| 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 | 41.5 | Very low | 57.3 | Low | 238 Ų | 238 | 151.1 Ų | 151.1 | 100% | 1.172 | 69% | 0.691 | S | S | * | * | 0 | 76.9 | 0 | -164.7 | 177.7 | -166.8 | 0 | 0 | 109 | |||||
| 2 | F | 43.7 | Very low | 58 | Low | 206 Ų | 206 | 151.4 Ų | 151.4 | 90% | 0.904 | 69% | 0.69 | S | S | * | * | trans | -105.6 | 90.3 | -178.8 | -95.6 | -84.1 | 0 | 0 | 0 | 109.7 | ||||
| 3 | Q | 53.9 | Low | 58.3 | Low | 158 Ų | 158 | 145.3 Ų | 145.3 | 74% | 0.738 | 67% | 0.666 | S | S | * | * | trans | -98.9 | 86.2 | 163.2 | -95.1 | -158.5 | 79.9 | 0 | 0 | 109 | K5 | Q3-K5 PolarHBondContact O-N 3.01Š| ||
| 4 | R | 55.8 | Low | 58.7 | Low | 240 Ų | 240 | 140.3 Ų | 140.3 | 91% | 0.906 | 66% | 0.656 | S | S | * | * | trans | -67.4 | 88.8 | 155.5 | -93 | -172.1 | 178.9 | -176 | 1.2 | 107 | S6 | R4-S6 PolarHBondContact O-N 2.91Š| ||
| 5 | K | 57 | Low | 59 | Low | 138 Ų | 138 | 139.1 Ų | 139.1 | 60% | 0.6 | 65% | 0.654 | S | S | * | * | trans | -70.7 | 82.8 | 173.6 | -123.7 | -169.9 | -169.2 | 175.6 | 0 | 108.4 | Q3 Q7 | Q3-K5 PolarHBondContact O-N 3.01Å; K5-Q7 PolarHBondContact O-N 3.16Å; K5-Q7 PolarHBondContact O-NE2 2.86Å; K5-Q7 VanDerWaalsContact O-NE2 3.16Å | ||
| 6 | S | 58.3 | Low | 59 | Low | 55 Ų | 55 | 134.9 Ų | 134.9 | 39% | 0.385 | 64% | 0.641 | S | S | . | * | trans | -59.6 | 109.8 | 175.4 | -172.6 | 0 | 0 | 0 | 0 | 108.6 | R4 N8 I9 K10 | R4-S6 PolarHBondContact O-N 2.91Å; S6-N8 PolarHBondContact O-N 3.44Å; S6-I9 WeakPolarHBondContact O-CB 3.44Å; S6-I9 PolarHBondContact O-N 3.23Å; S6-I9 VanDerWaalsContact O-N 3.1Å; S6-K10 PolarHBondContact O-N 3.1Å | ||
| 7 | Q | 63.9 | Low | 58.5 | Low | 123 Ų | 123 | 134.8 Ų | 134.8 | 58% | 0.575 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -59.6 | -31 | -177.2 | -64.2 | -60.5 | -77.2 | 0 | 0 | 111.3 | K5 I9 K10 Y11 | K5-Q7 PolarHBondContact O-N 3.16Å; K5-Q7 PolarHBondContact O-NE2 2.86Å; K5-Q7 VanDerWaalsContact O-NE2 3.16Å; Q7-I9 VanDerWaalsContact C-N 3.35Å; Q7-I9 PolarHBondContact O-N 3.35Å; Q7-K10 WeakPolarHBondContact O-CB 3.27Å; Q7-K10 PolarHBondContact O-N 2.9Å; Q7-K10 VanDerWaalsContact O-N 3.14Å; Q7-Y11 WeakPolarHBondContact O-CB 2.92Å; Q7-Y11 PolarHBondContact O-N 3.16Å |
| 8 | N | 63.8 | Low | 58.4 | Low | 113 Ų | 113 | 128.6 Ų | 128.6 | 60% | 0.604 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -59.1 | -46.1 | 175.9 | -61.9 | -18 | 0 | 0 | 0 | 111.1 | S6 K10 Y11 F12 | S6-N8 PolarHBondContact O-N 3.44Å; N8-K10 VanDerWaalsContact C-N 3.31Å; N8-K10 PolarHBondContact O-N 3.38Å; N8-Y11 PolarHBondContact O-N 3.14Å; N8-Y11 VanDerWaalsContact O-N 3.16Å; N8-F12 VanDerWaalsContact O-CD2 3.27Å; N8-F12 WeakPolarHBondContact O-CD2 3.3Å; N8-F12 PolarHBondContact O-N 2.91Å |
| 9 | I | 63.5 | Low | 58.3 | Low | 104 Ų | 104 | 130.5 Ų | 130.5 | 53% | 0.533 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -60 | -44.8 | 176.8 | -60.5 | 176.9 | 0 | 0 | 0 | 109.6 | S6 Q7 Y11 L13 | S6-I9 WeakPolarHBondContact O-CB 3.44Å; S6-I9 PolarHBondContact O-N 3.23Å; S6-I9 VanDerWaalsContact O-N 3.1Å; Q7-I9 VanDerWaalsContact C-N 3.35Å; Q7-I9 PolarHBondContact O-N 3.35Å; I9-Y11 VanDerWaalsContact C-N 3.32Å; I9-Y11 PolarHBondContact O-N 3.38Å; I9-L13 HydrophobicContact CG2-CD1 3.52Å; I9-L13 VanDerWaalsContact O-CB 3.3Å; I9-L13 WeakPolarHBondContact O-CB 3.48Å; I9-L13 WeakPolarHBondContact O-CD1 3.5Å; I9-L13 PolarHBondContact O-N 3.39Å |
| 10 | K | 63.4 | Low | 58.1 | Low | 127 Ų | 127 | 136.5 Ų | 136.5 | 55% | 0.552 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -63.4 | -36.3 | 178.2 | -163.1 | -177.8 | 175.6 | -161.2 | 0 | 112.7 | S6 Q7 N8 L13 S14 | S6-K10 PolarHBondContact O-N 3.1Å; Q7-K10 WeakPolarHBondContact O-CB 3.27Å; Q7-K10 PolarHBondContact O-N 2.9Å; Q7-K10 VanDerWaalsContact O-N 3.14Å; N8-K10 VanDerWaalsContact C-N 3.31Å; N8-K10 PolarHBondContact O-N 3.38Å; K10-L13 PolarHBondContact O-N 3.47Å; K10-S14 WeakPolarHBondContact O-CB 3.46Å; K10-S14 PolarHBondContact O-N 3.03Å; K10-S14 PolarHBondContact O-OG 3Å |
| 11 | Y | 65.6 | Low | 58.1 | Low | 160 Ų | 160 | 141 Ų | 141 | 63% | 0.627 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -71.2 | -46.6 | 179.4 | -164.3 | -96 | 0 | 0 | 0 | 112.2 | Q7 N8 I9 L13 S14 L15 | Q7-Y11 WeakPolarHBondContact O-CB 2.92Å; Q7-Y11 PolarHBondContact O-N 3.16Å; N8-Y11 PolarHBondContact O-N 3.14Å; N8-Y11 VanDerWaalsContact O-N 3.16Å; I9-Y11 VanDerWaalsContact C-N 3.32Å; I9-Y11 PolarHBondContact O-N 3.38Å; Y11-L13 VanDerWaalsContact C-N 3.28Å; Y11-L13 PolarHBondContact O-N 2.93Å; Y11-S14 WeakPolarHBondContact CA-OG 3.38Å; Y11-S14 PolarHBondContact O-N 2.88Å; Y11-S14 VanDerWaalsContact O-N 3.09Å; Y11-S14 PolarHBondContact O-OG 3.43Å; Y11-L15 HydrophobicContact CE1-CD1 4.45Å; Y11-L15 PolarHBondContact O-N 3.24Å |
| 12 | F | 65.6 | Low | 59 | Low | 155 Ų | 155 | 134.7 Ų | 134.7 | 68% | 0.68 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -60 | -39.2 | 171.1 | -84.7 | -79.6 | 0 | 0 | 0 | 111.7 | N8 S14 | N8-F12 VanDerWaalsContact O-CD2 3.27Å; N8-F12 WeakPolarHBondContact O-CD2 3.3Å; N8-F12 PolarHBondContact O-N 2.91Å; F12-S14 VanDerWaalsContact C-N 3.3Å; F12-S14 PolarHBondContact O-N 3.21Å |
| 13 | L | 61.8 | Low | 60 | Low | 72 Ų | 72 | 128.2 Ų | 128.2 | 38% | 0.377 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -73.2 | -15.8 | 176.1 | -88.5 | 86.9 | 0 | 0 | 0 | 114.3 | I9 K10 Y11 R26 | I9-L13 HydrophobicContact CG2-CD1 3.52Å; I9-L13 VanDerWaalsContact O-CB 3.3Å; I9-L13 WeakPolarHBondContact O-CB 3.48Å; I9-L13 WeakPolarHBondContact O-CD1 3.5Å; I9-L13 PolarHBondContact O-N 3.39Å; K10-L13 PolarHBondContact O-N 3.47Å; Y11-L13 VanDerWaalsContact C-N 3.28Å; Y11-L13 PolarHBondContact O-N 2.93Å; L13-R26 PolarHBondContact O-NH2 3.05Å; L13-R26 VanDerWaalsContact O-NH2 3.09Å |
| 14 | S | 63.6 | Low | 60.4 | Low | 75 Ų | 75 | 126.7 Ų | 126.7 | 52% | 0.524 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -95.8 | -18.8 | 175.5 | 58.6 | 0 | 0 | 0 | 0 | 113.9 | K10 Y11 F12 V16 | K10-S14 WeakPolarHBondContact O-CB 3.46Å; K10-S14 PolarHBondContact O-N 3.03Å; K10-S14 PolarHBondContact O-OG 3Å; Y11-S14 WeakPolarHBondContact CA-OG 3.38Å; Y11-S14 PolarHBondContact O-N 2.88Å; Y11-S14 VanDerWaalsContact O-N 3.09Å; Y11-S14 PolarHBondContact O-OG 3.43Å; F12-S14 VanDerWaalsContact C-N 3.3Å; F12-S14 PolarHBondContact O-N 3.21Å; S14-V16 PolarHBondContact O-N 3.09Å |
| 15 | L | 64.3 | Low | 60.7 | Low | 122 Ų | 122 | 122.2 Ų | 122.2 | 64% | 0.639 | 60% | 0.604 | S | S | * | * | S | Bend | trans | -67.8 | -15 | 178.5 | -152.5 | 77.8 | 0 | 0 | 0 | 113.1 | Y11 P17 | Y11-L15 HydrophobicContact CE1-CD1 4.45Å; Y11-L15 PolarHBondContact O-N 3.24Å; L15-P17 WeakPolarHBondContact O-CD 3.13Å |
| 16 | V | 58 | Low | 61.3 | Low | 72 Ų | 72 | 119.9 Ų | 119.9 | 44% | 0.436 | 59% | 0.592 | S | S | . | * | S | Bend | trans | -93.9 | 100.3 | 170.6 | -91.6 | 0 | 0 | 0 | 0 | 110 | S14 G18 | S14-V16 PolarHBondContact O-N 3.09Å; V16-G18 PolarHBondContact O-N 3.09Å |
| 17 | P | 50.8 | Low | 61.8 | Low | 134 Ų | 134 | 123.8 Ų | 123.8 | 87% | 0.87 | 60% | 0.602 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | 78.4 | 175.5 | 32.6 | -35.1 | 0 | 0 | 0 | 109 | L15 | L15-P17 WeakPolarHBondContact O-CD 3.13Š|
| 18 | G | 56.1 | Low | 62.5 | Low | 22 Ų | 22 | 122.4 Ų | 122.4 | 23% | 0.227 | 60% | 0.598 | C | S | . | * | T | Hydrogen-bonded Turn | trans | -155.3 | 0.7 | -175 | 0 | 0 | 0 | 0 | 0 | 115.1 | V16 R20 R21 F22 | V16-G18 PolarHBondContact O-N 3.09Å; G18-R20 PolarHBondContact O-N 2.89Å; G18-R21 PolarHBondContact O-N 2.93Å; G18-R21 VanDerWaalsContact O-N 3.11Å; G18-F22 WeakPolarHBondContact O-CB 3.45Å; G18-F22 PolarHBondContact O-N 2.84Å |
| 19 | K | 56.5 | Low | 63.1 | Low | 165 Ų | 165 | 120.1 Ų | 120.1 | 72% | 0.717 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.8 | -25.3 | -173.4 | -98.7 | -168.9 | 177.5 | -166.2 | 0 | 115.1 | ||
| 20 | R | 55.8 | Low | 64 | Low | 250 Ų | 250 | 118.6 Ų | 118.6 | 94% | 0.943 | 59% | 0.585 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97 | -16 | -175 | -148 | 169 | -178.8 | 168.5 | -1.3 | 114.3 | G18 | G18-R20 PolarHBondContact O-N 2.89Š|
| 21 | R | 57.9 | Low | 65 | Low | 232 Ų | 232 | 119.4 Ų | 119.4 | 88% | 0.875 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.5 | -27.7 | -178.7 | -159.3 | 75.7 | -173.9 | -176.4 | 3.6 | 113.6 | G18 G23 | G18-R21 PolarHBondContact O-N 2.93Å; G18-R21 VanDerWaalsContact O-N 3.11Å; R21-G23 PolarHBondContact O-N 3.13Å |
| 22 | F | 59.9 | Low | 65.9 | Low | 105 Ų | 105 | 119.9 Ų | 119.9 | 46% | 0.461 | 59% | 0.594 | S | S | . | * | trans | -98.7 | 37.7 | -178.1 | -80.1 | -95.7 | 0 | 0 | 0 | 112.8 | G18 V24 Y25 R26 | G18-F22 WeakPolarHBondContact O-CB 3.45Å; G18-F22 PolarHBondContact O-N 2.84Å; F22-V24 PolarHBondContact O-N 3.11Å; F22-V24 VanDerWaalsContact O-N 3.13Å; F22-Y25 VanDerWaalsContact CD1-CB 3.46Å; F22-Y25 PolarHBondContact O-N 3.46Å; F22-R26 PolarHBondContact O-N 3.49Å | ||
| 23 | G | 64.5 | Low | 67 | Low | 71 Ų | 71 | 116.3 Ų | 116.3 | 73% | 0.732 | 59% | 0.588 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.2 | -26.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | R21 | R21-G23 PolarHBondContact O-N 3.13Š|
| 24 | V | 62.8 | Low | 68.4 | Low | 126 Ų | 126 | 117.5 Ų | 117.5 | 76% | 0.764 | 59% | 0.593 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.6 | -33.8 | 176.9 | -176.7 | 0 | 0 | 0 | 0 | 112 | F22 R26 | F22-V24 PolarHBondContact O-N 3.11Å; F22-V24 VanDerWaalsContact O-N 3.13Å; V24-R26 VanDerWaalsContact C-N 3.3Å; V24-R26 PolarHBondContact O-N 3.25Å |
| 25 | Y | 62.5 | Low | 69.6 | Low | 145 Ų | 145 | 115.5 Ų | 115.5 | 57% | 0.569 | 59% | 0.585 | S | S | * | * | G | 310 helix | trans | -85.6 | 11.8 | -175.5 | -90.2 | -91.9 | 0 | 0 | 0 | 115 | F22 F27 L28 P29 | F22-Y25 VanDerWaalsContact CD1-CB 3.46Å; F22-Y25 PolarHBondContact O-N 3.46Å; Y25-F27 PolarHBondContact O-N 3.13Å; Y25-F27 VanDerWaalsContact O-N 3.13Å; Y25-L28 HydrophobicContact CD1-CB 3.7Å; Y25-L28 HydrophobicContact CD1-CD1 4.2Å; Y25-L28 HydrophobicContact CD1-CD2 3.58Å; Y25-L28 HydrophobicContact CD1-CG 4.01Å; Y25-L28 HydrophobicContact CE1-CB 4.48Å; Y25-L28 HydrophobicContact CE1-CD1 4.16Å; Y25-L28 HydrophobicContact CE1-CD2 3.96Å; Y25-L28 HydrophobicContact CE1-CG 4.42Å; Y25-L28 WeakPolarHBondContact O-CB 3.33Å; Y25-L28 PolarHBondContact O-N 3.3Å; Y25-P29 WeakPolarHBondContact O-CD 3.42Å |
| 26 | R | 68.7 | Low | 70.9 | Confident | 90 Ų | 90 | 111.5 Ų | 111.5 | 34% | 0.34 | 57% | 0.573 | S | S | . | * | G | 310 helix | trans | -59.2 | -25.7 | 179.3 | -166.5 | 175.3 | -173.3 | 167.6 | 8.4 | 113.6 | L13 F22 V24 | L13-R26 PolarHBondContact O-NH2 3.05Å; L13-R26 VanDerWaalsContact O-NH2 3.09Å; F22-R26 PolarHBondContact O-N 3.49Å; V24-R26 VanDerWaalsContact C-N 3.3Å; V24-R26 PolarHBondContact O-N 3.25Å |
| 27 | F | 68.5 | Low | 72.5 | Confident | 137 Ų | 137 | 112 Ų | 112 | 60% | 0.601 | 58% | 0.576 | S | S | * | * | G | 310 helix | trans | -86.8 | -16.5 | 178.8 | -60.3 | -79.6 | 0 | 0 | 0 | 113.6 | Y25 V30 F31 | Y25-F27 PolarHBondContact O-N 3.13Å; Y25-F27 VanDerWaalsContact O-N 3.13Å; F27-V30 CarbonylContact O-C 3.57Å; F27-V30 WeakPolarHBondContact O-CA 3.43Å; F27-V30 WeakPolarHBondContact O-CB 3.33Å; F27-V30 PolarHBondContact O-N 2.85Å; F27-F31 HydrophobicContact CB-CD2 3.78Å; F27-F31 HydrophobicContact CB-CE2 3.51Å; F27-F31 HydrophobicContact CG-CE2 4.45Å; F27-F31 WeakPolarHBondContact O-CD2 3.2Å; F27-F31 PolarHBondContact O-N 3.24Å |
| 28 | L | 78.9 | Confident | 74.1 | Confident | 93 Ų | 93 | 111.4 Ų | 111.4 | 49% | 0.487 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -56.3 | -49.8 | -179.6 | -175.2 | 74.5 | 0 | 0 | 0 | 113.5 | Y25 V30 F31 F32 | Y25-L28 HydrophobicContact CD1-CB 3.7Å; Y25-L28 HydrophobicContact CD1-CD1 4.2Å; Y25-L28 HydrophobicContact CD1-CD2 3.58Å; Y25-L28 HydrophobicContact CD1-CG 4.01Å; Y25-L28 HydrophobicContact CE1-CB 4.48Å; Y25-L28 HydrophobicContact CE1-CD1 4.16Å; Y25-L28 HydrophobicContact CE1-CD2 3.96Å; Y25-L28 HydrophobicContact CE1-CG 4.42Å; Y25-L28 WeakPolarHBondContact O-CB 3.33Å; Y25-L28 PolarHBondContact O-N 3.3Å; L28-V30 PolarHBondContact O-N 3.43Å; L28-F31 PolarHBondContact O-N 2.87Å; L28-F32 PolarHBondContact O-N 3.49Å |
| 29 | P | 77.5 | Confident | 75.5 | Confident | 65 Ų | 65 | 116.9 Ų | 116.9 | 42% | 0.422 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -63.3 | -30 | 175.8 | 23.8 | -33.5 | 0 | 0 | 0 | 112.1 | Y25 C33 | Y25-P29 WeakPolarHBondContact O-CD 3.42Å; P29-C33 WeakPolarHBondContact O-CB 3.36Å; P29-C33 PolarHBondContact O-N 2.97Å; P29-C33 PolarHBondContact O-SG 3.29Å |
| 30 | V | 81.4 | Confident | 76.9 | Confident | 73 Ų | 73 | 116.5 Ų | 116.5 | 44% | 0.442 | 58% | 0.577 | S | S | . | * | H | α-helix | trans | -69.3 | -45.3 | 177.1 | -177.8 | 0 | 0 | 0 | 0 | 111 | F27 L28 F32 C33 I34 | F27-V30 CarbonylContact O-C 3.57Å; F27-V30 WeakPolarHBondContact O-CA 3.43Å; F27-V30 WeakPolarHBondContact O-CB 3.33Å; F27-V30 PolarHBondContact O-N 2.85Å; L28-V30 PolarHBondContact O-N 3.43Å; V30-F32 VanDerWaalsContact C-N 3.31Å; V30-F32 PolarHBondContact O-N 3.35Å; V30-C33 PolarHBondContact O-N 3.46Å; V30-I34 HydrophobicContact CG1-CD1 3.74Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 WeakPolarHBondContact O-CB 3.25Å; V30-I34 VanDerWaalsContact O-CG1 3.25Å; V30-I34 WeakPolarHBondContact O-CG1 3.45Å; V30-I34 PolarHBondContact O-N 3.01Å |
| 31 | F | 84.1 | Confident | 78.1 | Confident | 144 Ų | 144 | 107.4 Ų | 107.4 | 63% | 0.632 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -62.8 | -38.1 | 175.5 | -75.8 | -68.7 | 0 | 0 | 0 | 112.1 | F27 L28 I34 G35 | F27-F31 HydrophobicContact CB-CD2 3.78Å; F27-F31 HydrophobicContact CB-CE2 3.51Å; F27-F31 HydrophobicContact CG-CE2 4.45Å; F27-F31 WeakPolarHBondContact O-CD2 3.2Å; F27-F31 PolarHBondContact O-N 3.24Å; L28-F31 PolarHBondContact O-N 2.87Å; F31-I34 PolarHBondContact O-N 3.29Å; F31-G35 PolarHBondContact O-N 3.41Å |
| 32 | F | 85.8 | Confident | 79.1 | Confident | 169 Ų | 169 | 102.3 Ų | 102.3 | 74% | 0.741 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -66.3 | -44.9 | 175.6 | -171.5 | -99 | 0 | 0 | 0 | 112 | L28 V30 G35 G36 | L28-F32 PolarHBondContact O-N 3.49Å; V30-F32 VanDerWaalsContact C-N 3.31Å; V30-F32 PolarHBondContact O-N 3.35Å; F32-G35 PolarHBondContact O-N 2.75Å; F32-G36 PolarHBondContact O-N 3.39Å |
| 33 | C | 88.6 | Confident | 79.7 | Confident | 81 Ų | 81 | 103 Ų | 103 | 55% | 0.547 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -62.7 | -43.8 | 174.6 | -70.4 | 0 | 0 | 0 | 0 | 112 | P29 V30 G36 V37 | P29-C33 WeakPolarHBondContact O-CB 3.36Å; P29-C33 PolarHBondContact O-N 2.97Å; P29-C33 PolarHBondContact O-SG 3.29Å; V30-C33 PolarHBondContact O-N 3.46Å; C33-G36 PolarHBondContact O-N 3Å; C33-V37 WeakPolarHBondContact O-CB 3.47Å; C33-V37 WeakPolarHBondContact O-CG2 3.08Å; C33-V37 PolarHBondContact O-N 2.84Å |
| 34 | I | 90.1 | Very high | 80 | Confident | 96 Ų | 96 | 103.3 Ų | 103.3 | 49% | 0.492 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.4 | -43.2 | 176.7 | -68.7 | 168.2 | 0 | 0 | 0 | 110.5 | V30 F31 V37 M38 | V30-I34 HydrophobicContact CG1-CD1 3.74Å; V30-I34 HydrophobicContact CG1-CG1 4.39Å; V30-I34 WeakPolarHBondContact O-CB 3.25Å; V30-I34 VanDerWaalsContact O-CG1 3.25Å; V30-I34 WeakPolarHBondContact O-CG1 3.45Å; V30-I34 PolarHBondContact O-N 3.01Å; F31-I34 PolarHBondContact O-N 3.29Å; I34-V37 PolarHBondContact O-N 3.15Å; I34-M38 HydrophobicContact CG2-CG 4.44Å; I34-M38 WeakPolarHBondContact O-CB 3.16Å; I34-M38 VanDerWaalsContact O-CG 3.25Å; I34-M38 WeakPolarHBondContact O-CG 3.15Å; I34-M38 PolarHBondContact O-N 2.84Å |
| 35 | G | 89.7 | Confident | 80 | Confident | 34 Ų | 34 | 101.4 Ų | 101.4 | 35% | 0.351 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61 | -48.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | F31 F32 V37 M38 E39 | F31-G35 PolarHBondContact O-N 3.41Å; F32-G35 PolarHBondContact O-N 2.75Å; G35-V37 VanDerWaalsContact C-N 3.35Å; G35-V37 PolarHBondContact O-N 2.85Å; G35-M38 WeakPolarHBondContact O-CB 3.24Å; G35-M38 PolarHBondContact O-N 2.85Å; G35-M38 VanDerWaalsContact O-N 3.15Å; G35-E39 PolarHBondContact O-N 3.45Å |
| 36 | G | 91.7 | Very high | 79.7 | Confident | 37 Ų | 37 | 102.9 Ų | 102.9 | 38% | 0.381 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.9 | -37.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | F32 C33 W40 | F32-G36 PolarHBondContact O-N 3.39Å; C33-G36 PolarHBondContact O-N 3Å; G36-W40 WeakPolarHBondContact O-CB 3.49Å; G36-W40 PolarHBondContact O-N 2.85Å |
| 37 | V | 89.9 | Confident | 78.9 | Confident | 84 Ų | 84 | 105.5 Ų | 105.5 | 51% | 0.509 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.1 | -41 | 172.3 | 169.4 | 0 | 0 | 0 | 0 | 110.7 | C33 I34 G35 W40 V41 | C33-V37 WeakPolarHBondContact O-CB 3.47Å; C33-V37 WeakPolarHBondContact O-CG2 3.08Å; C33-V37 PolarHBondContact O-N 2.84Å; I34-V37 PolarHBondContact O-N 3.15Å; G35-V37 VanDerWaalsContact C-N 3.35Å; G35-V37 PolarHBondContact O-N 2.85Å; V37-W40 PolarHBondContact O-N 2.94Å; V37-V41 HydrophobicContact CG1-CG2 4.09Å; V37-V41 VanDerWaalsContact O-CB 3.24Å; V37-V41 WeakPolarHBondContact O-CB 3.45Å; V37-V41 WeakPolarHBondContact O-CG2 3.27Å; V37-V41 PolarHBondContact O-N 3.36Å |
| 38 | M | 84.8 | Confident | 78.3 | Confident | 121 Ų | 121 | 100.5 Ų | 100.5 | 60% | 0.596 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.7 | -45.9 | 176.4 | -74.4 | -72.5 | -85.8 | 0 | 0 | 111.5 | I34 G35 V41 M42 | I34-M38 HydrophobicContact CG2-CG 4.44Å; I34-M38 WeakPolarHBondContact O-CB 3.16Å; I34-M38 VanDerWaalsContact O-CG 3.25Å; I34-M38 WeakPolarHBondContact O-CG 3.15Å; I34-M38 PolarHBondContact O-N 2.84Å; G35-M38 WeakPolarHBondContact O-CB 3.24Å; G35-M38 PolarHBondContact O-N 2.85Å; G35-M38 VanDerWaalsContact O-N 3.15Å; M38-V41 PolarHBondContact O-N 3.03Å; M38-M42 VanDerWaalsContact O-CG 3.27Å; M38-M42 WeakPolarHBondContact O-CG 3.13Å; M38-M42 PolarHBondContact O-N 3.4Å |
| 39 | E | 85.1 | Confident | 77 | Confident | 137 Ų | 137 | 106 Ų | 106 | 64% | 0.64 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -65.3 | -42.2 | 174.8 | -69.3 | -155 | 99.4 | 0 | 0 | 112.5 | G35 V41 M42 I43 | G35-E39 PolarHBondContact O-N 3.45Å; E39-V41 PolarHBondContact O-N 3.4Å; E39-M42 WeakPolarHBondContact O-CB 3.2Å; E39-M42 PolarHBondContact O-N 2.77Å; E39-M42 VanDerWaalsContact O-N 3.15Å; E39-I43 WeakPolarHBondContact O-CG1 3.25Å; E39-I43 PolarHBondContact O-N 3.46Å |
| 40 | W | 85.9 | Confident | 75.9 | Confident | 156 Ų | 156 | 109.5 Ų | 109.5 | 59% | 0.591 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -63.8 | -40.6 | 176.1 | -179.9 | 81.1 | 0 | 0 | 0 | 111.9 | G36 V37 M42 I43 N44 | G36-W40 WeakPolarHBondContact O-CB 3.49Å; G36-W40 PolarHBondContact O-N 2.85Å; V37-W40 PolarHBondContact O-N 2.94Å; W40-M42 VanDerWaalsContact C-N 3.34Å; W40-I43 PolarHBondContact O-N 2.69Å; W40-N44 HydrophobicContact CD2-CB 4.35Å; W40-N44 HydrophobicContact CH2-CB 4.42Å; W40-N44 HydrophobicContact CZ2-CB 4.22Å; W40-N44 WeakPolarHBondContact O-CB 3.34Å; W40-N44 PolarHBondContact O-N 3.25Å |
| 41 | V | 82.7 | Confident | 74.6 | Confident | 59 Ų | 59 | 110.8 Ų | 110.8 | 36% | 0.358 | 56% | 0.562 | S | S | . | * | H | α-helix | trans | -62.9 | -41.6 | 171.9 | 166.2 | 0 | 0 | 0 | 0 | 109.6 | V37 M38 E39 I43 N44 V45 | V37-V41 HydrophobicContact CG1-CG2 4.09Å; V37-V41 VanDerWaalsContact O-CB 3.24Å; V37-V41 WeakPolarHBondContact O-CB 3.45Å; V37-V41 WeakPolarHBondContact O-CG2 3.27Å; V37-V41 PolarHBondContact O-N 3.36Å; M38-V41 PolarHBondContact O-N 3.03Å; E39-V41 PolarHBondContact O-N 3.4Å; V41-I43 VanDerWaalsContact C-N 3.28Å; V41-I43 PolarHBondContact O-N 3.33Å; V41-N44 PolarHBondContact O-N 3Å; V41-V45 HydrophobicContact CG1-CB 4.13Å; V41-V45 HydrophobicContact CG1-CG1 4.35Å; V41-V45 WeakPolarHBondContact O-CA 3.39Å; V41-V45 WeakPolarHBondContact O-CB 3.27Å; V41-V45 WeakPolarHBondContact O-CG1 2.97Å; V41-V45 PolarHBondContact O-N 3.42Å |
| 42 | M | 77.8 | Confident | 73 | Confident | 126 Ų | 126 | 109.8 Ų | 109.8 | 62% | 0.621 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -60 | -38.3 | 175.5 | -72.4 | 170.5 | 65.7 | 0 | 0 | 112.4 | M38 E39 W40 R46 | M38-M42 VanDerWaalsContact O-CG 3.27Å; M38-M42 WeakPolarHBondContact O-CG 3.13Å; M38-M42 PolarHBondContact O-N 3.4Å; E39-M42 WeakPolarHBondContact O-CB 3.2Å; E39-M42 PolarHBondContact O-N 2.77Å; E39-M42 VanDerWaalsContact O-N 3.15Å; W40-M42 VanDerWaalsContact C-N 3.34Å; M42-R46 VanDerWaalsContact O-CB 3.24Å; M42-R46 WeakPolarHBondContact O-CB 3.44Å; M42-R46 WeakPolarHBondContact O-CG 3.41Å; M42-R46 PolarHBondContact O-N 3.33Å |
| 43 | I | 71.9 | Confident | 71.4 | Confident | 119 Ų | 119 | 111.7 Ų | 111.7 | 61% | 0.61 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -75.4 | -42.7 | 177.8 | -64.7 | 162.6 | 0 | 0 | 0 | 111.8 | E39 W40 V41 R46 | E39-I43 WeakPolarHBondContact O-CG1 3.25Å; E39-I43 PolarHBondContact O-N 3.46Å; W40-I43 PolarHBondContact O-N 2.69Å; V41-I43 VanDerWaalsContact C-N 3.28Å; V41-I43 PolarHBondContact O-N 3.33Å; I43-R46 WeakPolarHBondContact O-CB 2.98Å |
| 44 | N | 71 | Confident | 69.9 | Low | 78 Ų | 78 | 111.9 Ų | 111.9 | 42% | 0.417 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -81.5 | -37.7 | -176.5 | -168.5 | -93.5 | 0 | 0 | 0 | 112.6 | W40 V41 R46 I47 | W40-N44 HydrophobicContact CD2-CB 4.35Å; W40-N44 HydrophobicContact CH2-CB 4.42Å; W40-N44 HydrophobicContact CZ2-CB 4.22Å; W40-N44 WeakPolarHBondContact O-CB 3.34Å; W40-N44 PolarHBondContact O-N 3.25Å; V41-N44 PolarHBondContact O-N 3Å; N44-R46 PolarHBondContact O-N 2.88Å; N44-I47 VanDerWaalsContact O-CB 3.27Å; N44-I47 WeakPolarHBondContact O-CB 3.43Å; N44-I47 PolarHBondContact O-N 3.15Å |
| 45 | V | 63.6 | Low | 68.2 | Low | 85 Ų | 85 | 111 Ų | 111 | 52% | 0.515 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -70 | -22.3 | 172.7 | 98.9 | 0 | 0 | 0 | 0 | 111.5 | V41 I47 G48 R49 | V41-V45 HydrophobicContact CG1-CB 4.13Å; V41-V45 HydrophobicContact CG1-CG1 4.35Å; V41-V45 WeakPolarHBondContact O-CA 3.39Å; V41-V45 WeakPolarHBondContact O-CB 3.27Å; V41-V45 WeakPolarHBondContact O-CG1 2.97Å; V41-V45 PolarHBondContact O-N 3.42Å; V45-I47 PolarHBondContact O-N 3.34Å; V45-G48 PolarHBondContact O-N 3.4Å; V45-R49 PolarHBondContact O-N 3.49Å |
| 46 | R | 55.7 | Low | 66.4 | Low | 176 Ų | 176 | 119 Ų | 119 | 66% | 0.664 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65 | -17 | 166.5 | -104.5 | -176.5 | 165.6 | 174.1 | 2 | 114.1 | M42 I43 N44 G48 E50 | M42-R46 VanDerWaalsContact O-CB 3.24Å; M42-R46 WeakPolarHBondContact O-CB 3.44Å; M42-R46 WeakPolarHBondContact O-CG 3.41Å; M42-R46 PolarHBondContact O-N 3.33Å; I43-R46 WeakPolarHBondContact O-CB 2.98Å; N44-R46 PolarHBondContact O-N 2.88Å; R46-G48 PolarHBondContact O-N 3.16Å; R46-E50 IonicContact CZ-OE2 3.57Å; R46-E50 IonicContact NE-OE2 2.92Å; R46-E50 PolarHBondContact NE-OE2 3.22Å; R46-E50 IonicContact NH2-OE2 3.39Å; R46-E50 PolarHBondContact NH2-OE2 3.32Å |
| 47 | I | 53.2 | Low | 64.6 | Low | 146 Ų | 146 | 126.6 Ų | 126.6 | 75% | 0.749 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.7 | -17.6 | 173.8 | -108 | 95.9 | 0 | 0 | 0 | 112 | N44 V45 | N44-I47 VanDerWaalsContact O-CB 3.27Å; N44-I47 WeakPolarHBondContact O-CB 3.43Å; N44-I47 PolarHBondContact O-N 3.15Å; V45-I47 PolarHBondContact O-N 3.34Å |
| 48 | G | 54.3 | Low | 62.8 | Low | 32 Ų | 32 | 131.1 Ų | 131.1 | 33% | 0.33 | 60% | 0.601 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -132.7 | -7.4 | -165.8 | 0 | 0 | 0 | 0 | 0 | 118.8 | V45 R46 F52 | V45-G48 PolarHBondContact O-N 3.4Å; R46-G48 PolarHBondContact O-N 3.16Å; G48-F52 WeakPolarHBondContact O-CD2 3.43Å |
| 49 | R | 51.6 | Low | 61.3 | Low | 207 Ų | 207 | 133.1 Ų | 133.1 | 78% | 0.781 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -143.7 | 10 | -170.2 | -88.1 | -132.3 | -160.4 | 160.3 | 7.5 | 118.9 | V45 F52 | V45-R49 PolarHBondContact O-N 3.49Å; R49-F52 HydrophobicContact CG-CB 4.43Å |
| 50 | E | 54.2 | Low | 59.7 | Low | 139 Ų | 139 | 134.7 Ų | 134.7 | 65% | 0.65 | 61% | 0.612 | S | S | * | * | S | Bend | trans | -81.9 | -22.1 | 155.1 | -83.6 | -172.5 | 90.7 | 0 | 0 | 111.6 | R46 | R46-E50 IonicContact CZ-OE2 3.57Å; R46-E50 IonicContact NE-OE2 2.92Å; R46-E50 PolarHBondContact NE-OE2 3.22Å; R46-E50 IonicContact NH2-OE2 3.39Å; R46-E50 PolarHBondContact NH2-OE2 3.32Å |
| 51 | T | 55.7 | Low | 57.9 | Low | 101 Ų | 101 | 129.8 Ų | 129.8 | 62% | 0.62 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -93.7 | -10.8 | 178 | -35.3 | 0 | 0 | 0 | 0 | 114.4 | D54 | T51-D54 VanDerWaalsContact O-CB 3.25Å; T51-D54 WeakPolarHBondContact O-CB 3.24Å; T51-D54 PolarHBondContact O-N 3.44Å |
| 52 | F | 49.5 | Very low | 56.5 | Low | 123 Ų | 123 | 133.9 Ų | 133.9 | 54% | 0.539 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -85.9 | -13.7 | 179.6 | -92.7 | -95.3 | 0 | 0 | 0 | 114.8 | G48 R49 D54 V55 Y56 | G48-F52 WeakPolarHBondContact O-CD2 3.43Å; R49-F52 HydrophobicContact CG-CB 4.43Å; F52-D54 PolarHBondContact O-N 3.32Å; F52-V55 HydrophobicContact CD1-CB 3.98Å; F52-V55 HydrophobicContact CD1-CG1 4.34Å; F52-V55 HydrophobicContact CD1-CG2 4.11Å; F52-V55 HydrophobicContact CE1-CB 4.44Å; F52-V55 HydrophobicContact CE1-CG1 4.41Å; F52-V55 HydrophobicContact CE1-CG2 4.36Å; F52-V55 HydrophobicContact CG-CG2 4.38Å; F52-V55 PolarHBondContact O-N 2.92Å; F52-Y56 PolarHBondContact O-N 3.34Å; F52-Y56 VanDerWaalsContact O-N 3.16Å |
| 53 | Y | 53.3 | Low | 55.4 | Low | 208 Ų | 208 | 137.5 Ų | 137.5 | 82% | 0.816 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -66.6 | -25.9 | 164.4 | -138.1 | -91 | 0 | 0 | 0 | 111 | R57 | Y53-R57 WeakPolarHBondContact O-CB 3.25Å; Y53-R57 PolarHBondContact O-N 3.18Å |
| 54 | D | 55.4 | Low | 54.6 | Low | 86 Ų | 86 | 138 Ų | 138 | 46% | 0.46 | 62% | 0.623 | S | S | . | * | H | α-helix | trans | -70.3 | -43 | 171.7 | -150.2 | -96.7 | 0 | 0 | 0 | 111.5 | T51 F52 Y56 R57 R58 | T51-D54 VanDerWaalsContact O-CB 3.25Å; T51-D54 WeakPolarHBondContact O-CB 3.24Å; T51-D54 PolarHBondContact O-N 3.44Å; F52-D54 PolarHBondContact O-N 3.32Å; D54-Y56 PolarHBondContact O-N 3.15Å; D54-R57 PolarHBondContact O-N 3.27Å; D54-R57 VanDerWaalsContact O-N 3.16Å; D54-R58 WeakPolarHBondContact O-CG 3.19Å; D54-R58 PolarHBondContact O-N 3.38Å |
| 55 | V | 55 | Low | 53.6 | Low | 77 Ų | 77 | 141.4 Ų | 141.4 | 47% | 0.467 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -66.5 | -35.4 | -179.1 | -176.7 | 0 | 0 | 0 | 0 | 112.2 | F52 | F52-V55 HydrophobicContact CD1-CB 3.98Å; F52-V55 HydrophobicContact CD1-CG1 4.34Å; F52-V55 HydrophobicContact CD1-CG2 4.11Å; F52-V55 HydrophobicContact CE1-CB 4.44Å; F52-V55 HydrophobicContact CE1-CG1 4.41Å; F52-V55 HydrophobicContact CE1-CG2 4.36Å; F52-V55 HydrophobicContact CG-CG2 4.38Å; F52-V55 PolarHBondContact O-N 2.92Å |
| 56 | Y | 52.3 | Low | 53.2 | Low | 202 Ų | 202 | 143 Ų | 143 | 79% | 0.792 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.1 | -28.1 | 175.2 | -131 | -91.4 | 0 | 0 | 0 | 112.8 | F52 D54 | F52-Y56 PolarHBondContact O-N 3.34Å; F52-Y56 VanDerWaalsContact O-N 3.16Å; D54-Y56 PolarHBondContact O-N 3.15Å |
| 57 | R | 53.5 | Low | 53.3 | Low | 197 Ų | 197 | 140.4 Ų | 140.4 | 74% | 0.743 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -72.1 | -30.5 | 173.9 | -169.7 | 175.7 | 170 | 166.2 | -2.6 | 112.4 | Y53 D54 K59 K60 | Y53-R57 WeakPolarHBondContact O-CB 3.25Å; Y53-R57 PolarHBondContact O-N 3.18Å; D54-R57 PolarHBondContact O-N 3.27Å; D54-R57 VanDerWaalsContact O-N 3.16Å; R57-K59 VanDerWaalsContact C-N 3.34Å; R57-K59 PolarHBondContact O-N 3.36Å; R57-K60 PolarHBondContact O-N 3.26Å |
| 58 | R | 52.7 | Low | 53.4 | Low | 178 Ų | 178 | 140.4 Ų | 140.4 | 67% | 0.672 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -63 | -33.5 | 177.4 | -75 | -81.3 | -179.5 | 166.8 | -0.9 | 113.7 | D54 K60 S61 | D54-R58 WeakPolarHBondContact O-CG 3.19Å; D54-R58 PolarHBondContact O-N 3.38Å; R58-K60 VanDerWaalsContact C-N 3.3Å; R58-K60 PolarHBondContact O-N 3.4Å; R58-S61 PolarHBondContact O-N 3.03Å |
| 59 | K | 53.2 | Low | 53.6 | Low | 164 Ų | 164 | 143.9 Ų | 143.9 | 71% | 0.713 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -75.5 | -11.2 | 177.7 | -72.4 | -155.9 | -177.9 | -165.2 | 0 | 115.3 | R57 | R57-K59 VanDerWaalsContact C-N 3.34Å; R57-K59 PolarHBondContact O-N 3.36Å |
| 60 | K | 52.1 | Low | 53.9 | Low | 169 Ų | 169 | 140.1 Ų | 140.1 | 74% | 0.735 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -87.4 | -23.4 | 174.2 | -131.1 | 179.9 | -175.7 | -172.1 | 0 | 112.5 | R57 R58 | R57-K60 PolarHBondContact O-N 3.26Å; R58-K60 VanDerWaalsContact C-N 3.3Å; R58-K60 PolarHBondContact O-N 3.4Å |
| 61 | S | 47.9 | Very low | 54 | Low | 54 Ų | 54 | 138.3 Ų | 138.3 | 38% | 0.378 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -72.6 | -38.3 | -179.7 | -161.5 | 0 | 0 | 0 | 0 | 112.7 | R58 R63 E64 Y65 | R58-S61 PolarHBondContact O-N 3.03Å; S61-R63 PolarHBondContact O-N 3.28Å; S61-E64 PolarHBondContact O-N 3.39Å; S61-E64 VanDerWaalsContact O-N 3.15Å; S61-Y65 WeakPolarHBondContact O-CD2 3.46Å; S61-Y65 PolarHBondContact O-N 3.16Å; S61-Y65 VanDerWaalsContact OG-CE2 3.28Å; S61-Y65 WeakPolarHBondContact OG-CE2 3.22Å |
| 62 | E | 53.2 | Low | 54.1 | Low | 145 Ų | 145 | 135.5 Ų | 135.5 | 68% | 0.678 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -62.8 | -24.9 | 178.9 | -75.4 | 179.2 | 83 | 0 | 0 | 113.6 | ||
| 63 | R | 55 | Low | 54.4 | Low | 201 Ų | 201 | 135.3 Ų | 135.3 | 76% | 0.758 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -83.7 | -20.6 | 177.9 | -64.9 | -168.7 | -178.8 | -149.5 | -0.6 | 113.8 | S61 | S61-R63 PolarHBondContact O-N 3.28Å |
| 64 | E | 53.4 | Low | 54.4 | Low | 129 Ų | 129 | 130.1 Ų | 130.1 | 60% | 0.603 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -88.3 | -24.8 | 175.8 | -70.1 | -145.4 | 89.7 | 0 | 0 | 112.9 | S61 K68 | S61-E64 PolarHBondContact O-N 3.39Å; S61-E64 VanDerWaalsContact O-N 3.15Å; E64-K68 WeakPolarHBondContact O-CG 3.39Å; E64-K68 PolarHBondContact O-N 3.23Å |
| 65 | Y | 51.4 | Low | 54.3 | Low | 151 Ų | 151 | 131.4 Ų | 131.4 | 59% | 0.592 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -72.9 | -33.9 | 173.8 | -78.4 | -74.9 | 0 | 0 | 0 | 113.2 | S61 K68 I69 | S61-Y65 WeakPolarHBondContact O-CD2 3.46Å; S61-Y65 PolarHBondContact O-N 3.16Å; S61-Y65 VanDerWaalsContact OG-CE2 3.28Å; S61-Y65 WeakPolarHBondContact OG-CE2 3.22Å; Y65-K68 PolarHBondContact O-N 3.45Å; Y65-I69 WeakPolarHBondContact O-CD1 3.37Å; Y65-I69 VanDerWaalsContact O-CG1 3.22Å; Y65-I69 WeakPolarHBondContact O-CG1 3.46Å; Y65-I69 PolarHBondContact O-N 2.86Å; Y65-I69 VanDerWaalsContact O-N 3.1Å |
| 66 | Q | 55.4 | Low | 54.3 | Low | 118 Ų | 118 | 134.4 Ų | 134.4 | 55% | 0.551 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -65.8 | -41.5 | 175.4 | -73.5 | -66.4 | -12.6 | 0 | 0 | 112 | K68 I69 E70 | Q66-K68 PolarHBondContact O-N 2.92Å; Q66-I69 PolarHBondContact O-N 3.46Å; Q66-E70 PolarHBondContact O-N 3.02Å |
| 67 | Q | 56.2 | Low | 54.4 | Low | 122 Ų | 122 | 130 Ų | 130 | 57% | 0.57 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -66.6 | -37.2 | 177.4 | -72.5 | -172.7 | 91.8 | 0 | 0 | 112.5 | E70 D71 | Q67-E70 PolarHBondContact O-N 3.29Å; Q67-D71 WeakPolarHBondContact O-CB 3.41Å; Q67-D71 PolarHBondContact O-N 3.26Å |
| 68 | K | 56.6 | Low | 54.5 | Low | 146 Ų | 146 | 129.4 Ų | 129.4 | 64% | 0.635 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -72.5 | -25.8 | 176.3 | -71 | -175.1 | 176.7 | -171.2 | 0 | 113.9 | E64 Y65 Q66 G72 | E64-K68 WeakPolarHBondContact O-CG 3.39Å; E64-K68 PolarHBondContact O-N 3.23Å; Y65-K68 PolarHBondContact O-N 3.45Å; Q66-K68 PolarHBondContact O-N 2.92Å; K68-G72 PolarHBondContact O-N 3.18Å |
| 69 | I | 58.3 | Low | 54.5 | Low | 104 Ų | 104 | 125.6 Ų | 125.6 | 53% | 0.533 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -75.7 | -40.6 | 173.8 | -67 | 163.7 | 0 | 0 | 0 | 110 | Y65 Q66 G72 L73 | Y65-I69 WeakPolarHBondContact O-CD1 3.37Å; Y65-I69 VanDerWaalsContact O-CG1 3.22Å; Y65-I69 WeakPolarHBondContact O-CG1 3.46Å; Y65-I69 PolarHBondContact O-N 2.86Å; Y65-I69 VanDerWaalsContact O-N 3.1Å; Q66-I69 PolarHBondContact O-N 3.46Å; I69-G72 PolarHBondContact O-N 3.45Å; I69-L73 WeakPolarHBondContact O-CB 3.19Å; I69-L73 PolarHBondContact O-N 2.9Å |
| 70 | E | 56.8 | Low | 54.4 | Low | 128 Ų | 128 | 125 Ų | 125 | 60% | 0.598 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -64.8 | -45.7 | 171.9 | -75.3 | -175.8 | 97.9 | 0 | 0 | 111.6 | Q66 Q67 G72 L73 I74 | Q66-E70 PolarHBondContact O-N 3.02Å; Q67-E70 PolarHBondContact O-N 3.29Å; E70-G72 PolarHBondContact O-N 3.1Å; E70-L73 PolarHBondContact O-N 3.46Å; E70-I74 WeakPolarHBondContact O-CG1 3.5Å; E70-I74 WeakPolarHBondContact O-CG2 3.1Å; E70-I74 PolarHBondContact O-N 3.45Å |
| 71 | D | 58.1 | Low | 54.2 | Low | 102 Ų | 102 | 121.9 Ų | 121.9 | 55% | 0.545 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -64.3 | -36.2 | 176 | -106.6 | -93.1 | 0 | 0 | 0 | 112.9 | Q67 I74 V75 | Q67-D71 WeakPolarHBondContact O-CB 3.41Å; Q67-D71 PolarHBondContact O-N 3.26Å; D71-I74 HydrophobicContact CB-CD1 4.49Å; D71-I74 WeakPolarHBondContact O-CG1 3.28Å; D71-V75 PolarHBondContact O-N 2.91Å |
| 72 | G | 56.4 | Low | 53.9 | Low | 41 Ų | 41 | 132.5 Ų | 132.5 | 42% | 0.423 | 67% | 0.672 | S | S | . | * | H | α-helix | trans | -71.3 | -32 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | K68 I69 E70 L76 | K68-G72 PolarHBondContact O-N 3.18Å; I69-G72 PolarHBondContact O-N 3.45Å; E70-G72 PolarHBondContact O-N 3.1Å; G72-L76 PolarHBondContact O-N 3.1Å |
| 73 | L | 55.5 | Low | 53.9 | Low | 120 Ų | 120 | 131.9 Ų | 131.9 | 63% | 0.628 | 67% | 0.672 | S | S | * | * | H | α-helix | trans | -76.5 | -35.6 | 176.5 | -166.6 | 68.7 | 0 | 0 | 0 | 111.7 | I69 E70 V75 L76 T77 | I69-L73 WeakPolarHBondContact O-CB 3.19Å; I69-L73 PolarHBondContact O-N 2.9Å; E70-L73 PolarHBondContact O-N 3.46Å; L73-V75 VanDerWaalsContact C-N 3.34Å; L73-L76 PolarHBondContact O-N 3.22Å; L73-T77 PolarHBondContact O-N 3.49Å; L73-T77 VanDerWaalsContact O-N 3.1Å |
| 74 | I | 53.3 | Low | 53.8 | Low | 99 Ų | 99 | 128.2 Ų | 128.2 | 51% | 0.508 | 67% | 0.668 | S | S | . | * | H | α-helix | trans | -71.8 | -26.4 | 173.6 | 65.3 | 175.9 | 0 | 0 | 0 | 112.9 | E70 D71 | E70-I74 WeakPolarHBondContact O-CG1 3.5Å; E70-I74 WeakPolarHBondContact O-CG2 3.1Å; E70-I74 PolarHBondContact O-N 3.45Å; D71-I74 HydrophobicContact CB-CD1 4.49Å; D71-I74 WeakPolarHBondContact O-CG1 3.28Å |
| 75 | V | 54.3 | Low | 53.9 | Low | 113 Ų | 113 | 128.2 Ų | 128.2 | 69% | 0.685 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -74.6 | -37 | 173 | 141.6 | 0 | 0 | 0 | 0 | 111.7 | D71 L73 | D71-V75 PolarHBondContact O-N 2.91Å; L73-V75 VanDerWaalsContact C-N 3.34Å |
| 76 | L | 55.5 | Low | 54 | Low | 139 Ų | 139 | 126.8 Ų | 126.8 | 73% | 0.728 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -77.6 | -23.8 | 178.6 | -155.9 | 92.4 | 0 | 0 | 0 | 113.2 | G72 L73 K78 P79 | G72-L76 PolarHBondContact O-N 3.1Å; L73-L76 PolarHBondContact O-N 3.22Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.45Å; L76-P79 WeakPolarHBondContact O-CD 3.03Å |
| 77 | T | 53.7 | Low | 53.9 | Low | 109 Ų | 109 | 127.4 Ų | 127.4 | 67% | 0.669 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.2 | 1 | 179 | -158.6 | 0 | 0 | 0 | 0 | 114.4 | L73 | L73-T77 PolarHBondContact O-N 3.49Å; L73-T77 VanDerWaalsContact O-N 3.1Å |
| 78 | K | 54.7 | Low | 53.8 | Low | 186 Ų | 186 | 127.7 Ų | 127.7 | 81% | 0.809 | 69% | 0.691 | S | S | * | * | trans | -119.1 | 71.5 | 170 | -78.2 | -164.1 | 170.6 | 179.8 | 0 | 112.2 | L76 | L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.45Å | ||
| 79 | P | 53.7 | Low | 53.6 | Low | 97 Ų | 97 | 126.4 Ų | 126.4 | 63% | 0.63 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -117.9 | 132 | 135.1 | 34.2 | -28.4 | 0 | 0 | 0 | 109.3 | L76 | L76-P79 WeakPolarHBondContact O-CD 3.03Š|
| 80 | V | 51.8 | Low | 53.2 | Low | 152 Ų | 152 | 128.2 Ų | 128.2 | 92% | 0.921 | 71% | 0.708 | S | S | * | * | trans | 78.4 | 80.6 | 162.8 | 105.9 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 81 | A | 46 | Very low | 52.9 | Low | 103 Ų | 103 | 128.2 Ų | 128.2 | 85% | 0.851 | 72% | 0.717 | S | S | * | * | trans | -134.8 | 88.2 | 152.2 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 82 | K | 41.8 | Very low | 52.4 | Low | 277 Ų | 277 | 130.5 Ų | 130.5 | 100% | 1.204 | 73% | 0.732 | S | S | * | * | trans | 68 | 0 | 155.1 | -147.3 | 173.2 | -174.5 | -178.1 | 0 | 119.5 |
Retrieved 82 of 82 residues in 83.7 ms
(Link to these results)