| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 46.2 | Very low | 53 | Low | 233 Ų | 233 | 137.3 Ų | 137.3 | 100% | 1.148 | 75% | 0.754 | S | S | * | * | 0 | 136 | 0 | -79.7 | 62.3 | -177.4 | 0 | 0 | 108.5 | |||||
| 2 | G | 46.7 | Very low | 53.7 | Low | 50 Ų | 50 | 136.8 Ų | 136.8 | 52% | 0.515 | 76% | 0.758 | S | S | . | * | trans | 174.7 | 64.9 | -173.9 | 0 | 0 | 0 | 0 | 0 | 109.2 | H4 | G2-H4 PolarHBondContact O-CD2 2.76Å; G2-H4 PolarHBondContact O-N 2.76Å | ||
| 3 | E | 51.7 | Low | 54.4 | Low | 160 Ų | 160 | 128.5 Ų | 128.5 | 75% | 0.748 | 72% | 0.722 | S | S | * | * | trans | -67.9 | 96.2 | -174.9 | -51.2 | -60.4 | 119 | 0 | 0 | 110.3 | N5 | E3-N5 PolarHBondContact O-N 3.46Å; E3-N5 PolarHBondContact O-ND2 3.29Å; E3-N5 VanDerWaalsContact O-ND2 3.14Å | ||
| 4 | H | 56.4 | Low | 55.1 | Low | 173 Ų | 173 | 127.4 Ų | 127.4 | 80% | 0.801 | 72% | 0.723 | S | S | * | * | trans | -77.1 | 106.9 | 179 | -72.2 | -78.1 | 0 | 0 | 0 | 110.6 | G2 L6 | G2-H4 PolarHBondContact O-CD2 2.76Å; G2-H4 PolarHBondContact O-N 2.76Å; H4-L6 PolarHBondContact O-N 3.48Å | ||
| 5 | N | 51.3 | Low | 55.2 | Low | 137 Ų | 137 | 130.1 Ų | 130.1 | 73% | 0.733 | 73% | 0.734 | S | S | * | * | trans | -69.4 | 114.2 | -175.5 | -82.4 | -102.4 | 0 | 0 | 0 | 111.9 | E3 L7 | E3-N5 PolarHBondContact O-N 3.46Å; E3-N5 PolarHBondContact O-ND2 3.29Å; E3-N5 VanDerWaalsContact O-ND2 3.14Å; N5-L7 VanDerWaalsContact C-N 3.29Å; N5-L7 PolarHBondContact O-N 3.04Å | ||
| 6 | L | 56.6 | Low | 55.3 | Low | 143 Ų | 143 | 128.5 Ų | 128.5 | 75% | 0.749 | 73% | 0.727 | S | S | * | * | trans | -81.4 | 5.5 | -175 | -65.7 | 172.5 | 0 | 0 | 0 | 115 | H4 | H4-L6 PolarHBondContact O-N 3.48Š| ||
| 7 | L | 56.3 | Low | 54.9 | Low | 166 Ų | 166 | 128.6 Ų | 128.6 | 87% | 0.869 | 73% | 0.726 | S | S | * | * | trans | -96.3 | 19.3 | -169.7 | -71.6 | 164.9 | 0 | 0 | 0 | 114.4 | N5 | N5-L7 VanDerWaalsContact C-N 3.29Å; N5-L7 PolarHBondContact O-N 3.04Å | ||
| 8 | N | 45.5 | Very low | 54.8 | Low | 112 Ų | 112 | 128.9 Ų | 128.9 | 60% | 0.599 | 72% | 0.724 | S | S | * | * | trans | -95.7 | 114.2 | 177.2 | -165.2 | -23 | 0 | 0 | 0 | 110.4 | G10 F11 | N8-G10 PolarHBondContact O-N 3.17Å; N8-F11 HydrophobicContact CB-CB 4.48Å; N8-F11 WeakPolarHBondContact O-CB 3.3Å; N8-F11 PolarHBondContact O-N 3.06Å | ||
| 9 | P | 57.3 | Low | 54.3 | Low | 137 Ų | 137 | 130.1 Ų | 130.1 | 89% | 0.89 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.8 | -0.9 | -172.2 | 27 | -35.4 | 0 | 0 | 0 | 115.2 | ||
| 10 | G | 55.1 | Low | 54.1 | Low | 63 Ų | 63 | 131.4 Ų | 131.4 | 65% | 0.649 | 73% | 0.734 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | -0.2 | 170 | 0 | 0 | 0 | 0 | 0 | 115.5 | N8 V12 | N8-G10 PolarHBondContact O-N 3.17Å; G10-V12 PolarHBondContact O-N 2.92Å |
| 11 | F | 59.8 | Low | 53.9 | Low | 136 Ų | 136 | 128.1 Ų | 128.1 | 60% | 0.596 | 73% | 0.73 | S | S | * | * | trans | -83.7 | 97.5 | -174.2 | -171.2 | -99.5 | 0 | 0 | 0 | 112.6 | N8 G13 | N8-F11 HydrophobicContact CB-CB 4.48Å; N8-F11 WeakPolarHBondContact O-CB 3.3Å; N8-F11 PolarHBondContact O-N 3.06Å; F11-G13 PolarHBondContact O-N 2.91Å | ||
| 12 | V | 61.8 | Low | 53.7 | Low | 131 Ų | 131 | 124 Ų | 124 | 79% | 0.794 | 71% | 0.713 | S | S | * | * | trans | -89.2 | 96.2 | 166.8 | -173.7 | 0 | 0 | 0 | 0 | 108.6 | G10 | G10-V12 PolarHBondContact O-N 2.92Š| ||
| 13 | G | 62.6 | Low | 53.7 | Low | 29 Ų | 29 | 127.6 Ų | 127.6 | 30% | 0.299 | 73% | 0.725 | S | S | . | * | trans | -62.9 | 155.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | F11 L15 | F11-G13 PolarHBondContact O-N 2.91Å; G13-L15 PolarHBondContact O-N 3.26Å; G13-L15 VanDerWaalsContact O-N 3.07Å | ||
| 14 | P | 64 | Low | 53.6 | Low | 113 Ų | 113 | 128.4 Ų | 128.4 | 73% | 0.734 | 73% | 0.726 | S | S | * | * | trans | -62 | 113.5 | 179.2 | -20.3 | 32.4 | 0 | 0 | 0 | 111.3 | V16 | P14-V16 PolarHBondContact O-N 3.47Š| ||
| 15 | L | 57 | Low | 53.3 | Low | 169 Ų | 169 | 128.1 Ų | 128.1 | 89% | 0.885 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -71.1 | 16.5 | 177.3 | -87.4 | 165.3 | 0 | 0 | 0 | 114.3 | G13 | G13-L15 PolarHBondContact O-N 3.26Å; G13-L15 VanDerWaalsContact O-N 3.07Å |
| 16 | V | 56 | Low | 53.1 | Low | 104 Ų | 104 | 130.3 Ų | 130.3 | 63% | 0.63 | 72% | 0.723 | S | S | * | * | trans | -127.4 | 89.8 | 174.1 | -80.1 | 0 | 0 | 0 | 0 | 108.4 | P14 I18 | P14-V16 PolarHBondContact O-N 3.47Å; V16-I18 HydrophobicContact CB-CD1 4.3Å; V16-I18 HydrophobicContact CB-CG1 4.28Å; V16-I18 PolarHBondContact O-N 3.35Å | ||
| 17 | N | 49.3 | Very low | 52.8 | Low | 131 Ų | 131 | 127.7 Ų | 127.7 | 70% | 0.701 | 71% | 0.714 | S | S | * | * | trans | -72.2 | 69.6 | 168.8 | -174.3 | 41.2 | 0 | 0 | 0 | 110.1 | H19 | N17-H19 PolarHBondContact ND2-CD2 3.43Å; N17-H19 PolarHBondContact ND2-NE2 2.67Å; N17-H19 PolarHBondContact OD1-NE2 2.79Å | ||
| 18 | I | 52.6 | Low | 52.1 | Low | 134 Ų | 134 | 126.4 Ų | 126.4 | 69% | 0.687 | 71% | 0.708 | S | S | * | * | trans | -91 | 103.1 | 167.3 | -58.4 | 171.5 | 0 | 0 | 0 | 105.4 | V16 T20 | V16-I18 HydrophobicContact CB-CD1 4.3Å; V16-I18 HydrophobicContact CB-CG1 4.28Å; V16-I18 PolarHBondContact O-N 3.35Å; I18-T20 PolarHBondContact O-N 3.14Å; I18-T20 VanDerWaalsContact O-N 3.16Å | ||
| 19 | H | 45.3 | Very low | 52.5 | Low | 151 Ų | 151 | 131.3 Ų | 131.3 | 70% | 0.699 | 73% | 0.725 | S | S | * | * | trans | -59.4 | 119.3 | 173.9 | -74.8 | -102 | 0 | 0 | 0 | 109.1 | N17 G21 | N17-H19 PolarHBondContact ND2-CD2 3.43Å; N17-H19 PolarHBondContact ND2-NE2 2.67Å; N17-H19 PolarHBondContact OD1-NE2 2.79Å; H19-G21 PolarHBondContact O-N 2.68Å | ||
| 20 | T | 51.4 | Low | 52.1 | Low | 155 Ų | 155 | 134.5 Ų | 134.5 | 95% | 0.951 | 72% | 0.719 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | 107.6 | 176.6 | -48.1 | 0 | 0 | 0 | 0 | 109.5 | I18 | I18-T20 PolarHBondContact O-N 3.14Å; I18-T20 VanDerWaalsContact O-N 3.16Å |
| 21 | G | 48 | Very low | 51.7 | Low | 64 Ų | 64 | 136.7 Ų | 136.7 | 66% | 0.66 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -156.9 | -55.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112 | H19 | H19-G21 PolarHBondContact O-N 2.68Š|
| 22 | D | 43.1 | Very low | 51.2 | Low | 147 Ų | 147 | 134.4 Ų | 134.4 | 79% | 0.786 | 73% | 0.731 | S | S | * | * | S | Bend | trans | -114.5 | 121.7 | 179.4 | -75.6 | -60.6 | 0 | 0 | 0 | 112.5 | F24 | D22-F24 PolarHBondContact O-N 2.71Å; D22-F24 VanDerWaalsContact O-N 3.17Å |
| 23 | T | 47.5 | Very low | 50.5 | Low | 124 Ų | 124 | 132.7 Ų | 132.7 | 76% | 0.761 | 74% | 0.741 | S | S | * | * | trans | -79.1 | 99 | 179.9 | -61.4 | 0 | 0 | 0 | 0 | 109.7 | Y25 | T23-Y25 HydrophobicContact CG2-CD2 4.33Å; T23-Y25 PolarHBondContact O-N 3.21Å | ||
| 24 | F | 48.3 | Very low | 49.8 | Very low | 178 Ų | 178 | 134.6 Ų | 134.6 | 78% | 0.781 | 76% | 0.76 | S | S | * | * | trans | -68.5 | 80.3 | 165.7 | -84.7 | -83.5 | 0 | 0 | 0 | 110.6 | D22 F26 | D22-F24 PolarHBondContact O-N 2.71Å; D22-F24 VanDerWaalsContact O-N 3.17Å; F24-F26 HydrophobicContact CB-CE2 4.5Å; F24-F26 WeakPolarHBondContact O-CD2 3.06Å; F24-F26 PolarHBondContact O-N 3.24Å | ||
| 25 | Y | 49.7 | Very low | 49.2 | Very low | 166 Ų | 166 | 138.8 Ų | 138.8 | 65% | 0.651 | 77% | 0.77 | S | S | * | * | trans | -73.9 | 99.7 | 179.1 | -163 | -91.6 | 0 | 0 | 0 | 109.8 | T23 P27 | T23-Y25 HydrophobicContact CG2-CD2 4.33Å; T23-Y25 PolarHBondContact O-N 3.21Å; Y25-P27 HydrophobicContact CD1-CB 3.95Å; Y25-P27 HydrophobicContact CD1-CG 4.03Å; Y25-P27 HydrophobicContact CE1-CB 4.01Å; Y25-P27 WeakPolarHBondContact O-CD 3.09Å; Y25-P27 WeakPolarHBondContact O-CG 3.27Å | ||
| 26 | F | 47.4 | Very low | 48.7 | Very low | 183 Ų | 183 | 138.9 Ų | 138.9 | 80% | 0.803 | 77% | 0.77 | S | S | * | * | trans | -77.3 | 102.8 | 169.4 | -70.9 | -81.8 | 0 | 0 | 0 | 109.2 | F24 N28 | F24-F26 HydrophobicContact CB-CE2 4.5Å; F24-F26 WeakPolarHBondContact O-CD2 3.06Å; F24-F26 PolarHBondContact O-N 3.24Å; F26-N28 VanDerWaalsContact C-N 3.26Å; F26-N28 PolarHBondContact O-N 2.89Å; F26-N28 VanDerWaalsContact O-N 3.1Å | ||
| 27 | P | 49.8 | Very low | 48.6 | Very low | 88 Ų | 88 | 139.1 Ų | 139.1 | 57% | 0.571 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79.8 | 0.8 | -159.9 | -10.6 | 27.3 | 0 | 0 | 0 | 115.4 | Y25 | Y25-P27 HydrophobicContact CD1-CB 3.95Å; Y25-P27 HydrophobicContact CD1-CG 4.03Å; Y25-P27 HydrophobicContact CE1-CB 4.01Å; Y25-P27 WeakPolarHBondContact O-CD 3.09Å; Y25-P27 WeakPolarHBondContact O-CG 3.27Å |
| 28 | N | 43.2 | Very low | 49.1 | Very low | 139 Ų | 139 | 136.4 Ų | 136.4 | 74% | 0.743 | 79% | 0.786 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113 | 13.8 | -153.9 | -70.7 | -39.2 | 0 | 0 | 0 | 116.4 | F26 | F26-N28 VanDerWaalsContact C-N 3.26Å; F26-N28 PolarHBondContact O-N 2.89Å; F26-N28 VanDerWaalsContact O-N 3.1Å |
| 29 | F | 52.6 | Low | 49 | Very low | 216 Ų | 216 | 137.8 Ų | 137.8 | 95% | 0.947 | 79% | 0.794 | S | S | * | * | trans | -128.3 | 80.1 | 168.9 | -80.3 | -77.2 | 0 | 0 | 0 | 112.3 | ||||
| 30 | R | 48.8 | Very low | 49.1 | Very low | 204 Ų | 204 | 136.1 Ų | 136.1 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -114 | 122.5 | 156.2 | -172.3 | 174.8 | -73.3 | -119.2 | 2.4 | 108.5 | S32 | R30-S32 PolarHBondContact O-N 3.49Š| ||
| 31 | A | 47.8 | Very low | 49.2 | Very low | 108 Ų | 108 | 133.5 Ų | 133.5 | 89% | 0.893 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -78.7 | 66 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 32 | S | 48.3 | Very low | 49.3 | Very low | 88 Ų | 88 | 137.1 Ų | 137.1 | 62% | 0.615 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -157.1 | 120.8 | 175.5 | -41.4 | 0 | 0 | 0 | 0 | 109.2 | R30 G34 | R30-S32 PolarHBondContact O-N 3.49Å; S32-G34 PolarHBondContact O-N 3.01Å |
| 33 | G | 48.2 | Very low | 49.3 | Very low | 96 Ų | 96 | 135.4 Ų | 135.4 | 99% | 0.99 | 79% | 0.788 | S | S | * | * | trans | -71.3 | 112 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 34 | G | 48.4 | Very low | 49.3 | Very low | 68 Ų | 68 | 138.4 Ų | 138.4 | 70% | 0.701 | 79% | 0.786 | S | S | * | * | trans | -155.7 | 116.5 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | S32 | S32-G34 PolarHBondContact O-N 3.01Š| ||
| 35 | Q | 49.9 | Very low | 49.3 | Very low | 201 Ų | 201 | 134.4 Ų | 134.4 | 94% | 0.939 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 129.2 | 176.3 | -71.5 | -168.7 | -16 | 0 | 0 | 110.1 | ||
| 36 | L | 46.5 | Very low | 49.2 | Very low | 172 Ų | 172 | 136.7 Ų | 136.7 | 90% | 0.901 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -97.1 | 122.9 | 162.6 | -66.9 | 177.9 | 0 | 0 | 0 | 108.6 | ||
| 37 | A | 54.8 | Low | 49 | Very low | 108 Ų | 108 | 137.8 Ų | 137.8 | 89% | 0.893 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -72.8 | 137 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||
| 38 | G | 58.7 | Low | 48.9 | Very low | 74 Ų | 74 | 139.7 Ų | 139.7 | 76% | 0.763 | 79% | 0.79 | S | S | * | * | trans | 144.8 | -2.9 | 170.5 | 0 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 39 | L | 51 | Low | 49.1 | Very low | 164 Ų | 164 | 139.8 Ų | 139.8 | 86% | 0.859 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -100.6 | 135.6 | 171.5 | -66 | -179.6 | 0 | 0 | 0 | 111 | S41 | L39-S41 PolarHBondContact O-N 3.02Š|
| 40 | P | 48.7 | Very low | 49 | Very low | 115 Ų | 115 | 136.2 Ų | 136.2 | 75% | 0.747 | 79% | 0.786 | S | S | * | * | trans | -64 | 131.4 | 176.4 | 27.4 | -33.9 | 0 | 0 | 0 | 109.8 | L42 | P40-L42 PolarHBondContact O-N 3.07Š| ||
| 41 | S | 53.4 | Low | 49.2 | Very low | 101 Ų | 101 | 132.2 Ų | 132.2 | 71% | 0.706 | 79% | 0.788 | S | S | * | * | trans | -66.4 | 108.1 | 176.2 | 59.9 | 0 | 0 | 0 | 0 | 109.9 | L39 S43 | L39-S41 PolarHBondContact O-N 3.02Å; S41-S43 VanDerWaalsContact C-N 3.33Å; S41-S43 PolarHBondContact O-N 3.37Å | ||
| 42 | L | 49.7 | Very low | 49.3 | Very low | 140 Ų | 140 | 131.9 Ų | 131.9 | 73% | 0.733 | 78% | 0.779 | S | S | * | * | trans | -62.7 | 100 | 161.7 | -79.1 | 163.8 | 0 | 0 | 0 | 107.4 | P40 Y44 | P40-L42 PolarHBondContact O-N 3.07Å; L42-Y44 HydrophobicContact CB-CD2 4.07Å; L42-Y44 HydrophobicContact CB-CE2 3.86Å; L42-Y44 HydrophobicContact CD1-CE2 4.4Å; L42-Y44 PolarHBondContact O-N 2.81Å | ||
| 43 | S | 43.5 | Very low | 49.8 | Very low | 111 Ų | 111 | 134.5 Ų | 134.5 | 78% | 0.776 | 79% | 0.786 | S | S | * | * | trans | -68.4 | 75.7 | 175.5 | -73.5 | 0 | 0 | 0 | 0 | 110.5 | S41 | S41-S43 VanDerWaalsContact C-N 3.33Å; S41-S43 PolarHBondContact O-N 3.37Å | ||
| 44 | Y | 45.6 | Very low | 49.8 | Very low | 186 Ų | 186 | 136 Ų | 136 | 73% | 0.729 | 78% | 0.778 | S | S | * | * | trans | -65.4 | 124.5 | 157.3 | -73.9 | -80.6 | 0 | 0 | 0 | 107.5 | L42 R46 | L42-Y44 HydrophobicContact CB-CD2 4.07Å; L42-Y44 HydrophobicContact CB-CE2 3.86Å; L42-Y44 HydrophobicContact CD1-CE2 4.4Å; L42-Y44 PolarHBondContact O-N 2.81Å; Y44-R46 PolarHBondContact O-N 3.05Å | ||
| 45 | P | 50.1 | Low | 50 | Low | 95 Ų | 95 | 144.2 Ų | 144.2 | 62% | 0.617 | 79% | 0.788 | S | S | * | * | trans | -60.7 | 114.3 | 175.3 | 24.4 | -32.3 | 0 | 0 | 0 | 108 | R47 | P45-R47 PolarHBondContact O-N 2.92Š| ||
| 46 | R | 45.8 | Very low | 49.8 | Very low | 214 Ų | 214 | 140.8 Ų | 140.8 | 81% | 0.808 | 78% | 0.776 | S | S | * | * | trans | -64.7 | 104.1 | 174.3 | -177 | 177 | -71.4 | 163.6 | -0.8 | 107 | Y44 D48 | Y44-R46 PolarHBondContact O-N 3.05Å; R46-D48 WeakPolarHBondContact CD-OD1 3.14Å; R46-D48 WeakPolarHBondContact CG-OD1 3.35Å; R46-D48 PolarHBondContact O-N 2.9Å | ||
| 47 | R | 44.6 | Very low | 49.6 | Very low | 205 Ų | 205 | 138 Ų | 138 | 77% | 0.774 | 77% | 0.768 | S | S | * | * | trans | -81.4 | 100.4 | 173.6 | -58.3 | -178.3 | -171.1 | -108.9 | 0.6 | 106.6 | P45 N49 | P45-R47 PolarHBondContact O-N 2.92Å; R47-N49 PolarHBondContact O-N 2.99Å | ||
| 48 | D | 47 | Very low | 49.2 | Very low | 128 Ų | 128 | 138 Ų | 138 | 68% | 0.684 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -73.5 | 43.7 | -179.9 | -63.2 | -57.4 | 0 | 0 | 0 | 112.6 | R46 | R46-D48 WeakPolarHBondContact CD-OD1 3.14Å; R46-D48 WeakPolarHBondContact CG-OD1 3.35Å; R46-D48 PolarHBondContact O-N 2.9Å |
| 49 | N | 48.2 | Very low | 48.8 | Very low | 141 Ų | 141 | 142.8 Ų | 142.8 | 75% | 0.754 | 76% | 0.764 | S | S | * | * | trans | -140.2 | 70.6 | 177.5 | -65.7 | 102.1 | 0 | 0 | 0 | 109.4 | R47 C51 | R47-N49 PolarHBondContact O-N 2.99Å; N49-C51 VanDerWaalsContact C-N 3.33Å; N49-C51 PolarHBondContact O-N 2.82Å | ||
| 50 | V | 51 | Low | 48.9 | Very low | 141 Ų | 141 | 141 Ų | 141 | 86% | 0.855 | 76% | 0.762 | S | S | * | * | trans | -73.6 | 84.7 | 174.9 | -176 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 51 | C | 51.9 | Low | 48.9 | Very low | 121 Ų | 121 | 141.2 Ų | 141.2 | 82% | 0.818 | 77% | 0.765 | S | S | * | * | trans | -177 | 57.7 | 155.9 | -106.5 | 0 | 0 | 0 | 0 | 113.7 | N49 | N49-C51 VanDerWaalsContact C-N 3.33Å; N49-C51 PolarHBondContact O-N 2.82Å | ||
| 52 | S | 50.5 | Low | 48.6 | Very low | 101 Ų | 101 | 144.5 Ų | 144.5 | 71% | 0.706 | 78% | 0.775 | S | S | * | * | trans | -142.2 | 101.1 | 165.9 | -70.1 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 53 | L | 58.1 | Low | 48 | Very low | 143 Ų | 143 | 140.8 Ų | 140.8 | 75% | 0.749 | 77% | 0.771 | S | S | * | * | trans | -70.9 | 151.4 | 159.1 | -85.3 | 75.4 | 0 | 0 | 0 | 108.6 | W55 N56 | L53-W55 PolarHBondContact O-N 3.04Å; L53-N56 PolarHBondContact O-N 2.61Å | ||
| 54 | P | 49.3 | Very low | 47.7 | Very low | 128 Ų | 128 | 146.5 Ų | 146.5 | 83% | 0.831 | 78% | 0.777 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | 14.6 | -169.3 | 23.5 | -30.5 | 0 | 0 | 0 | 116 | ||
| 55 | W | 51.3 | Low | 47.3 | Very low | 240 Ų | 240 | 143 Ų | 143 | 91% | 0.909 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -119 | 4.4 | -171.8 | -69.7 | 47.2 | 0 | 0 | 0 | 112.8 | L53 | L53-W55 PolarHBondContact O-N 3.04Š|
| 56 | N | 45.8 | Very low | 46.9 | Very low | 128 Ų | 128 | 146.3 Ų | 146.3 | 68% | 0.684 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -104.8 | 112.2 | 176.1 | -150.3 | 25.5 | 0 | 0 | 0 | 109.2 | L53 S58 | L53-N56 PolarHBondContact O-N 2.61Å; N56-S58 PolarHBondContact O-N 3.28Å |
| 57 | P | 42.2 | Very low | 46.4 | Very low | 114 Ų | 114 | 139.3 Ų | 139.3 | 74% | 0.74 | 77% | 0.771 | S | S | * | * | trans | -66.7 | 115.9 | 173.4 | 27.7 | -31.8 | 0 | 0 | 0 | 108.7 | E59 | P57-E59 PolarHBondContact O-N 3.21Å; P57-E59 VanDerWaalsContact O-N 3.16Å | ||
| 58 | S | 46.6 | Very low | 46.2 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 75% | 0.748 | 77% | 0.772 | S | S | * | * | trans | -83.3 | 88.6 | -177 | 54.4 | 0 | 0 | 0 | 0 | 111.1 | N56 | N56-S58 PolarHBondContact O-N 3.28Š| ||
| 59 | E | 51.1 | Low | 46.1 | Very low | 176 Ų | 176 | 142.3 Ų | 142.3 | 82% | 0.822 | 78% | 0.78 | S | S | * | * | trans | -78.8 | 123.9 | 160.2 | -82.4 | -172.8 | 119.9 | 0 | 0 | 110.2 | P57 C61 | P57-E59 PolarHBondContact O-N 3.21Å; P57-E59 VanDerWaalsContact O-N 3.16Å; E59-C61 PolarHBondContact O-N 3.42Å | ||
| 60 | P | 53.4 | Low | 45.5 | Very low | 126 Ų | 126 | 140.3 Ų | 140.3 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -82.9 | 100.4 | 175.3 | 32 | -31.8 | 0 | 0 | 0 | 110.7 | N62 | P60-N62 PolarHBondContact O-N 2.9Š| ||
| 61 | C | 47.6 | Very low | 44.8 | Very low | 120 Ų | 120 | 138.9 Ų | 138.9 | 81% | 0.811 | 77% | 0.773 | S | S | * | * | trans | -75.3 | 106.5 | 167.2 | -77.6 | 0 | 0 | 0 | 0 | 110.9 | E59 | E59-C61 PolarHBondContact O-N 3.42Š| ||
| 62 | N | 47.2 | Very low | 45.4 | Very low | 169 Ų | 169 | 138.9 Ų | 138.9 | 90% | 0.904 | 77% | 0.771 | S | S | * | * | trans | -158.8 | 114.4 | 153.7 | -114.6 | -18.7 | 0 | 0 | 0 | 113.3 | P60 | P60-N62 PolarHBondContact O-N 2.9Š| ||
| 63 | G | 36.9 | Very low | 44.8 | Very low | 63 Ų | 63 | 140.3 Ų | 140.3 | 65% | 0.649 | 78% | 0.775 | S | S | * | * | trans | 90.7 | 83.2 | 138 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 64 | Y | 38 | Very low | 44 | Very low | 231 Ų | 231 | 138.2 Ų | 138.2 | 91% | 0.906 | 77% | 0.773 | S | S | * | * | trans | 58.3 | 128.8 | 149.4 | -70.6 | -89.4 | 0 | 0 | 0 | 119 | ||||
| 65 | S | 36 | Very low | 43.9 | Very low | 113 Ų | 113 | 139.7 Ų | 139.7 | 79% | 0.79 | 77% | 0.772 | S | S | * | * | -141.4 | 156.2 | 65.3 | 173.3 | 0 | 0 | 0 | 0 | 114.5 | |||||
| 66 | Q | 41.7 | Very low | 43.4 | Very low | 164 Ų | 164 | 135.5 Ų | 135.5 | 77% | 0.766 | 77% | 0.768 | S | S | * | * | trans | -28.8 | 154.5 | 163 | -75.3 | -161.1 | 30.9 | 0 | 0 | 116.4 | ||||
| 67 | S | 35.9 | Very low | 43.4 | Very low | 67 Ų | 67 | 134.8 Ų | 134.8 | 47% | 0.469 | 77% | 0.77 | S | S | . | * | cis | -166.2 | -173.7 | 4.7 | 36.7 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 68 | Y | 41.1 | Very low | 43.2 | Very low | 202 Ų | 202 | 134.7 Ų | 134.7 | 79% | 0.792 | 77% | 0.772 | S | S | * | * | cis | -146 | 155.4 | 14.1 | -45.5 | -107.9 | 0 | 0 | 0 | 106.3 | ||||
| 69 | F | 43.6 | Very low | 43.1 | Very low | 194 Ų | 194 | 139.2 Ų | 139.2 | 85% | 0.851 | 78% | 0.778 | S | S | * | * | -172.7 | 165.6 | 63.8 | -117.6 | -87.6 | 0 | 0 | 0 | 108.9 | |||||
| 70 | S | 36 | Very low | 42.8 | Very low | 99 Ų | 99 | 138 Ų | 138 | 69% | 0.692 | 78% | 0.778 | S | S | * | * | trans | -27.7 | 160.2 | 164.9 | -47.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 71 | S | 36.3 | Very low | 42 | Very low | 111 Ų | 111 | 143.7 Ų | 143.7 | 78% | 0.776 | 78% | 0.783 | S | S | * | * | cis | -170.7 | 165.8 | -12.7 | -97.7 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 72 | P | 64.2 | Low | 41.5 | Very low | 120 Ų | 120 | 143.5 Ų | 143.5 | 78% | 0.779 | 78% | 0.783 | S | S | * | * | trans | -103.9 | 127.1 | -167.8 | 36.4 | -30.7 | 0 | 0 | 0 | 115.9 | ||||
| 73 | V | 37.9 | Very low | 40.9 | Very low | 131 Ų | 131 | 141.2 Ų | 141.2 | 79% | 0.794 | 78% | 0.779 | S | S | * | * | trans | -151.9 | 103.6 | 168 | 171.2 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 74 | S | 42.5 | Very low | 41 | Very low | 100 Ų | 100 | 147.2 Ų | 147.2 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | 84.2 | 123.2 | 98.1 | -53.9 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 75 | I | 46.8 | Very low | 40.9 | Very low | 158 Ų | 158 | 143.1 Ų | 143.1 | 81% | 0.81 | 78% | 0.782 | S | S | * | * | trans | 38.7 | 117.3 | 138.7 | -55.8 | 166.4 | 0 | 0 | 0 | 118.3 | ||||
| 76 | N | 40.1 | Very low | 40.8 | Very low | 153 Ų | 153 | 144 Ų | 144 | 82% | 0.818 | 78% | 0.783 | S | S | * | * | trans | -8 | 138.6 | 157.1 | -80.9 | -46 | 0 | 0 | 0 | 117.1 | ||||
| 77 | P | 46.4 | Very low | 40.5 | Very low | 112 Ų | 112 | 146.8 Ų | 146.8 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | -157 | -176.7 | 68.8 | 42.1 | -22 | 0 | 0 | 0 | 118.8 | |||||
| 78 | S | 37.4 | Very low | 41 | Very low | 112 Ų | 112 | 148.6 Ų | 148.6 | 78% | 0.783 | 80% | 0.796 | S | S | * | * | trans | 96.6 | 137.3 | 146.5 | -63.4 | 0 | 0 | 0 | 0 | 121.1 | ||||
| 79 | F | 45.4 | Very low | 40.7 | Very low | 202 Ų | 202 | 147 Ų | 147 | 89% | 0.886 | 80% | 0.796 | S | S | * | * | trans | -69.3 | 170.1 | 173.7 | -84.6 | -115.4 | 0 | 0 | 0 | 112.6 | ||||
| 80 | N | 43.6 | Very low | 40.4 | Very low | 152 Ų | 152 | 145.2 Ų | 145.2 | 81% | 0.813 | 79% | 0.791 | S | S | * | * | trans | 77.3 | 96.5 | 177.2 | -65.5 | -11.5 | 0 | 0 | 0 | 116.9 | ||||
| 81 | R | 38.1 | Very low | 40.4 | Very low | 244 Ų | 244 | 143.5 Ų | 143.5 | 92% | 0.921 | 79% | 0.788 | S | S | * | * | trans | -131 | 123.1 | 132.8 | -70.8 | -169.8 | -175.1 | -95.7 | -3.7 | 109.1 | ||||
| 82 | S | 36.3 | Very low | 40.5 | Very low | 117 Ų | 117 | 147.6 Ų | 147.6 | 82% | 0.818 | 79% | 0.792 | S | S | * | * | trans | -68.5 | 142.3 | 169.7 | -55.5 | 0 | 0 | 0 | 0 | 109.7 | E84 | S82-E84 PolarHBondContact O-N 3.03Š| ||
| 83 | C | 35.7 | Very low | 38.9 | Very low | 120 Ų | 120 | 147.3 Ų | 147.3 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | trans | -79.4 | 105 | 171 | -60.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 84 | E | 38.1 | Very low | 38.9 | Very low | 190 Ų | 190 | 151 Ų | 151 | 89% | 0.888 | 79% | 0.793 | S | S | * | * | trans | -83.8 | 114.7 | 165.8 | -164.7 | 169.1 | -160.8 | 0 | 0 | 107.9 | S82 | S82-E84 PolarHBondContact O-N 3.03Š| ||
| 85 | I | 35.2 | Very low | 38.4 | Very low | 145 Ų | 145 | 156.5 Ų | 156.5 | 74% | 0.744 | 80% | 0.8 | S | S | * | * | trans | -117 | 108.5 | 177.7 | -72 | 173.9 | 0 | 0 | 0 | 108.3 | ||||
| 86 | T | 34.4 | Very low | 37.8 | Very low | 131 Ų | 131 | 155.6 Ų | 155.6 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -67.8 | 131.5 | 174.9 | -40.7 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 87 | R | 36.8 | Very low | 37.5 | Very low | 222 Ų | 222 | 155.3 Ų | 155.3 | 84% | 0.838 | 80% | 0.795 | S | S | * | * | trans | -136.6 | 116.9 | 170.5 | -120 | -76.3 | 176.8 | 119.7 | -1.5 | 108.2 | ||||
| 88 | P | 45.8 | Very low | 36.9 | Very low | 105 Ų | 105 | 153.6 Ų | 153.6 | 68% | 0.682 | 80% | 0.798 | S | S | * | * | trans | -88.2 | 135 | 171.4 | 33.6 | -30.5 | 0 | 0 | 0 | 110.4 | ||||
| 89 | E | 34.9 | Very low | 36.7 | Very low | 169 Ų | 169 | 155.8 Ų | 155.8 | 79% | 0.79 | 80% | 0.801 | S | S | * | * | trans | -168.5 | 109.8 | 150.2 | -111.2 | -112.8 | 111.4 | 0 | 0 | 110.3 | ||||
| 90 | E | 35.6 | Very low | 36.4 | Very low | 157 Ų | 157 | 156.2 Ų | 156.2 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | trans | 36.2 | 106.1 | 135 | -47.6 | -44.6 | 109.6 | 0 | 0 | 118.9 | ||||
| 91 | G | 37.7 | Very low | 36.3 | Very low | 62 Ų | 62 | 156.8 Ų | 156.8 | 64% | 0.639 | 79% | 0.794 | S | S | * | * | trans | -85 | 169 | -175.8 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 92 | K | 36.9 | Very low | 36.3 | Very low | 198 Ų | 198 | 150.4 Ų | 150.4 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | -140.3 | 118.9 | 146 | -91.5 | 102.1 | -167 | 168.2 | 0 | 109.1 | ||||
| 93 | C | 31.3 | Very low | 36.1 | Very low | 114 Ų | 114 | 149.9 Ų | 149.9 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -108.1 | 131.3 | 174.9 | -50 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 94 | Y | 37.9 | Very low | 36.2 | Very low | 208 Ų | 208 | 150 Ų | 150 | 82% | 0.816 | 78% | 0.775 | S | S | * | * | trans | -149 | 122.3 | 161.1 | -83 | -68.5 | 0 | 0 | 0 | 111.2 | ||||
| 95 | Y | 33 | Very low | 36 | Very low | 216 Ų | 216 | 144.9 Ų | 144.9 | 85% | 0.847 | 77% | 0.772 | S | S | * | * | trans | 50.4 | 114.7 | 169.6 | -65.6 | -84.5 | 0 | 0 | 0 | 118.4 | ||||
| 96 | N | 34.1 | Very low | 35.9 | Very low | 138 Ų | 138 | 141.9 Ų | 141.9 | 74% | 0.738 | 78% | 0.777 | S | S | * | * | cis | 96.7 | 146.2 | 34.2 | -166.5 | 48.2 | 0 | 0 | 0 | 115 | ||||
| 97 | N | 32.6 | Very low | 35.8 | Very low | 147 Ų | 147 | 139.9 Ų | 139.9 | 79% | 0.786 | 78% | 0.783 | S | S | * | * | trans | 67.4 | 128.3 | -175 | -82.7 | 13.4 | 0 | 0 | 0 | 116.2 | ||||
| 98 | G | 34.2 | Very low | 35.6 | Very low | 76 Ų | 76 | 133 Ų | 133 | 78% | 0.784 | 78% | 0.781 | S | S | * | * | cis | 143.9 | 104.7 | -5.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 99 | N | 33.7 | Very low | 35 | Very low | 159 Ų | 159 | 132.1 Ų | 132.1 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -153 | 133.9 | 154.9 | -160.7 | -0 | 0 | 0 | 0 | 109.7 | ||||
| 100 | R | 37.7 | Very low | 34.8 | Very low | 210 Ų | 210 | 128.3 Ų | 128.3 | 79% | 0.792 | 80% | 0.797 | S | S | * | * | trans | -148.4 | 98 | -176.1 | -174.5 | -161.8 | -168.4 | -160.9 | 4.8 | 110 | I102 | R100-I102 HydrophobicContact CG-CD1 3.86Š| ||
| 101 | E | 42.4 | Very low | 34.7 | Very low | 165 Ų | 165 | 124.9 Ų | 124.9 | 77% | 0.771 | 80% | 0.804 | S | S | * | * | trans | -129.5 | 119.2 | 161.2 | -62.2 | -79.8 | 98.2 | 0 | 0 | 104.3 | ||||
| 102 | I | 37.5 | Very low | 34.8 | Very low | 110 Ų | 110 | 128.1 Ų | 128.1 | 56% | 0.564 | 82% | 0.817 | S | S | * | * | 55.6 | 123 | 59.5 | -74.3 | 74 | 0 | 0 | 0 | 109.5 | R100 | R100-I102 HydrophobicContact CG-CD1 3.86Š| |||
| 103 | C | 32.6 | Very low | 34.6 | Very low | 106 Ų | 106 | 122.4 Ų | 122.4 | 72% | 0.716 | 81% | 0.814 | S | S | * | * | cis | -162.2 | -175.4 | -4.1 | -113.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 104 | S | 37.6 | Very low | 34.7 | Very low | 123 Ų | 123 | 122 Ų | 122 | 86% | 0.86 | 81% | 0.813 | S | S | * | * | trans | 80.7 | 130.8 | 166.6 | -45.7 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 105 | G | 33.2 | Very low | 34.7 | Very low | 81 Ų | 81 | 119.1 Ų | 119.1 | 84% | 0.835 | 81% | 0.81 | S | S | * | * | cis | 117.8 | 105.6 | -4.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 106 | G | 34 | Very low | 34.8 | Very low | 82 Ų | 82 | 117.2 Ų | 117.2 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | 104.7 | 122.8 | 151.7 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 107 | G | 32.4 | Very low | 34.8 | Very low | 89 Ų | 89 | 119.1 Ų | 119.1 | 92% | 0.918 | 80% | 0.803 | S | S | * | * | trans | 77.9 | 148.1 | 157.7 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 108 | G | 32.4 | Very low | 34.9 | Very low | 78 Ų | 78 | 118.9 Ų | 118.9 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | cis | 150.3 | 143.8 | -4.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 109 | G | 32.7 | Very low | 34.9 | Very low | 87 Ų | 87 | 120.8 Ų | 120.8 | 90% | 0.897 | 79% | 0.79 | S | S | * | * | trans | 83.8 | 140.1 | 169.8 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 110 | G | 32.1 | Very low | 35.2 | Very low | 88 Ų | 88 | 123.1 Ų | 123.1 | 91% | 0.907 | 79% | 0.787 | S | S | * | * | trans | -113.9 | -171.9 | 169.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 111 | G | 33.1 | Very low | 35.1 | Very low | 86 Ų | 86 | 117.3 Ų | 117.3 | 89% | 0.887 | 78% | 0.783 | S | S | * | * | trans | 162.3 | 138 | 174.9 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 112 | S | 39.6 | Very low | 35.1 | Very low | 129 Ų | 129 | 121.2 Ų | 121.2 | 90% | 0.902 | 79% | 0.791 | S | S | * | * | trans | -100.4 | 152.1 | -169.7 | 52.3 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 113 | G | 32.9 | Very low | 34.9 | Very low | 78 Ų | 78 | 123.6 Ų | 123.6 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | 113.8 | 160.3 | 155.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 114 | S | 33.1 | Very low | 35.1 | Very low | 106 Ų | 106 | 123.6 Ų | 123.6 | 74% | 0.741 | 81% | 0.813 | S | S | * | * | cis | 179.3 | 148 | -18.3 | -159.7 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 115 | L | 38.5 | Very low | 35.2 | Very low | 147 Ų | 147 | 123.4 Ų | 123.4 | 77% | 0.77 | 81% | 0.811 | S | S | * | * | trans | 79 | 127.1 | 160.5 | -56.1 | 179.2 | 0 | 0 | 0 | 123.6 | ||||
| 116 | K | 33.8 | Very low | 35.2 | Very low | 177 Ų | 177 | 124.7 Ų | 124.7 | 77% | 0.77 | 81% | 0.808 | S | S | * | * | trans | 71.3 | 146.2 | 143.1 | -75 | 167.7 | 62 | 175.6 | 0 | 117.8 | ||||
| 117 | R | 33.9 | Very low | 35.8 | Very low | 177 Ų | 177 | 128.4 Ų | 128.4 | 67% | 0.668 | 81% | 0.807 | S | S | * | * | cis | -163.4 | 149.4 | 13.5 | -143.5 | -171.4 | 170.7 | -150.3 | -21 | 111.5 | ||||
| 118 | E | 36.1 | Very low | 35.9 | Very low | 143 Ų | 143 | 131.1 Ų | 131.1 | 67% | 0.668 | 81% | 0.806 | S | S | * | * | trans | 45.3 | 150.6 | 140.8 | -81.1 | 159.9 | 49.3 | 0 | 0 | 121.7 | ||||
| 119 | D | 33.1 | Very low | 36.2 | Very low | 115 Ų | 115 | 133 Ų | 133 | 62% | 0.615 | 81% | 0.807 | S | S | * | * | cis | -167.1 | 171.5 | 4.1 | 175.6 | -122 | 0 | 0 | 0 | 110.2 | ||||
| 120 | R | 39.4 | Very low | 36.2 | Very low | 209 Ų | 209 | 135 Ų | 135 | 79% | 0.789 | 80% | 0.797 | S | S | * | * | trans | 78.6 | 117.8 | 176.1 | -50.2 | -179.3 | 179.9 | 72.6 | 4.2 | 115.4 | ||||
| 121 | A | 36.3 | Very low | 36.6 | Very low | 87 Ų | 87 | 138.5 Ų | 138.5 | 72% | 0.719 | 79% | 0.789 | S | S | * | * | cis | 74 | 98.4 | 26.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 122 | R | 42.7 | Very low | 36.7 | Very low | 247 Ų | 247 | 137.3 Ų | 137.3 | 93% | 0.932 | 78% | 0.777 | S | S | * | * | -177.9 | 137.2 | 105.3 | -98 | -179.5 | -177.9 | 123.6 | 1.9 | 113.3 | |||||
| 123 | D | 34.2 | Very low | 36.7 | Very low | 161 Ų | 161 | 139.5 Ų | 139.5 | 86% | 0.861 | 78% | 0.775 | S | S | * | * | trans | -65.6 | 156.5 | 162.8 | -55.5 | -96.4 | 0 | 0 | 0 | 112.9 | ||||
| 124 | A | 35.2 | Very low | 37 | Very low | 106 Ų | 106 | 144.5 Ų | 144.5 | 88% | 0.876 | 78% | 0.777 | S | S | * | * | trans | -151.4 | 119.9 | 144.2 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 125 | S | 40.3 | Very low | 37.1 | Very low | 118 Ų | 118 | 143.6 Ų | 143.6 | 83% | 0.825 | 78% | 0.776 | S | S | * | * | trans | -97 | 154.7 | 173.6 | 49.1 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 126 | S | 34.3 | Very low | 36.8 | Very low | 109 Ų | 109 | 139.6 Ų | 139.6 | 76% | 0.762 | 77% | 0.77 | S | S | * | * | 161.8 | 130.3 | 129 | -174.6 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 127 | L | 45.2 | Very low | 37.4 | Very low | 160 Ų | 160 | 139.8 Ų | 139.8 | 84% | 0.838 | 78% | 0.778 | S | S | * | * | trans | -21.7 | 141.3 | 147.5 | -53.9 | 162 | 0 | 0 | 0 | 116.9 | ||||
| 128 | T | 36 | Very low | 37.6 | Very low | 146 Ų | 146 | 135.9 Ų | 135.9 | 90% | 0.896 | 78% | 0.784 | S | S | * | * | trans | -151.2 | 155.2 | 134.1 | 47.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 129 | S | 36.7 | Very low | 37.6 | Very low | 116 Ų | 116 | 133.1 Ų | 133.1 | 81% | 0.811 | 79% | 0.793 | S | S | * | * | trans | -105.7 | 166.1 | -179.1 | -58.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 130 | D | 33.7 | Very low | 37.7 | Very low | 130 Ų | 130 | 131.2 Ų | 131.2 | 70% | 0.695 | 80% | 0.801 | S | S | * | * | 107.8 | 144.3 | 127.6 | -139 | -175.5 | 0 | 0 | 0 | 121.1 | |||||
| 131 | H | 41 | Very low | 37.7 | Very low | 162 Ų | 162 | 128 Ų | 128 | 75% | 0.75 | 80% | 0.804 | S | S | * | * | trans | 56.4 | 148.2 | 173.6 | -58.8 | 91.5 | 0 | 0 | 0 | 118.9 | ||||
| 132 | G | 34 | Very low | 37.9 | Very low | 60 Ų | 60 | 128.4 Ų | 128.4 | 62% | 0.619 | 81% | 0.807 | S | S | * | * | cis | 159.2 | 147.8 | -8.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 133 | M | 40.5 | Very low | 37.3 | Very low | 176 Ų | 176 | 126 Ų | 126 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | trans | 87.7 | 122.8 | 154.9 | -46.9 | -52.8 | 175 | 0 | 0 | 123.6 | ||||
| 134 | H | 39.5 | Very low | 37.8 | Very low | 182 Ų | 182 | 121.9 Ų | 121.9 | 84% | 0.843 | 79% | 0.788 | S | S | * | * | 108.2 | 112.7 | 124.7 | -151 | -104.2 | 0 | 0 | 0 | 123.2 | |||||
| 135 | A | 35 | Very low | 37.8 | Very low | 88 Ų | 88 | 123.9 Ų | 123.9 | 73% | 0.727 | 78% | 0.777 | S | S | * | * | trans | 55 | 153.5 | 152.2 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 136 | G | 32.3 | Very low | 37.5 | Very low | 63 Ų | 63 | 129.5 Ų | 129.5 | 65% | 0.649 | 78% | 0.781 | S | S | * | * | cis | 156.8 | 164.7 | -2.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | ||||
| 137 | I | 45.5 | Very low | 37.4 | Very low | 181 Ų | 181 | 131 Ų | 131 | 93% | 0.928 | 78% | 0.777 | S | S | * | * | trans | 77.5 | 142.4 | 178.3 | -51.4 | 175.4 | 0 | 0 | 0 | 115.1 | ||||
| 138 | A | 38.7 | Very low | 36.8 | Very low | 95 Ų | 95 | 134.7 Ų | 134.7 | 79% | 0.785 | 78% | 0.781 | S | S | * | * | cis | -170.8 | 156.7 | -33.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 139 | G | 35.3 | Very low | 36.9 | Very low | 85 Ų | 85 | 130.5 Ų | 130.5 | 88% | 0.876 | 77% | 0.766 | S | S | * | * | trans | 91.5 | 132 | 162.6 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 140 | G | 35.5 | Very low | 36.7 | Very low | 74 Ų | 74 | 131.3 Ų | 131.3 | 76% | 0.763 | 77% | 0.767 | S | S | * | * | cis | 139.4 | 92.1 | -11.3 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 141 | V | 39.2 | Very low | 37.2 | Very low | 142 Ų | 142 | 134.3 Ų | 134.3 | 86% | 0.861 | 78% | 0.777 | S | S | * | * | trans | -172.9 | 111.2 | 152.6 | -97.2 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 142 | A | 40.4 | Very low | 37.2 | Very low | 95 Ų | 95 | 135 Ų | 135 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | 63.2 | 116.7 | 77.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | |||||
| 143 | F | 31.6 | Very low | 37.2 | Very low | 196 Ų | 196 | 139.7 Ų | 139.7 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | -171.2 | 148.3 | 65.8 | -176.7 | -108.4 | 0 | 0 | 0 | 113.9 | |||||
| 144 | S | 43.1 | Very low | 37.1 | Very low | 76 Ų | 76 | 136.5 Ų | 136.5 | 53% | 0.531 | 78% | 0.781 | S | S | . | * | trans | 30.4 | 129.3 | 160.2 | -53 | 0 | 0 | 0 | 0 | 122.1 | ||||
| 145 | K | 36.2 | Very low | 36.9 | Very low | 148 Ų | 148 | 137.1 Ų | 137.1 | 64% | 0.643 | 78% | 0.784 | S | S | * | * | cis | 74.4 | 114 | 41.6 | -157.7 | -164.1 | -161 | -154.2 | 0 | 114.7 | E147 | K145-E147 HydrophobicContact CD-CB 4.35Å; K145-E147 WeakPolarHBondContact CE-OE1 3.34Å; K145-E147 WeakPolarHBondContact CE-OE2 3.24Å; K145-E147 HydrophobicContact CG-CB 4.22Å; K145-E147 IonicContact NZ-OE1 2.68Å; K145-E147 PolarHBondContact NZ-OE1 2.98Å; K145-E147 IonicContact NZ-OE2 3.75Å; K145-E147 PolarHBondContact NZ-OE2 3.05Å; K145-E147 VanDerWaalsContact NZ-OE2 3.14Å | ||
| 146 | Y | 34.2 | Very low | 36.9 | Very low | 235 Ų | 235 | 140.1 Ų | 140.1 | 92% | 0.922 | 79% | 0.788 | S | S | * | * | trans | -129 | 135.6 | 138.3 | 52.2 | -96.5 | 0 | 0 | 0 | 108.9 | ||||
| 147 | E | 31.2 | Very low | 38.2 | Very low | 141 Ų | 141 | 141.6 Ų | 141.6 | 66% | 0.659 | 79% | 0.786 | S | S | * | * | trans | -149.9 | 131.4 | -172.3 | 175.4 | -170.9 | 96.1 | 0 | 0 | 107.3 | K145 | K145-E147 HydrophobicContact CD-CB 4.35Å; K145-E147 WeakPolarHBondContact CE-OE1 3.34Å; K145-E147 WeakPolarHBondContact CE-OE2 3.24Å; K145-E147 HydrophobicContact CG-CB 4.22Å; K145-E147 IonicContact NZ-OE1 2.68Å; K145-E147 PolarHBondContact NZ-OE1 2.98Å; K145-E147 IonicContact NZ-OE2 3.75Å; K145-E147 PolarHBondContact NZ-OE2 3.05Å; K145-E147 VanDerWaalsContact NZ-OE2 3.14Å | ||
| 148 | Y | 34 | Very low | 38.5 | Very low | 238 Ų | 238 | 138.7 Ų | 138.7 | 93% | 0.933 | 78% | 0.779 | S | S | * | * | trans | -164.1 | 134.1 | 166.9 | -148 | -86.5 | 0 | 0 | 0 | 106.4 | ||||
| 149 | G | 37 | Very low | 38.7 | Very low | 57 Ų | 57 | 139 Ų | 139 | 59% | 0.588 | 78% | 0.775 | S | S | * | * | cis | 172.1 | 119.8 | -4.2 | 0 | 0 | 0 | 0 | 0 | 106.4 | ||||
| 150 | T | 33.7 | Very low | 38.6 | Very low | 133 Ų | 133 | 141 Ų | 141 | 82% | 0.816 | 78% | 0.775 | S | S | * | * | trans | -99.7 | 125.7 | -175.8 | -58.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 151 | E | 44.3 | Very low | 38.8 | Very low | 194 Ų | 194 | 146 Ų | 146 | 91% | 0.907 | 78% | 0.778 | S | S | * | * | trans | -118.1 | 145.5 | 167.2 | -63.5 | -110.9 | 119.8 | 0 | 0 | 108.8 | ||||
| 152 | Q | 39.2 | Very low | 39 | Very low | 177 Ų | 177 | 143.8 Ų | 143.8 | 83% | 0.827 | 77% | 0.769 | S | S | * | * | trans | -142.5 | 112 | -162.5 | 174.2 | -173.6 | 11.4 | 0 | 0 | 109.8 | ||||
| 153 | L | 34.5 | Very low | 39.4 | Very low | 157 Ų | 157 | 148 Ų | 148 | 82% | 0.822 | 77% | 0.774 | S | S | * | * | trans | -163.2 | 121.3 | 158.5 | -134.9 | 68.3 | 0 | 0 | 0 | 114.5 | ||||
| 154 | T | 38.4 | Very low | 39.8 | Very low | 109 Ų | 109 | 146.4 Ų | 146.4 | 67% | 0.669 | 77% | 0.77 | S | S | * | * | trans | 38.2 | 115.8 | 142.7 | 60.7 | 0 | 0 | 0 | 0 | 122 | ||||
| 155 | Q | 35.8 | Very low | 40 | Very low | 196 Ų | 196 | 148.1 Ų | 148.1 | 92% | 0.916 | 78% | 0.782 | S | S | * | * | 173.2 | 156.1 | 103 | -91.1 | -176.2 | -0.5 | 0 | 0 | 111.2 | |||||
| 156 | D | 35.5 | Very low | 40.4 | Very low | 151 Ų | 151 | 148.3 Ų | 148.3 | 81% | 0.807 | 79% | 0.79 | S | S | * | * | trans | -122.3 | -177.5 | -175.3 | -156.1 | 22.2 | 0 | 0 | 0 | 109.4 | ||||
| 157 | P | 59.3 | Low | 41 | Very low | 94 Ų | 94 | 142.7 Ų | 142.7 | 61% | 0.61 | 79% | 0.785 | S | S | * | * | -111.3 | -170.6 | -97.6 | 38.8 | -23.4 | 0 | 0 | 0 | 113.8 | |||||
| 158 | P | 52 | Low | 41.4 | Very low | 119 Ų | 119 | 141.1 Ų | 141.1 | 77% | 0.773 | 79% | 0.789 | S | S | * | * | -140.3 | 136.9 | 91.2 | 32.1 | -14.8 | 0 | 0 | 0 | 113.3 | |||||
| 159 | S | 41.3 | Very low | 41.6 | Very low | 101 Ų | 101 | 135.3 Ų | 135.3 | 71% | 0.706 | 78% | 0.784 | S | S | * | * | 63.3 | 104 | 77.5 | -166.6 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 160 | C | 34.3 | Very low | 41.8 | Very low | 129 Ų | 129 | 137.6 Ų | 137.6 | 87% | 0.872 | 79% | 0.791 | S | S | * | * | trans | -133.8 | 93.8 | 162.7 | -79.2 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 161 | Q | 40.4 | Very low | 42.2 | Very low | 178 Ų | 178 | 138.9 Ų | 138.9 | 83% | 0.832 | 79% | 0.792 | S | S | * | * | trans | 6.3 | 115 | 146.2 | -57.7 | 168.7 | 18 | 0 | 0 | 115.3 | ||||
| 162 | S | 42.8 | Very low | 42.4 | Very low | 95 Ų | 95 | 137.3 Ų | 137.3 | 66% | 0.664 | 79% | 0.788 | S | S | * | * | 47.5 | 104.5 | 72.2 | -163.2 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 163 | M | 48.4 | Very low | 42.3 | Very low | 184 Ų | 184 | 135.2 Ų | 135.2 | 91% | 0.906 | 78% | 0.783 | S | S | * | * | trans | -135 | 103.8 | 145.6 | 64.6 | 179.4 | -170.8 | 0 | 0 | 109.1 | ||||
| 164 | E | 40.7 | Very low | 42.3 | Very low | 163 Ų | 163 | 135.8 Ų | 135.8 | 76% | 0.762 | 78% | 0.782 | S | S | * | * | trans | -75.3 | 147.9 | 169.4 | -50 | 174 | 132 | 0 | 0 | 107.3 | ||||
| 165 | S | 47.6 | Very low | 42.2 | Very low | 112 Ų | 112 | 134.3 Ų | 134.3 | 78% | 0.783 | 79% | 0.788 | S | S | * | * | trans | -145 | 73.7 | 172.4 | -73.4 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 166 | D | 42.7 | Very low | 42.3 | Very low | 152 Ų | 152 | 128.2 Ų | 128.2 | 81% | 0.813 | 78% | 0.778 | S | S | * | * | trans | -62.2 | 134.7 | 158.7 | -75.8 | -48 | 0 | 0 | 0 | 109.7 | ||||
| 167 | S | 48.8 | Very low | 42.6 | Very low | 117 Ų | 117 | 131 Ų | 131 | 82% | 0.818 | 78% | 0.782 | S | S | * | * | trans | -140.8 | 69 | 162.7 | -77.1 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 168 | S | 39.1 | Very low | 42.3 | Very low | 107 Ų | 107 | 131.8 Ų | 131.8 | 75% | 0.748 | 79% | 0.788 | S | S | * | * | trans | -68.8 | 120.4 | 158.6 | 171.5 | 0 | 0 | 0 | 0 | 109 | ||||
| 169 | S | 38.6 | Very low | 42.1 | Very low | 117 Ų | 117 | 131.8 Ų | 131.8 | 82% | 0.818 | 79% | 0.788 | S | S | * | * | trans | -124.9 | 91.6 | 162.8 | 54.1 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 170 | S | 41 | Very low | 41.9 | Very low | 105 Ų | 105 | 132.1 Ų | 132.1 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | -116.4 | 92.7 | 172.3 | -66.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 171 | L | 42.1 | Very low | 42.2 | Very low | 160 Ų | 160 | 131.6 Ų | 131.6 | 84% | 0.838 | 79% | 0.788 | S | S | * | * | trans | -151.9 | 128.5 | 171.4 | -65.1 | 178.1 | 0 | 0 | 0 | 105.9 | ||||
| 172 | L | 48.1 | Very low | 42.1 | Very low | 160 Ų | 160 | 130 Ų | 130 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | cis | -138 | 155.7 | 3.3 | -65 | 170.1 | 0 | 0 | 0 | 110.1 | ||||
| 173 | N | 36.5 | Very low | 42.1 | Very low | 133 Ų | 133 | 132.4 Ų | 132.4 | 71% | 0.711 | 80% | 0.796 | S | S | * | * | trans | -103.1 | 144.7 | 159.7 | 168.3 | 58.8 | 0 | 0 | 0 | 108.9 | ||||
| 174 | E | 35.4 | Very low | 42 | Very low | 170 Ų | 170 | 132 Ų | 132 | 79% | 0.794 | 79% | 0.792 | S | S | * | * | trans | 149.3 | 150.2 | 143.3 | -87.1 | -63.5 | 101.4 | 0 | 0 | 112.7 | ||||
| 175 | G | 36 | Very low | 42.1 | Very low | 77 Ų | 77 | 130.6 Ų | 130.6 | 79% | 0.794 | 79% | 0.794 | S | S | * | * | trans | 111.1 | 80.5 | 156.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 176 | G | 38.5 | Very low | 42.2 | Very low | 69 Ų | 69 | 133.2 Ų | 133.2 | 71% | 0.711 | 80% | 0.799 | S | S | * | * | trans | -115.9 | 128.1 | 167.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 177 | K | 40.3 | Very low | 42.5 | Very low | 208 Ų | 208 | 132.4 Ų | 132.4 | 90% | 0.904 | 80% | 0.799 | S | S | * | * | trans | -171.6 | 154.5 | 144.2 | -120.9 | 78.5 | 173.4 | -169.3 | 0 | 109.9 | ||||
| 178 | P | 53.2 | Low | 42 | Very low | 112 Ų | 112 | 132.1 Ų | 132.1 | 73% | 0.727 | 80% | 0.797 | S | S | * | * | trans | -95.3 | 178.3 | -177 | 42.3 | -36.3 | 0 | 0 | 0 | 111.9 | ||||
| 179 | P | 47.5 | Very low | 42.4 | Very low | 119 Ų | 119 | 132.7 Ų | 132.7 | 77% | 0.773 | 80% | 0.798 | S | S | * | * | -146.3 | 157.9 | 88.8 | 38.6 | -21.7 | 0 | 0 | 0 | 117.1 | |||||
| 180 | S | 38.5 | Very low | 42.6 | Very low | 108 Ų | 108 | 130.4 Ų | 130.4 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | trans | -9.4 | 135.9 | 158.4 | 55.2 | 0 | 0 | 0 | 0 | 121.8 | ||||
| 181 | S | 39.3 | Very low | 42.7 | Very low | 117 Ų | 117 | 131 Ų | 131 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | -158.5 | 143.8 | 121.9 | 56.7 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 182 | D | 39.7 | Very low | 43 | Very low | 145 Ų | 145 | 132.6 Ų | 132.6 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | trans | -68.8 | 149.5 | -173 | -60.5 | -99.9 | 0 | 0 | 0 | 114.6 | ||||
| 183 | T | 41.6 | Very low | 42.9 | Very low | 145 Ų | 145 | 130.3 Ų | 130.3 | 89% | 0.89 | 80% | 0.797 | S | S | * | * | trans | -150.6 | 129.9 | 137.6 | -16.4 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 184 | Q | 46.6 | Very low | 43 | Very low | 176 Ų | 176 | 127 Ų | 127 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | -83.4 | 140.1 | -174.2 | -55.4 | 167.7 | 10.8 | 0 | 0 | 111.1 | ||||
| 185 | T | 42.4 | Very low | 43.5 | Very low | 133 Ų | 133 | 126.8 Ų | 126.8 | 82% | 0.816 | 80% | 0.799 | S | S | * | * | trans | -153.6 | 98.7 | 154.1 | 17.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 186 | L | 49.2 | Very low | 44.1 | Very low | 167 Ų | 167 | 130.8 Ų | 130.8 | 87% | 0.874 | 80% | 0.801 | S | S | * | * | trans | 42.6 | 102.8 | 140.3 | -56.9 | 176.1 | 0 | 0 | 0 | 119.2 | ||||
| 187 | V | 49.2 | Very low | 44.7 | Very low | 135 Ų | 135 | 132.4 Ų | 132.4 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -65.1 | 141 | 153 | 52.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 188 | S | 38.8 | Very low | 45.2 | Very low | 112 Ų | 112 | 127 Ų | 127 | 78% | 0.783 | 80% | 0.801 | S | S | * | * | trans | -149.3 | 148.1 | 156.5 | -88.4 | 0 | 0 | 0 | 0 | 111 | ||||
| 189 | P | 48.5 | Very low | 45.2 | Very low | 118 Ų | 118 | 125.6 Ų | 125.6 | 77% | 0.766 | 81% | 0.807 | S | S | * | * | trans | -105.1 | 161.2 | -154.1 | 38.9 | -34.3 | 0 | 0 | 0 | 114.5 | ||||
| 190 | G | 42.5 | Very low | 45.4 | Very low | 69 Ų | 69 | 123.9 Ų | 123.9 | 71% | 0.711 | 81% | 0.811 | S | S | * | * | trans | 70.1 | 97.5 | 143.1 | 0 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 191 | S | 43.5 | Very low | 45.9 | Very low | 118 Ų | 118 | 121.9 Ų | 121.9 | 83% | 0.825 | 81% | 0.807 | S | S | * | * | trans | -123.1 | 84.8 | 151.9 | -83.8 | 0 | 0 | 0 | 0 | 110.2 | S193 | S191-S193 VanDerWaalsContact C-N 3.26Å; S191-S193 PolarHBondContact O-N 3.12Å | ||
| 192 | H | 46.7 | Very low | 46.8 | Very low | 194 Ų | 194 | 119.1 Ų | 119.1 | 90% | 0.898 | 79% | 0.792 | S | S | * | * | trans | -70.8 | 88.4 | 157.4 | -72.9 | -58.9 | 0 | 0 | 0 | 108.3 | G194 | H192-G194 PolarHBondContact O-N 3.32Š| ||
| 193 | S | 47.2 | Very low | 47.8 | Very low | 111 Ų | 111 | 118.1 Ų | 118.1 | 78% | 0.776 | 79% | 0.793 | S | S | * | * | trans | -62.8 | 99.6 | 168 | -65.8 | 0 | 0 | 0 | 0 | 108.8 | S191 N195 | S191-S193 VanDerWaalsContact C-N 3.26Å; S191-S193 PolarHBondContact O-N 3.12Å; S193-N195 PolarHBondContact O-N 3.46Å | ||
| 194 | G | 38.4 | Very low | 48.7 | Very low | 63 Ų | 63 | 122.1 Ų | 122.1 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | trans | -61.3 | 130.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | H192 I196 | H192-G194 PolarHBondContact O-N 3.32Å; G194-I196 PolarHBondContact O-N 3.17Å | ||
| 195 | N | 45.5 | Very low | 49 | Very low | 167 Ų | 167 | 122.5 Ų | 122.5 | 89% | 0.893 | 79% | 0.787 | S | S | * | * | trans | -63.4 | 101.7 | 165.9 | -79.5 | -11.5 | 0 | 0 | 0 | 108.3 | S193 A197 | S193-N195 PolarHBondContact O-N 3.46Å; N195-A197 PolarHBondContact O-N 3.08Å | ||
| 196 | I | 47.9 | Very low | 50 | Low | 161 Ų | 161 | 121.8 Ų | 121.8 | 83% | 0.826 | 79% | 0.785 | S | S | * | * | trans | -66.5 | 103.7 | 168.9 | -63.8 | -176.3 | 0 | 0 | 0 | 107.5 | G194 A198 | G194-I196 PolarHBondContact O-N 3.17Å; I196-A198 VanDerWaalsContact C-N 3.29Å; I196-A198 PolarHBondContact O-N 3.44Å | ||
| 197 | A | 52.5 | Low | 50.3 | Low | 103 Ų | 103 | 121.1 Ų | 121.1 | 85% | 0.851 | 78% | 0.779 | S | S | * | * | trans | -73.4 | 83 | 171.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | N195 G199 | N195-A197 PolarHBondContact O-N 3.08Å; A197-G199 PolarHBondContact O-N 3.28Å | ||
| 198 | A | 51 | Low | 50.8 | Low | 93 Ų | 93 | 122.5 Ų | 122.5 | 77% | 0.769 | 78% | 0.777 | S | S | * | * | trans | -80.8 | 98.8 | 165.5 | 0 | 0 | 0 | 0 | 0 | 108.8 | I196 | I196-A198 VanDerWaalsContact C-N 3.29Å; I196-A198 PolarHBondContact O-N 3.44Å | ||
| 199 | G | 53.1 | Low | 51.9 | Low | 83 Ų | 83 | 123.1 Ų | 123.1 | 86% | 0.856 | 78% | 0.775 | S | S | * | * | trans | -67.1 | 147.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A197 | A197-G199 PolarHBondContact O-N 3.28Š| ||
| 200 | G | 51.5 | Low | 52.8 | Low | 84 Ų | 84 | 128.1 Ų | 128.1 | 87% | 0.866 | 78% | 0.779 | S | S | * | * | trans | 150.1 | 23.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||||
| 201 | G | 49.8 | Very low | 54.4 | Low | 65 Ų | 65 | 131.2 Ų | 131.2 | 67% | 0.67 | 78% | 0.784 | S | S | * | * | trans | -84.8 | 118.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 202 | A | 57.1 | Low | 56.2 | Low | 59 Ų | 59 | 137.1 Ų | 137.1 | 49% | 0.488 | 79% | 0.789 | S | S | . | * | trans | -63.9 | 142.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | W204 Y205 | A202-W204 PolarHBondContact O-N 3.37Å; A202-Y205 PolarHBondContact O-N 3.33Å | ||
| 203 | P | 60.4 | Low | 58 | Low | 124 Ų | 124 | 137.3 Ų | 137.3 | 81% | 0.805 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.1 | -15.6 | -171.3 | -26.8 | 35.2 | 0 | 0 | 0 | 116.6 | ||
| 204 | W | 61.6 | Low | 60 | Low | 230 Ų | 230 | 141.5 Ų | 141.5 | 87% | 0.871 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | -5.2 | -170.8 | -59.2 | 101.8 | 0 | 0 | 0 | 114.5 | A202 | A202-W204 PolarHBondContact O-N 3.37Š|
| 205 | Y | 53.1 | Low | 62.6 | Low | 183 Ų | 183 | 148.8 Ų | 148.8 | 72% | 0.718 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -112.1 | 114.6 | 174.8 | -72.4 | -89.4 | 0 | 0 | 0 | 109.7 | A202 M207 | A202-Y205 PolarHBondContact O-N 3.33Å; Y205-M207 VanDerWaalsContact C-N 3.31Å; Y205-M207 PolarHBondContact O-N 3.37Å |
| 206 | P | 61.5 | Low | 64.9 | Low | 119 Ų | 119 | 149.8 Ų | 149.8 | 77% | 0.773 | 80% | 0.795 | S | S | * | * | trans | -62 | 92.4 | 170.7 | -23.8 | 35 | 0 | 0 | 0 | 110.6 | H208 | P206-H208 PolarHBondContact O-N 3.2Š| ||
| 207 | M | 57.3 | Low | 67.2 | Low | 153 Ų | 153 | 147.9 Ų | 147.9 | 75% | 0.754 | 79% | 0.794 | S | S | * | * | trans | -72 | 37.3 | 172 | -99 | -66.5 | 156.6 | 0 | 0 | 112.8 | Y205 | Y205-M207 VanDerWaalsContact C-N 3.31Å; Y205-M207 PolarHBondContact O-N 3.37Å | ||
| 208 | H | 59.9 | Low | 69.4 | Low | 164 Ų | 164 | 146.1 Ų | 146.1 | 76% | 0.759 | 77% | 0.765 | S | S | * | * | trans | -113.1 | 88.4 | 155.9 | -75.2 | -41.3 | 0 | 0 | 0 | 107.9 | P206 R210 | P206-H208 PolarHBondContact O-N 3.2Å; H208-R210 HydrophobicContact CB-CB 4.43Å; H208-R210 PolarHBondContact O-N 3.18Å | ||
| 209 | T | 61.2 | Low | 71.7 | Confident | 124 Ų | 124 | 144.4 Ų | 144.4 | 76% | 0.761 | 75% | 0.747 | S | S | * | * | trans | -63.2 | 56.4 | 149.9 | 45.5 | 0 | 0 | 0 | 0 | 109.5 | T211 | T209-T211 PolarHBondContact O-N 3.11Š| ||
| 210 | R | 67.4 | Low | 73.8 | Confident | 223 Ų | 223 | 149.8 Ų | 149.8 | 84% | 0.842 | 75% | 0.747 | S | S | * | * | trans | -58.9 | 104.1 | -179.3 | -164.1 | 179.3 | -162.6 | -132.8 | 4.5 | 106.5 | H208 R212 | H208-R210 HydrophobicContact CB-CB 4.43Å; H208-R210 PolarHBondContact O-N 3.18Å; R210-R212 PolarHBondContact O-N 3.29Å | ||
| 211 | T | 75.6 | Confident | 76 | Confident | 134 Ų | 134 | 151.5 Ų | 151.5 | 82% | 0.822 | 74% | 0.736 | S | S | * | * | trans | -53.1 | 108.6 | -166.4 | 39.4 | 0 | 0 | 0 | 0 | 108.9 | T209 K213 | T209-T211 PolarHBondContact O-N 3.11Å; T211-K213 PolarHBondContact O-N 3.49Å | ||
| 212 | R | 81.5 | Confident | 78.4 | Confident | 243 Ų | 243 | 150 Ų | 150 | 92% | 0.917 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 117.2 | -172.3 | -78.7 | -172 | 173.2 | -142.7 | 0.4 | 107.9 | R210 K214 | R210-R212 PolarHBondContact O-N 3.29Å; R212-K214 PolarHBondContact O-N 3.17Å; R212-K214 VanDerWaalsContact O-N 3.13Å |
| 213 | K | 85.7 | Confident | 80.3 | Confident | 197 Ų | 197 | 150.2 Ų | 150.2 | 86% | 0.857 | 70% | 0.704 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 122.2 | -179.4 | -171.8 | 164.6 | -176 | 168.4 | 0 | 109.4 | T211 R215 | T211-K213 PolarHBondContact O-N 3.49Å; K213-R215 PolarHBondContact O-N 3.46Å |
| 214 | K | 88.9 | Confident | 82.1 | Confident | 199 Ų | 199 | 147.1 Ų | 147.1 | 87% | 0.865 | 69% | 0.689 | S | S | * | * | P | Polyproline II helix | trans | -51.6 | 123.6 | -179.2 | -173.5 | 174 | -179 | 177 | 0 | 108.8 | R212 K216 | R212-K214 PolarHBondContact O-N 3.17Å; R212-K214 VanDerWaalsContact O-N 3.13Å; K214-K216 PolarHBondContact O-N 2.99Å |
| 215 | R | 92.9 | Very high | 83.9 | Confident | 217 Ų | 217 | 138.9 Ų | 138.9 | 82% | 0.819 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -68 | 131.1 | -176.7 | -56.6 | 178.6 | 88.3 | 168.1 | 5.3 | 108.3 | K213 | K213-R215 PolarHBondContact O-N 3.46Š|
| 216 | K | 93.6 | Very high | 86 | Confident | 188 Ų | 188 | 130.1 Ų | 130.1 | 82% | 0.817 | 63% | 0.626 | S | S | * | * | P | Polyproline II helix | trans | -87.8 | 135 | 165.8 | -65.9 | -172.3 | 175.1 | -170.8 | 0 | 108.2 | K214 | K214-K216 PolarHBondContact O-N 2.99Š|
| 217 | P | 96.5 | Very high | 87.8 | Confident | 121 Ų | 121 | 128.1 Ų | 128.1 | 79% | 0.786 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 154.8 | 169.3 | 30.4 | -34.1 | 0 | 0 | 0 | 110 | ||
| 218 | Y | 98.1 | Very high | 89.8 | Confident | 66 Ų | 66 | 122.1 Ų | 122.1 | 26% | 0.259 | 58% | 0.583 | S | S | . | * | P | Polyproline II helix | trans | -79.7 | 147.2 | 171.2 | -59.5 | -52.3 | 0 | 0 | 0 | 110.2 | L223 L250 W258 | Y218-L223 HydrophobicContact CD2-CD2 4.24Å; Y218-L250 HydrophobicContact CD1-CD1 4.22Å; Y218-L250 HydrophobicContact CD1-CD2 3.82Å; Y218-L250 HydrophobicContact CE1-CD1 4.11Å; Y218-L250 HydrophobicContact CE1-CD2 3.63Å; Y218-W258 AromaticContact CD2-CD1 3.87Å; Y218-W258 AromaticContact CE2-CD1 3.7Å |
| 219 | S | 98.5 | Very high | 91.6 | Very high | 56 Ų | 56 | 115.4 Ų | 115.4 | 39% | 0.392 | 55% | 0.552 | S | S | . | * | P | Polyproline II helix | trans | -71 | 161.7 | 177 | 78.2 | 0 | 0 | 0 | 0 | 111.6 | L221 Q222 L223 | S219-L221 VanDerWaalsContact C-N 3.27Å; S219-L221 PolarHBondContact O-N 2.84Å; S219-Q222 PolarHBondContact O-N 3.45Å; S219-Q222 WeakPolarHBondContact OG-CG 3.28Å; S219-Q222 PolarHBondContact OG-N 3.18Å; S219-L223 WeakPolarHBondContact O-CG 3.19Å; S219-L223 PolarHBondContact O-N 3.13Å |
| 220 | K | 98.3 | Very high | 93.4 | Very high | 197 Ų | 197 | 109.9 Ų | 109.9 | 86% | 0.857 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -56 | -42.2 | 176.2 | -67.3 | -174.2 | 179.6 | -178.8 | 0 | 111.8 | L223 A224 | K220-L223 PolarHBondContact O-N 3.39Å; K220-A224 WeakPolarHBondContact O-CB 3.41Å; K220-A224 PolarHBondContact O-N 3.03Å |
| 221 | L | 98.1 | Very high | 94.8 | Very high | 119 Ų | 119 | 106.7 Ų | 106.7 | 62% | 0.623 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.2 | -46.5 | 176.3 | -179.4 | 64.6 | 0 | 0 | 0 | 112.1 | S219 L223 A224 E225 | S219-L221 VanDerWaalsContact C-N 3.27Å; S219-L221 PolarHBondContact O-N 2.84Å; L221-L223 VanDerWaalsContact C-N 3.28Å; L221-L223 PolarHBondContact O-N 3.37Å; L221-A224 PolarHBondContact O-N 2.88Å; L221-E225 HydrophobicContact CD1-CG 4.34Å; L221-E225 WeakPolarHBondContact O-CG 3.23Å; L221-E225 PolarHBondContact O-N 2.91Å; L221-E225 VanDerWaalsContact O-N 3.08Å |
| 222 | Q | 98.4 | Very high | 95.9 | Very high | 33 Ų | 33 | 107 Ų | 107 | 15% | 0.154 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -59.8 | -40.2 | 176.8 | -72.9 | 174.5 | -29 | 0 | 0 | 111.8 | S219 L226 L248 | S219-Q222 PolarHBondContact O-N 3.45Å; S219-Q222 WeakPolarHBondContact OG-CG 3.28Å; S219-Q222 PolarHBondContact OG-N 3.18Å; Q222-L226 WeakPolarHBondContact O-CB 3.39Å; Q222-L226 VanDerWaalsContact O-CD1 3.29Å; Q222-L226 WeakPolarHBondContact O-CD1 3.44Å; Q222-L226 WeakPolarHBondContact O-CG 3.41Å; Q222-L226 PolarHBondContact O-N 2.81Å; Q222-L248 HydrophobicContact CG-CB 4.27Å; Q222-L248 PolarHBondContact NE2-O 3.2Å |
| 223 | L | 98.4 | Very high | 96.6 | Very high | 65 Ų | 65 | 99 Ų | 99 | 34% | 0.34 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -67.4 | -45.4 | 176.8 | -67.4 | 174.6 | 0 | 0 | 0 | 111.9 | Y218 S219 K220 L221 E225 L226 E227 | Y218-L223 HydrophobicContact CD2-CD2 4.24Å; S219-L223 WeakPolarHBondContact O-CG 3.19Å; S219-L223 PolarHBondContact O-N 3.13Å; K220-L223 PolarHBondContact O-N 3.39Å; L221-L223 VanDerWaalsContact C-N 3.28Å; L221-L223 PolarHBondContact O-N 3.37Å; L223-E225 PolarHBondContact O-N 2.84Å; L223-L226 PolarHBondContact O-N 2.95Å; L223-E227 WeakPolarHBondContact O-CB 3.39Å; L223-E227 WeakPolarHBondContact O-CG 3.45Å; L223-E227 PolarHBondContact O-N 3.31Å |
| 224 | A | 98.4 | Very high | 97.2 | Very high | 59 Ų | 59 | 92.4 Ų | 92.4 | 49% | 0.488 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 180 | 0 | 0 | 0 | 0 | 0 | 112.4 | K220 L221 E227 G228 | K220-A224 WeakPolarHBondContact O-CB 3.41Å; K220-A224 PolarHBondContact O-N 3.03Å; L221-A224 PolarHBondContact O-N 2.88Å; A224-E227 PolarHBondContact O-N 2.97Å; A224-G228 PolarHBondContact O-N 3.23Å |
| 225 | E | 98.3 | Very high | 97.6 | Very high | 56 Ų | 56 | 88.8 Ų | 88.8 | 26% | 0.262 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -66.4 | -42.2 | 177.8 | -70.8 | -94.9 | -147.8 | 0 | 0 | 112.4 | L221 L223 E227 G228 E229 R247 L248 | L221-E225 HydrophobicContact CD1-CG 4.34Å; L221-E225 WeakPolarHBondContact O-CG 3.23Å; L221-E225 PolarHBondContact O-N 2.91Å; L221-E225 VanDerWaalsContact O-N 3.08Å; L223-E225 PolarHBondContact O-N 2.84Å; E225-E227 VanDerWaalsContact C-N 3.34Å; E225-G228 PolarHBondContact O-N 2.75Å; E225-E229 PolarHBondContact O-N 3.41Å; E225-E229 VanDerWaalsContact O-N 3.12Å; E225-R247 IonicContact OE1-CZ 2.79Å; E225-R247 IonicContact OE1-NH2 3.51Å; E225-R247 PolarHBondContact OE1-NH2 3.15Å; E225-R247 IonicContact OE2-CZ 3.32Å; E225-R247 IonicContact OE2-NH1 3.14Å; E225-R247 IonicContact OE2-NH2 3.72Å; E225-R247 PolarHBondContact OE2-NH2 3.3Å; E225-L248 HydrophobicContact CB-CD1 4Å; E225-L248 HydrophobicContact CB-CD2 3.67Å; E225-L248 HydrophobicContact CB-CG 4.41Å; E225-L248 HydrophobicContact CG-CD2 3.81Å |
| 226 | L | 98.6 | Very high | 97.8 | Very high | 0 Ų | 0 | 79.7 Ų | 79.7 | 0% | 0 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -66.4 | -35.3 | 175.4 | -71 | 167.6 | 0 | 0 | 0 | 112.3 | Q222 L223 F230 L244 L248 L250 V255 W258 F259 | Q222-L226 WeakPolarHBondContact O-CB 3.39Å; Q222-L226 VanDerWaalsContact O-CD1 3.29Å; Q222-L226 WeakPolarHBondContact O-CD1 3.44Å; Q222-L226 WeakPolarHBondContact O-CG 3.41Å; Q222-L226 PolarHBondContact O-N 2.81Å; L223-L226 PolarHBondContact O-N 2.95Å; L226-F230 WeakPolarHBondContact O-CB 3.15Å; L226-F230 PolarHBondContact O-N 2.9Å; L226-F230 VanDerWaalsContact O-N 3.08Å; L226-L244 HydrophobicContact CD2-CD1 4.17Å; L226-L248 HydrophobicContact CD1-CD1 4.3Å; L226-L248 HydrophobicContact CD2-CD1 3.93Å; L226-L248 HydrophobicContact CG-CD1 3.68Å; L226-L250 HydrophobicContact CD1-CD1 4.09Å; L226-V255 HydrophobicContact CD2-CG1 4.08Å; L226-W258 VanDerWaalsContact C-CH2 3.45Å; L226-W258 HydrophobicContact CB-CD2 3.9Å; L226-W258 HydrophobicContact CB-CE3 3.89Å; L226-W258 HydrophobicContact CB-CH2 3.68Å; L226-W258 HydrophobicContact CB-CZ2 3.66Å; L226-W258 HydrophobicContact CB-CZ3 3.79Å; L226-W258 HydrophobicContact CD1-CB 4.47Å; L226-W258 HydrophobicContact CD1-CD2 3.9Å; L226-W258 HydrophobicContact CD1-CG 3.82Å; L226-W258 HydrophobicContact CD2-CD2 4.44Å; L226-W258 HydrophobicContact CD2-CE3 4.31Å; L226-W258 HydrophobicContact CG-CD2 4.3Å; L226-W258 HydrophobicContact CG-CE3 4.47Å; L226-W258 VanDerWaalsContact O-CH2 3.3Å; L226-W258 WeakPolarHBondContact O-CH2 3.38Å; L226-W258 VanDerWaalsContact O-CZ3 3.29Å; L226-W258 WeakPolarHBondContact O-CZ3 3.41Å; L226-F259 HydrophobicContact CD2-CE2 4.04Å |
| 227 | E | 98.6 | Very high | 98.1 | Very high | 77 Ų | 77 | 74.4 Ų | 74.4 | 36% | 0.36 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -74.4 | -37.8 | 175.7 | -71.8 | -171 | 152.7 | 0 | 0 | 112.4 | L223 A224 E225 F230 M231 W258 R262 | L223-E227 WeakPolarHBondContact O-CB 3.39Å; L223-E227 WeakPolarHBondContact O-CG 3.45Å; L223-E227 PolarHBondContact O-N 3.31Å; A224-E227 PolarHBondContact O-N 2.97Å; E225-E227 VanDerWaalsContact C-N 3.34Å; E227-F230 PolarHBondContact O-N 3.36Å; E227-M231 WeakPolarHBondContact O-CG 3.29Å; E227-M231 PolarHBondContact O-N 2.9Å; E227-W258 HydrophobicContact CB-CH2 4.49Å; E227-W258 HydrophobicContact CG-CH2 3.69Å; E227-W258 HydrophobicContact CG-CZ2 3.67Å; E227-R262 IonicContact OE1-NE 3.72Å |
| 228 | G | 98.1 | Very high | 98.1 | Very high | 26 Ų | 26 | 77.1 Ų | 77.1 | 27% | 0.268 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -55.3 | -52.1 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A224 E225 F230 M231 L232 | A224-G228 PolarHBondContact O-N 3.23Å; E225-G228 PolarHBondContact O-N 2.75Å; G228-F230 VanDerWaalsContact C-N 3.32Å; G228-F230 PolarHBondContact O-N 3.27Å; G228-M231 PolarHBondContact O-N 3.2Å; G228-L232 PolarHBondContact O-N 3.44Å |
| 229 | E | 98.3 | Very high | 98.1 | Very high | 23 Ų | 23 | 78.5 Ų | 78.5 | 11% | 0.107 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -64.2 | -35.1 | 176.3 | -73.2 | -71.3 | 135.4 | 0 | 0 | 113.3 | E225 M231 L232 N233 R240 L244 F259 | E225-E229 PolarHBondContact O-N 3.41Å; E225-E229 VanDerWaalsContact O-N 3.12Å; E229-M231 VanDerWaalsContact C-N 3.3Å; E229-M231 PolarHBondContact O-N 3.13Å; E229-L232 PolarHBondContact O-N 3Å; E229-N233 PolarHBondContact O-N 3.22Å; E229-R240 IonicContact OE1-CZ 3.87Å; E229-R240 VanDerWaalsContact OE1-CZ 3.32Å; E229-R240 IonicContact OE1-NE 3.76Å; E229-R240 PolarHBondContact OE1-NE 3.14Å; E229-R240 VanDerWaalsContact OE1-NE 3.14Å; E229-R240 IonicContact OE1-NH2 2.76Å; E229-R240 PolarHBondContact OE1-NH2 3.34Å; E229-R240 WeakPolarHBondContact OE2-CG 3.33Å; E229-R240 IonicContact OE2-CZ 3.79Å; E229-R240 IonicContact OE2-NE 2.67Å; E229-R240 PolarHBondContact OE2-NE 3.15Å; E229-R240 IonicContact OE2-NH2 3.68Å; E229-L244 HydrophobicContact CB-CD1 3.93Å; E229-L244 HydrophobicContact CG-CD1 3.66Å; E229-L244 HydrophobicContact CG-CD2 3.95Å; E229-L244 HydrophobicContact CG-CG 4.18Å; E229-F259 HydrophobicContact CB-CZ 4.03Å |
| 230 | F | 98.5 | Very high | 98.1 | Very high | 9 Ų | 9 | 79.8 Ų | 79.8 | 4% | 0.039 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.9 | -32 | 176 | -173.8 | -96.8 | 0 | 0 | 0 | 113 | L226 E227 G228 N233 E234 W258 F259 R262 R263 K266 | L226-F230 WeakPolarHBondContact O-CB 3.15Å; L226-F230 PolarHBondContact O-N 2.9Å; L226-F230 VanDerWaalsContact O-N 3.08Å; E227-F230 PolarHBondContact O-N 3.36Å; G228-F230 VanDerWaalsContact C-N 3.32Å; G228-F230 PolarHBondContact O-N 3.27Å; F230-N233 CarbonylContact O-C 3.59Å; F230-E234 HydrophobicContact CD2-CB 4.38Å; F230-E234 HydrophobicContact CE1-CG 4.19Å; F230-E234 HydrophobicContact CE2-CB 3.65Å; F230-E234 HydrophobicContact CE2-CG 3.97Å; F230-E234 HydrophobicContact CZ-CB 3.87Å; F230-E234 HydrophobicContact CZ-CG 3.68Å; F230-W258 HydrophobicContact CB-CH2 4.2Å; F230-W258 HydrophobicContact CB-CZ3 4.05Å; F230-W258 HydrophobicContact CD2-CZ3 4.46Å; F230-W258 HydrophobicContact CG-CZ3 4.44Å; F230-F259 HydrophobicContact CB-CE1 4.25Å; F230-F259 AromaticContact CD2-CD1 3.96Å; F230-F259 HydrophobicContact CD2-CD1 3.96Å; F230-F259 AromaticContact CD2-CE1 3.95Å; F230-F259 HydrophobicContact CD2-CE1 3.95Å; F230-R262 HydrophobicContact CB-CG 4.38Å; F230-R262 HydrophobicContact CD1-CG 3.71Å; F230-R262 HydrophobicContact CD2-CB 4.19Å; F230-R262 HydrophobicContact CD2-CG 3.59Å; F230-R262 HydrophobicContact CE1-CG 3.88Å; F230-R262 HydrophobicContact CE2-CB 4.23Å; F230-R262 HydrophobicContact CE2-CG 3.77Å; F230-R262 HydrophobicContact CG-CG 3.58Å; F230-R262 HydrophobicContact CZ-CG 3.91Å; F230-R263 HydrophobicContact CE2-CG 3.6Å; F230-R263 HydrophobicContact CZ-CG 3.97Å; F230-K266 HydrophobicContact CE1-CD 4.48Å |
| 231 | M | 98 | Very high | 98.1 | Very high | 156 Ų | 156 | 73 Ų | 73 | 77% | 0.768 | 36% | 0.362 | S | S | * | . | H | α-helix | trans | -71.2 | -34.8 | 174 | -69.6 | -175.5 | -65.7 | 0 | 0 | 112.2 | E227 G228 E229 | E227-M231 WeakPolarHBondContact O-CG 3.29Å; E227-M231 PolarHBondContact O-N 2.9Å; G228-M231 PolarHBondContact O-N 3.2Å; E229-M231 VanDerWaalsContact C-N 3.3Å; E229-M231 PolarHBondContact O-N 3.13Å |
| 232 | L | 97.4 | Very high | 98.2 | Very high | 139 Ų | 139 | 72.2 Ų | 72.2 | 73% | 0.728 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -70.6 | -42.3 | 173.7 | -62.9 | 176.4 | 0 | 0 | 0 | 112 | G228 E229 | G228-L232 PolarHBondContact O-N 3.44Å; E229-L232 PolarHBondContact O-N 3Å |
| 233 | N | 96.8 | Very high | 98.1 | Very high | 76 Ų | 76 | 73.6 Ų | 73.6 | 41% | 0.406 | 36% | 0.357 | S | S | . | . | trans | -156.6 | 120.7 | 179.4 | -179.3 | 1 | 0 | 0 | 0 | 111.9 | E229 F230 F235 | E229-N233 PolarHBondContact O-N 3.22Å; F230-N233 CarbonylContact O-C 3.59Å; N233-F235 PolarHBondContact ND2-O 2.84Å; N233-F235 PolarHBondContact O-N 3.08Å; N233-F235 VanDerWaalsContact O-N 3.13Å; N233-F235 PolarHBondContact OD1-N 3.38Å; N233-F235 PolarHBondContact OD1-O 2.86Å | ||
| 234 | E | 97.7 | Very high | 98.1 | Very high | 59 Ų | 59 | 70.5 Ų | 70.5 | 28% | 0.276 | 34% | 0.341 | S | S | . | . | S | Bend | trans | -66.3 | -15.9 | 179.1 | -55.5 | -160 | 143 | 0 | 0 | 114.4 | F230 R263 K266 | F230-E234 HydrophobicContact CD2-CB 4.38Å; F230-E234 HydrophobicContact CE1-CG 4.19Å; F230-E234 HydrophobicContact CE2-CB 3.65Å; F230-E234 HydrophobicContact CE2-CG 3.97Å; F230-E234 HydrophobicContact CZ-CB 3.87Å; F230-E234 HydrophobicContact CZ-CG 3.68Å; E234-R263 HydrophobicContact CB-CG 4.43Å; E234-R263 WeakPolarHBondContact O-CD 3.38Å; E234-K266 WeakPolarHBondContact OE1-CD 3.37Å; E234-K266 WeakPolarHBondContact OE1-CE 3.35Å; E234-K266 IonicContact OE1-NZ 2.68Å; E234-K266 PolarHBondContact OE1-NZ 2.95Å |
| 235 | F | 98.2 | Very high | 98.1 | Very high | 123 Ų | 123 | 68 Ų | 68 | 54% | 0.539 | 32% | 0.32 | S | S | . | . | S | Bend | trans | -123.1 | 93.8 | -174.8 | -68.9 | -104.4 | 0 | 0 | 0 | 111.8 | N233 T237 | N233-F235 PolarHBondContact ND2-O 2.84Å; N233-F235 PolarHBondContact O-N 3.08Å; N233-F235 VanDerWaalsContact O-N 3.13Å; N233-F235 PolarHBondContact OD1-N 3.38Å; N233-F235 PolarHBondContact OD1-O 2.86Å; F235-T237 PolarHBondContact O-N 3.33Å |
| 236 | I | 97.9 | Very high | 98.1 | Very high | 25 Ų | 25 | 71.1 Ų | 71.1 | 13% | 0.128 | 34% | 0.338 | C | S | . | . | trans | -66.6 | 126.1 | -177.3 | -162.5 | 167.6 | 0 | 0 | 0 | 114.2 | R240 R241 L244 V255 F259 | I236-R240 HydrophobicContact CD1-CB 4.46Å; I236-R240 HydrophobicContact CD1-CG 4.36Å; I236-R240 HydrophobicContact CG1-CB 4.03Å; I236-R240 HydrophobicContact CG1-CG 4.28Å; I236-R241 VanDerWaalsContact CD1-CA 3.49Å; I236-R241 HydrophobicContact CD1-CB 3.96Å; I236-R241 HydrophobicContact CD1-CG 4.44Å; I236-R241 HydrophobicContact CG1-CB 4.07Å; I236-R241 HydrophobicContact CG2-CB 4.41Å; I236-R241 HydrophobicContact CG2-CG 4.49Å; I236-L244 HydrophobicContact CD1-CD1 3.42Å; I236-L244 VanDerWaalsContact CD1-CD1 3.42Å; I236-L244 HydrophobicContact CD1-CG 4.38Å; I236-V255 HydrophobicContact CD1-CG1 3.86Å; I236-F259 HydrophobicContact CB-CD1 3.9Å; I236-F259 HydrophobicContact CB-CD2 4.18Å; I236-F259 HydrophobicContact CB-CE1 3.83Å; I236-F259 HydrophobicContact CB-CE2 4.13Å; I236-F259 HydrophobicContact CB-CG 4.08Å; I236-F259 HydrophobicContact CB-CZ 3.96Å; I236-F259 HydrophobicContact CD1-CD2 4.24Å; I236-F259 HydrophobicContact CD1-CE2 3.67Å; I236-F259 HydrophobicContact CD1-CZ 3.88Å; I236-F259 HydrophobicContact CG1-CE2 4.48Å; I236-F259 HydrophobicContact CG1-CZ 4.37Å; I236-F259 HydrophobicContact CG2-CB 4.18Å; I236-F259 HydrophobicContact CG2-CD1 4.03Å; I236-F259 HydrophobicContact CG2-CD2 3.86Å; I236-F259 HydrophobicContact CG2-CE1 4.42Å; I236-F259 HydrophobicContact CG2-CE2 4.28Å; I236-F259 HydrophobicContact CG2-CG 3.74Å | ||
| 237 | T | 98.4 | Very high | 98.1 | Very high | 77 Ų | 77 | 77 Ų | 77 | 47% | 0.472 | 36% | 0.36 | S | S | . | . | trans | -67.3 | 166.8 | 176 | 70.1 | 0 | 0 | 0 | 0 | 111.6 | F235 Q239 R240 R241 | F235-T237 PolarHBondContact O-N 3.33Å; T237-Q239 VanDerWaalsContact C-N 3.3Å; T237-Q239 PolarHBondContact O-N 3.36Å; T237-R240 PolarHBondContact OG1-N 3.38Å; T237-R241 VanDerWaalsContact O-CB 3.24Å; T237-R241 WeakPolarHBondContact O-CB 3.37Å; T237-R241 PolarHBondContact O-N 3Å | ||
| 238 | R | 98.1 | Very high | 98 | Very high | 179 Ų | 179 | 73.8 Ų | 73.8 | 68% | 0.675 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -62.3 | -39.1 | 175.5 | -178.8 | -179.2 | 177.4 | -169.1 | -0.7 | 111.9 | ||
| 239 | Q | 98.1 | Very high | 98 | Very high | 95 Ų | 95 | 79.6 Ų | 79.6 | 44% | 0.444 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -69 | -55.5 | -177.2 | 179.3 | 55.4 | 22.5 | 0 | 0 | 111.1 | T237 R241 R242 E243 | T237-Q239 VanDerWaalsContact C-N 3.3Å; T237-Q239 PolarHBondContact O-N 3.36Å; Q239-R241 PolarHBondContact O-N 3.35Å; Q239-R242 PolarHBondContact O-N 3.26Å; Q239-E243 VanDerWaalsContact CG-OE1 3.3Å; Q239-E243 WeakPolarHBondContact CG-OE1 3.22Å; Q239-E243 PolarHBondContact NE2-OE1 3.1Å; Q239-E243 PolarHBondContact O-N 3.01Å |
| 240 | R | 98.1 | Very high | 98 | Very high | 82 Ų | 82 | 79.4 Ų | 79.4 | 31% | 0.309 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -62.1 | -29.5 | -178 | -167.8 | 52.4 | 167.7 | -176.7 | -1.3 | 113.3 | E229 I236 T237 E243 L244 | E229-R240 IonicContact OE1-CZ 3.87Å; E229-R240 VanDerWaalsContact OE1-CZ 3.32Å; E229-R240 IonicContact OE1-NE 3.76Å; E229-R240 PolarHBondContact OE1-NE 3.14Å; E229-R240 VanDerWaalsContact OE1-NE 3.14Å; E229-R240 IonicContact OE1-NH2 2.76Å; E229-R240 PolarHBondContact OE1-NH2 3.34Å; E229-R240 WeakPolarHBondContact OE2-CG 3.33Å; E229-R240 IonicContact OE2-CZ 3.79Å; E229-R240 IonicContact OE2-NE 2.67Å; E229-R240 PolarHBondContact OE2-NE 3.15Å; E229-R240 IonicContact OE2-NH2 3.68Å; I236-R240 HydrophobicContact CD1-CB 4.46Å; I236-R240 HydrophobicContact CD1-CG 4.36Å; I236-R240 HydrophobicContact CG1-CB 4.03Å; I236-R240 HydrophobicContact CG1-CG 4.28Å; T237-R240 PolarHBondContact OG1-N 3.38Å; R240-E243 WeakPolarHBondContact CD-OE2 3.29Å; R240-E243 IonicContact CZ-OE2 2.71Å; R240-E243 IonicContact NE-OE2 2.62Å; R240-E243 IonicContact NH1-OE2 3.14Å; R240-E243 PolarHBondContact NH1-OE2 3.44Å; R240-E243 PolarHBondContact O-N 3.39Å; R240-L244 PolarHBondContact O-N 2.79Å |
| 241 | R | 98.6 | Very high | 98 | Very high | 54 Ų | 54 | 81.3 Ų | 81.3 | 20% | 0.204 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -63 | -41.8 | 174.4 | -169.3 | -166.6 | -46.8 | 150.5 | 11 | 113 | I236 T237 Q239 L244 S245 D252 V255 | I236-R241 VanDerWaalsContact CD1-CA 3.49Å; I236-R241 HydrophobicContact CD1-CB 3.96Å; I236-R241 HydrophobicContact CD1-CG 4.44Å; I236-R241 HydrophobicContact CG1-CB 4.07Å; I236-R241 HydrophobicContact CG2-CB 4.41Å; I236-R241 HydrophobicContact CG2-CG 4.49Å; T237-R241 VanDerWaalsContact O-CB 3.24Å; T237-R241 WeakPolarHBondContact O-CB 3.37Å; T237-R241 PolarHBondContact O-N 3Å; Q239-R241 PolarHBondContact O-N 3.35Å; R241-L244 PolarHBondContact O-N 2.77Å; R241-S245 WeakPolarHBondContact O-CB 3.34Å; R241-S245 PolarHBondContact O-N 2.93Å; R241-D252 WeakPolarHBondContact CD-O 3.09Å; R241-V255 HydrophobicContact CG-CB 3.96Å; R241-V255 HydrophobicContact CG-CG1 3.82Å |
| 242 | R | 98.4 | Very high | 98 | Very high | 103 Ų | 103 | 76.5 Ų | 76.5 | 39% | 0.389 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -65.3 | -47.8 | 176.9 | -70.1 | -173.5 | -69 | -180 | 0.7 | 110.4 | Q239 L244 S245 D246 | Q239-R242 PolarHBondContact O-N 3.26Å; R242-L244 VanDerWaalsContact C-N 3.3Å; R242-L244 PolarHBondContact O-N 3.14Å; R242-S245 WeakPolarHBondContact O-CA 3.36Å; R242-S245 WeakPolarHBondContact O-CB 3.4Å; R242-S245 PolarHBondContact O-N 2.62Å; R242-D246 VanDerWaalsContact O-CG 3.28Å; R242-D246 PolarHBondContact O-N 2.68Å |
| 243 | E | 98.3 | Very high | 98 | Very high | 63 Ų | 63 | 76.2 Ų | 76.2 | 29% | 0.294 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -55.7 | -41.5 | 176.5 | -65.5 | 164.3 | -165.2 | 0 | 0 | 112.9 | Q239 R240 R247 | Q239-E243 VanDerWaalsContact CG-OE1 3.3Å; Q239-E243 WeakPolarHBondContact CG-OE1 3.22Å; Q239-E243 PolarHBondContact NE2-OE1 3.1Å; Q239-E243 PolarHBondContact O-N 3.01Å; R240-E243 WeakPolarHBondContact CD-OE2 3.29Å; R240-E243 IonicContact CZ-OE2 2.71Å; R240-E243 IonicContact NE-OE2 2.62Å; R240-E243 IonicContact NH1-OE2 3.14Å; R240-E243 PolarHBondContact NH1-OE2 3.44Å; R240-E243 PolarHBondContact O-N 3.39Å; E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 VanDerWaalsContact O-CG 3.27Å; E243-R247 WeakPolarHBondContact O-CG 3.39Å; E243-R247 PolarHBondContact O-N 3.33Å |
| 244 | L | 97.9 | Very high | 98 | Very high | 0 Ų | 0 | 76.1 Ų | 76.1 | 0% | 0 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -71.3 | -34.8 | 172.1 | -78.1 | -179.5 | 0 | 0 | 0 | 113.5 | L226 E229 I236 R240 R241 R242 D246 L248 V255 F259 | L226-L244 HydrophobicContact CD2-CD1 4.17Å; E229-L244 HydrophobicContact CB-CD1 3.93Å; E229-L244 HydrophobicContact CG-CD1 3.66Å; E229-L244 HydrophobicContact CG-CD2 3.95Å; E229-L244 HydrophobicContact CG-CG 4.18Å; I236-L244 HydrophobicContact CD1-CD1 3.42Å; I236-L244 VanDerWaalsContact CD1-CD1 3.42Å; I236-L244 HydrophobicContact CD1-CG 4.38Å; R240-L244 PolarHBondContact O-N 2.79Å; R241-L244 PolarHBondContact O-N 2.77Å; R242-L244 VanDerWaalsContact C-N 3.3Å; R242-L244 PolarHBondContact O-N 3.14Å; L244-D246 VanDerWaalsContact C-N 3.33Å; L244-L248 HydrophobicContact CD2-CD1 4.15Å; L244-L248 HydrophobicContact CD2-CG 4.46Å; L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 VanDerWaalsContact O-CG 3.28Å; L244-L248 WeakPolarHBondContact O-CG 3.49Å; L244-L248 PolarHBondContact O-N 3.4Å; L244-V255 HydrophobicContact CB-CG1 4.35Å; L244-V255 HydrophobicContact CD1-CG1 4.38Å; L244-F259 HydrophobicContact CD1-CE2 4.2Å; L244-F259 HydrophobicContact CD1-CZ 4.49Å |
| 245 | S | 98.4 | Very high | 98.1 | Very high | 7 Ų | 7 | 73.3 Ų | 73.3 | 5% | 0.049 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -55.6 | -52.3 | 174.5 | -145.6 | 0 | 0 | 0 | 0 | 110.1 | R241 R242 N249 L250 S251 D252 | R241-S245 WeakPolarHBondContact O-CB 3.34Å; R241-S245 PolarHBondContact O-N 2.93Å; R242-S245 WeakPolarHBondContact O-CA 3.36Å; R242-S245 WeakPolarHBondContact O-CB 3.4Å; R242-S245 PolarHBondContact O-N 2.62Å; S245-N249 PolarHBondContact O-N 3.02Å; S245-L250 CarbonylContact C-O 3.6Å; S245-L250 PolarHBondContact O-N 2.83Å; S245-L250 VanDerWaalsContact O-O 3.11Å; S245-L250 PolarHBondContact OG-O 2.93Å; S245-S251 WeakPolarHBondContact OG-CA 3.33Å; S245-D252 PolarHBondContact OG-N 2.84Å; S245-D252 PolarHBondContact OG-OD1 2.97Å |
| 246 | D | 98.1 | Very high | 98.1 | Very high | 120 Ų | 120 | 72.3 Ų | 72.3 | 64% | 0.642 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -68.8 | -49.2 | -175.8 | -57.9 | -30.2 | 0 | 0 | 0 | 111 | R242 L244 L248 N249 | R242-D246 VanDerWaalsContact O-CG 3.28Å; R242-D246 PolarHBondContact O-N 2.68Å; L244-D246 VanDerWaalsContact C-N 3.33Å; D246-L248 VanDerWaalsContact C-N 3.32Å; D246-L248 PolarHBondContact O-N 2.93Å; D246-N249 PolarHBondContact O-N 3Å |
| 247 | R | 97.8 | Very high | 98.1 | Very high | 124 Ų | 124 | 73.9 Ų | 73.9 | 47% | 0.468 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -61 | -37.2 | 178.4 | -75.9 | 175.4 | 63.7 | -155.1 | -3.4 | 113.4 | E225 E243 | E225-R247 IonicContact OE1-CZ 2.79Å; E225-R247 IonicContact OE1-NH2 3.51Å; E225-R247 PolarHBondContact OE1-NH2 3.15Å; E225-R247 IonicContact OE2-CZ 3.32Å; E225-R247 IonicContact OE2-NH1 3.14Å; E225-R247 IonicContact OE2-NH2 3.72Å; E225-R247 PolarHBondContact OE2-NH2 3.3Å; E243-R247 WeakPolarHBondContact O-CB 3.44Å; E243-R247 VanDerWaalsContact O-CG 3.27Å; E243-R247 WeakPolarHBondContact O-CG 3.39Å; E243-R247 PolarHBondContact O-N 3.33Å |
| 248 | L | 97.6 | Very high | 98.1 | Very high | 10 Ų | 10 | 71.3 Ų | 71.3 | 5% | 0.052 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -97.9 | -1.5 | -173 | -57.9 | -174.8 | 0 | 0 | 0 | 114 | Q222 E225 L226 L244 D246 L250 | Q222-L248 HydrophobicContact CG-CB 4.27Å; Q222-L248 PolarHBondContact NE2-O 3.2Å; E225-L248 HydrophobicContact CB-CD1 4Å; E225-L248 HydrophobicContact CB-CD2 3.67Å; E225-L248 HydrophobicContact CB-CG 4.41Å; E225-L248 HydrophobicContact CG-CD2 3.81Å; L226-L248 HydrophobicContact CD1-CD1 4.3Å; L226-L248 HydrophobicContact CD2-CD1 3.93Å; L226-L248 HydrophobicContact CG-CD1 3.68Å; L244-L248 HydrophobicContact CD2-CD1 4.15Å; L244-L248 HydrophobicContact CD2-CG 4.46Å; L244-L248 WeakPolarHBondContact O-CB 3.3Å; L244-L248 VanDerWaalsContact O-CG 3.28Å; L244-L248 WeakPolarHBondContact O-CG 3.49Å; L244-L248 PolarHBondContact O-N 3.4Å; D246-L248 VanDerWaalsContact C-N 3.32Å; D246-L248 PolarHBondContact O-N 2.93Å; L248-L250 HydrophobicContact CB-CD1 4.12Å; L248-L250 HydrophobicContact CB-CG 4.02Å; L248-L250 HydrophobicContact CD1-CD1 4.44Å; L248-L250 PolarHBondContact O-N 3.31Å |
| 249 | N | 98 | Very high | 98.1 | Very high | 148 Ų | 148 | 63 Ų | 63 | 79% | 0.791 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.4 | 43.2 | -172.6 | -65.3 | -86.2 | 0 | 0 | 0 | 112.1 | S245 D246 | S245-N249 PolarHBondContact O-N 3.02Å; D246-N249 PolarHBondContact O-N 3Å |
| 250 | L | 97.4 | Very high | 98.2 | Very high | 19 Ų | 19 | 62.3 Ų | 62.3 | 10% | 0.099 | 29% | 0.292 | C | S | . | . | trans | -112.8 | 164.6 | 174.2 | -64.3 | -178 | 0 | 0 | 0 | 109.2 | Y218 L226 S245 L248 Q254 V255 | Y218-L250 HydrophobicContact CD1-CD1 4.22Å; Y218-L250 HydrophobicContact CD1-CD2 3.82Å; Y218-L250 HydrophobicContact CE1-CD1 4.11Å; Y218-L250 HydrophobicContact CE1-CD2 3.63Å; L226-L250 HydrophobicContact CD1-CD1 4.09Å; S245-L250 CarbonylContact C-O 3.6Å; S245-L250 PolarHBondContact O-N 2.83Å; S245-L250 VanDerWaalsContact O-O 3.11Å; S245-L250 PolarHBondContact OG-O 2.93Å; L248-L250 HydrophobicContact CB-CD1 4.12Å; L248-L250 HydrophobicContact CB-CG 4.02Å; L248-L250 HydrophobicContact CD1-CD1 4.44Å; L248-L250 PolarHBondContact O-N 3.31Å; L250-Q254 HydrophobicContact CB-CB 4.34Å; L250-V255 HydrophobicContact CB-CG2 4.12Å; L250-V255 HydrophobicContact CD1-CG2 4.5Å | ||
| 251 | S | 98.1 | Very high | 98.2 | Very high | 49 Ų | 49 | 62.7 Ų | 62.7 | 34% | 0.343 | 30% | 0.3 | S | S | . | . | trans | -86.7 | 152.6 | 168.7 | 74.4 | 0 | 0 | 0 | 0 | 112.5 | S245 Q253 Q254 V255 | S245-S251 WeakPolarHBondContact OG-CA 3.33Å; S251-Q253 PolarHBondContact O-N 3.39Å; S251-Q254 WeakPolarHBondContact O-CA 2.88Å; S251-Q254 WeakPolarHBondContact O-CB 3.4Å; S251-Q254 PolarHBondContact O-N 3.29Å; S251-Q254 WeakPolarHBondContact OG-CG 3.37Å; S251-Q254 PolarHBondContact OG-N 3.28Å; S251-Q254 PolarHBondContact OG-OE1 3.05Å; S251-V255 PolarHBondContact O-N 3.27Å | ||
| 252 | D | 98 | Very high | 98.2 | Very high | 55 Ų | 55 | 63 Ų | 63 | 29% | 0.294 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -46.2 | -38.9 | 171.4 | -100.4 | 57.4 | 0 | 0 | 0 | 112.1 | R241 S245 K256 | R241-D252 WeakPolarHBondContact CD-O 3.09Å; S245-D252 PolarHBondContact OG-N 2.84Å; S245-D252 PolarHBondContact OG-OD1 2.97Å; D252-K256 VanDerWaalsContact O-CB 3.23Å; D252-K256 WeakPolarHBondContact O-CB 3.37Å; D252-K256 PolarHBondContact O-N 2.97Å |
| 253 | Q | 97.8 | Very high | 98.2 | Very high | 132 Ų | 132 | 61.8 Ų | 61.8 | 62% | 0.617 | 30% | 0.296 | S | S | * | . | H | α-helix | trans | -68.8 | -41.2 | 177.3 | -173.2 | -176.1 | -7.1 | 0 | 0 | 111.9 | S251 K256 I257 | S251-Q253 PolarHBondContact O-N 3.39Å; Q253-K256 PolarHBondContact O-N 2.95Å; Q253-I257 HydrophobicContact CG-CD1 3.79Å; Q253-I257 HydrophobicContact CG-CG1 4.42Å; Q253-I257 WeakPolarHBondContact O-CB 3.48Å; Q253-I257 WeakPolarHBondContact O-CG1 3.41Å; Q253-I257 PolarHBondContact O-N 3.47Å |
| 254 | Q | 98 | Very high | 98.2 | Very high | 74 Ų | 74 | 63.6 Ų | 63.6 | 35% | 0.346 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -63.8 | -44.8 | 175.6 | -74.8 | 172.4 | -78.6 | 0 | 0 | 111.6 | L250 S251 I257 W258 | L250-Q254 HydrophobicContact CB-CB 4.34Å; S251-Q254 WeakPolarHBondContact O-CA 2.88Å; S251-Q254 WeakPolarHBondContact O-CB 3.4Å; S251-Q254 PolarHBondContact O-N 3.29Å; S251-Q254 WeakPolarHBondContact OG-CG 3.37Å; S251-Q254 PolarHBondContact OG-N 3.28Å; S251-Q254 PolarHBondContact OG-OE1 3.05Å; Q254-I257 PolarHBondContact O-N 3.13Å; Q254-W258 WeakPolarHBondContact O-CB 3.4Å; Q254-W258 PolarHBondContact O-N 3.18Å |
| 255 | V | 98.4 | Very high | 98.2 | Very high | 0 Ų | 0 | 69.3 Ų | 69.3 | 0% | 0 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.9 | -47.9 | 175.4 | -177.7 | 0 | 0 | 0 | 0 | 110.2 | L226 I236 R241 L244 L250 S251 I257 W258 F259 | L226-V255 HydrophobicContact CD2-CG1 4.08Å; I236-V255 HydrophobicContact CD1-CG1 3.86Å; R241-V255 HydrophobicContact CG-CB 3.96Å; R241-V255 HydrophobicContact CG-CG1 3.82Å; L244-V255 HydrophobicContact CB-CG1 4.35Å; L244-V255 HydrophobicContact CD1-CG1 4.38Å; L250-V255 HydrophobicContact CB-CG2 4.12Å; L250-V255 HydrophobicContact CD1-CG2 4.5Å; S251-V255 PolarHBondContact O-N 3.27Å; V255-I257 PolarHBondContact O-N 3.16Å; V255-W258 PolarHBondContact O-N 3.46Å; V255-F259 HydrophobicContact CG1-CD2 4.01Å; V255-F259 HydrophobicContact CG1-CE2 4.09Å; V255-F259 WeakPolarHBondContact O-CD2 3.24Å; V255-F259 PolarHBondContact O-N 2.79Å |
| 256 | K | 98.4 | Very high | 98.2 | Very high | 102 Ų | 102 | 72.6 Ų | 72.6 | 44% | 0.443 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -56.1 | -46.8 | 175.5 | -179.5 | -177.5 | 176.6 | -175.9 | 0 | 112.5 | D252 Q253 F259 Q260 | D252-K256 VanDerWaalsContact O-CB 3.23Å; D252-K256 WeakPolarHBondContact O-CB 3.37Å; D252-K256 PolarHBondContact O-N 2.97Å; Q253-K256 PolarHBondContact O-N 2.95Å; K256-F259 PolarHBondContact O-N 2.81Å; K256-Q260 WeakPolarHBondContact O-CG 3.47Å; K256-Q260 PolarHBondContact O-N 2.91Å; K256-Q260 VanDerWaalsContact O-N 3.11Å |
| 257 | I | 98.4 | Very high | 98.2 | Very high | 58 Ų | 58 | 73.8 Ų | 73.8 | 30% | 0.297 | 34% | 0.344 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 178.6 | -73 | 170.3 | 0 | 0 | 0 | 110.9 | Q253 Q254 V255 Q260 N261 | Q253-I257 HydrophobicContact CG-CD1 3.79Å; Q253-I257 HydrophobicContact CG-CG1 4.42Å; Q253-I257 WeakPolarHBondContact O-CB 3.48Å; Q253-I257 WeakPolarHBondContact O-CG1 3.41Å; Q253-I257 PolarHBondContact O-N 3.47Å; Q254-I257 PolarHBondContact O-N 3.13Å; V255-I257 PolarHBondContact O-N 3.16Å; I257-Q260 PolarHBondContact O-N 3.01Å; I257-N261 WeakPolarHBondContact CG2-ND2 3.46Å; I257-N261 WeakPolarHBondContact O-CB 3.44Å; I257-N261 VanDerWaalsContact O-CG 3.23Å; I257-N261 PolarHBondContact O-N 2.99Å; I257-N261 PolarHBondContact O-ND2 2.95Å; I257-N261 VanDerWaalsContact O-ND2 3.15Å |
| 258 | W | 98.5 | Very high | 98.2 | Very high | 23 Ų | 23 | 76.6 Ų | 76.6 | 9% | 0.087 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.8 | -48.2 | 176.6 | -171.9 | 103.2 | 0 | 0 | 0 | 111 | Y218 L226 E227 F230 Q254 V255 Q260 N261 R262 | Y218-W258 AromaticContact CD2-CD1 3.87Å; Y218-W258 AromaticContact CE2-CD1 3.7Å; L226-W258 VanDerWaalsContact C-CH2 3.45Å; L226-W258 HydrophobicContact CB-CD2 3.9Å; L226-W258 HydrophobicContact CB-CE3 3.89Å; L226-W258 HydrophobicContact CB-CH2 3.68Å; L226-W258 HydrophobicContact CB-CZ2 3.66Å; L226-W258 HydrophobicContact CB-CZ3 3.79Å; L226-W258 HydrophobicContact CD1-CB 4.47Å; L226-W258 HydrophobicContact CD1-CD2 3.9Å; L226-W258 HydrophobicContact CD1-CG 3.82Å; L226-W258 HydrophobicContact CD2-CD2 4.44Å; L226-W258 HydrophobicContact CD2-CE3 4.31Å; L226-W258 HydrophobicContact CG-CD2 4.3Å; L226-W258 HydrophobicContact CG-CE3 4.47Å; L226-W258 VanDerWaalsContact O-CH2 3.3Å; L226-W258 WeakPolarHBondContact O-CH2 3.38Å; L226-W258 VanDerWaalsContact O-CZ3 3.29Å; L226-W258 WeakPolarHBondContact O-CZ3 3.41Å; E227-W258 HydrophobicContact CB-CH2 4.49Å; E227-W258 HydrophobicContact CG-CH2 3.69Å; E227-W258 HydrophobicContact CG-CZ2 3.67Å; F230-W258 HydrophobicContact CB-CH2 4.2Å; F230-W258 HydrophobicContact CB-CZ3 4.05Å; F230-W258 HydrophobicContact CD2-CZ3 4.46Å; F230-W258 HydrophobicContact CG-CZ3 4.44Å; Q254-W258 WeakPolarHBondContact O-CB 3.4Å; Q254-W258 PolarHBondContact O-N 3.18Å; V255-W258 PolarHBondContact O-N 3.46Å; W258-Q260 VanDerWaalsContact C-N 3.31Å; W258-Q260 PolarHBondContact O-N 3.22Å; W258-N261 CarbonylContact O-C 3.54Å; W258-N261 PolarHBondContact O-N 3.45Å; W258-N261 VanDerWaalsContact O-N 3.14Å; W258-R262 HydrophobicContact CD2-CB 4.41Å; W258-R262 HydrophobicContact CE3-CB 3.93Å; W258-R262 HydrophobicContact CE3-CG 4.44Å; W258-R262 HydrophobicContact CH2-CB 3.91Å; W258-R262 HydrophobicContact CH2-CG 3.55Å; W258-R262 HydrophobicContact CZ2-CB 4.4Å; W258-R262 HydrophobicContact CZ2-CG 4.25Å; W258-R262 HydrophobicContact CZ3-CB 3.65Å; W258-R262 HydrophobicContact CZ3-CG 3.67Å; W258-R262 WeakPolarHBondContact O-CB 3.39Å; W258-R262 PolarHBondContact O-N 3.26Å |
| 259 | F | 98.8 | Very high | 98.1 | Very high | 4 Ų | 4 | 80.2 Ų | 80.2 | 2% | 0.018 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -62.8 | -33.9 | 177.1 | -90.5 | -98 | 0 | 0 | 0 | 113.3 | L226 E229 F230 I236 L244 V255 K256 R263 | L226-F259 HydrophobicContact CD2-CE2 4.04Å; E229-F259 HydrophobicContact CB-CZ 4.03Å; F230-F259 HydrophobicContact CB-CE1 4.25Å; F230-F259 AromaticContact CD2-CD1 3.96Å; F230-F259 HydrophobicContact CD2-CD1 3.96Å; F230-F259 AromaticContact CD2-CE1 3.95Å; F230-F259 HydrophobicContact CD2-CE1 3.95Å; I236-F259 HydrophobicContact CB-CD1 3.9Å; I236-F259 HydrophobicContact CB-CD2 4.18Å; I236-F259 HydrophobicContact CB-CE1 3.83Å; I236-F259 HydrophobicContact CB-CE2 4.13Å; I236-F259 HydrophobicContact CB-CG 4.08Å; I236-F259 HydrophobicContact CB-CZ 3.96Å; I236-F259 HydrophobicContact CD1-CD2 4.24Å; I236-F259 HydrophobicContact CD1-CE2 3.67Å; I236-F259 HydrophobicContact CD1-CZ 3.88Å; I236-F259 HydrophobicContact CG1-CE2 4.48Å; I236-F259 HydrophobicContact CG1-CZ 4.37Å; I236-F259 HydrophobicContact CG2-CB 4.18Å; I236-F259 HydrophobicContact CG2-CD1 4.03Å; I236-F259 HydrophobicContact CG2-CD2 3.86Å; I236-F259 HydrophobicContact CG2-CE1 4.42Å; I236-F259 HydrophobicContact CG2-CE2 4.28Å; I236-F259 HydrophobicContact CG2-CG 3.74Å; L244-F259 HydrophobicContact CD1-CE2 4.2Å; L244-F259 HydrophobicContact CD1-CZ 4.49Å; V255-F259 HydrophobicContact CG1-CD2 4.01Å; V255-F259 HydrophobicContact CG1-CE2 4.09Å; V255-F259 WeakPolarHBondContact O-CD2 3.24Å; V255-F259 PolarHBondContact O-N 2.79Å; K256-F259 PolarHBondContact O-N 2.81Å; F259-R263 PolarHBondContact O-N 3.02Å; F259-R263 PolarHBondContact O-NE 3.24Å |
| 260 | Q | 98.6 | Very high | 98 | Very high | 82 Ų | 82 | 78.1 Ų | 78.1 | 38% | 0.383 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.6 | -50.2 | 171.1 | -72.5 | 173 | -13.3 | 0 | 0 | 111.2 | K256 I257 W258 R262 R263 M264 | K256-Q260 WeakPolarHBondContact O-CG 3.47Å; K256-Q260 PolarHBondContact O-N 2.91Å; K256-Q260 VanDerWaalsContact O-N 3.11Å; I257-Q260 PolarHBondContact O-N 3.01Å; W258-Q260 VanDerWaalsContact C-N 3.31Å; W258-Q260 PolarHBondContact O-N 3.22Å; Q260-R262 VanDerWaalsContact C-N 3.33Å; Q260-R262 PolarHBondContact O-N 2.92Å; Q260-R263 PolarHBondContact O-N 3.23Å; Q260-M264 WeakPolarHBondContact O-CG 3.38Å; Q260-M264 PolarHBondContact O-N 3.24Å; Q260-M264 VanDerWaalsContact O-N 3.1Å |
| 261 | N | 98.4 | Very high | 97.8 | Very high | 90 Ų | 90 | 82.4 Ų | 82.4 | 48% | 0.481 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -62.6 | -37.6 | 178.5 | -68.1 | -30.6 | 0 | 0 | 0 | 112.4 | I257 W258 M264 K265 | I257-N261 WeakPolarHBondContact CG2-ND2 3.46Å; I257-N261 WeakPolarHBondContact O-CB 3.44Å; I257-N261 VanDerWaalsContact O-CG 3.23Å; I257-N261 PolarHBondContact O-N 2.99Å; I257-N261 PolarHBondContact O-ND2 2.95Å; I257-N261 VanDerWaalsContact O-ND2 3.15Å; W258-N261 CarbonylContact O-C 3.54Å; W258-N261 PolarHBondContact O-N 3.45Å; W258-N261 VanDerWaalsContact O-N 3.14Å; N261-M264 PolarHBondContact O-N 3.42Å; N261-K265 WeakPolarHBondContact O-CB 3.41Å; N261-K265 PolarHBondContact O-N 3.22Å |
| 262 | R | 98.6 | Very high | 97.6 | Very high | 59 Ų | 59 | 88.7 Ų | 88.7 | 22% | 0.223 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -66.7 | -40.6 | -179 | -175.2 | 63.5 | -176.6 | 76.8 | -2 | 112.4 | E227 F230 W258 Q260 K265 K266 | E227-R262 IonicContact OE1-NE 3.72Å; F230-R262 HydrophobicContact CB-CG 4.38Å; F230-R262 HydrophobicContact CD1-CG 3.71Å; F230-R262 HydrophobicContact CD2-CB 4.19Å; F230-R262 HydrophobicContact CD2-CG 3.59Å; F230-R262 HydrophobicContact CE1-CG 3.88Å; F230-R262 HydrophobicContact CE2-CB 4.23Å; F230-R262 HydrophobicContact CE2-CG 3.77Å; F230-R262 HydrophobicContact CG-CG 3.58Å; F230-R262 HydrophobicContact CZ-CG 3.91Å; W258-R262 HydrophobicContact CD2-CB 4.41Å; W258-R262 HydrophobicContact CE3-CB 3.93Å; W258-R262 HydrophobicContact CE3-CG 4.44Å; W258-R262 HydrophobicContact CH2-CB 3.91Å; W258-R262 HydrophobicContact CH2-CG 3.55Å; W258-R262 HydrophobicContact CZ2-CB 4.4Å; W258-R262 HydrophobicContact CZ2-CG 4.25Å; W258-R262 HydrophobicContact CZ3-CB 3.65Å; W258-R262 HydrophobicContact CZ3-CG 3.67Å; W258-R262 WeakPolarHBondContact O-CB 3.39Å; W258-R262 PolarHBondContact O-N 3.26Å; Q260-R262 VanDerWaalsContact C-N 3.33Å; Q260-R262 PolarHBondContact O-N 2.92Å; R262-K265 PolarHBondContact O-N 3.29Å; R262-K266 PolarHBondContact O-N 2.96Å |
| 263 | R | 98.6 | Very high | 97.4 | Very high | 79 Ų | 79 | 91.3 Ų | 91.3 | 30% | 0.298 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 171.4 | -72.5 | -175.7 | -72.4 | 142.4 | -1.2 | 111.9 | F230 E234 F259 Q260 K265 K266 K267 | F230-R263 HydrophobicContact CE2-CG 3.6Å; F230-R263 HydrophobicContact CZ-CG 3.97Å; E234-R263 HydrophobicContact CB-CG 4.43Å; E234-R263 WeakPolarHBondContact O-CD 3.38Å; F259-R263 PolarHBondContact O-N 3.02Å; F259-R263 PolarHBondContact O-NE 3.24Å; Q260-R263 PolarHBondContact O-N 3.23Å; R263-K265 VanDerWaalsContact C-N 3.3Å; R263-K265 PolarHBondContact O-N 3.36Å; R263-K266 PolarHBondContact O-N 3.43Å; R263-K267 PolarHBondContact O-N 2.99Å |
| 264 | M | 98.5 | Very high | 97.1 | Very high | 100 Ų | 100 | 90 Ų | 90 | 49% | 0.493 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.7 | -36.1 | 174.9 | -66.8 | -53.8 | -63.7 | 0 | 0 | 112.4 | Q260 N261 R268 | Q260-M264 WeakPolarHBondContact O-CG 3.38Å; Q260-M264 PolarHBondContact O-N 3.24Å; Q260-M264 VanDerWaalsContact O-N 3.1Å; N261-M264 PolarHBondContact O-N 3.42Å; M264-R268 WeakPolarHBondContact O-CB 3.41Å; M264-R268 VanDerWaalsContact O-CG 3.24Å; M264-R268 WeakPolarHBondContact O-CG 3.31Å; M264-R268 PolarHBondContact O-N 3.32Å |
| 265 | K | 98.1 | Very high | 96.8 | Very high | 121 Ų | 121 | 88.9 Ų | 88.9 | 53% | 0.526 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.8 | -45.6 | 172.4 | -172.8 | -176.9 | 176.1 | -170.1 | 0 | 111.5 | N261 R262 R263 R268 L269 | N261-K265 WeakPolarHBondContact O-CB 3.41Å; N261-K265 PolarHBondContact O-N 3.22Å; R262-K265 PolarHBondContact O-N 3.29Å; R263-K265 VanDerWaalsContact C-N 3.3Å; R263-K265 PolarHBondContact O-N 3.36Å; K265-R268 PolarHBondContact O-N 3.28Å; K265-L269 HydrophobicContact CG-CD1 4.33Å; K265-L269 PolarHBondContact O-N 3.14Å |
| 266 | K | 97.7 | Very high | 96.4 | Very high | 75 Ų | 75 | 93.8 Ų | 93.8 | 33% | 0.326 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58.9 | -51 | 175.6 | -176.3 | 176 | 174.7 | 176.2 | 0 | 111.5 | F230 E234 R262 R263 R268 L269 M270 | F230-K266 HydrophobicContact CE1-CD 4.48Å; E234-K266 WeakPolarHBondContact OE1-CD 3.37Å; E234-K266 WeakPolarHBondContact OE1-CE 3.35Å; E234-K266 IonicContact OE1-NZ 2.68Å; E234-K266 PolarHBondContact OE1-NZ 2.95Å; R262-K266 PolarHBondContact O-N 2.96Å; R263-K266 PolarHBondContact O-N 3.43Å; K266-R268 VanDerWaalsContact C-N 3.28Å; K266-R268 PolarHBondContact O-N 2.98Å; K266-L269 PolarHBondContact O-N 3.07Å; K266-L269 VanDerWaalsContact O-N 3.15Å; K266-M270 HydrophobicContact CG-SD 4.03Å; K266-M270 PolarHBondContact O-N 3.1Å |
| 267 | K | 98 | Very high | 95.9 | Very high | 145 Ų | 145 | 92.8 Ų | 92.8 | 63% | 0.63 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -57.8 | -39.5 | 177.7 | -175.2 | 174 | -178.6 | 175 | 0 | 112.5 | R263 L271 | R263-K267 PolarHBondContact O-N 2.99Å; K267-L271 WeakPolarHBondContact O-CB 3.1Å; K267-L271 PolarHBondContact O-N 2.92Å |
| 268 | R | 97.4 | Very high | 94.9 | Very high | 183 Ų | 183 | 98.6 Ų | 98.6 | 69% | 0.691 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -69.1 | -37.1 | 177 | -75.9 | 173.8 | 177.9 | -165.3 | -1.6 | 113.3 | M264 K265 K266 R272 | M264-R268 WeakPolarHBondContact O-CB 3.41Å; M264-R268 VanDerWaalsContact O-CG 3.24Å; M264-R268 WeakPolarHBondContact O-CG 3.31Å; M264-R268 PolarHBondContact O-N 3.32Å; K265-R268 PolarHBondContact O-N 3.28Å; K266-R268 VanDerWaalsContact C-N 3.28Å; K266-R268 PolarHBondContact O-N 2.98Å; R268-R272 WeakPolarHBondContact O-CB 3.35Å; R268-R272 PolarHBondContact O-N 3.21Å; R268-R272 VanDerWaalsContact O-N 3.13Å |
| 269 | L | 96.6 | Very high | 93.5 | Very high | 86 Ų | 86 | 109.1 Ų | 109.1 | 45% | 0.45 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.7 | -53.2 | 173.1 | -106.9 | 72.3 | 0 | 0 | 0 | 110.5 | K265 K266 L271 R272 E273 | K265-L269 HydrophobicContact CG-CD1 4.33Å; K265-L269 PolarHBondContact O-N 3.14Å; K266-L269 PolarHBondContact O-N 3.07Å; K266-L269 VanDerWaalsContact O-N 3.15Å; L269-L271 VanDerWaalsContact C-N 3.31Å; L269-L271 PolarHBondContact O-N 3.04Å; L269-R272 CarbonylContact O-C 3.46Å; L269-R272 WeakPolarHBondContact O-CA 3.38Å; L269-R272 WeakPolarHBondContact O-CB 3.36Å; L269-R272 PolarHBondContact O-N 2.92Å; L269-E273 WeakPolarHBondContact O-CG 3.37Å; L269-E273 PolarHBondContact O-N 2.83Å |
| 270 | M | 95 | Very high | 93.2 | Very high | 105 Ų | 105 | 114.4 Ų | 114.4 | 52% | 0.517 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -58.4 | -40.6 | -179.1 | -72 | 177.2 | 143.8 | 0 | 0 | 112.8 | K266 E273 Q274 | K266-M270 HydrophobicContact CG-SD 4.03Å; K266-M270 PolarHBondContact O-N 3.1Å; M270-E273 PolarHBondContact O-N 3.18Å; M270-Q274 VanDerWaalsContact O-CB 3.31Å; M270-Q274 WeakPolarHBondContact O-CB 3.49Å; M270-Q274 PolarHBondContact O-N 2.78Å |
| 271 | L | 94.5 | Very high | 92.9 | Very high | 108 Ų | 108 | 116.1 Ų | 116.1 | 57% | 0.565 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -67.5 | -34.4 | 175.4 | -176 | 62.9 | 0 | 0 | 0 | 112.6 | K267 L269 A275 | K267-L271 WeakPolarHBondContact O-CB 3.1Å; K267-L271 PolarHBondContact O-N 2.92Å; L269-L271 VanDerWaalsContact C-N 3.31Å; L269-L271 PolarHBondContact O-N 3.04Å; L271-A275 WeakPolarHBondContact O-CB 3.28Å; L271-A275 PolarHBondContact O-N 3.16Å |
| 272 | R | 94.4 | Very high | 92.6 | Very high | 182 Ų | 182 | 117.5 Ų | 117.5 | 69% | 0.687 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -70 | -44 | 175 | -179.8 | -177.2 | 176.9 | -177.9 | -1 | 111.4 | R268 L269 A275 L276 | R268-R272 WeakPolarHBondContact O-CB 3.35Å; R268-R272 PolarHBondContact O-N 3.21Å; R268-R272 VanDerWaalsContact O-N 3.13Å; L269-R272 CarbonylContact O-C 3.46Å; L269-R272 WeakPolarHBondContact O-CA 3.38Å; L269-R272 WeakPolarHBondContact O-CB 3.36Å; L269-R272 PolarHBondContact O-N 2.92Å; R272-A275 PolarHBondContact O-N 2.8Å; R272-L276 HydrophobicContact CG-CD1 4.24Å; R272-L276 WeakPolarHBondContact O-CG 3.49Å; R272-L276 PolarHBondContact O-N 3.5Å |
| 273 | E | 92.8 | Very high | 92.2 | Very high | 109 Ų | 109 | 120.9 Ų | 120.9 | 51% | 0.509 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -62 | -44.9 | 176.7 | -72.3 | 158.3 | -173.7 | 0 | 0 | 110.6 | L269 M270 A275 L276 A277 | L269-E273 WeakPolarHBondContact O-CG 3.37Å; L269-E273 PolarHBondContact O-N 2.83Å; M270-E273 PolarHBondContact O-N 3.18Å; E273-A275 PolarHBondContact O-N 3.17Å; E273-L276 PolarHBondContact O-N 2.99Å; E273-A277 PolarHBondContact O-N 3.42Å |
| 274 | Q | 91.6 | Very high | 91.8 | Very high | 105 Ų | 105 | 123.6 Ų | 123.6 | 49% | 0.491 | 58% | 0.58 | S | S | . | * | H | α-helix | trans | -58.7 | -44.5 | 172.3 | 179.8 | 173.3 | 36.8 | 0 | 0 | 112.2 | M270 L276 A277 Y278 | M270-Q274 VanDerWaalsContact O-CB 3.31Å; M270-Q274 WeakPolarHBondContact O-CB 3.49Å; M270-Q274 PolarHBondContact O-N 2.78Å; Q274-L276 VanDerWaalsContact C-N 3.3Å; Q274-L276 PolarHBondContact O-N 3.1Å; Q274-A277 PolarHBondContact O-N 2.99Å; Q274-Y278 HydrophobicContact CG-CD2 4.46Å; Q274-Y278 HydrophobicContact CG-CE2 3.77Å; Q274-Y278 WeakPolarHBondContact O-CD2 3.44Å |
| 275 | A | 90.8 | Very high | 91.4 | Very high | 51 Ų | 51 | 125.1 Ų | 125.1 | 42% | 0.421 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -65 | -32.4 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113 | L271 R272 E273 F279 | L271-A275 WeakPolarHBondContact O-CB 3.28Å; L271-A275 PolarHBondContact O-N 3.16Å; R272-A275 PolarHBondContact O-N 2.8Å; E273-A275 PolarHBondContact O-N 3.17Å; A275-F279 VanDerWaalsContact O-CD2 3.28Å; A275-F279 WeakPolarHBondContact O-CD2 3.11Å |
| 276 | L | 90.1 | Very high | 90.9 | Very high | 103 Ų | 103 | 125.4 Ų | 125.4 | 54% | 0.539 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -75.4 | -27.2 | 175.1 | -69.5 | 171 | 0 | 0 | 0 | 112.8 | R272 E273 Q274 Y278 F279 | R272-L276 HydrophobicContact CG-CD1 4.24Å; R272-L276 WeakPolarHBondContact O-CG 3.49Å; R272-L276 PolarHBondContact O-N 3.5Å; E273-L276 PolarHBondContact O-N 2.99Å; Q274-L276 VanDerWaalsContact C-N 3.3Å; Q274-L276 PolarHBondContact O-N 3.1Å; L276-Y278 PolarHBondContact O-N 3.04Å; L276-F279 PolarHBondContact O-N 3.39Å |
| 277 | A | 88.3 | Confident | 90.4 | Very high | 80 Ų | 80 | 129.3 Ų | 129.3 | 66% | 0.661 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.9 | -1.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | E273 Q274 | E273-A277 PolarHBondContact O-N 3.42Å; Q274-A277 PolarHBondContact O-N 2.99Å |
| 278 | Y | 77.6 | Confident | 89.8 | Confident | 181 Ų | 181 | 128 Ų | 128 | 71% | 0.71 | 61% | 0.609 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.6 | 7.6 | 174.8 | -69.5 | -68 | 0 | 0 | 0 | 113.6 | Q274 L276 | Q274-Y278 HydrophobicContact CG-CD2 4.46Å; Q274-Y278 HydrophobicContact CG-CE2 3.77Å; Q274-Y278 WeakPolarHBondContact O-CD2 3.44Å; L276-Y278 PolarHBondContact O-N 3.04Å |
| 279 | F | 68.4 | Low | 89.1 | Confident | 243 Ų | 243 | 123 Ų | 123 | 100% | 1.066 | 60% | 0.602 | S | S | * | * | trans | -121.3 | 0 | 175.3 | -68.6 | -77 | 0 | 0 | 0 | 110.8 | A275 L276 | A275-F279 VanDerWaalsContact O-CD2 3.28Å; A275-F279 WeakPolarHBondContact O-CD2 3.11Å; L276-F279 PolarHBondContact O-N 3.39Å |
Retrieved 279 of 279 residues in 106.9 ms
(Link to these results)