrophobicContact CZ-CG 4.48Å; F599-F634 AromaticContact CD1-CD2 3.43Å; F599-F634 HydrophobicContact CD1-CD2 3.43Å; F599-F634 VanDerWaalsContact CD1-CD2 3.43Å; F599-F634 AromaticContact CD1-CE2 4Å; F599-F634 HydrophobicContact CD1-CE2 4Å; F599-F634 HydrophobicContact CD1-CG 4.33Å; F599-F634 HydrophobicContact CE1-CB 3.85Å; F599-F634 AromaticContact CE1-CD2 3.34Å; F599-F634 HydrophobicContact CE1-CD2 3.34Å; F599-F634 HydrophobicContact CE1-CE2 4.12Å; F599-F634 AromaticContact CE1-CG 3.8Å; F599-F634 HydrophobicContact CE1-CG 3.8Å; F599-F634 HydrophobicContact CZ-CB 4.14Å; F599-F634 HydrophobicContact CZ-CD2 4.4Å; F599-F644 HydrophobicContact CE1-CD1 4.33Å; F599-F644 AromaticContact CE1-CE1 3.93Å; F599-F644 HydrophobicContact CE1-CE1 3.93Å; F599-F644 HydrophobicContact CZ-CD1 4.38Å; F599-F644 HydrophobicContact CZ-CE1 4.28Å; F599-F717 AromaticContact CE2-CD1 3.71Å; F599-F717 HydrophobicContact CE2-CD1 3.71Å; F599-F717 AromaticContact CE2-CE1 3.99Å; F599-F717 HydrophobicContact CE2-CE1 3.99Å; F599-F717 HydrophobicContact CE2-CG 4.12Å; F599-F717 AromaticContact CZ-CD1 3.83Å; F599-F717 HydrophobicContact CZ-CD1 3.83Å; F599-F717 AromaticContact CZ-CE1 3.63Å; F599-F717 HydrophobicContact CZ-CE1 3.63Å; F599-F717 HydrophobicContact CZ-CE2 4.37Å; F599-F717 HydrophobicContact CZ-CG 4.29Å; F599-F717 AromaticContact CZ-CZ 3.92Å; F599-F717 HydrophobicContact CZ-CZ 3.92Å; F599-T718 WeakPolarHBondContact O-CA 3.45Å; F599-T718 WeakPolarHBondContact O-CG2 3.11Å; F599-G719 WeakPolarHBondContact CD1-O 3.5Å; F599-G719 VanDerWaalsContact CE1-CA 3.44Å; F599-G719 VanDerWaalsContact CE1-N 3.31Å; F599-G719 PolarHBondContact N-O 3.35Å; F599-G719 PolarHBondContact O-N 3.24Å; F599-G719 VanDerWaalsContact O-N 3.12Å |
| 600 | T | 98.3 | Very high | 82.2 | Confident | 38 Ų | 38 | 53.3 Ų | 53.3 | 23% | 0.233 | 34% | 0.335 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.4 | 122.5 | 167.9 | -62.4 | 0 | 0 | 0 | 0 | 107.5 | L620 Y621 T718 | T600-L620 HydrophobicContact CG2-CB 4.11Å; T600-L620 HydrophobicContact CG2-CD1 4.03Å; T600-L620 HydrophobicContact CG2-CG 4.38Å; T600-L620 PolarHBondContact O-N 2.98Å; T600-Y621 PolarHBondContact N-O 2.65Å; T600-Y621 PolarHBondContact O-N 2.89Å; T600-Y621 VanDerWaalsContact O-N 3.09Å; T600-Y621 VanDerWaalsContact O-O 3.13Å; T600-T718 WeakPolarHBondContact CG2-OG1 3.08Å; T600-T718 PolarHBondContact OG1-OG1 3.28Å |
| 601 | A | 97.6 | Very high | 84.7 | Confident | 0 Ų | 0 | 53.9 Ų | 53.9 | 0% | 0 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 151.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | F616 L619 Y627 S716 F717 | A601-F616 HydrophobicContact CB-CB 3.62Å; A601-F616 WeakPolarHBondContact CB-O 3.45Å; A601-L619 HydrophobicContact CB-CD2 4.01Å; A601-Y627 HydrophobicContact CB-CD1 4.15Å; A601-Y627 HydrophobicContact CB-CE1 3.63Å; A601-S716 CarbonylContact O-C 3.58Å; A601-S716 VanDerWaalsContact O-CA 3.32Å; A601-S716 WeakPolarHBondContact O-CA 3.5Å; A601-F717 PolarHBondContact N-O 3.22Å; A601-F717 PolarHBondContact O-N 3.35Å |
| 602 | V | 97.6 | Very high | 87.2 | Confident | 4 Ų | 4 | 49 Ų | 49 | 2% | 0.024 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.2 | 147.3 | 174.1 | -49 | 0 | 0 | 0 | 0 | 110.4 | F616 D617 K618 L620 Q714 S715 | V602-F616 CarbonylContact O-C 3.48Å; V602-D617 PolarHBondContact O-N 3.46Å; V602-K618 HydrophobicContact CG2-CB 3.75Å; V602-K618 HydrophobicContact CG2-CD 3.67Å; V602-K618 HydrophobicContact CG2-CG 3.85Å; V602-K618 PolarHBondContact N-O 3.17Å; V602-K618 WeakPolarHBondContact O-CB 3.35Å; V602-K618 PolarHBondContact O-N 3.41Å; V602-L620 HydrophobicContact CG1-CD1 3.8Å; V602-L620 HydrophobicContact CG1-CG 4.13Å; V602-Q714 HydrophobicContact CB-CB 4.29Å; V602-Q714 HydrophobicContact CG1-CB 4.34Å; V602-S715 WeakPolarHBondContact CA-O 3.38Å |
| 603 | A | 96.1 | Very high | 89.9 | Confident | 2 Ų | 2 | 47 Ų | 47 | 2% | 0.017 | 29% | 0.291 | C | S | . | . | trans | -79.7 | 139 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | F616 A709 S715 | A603-F616 HydrophobicContact CB-CD1 3.97Å; A603-F616 HydrophobicContact CB-CE1 4.5Å; A603-A709 HydrophobicContact CB-CB 3.75Å; A603-A709 WeakPolarHBondContact O-CB 3.11Å; A603-S715 PolarHBondContact N-O 3.44Å | ||
| 604 | S | 92.4 | Very high | 92.3 | Very high | 56 Ų | 56 | 44.5 Ų | 44.5 | 39% | 0.392 | 27% | 0.265 | S | S | . | . | trans | -95.6 | -23.6 | 168 | 69.7 | 0 | 0 | 0 | 0 | 112.7 | D617 | S604-D617 VanDerWaalsContact CB-OD2 3.3Å; S604-D617 WeakPolarHBondContact CB-OD2 3.2Å; S604-D617 PolarHBondContact N-OD1 3.3Å; S604-D617 PolarHBondContact OG-OD1 2.96Å; S604-D617 VanDerWaalsContact OG-OD1 3.07Å; S604-D617 PolarHBondContact OG-OD2 3.48Å | ||
| 605 | T | 91.1 | Very high | 94.1 | Very high | 71 Ų | 71 | 41.1 Ų | 41.1 | 44% | 0.436 | 25% | 0.249 | S | C | . | . | S | Bend | trans | -94.4 | 124.3 | -174.7 | 47.2 | 0 | 0 | 0 | 0 | 112.5 | ||
| 606 | P | 94.7 | Very high | 95.1 | Very high | 60 Ų | 60 | 36.6 Ų | 36.6 | 39% | 0.39 | 23% | 0.229 | S | C | . | . | S | Bend | trans | -73.3 | 150.1 | 168.6 | 30.3 | -33.3 | 0 | 0 | 0 | 110.9 | Y708 A709 | P606-Y708 HydrophobicContact CB-CD2 3.64Å; P606-Y708 HydrophobicContact CB-CE2 3.71Å; P606-A709 WeakPolarHBondContact CB-O 3.31Å |
| 607 | F | 95.6 | Very high | 95.6 | Very high | 109 Ų | 109 | 35 Ų | 35 | 48% | 0.478 | 22% | 0.222 | S | C | . | . | S | Bend | trans | 55.1 | 59 | 175 | -44.3 | -57.4 | 0 | 0 | 0 | 113.3 | K651 L707 Y708 | F607-K651 WeakPolarHBondContact CE1-O 3.38Å; F607-L707 WeakPolarHBondContact CA-O 3.49Å; F607-L707 PolarHBondContact N-O 3.29Å; F607-Y708 HydrophobicContact CE1-CD2 4.26Å; F607-Y708 HydrophobicContact CE2-CD2 4.25Å; F607-Y708 AromaticContact CZ-CD2 3.81Å; F607-Y708 HydrophobicContact CZ-CD2 3.81Å; F607-Y708 HydrophobicContact CZ-CE2 4.47Å |
| 608 | P | 95.1 | Very high | 95.8 | Very high | 8 Ų | 8 | 39.7 Ų | 39.7 | 5% | 0.052 | 24% | 0.242 | C | C | . | . | P | Polyproline II helix | trans | -62 | 159.4 | 177.1 | 26.9 | -34.1 | 0 | 0 | 0 | 112.1 | V610 V614 M699 L707 | P608-V610 PolarHBondContact O-N 2.88Å; P608-V614 HydrophobicContact CB-CG1 4.25Å; P608-V614 HydrophobicContact CG-CG1 3.89Å; P608-V614 HydrophobicContact CG-CG2 4.26Å; P608-M699 HydrophobicContact CG-CE 3.93Å; P608-M699 WeakPolarHBondContact O-CE 3.15Å; P608-L707 WeakPolarHBondContact CD-O 2.97Å; P608-L707 HydrophobicContact CG-CB 4.36Å; P608-L707 HydrophobicContact CG-CD1 3.87Å; P608-L707 HydrophobicContact CG-CD2 3.93Å; P608-L707 HydrophobicContact CG-CG 4.24Å |
| 609 | P | 94.8 | Very high | 95.8 | Very high | 85 Ų | 85 | 42.2 Ų | 42.2 | 55% | 0.552 | 25% | 0.253 | S | S | * | . | P | Polyproline II helix | trans | -64.9 | 129.7 | -174.8 | 24 | -33.3 | 0 | 0 | 0 | 113.5 | S612 | P609-S612 WeakPolarHBondContact CB-OG 3.25Å; P609-S612 WeakPolarHBondContact CG-OG 3.42Å; P609-S612 PolarHBondContact O-OG 3.37Å |
| 610 | V | 95.4 | Very high | 95.7 | Very high | 53 Ų | 53 | 46.9 Ų | 46.9 | 32% | 0.321 | 28% | 0.277 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.7 | 148.2 | 174.1 | 174.7 | 0 | 0 | 0 | 0 | 110.6 | P608 S612 M699 S701 D702 S705 | P608-V610 PolarHBondContact O-N 2.88Å; V610-S612 PolarHBondContact O-N 2.78Å; V610-M699 HydrophobicContact CG2-CB 4.32Å; V610-M699 HydrophobicContact CG2-CE 3.95Å; V610-S701 VanDerWaalsContact CG1-C 3.43Å; V610-D702 HydrophobicContact CG1-CB 4.42Å; V610-S705 VanDerWaalsContact CG2-CB 3.45Å |
| 611 | G | 92.9 | Very high | 95.6 | Very high | 50 Ų | 50 | 49.5 Ų | 49.5 | 52% | 0.515 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76.4 | -3.9 | 178.9 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q698 M699 | G611-Q698 VanDerWaalsContact C-NE2 3.28Å; G611-Q698 PolarHBondContact O-NE2 3.27Å; G611-M699 PolarHBondContact N-O 3.5Å |
| 612 | S | 95.6 | Very high | 95.4 | Very high | 39 Ų | 39 | 50.4 Ų | 50.4 | 27% | 0.273 | 29% | 0.289 | S | S | . | . | S | Bend | trans | -119.1 | 160.5 | 172.4 | 45.6 | 0 | 0 | 0 | 0 | 111.9 | P609 V610 V614 | P609-S612 WeakPolarHBondContact CB-OG 3.25Å; P609-S612 WeakPolarHBondContact CG-OG 3.42Å; P609-S612 PolarHBondContact O-OG 3.37Å; V610-S612 PolarHBondContact O-N 2.78Å; S612-V614 PolarHBondContact O-N 3.07Å |
| 613 | P | 97.6 | Very high | 94.8 | Very high | 34 Ų | 34 | 51.5 Ų | 51.5 | 22% | 0.221 | 30% | 0.3 | C | S | . | . | B | Isolated β-bridge | trans | -54.2 | 138 | 169.6 | -23.7 | 33.2 | 0 | 0 | 0 | 112.1 | V615 T631 I633 Y696 I697 | P613-V615 PolarHBondContact O-N 2.64Å; P613-T631 WeakPolarHBondContact CB-O 3.48Å; P613-I633 HydrophobicContact CB-CG1 4.26Å; P613-I633 HydrophobicContact CG-CD1 4.23Å; P613-I633 HydrophobicContact CG-CG1 4.2Å; P613-Y696 HydrophobicContact CB-CD2 3.62Å; P613-Y696 HydrophobicContact CB-CE2 4.19Å; P613-Y696 HydrophobicContact CB-CG 4.1Å; P613-Y696 HydrophobicContact CG-CD2 3.71Å; P613-Y696 HydrophobicContact CG-CE2 3.8Å; P613-Y696 HydrophobicContact CG-CG 4.22Å; P613-I697 CarbonylContact C-O 3.55Å; P613-I697 WeakPolarHBondContact CA-O 3.31Å |
| 614 | V | 97.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 55.6 Ų | 55.6 | 0% | 0 | 32% | 0.315 | C | S | . | . | trans | -76.6 | 119.3 | 174.8 | 177 | 0 | 0 | 0 | 0 | 108.8 | P608 S612 F616 G632 I697 L707 | P608-V614 HydrophobicContact CB-CG1 4.25Å; P608-V614 HydrophobicContact CG-CG1 3.89Å; P608-V614 HydrophobicContact CG-CG2 4.26Å; S612-V614 PolarHBondContact O-N 3.07Å; V614-F616 HydrophobicContact CB-CE2 3.86Å; V614-F616 HydrophobicContact CB-CZ 4.29Å; V614-F616 HydrophobicContact CG1-CD2 4.14Å; V614-F616 HydrophobicContact CG1-CE1 4.36Å; V614-F616 HydrophobicContact CG1-CE2 3.6Å; V614-F616 HydrophobicContact CG1-CZ 3.72Å; V614-F616 VanDerWaalsContact O-CD2 3.28Å; V614-F616 WeakPolarHBondContact O-CD2 3.34Å; V614-F616 WeakPolarHBondContact O-CE2 3.34Å; V614-F616 PolarHBondContact O-N 2.97Å; V614-G632 WeakPolarHBondContact O-CA 3.32Å; V614-I697 HydrophobicContact CB-CB 4.33Å; V614-I697 HydrophobicContact CB-CG2 4.47Å; V614-I697 HydrophobicContact CG2-CG2 4.25Å; V614-I697 PolarHBondContact N-O 3.23Å; V614-L707 HydrophobicContact CG1-CD1 3.98Å; V614-L707 HydrophobicContact CG2-CD1 3.88Å | ||
| 615 | V | 97.7 | Very high | 94.6 | Very high | 44 Ų | 44 | 60.5 Ų | 60.5 | 27% | 0.267 | 33% | 0.332 | S | S | . | . | trans | -85.7 | 107.9 | -179.3 | -174.5 | 0 | 0 | 0 | 0 | 109.6 | P613 D617 P629 | P613-V615 PolarHBondContact O-N 2.64Å; V615-D617 HydrophobicContact CG1-CB 4.39Å; V615-D617 PolarHBondContact O-N 3.14Å; V615-P629 WeakPolarHBondContact CG1-O 3.33Å | ||
| 616 | F | 97.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 32% | 0.315 | C | S | . | . | trans | -90.8 | 89.7 | 168.3 | -54.5 | -102.1 | 0 | 0 | 0 | 107 | A601 V602 A603 V614 Y627 I648 I697 F717 | A601-F616 HydrophobicContact CB-CB 3.62Å; A601-F616 WeakPolarHBondContact CB-O 3.45Å; V602-F616 CarbonylContact O-C 3.48Å; A603-F616 HydrophobicContact CB-CD1 3.97Å; A603-F616 HydrophobicContact CB-CE1 4.5Å; V614-F616 HydrophobicContact CB-CE2 3.86Å; V614-F616 HydrophobicContact CB-CZ 4.29Å; V614-F616 HydrophobicContact CG1-CD2 4.14Å; V614-F616 HydrophobicContact CG1-CE1 4.36Å; V614-F616 HydrophobicContact CG1-CE2 3.6Å; V614-F616 HydrophobicContact CG1-CZ 3.72Å; V614-F616 VanDerWaalsContact O-CD2 3.28Å; V614-F616 WeakPolarHBondContact O-CD2 3.34Å; V614-F616 WeakPolarHBondContact O-CE2 3.34Å; V614-F616 PolarHBondContact O-N 2.97Å; F616-Y627 WeakPolarHBondContact CB-OH 3.44Å; F616-Y627 PolarHBondContact N-OH 3.18Å; F616-Y627 VanDerWaalsContact N-OH 3.09Å; F616-Y627 WeakPolarHBondContact O-CE1 3.49Å; F616-Y627 PolarHBondContact O-OH 3.35Å; F616-I648 HydrophobicContact CE1-CD1 4.2Å; F616-I648 HydrophobicContact CZ-CD1 4.15Å; F616-I697 HydrophobicContact CE2-CB 3.97Å; F616-I697 HydrophobicContact CE2-CG1 3.92Å; F616-I697 HydrophobicContact CZ-CB 4.25Å; F616-I697 HydrophobicContact CZ-CG1 4.08Å; F616-F717 HydrophobicContact CD1-CB 4.01Å; F616-F717 HydrophobicContact CD2-CB 3.74Å; F616-F717 HydrophobicContact CD2-CD1 4.14Å; F616-F717 HydrophobicContact CD2-CG 4.39Å; F616-F717 HydrophobicContact CE1-CB 3.88Å; F616-F717 HydrophobicContact CE2-CB 3.6Å; F616-F717 HydrophobicContact CE2-CD1 4.1Å; F616-F717 HydrophobicContact CE2-CG 4.14Å; F616-F717 HydrophobicContact CG-CB 3.96Å; F616-F717 HydrophobicContact CZ-CB 3.68Å | ||
| 617 | D | 95.3 | Very high | 94.9 | Very high | 62 Ų | 62 | 55 Ų | 55 | 33% | 0.332 | 30% | 0.297 | S | S | . | . | trans | -72.8 | -32.4 | -168.8 | 58.5 | -63.5 | 0 | 0 | 0 | 113.9 | V602 S604 V615 L619 | V602-D617 PolarHBondContact O-N 3.46Å; S604-D617 VanDerWaalsContact CB-OD2 3.3Å; S604-D617 WeakPolarHBondContact CB-OD2 3.2Å; S604-D617 PolarHBondContact N-OD1 3.3Å; S604-D617 PolarHBondContact OG-OD1 2.96Å; S604-D617 VanDerWaalsContact OG-OD1 3.07Å; S604-D617 PolarHBondContact OG-OD2 3.48Å; V615-D617 HydrophobicContact CG1-CB 4.39Å; V615-D617 PolarHBondContact O-N 3.14Å; D617-L619 PolarHBondContact O-N 3.38Å | ||
| 618 | K | 95.5 | Very high | 95 | Very high | 98 Ų | 98 | 53 Ų | 53 | 43% | 0.426 | 29% | 0.291 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 95.6 | -174.2 | 178.3 | -179.4 | 167.8 | -168.3 | 0 | 110.3 | V602 | V602-K618 HydrophobicContact CG2-CB 3.75Å; V602-K618 HydrophobicContact CG2-CD 3.67Å; V602-K618 HydrophobicContact CG2-CG 3.85Å; V602-K618 PolarHBondContact N-O 3.17Å; V602-K618 WeakPolarHBondContact O-CB 3.35Å; V602-K618 PolarHBondContact O-N 3.41Å |
| 619 | L | 95.9 | Very high | 95 | Very high | 71 Ų | 71 | 54.6 Ų | 54.6 | 37% | 0.372 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.9 | 132.8 | 172.8 | -56.7 | -179.1 | 0 | 0 | 0 | 111.3 | A601 D617 N622 Y627 P629 | A601-L619 HydrophobicContact CB-CD2 4.01Å; D617-L619 PolarHBondContact O-N 3.38Å; L619-N622 HydrophobicContact CD1-CB 3.93Å; L619-N622 HydrophobicContact CD2-CB 4.16Å; L619-N622 HydrophobicContact CG-CB 4.49Å; L619-Y627 HydrophobicContact CD2-CD1 3.65Å; L619-Y627 HydrophobicContact CD2-CE1 3.92Å; L619-P629 HydrophobicContact CD1-CG 4.11Å; L619-P629 HydrophobicContact CD2-CB 3.97Å; L619-P629 HydrophobicContact CD2-CG 4.29Å; L619-P629 HydrophobicContact CG-CB 4.18Å; L619-P629 HydrophobicContact CG-CG 4.26Å |
| 620 | L | 95.4 | Very high | 95.1 | Very high | 100 Ų | 100 | 58.7 Ų | 58.7 | 52% | 0.524 | 31% | 0.313 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.1 | -35.4 | 164.4 | -55.6 | -172.6 | 0 | 0 | 0 | 110.9 | T600 V602 | T600-L620 HydrophobicContact CG2-CB 4.11Å; T600-L620 HydrophobicContact CG2-CD1 4.03Å; T600-L620 HydrophobicContact CG2-CG 4.38Å; T600-L620 PolarHBondContact O-N 2.98Å; V602-L620 HydrophobicContact CG1-CD1 3.8Å; V602-L620 HydrophobicContact CG1-CG 4.13Å |
| 621 | Y | 95.9 | Very high | 95.1 | Very high | 93 Ų | 93 | 58.8 Ų | 58.8 | 37% | 0.365 | 31% | 0.314 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -152.7 | 144.3 | 172.2 | 178.9 | -101.5 | 0 | 0 | 0 | 109.9 | E595 A598 F599 T600 | E595-Y621 VanDerWaalsContact CG-OH 3.31Å; E595-Y621 WeakPolarHBondContact CG-OH 3.48Å; E595-Y621 PolarHBondContact OE1-OH 3.49Å; A598-Y621 HydrophobicContact CB-CD1 4.34Å; A598-Y621 HydrophobicContact CB-CE1 3.74Å; A598-Y621 WeakPolarHBondContact O-CD1 3.24Å; A598-Y621 WeakPolarHBondContact O-CE1 3.08Å; F599-Y621 CarbonylContact C-O 3.59Å; F599-Y621 VanDerWaalsContact CA-O 3.25Å; F599-Y621 WeakPolarHBondContact CA-O 3.31Å; T600-Y621 PolarHBondContact N-O 2.65Å; T600-Y621 PolarHBondContact O-N 2.89Å; T600-Y621 VanDerWaalsContact O-N 3.09Å; T600-Y621 VanDerWaalsContact O-O 3.13Å |
| 622 | N | 94.6 | Very high | 95.3 | Very high | 20 Ų | 20 | 56.4 Ų | 56.4 | 11% | 0.107 | 29% | 0.29 | C | S | . | . | trans | -169.3 | 51.7 | 179.8 | -169.8 | 17.7 | 0 | 0 | 0 | 110.6 | F599 L619 R624 Q625 Y627 | F599-N622 HydrophobicContact CB-CB 4.32Å; L619-N622 HydrophobicContact CD1-CB 3.93Å; L619-N622 HydrophobicContact CD2-CB 4.16Å; L619-N622 HydrophobicContact CG-CB 4.49Å; N622-R624 PolarHBondContact O-N 3.35Å; N622-Q625 WeakPolarHBondContact O-CA 3.18Å; N622-Q625 PolarHBondContact O-N 3.19Å; N622-Q625 WeakPolarHBondContact OD1-CA 3.34Å; N622-Y627 PolarHBondContact ND2-O 3.32Å; N622-Y627 PolarHBondContact OD1-N 3.21Å | ||
| 623 | G | 85 | Confident | 95.5 | Very high | 26 Ų | 26 | 56.4 Ų | 56.4 | 27% | 0.268 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -51.4 | -56.5 | -163.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | E595 Q625 | E595-G623 WeakPolarHBondContact OE2-CA 3.24Å; G623-Q625 VanDerWaalsContact C-N 3.26Å; G623-Q625 PolarHBondContact O-N 3.19Å |
| 624 | R | 90.4 | Very high | 95.5 | Very high | 88 Ų | 88 | 54.8 Ų | 54.8 | 33% | 0.332 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.8 | -3 | 176 | -65.7 | -173.4 | 78.9 | 78.7 | 0 | 115.6 | E595 P597 N622 N626 D637 | E595-R624 VanDerWaalsContact O-CD 3.25Å; E595-R624 WeakPolarHBondContact O-CD 3.29Å; E595-R624 WeakPolarHBondContact O-CG 3.33Å; E595-R624 PolarHBondContact O-NH1 3.45Å; P597-R624 VanDerWaalsContact CA-CD 3.47Å; P597-R624 VanDerWaalsContact N-CD 3.3Å; N622-R624 PolarHBondContact O-N 3.35Å; R624-N626 WeakPolarHBondContact CB-OD1 3.5Å; R624-N626 PolarHBondContact O-N 3.48Å; R624-D637 IonicContact CZ-OD2 3.33Å; R624-D637 IonicContact NE-OD1 2.84Å; R624-D637 IonicContact NE-OD2 2.98Å; R624-D637 PolarHBondContact NE-OD2 2.93Å; R624-D637 IonicContact NH2-OD2 3.19Å; R624-D637 PolarHBondContact NH2-OD2 2.93Å |
| 625 | Q | 93.2 | Very high | 95.5 | Very high | 160 Ų | 160 | 57.8 Ų | 57.8 | 75% | 0.748 | 29% | 0.294 | S | S | * | . | trans | 60.7 | 22 | -176.7 | -51.5 | 179.9 | 23 | 0 | 0 | 115.2 | N622 G623 Y627 | N622-Q625 WeakPolarHBondContact O-CA 3.18Å; N622-Q625 PolarHBondContact O-N 3.19Å; N622-Q625 WeakPolarHBondContact OD1-CA 3.34Å; G623-Q625 VanDerWaalsContact C-N 3.26Å; G623-Q625 PolarHBondContact O-N 3.19Å; Q625-Y627 PolarHBondContact O-N 3.23Å | ||
| 626 | N | 94.7 | Very high | 95.5 | Very high | 15 Ų | 15 | 55.9 Ų | 55.9 | 8% | 0.08 | 28% | 0.282 | C | S | . | . | trans | -58 | -31.9 | 175.8 | -71.7 | 102.3 | 0 | 0 | 0 | 113.5 | R624 F634 T635 D637 | R624-N626 WeakPolarHBondContact CB-OD1 3.5Å; R624-N626 PolarHBondContact O-N 3.48Å; N626-F634 HydrophobicContact CB-CD2 3.62Å; N626-F634 HydrophobicContact CB-CE2 3.29Å; N626-F634 HydrophobicContact CB-CZ 4.06Å; N626-T635 PolarHBondContact ND2-O 3.4Å; N626-T635 PolarHBondContact O-N 3.05Å; N626-D637 VanDerWaalsContact ND2-CG 3.28Å; N626-D637 PolarHBondContact ND2-OD1 3.41Å | ||
| 627 | Y | 97.8 | Very high | 95.3 | Very high | 1 Ų | 1 | 58.8 Ų | 58.8 | 0% | 0.004 | 30% | 0.298 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94 | 127.6 | 179.1 | 176.2 | -93 | 0 | 0 | 0 | 110.9 | F599 A601 F616 L619 N622 Q625 P629 G632 F634 F717 | F599-Y627 HydrophobicContact CD2-CD1 4.1Å; F599-Y627 AromaticContact CD2-CD2 3.71Å; F599-Y627 HydrophobicContact CD2-CD2 3.71Å; F599-Y627 HydrophobicContact CD2-CE2 4.43Å; F599-Y627 AromaticContact CD2-CG 3.52Å; F599-Y627 HydrophobicContact CD2-CG 3.52Å; F599-Y627 AromaticContact CE2-CD2 3.47Å; F599-Y627 HydrophobicContact CE2-CD2 3.47Å; F599-Y627 VanDerWaalsContact CE2-CD2 3.47Å; F599-Y627 AromaticContact CE2-CE2 3.97Å; F599-Y627 HydrophobicContact CE2-CE2 3.97Å; F599-Y627 AromaticContact CE2-CG 3.82Å; F599-Y627 HydrophobicContact CE2-CG 3.82Å; F599-Y627 HydrophobicContact CG-CD2 4.37Å; F599-Y627 AromaticContact CG-CG 3.98Å; F599-Y627 HydrophobicContact CG-CG 3.98Å; F599-Y627 AromaticContact CZ-CD2 3.93Å; F599-Y627 HydrophobicContact CZ-CD2 3.93Å; F599-Y627 HydrophobicContact CZ-CG 4.48Å; A601-Y627 HydrophobicContact CB-CD1 4.15Å; A601-Y627 HydrophobicContact CB-CE1 3.63Å; F616-Y627 WeakPolarHBondContact CB-OH 3.44Å; F616-Y627 PolarHBondContact N-OH 3.18Å; F616-Y627 VanDerWaalsContact N-OH 3.09Å; F616-Y627 WeakPolarHBondContact O-CE1 3.49Å; F616-Y627 PolarHBondContact O-OH 3.35Å; L619-Y627 HydrophobicContact CD2-CD1 3.65Å; L619-Y627 HydrophobicContact CD2-CE1 3.92Å; N622-Y627 PolarHBondContact ND2-O 3.32Å; N622-Y627 PolarHBondContact OD1-N 3.21Å; Q625-Y627 PolarHBondContact O-N 3.23Å; Y627-P629 HydrophobicContact CE1-CB 4.24Å; Y627-P629 WeakPolarHBondContact O-CD 3.22Å; Y627-G632 WeakPolarHBondContact CE2-O 3.5Å; Y627-G632 WeakPolarHBondContact OH-CA 3.31Å; Y627-F634 HydrophobicContact CD2-CB 4.22Å; Y627-F717 HydrophobicContact CE2-CD1 4.08Å; Y627-F717 HydrophobicContact CE2-CE1 4.32Å |
| 628 | N | 97.4 | Very high | 95.3 | Very high | 65 Ų | 65 | 58.1 Ų | 58.1 | 35% | 0.348 | 29% | 0.294 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 107.4 | -179.8 | -177.4 | -13.6 | 0 | 0 | 0 | 111.1 | Q630 T631 G632 I633 | N628-Q630 PolarHBondContact O-N 3.3Å; N628-Q630 VanDerWaalsContact O-N 3.14Å; N628-Q630 WeakPolarHBondContact OD1-CB 3.14Å; N628-Q630 PolarHBondContact OD1-N 3.34Å; N628-T631 WeakPolarHBondContact CB-OG1 3.26Å; N628-T631 PolarHBondContact O-N 2.91Å; N628-G632 PolarHBondContact O-N 3.39Å; N628-I633 PolarHBondContact N-O 3.28Å |
| 629 | P | 95.8 | Very high | 95.4 | Very high | 43 Ų | 43 | 55.3 Ų | 55.3 | 28% | 0.279 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.1 | -2.2 | -179.1 | 32.1 | -37.9 | 0 | 0 | 0 | 114.2 | V615 L619 Y627 | V615-P629 WeakPolarHBondContact CG1-O 3.33Å; L619-P629 HydrophobicContact CD1-CG 4.11Å; L619-P629 HydrophobicContact CD2-CB 3.97Å; L619-P629 HydrophobicContact CD2-CG 4.29Å; L619-P629 HydrophobicContact CG-CB 4.18Å; L619-P629 HydrophobicContact CG-CG 4.26Å; Y627-P629 HydrophobicContact CE1-CB 4.24Å; Y627-P629 WeakPolarHBondContact O-CD 3.22Å |
| 630 | Q | 95.8 | Very high | 95.4 | Very high | 170 Ų | 170 | 52 Ų | 52 | 79% | 0.794 | 27% | 0.268 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.5 | -24.5 | 171.9 | -58.9 | -176.8 | -7 | 0 | 0 | 112.5 | N628 | N628-Q630 PolarHBondContact O-N 3.3Å; N628-Q630 VanDerWaalsContact O-N 3.14Å; N628-Q630 WeakPolarHBondContact OD1-CB 3.14Å; N628-Q630 PolarHBondContact OD1-N 3.34Å |
| 631 | T | 96.6 | Very high | 95.5 | Very high | 56 Ų | 56 | 48.6 Ų | 48.6 | 34% | 0.344 | 25% | 0.251 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -115.8 | -14.7 | -176 | 62.4 | 0 | 0 | 0 | 0 | 114.1 | P613 N628 I633 | P613-T631 WeakPolarHBondContact CB-O 3.48Å; N628-T631 WeakPolarHBondContact CB-OG1 3.26Å; N628-T631 PolarHBondContact O-N 2.91Å; T631-I633 VanDerWaalsContact C-N 3.3Å |
| 632 | G | 96.9 | Very high | 95.6 | Very high | 0 Ų | 0 | 44.2 Ų | 44.2 | 0% | 0 | 23% | 0.233 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 80.7 | 7.7 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | V614 Y627 N628 Y696 | V614-G632 WeakPolarHBondContact O-CA 3.32Å; Y627-G632 WeakPolarHBondContact CE2-O 3.5Å; Y627-G632 WeakPolarHBondContact OH-CA 3.31Å; N628-G632 PolarHBondContact O-N 3.39Å; G632-Y696 WeakPolarHBondContact O-CB 3.3Å |
| 633 | I | 98.3 | Very high | 95.8 | Very high | 39 Ų | 39 | 46.5 Ų | 46.5 | 20% | 0.2 | 24% | 0.241 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 130.2 | -168.9 | -58.2 | 170 | 0 | 0 | 0 | 111.2 | P613 N628 T631 T694 Y696 | P613-I633 HydrophobicContact CB-CG1 4.26Å; P613-I633 HydrophobicContact CG-CD1 4.23Å; P613-I633 HydrophobicContact CG-CG1 4.2Å; N628-I633 PolarHBondContact N-O 3.28Å; T631-I633 VanDerWaalsContact C-N 3.3Å; I633-T694 HydrophobicContact CG2-CG2 3.92Å; I633-Y696 HydrophobicContact CG1-CD1 4.19Å; I633-Y696 HydrophobicContact CG1-CG 4.26Å |
| 634 | F | 98.4 | Very high | 96.4 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.228 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -85 | 134.1 | 160.9 | 171.5 | -88.1 | 0 | 0 | 0 | 110 | F599 N626 Y627 C636 Y642 F644 L689 T694 V695 | F599-F634 AromaticContact CD1-CD2 3.43Å; F599-F634 HydrophobicContact CD1-CD2 3.43Å; F599-F634 VanDerWaalsContact CD1-CD2 3.43Å; F599-F634 AromaticContact CD1-CE2 4Å; F599-F634 HydrophobicContact CD1-CE2 4Å; F599-F634 HydrophobicContact CD1-CG 4.33Å; F599-F634 HydrophobicContact CE1-CB 3.85Å; F599-F634 AromaticContact CE1-CD2 3.34Å; F599-F634 HydrophobicContact CE1-CD2 3.34Å; F599-F634 HydrophobicContact CE1-CE2 4.12Å; F599-F634 AromaticContact CE1-CG 3.8Å; F599-F634 HydrophobicContact CE1-CG 3.8Å; F599-F634 HydrophobicContact CZ-CB 4.14Å; F599-F634 HydrophobicContact CZ-CD2 4.4Å; N626-F634 HydrophobicContact CB-CD2 3.62Å; N626-F634 HydrophobicContact CB-CE2 3.29Å; N626-F634 HydrophobicContact CB-CZ 4.06Å; Y627-F634 HydrophobicContact CD2-CB 4.22Å; F634-C636 HydrophobicContact CE1-CB 4.1Å; F634-Y642 HydrophobicContact CE1-CD1 4.36Å; F634-Y642 HydrophobicContact CE1-CE1 4.08Å; F634-Y642 HydrophobicContact CE2-CE1 4.25Å; F634-Y642 AromaticContact CZ-CD1 3.98Å; F634-Y642 HydrophobicContact CZ-CD1 3.98Å; F634-Y642 AromaticContact CZ-CE1 3.41Å; F634-Y642 HydrophobicContact CZ-CE1 3.41Å; F634-Y642 VanDerWaalsContact CZ-CE1 3.41Å; F634-Y642 AromaticContact CZ-CZ 3.93Å; F634-F644 HydrophobicContact CB-CE1 4.38Å; F634-F644 AromaticContact CD1-CE1 3.99Å; F634-F644 HydrophobicContact CD1-CE1 3.99Å; F634-F644 AromaticContact CD1-CZ 3.77Å; F634-F644 HydrophobicContact CD1-CZ 3.77Å; F634-F644 HydrophobicContact CE1-CE1 4.49Å; F634-F644 AromaticContact CE1-CZ 3.96Å; F634-F644 HydrophobicContact CE1-CZ 3.96Å; F634-F644 HydrophobicContact CG-CE1 4.08Å; F634-F644 HydrophobicContact CG-CZ 4.32Å; F634-L689 HydrophobicContact CD1-CD1 4.38Å; F634-L689 HydrophobicContact CE1-CD1 3.82Å; F634-T694 CarbonylContact O-C 3.6Å; F634-T694 VanDerWaalsContact O-CA 3.29Å; F634-T694 WeakPolarHBondContact O-CA 3.37Å; F634-V695 WeakPolarHBondContact CB-O 3.42Å; F634-V695 HydrophobicContact CD1-CB 4.28Å; F634-V695 HydrophobicContact CD1-CG2 4.45Å; F634-V695 PolarHBondContact N-O 3.45Å; F634-V695 PolarHBondContact O-N 3.13Å |
| 635 | T | 98.1 | Very high | 96.8 | Very high | 62 Ų | 62 | 41.5 Ų | 41.5 | 38% | 0.38 | 22% | 0.216 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 127.2 | 172.5 | -53.4 | 0 | 0 | 0 | 0 | 110.6 | N626 D693 | N626-T635 PolarHBondContact ND2-O 3.4Å; N626-T635 PolarHBondContact O-N 3.05Å; T635-D693 WeakPolarHBondContact CA-O 3.41Å |
| 636 | C | 96.8 | Very high | 97 | Very high | 4 Ų | 4 | 33.9 Ų | 33.9 | 3% | 0.027 | 18% | 0.18 | C | C | . | . | trans | -72.3 | 126.8 | -179.7 | -170.7 | 0 | 0 | 0 | 0 | 111.7 | F634 I638 L689 Q690 G692 D693 | F634-C636 HydrophobicContact CE1-CB 4.1Å; C636-I638 PolarHBondContact SG-O 2.92Å; C636-L689 HydrophobicContact CB-CB 4.11Å; C636-L689 HydrophobicContact CB-CD1 4.12Å; C636-L689 VanDerWaalsContact SG-CB 3.56Å; C636-Q690 WeakPolarHBondContact CB-O 3.49Å; C636-Q690 PolarHBondContact SG-O 3.21Å; C636-G692 PolarHBondContact O-N 3.15Å; C636-D693 HydrophobicContact CB-CB 4.08Å; C636-D693 WeakPolarHBondContact CB-O 3.45Å; C636-D693 PolarHBondContact N-O 3.16Å | ||
| 637 | D | 94.5 | Very high | 97.2 | Very high | 62 Ų | 62 | 37.2 Ų | 37.2 | 33% | 0.332 | 20% | 0.195 | S | C | . | . | trans | -108.7 | -32 | 174.2 | 71.4 | -41 | 0 | 0 | 0 | 113.1 | R624 N626 | R624-D637 IonicContact CZ-OD2 3.33Å; R624-D637 IonicContact NE-OD1 2.84Å; R624-D637 IonicContact NE-OD2 2.98Å; R624-D637 PolarHBondContact NE-OD2 2.93Å; R624-D637 IonicContact NH2-OD2 3.19Å; R624-D637 PolarHBondContact NH2-OD2 2.93Å; N626-D637 VanDerWaalsContact ND2-CG 3.28Å; N626-D637 PolarHBondContact ND2-OD1 3.41Å | ||
| 638 | I | 94.9 | Very high | 97.2 | Very high | 48 Ų | 48 | 37.1 Ų | 37.1 | 25% | 0.246 | 20% | 0.195 | C | C | . | . | S | Bend | trans | -109.9 | 126.2 | 177.7 | -61.4 | -177.1 | 0 | 0 | 0 | 109 | P597 C636 Y642 L721 P724 | P597-I638 HydrophobicContact CG-CB 4.08Å; P597-I638 HydrophobicContact CG-CD1 3.74Å; P597-I638 HydrophobicContact CG-CG1 4.04Å; C636-I638 PolarHBondContact SG-O 2.92Å; I638-Y642 WeakPolarHBondContact O-CE2 3.29Å; I638-Y642 PolarHBondContact O-OH 3.06Å; I638-L721 HydrophobicContact CG2-CD2 4.2Å; I638-P724 HydrophobicContact CG2-CB 4.25Å |
| 639 | P | 96.5 | Very high | 97.2 | Very high | 39 Ų | 39 | 36 Ų | 36 | 25% | 0.253 | 19% | 0.187 | S | C | . | . | trans | -60.7 | 140.5 | 174.1 | 25.6 | -31.8 | 0 | 0 | 0 | 111.2 | P691 P724 M725 | P639-P691 HydrophobicContact CB-CG 4.33Å; P639-P691 HydrophobicContact CG-CG 4.41Å; P639-P724 WeakPolarHBondContact O-CA 3.44Å; P639-M725 WeakPolarHBondContact CG-O 3.38Å; P639-M725 PolarHBondContact O-N 3.23Å | ||
| 640 | G | 96.1 | Very high | 97.2 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 17% | 0.174 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 163.9 | -177.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | P688 L689 Y723 | G640-P688 CarbonylContact O-C 3.54Å; G640-L689 PolarHBondContact N-O 3.47Å; G640-L689 VanDerWaalsContact N-O 3.09Å; G640-L689 PolarHBondContact O-N 3.1Å; G640-Y723 CarbonylContact C-O 3.54Å; G640-Y723 WeakPolarHBondContact CA-O 3.48Å |
| 641 | I | 97.8 | Very high | 97.2 | Very high | 30 Ų | 30 | 29.4 Ų | 29.4 | 15% | 0.154 | 15% | 0.152 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -87 | 119.5 | 172.4 | -53.9 | -56.7 | 0 | 0 | 0 | 108.6 | V686 P688 L722 Y723 M725 | I641-V686 HydrophobicContact CG2-CG1 3.33Å; I641-P688 HydrophobicContact CD1-CB 3.7Å; I641-L722 HydrophobicContact CG2-CB 4.48Å; I641-L722 HydrophobicContact CG2-CD1 4.18Å; I641-L722 WeakPolarHBondContact O-CB 3.49Å; I641-L722 PolarHBondContact O-N 2.82Å; I641-Y723 HydrophobicContact CB-CD2 4.15Å; I641-Y723 HydrophobicContact CG1-CD2 4.49Å; I641-Y723 HydrophobicContact CG2-CD2 4.37Å; I641-Y723 PolarHBondContact N-O 3.31Å; I641-Y723 PolarHBondContact O-N 2.82Å; I641-M725 HydrophobicContact CD1-CE 3.61Å; I641-M725 HydrophobicContact CD1-SD 3.62Å; I641-M725 HydrophobicContact CG1-CE 4.22Å; I641-M725 HydrophobicContact CG1-CG 4.44Å; I641-M725 HydrophobicContact CG1-SD 3.86Å |
| 642 | Y | 98 | Very high | 97 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.156 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -109.3 | 144.6 | 177.6 | -78.2 | -100.8 | 0 | 0 | 0 | 111.5 | P597 F634 I638 F644 V686 L687 L689 Y720 L721 | P597-Y642 HydrophobicContact CB-CE1 3.81Å; P597-Y642 WeakPolarHBondContact CB-OH 3.37Å; F634-Y642 HydrophobicContact CE1-CD1 4.36Å; F634-Y642 HydrophobicContact CE1-CE1 4.08Å; F634-Y642 HydrophobicContact CE2-CE1 4.25Å; F634-Y642 AromaticContact CZ-CD1 3.98Å; F634-Y642 HydrophobicContact CZ-CD1 3.98Å; F634-Y642 AromaticContact CZ-CE1 3.41Å; F634-Y642 HydrophobicContact CZ-CE1 3.41Å; F634-Y642 VanDerWaalsContact CZ-CE1 3.41Å; F634-Y642 AromaticContact CZ-CZ 3.93Å; I638-Y642 WeakPolarHBondContact O-CE2 3.29Å; I638-Y642 PolarHBondContact O-OH 3.06Å; Y642-F644 VanDerWaalsContact CB-CE2 3.47Å; Y642-F644 HydrophobicContact CD1-CZ 4.39Å; Y642-F644 HydrophobicContact CG-CE2 4.25Å; Y642-F644 HydrophobicContact CG-CZ 4.47Å; Y642-V686 CarbonylContact O-C 3.54Å; Y642-V686 VanDerWaalsContact O-CA 3.3Å; Y642-V686 WeakPolarHBondContact O-CA 3.38Å; Y642-L687 PolarHBondContact N-O 3.39Å; Y642-L687 PolarHBondContact O-N 3.42Å; Y642-L689 HydrophobicContact CD2-CB 3.85Å; Y642-L689 HydrophobicContact CD2-CD1 3.73Å; Y642-L689 HydrophobicContact CD2-CG 3.84Å; Y642-L689 HydrophobicContact CE2-CB 4.11Å; Y642-L689 HydrophobicContact CE2-CD1 4.2Å; Y642-L689 HydrophobicContact CE2-CG 4.48Å; Y642-L689 HydrophobicContact CG-CD1 3.91Å; Y642-L689 HydrophobicContact CG-CG 4.32Å; Y642-Y720 CarbonylContact C-O 3.54Å; Y642-Y720 WeakPolarHBondContact CA-O 3.26Å; Y642-L721 HydrophobicContact CD1-CB 4.24Å; Y642-L721 HydrophobicContact CD2-CD1 3.94Å; Y642-L721 HydrophobicContact CE1-CB 3.87Å; Y642-L721 HydrophobicContact CE1-CD1 4.32Å; Y642-L721 HydrophobicContact CE2-CD1 3.59Å; Y642-L721 HydrophobicContact CG-CD1 4.46Å |
| 643 | Y | 98.4 | Very high | 96.8 | Very high | 68 Ų | 68 | 33.9 Ų | 33.9 | 27% | 0.267 | 18% | 0.18 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -102.7 | 129.5 | 165.7 | 179.6 | -89.9 | 0 | 0 | 0 | 109.6 | A645 S684 V686 G719 Y720 | Y643-A645 HydrophobicContact CD1-CB 4.5Å; Y643-A645 HydrophobicContact CE1-CB 3.63Å; Y643-S684 VanDerWaalsContact OH-CB 3.31Å; Y643-S684 WeakPolarHBondContact OH-CB 3.5Å; Y643-S684 PolarHBondContact OH-OG 3.31Å; Y643-V686 HydrophobicContact CD2-CG2 3.95Å; Y643-G719 CarbonylContact O-C 3.45Å; Y643-G719 VanDerWaalsContact O-CA 3.24Å; Y643-G719 WeakPolarHBondContact O-CA 3.46Å; Y643-Y720 HydrophobicContact CD1-CD1 4.22Å; Y643-Y720 AromaticContact CD1-CE1 3.37Å; Y643-Y720 HydrophobicContact CD1-CE1 3.37Å; Y643-Y720 AromaticContact CD1-CZ 3.62Å; Y643-Y720 HydrophobicContact CE1-CE1 4.1Å; Y643-Y720 HydrophobicContact CG-CE1 4.14Å; Y643-Y720 AromaticContact CG-CZ 4Å; Y643-Y720 PolarHBondContact N-O 2.82Å; Y643-Y720 PolarHBondContact O-N 3Å |
| 644 | F | 98.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.181 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 143.1 | 172 | -67.6 | -90.4 | 0 | 0 | 0 | 110.2 | F599 F634 Y642 L659 S684 A685 L687 L689 V695 F717 T718 | F599-F644 HydrophobicContact CE1-CD1 4.33Å; F599-F644 AromaticContact CE1-CE1 3.93Å; F599-F644 HydrophobicContact CE1-CE1 3.93Å; F599-F644 HydrophobicContact CZ-CD1 4.38Å; F599-F644 HydrophobicContact CZ-CE1 4.28Å; F634-F644 HydrophobicContact CB-CE1 4.38Å; F634-F644 AromaticContact CD1-CE1 3.99Å; F634-F644 HydrophobicContact CD1-CE1 3.99Å; F634-F644 AromaticContact CD1-CZ 3.77Å; F634-F644 HydrophobicContact CD1-CZ 3.77Å; F634-F644 HydrophobicContact CE1-CE1 4.49Å; F634-F644 AromaticContact CE1-CZ 3.96Å; F634-F644 HydrophobicContact CE1-CZ 3.96Å; F634-F644 HydrophobicContact CG-CE1 4.08Å; F634-F644 HydrophobicContact CG-CZ 4.32Å; Y642-F644 VanDerWaalsContact CB-CE2 3.47Å; Y642-F644 HydrophobicContact CD1-CZ 4.39Å; Y642-F644 HydrophobicContact CG-CE2 4.25Å; Y642-F644 HydrophobicContact CG-CZ 4.47Å; F644-L659 HydrophobicContact CB-CD2 4.29Å; F644-S684 CarbonylContact O-C 3.53Å; F644-S684 WeakPolarHBondContact O-CA 3.41Å; F644-S684 VanDerWaalsContact O-CB 3.24Å; F644-S684 WeakPolarHBondContact O-CB 3.43Å; F644-A685 PolarHBondContact N-O 3.35Å; F644-A685 PolarHBondContact O-N 3.44Å; F644-L687 HydrophobicContact CD2-CB 4.38Å; F644-L687 HydrophobicContact CD2-CD1 3.82Å; F644-L687 HydrophobicContact CD2-CG 4.22Å; F644-L687 HydrophobicContact CE2-CB 4.32Å; F644-L687 HydrophobicContact CE2-CD1 4.02Å; F644-L689 HydrophobicContact CE2-CD1 3.87Å; F644-L689 HydrophobicContact CZ-CD1 3.84Å; F644-V695 HydrophobicContact CD1-CG1 3.91Å; F644-V695 HydrophobicContact CD2-CG1 4.27Å; F644-V695 HydrophobicContact CE1-CB 3.86Å; F644-V695 HydrophobicContact CE1-CG1 3.7Å; F644-V695 HydrophobicContact CE1-CG2 4.36Å; F644-V695 HydrophobicContact CE2-CB 4.34Å; F644-V695 HydrophobicContact CE2-CG1 4.09Å; F644-V695 HydrophobicContact CE2-CG2 4.02Å; F644-V695 HydrophobicContact CG-CG1 4.19Å; F644-V695 HydrophobicContact CZ-CB 3.75Å; F644-V695 HydrophobicContact CZ-CG1 3.82Å; F644-V695 HydrophobicContact CZ-CG2 3.73Å; F644-F717 HydrophobicContact CB-CE2 4.31Å; F644-F717 AromaticContact CD1-CE2 3.85Å; F644-F717 HydrophobicContact CD1-CE2 3.85Å; F644-F717 AromaticContact CD1-CZ 3.8Å; F644-F717 HydrophobicContact CD1-CZ 3.8Å; F644-F717 HydrophobicContact CE1-CZ 4.32Å; F644-T718 CarbonylContact C-O 3.49Å; F644-T718 WeakPolarHBondContact CA-O 3.46Å |
| 645 | A | 98.4 | Very high | 96.6 | Very high | 9 Ų | 9 | 34 Ų | 34 | 7% | 0.074 | 18% | 0.181 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -144.2 | 147.2 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | Y643 G683 T718 | Y643-A645 HydrophobicContact CD1-CB 4.5Å; Y643-A645 HydrophobicContact CE1-CB 3.63Å; A645-G683 WeakPolarHBondContact CA-O 3.45Å; A645-T718 PolarHBondContact N-O 3.17Å; A645-T718 PolarHBondContact O-N 3.24Å; A645-T718 VanDerWaalsContact O-O 3.14Å |
| 646 | Y | 98.4 | Very high | 96.6 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 18% | 0.178 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.2 | 144.6 | 175.1 | 49.5 | -89 | 0 | 0 | 0 | 110.7 | I648 V657 L659 T669 S682 G683 I697 S716 | Y646-I648 HydrophobicContact CD2-CG1 4.12Å; Y646-V657 HydrophobicContact CD2-CG2 4.33Å; Y646-V657 HydrophobicContact CE2-CG2 3.78Å; Y646-L659 HydrophobicContact CE1-CB 4.01Å; Y646-L659 HydrophobicContact CE1-CD2 4.45Å; Y646-T669 WeakPolarHBondContact CE2-OG1 3.46Å; Y646-T669 PolarHBondContact OH-OG1 2.89Å; Y646-S682 WeakPolarHBondContact O-CA 3.38Å; Y646-G683 WeakPolarHBondContact CD1-O 3.34Å; Y646-G683 PolarHBondContact N-O 3.16Å; Y646-G683 PolarHBondContact O-N 3.21Å; Y646-G683 VanDerWaalsContact O-N 3.11Å; Y646-I697 HydrophobicContact CD1-CD1 3.38Å; Y646-I697 HydrophobicContact CE1-CD1 3.83Å; Y646-I697 HydrophobicContact CG-CD1 3.77Å; Y646-S716 VanDerWaalsContact CA-O 3.24Å; Y646-S716 WeakPolarHBondContact CA-O 3.34Å; Y646-S716 WeakPolarHBondContact CB-O 3.42Å |
| 647 | H | 98.1 | Very high | 96.6 | Very high | 85 Ų | 85 | 34.9 Ų | 34.9 | 39% | 0.394 | 18% | 0.177 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 112.5 | 174.1 | -57 | -76.5 | 0 | 0 | 0 | 107.5 | S682 S715 S716 | H647-S682 PolarHBondContact ND1-OG 3.41Å; H647-S715 CarbonylContact O-C 3.44Å; H647-S715 WeakPolarHBondContact O-CA 3.24Å; H647-S716 PolarHBondContact N-O 3.1Å; H647-S716 PolarHBondContact O-N 3.47Å |
| 648 | I | 97.8 | Very high | 96.8 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 16% | 0.161 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -110.7 | 143.1 | -178 | -60.5 | -57.6 | 0 | 0 | 0 | 109.5 | F616 Y646 V655 V657 Q680 A681 L707 | F616-I648 HydrophobicContact CE1-CD1 4.2Å; F616-I648 HydrophobicContact CZ-CD1 4.15Å; Y646-I648 HydrophobicContact CD2-CG1 4.12Å; I648-V655 HydrophobicContact CG2-CG1 3.92Å; I648-V655 HydrophobicContact CG2-CG2 4.44Å; I648-V657 HydrophobicContact CG1-CG1 4.41Å; I648-V657 HydrophobicContact CG1-CG2 4.42Å; I648-Q680 CarbonylContact O-C 3.59Å; I648-Q680 WeakPolarHBondContact O-CA 3.3Å; I648-Q680 PolarHBondContact O-NE2 3.47Å; I648-A681 PolarHBondContact N-O 3.3Å; I648-A681 PolarHBondContact O-N 3.39Å; I648-L707 HydrophobicContact CD1-CD1 4.18Å; I648-L707 HydrophobicContact CD1-CG 4.25Å; I648-L707 HydrophobicContact CG2-CB 4.4Å; I648-L707 HydrophobicContact CG2-CD2 4.49Å; I648-L707 HydrophobicContact CG2-CG 3.76Å |
| 649 | H | 97.4 | Very high | 97 | Very high | 41 Ų | 41 | 29.7 Ų | 29.7 | 19% | 0.19 | 15% | 0.15 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 133.6 | 169.2 | -75.5 | -74.9 | 0 | 0 | 0 | 111.4 | L678 D679 Y708 V713 S715 | H649-L678 HydrophobicContact CB-CD1 4.19Å; H649-D679 WeakPolarHBondContact CA-O 3.32Å; H649-D679 PolarHBondContact ND1-O 3.47Å; H649-Y708 PolarHBondContact O-N 3.5Å; H649-V713 HydrophobicContact CB-CG1 3.87Å; H649-V713 WeakPolarHBondContact CD2-CG1 3.32Å; H649-V713 VanDerWaalsContact CG-CG1 3.46Å; H649-S715 PolarHBondContact N-OG 3.08Å |
| 650 | C | 95.9 | Very high | 97.1 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 14% | 0.14 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -100.2 | 122.9 | -178.8 | -169 | 0 | 0 | 0 | 0 | 110.7 | E653 V655 D671 D679 | C650-E653 PolarHBondContact SG-O 3.39Å; C650-V655 HydrophobicContact CB-CB 4.31Å; C650-V655 HydrophobicContact CB-CG2 3.87Å; C650-V655 VanDerWaalsContact SG-CG2 3.57Å; C650-D671 HydrophobicContact CB-CB 4.47Å; C650-D671 WeakPolarHBondContact CB-OD2 3.35Å; C650-D679 HydrophobicContact CB-CB 4.15Å; C650-D679 PolarHBondContact N-O 3.39Å; C650-D679 PolarHBondContact O-N 3.33Å |
| 651 | K | 95.1 | Very high | 97.2 | Very high | 75 Ų | 75 | 31.4 Ų | 31.4 | 33% | 0.326 | 15% | 0.152 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -153.4 | 141 | -178.8 | -162.4 | -175.8 | -178.2 | 176.6 | 0 | 112.6 | F607 E653 Y673 L678 G706 Y708 | F607-K651 WeakPolarHBondContact CE1-O 3.38Å; K651-E653 PolarHBondContact O-N 3.46Å; K651-Y673 HydrophobicContact CG-CE2 4.42Å; K651-L678 HydrophobicContact CB-CD1 3.96Å; K651-L678 HydrophobicContact CD-CD1 4.13Å; K651-L678 HydrophobicContact CG-CD1 4.17Å; K651-G706 PolarHBondContact N-O 3.36Å; K651-G706 WeakPolarHBondContact O-CA 3.38Å; K651-Y708 HydrophobicContact CB-CD1 4.29Å; K651-Y708 HydrophobicContact CB-CD2 4.33Å; K651-Y708 HydrophobicContact CB-CG 3.82Å; K651-Y708 HydrophobicContact CD-CD1 3.57Å; K651-Y708 HydrophobicContact CD-CD2 3.67Å; K651-Y708 HydrophobicContact CD-CE1 3.69Å; K651-Y708 HydrophobicContact CD-CE2 3.83Å; K651-Y708 HydrophobicContact CD-CG 3.55Å; K651-Y708 HydrophobicContact CG-CG 4.37Å; K651-Y708 PolarHBondContact NZ-OH 3.43Å; K651-Y708 VanDerWaalsContact NZ-OH 3.15Å |
| 652 | G | 92.6 | Very high | 97.1 | Very high | 42 Ų | 42 | 33.2 Ų | 33.2 | 43% | 0.433 | 16% | 0.162 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | 83.4 | -49.3 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y673 | G652-Y673 VanDerWaalsContact CA-CE1 3.45Å; G652-Y673 VanDerWaalsContact N-CD2 3.28Å; G652-Y673 VanDerWaalsContact N-CZ 3.31Å; G652-Y673 WeakPolarHBondContact O-CD1 3.41Å; G652-Y673 WeakPolarHBondContact O-CE1 3.35Å |
| 653 | E | 93.9 | Very high | 97 | Very high | 108 Ų | 108 | 38.9 Ų | 38.9 | 51% | 0.505 | 19% | 0.192 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -137.8 | 171.5 | 172.4 | -62.3 | -170.7 | 163.9 | 0 | 0 | 109.6 | C650 K651 Y673 | C650-E653 PolarHBondContact SG-O 3.39Å; K651-E653 PolarHBondContact O-N 3.46Å; E653-Y673 VanDerWaalsContact C-CB 3.43Å; E653-Y673 WeakPolarHBondContact O-CB 3.4Å |
| 654 | N | 95.9 | Very high | 96.9 | Very high | 42 Ų | 42 | 42.4 Ų | 42.4 | 23% | 0.225 | 21% | 0.211 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -64.1 | 161.2 | 177.6 | -66.6 | 8.1 | 0 | 0 | 0 | 110.6 | Y670 D671 Y673 A704 S705 G706 | N654-Y670 HydrophobicContact CB-CE2 4.38Å; N654-Y670 PolarHBondContact ND2-OH 3.32Å; N654-D671 WeakPolarHBondContact CA-O 3.2Å; N654-D671 WeakPolarHBondContact CB-O 3.5Å; N654-Y673 PolarHBondContact OD1-N 3.41Å; N654-A704 HydrophobicContact CB-CB 4.44Å; N654-A704 CarbonylContact O-C 2.91Å; N654-A704 WeakPolarHBondContact O-CA 3.34Å; N654-S705 PolarHBondContact O-N 3.37Å; N654-G706 PolarHBondContact O-N 2.89Å |
| 655 | V | 96.6 | Very high | 96.8 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 23% | 0.23 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 129 | 177.5 | 163.9 | 0 | 0 | 0 | 0 | 109.8 | I648 C650 V657 Y670 D671 A704 G706 | I648-V655 HydrophobicContact CG2-CG1 3.92Å; I648-V655 HydrophobicContact CG2-CG2 4.44Å; C650-V655 HydrophobicContact CB-CB 4.31Å; C650-V655 HydrophobicContact CB-CG2 3.87Å; C650-V655 VanDerWaalsContact SG-CG2 3.57Å; V655-V657 HydrophobicContact CG1-CG1 4.06Å; V655-Y670 CarbonylContact O-C 3.56Å; V655-Y670 VanDerWaalsContact O-CA 3.29Å; V655-Y670 WeakPolarHBondContact O-CA 3.41Å; V655-Y670 VanDerWaalsContact O-CD2 3.3Å; V655-Y670 WeakPolarHBondContact O-CD2 3.35Å; V655-D671 PolarHBondContact N-O 3.4Å; V655-D671 PolarHBondContact O-N 3Å; V655-A704 CarbonylContact C-O 3.45Å; V655-A704 WeakPolarHBondContact CA-O 3.48Å; V655-G706 WeakPolarHBondContact CG2-O 3.41Å |
| 656 | W | 97.3 | Very high | 96.8 | Very high | 83 Ų | 83 | 47.9 Ų | 47.9 | 31% | 0.314 | 24% | 0.244 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.3 | 116 | 162.3 | -171.5 | 15.8 | 0 | 0 | 0 | 108.8 | Y668 Y670 P700 A704 | W656-Y668 AromaticContact CE2-CD1 3.81Å; W656-Y668 AromaticContact CZ2-CD1 3.98Å; W656-Y668 HydrophobicContact CZ2-CD1 3.98Å; W656-Y668 AromaticContact CZ2-CE1 3.77Å; W656-Y668 HydrophobicContact CZ2-CE1 3.77Å; W656-Y668 AromaticContact NE1-CD1 3.18Å; W656-Y668 AromaticContact NE1-CE1 3.87Å; W656-Y668 AromaticContact NE1-CG 3.7Å; W656-Y670 HydrophobicContact CB-CD2 3.9Å; W656-Y670 HydrophobicContact CB-CE2 4.43Å; W656-Y670 HydrophobicContact CG-CD2 4.21Å; W656-P700 HydrophobicContact CD2-CG 3.55Å; W656-P700 HydrophobicContact CE3-CG 3.72Å; W656-P700 HydrophobicContact CG-CG 4.07Å; W656-P700 HydrophobicContact CH2-CG 4.01Å; W656-P700 HydrophobicContact CZ2-CG 3.88Å; W656-P700 HydrophobicContact CZ3-CG 3.94Å; W656-P700 WeakPolarHBondContact O-CD 3.4Å; W656-A704 HydrophobicContact CB-CB 3.54Å; W656-A704 PolarHBondContact N-O 3.14Å |
| 657 | V | 97.6 | Very high | 96.7 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 25% | 0.254 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.2 | 146.9 | 172.6 | -69.1 | 0 | 0 | 0 | 0 | 110.7 | Y646 I648 V655 Y668 T669 I697 Q698 M699 L707 | Y646-V657 HydrophobicContact CD2-CG2 4.33Å; Y646-V657 HydrophobicContact CE2-CG2 3.78Å; I648-V657 HydrophobicContact CG1-CG1 4.41Å; I648-V657 HydrophobicContact CG1-CG2 4.42Å; V655-V657 HydrophobicContact CG1-CG1 4.06Å; V657-Y668 WeakPolarHBondContact O-CA 3.36Å; V657-T669 PolarHBondContact N-O 3.24Å; V657-T669 PolarHBondContact O-N 3.33Å; V657-I697 HydrophobicContact CB-CG2 3.98Å; V657-I697 HydrophobicContact CG1-CG2 4.05Å; V657-Q698 CarbonylContact C-O 3.48Å; V657-Q698 WeakPolarHBondContact CA-O 3.25Å; V657-M699 HydrophobicContact CG1-CG 3.99Å; V657-L707 HydrophobicContact CG1-CD1 4.09Å |
| 658 | A | 98 | Very high | 96.7 | Very high | 1 Ų | 1 | 50.8 Ų | 50.8 | 1% | 0.008 | 26% | 0.255 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 133.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | M660 P665 M667 Y668 I697 Q698 | A658-M660 HydrophobicContact CB-CG 4.4Å; A658-M660 HydrophobicContact CB-SD 3.58Å; A658-M660 VanDerWaalsContact CB-SD 3.58Å; A658-P665 HydrophobicContact CB-CB 4.38Å; A658-M667 CarbonylContact C-O 3.57Å; A658-M667 VanDerWaalsContact CA-O 3.31Å; A658-M667 WeakPolarHBondContact CA-O 3.39Å; A658-Y668 HydrophobicContact CB-CD1 3.65Å; A658-Y668 HydrophobicContact CB-CE1 3.65Å; A658-I697 CarbonylContact O-C 3.45Å; A658-I697 WeakPolarHBondContact O-CA 3.17Å; A658-Q698 PolarHBondContact N-O 3.15Å; A658-Q698 PolarHBondContact O-N 3.44Å |
| 659 | L | 98.5 | Very high | 96.7 | Very high | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 26% | 0.261 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.6 | 124.6 | 157.7 | -177.1 | 65.4 | 0 | 0 | 0 | 107.1 | F644 Y646 V666 M667 A685 L687 V695 I697 F717 | F644-L659 HydrophobicContact CB-CD2 4.29Å; Y646-L659 HydrophobicContact CE1-CB 4.01Å; Y646-L659 HydrophobicContact CE1-CD2 4.45Å; L659-V666 HydrophobicContact CB-CG2 4.2Å; L659-V666 HydrophobicContact CD2-CG2 3.93Å; L659-V666 HydrophobicContact CG-CG2 3.87Å; L659-V666 WeakPolarHBondContact O-CG2 3.4Å; L659-V666 PolarHBondContact O-N 2.61Å; L659-M667 HydrophobicContact CB-CB 4.14Å; L659-M667 PolarHBondContact N-O 3.49Å; L659-M667 PolarHBondContact O-N 3.38Å; L659-A685 HydrophobicContact CD2-CB 3.64Å; L659-L687 HydrophobicContact CD2-CD1 4.16Å; L659-V695 HydrophobicContact CD1-CG1 3.69Å; L659-V695 HydrophobicContact CG-CG1 4.38Å; L659-I697 HydrophobicContact CB-CD1 4.34Å; L659-I697 HydrophobicContact CD1-CD1 3.62Å; L659-F717 HydrophobicContact CD1-CE2 3.92Å; L659-F717 HydrophobicContact CD1-CZ 4.04Å |
| 660 | M | 98.3 | Very high | 96.7 | Very high | 12 Ų | 12 | 54.9 Ų | 54.9 | 6% | 0.059 | 27% | 0.272 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.4 | 136.6 | -176.3 | -55.2 | -61.7 | -64.4 | 0 | 0 | 109.3 | A658 N663 E664 P665 V695 Y696 Q698 | A658-M660 HydrophobicContact CB-CG 4.4Å; A658-M660 HydrophobicContact CB-SD 3.58Å; A658-M660 VanDerWaalsContact CB-SD 3.58Å; M660-N663 WeakPolarHBondContact CE-O 3.15Å; M660-E664 CarbonylContact C-O 3.59Å; M660-E664 WeakPolarHBondContact CA-O 3.29Å; M660-P665 HydrophobicContact CE-CB 4.21Å; M660-P665 HydrophobicContact SD-CB 3.73Å; M660-V695 VanDerWaalsContact O-CA 3.26Å; M660-V695 WeakPolarHBondContact O-CA 3.34Å; M660-V695 WeakPolarHBondContact O-CG1 3.43Å; M660-Y696 HydrophobicContact CB-CD1 4.05Å; M660-Y696 HydrophobicContact CB-CD2 3.88Å; M660-Y696 HydrophobicContact CB-CE1 3.74Å; M660-Y696 HydrophobicContact CB-CE2 3.58Å; M660-Y696 HydrophobicContact CB-CG 4.1Å; M660-Y696 VanDerWaalsContact CB-CZ 3.48Å; M660-Y696 HydrophobicContact CG-CD2 3.94Å; M660-Y696 HydrophobicContact CG-CE2 3.48Å; M660-Y696 VanDerWaalsContact CG-CE2 3.48Å; M660-Y696 PolarHBondContact N-O 3.46Å; M660-Y696 PolarHBondContact O-N 3.21Å; M660-Q698 HydrophobicContact CG-CB 3.72Å; M660-Q698 HydrophobicContact SD-CB 4.39Å |
| 661 | R | 98.1 | Very high | 96.7 | Very high | 64 Ų | 64 | 56.1 Ų | 56.1 | 24% | 0.242 | 28% | 0.278 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.8 | 125.6 | 165.8 | 179.1 | -168.4 | 174.3 | -178.1 | 5.1 | 108.1 | N663 E664 V666 P688 L689 D693 T694 V695 | R661-N663 PolarHBondContact O-N 3.43Å; R661-N663 VanDerWaalsContact O-N 3.15Å; R661-E664 PolarHBondContact N-O 3.14Å; R661-E664 PolarHBondContact O-N 3.25Å; R661-V666 HydrophobicContact CB-CG1 3.69Å; R661-P688 PolarHBondContact NH1-O 3.16Å; R661-P688 VanDerWaalsContact NH1-O 3.12Å; R661-P688 PolarHBondContact NH2-O 3.19Å; R661-L689 HydrophobicContact CG-CD2 4.18Å; R661-D693 IonicContact CZ-OD2 3.05Å; R661-D693 IonicContact NE-OD2 2.68Å; R661-D693 PolarHBondContact NE-OD2 3.26Å; R661-D693 IonicContact NH2-OD2 2.82Å; R661-D693 PolarHBondContact NH2-OD2 3.33Å; R661-T694 CarbonylContact C-O 3.56Å; R661-T694 VanDerWaalsContact CA-O 3.26Å; R661-T694 WeakPolarHBondContact CA-O 3.27Å; R661-V695 HydrophobicContact CG-CG2 4.43Å |
| 662 | N | 97 | Very high | 96.7 | Very high | 67 Ų | 67 | 57.5 Ų | 57.5 | 36% | 0.358 | 29% | 0.286 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.5 | 41.8 | 177.6 | -62 | -14.2 | 0 | 0 | 0 | 113.6 | E664 D693 T694 | N662-E664 PolarHBondContact O-N 3.41Å; N662-D693 PolarHBondContact ND2-OD1 3.24Å; N662-D693 WeakPolarHBondContact OD1-CA 3.46Å; N662-T694 PolarHBondContact N-O 3.34Å; N662-T694 PolarHBondContact OD1-N 3.3Å; N662-T694 PolarHBondContact OD1-OG1 3.49Å |
| 663 | N | 95.3 | Very high | 96.8 | Very high | 119 Ų | 119 | 58.3 Ų | 58.3 | 64% | 0.636 | 28% | 0.276 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 65.8 | 4.9 | -174.2 | -63 | 79.2 | 0 | 0 | 0 | 116.6 | M660 R661 Y696 | M660-N663 WeakPolarHBondContact CE-O 3.15Å; R661-N663 PolarHBondContact O-N 3.43Å; R661-N663 VanDerWaalsContact O-N 3.15Å; N663-Y696 PolarHBondContact ND2-OH 3.38Å |
| 664 | E | 96.7 | Very high | 96.6 | Very high | 143 Ų | 143 | 58.5 Ų | 58.5 | 67% | 0.668 | 28% | 0.275 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -99.6 | 136.9 | 171 | -61.3 | -171.7 | 155.3 | 0 | 0 | 111.6 | M660 R661 N662 V666 | M660-E664 CarbonylContact C-O 3.59Å; M660-E664 WeakPolarHBondContact CA-O 3.29Å; R661-E664 PolarHBondContact N-O 3.14Å; R661-E664 PolarHBondContact O-N 3.25Å; N662-E664 PolarHBondContact O-N 3.41Å; E664-V666 PolarHBondContact O-N 3.16Å |
| 665 | P | 96.8 | Very high | 96.4 | Very high | 60 Ų | 60 | 66.1 Ų | 66.1 | 39% | 0.39 | 31% | 0.307 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.9 | 119.5 | 177.8 | 29.6 | -31.8 | 0 | 0 | 0 | 111.2 | A658 M660 Y668 | A658-P665 HydrophobicContact CB-CB 4.38Å; M660-P665 HydrophobicContact CE-CB 4.21Å; M660-P665 HydrophobicContact SD-CB 3.73Å; P665-Y668 HydrophobicContact CB-CE1 4Å; P665-Y668 HydrophobicContact CB-CE2 4.2Å; P665-Y668 WeakPolarHBondContact CB-OH 3.43Å; P665-Y668 HydrophobicContact CG-CE2 4.49Å; P665-Y668 VanDerWaalsContact CG-OH 3.27Å; P665-Y668 WeakPolarHBondContact CG-OH 3.41Å |
| 666 | V | 97 | Very high | 96 | Very high | 63 Ų | 63 | 69.6 Ų | 69.6 | 38% | 0.382 | 34% | 0.343 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | -19.8 | -179.6 | -58.4 | 0 | 0 | 0 | 0 | 113.6 | L659 R661 E664 L687 | L659-V666 HydrophobicContact CB-CG2 4.2Å; L659-V666 HydrophobicContact CD2-CG2 3.93Å; L659-V666 HydrophobicContact CG-CG2 3.87Å; L659-V666 WeakPolarHBondContact O-CG2 3.4Å; L659-V666 PolarHBondContact O-N 2.61Å; R661-V666 HydrophobicContact CB-CG1 3.69Å; E664-V666 PolarHBondContact O-N 3.16Å; V666-L687 HydrophobicContact CB-CD2 4.21Å; V666-L687 HydrophobicContact CG2-CD1 4Å; V666-L687 HydrophobicContact CG2-CD2 3.81Å |
| 667 | M | 97.4 | Very high | 95.6 | Very high | 43 Ų | 43 | 68.4 Ų | 68.4 | 21% | 0.212 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153.1 | 145 | 174.1 | 177.5 | 170.5 | -75.1 | 0 | 0 | 110 | A658 L659 S684 A685 | A658-M667 CarbonylContact C-O 3.57Å; A658-M667 VanDerWaalsContact CA-O 3.31Å; A658-M667 WeakPolarHBondContact CA-O 3.39Å; L659-M667 HydrophobicContact CB-CB 4.14Å; L659-M667 PolarHBondContact N-O 3.49Å; L659-M667 PolarHBondContact O-N 3.38Å; M667-S684 WeakPolarHBondContact CE-O 3.4Å; M667-A685 HydrophobicContact CE-CB 4.01Å; M667-A685 HydrophobicContact SD-CB 4.31Å |
| 668 | Y | 97.6 | Very high | 95.4 | Very high | 104 Ų | 104 | 72.1 Ų | 72.1 | 41% | 0.408 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.9 | 145.6 | 170.7 | -66.1 | -72.8 | 0 | 0 | 0 | 110.8 | W656 V657 A658 P665 P700 | W656-Y668 AromaticContact CE2-CD1 3.81Å; W656-Y668 AromaticContact CZ2-CD1 3.98Å; W656-Y668 HydrophobicContact CZ2-CD1 3.98Å; W656-Y668 AromaticContact CZ2-CE1 3.77Å; W656-Y668 HydrophobicContact CZ2-CE1 3.77Å; W656-Y668 AromaticContact NE1-CD1 3.18Å; W656-Y668 AromaticContact NE1-CE1 3.87Å; W656-Y668 AromaticContact NE1-CG 3.7Å; V657-Y668 WeakPolarHBondContact O-CA 3.36Å; A658-Y668 HydrophobicContact CB-CD1 3.65Å; A658-Y668 HydrophobicContact CB-CE1 3.65Å; P665-Y668 HydrophobicContact CB-CE1 4Å; P665-Y668 HydrophobicContact CB-CE2 4.2Å; P665-Y668 WeakPolarHBondContact CB-OH 3.43Å; P665-Y668 HydrophobicContact CG-CE2 4.49Å; P665-Y668 VanDerWaalsContact CG-OH 3.27Å; P665-Y668 WeakPolarHBondContact CG-OH 3.41Å; Y668-P700 HydrophobicContact CE1-CG 4.45Å |
| 669 | T | 97.8 | Very high | 95.3 | Very high | 20 Ų | 20 | 74.5 Ų | 74.5 | 12% | 0.123 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.4 | 132.3 | 167.2 | -53 | 0 | 0 | 0 | 0 | 108.8 | Y646 V657 A681 | Y646-T669 WeakPolarHBondContact CE2-OG1 3.46Å; Y646-T669 PolarHBondContact OH-OG1 2.89Å; V657-T669 PolarHBondContact N-O 3.24Å; V657-T669 PolarHBondContact O-N 3.33Å; T669-A681 HydrophobicContact CG2-CB 4Å |
| 670 | Y | 96.8 | Very high | 95.2 | Very high | 106 Ų | 106 | 78.2 Ų | 78.2 | 42% | 0.416 | 40% | 0.396 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125 | 142.9 | 179.5 | -175.9 | -101.4 | 0 | 0 | 0 | 110 | N654 V655 W656 E672 A704 | N654-Y670 HydrophobicContact CB-CE2 4.38Å; N654-Y670 PolarHBondContact ND2-OH 3.32Å; V655-Y670 CarbonylContact O-C 3.56Å; V655-Y670 VanDerWaalsContact O-CA 3.29Å; V655-Y670 WeakPolarHBondContact O-CA 3.41Å; V655-Y670 VanDerWaalsContact O-CD2 3.3Å; V655-Y670 WeakPolarHBondContact O-CD2 3.35Å; W656-Y670 HydrophobicContact CB-CD2 3.9Å; W656-Y670 HydrophobicContact CB-CE2 4.43Å; W656-Y670 HydrophobicContact CG-CD2 4.21Å; Y670-E672 HydrophobicContact CD1-CG 4.48Å; Y670-E672 HydrophobicContact CE1-CG 3.68Å; Y670-A704 HydrophobicContact CE2-CB 4.21Å |
| 671 | D | 96.5 | Very high | 95 | Very high | 26 Ų | 26 | 78 Ų | 78 | 14% | 0.139 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.8 | 149.3 | 176.7 | -171.8 | 17.9 | 0 | 0 | 0 | 111.5 | C650 N654 V655 A681 | C650-D671 HydrophobicContact CB-CB 4.47Å; C650-D671 WeakPolarHBondContact CB-OD2 3.35Å; N654-D671 WeakPolarHBondContact CA-O 3.2Å; N654-D671 WeakPolarHBondContact CB-O 3.5Å; V655-D671 PolarHBondContact N-O 3.4Å; V655-D671 PolarHBondContact O-N 3Å; D671-A681 HydrophobicContact CB-CB 3.63Å |
| 672 | E | 94.7 | Very high | 95 | Very high | 105 Ų | 105 | 77.5 Ų | 77.5 | 49% | 0.491 | 40% | 0.403 | S | S | . | . | trans | -108.3 | 117.4 | -171.2 | -66.2 | -167.7 | 154.3 | 0 | 0 | 112.2 | Y670 K674 | Y670-E672 HydrophobicContact CD1-CG 4.48Å; Y670-E672 HydrophobicContact CE1-CG 3.68Å; E672-K674 PolarHBondContact O-N 3.22Å; E672-K674 VanDerWaalsContact O-N 3.09Å; E672-K674 PolarHBondContact O-NZ 3.5Å | ||
| 673 | Y | 94.1 | Very high | 95.1 | Very high | 58 Ų | 58 | 74.9 Ų | 74.9 | 23% | 0.227 | 39% | 0.392 | C | S | . | . | trans | -74.4 | 105.3 | 178.6 | 169.1 | -109.5 | 0 | 0 | 0 | 111.7 | K651 G652 E653 N654 K675 G676 S677 | K651-Y673 HydrophobicContact CG-CE2 4.42Å; G652-Y673 VanDerWaalsContact CA-CE1 3.45Å; G652-Y673 VanDerWaalsContact N-CD2 3.28Å; G652-Y673 VanDerWaalsContact N-CZ 3.31Å; G652-Y673 WeakPolarHBondContact O-CD1 3.41Å; G652-Y673 WeakPolarHBondContact O-CE1 3.35Å; E653-Y673 VanDerWaalsContact C-CB 3.43Å; E653-Y673 WeakPolarHBondContact O-CB 3.4Å; N654-Y673 PolarHBondContact OD1-N 3.41Å; Y673-K675 HydrophobicContact CE1-CB 4.44Å; Y673-K675 PolarHBondContact O-N 3.46Å; Y673-G676 PolarHBondContact OH-N 3.35Å; Y673-G676 VanDerWaalsContact OH-N 3.14Å; Y673-S677 WeakPolarHBondContact CD2-O 3.36Å; Y673-S677 WeakPolarHBondContact CE2-O 3.32Å | ||
| 674 | K | 91.5 | Very high | 95.2 | Very high | 112 Ų | 112 | 71.8 Ų | 71.8 | 49% | 0.487 | 38% | 0.379 | S | S | . | . | trans | -79.6 | 113.8 | 171.7 | -63.2 | 166.5 | -155.2 | 83.8 | 0 | 108.3 | E672 G676 S677 D679 | E672-K674 PolarHBondContact O-N 3.22Å; E672-K674 VanDerWaalsContact O-N 3.09Å; E672-K674 PolarHBondContact O-NZ 3.5Å; K674-G676 PolarHBondContact O-N 3.43Å; K674-S677 WeakPolarHBondContact O-CB 3.48Å; K674-S677 PolarHBondContact O-N 2.92Å; K674-D679 IonicContact NZ-OD2 3.78Å; K674-D679 PolarHBondContact NZ-OD2 3.14Å | ||
| 675 | K | 90.7 | Very high | 95.2 | Very high | 202 Ų | 202 | 65.5 Ų | 65.5 | 88% | 0.878 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -47.6 | 112.1 | -172.7 | -176.3 | 177.5 | -179.6 | 175.2 | 0 | 113.3 | Y673 | Y673-K675 HydrophobicContact CE1-CB 4.44Å; Y673-K675 PolarHBondContact O-N 3.46Å |
| 676 | G | 88 | Confident | 95.3 | Very high | 74 Ų | 74 | 66.7 Ų | 66.7 | 76% | 0.763 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 96.4 | -6.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | Y673 K674 | Y673-G676 PolarHBondContact OH-N 3.35Å; Y673-G676 VanDerWaalsContact OH-N 3.14Å; K674-G676 PolarHBondContact O-N 3.43Å |
| 677 | S | 90.1 | Very high | 95.3 | Very high | 57 Ų | 57 | 64.3 Ų | 64.3 | 40% | 0.399 | 34% | 0.343 | S | S | . | . | trans | -95.9 | 143.3 | 169.4 | -161.6 | 0 | 0 | 0 | 0 | 110.6 | Y673 K674 | Y673-S677 WeakPolarHBondContact CD2-O 3.36Å; Y673-S677 WeakPolarHBondContact CE2-O 3.32Å; K674-S677 WeakPolarHBondContact O-CB 3.48Å; K674-S677 PolarHBondContact O-N 2.92Å | ||
| 678 | L | 92.8 | Very high | 95.3 | Very high | 79 Ų | 79 | 64.9 Ų | 64.9 | 41% | 0.414 | 35% | 0.35 | S | S | . | . | trans | -94.8 | 124.2 | 161.6 | -179.8 | 71.8 | 0 | 0 | 0 | 106.5 | H649 K651 Y708 V713 | H649-L678 HydrophobicContact CB-CD1 4.19Å; K651-L678 HydrophobicContact CB-CD1 3.96Å; K651-L678 HydrophobicContact CD-CD1 4.13Å; K651-L678 HydrophobicContact CG-CD1 4.17Å; L678-Y708 HydrophobicContact CD1-CD1 4.04Å; L678-V713 HydrophobicContact CD2-CG1 3.99Å; L678-V713 HydrophobicContact CD2-CG2 4.2Å | ||
| 679 | D | 95.3 | Very high | 95.3 | Very high | 50 Ų | 50 | 60 Ų | 60 | 27% | 0.267 | 33% | 0.331 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 172.6 | 178.7 | -130.6 | -36.5 | 0 | 0 | 0 | 111.1 | H649 C650 K674 | H649-D679 WeakPolarHBondContact CA-O 3.32Å; H649-D679 PolarHBondContact ND1-O 3.47Å; C650-D679 HydrophobicContact CB-CB 4.15Å; C650-D679 PolarHBondContact N-O 3.39Å; C650-D679 PolarHBondContact O-N 3.33Å; K674-D679 IonicContact NZ-OD2 3.78Å; K674-D679 PolarHBondContact NZ-OD2 3.14Å |
| 680 | Q | 96.1 | Very high | 95.3 | Very high | 78 Ų | 78 | 64.1 Ų | 64.1 | 36% | 0.364 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.1 | 103.8 | -172 | -158.4 | -71.9 | -81.4 | 0 | 0 | 112.7 | I648 S682 | I648-Q680 CarbonylContact O-C 3.59Å; I648-Q680 WeakPolarHBondContact O-CA 3.3Å; I648-Q680 PolarHBondContact O-NE2 3.47Å; Q680-S682 PolarHBondContact NE2-OG 3.17Å; Q680-S682 PolarHBondContact OE1-OG 3.15Å |
| 681 | A | 95.6 | Very high | 95.3 | Very high | 7 Ų | 7 | 62.8 Ų | 62.8 | 6% | 0.058 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.4 | 125.9 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I648 T669 D671 | I648-A681 PolarHBondContact N-O 3.3Å; I648-A681 PolarHBondContact O-N 3.39Å; T669-A681 HydrophobicContact CG2-CB 4Å; D671-A681 HydrophobicContact CB-CB 3.63Å |
| 682 | S | 97.8 | Very high | 95.3 | Very high | 55 Ų | 55 | 64 Ų | 64 | 39% | 0.385 | 37% | 0.371 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.3 | 149.6 | 177.6 | -63 | 0 | 0 | 0 | 0 | 111.9 | Y646 H647 Q680 | Y646-S682 WeakPolarHBondContact O-CA 3.38Å; H647-S682 PolarHBondContact ND1-OG 3.41Å; Q680-S682 PolarHBondContact NE2-OG 3.17Å; Q680-S682 PolarHBondContact OE1-OG 3.15Å |
| 683 | G | 97.5 | Very high | 95.4 | Very high | 12 Ų | 12 | 59.8 Ų | 59.8 | 12% | 0.124 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.9 | 154.7 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | A645 Y646 | A645-G683 WeakPolarHBondContact CA-O 3.45Å; Y646-G683 WeakPolarHBondContact CD1-O 3.34Å; Y646-G683 PolarHBondContact N-O 3.16Å; Y646-G683 PolarHBondContact O-N 3.21Å; Y646-G683 VanDerWaalsContact O-N 3.11Å |
| 684 | S | 97.9 | Very high | 95.6 | Very high | 53 Ų | 53 | 58.5 Ų | 58.5 | 37% | 0.371 | 35% | 0.35 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.1 | 139.2 | 179.5 | 57 | 0 | 0 | 0 | 0 | 111.7 | Y643 F644 M667 | Y643-S684 VanDerWaalsContact OH-CB 3.31Å; Y643-S684 WeakPolarHBondContact OH-CB 3.5Å; Y643-S684 PolarHBondContact OH-OG 3.31Å; F644-S684 CarbonylContact O-C 3.53Å; F644-S684 WeakPolarHBondContact O-CA 3.41Å; F644-S684 VanDerWaalsContact O-CB 3.24Å; F644-S684 WeakPolarHBondContact O-CB 3.43Å; M667-S684 WeakPolarHBondContact CE-O 3.4Å |
| 685 | A | 97.6 | Very high | 96 | Very high | 12 Ų | 12 | 53.1 Ų | 53.1 | 10% | 0.099 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.7 | 148.1 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F644 L659 M667 L687 | F644-A685 PolarHBondContact N-O 3.35Å; F644-A685 PolarHBondContact O-N 3.44Å; L659-A685 HydrophobicContact CD2-CB 3.64Å; M667-A685 HydrophobicContact CE-CB 4.01Å; M667-A685 HydrophobicContact SD-CB 4.31Å; A685-L687 HydrophobicContact CB-CD2 4.31Å; A685-L687 HydrophobicContact CB-CG 4.35Å |
| 686 | V | 98.1 | Very high | 96.4 | Very high | 84 Ų | 84 | 43.8 Ų | 43.8 | 51% | 0.509 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.8 | 123.4 | 167.5 | 176.3 | 0 | 0 | 0 | 0 | 108.1 | I641 Y642 Y643 L722 | I641-V686 HydrophobicContact CG2-CG1 3.33Å; Y642-V686 CarbonylContact O-C 3.54Å; Y642-V686 VanDerWaalsContact O-CA 3.3Å; Y642-V686 WeakPolarHBondContact O-CA 3.38Å; Y643-V686 HydrophobicContact CD2-CG2 3.95Å; V686-L722 HydrophobicContact CG1-CD1 4.39Å; V686-L722 HydrophobicContact CG2-CD1 4.33Å |
| 687 | L | 97.4 | Very high | 96.8 | Very high | 14 Ų | 14 | 40.2 Ų | 40.2 | 7% | 0.073 | 25% | 0.25 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.1 | 124 | -174.6 | -60.6 | 179.5 | 0 | 0 | 0 | 110.9 | Y642 F644 L659 V666 A685 L689 V695 | Y642-L687 PolarHBondContact N-O 3.39Å; Y642-L687 PolarHBondContact O-N 3.42Å; F644-L687 HydrophobicContact CD2-CB 4.38Å; F644-L687 HydrophobicContact CD2-CD1 3.82Å; F644-L687 HydrophobicContact CD2-CG 4.22Å; F644-L687 HydrophobicContact CE2-CB 4.32Å; F644-L687 HydrophobicContact CE2-CD1 4.02Å; L659-L687 HydrophobicContact CD2-CD1 4.16Å; V666-L687 HydrophobicContact CB-CD2 4.21Å; V666-L687 HydrophobicContact CG2-CD1 4Å; V666-L687 HydrophobicContact CG2-CD2 3.81Å; A685-L687 HydrophobicContact CB-CD2 4.31Å; A685-L687 HydrophobicContact CB-CG 4.35Å; L687-L689 HydrophobicContact CB-CD2 3.93Å; L687-L689 HydrophobicContact CB-CG 4.37Å; L687-L689 PolarHBondContact O-N 3.12Å; L687-V695 HydrophobicContact CD1-CG1 4.16Å; L687-V695 HydrophobicContact CD1-CG2 4.28Å |
| 688 | P | 97.4 | Very high | 97.2 | Very high | 55 Ų | 55 | 39 Ų | 39 | 36% | 0.357 | 24% | 0.238 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -77.1 | 111.3 | 168.6 | 29.7 | -31 | 0 | 0 | 0 | 109.5 | G640 I641 R661 M725 | G640-P688 CarbonylContact O-C 3.54Å; I641-P688 HydrophobicContact CD1-CB 3.7Å; R661-P688 PolarHBondContact NH1-O 3.16Å; R661-P688 VanDerWaalsContact NH1-O 3.12Å; R661-P688 PolarHBondContact NH2-O 3.19Å; P688-M725 HydrophobicContact CB-CE 4.22Å |
| 689 | L | 97.8 | Very high | 97.4 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 22% | 0.218 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 150.6 | -177.1 | -58 | -172 | 0 | 0 | 0 | 113 | F634 C636 G640 Y642 F644 R661 L687 D693 V695 | F634-L689 HydrophobicContact CD1-CD1 4.38Å; F634-L689 HydrophobicContact CE1-CD1 3.82Å; C636-L689 HydrophobicContact CB-CB 4.11Å; C636-L689 HydrophobicContact CB-CD1 4.12Å; C636-L689 VanDerWaalsContact SG-CB 3.56Å; G640-L689 PolarHBondContact N-O 3.47Å; G640-L689 VanDerWaalsContact N-O 3.09Å; G640-L689 PolarHBondContact O-N 3.1Å; Y642-L689 HydrophobicContact CD2-CB 3.85Å; Y642-L689 HydrophobicContact CD2-CD1 3.73Å; Y642-L689 HydrophobicContact CD2-CG 3.84Å; Y642-L689 HydrophobicContact CE2-CB 4.11Å; Y642-L689 HydrophobicContact CE2-CD1 4.2Å; Y642-L689 HydrophobicContact CE2-CG 4.48Å; Y642-L689 HydrophobicContact CG-CD1 3.91Å; Y642-L689 HydrophobicContact CG-CG 4.32Å; F644-L689 HydrophobicContact CE2-CD1 3.87Å; F644-L689 HydrophobicContact CZ-CD1 3.84Å; R661-L689 HydrophobicContact CG-CD2 4.18Å; L687-L689 HydrophobicContact CB-CD2 3.93Å; L687-L689 HydrophobicContact CB-CG 4.37Å; L687-L689 PolarHBondContact O-N 3.12Å; L689-D693 WeakPolarHBondContact CA-OD2 3.07Å; L689-D693 HydrophobicContact CB-CB 4.2Å; L689-D693 HydrophobicContact CD2-CB 4.16Å; L689-V695 HydrophobicContact CD1-CG2 3.76Å; L689-V695 HydrophobicContact CD2-CG2 3.9Å |
| 690 | Q | 97.5 | Very high | 97.3 | Very high | 107 Ų | 107 | 35.5 Ų | 35.5 | 50% | 0.5 | 22% | 0.222 | S | C | . | . | trans | -112.4 | 158.5 | 172.8 | -68.5 | -64.3 | -21.7 | 0 | 0 | 111.2 | C636 G692 D693 | C636-Q690 WeakPolarHBondContact CB-O 3.49Å; C636-Q690 PolarHBondContact SG-O 3.21Å; Q690-G692 PolarHBondContact O-N 3Å; Q690-D693 PolarHBondContact N-OD2 3.14Å; Q690-D693 WeakPolarHBondContact O-CB 3.28Å; Q690-D693 PolarHBondContact O-N 3.18Å | ||
| 691 | P | 96.9 | Very high | 97.2 | Very high | 79 Ų | 79 | 32.9 Ų | 32.9 | 51% | 0.513 | 21% | 0.213 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | 127 | -179.1 | -24.4 | 36.4 | 0 | 0 | 0 | 111.9 | P639 | P639-P691 HydrophobicContact CB-CG 4.33Å; P639-P691 HydrophobicContact CG-CG 4.41Å |
| 692 | G | 96.1 | Very high | 97 | Very high | 50 Ų | 50 | 37.9 Ų | 37.9 | 52% | 0.515 | 24% | 0.239 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 91.3 | -8.7 | -172.2 | 0 | 0 | 0 | 0 | 0 | 115 | C636 Q690 | C636-G692 PolarHBondContact O-N 3.15Å; Q690-G692 PolarHBondContact O-N 3Å |
| 693 | D | 98.2 | Very high | 96.7 | Very high | 17 Ų | 17 | 43 Ų | 43 | 9% | 0.091 | 26% | 0.257 | C | S | . | . | trans | -59.9 | 141.6 | 170.2 | -82.4 | -7.1 | 0 | 0 | 0 | 110.7 | T635 C636 R661 N662 L689 Q690 | T635-D693 WeakPolarHBondContact CA-O 3.41Å; C636-D693 HydrophobicContact CB-CB 4.08Å; C636-D693 WeakPolarHBondContact CB-O 3.45Å; C636-D693 PolarHBondContact N-O 3.16Å; R661-D693 IonicContact CZ-OD2 3.05Å; R661-D693 IonicContact NE-OD2 2.68Å; R661-D693 PolarHBondContact NE-OD2 3.26Å; R661-D693 IonicContact NH2-OD2 2.82Å; R661-D693 PolarHBondContact NH2-OD2 3.33Å; N662-D693 PolarHBondContact ND2-OD1 3.24Å; N662-D693 WeakPolarHBondContact OD1-CA 3.46Å; L689-D693 WeakPolarHBondContact CA-OD2 3.07Å; L689-D693 HydrophobicContact CB-CB 4.2Å; L689-D693 HydrophobicContact CD2-CB 4.16Å; Q690-D693 PolarHBondContact N-OD2 3.14Å; Q690-D693 WeakPolarHBondContact O-CB 3.28Å; Q690-D693 PolarHBondContact O-N 3.18Å | ||
| 694 | T | 98.3 | Very high | 96.5 | Very high | 31 Ų | 31 | 42.7 Ų | 42.7 | 19% | 0.19 | 25% | 0.253 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 138.5 | -179.9 | 52.7 | 0 | 0 | 0 | 0 | 110.8 | I633 F634 R661 N662 | I633-T694 HydrophobicContact CG2-CG2 3.92Å; F634-T694 CarbonylContact O-C 3.6Å; F634-T694 VanDerWaalsContact O-CA 3.29Å; F634-T694 WeakPolarHBondContact O-CA 3.37Å; R661-T694 CarbonylContact C-O 3.56Å; R661-T694 VanDerWaalsContact CA-O 3.26Å; R661-T694 WeakPolarHBondContact CA-O 3.27Å; N662-T694 PolarHBondContact N-O 3.34Å; N662-T694 PolarHBondContact OD1-N 3.3Å; N662-T694 PolarHBondContact OD1-OG1 3.49Å |
| 695 | V | 98.6 | Very high | 96.4 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 24% | 0.244 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 132.6 | 176.8 | -173.8 | 0 | 0 | 0 | 0 | 110.4 | F634 F644 L659 M660 R661 L687 L689 F717 | F634-V695 WeakPolarHBondContact CB-O 3.42Å; F634-V695 HydrophobicContact CD1-CB 4.28Å; F634-V695 HydrophobicContact CD1-CG2 4.45Å; F634-V695 PolarHBondContact N-O 3.45Å; F634-V695 PolarHBondContact O-N 3.13Å; F644-V695 HydrophobicContact CD1-CG1 3.91Å; F644-V695 HydrophobicContact CD2-CG1 4.27Å; F644-V695 HydrophobicContact CE1-CB 3.86Å; F644-V695 HydrophobicContact CE1-CG1 3.7Å; F644-V695 HydrophobicContact CE1-CG2 4.36Å; F644-V695 HydrophobicContact CE2-CB 4.34Å; F644-V695 HydrophobicContact CE2-CG1 4.09Å; F644-V695 HydrophobicContact CE2-CG2 4.02Å; F644-V695 HydrophobicContact CG-CG1 4.19Å; F644-V695 HydrophobicContact CZ-CB 3.75Å; F644-V695 HydrophobicContact CZ-CG1 3.82Å; F644-V695 HydrophobicContact CZ-CG2 3.73Å; L659-V695 HydrophobicContact CD1-CG1 3.69Å; L659-V695 HydrophobicContact CG-CG1 4.38Å; M660-V695 VanDerWaalsContact O-CA 3.26Å; M660-V695 WeakPolarHBondContact O-CA 3.34Å; M660-V695 WeakPolarHBondContact O-CG1 3.43Å; R661-V695 HydrophobicContact CG-CG2 4.43Å; L687-V695 HydrophobicContact CD1-CG1 4.16Å; L687-V695 HydrophobicContact CD1-CG2 4.28Å; L689-V695 HydrophobicContact CD1-CG2 3.76Å; L689-V695 HydrophobicContact CD2-CG2 3.9Å; V695-F717 HydrophobicContact CG1-CZ 4.28Å |
| 696 | Y | 98.5 | Very high | 96.3 | Very high | 5 Ų | 5 | 40.9 Ų | 40.9 | 2% | 0.02 | 24% | 0.239 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -156 | 165.8 | -178.7 | 61.4 | -88.4 | 0 | 0 | 0 | 112.3 | P613 G632 I633 M660 N663 Q698 | P613-Y696 HydrophobicContact CB-CD2 3.62Å; P613-Y696 HydrophobicContact CB-CE2 4.19Å; P613-Y696 HydrophobicContact CB-CG 4.1Å; P613-Y696 HydrophobicContact CG-CD2 3.71Å; P613-Y696 HydrophobicContact CG-CE2 3.8Å; P613-Y696 HydrophobicContact CG-CG 4.22Å; G632-Y696 WeakPolarHBondContact O-CB 3.3Å; I633-Y696 HydrophobicContact CG1-CD1 4.19Å; I633-Y696 HydrophobicContact CG1-CG 4.26Å; M660-Y696 HydrophobicContact CB-CD1 4.05Å; M660-Y696 HydrophobicContact CB-CD2 3.88Å; M660-Y696 HydrophobicContact CB-CE1 3.74Å; M660-Y696 HydrophobicContact CB-CE2 3.58Å; M660-Y696 HydrophobicContact CB-CG 4.1Å; M660-Y696 VanDerWaalsContact CB-CZ 3.48Å; M660-Y696 HydrophobicContact CG-CD2 3.94Å; M660-Y696 HydrophobicContact CG-CE2 3.48Å; M660-Y696 VanDerWaalsContact CG-CE2 3.48Å; M660-Y696 PolarHBondContact N-O 3.46Å; M660-Y696 PolarHBondContact O-N 3.21Å; N663-Y696 PolarHBondContact ND2-OH 3.38Å; Y696-Q698 HydrophobicContact CD2-CB 4.2Å; Y696-Q698 HydrophobicContact CE2-CB 3.9Å; Y696-Q698 HydrophobicContact CE2-CG 4.41Å; Y696-Q698 PolarHBondContact OH-OE1 3.41Å |
| 697 | I | 98.4 | Very high | 96.2 | Very high | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 22% | 0.215 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.6 | 141.4 | 170.8 | -54.1 | -62.1 | 0 | 0 | 0 | 109.2 | P613 V614 F616 Y646 V657 A658 L659 F717 | P613-I697 CarbonylContact C-O 3.55Å; P613-I697 WeakPolarHBondContact CA-O 3.31Å; V614-I697 HydrophobicContact CB-CB 4.33Å; V614-I697 HydrophobicContact CB-CG2 4.47Å; V614-I697 HydrophobicContact CG2-CG2 4.25Å; V614-I697 PolarHBondContact N-O 3.23Å; F616-I697 HydrophobicContact CE2-CB 3.97Å; F616-I697 HydrophobicContact CE2-CG1 3.92Å; F616-I697 HydrophobicContact CZ-CB 4.25Å; F616-I697 HydrophobicContact CZ-CG1 4.08Å; Y646-I697 HydrophobicContact CD1-CD1 3.38Å; Y646-I697 HydrophobicContact CE1-CD1 3.83Å; Y646-I697 HydrophobicContact CG-CD1 3.77Å; V657-I697 HydrophobicContact CB-CG2 3.98Å; V657-I697 HydrophobicContact CG1-CG2 4.05Å; A658-I697 CarbonylContact O-C 3.45Å; A658-I697 WeakPolarHBondContact O-CA 3.17Å; L659-I697 HydrophobicContact CB-CD1 4.34Å; L659-I697 HydrophobicContact CD1-CD1 3.62Å; I697-F717 HydrophobicContact CD1-CD2 3.94Å; I697-F717 HydrophobicContact CD1-CE2 3.83Å; I697-F717 HydrophobicContact CD1-CG 4.49Å; I697-F717 HydrophobicContact CD1-CZ 4.28Å; I697-F717 HydrophobicContact CG1-CB 4.42Å; I697-F717 HydrophobicContact CG1-CD1 4.08Å; I697-F717 HydrophobicContact CG1-CD2 3.83Å; I697-F717 HydrophobicContact CG1-CE1 4.26Å; I697-F717 HydrophobicContact CG1-CE2 4.02Å; I697-F717 HydrophobicContact CG1-CG 3.86Å; I697-F717 HydrophobicContact CG1-CZ 4.23Å |
| 698 | Q | 97.6 | Very high | 96.2 | Very high | 31 Ų | 31 | 38.6 Ų | 38.6 | 15% | 0.145 | 22% | 0.221 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -139.2 | 145.5 | 177.3 | -172.9 | 169 | 23.3 | 0 | 0 | 110.3 | G611 V657 A658 M660 Y696 | G611-Q698 VanDerWaalsContact C-NE2 3.28Å; G611-Q698 PolarHBondContact O-NE2 3.27Å; V657-Q698 CarbonylContact C-O 3.48Å; V657-Q698 WeakPolarHBondContact CA-O 3.25Å; A658-Q698 PolarHBondContact N-O 3.15Å; A658-Q698 PolarHBondContact O-N 3.44Å; M660-Q698 HydrophobicContact CG-CB 3.72Å; M660-Q698 HydrophobicContact SD-CB 4.39Å; Y696-Q698 HydrophobicContact CD2-CB 4.2Å; Y696-Q698 HydrophobicContact CE2-CB 3.9Å; Y696-Q698 HydrophobicContact CE2-CG 4.41Å; Y696-Q698 PolarHBondContact OH-OE1 3.41Å |
| 699 | M | 96.9 | Very high | 96.1 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.204 | C | C | . | . | trans | -94.5 | 116.8 | 164.4 | -66.3 | -172.9 | -61.2 | 0 | 0 | 108.5 | P608 V610 G611 V657 L707 | P608-M699 HydrophobicContact CG-CE 3.93Å; P608-M699 WeakPolarHBondContact O-CE 3.15Å; V610-M699 HydrophobicContact CG2-CB 4.32Å; V610-M699 HydrophobicContact CG2-CE 3.95Å; G611-M699 PolarHBondContact N-O 3.5Å; V657-M699 HydrophobicContact CG1-CG 3.99Å; M699-L707 HydrophobicContact CE-CB 4.21Å; M699-L707 HydrophobicContact CG-CD1 4.22Å; M699-L707 HydrophobicContact SD-CB 3.43Å; M699-L707 WeakPolarHBondContact SD-CB 3.15Å; M699-L707 HydrophobicContact SD-CD1 3.9Å; M699-L707 HydrophobicContact SD-CG 4.32Å | ||
| 700 | P | 93.8 | Very high | 95.7 | Very high | 55 Ų | 55 | 36.8 Ų | 36.8 | 36% | 0.357 | 21% | 0.212 | S | C | . | . | trans | -85.4 | -10.4 | -173.8 | 34.1 | -35.8 | 0 | 0 | 0 | 113.9 | W656 Y668 | W656-P700 HydrophobicContact CD2-CG 3.55Å; W656-P700 HydrophobicContact CE3-CG 3.72Å; W656-P700 HydrophobicContact CG-CG 4.07Å; W656-P700 HydrophobicContact CH2-CG 4.01Å; W656-P700 HydrophobicContact CZ2-CG 3.88Å; W656-P700 HydrophobicContact CZ3-CG 3.94Å; W656-P700 WeakPolarHBondContact O-CD 3.4Å; Y668-P700 HydrophobicContact CE1-CG 4.45Å | ||
| 701 | S | 93.1 | Very high | 95.2 | Very high | 24 Ų | 24 | 38.6 Ų | 38.6 | 17% | 0.168 | 22% | 0.221 | C | C | . | . | trans | -140.5 | 146.8 | 179.8 | -179.2 | 0 | 0 | 0 | 0 | 111.8 | V610 Q703 | V610-S701 VanDerWaalsContact CG1-C 3.43Å; S701-Q703 PolarHBondContact OG-N 3.49Å | ||
| 702 | D | 92.1 | Very high | 94.8 | Very high | 111 Ų | 111 | 44 Ų | 44 | 59% | 0.594 | 23% | 0.232 | S | C | * | . | G | 310 helix | trans | -73.4 | -34.4 | 174.9 | 56 | -21.1 | 0 | 0 | 0 | 112.4 | V610 A704 S705 | V610-D702 HydrophobicContact CG1-CB 4.42Å; D702-A704 PolarHBondContact O-N 3.29Å; D702-S705 WeakPolarHBondContact O-CB 3.35Å; D702-S705 PolarHBondContact O-N 3.47Å; D702-S705 PolarHBondContact O-OG 3.35Å |
| 703 | Q | 90.7 | Very high | 94.7 | Very high | 163 Ų | 163 | 43.1 Ų | 43.1 | 76% | 0.762 | 22% | 0.217 | S | C | * | . | G | 310 helix | trans | -63.5 | -9 | 177.6 | -57.7 | -175.8 | -4.1 | 0 | 0 | 114.6 | S701 | S701-Q703 PolarHBondContact OG-N 3.49Š|
| 704 | A | 93.4 | Very high | 94.5 | Very high | 5 Ų | 5 | 46 Ų | 46 | 4% | 0.041 | 23% | 0.23 | C | C | . | . | G | 310 helix | trans | -141.2 | 49.4 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111 | N654 V655 W656 Y670 D702 | N654-A704 HydrophobicContact CB-CB 4.44Å; N654-A704 CarbonylContact O-C 2.91Å; N654-A704 WeakPolarHBondContact O-CA 3.34Å; V655-A704 CarbonylContact C-O 3.45Å; V655-A704 WeakPolarHBondContact CA-O 3.48Å; W656-A704 HydrophobicContact CB-CB 3.54Å; W656-A704 PolarHBondContact N-O 3.14Å; Y670-A704 HydrophobicContact CE2-CB 4.21Å; D702-A704 PolarHBondContact O-N 3.29Å |
| 705 | S | 95.3 | Very high | 94.4 | Very high | 26 Ų | 26 | 44.6 Ų | 44.6 | 18% | 0.182 | 22% | 0.221 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 13.3 | -172.9 | 62.9 | 0 | 0 | 0 | 0 | 115.2 | V610 N654 D702 L707 | V610-S705 VanDerWaalsContact CG2-CB 3.45Å; N654-S705 PolarHBondContact O-N 3.37Å; D702-S705 WeakPolarHBondContact O-CB 3.35Å; D702-S705 PolarHBondContact O-N 3.47Å; D702-S705 PolarHBondContact O-OG 3.35Å; S705-L707 PolarHBondContact O-N 3.44Å |
| 706 | G | 95.9 | Very high | 94.4 | Very high | 1 Ų | 1 | 45.5 Ų | 45.5 | 1% | 0.01 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 24.7 | -173.1 | 0 | 0 | 0 | 0 | 0 | 117.2 | K651 N654 V655 Y708 | K651-G706 PolarHBondContact N-O 3.36Å; K651-G706 WeakPolarHBondContact O-CA 3.38Å; N654-G706 PolarHBondContact O-N 2.89Å; V655-G706 WeakPolarHBondContact CG2-O 3.41Å; G706-Y708 PolarHBondContact O-N 3.42Å |
| 707 | L | 97 | Very high | 94.4 | Very high | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 23% | 0.226 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -67.1 | 110.5 | -179.7 | -171.1 | 173.1 | 0 | 0 | 0 | 109.2 | F607 P608 V614 I648 V657 M699 S705 | F607-L707 WeakPolarHBondContact CA-O 3.49Å; F607-L707 PolarHBondContact N-O 3.29Å; P608-L707 WeakPolarHBondContact CD-O 2.97Å; P608-L707 HydrophobicContact CG-CB 4.36Å; P608-L707 HydrophobicContact CG-CD1 3.87Å; P608-L707 HydrophobicContact CG-CD2 3.93Å; P608-L707 HydrophobicContact CG-CG 4.24Å; V614-L707 HydrophobicContact CG1-CD1 3.98Å; V614-L707 HydrophobicContact CG2-CD1 3.88Å; I648-L707 HydrophobicContact CD1-CD1 4.18Å; I648-L707 HydrophobicContact CD1-CG 4.25Å; I648-L707 HydrophobicContact CG2-CB 4.4Å; I648-L707 HydrophobicContact CG2-CD2 4.49Å; I648-L707 HydrophobicContact CG2-CG 3.76Å; V657-L707 HydrophobicContact CG1-CD1 4.09Å; M699-L707 HydrophobicContact CE-CB 4.21Å; M699-L707 HydrophobicContact CG-CD1 4.22Å; M699-L707 HydrophobicContact SD-CB 3.43Å; M699-L707 WeakPolarHBondContact SD-CB 3.15Å; M699-L707 HydrophobicContact SD-CD1 3.9Å; M699-L707 HydrophobicContact SD-CG 4.32Å; S705-L707 PolarHBondContact O-N 3.44Å |
| 708 | Y | 96.9 | Very high | 94.4 | Very high | 50 Ų | 50 | 46.6 Ų | 46.6 | 20% | 0.196 | 24% | 0.235 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 138.5 | -173.9 | -172.2 | -112.6 | 0 | 0 | 0 | 112.7 | P606 F607 H649 K651 L678 G706 V713 S715 | P606-Y708 HydrophobicContact CB-CD2 3.64Å; P606-Y708 HydrophobicContact CB-CE2 3.71Å; F607-Y708 HydrophobicContact CE1-CD2 4.26Å; F607-Y708 HydrophobicContact CE2-CD2 4.25Å; F607-Y708 AromaticContact CZ-CD2 3.81Å; F607-Y708 HydrophobicContact CZ-CD2 3.81Å; F607-Y708 HydrophobicContact CZ-CE2 4.47Å; H649-Y708 PolarHBondContact O-N 3.5Å; K651-Y708 HydrophobicContact CB-CD1 4.29Å; K651-Y708 HydrophobicContact CB-CD2 4.33Å; K651-Y708 HydrophobicContact CB-CG 3.82Å; K651-Y708 HydrophobicContact CD-CD1 3.57Å; K651-Y708 HydrophobicContact CD-CD2 3.67Å; K651-Y708 HydrophobicContact CD-CE1 3.69Å; K651-Y708 HydrophobicContact CD-CE2 3.83Å; K651-Y708 HydrophobicContact CD-CG 3.55Å; K651-Y708 HydrophobicContact CG-CG 4.37Å; K651-Y708 PolarHBondContact NZ-OH 3.43Å; K651-Y708 VanDerWaalsContact NZ-OH 3.15Å; L678-Y708 HydrophobicContact CD1-CD1 4.04Å; G706-Y708 PolarHBondContact O-N 3.42Å; Y708-V713 HydrophobicContact CD1-CB 4.28Å; Y708-V713 HydrophobicContact CD1-CG1 3.84Å; Y708-V713 HydrophobicContact CE1-CB 4.03Å; Y708-V713 HydrophobicContact CE1-CG1 4.08Å; Y708-V713 HydrophobicContact CE1-CG2 4.3Å; Y708-S715 PolarHBondContact O-OG 3.36Å |
| 709 | A | 95.1 | Very high | 94.4 | Very high | 1 Ų | 1 | 45.1 Ų | 45.1 | 1% | 0.008 | 23% | 0.228 | C | C | . | . | trans | -148.2 | 162.9 | 172.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | A603 P606 V713 | A603-A709 HydrophobicContact CB-CB 3.75Å; A603-A709 WeakPolarHBondContact O-CB 3.11Å; P606-A709 WeakPolarHBondContact CB-O 3.31Å; A709-V713 CarbonylContact C-O 3.58Å; A709-V713 WeakPolarHBondContact CA-O 3.41Å | ||
| 710 | G | 90.2 | Very high | 94.5 | Very high | 16 Ų | 16 | 49.5 Ų | 49.5 | 17% | 0.165 | 25% | 0.245 | C | C | . | . | B | Isolated β-bridge | trans | 169.6 | -177.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112 | Y712 V713 | G710-Y712 VanDerWaalsContact C-N 3.28Å; G710-Y712 PolarHBondContact O-N 3.33Å; G710-Y712 VanDerWaalsContact O-N 3.1Å; G710-V713 PolarHBondContact N-O 3.4Å; G710-V713 CarbonylContact O-C 3.5Å; G710-V713 PolarHBondContact O-N 3.36Å; G710-V713 VanDerWaalsContact O-N 3.14Å |
| 711 | E | 86.1 | Confident | 94.6 | Very high | 146 Ų | 146 | 47.7 Ų | 47.7 | 68% | 0.682 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -48.6 | -44 | -172.4 | -173.4 | 175.3 | -153.7 | 0 | 0 | 114.2 | ||
| 712 | Y | 88.8 | Confident | 94.7 | Very high | 192 Ų | 192 | 49.6 Ų | 49.6 | 75% | 0.753 | 24% | 0.24 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -104.3 | -2.5 | -176.1 | -51 | -82.9 | 0 | 0 | 0 | 114.6 | G710 | G710-Y712 VanDerWaalsContact C-N 3.28Å; G710-Y712 PolarHBondContact O-N 3.33Å; G710-Y712 VanDerWaalsContact O-N 3.1Å |
| 713 | V | 93.4 | Very high | 94.7 | Very high | 31 Ų | 31 | 51.3 Ų | 51.3 | 19% | 0.188 | 24% | 0.239 | C | C | . | . | B | Isolated β-bridge | trans | -138 | 102.8 | -174.6 | 179.5 | 0 | 0 | 0 | 0 | 108.3 | H649 L678 Y708 A709 G710 | H649-V713 HydrophobicContact CB-CG1 3.87Å; H649-V713 WeakPolarHBondContact CD2-CG1 3.32Å; H649-V713 VanDerWaalsContact CG-CG1 3.46Å; L678-V713 HydrophobicContact CD2-CG1 3.99Å; L678-V713 HydrophobicContact CD2-CG2 4.2Å; Y708-V713 HydrophobicContact CD1-CB 4.28Å; Y708-V713 HydrophobicContact CD1-CG1 3.84Å; Y708-V713 HydrophobicContact CE1-CB 4.03Å; Y708-V713 HydrophobicContact CE1-CG1 4.08Å; Y708-V713 HydrophobicContact CE1-CG2 4.3Å; A709-V713 CarbonylContact C-O 3.58Å; A709-V713 WeakPolarHBondContact CA-O 3.41Å; G710-V713 PolarHBondContact N-O 3.4Å; G710-V713 CarbonylContact O-C 3.5Å; G710-V713 PolarHBondContact O-N 3.36Å; G710-V713 VanDerWaalsContact O-N 3.14Å |
| 714 | Q | 93.9 | Very high | 94.8 | Very high | 79 Ų | 79 | 47.5 Ų | 47.5 | 37% | 0.369 | 23% | 0.229 | S | C | . | . | trans | -108.9 | 98.8 | -163.2 | -66.3 | 177 | 17.8 | 0 | 0 | 110.9 | V602 | V602-Q714 HydrophobicContact CB-CB 4.29Å; V602-Q714 HydrophobicContact CG1-CB 4.34Å | ||
| 715 | S | 97.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 26% | 0.256 | C | S | . | . | trans | -68.7 | 130.3 | 161.9 | -72.9 | 0 | 0 | 0 | 0 | 109 | V602 A603 H647 H649 Y708 | V602-S715 WeakPolarHBondContact CA-O 3.38Å; A603-S715 PolarHBondContact N-O 3.44Å; H647-S715 CarbonylContact O-C 3.44Å; H647-S715 WeakPolarHBondContact O-CA 3.24Å; H649-S715 PolarHBondContact N-OG 3.08Å; Y708-S715 PolarHBondContact O-OG 3.36Å | ||
| 716 | S | 98.1 | Very high | 94.4 | Very high | 19 Ų | 19 | 54.6 Ų | 54.6 | 13% | 0.133 | 26% | 0.26 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133 | 153.7 | -169.5 | 65 | 0 | 0 | 0 | 0 | 113.5 | A601 Y646 H647 | A601-S716 CarbonylContact O-C 3.58Å; A601-S716 VanDerWaalsContact O-CA 3.32Å; A601-S716 WeakPolarHBondContact O-CA 3.5Å; Y646-S716 VanDerWaalsContact CA-O 3.24Å; Y646-S716 WeakPolarHBondContact CA-O 3.34Å; Y646-S716 WeakPolarHBondContact CB-O 3.42Å; H647-S716 PolarHBondContact N-O 3.1Å; H647-S716 PolarHBondContact O-N 3.47Å |
| 717 | F | 98.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 57.4 Ų | 57.4 | 0% | 0 | 27% | 0.273 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 132.8 | 174.7 | 179.6 | -140.3 | 0 | 0 | 0 | 109.9 | F599 A601 F616 Y627 F644 L659 V695 I697 | F599-F717 AromaticContact CE2-CD1 3.71Å; F599-F717 HydrophobicContact CE2-CD1 3.71Å; F599-F717 AromaticContact CE2-CE1 3.99Å; F599-F717 HydrophobicContact CE2-CE1 3.99Å; F599-F717 HydrophobicContact CE2-CG 4.12Å; F599-F717 AromaticContact CZ-CD1 3.83Å; F599-F717 HydrophobicContact CZ-CD1 3.83Å; F599-F717 AromaticContact CZ-CE1 3.63Å; F599-F717 HydrophobicContact CZ-CE1 3.63Å; F599-F717 HydrophobicContact CZ-CE2 4.37Å; F599-F717 HydrophobicContact CZ-CG 4.29Å; F599-F717 AromaticContact CZ-CZ 3.92Å; F599-F717 HydrophobicContact CZ-CZ 3.92Å; A601-F717 PolarHBondContact N-O 3.22Å; A601-F717 PolarHBondContact O-N 3.35Å; F616-F717 HydrophobicContact CD1-CB 4.01Å; F616-F717 HydrophobicContact CD2-CB 3.74Å; F616-F717 HydrophobicContact CD2-CD1 4.14Å; F616-F717 HydrophobicContact CD2-CG 4.39Å; F616-F717 HydrophobicContact CE1-CB 3.88Å; F616-F717 HydrophobicContact CE2-CB 3.6Å; F616-F717 HydrophobicContact CE2-CD1 4.1Å; F616-F717 HydrophobicContact CE2-CG 4.14Å; F616-F717 HydrophobicContact CG-CB 3.96Å; F616-F717 HydrophobicContact CZ-CB 3.68Å; Y627-F717 HydrophobicContact CE2-CD1 4.08Å; Y627-F717 HydrophobicContact CE2-CE1 4.32Å; F644-F717 HydrophobicContact CB-CE2 4.31Å; F644-F717 AromaticContact CD1-CE2 3.85Å; F644-F717 HydrophobicContact CD1-CE2 3.85Å; F644-F717 AromaticContact CD1-CZ 3.8Å; F644-F717 HydrophobicContact CD1-CZ 3.8Å; F644-F717 HydrophobicContact CE1-CZ 4.32Å; L659-F717 HydrophobicContact CD1-CE2 3.92Å; L659-F717 HydrophobicContact CD1-CZ 4.04Å; V695-F717 HydrophobicContact CG1-CZ 4.28Å; I697-F717 HydrophobicContact CD1-CD2 3.94Å; I697-F717 HydrophobicContact CD1-CE2 3.83Å; I697-F717 HydrophobicContact CD1-CG 4.49Å; I697-F717 HydrophobicContact CD1-CZ 4.28Å; I697-F717 HydrophobicContact CG1-CB 4.42Å; I697-F717 HydrophobicContact CG1-CD1 4.08Å; I697-F717 HydrophobicContact CG1-CD2 3.83Å; I697-F717 HydrophobicContact CG1-CE1 4.26Å; I697-F717 HydrophobicContact CG1-CE2 4.02Å; I697-F717 HydrophobicContact CG1-CG 3.86Å; I697-F717 HydrophobicContact CG1-CZ 4.23Å |
| 718 | T | 98.6 | Very high | 94.1 | Very high | 28 Ų | 28 | 60.6 Ų | 60.6 | 17% | 0.172 | 29% | 0.288 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.5 | 142.1 | -172.7 | -68 | 0 | 0 | 0 | 0 | 109.1 | F599 T600 F644 A645 Y720 | F599-T718 WeakPolarHBondContact O-CA 3.45Å; F599-T718 WeakPolarHBondContact O-CG2 3.11Å; T600-T718 WeakPolarHBondContact CG2-OG1 3.08Å; T600-T718 PolarHBondContact OG1-OG1 3.28Å; F644-T718 CarbonylContact C-O 3.49Å; F644-T718 WeakPolarHBondContact CA-O 3.46Å; A645-T718 PolarHBondContact N-O 3.17Å; A645-T718 PolarHBondContact O-N 3.24Å; A645-T718 VanDerWaalsContact O-O 3.14Å; T718-Y720 HydrophobicContact CG2-CD1 4.29Å |
| 719 | G | 97.9 | Very high | 94 | Very high | 0 Ų | 0 | 61.2 Ų | 61.2 | 0% | 0 | 29% | 0.294 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -151.6 | 143.1 | 169.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A598 F599 Y643 | A598-G719 CarbonylContact C-O 3.52Å; A598-G719 VanDerWaalsContact CA-O 3.29Å; A598-G719 WeakPolarHBondContact CA-O 3.36Å; F599-G719 WeakPolarHBondContact CD1-O 3.5Å; F599-G719 VanDerWaalsContact CE1-CA 3.44Å; F599-G719 VanDerWaalsContact CE1-N 3.31Å; F599-G719 PolarHBondContact N-O 3.35Å; F599-G719 PolarHBondContact O-N 3.24Å; F599-G719 VanDerWaalsContact O-N 3.12Å; Y643-G719 CarbonylContact O-C 3.45Å; Y643-G719 VanDerWaalsContact O-CA 3.24Å; Y643-G719 WeakPolarHBondContact O-CA 3.46Å |
| 720 | Y | 97.3 | Very high | 93.9 | Very high | 92 Ų | 92 | 65 Ų | 65 | 36% | 0.361 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.7 | 151 | 177.5 | 60.2 | -87.5 | 0 | 0 | 0 | 113 | P597 Y642 Y643 T718 L722 | P597-Y720 CarbonylContact O-C 3.55Å; P597-Y720 VanDerWaalsContact O-CA 3.31Å; P597-Y720 WeakPolarHBondContact O-CA 3.46Å; Y642-Y720 CarbonylContact C-O 3.54Å; Y642-Y720 WeakPolarHBondContact CA-O 3.26Å; Y643-Y720 HydrophobicContact CD1-CD1 4.22Å; Y643-Y720 AromaticContact CD1-CE1 3.37Å; Y643-Y720 HydrophobicContact CD1-CE1 3.37Å; Y643-Y720 AromaticContact CD1-CZ 3.62Å; Y643-Y720 HydrophobicContact CE1-CE1 4.1Å; Y643-Y720 HydrophobicContact CG-CE1 4.14Å; Y643-Y720 AromaticContact CG-CZ 4Å; Y643-Y720 PolarHBondContact N-O 2.82Å; Y643-Y720 PolarHBondContact O-N 3Å; T718-Y720 HydrophobicContact CG2-CD1 4.29Å; Y720-L722 HydrophobicContact CD2-CD2 4.33Å; Y720-L722 HydrophobicContact CE2-CD2 3.61Å; Y720-L722 HydrophobicContact CE2-CG 4.35Å |
| 721 | L | 96.4 | Very high | 94.1 | Very high | 18 Ų | 18 | 68.3 Ų | 68.3 | 9% | 0.094 | 32% | 0.321 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 125.4 | 173.1 | -177.7 | 69.1 | 0 | 0 | 0 | 109.9 | M596 P597 I638 Y642 P724 | M596-L721 HydrophobicContact SD-CD2 4.16Å; P597-L721 HydrophobicContact CB-CB 4.29Å; P597-L721 HydrophobicContact CG-CB 4.34Å; P597-L721 HydrophobicContact CG-CD2 4.18Å; P597-L721 PolarHBondContact O-N 3.29Å; I638-L721 HydrophobicContact CG2-CD2 4.2Å; Y642-L721 HydrophobicContact CD1-CB 4.24Å; Y642-L721 HydrophobicContact CD2-CD1 3.94Å; Y642-L721 HydrophobicContact CE1-CB 3.87Å; Y642-L721 HydrophobicContact CE1-CD1 4.32Å; Y642-L721 HydrophobicContact CE2-CD1 3.59Å; Y642-L721 HydrophobicContact CG-CD1 4.46Å; L721-P724 HydrophobicContact CD2-CB 4.26Å |
| 722 | L | 94.6 | Very high | 94.7 | Very high | 64 Ų | 64 | 62.7 Ų | 62.7 | 34% | 0.335 | 30% | 0.296 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.2 | -51.5 | 168.6 | -70.9 | 171.6 | 0 | 0 | 0 | 110.9 | I641 V686 Y720 | I641-L722 HydrophobicContact CG2-CB 4.48Å; I641-L722 HydrophobicContact CG2-CD1 4.18Å; I641-L722 WeakPolarHBondContact O-CB 3.49Å; I641-L722 PolarHBondContact O-N 2.82Å; V686-L722 HydrophobicContact CG1-CD1 4.39Å; V686-L722 HydrophobicContact CG2-CD1 4.33Å; Y720-L722 HydrophobicContact CD2-CD2 4.33Å; Y720-L722 HydrophobicContact CE2-CD2 3.61Å; Y720-L722 HydrophobicContact CE2-CG 4.35Å |
| 723 | Y | 93.1 | Very high | 95.2 | Very high | 146 Ų | 146 | 52.8 Ų | 52.8 | 57% | 0.573 | 26% | 0.26 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -142.6 | 119.4 | -173.6 | -52.8 | -72.5 | 0 | 0 | 0 | 110 | G640 I641 | G640-Y723 CarbonylContact C-O 3.54Å; G640-Y723 WeakPolarHBondContact CA-O 3.48Å; I641-Y723 HydrophobicContact CB-CD2 4.15Å; I641-Y723 HydrophobicContact CG1-CD2 4.49Å; I641-Y723 HydrophobicContact CG2-CD2 4.37Å; I641-Y723 PolarHBondContact N-O 3.31Å; I641-Y723 PolarHBondContact O-N 2.82Å |
| 724 | P | 92.8 | Very high | 95.3 | Very high | 84 Ų | 84 | 54.6 Ų | 54.6 | 55% | 0.545 | 27% | 0.266 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -65.4 | 153.6 | 166.6 | 29.3 | -33.5 | 0 | 0 | 0 | 110.6 | I638 P639 L721 | I638-P724 HydrophobicContact CG2-CB 4.25Å; P639-P724 WeakPolarHBondContact O-CA 3.44Å; L721-P724 HydrophobicContact CD2-CB 4.26Å |
| 725 | M | 84.9 | Confident | 95.4 | Very high | 125 Ų | 125 | 52.4 Ų | 52.4 | 62% | 0.616 | 26% | 0.257 | S | S | * | . | trans | -133 | 0 | 178.2 | -67.1 | -169.1 | -57.5 | 0 | 0 | 112.2 | M556 P639 I641 P688 | M556-M725 HydrophobicContact CE-CE 4.05Å; M556-M725 HydrophobicContact CE-SD 3.73Å; P639-M725 WeakPolarHBondContact CG-O 3.38Å; P639-M725 PolarHBondContact O-N 3.23Å; I641-M725 HydrophobicContact CD1-CE 3.61Å; I641-M725 HydrophobicContact CD1-SD 3.62Å; I641-M725 HydrophobicContact CG1-CE 4.22Å; I641-M725 HydrophobicContact CG1-CG 4.44Å; I641-M725 HydrophobicContact CG1-SD 3.86Å; P688-M725 HydrophobicContact CB-CE 4.22Å |
Retrieved 725 of 725 residues in 336.8 ms
(Link to these results)