| 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 | 41.8 | Very low | 55.7 | Low | 213 Ų | 213 | 125.5 Ų | 125.5 | 100% | 1.049 | 58% | 0.581 | S | S | * | * | 0 | 128.4 | 0 | -71.8 | 177.7 | 165.3 | 0 | 0 | 108.5 | |||||
| 2 | R | 47.6 | Very low | 56.2 | Low | 213 Ų | 213 | 123.6 Ų | 123.6 | 80% | 0.804 | 58% | 0.584 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -87.4 | 119.4 | 176.2 | -73 | 177.2 | 159.3 | 128.4 | -2.8 | 108 | F4 | R2-F4 HydrophobicContact CB-CE2 4.08Å |
| 3 | L | 46.8 | Very low | 56.7 | Low | 116 Ų | 116 | 121.9 Ų | 121.9 | 61% | 0.607 | 57% | 0.574 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -97.2 | 131.7 | 170.6 | -116.4 | 82.1 | 0 | 0 | 0 | 108.7 | F32 | L3-F32 HydrophobicContact CB-CB 3.87Å; L3-F32 PolarHBondContact N-O 3.48Å; L3-F32 WeakPolarHBondContact O-CA 3.29Å; L3-F32 VanDerWaalsContact O-CB 3.29Å; L3-F32 WeakPolarHBondContact O-CB 3.31Å; L3-F32 PolarHBondContact O-N 2.87Å |
| 4 | F | 55.9 | Low | 57 | Low | 133 Ų | 133 | 119.7 Ų | 119.7 | 58% | 0.583 | 59% | 0.587 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -109.7 | 134.8 | 168.1 | -64.3 | -85.4 | 0 | 0 | 0 | 107.7 | R2 R31 | R2-F4 HydrophobicContact CB-CE2 4.08Å; F4-R31 HydrophobicContact CD1-CG 4.35Å; F4-R31 HydrophobicContact CE1-CG 4.14Å |
| 5 | G | 60.6 | Low | 57 | Low | 23 Ų | 23 | 116.7 Ų | 116.7 | 24% | 0.237 | 58% | 0.578 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -138.3 | 143.2 | 173.5 | 0 | 0 | 0 | 0 | 0 | 110.6 | I30 | G5-I30 PolarHBondContact N-O 2.86Å; G5-I30 PolarHBondContact O-N 3.33Å |
| 6 | W | 60 | Low | 57.2 | Low | 169 Ų | 169 | 114.7 Ų | 114.7 | 64% | 0.64 | 60% | 0.596 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.4 | 122.2 | 171.1 | -67.7 | 95.8 | 0 | 0 | 0 | 108.3 | L8 K27 Q29 | W6-L8 HydrophobicContact CB-CD1 4.08Å; W6-K27 HydrophobicContact CE3-CB 4.36Å; W6-K27 HydrophobicContact CZ3-CB 4.32Å; W6-Q29 HydrophobicContact CE3-CB 4.27Å; W6-Q29 HydrophobicContact CH2-CB 4.2Å; W6-Q29 HydrophobicContact CH2-CG 4.4Å; W6-Q29 HydrophobicContact CZ3-CB 3.91Å; W6-Q29 HydrophobicContact CZ3-CG 4.5Å |
| 7 | L | 60.1 | Low | 57.4 | Low | 102 Ų | 102 | 116.8 Ų | 116.8 | 53% | 0.534 | 61% | 0.608 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -92.9 | 108.3 | 166.5 | -170.7 | 74.8 | 0 | 0 | 0 | 107.4 | R9 R28 I30 | L7-R9 PolarHBondContact O-N 2.81Å; L7-R28 PolarHBondContact N-O 3.25Å; L7-R28 VanDerWaalsContact N-O 3.17Å; L7-R28 PolarHBondContact O-N 3.2Å; L7-I30 HydrophobicContact CB-CD1 3.38Å; L7-I30 HydrophobicContact CB-CG1 3.93Å; L7-I30 HydrophobicContact CD2-CD1 3.75Å; L7-I30 HydrophobicContact CG-CD1 4.09Å |
| 8 | L | 59 | Low | 57.5 | Low | 97 Ų | 97 | 114.7 Ų | 114.7 | 51% | 0.508 | 62% | 0.62 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -80.8 | 109.2 | 168.7 | -93.1 | 56.7 | 0 | 0 | 0 | 107.7 | W6 F25 | W6-L8 HydrophobicContact CB-CD1 4.08Å; L8-F25 HydrophobicContact CB-CZ 4.16Å; L8-F25 HydrophobicContact CD1-CE1 4.35Å; L8-F25 HydrophobicContact CD2-CE1 3.8Å; L8-F25 HydrophobicContact CD2-CE2 4.14Å; L8-F25 HydrophobicContact CD2-CZ 3.21Å; L8-F25 HydrophobicContact CG-CE1 3.55Å; L8-F25 HydrophobicContact CG-CE2 4.25Å; L8-F25 HydrophobicContact CG-CZ 3.36Å |
| 9 | R | 59.6 | Low | 57.6 | Low | 134 Ų | 134 | 114.7 Ų | 114.7 | 51% | 0.506 | 63% | 0.63 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -99.7 | 104 | 167.9 | -170 | 178.7 | -169.1 | 169.7 | 5.7 | 108 | L7 R11 E26 | L7-R9 PolarHBondContact O-N 2.81Å; R9-R11 HydrophobicContact CG-CG 4.44Å; R9-R11 VanDerWaalsContact NH2-NH2 3.15Å; R9-E26 PolarHBondContact N-O 2.99Å; R9-E26 PolarHBondContact O-N 2.81Å |
| 10 | S | 60.9 | Low | 57.3 | Low | 73 Ų | 73 | 118 Ų | 118 | 51% | 0.51 | 63% | 0.632 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -84 | 121.7 | 167.8 | -55.9 | 0 | 0 | 0 | 0 | 108.5 | F25 | S10-F25 WeakPolarHBondContact OG-CE2 3.22Å |
| 11 | R | 60.1 | Low | 57.4 | Low | 108 Ų | 108 | 117.4 Ų | 117.4 | 41% | 0.408 | 63% | 0.633 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -111.4 | 112 | 166.4 | -74.9 | -174.4 | 165.6 | -175.5 | -6.9 | 108.3 | R9 F13 H24 | R9-R11 HydrophobicContact CG-CG 4.44Å; R9-R11 VanDerWaalsContact NH2-NH2 3.15Å; R11-F13 HydrophobicContact CB-CD2 4.22Å; R11-F13 HydrophobicContact CB-CE2 3.54Å; R11-F13 HydrophobicContact CB-CZ 3.91Å; R11-F13 HydrophobicContact CG-CE2 4.48Å; R11-F13 HydrophobicContact CG-CZ 4.43Å; R11-H24 PolarHBondContact N-O 3.39Å; R11-H24 PolarHBondContact O-N 3.12Å |
| 12 | T | 62.3 | Low | 58.2 | Low | 102 Ų | 102 | 112.8 Ų | 112.8 | 63% | 0.626 | 61% | 0.608 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -88.2 | 119.7 | 167.6 | 30.2 | 0 | 0 | 0 | 0 | 108.6 | V21 | T12-V21 HydrophobicContact CG2-CG1 3.97Å |
| 13 | F | 62.6 | Low | 58.7 | Low | 102 Ų | 102 | 106 Ų | 106 | 45% | 0.447 | 59% | 0.594 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -104.5 | 123.5 | 171.6 | -62.3 | -85.5 | 0 | 0 | 0 | 108.5 | R11 H22 H24 | R11-F13 HydrophobicContact CB-CD2 4.22Å; R11-F13 HydrophobicContact CB-CE2 3.54Å; R11-F13 HydrophobicContact CB-CZ 3.91Å; R11-F13 HydrophobicContact CG-CE2 4.48Å; R11-F13 HydrophobicContact CG-CZ 4.43Å; F13-H22 PolarHBondContact N-O 2.96Å; F13-H22 PolarHBondContact O-N 3.28Å; F13-H24 HydrophobicContact CE2-CB 4.19Å |
| 14 | A | 60.4 | Low | 59.4 | Low | 91 Ų | 91 | 104.9 Ų | 104.9 | 75% | 0.752 | 59% | 0.585 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -82.3 | 116 | 164.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||
| 15 | T | 57.3 | Low | 59.7 | Low | 74 Ų | 74 | 103 Ų | 103 | 45% | 0.454 | 58% | 0.577 | S | S | . | * | trans | -74.5 | 135.2 | 167.3 | 44.2 | 0 | 0 | 0 | 0 | 108.6 | N17 G18 R20 | T15-N17 PolarHBondContact O-N 2.72Å; T15-G18 PolarHBondContact O-N 2.83Å; T15-R20 PolarHBondContact N-O 3.24Å; T15-R20 PolarHBondContact OG1-O 3.24Å | ||
| 16 | G | 60.4 | Low | 59.5 | Low | 85 Ų | 85 | 105.3 Ų | 105.3 | 88% | 0.876 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.4 | 4.7 | -173 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||
| 17 | N | 60.2 | Low | 59.6 | Low | 150 Ų | 150 | 104.3 Ų | 104.3 | 80% | 0.802 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.8 | 20 | 177.5 | -82.6 | 7.2 | 0 | 0 | 0 | 113.7 | T15 S19 | T15-N17 PolarHBondContact O-N 2.72Å; N17-S19 PolarHBondContact O-N 2.76Å; N17-S19 PolarHBondContact O-OG 3.25Å |
| 18 | G | 59.6 | Low | 59.7 | Low | 80 Ų | 80 | 108.1 Ų | 108.1 | 83% | 0.825 | 59% | 0.589 | S | S | * | * | S | Bend | trans | 67.5 | -0.8 | 165.8 | 0 | 0 | 0 | 0 | 0 | 117.5 | T15 | T15-G18 PolarHBondContact O-N 2.83Š|
| 19 | S | 59.1 | Low | 59.9 | Low | 114 Ų | 114 | 109 Ų | 109 | 80% | 0.797 | 59% | 0.591 | S | S | * | * | S | Bend | trans | -129.6 | 0.3 | -170.2 | -50.8 | 0 | 0 | 0 | 0 | 116.1 | N17 | N17-S19 PolarHBondContact O-N 2.76Å; N17-S19 PolarHBondContact O-OG 3.25Å |
| 20 | R | 51.4 | Low | 60.1 | Low | 181 Ų | 181 | 105.4 Ų | 105.4 | 68% | 0.683 | 58% | 0.581 | S | S | * | * | trans | -145.1 | 107.5 | -178.1 | -141.3 | 170.7 | -177.3 | 179.5 | 0.9 | 113 | T15 | T15-R20 PolarHBondContact N-O 3.24Å; T15-R20 PolarHBondContact OG1-O 3.24Å | ||
| 21 | V | 59.4 | Low | 60 | Low | 106 Ų | 106 | 111.1 Ų | 111.1 | 64% | 0.642 | 59% | 0.591 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -87.4 | 116.7 | 167.2 | -178.9 | 0 | 0 | 0 | 0 | 107.6 | T12 | T12-V21 HydrophobicContact CG2-CG1 3.97Å |
| 22 | H | 58.8 | Low | 59.7 | Low | 115 Ų | 115 | 111.1 Ų | 111.1 | 53% | 0.532 | 59% | 0.594 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -97.6 | 120.7 | 172.7 | -131.6 | 99.6 | 0 | 0 | 0 | 108.4 | F13 | F13-H22 PolarHBondContact N-O 2.96Å; F13-H22 PolarHBondContact O-N 3.28Å |
| 23 | S | 59.2 | Low | 59.1 | Low | 72 Ų | 72 | 111 Ų | 111 | 50% | 0.503 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.4 | 107.9 | 172.9 | -167.9 | 0 | 0 | 0 | 0 | 108.2 | ||
| 24 | H | 61.4 | Low | 58.4 | Low | 92 Ų | 92 | 110 Ų | 110 | 43% | 0.426 | 61% | 0.609 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -93.1 | 124.5 | 172.7 | -173.7 | -101.5 | 0 | 0 | 0 | 108.9 | R11 F13 E26 | R11-H24 PolarHBondContact N-O 3.39Å; R11-H24 PolarHBondContact O-N 3.12Å; F13-H24 HydrophobicContact CE2-CB 4.19Å; H24-E26 WeakPolarHBondContact CE1-CG 3.43Å; H24-E26 IonicContact CE1-OE1 3.52Å; H24-E26 WeakPolarHBondContact ND1-CG 3.19Å |
| 25 | F | 61 | Low | 57.9 | Low | 94 Ų | 94 | 112.7 Ų | 112.7 | 41% | 0.412 | 61% | 0.605 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -111.9 | 103.5 | -174.5 | -154.4 | -99.3 | 0 | 0 | 0 | 110.1 | L8 S10 K27 | L8-F25 HydrophobicContact CB-CZ 4.16Å; L8-F25 HydrophobicContact CD1-CE1 4.35Å; L8-F25 HydrophobicContact CD2-CE1 3.8Å; L8-F25 HydrophobicContact CD2-CE2 4.14Å; L8-F25 HydrophobicContact CD2-CZ 3.21Å; L8-F25 HydrophobicContact CG-CE1 3.55Å; L8-F25 HydrophobicContact CG-CE2 4.25Å; L8-F25 HydrophobicContact CG-CZ 3.36Å; S10-F25 WeakPolarHBondContact OG-CE2 3.22Å; F25-K27 HydrophobicContact CD1-CG 3.91Å; F25-K27 HydrophobicContact CE1-CG 3.94Å |
| 26 | E | 56.2 | Low | 57.4 | Low | 71 Ų | 71 | 114 Ų | 114 | 33% | 0.332 | 62% | 0.618 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -94 | 114.4 | 173.9 | -66.8 | -169.9 | 143.2 | 0 | 0 | 109.7 | R9 H24 | R9-E26 PolarHBondContact N-O 2.99Å; R9-E26 PolarHBondContact O-N 2.81Å; H24-E26 WeakPolarHBondContact CE1-CG 3.43Å; H24-E26 IonicContact CE1-OE1 3.52Å; H24-E26 WeakPolarHBondContact ND1-CG 3.19Å |
| 27 | K | 63.2 | Low | 56.8 | Low | 148 Ų | 148 | 114 Ų | 114 | 64% | 0.643 | 60% | 0.597 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -88.1 | 107.4 | 166.5 | -65.6 | -178.9 | -176.8 | 176.6 | 0 | 108 | W6 F25 | W6-K27 HydrophobicContact CE3-CB 4.36Å; W6-K27 HydrophobicContact CZ3-CB 4.32Å; F25-K27 HydrophobicContact CD1-CG 3.91Å; F25-K27 HydrophobicContact CE1-CG 3.94Å |
| 28 | R | 61.8 | Low | 56.2 | Low | 181 Ų | 181 | 116.2 Ų | 116.2 | 68% | 0.683 | 60% | 0.6 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -109.9 | 124.5 | 168.7 | -81.6 | -175.4 | 166.4 | -157.9 | -2.6 | 109.9 | L7 I30 | L7-R28 PolarHBondContact N-O 3.25Å; L7-R28 VanDerWaalsContact N-O 3.17Å; L7-R28 PolarHBondContact O-N 3.2Å; R28-I30 PolarHBondContact O-N 3.1Å |
| 29 | Q | 62.9 | Low | 55.7 | Low | 117 Ų | 117 | 122.2 Ų | 122.2 | 55% | 0.547 | 60% | 0.597 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -73.8 | 119.6 | 172.4 | -168 | -178.3 | 19.1 | 0 | 0 | 108.5 | W6 | W6-Q29 HydrophobicContact CE3-CB 4.27Å; W6-Q29 HydrophobicContact CH2-CB 4.2Å; W6-Q29 HydrophobicContact CH2-CG 4.4Å; W6-Q29 HydrophobicContact CZ3-CB 3.91Å; W6-Q29 HydrophobicContact CZ3-CG 4.5Å |
| 30 | I | 64.6 | Low | 54.8 | Low | 57 Ų | 57 | 128.6 Ų | 128.6 | 29% | 0.292 | 61% | 0.606 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -102.7 | 125.4 | 174.4 | -55.4 | -169 | 0 | 0 | 0 | 108.5 | G5 L7 R28 F32 | G5-I30 PolarHBondContact N-O 2.86Å; G5-I30 PolarHBondContact O-N 3.33Å; L7-I30 HydrophobicContact CB-CD1 3.38Å; L7-I30 HydrophobicContact CB-CG1 3.93Å; L7-I30 HydrophobicContact CD2-CD1 3.75Å; L7-I30 HydrophobicContact CG-CD1 4.09Å; R28-I30 PolarHBondContact O-N 3.1Å; I30-F32 HydrophobicContact CB-CE2 4.02Å; I30-F32 HydrophobicContact CB-CZ 4.36Å; I30-F32 HydrophobicContact CG2-CD2 4.19Å; I30-F32 HydrophobicContact CG2-CE1 4.3Å; I30-F32 HydrophobicContact CG2-CE2 3.84Å; I30-F32 HydrophobicContact CG2-CZ 3.9Å |
| 31 | R | 58.4 | Low | 54.6 | Low | 194 Ų | 194 | 124 Ų | 124 | 73% | 0.732 | 61% | 0.607 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -89.2 | 109.9 | 170.8 | -63 | -176.8 | -129.2 | 175.2 | 2.2 | 107.6 | F4 S33 | F4-R31 HydrophobicContact CD1-CG 4.35Å; F4-R31 HydrophobicContact CE1-CG 4.14Å; R31-S33 PolarHBondContact O-N 2.84Å |
| 32 | F | 52.7 | Low | 53.8 | Low | 107 Ų | 107 | 128.2 Ų | 128.2 | 47% | 0.469 | 62% | 0.619 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -86 | 94.1 | 168.7 | -62.2 | -91.6 | 0 | 0 | 0 | 107.7 | L3 I30 A34 | L3-F32 HydrophobicContact CB-CB 3.87Å; L3-F32 PolarHBondContact N-O 3.48Å; L3-F32 WeakPolarHBondContact O-CA 3.29Å; L3-F32 VanDerWaalsContact O-CB 3.29Å; L3-F32 WeakPolarHBondContact O-CB 3.31Å; L3-F32 PolarHBondContact O-N 2.87Å; I30-F32 HydrophobicContact CB-CE2 4.02Å; I30-F32 HydrophobicContact CB-CZ 4.36Å; I30-F32 HydrophobicContact CG2-CD2 4.19Å; I30-F32 HydrophobicContact CG2-CE1 4.3Å; I30-F32 HydrophobicContact CG2-CE2 3.84Å; I30-F32 HydrophobicContact CG2-CZ 3.9Å; F32-A34 PolarHBondContact O-N 3.19Å |
| 33 | S | 50.3 | Low | 53.1 | Low | 100 Ų | 100 | 127.9 Ų | 127.9 | 70% | 0.699 | 63% | 0.63 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -78.8 | 99.2 | 164.6 | -69.6 | 0 | 0 | 0 | 0 | 107.6 | R31 H35 | R31-S33 PolarHBondContact O-N 2.84Å; S33-H35 PolarHBondContact O-N 2.93Å |
| 34 | A | 49.3 | Very low | 52.7 | Low | 82 Ų | 82 | 135.6 Ų | 135.6 | 68% | 0.678 | 65% | 0.648 | S | S | * | * | trans | -69.1 | 70.7 | 160 | 0 | 0 | 0 | 0 | 0 | 108.1 | F32 S36 | F32-A34 PolarHBondContact O-N 3.19Å; A34-S36 PolarHBondContact O-N 3.44Å | ||
| 35 | H | 48 | Very low | 51.8 | Low | 146 Ų | 146 | 142 Ų | 142 | 68% | 0.676 | 68% | 0.675 | S | S | * | * | trans | -75.8 | 106.1 | 162.8 | -147.3 | -124.7 | 0 | 0 | 0 | 104.8 | S33 D37 | S33-H35 PolarHBondContact O-N 2.93Å; H35-D37 IonicContact CE1-OD2 3.24Å; H35-D37 PolarHBondContact CE1-OD2 3.28Å; H35-D37 VanDerWaalsContact CE1-OD2 3.24Å; H35-D37 IonicContact CG-OD2 3.97Å; H35-D37 IonicContact ND1-OD2 2.72Å; H35-D37 PolarHBondContact ND1-OD2 3.01Å; H35-D37 PolarHBondContact O-N 2.86Å | ||
| 36 | S | 47.5 | Very low | 51.2 | Low | 103 Ų | 103 | 140.4 Ų | 140.4 | 72% | 0.72 | 69% | 0.686 | S | S | * | * | trans | -64.9 | 63.9 | 163.9 | 169.4 | 0 | 0 | 0 | 0 | 108.3 | A34 K38 | A34-S36 PolarHBondContact O-N 3.44Å; S36-K38 PolarHBondContact O-N 3.35Å; S36-K38 VanDerWaalsContact O-N 3.12Å | ||
| 37 | D | 48.8 | Very low | 50.2 | Low | 84 Ų | 84 | 148.6 Ų | 148.6 | 45% | 0.449 | 71% | 0.714 | S | S | . | * | trans | -79.7 | 95.5 | 171.9 | -130.6 | -56.8 | 0 | 0 | 0 | 106.9 | H35 R39 | H35-D37 IonicContact CE1-OD2 3.24Å; H35-D37 PolarHBondContact CE1-OD2 3.28Å; H35-D37 VanDerWaalsContact CE1-OD2 3.24Å; H35-D37 IonicContact CG-OD2 3.97Å; H35-D37 IonicContact ND1-OD2 2.72Å; H35-D37 PolarHBondContact ND1-OD2 3.01Å; H35-D37 PolarHBondContact O-N 2.86Å; D37-R39 PolarHBondContact O-N 3.44Å; D37-R39 VanDerWaalsContact OD1-CD 3.22Å; D37-R39 WeakPolarHBondContact OD1-CD 3.25Å; D37-R39 WeakPolarHBondContact OD1-CG 3.41Å; D37-R39 IonicContact OD1-NE 3.8Å | ||
| 38 | K | 47.3 | Very low | 49.3 | Very low | 196 Ų | 196 | 150 Ų | 150 | 85% | 0.852 | 73% | 0.727 | S | S | * | * | trans | -66 | 44.6 | 166.2 | -73.5 | -178.9 | 173.3 | 178.3 | 0 | 111.1 | S36 | S36-K38 PolarHBondContact O-N 3.35Å; S36-K38 VanDerWaalsContact O-N 3.12Å | ||
| 39 | R | 48.5 | Very low | 48.1 | Very low | 206 Ų | 206 | 150.6 Ų | 150.6 | 78% | 0.777 | 74% | 0.738 | S | S | * | * | trans | -111.9 | 69.1 | 173.2 | -70.5 | -175.4 | 177.6 | -170.4 | -0.9 | 108.3 | D37 A41 | D37-R39 PolarHBondContact O-N 3.44Å; D37-R39 VanDerWaalsContact OD1-CD 3.22Å; D37-R39 WeakPolarHBondContact OD1-CD 3.25Å; D37-R39 WeakPolarHBondContact OD1-CG 3.41Å; D37-R39 IonicContact OD1-NE 3.8Å; R39-A41 PolarHBondContact O-N 3.46Å | ||
| 40 | Y | 40.4 | Very low | 47.1 | Very low | 248 Ų | 248 | 148.1 Ų | 148.1 | 97% | 0.973 | 74% | 0.744 | S | S | * | * | trans | -62.3 | 83.6 | 154.3 | -105.7 | -97.3 | 0 | 0 | 0 | 107.2 | ||||
| 41 | A | 46.2 | Very low | 46 | Very low | 86 Ų | 86 | 154 Ų | 154 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | trans | -125.6 | 98.6 | 168.6 | 0 | 0 | 0 | 0 | 0 | 107 | R39 | R39-A41 PolarHBondContact O-N 3.46Š| ||
| 42 | H | 43.7 | Very low | 45.3 | Very low | 193 Ų | 193 | 151 Ų | 151 | 89% | 0.894 | 77% | 0.773 | S | S | * | * | trans | -33.9 | 147.5 | 153.6 | -137.3 | -91.9 | 0 | 0 | 0 | 111.1 | ||||
| 43 | S | 45 | Very low | 44.6 | Very low | 109 Ų | 109 | 149.4 Ų | 149.4 | 76% | 0.762 | 79% | 0.787 | S | S | * | * | trans | 100.1 | 88.2 | 164.3 | -153 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 44 | R | 49 | Very low | 44.5 | Very low | 233 Ų | 233 | 151.5 Ų | 151.5 | 88% | 0.879 | 80% | 0.795 | S | S | * | * | -176.4 | 98.7 | 115 | -107.3 | 175.4 | 170.1 | 174.5 | -3.3 | 110.4 | G46 | R44-G46 PolarHBondContact O-N 3.45Š| |||
| 45 | F | 43 | Very low | 44.3 | Very low | 226 Ų | 226 | 155 Ų | 155 | 99% | 0.991 | 80% | 0.802 | S | S | * | * | trans | -59 | 112.3 | 147.4 | -89.1 | -100.5 | 0 | 0 | 0 | 107 | ||||
| 46 | G | 48.2 | Very low | 43.9 | Very low | 62 Ų | 62 | 157 Ų | 157 | 64% | 0.639 | 81% | 0.811 | S | S | * | * | trans | -139.3 | 97.4 | -176.1 | 0 | 0 | 0 | 0 | 0 | 110.4 | R44 | R44-G46 PolarHBondContact O-N 3.45Š| ||
| 47 | R | 36.4 | Very low | 44 | Very low | 243 Ų | 243 | 157.6 Ų | 157.6 | 92% | 0.917 | 81% | 0.81 | S | S | * | * | trans | 0.2 | 112.6 | 162.7 | -68.1 | 176.4 | 178.7 | 174.6 | -1.7 | 116.2 | ||||
| 48 | L | 44.6 | Very low | 43.9 | Very low | 177 Ų | 177 | 164.6 Ų | 164.6 | 93% | 0.927 | 83% | 0.83 | S | S | * | * | trans | -127 | 86.1 | 148.6 | -90.9 | 159.9 | 0 | 0 | 0 | 108 | ||||
| 49 | Q | 36.6 | Very low | 43.8 | Very low | 194 Ų | 194 | 163.3 Ų | 163.3 | 91% | 0.907 | 83% | 0.827 | S | S | * | * | trans | -74.7 | 117 | 163.5 | -174.9 | 177 | 24.4 | 0 | 0 | 106.4 | ||||
| 50 | G | 40.4 | Very low | 43.7 | Very low | 65 Ų | 65 | 162.7 Ų | 162.7 | 67% | 0.67 | 83% | 0.83 | S | S | * | * | trans | 170.5 | 101.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 51 | Q | 43 | Very low | 44.2 | Very low | 181 Ų | 181 | 156 Ų | 156 | 85% | 0.846 | 81% | 0.814 | S | S | * | * | trans | 79.1 | 103.5 | 148.2 | -69.6 | 178.2 | -24.7 | 0 | 0 | 118.8 | ||||
| 52 | T | 43.2 | Very low | 44.1 | Very low | 131 Ų | 131 | 157.6 Ų | 157.6 | 80% | 0.804 | 82% | 0.815 | S | S | * | * | 65.8 | 96.9 | 126.9 | 55.3 | 0 | 0 | 0 | 0 | 118.2 | |||||
| 53 | G | 37.9 | Very low | 44.2 | Very low | 73 Ų | 73 | 156.4 Ų | 156.4 | 75% | 0.753 | 81% | 0.81 | S | S | * | * | 63.3 | 89.8 | 127.5 | 0 | 0 | 0 | 0 | 0 | 117 | |||||
| 54 | T | 47.3 | Very low | 44.4 | Very low | 143 Ų | 143 | 156.1 Ų | 156.1 | 88% | 0.877 | 81% | 0.814 | S | S | * | * | trans | -165.8 | 119.6 | 138.1 | -0.3 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 55 | L | 45.6 | Very low | 44.2 | Very low | 155 Ų | 155 | 147.6 Ų | 147.6 | 81% | 0.812 | 79% | 0.794 | S | S | * | * | trans | 18.9 | 116.4 | 155.3 | -98.7 | 76.5 | 0 | 0 | 0 | 118.7 | V57 | L55-V57 PolarHBondContact O-N 3Š| ||
| 56 | H | 39.1 | Very low | 44.7 | Very low | 188 Ų | 188 | 144.7 Ų | 144.7 | 87% | 0.87 | 78% | 0.781 | S | S | * | * | trans | -12.9 | 95.4 | 142.6 | -93.3 | 129.4 | 0 | 0 | 0 | 114.7 | ||||
| 57 | V | 50 | Low | 45 | Very low | 116 Ų | 116 | 147.3 Ų | 147.3 | 70% | 0.703 | 79% | 0.787 | S | S | * | * | trans | -107.1 | 107.5 | 148.1 | -177.1 | 0 | 0 | 0 | 0 | 105.2 | L55 H59 | L55-V57 PolarHBondContact O-N 3Å; V57-H59 VanDerWaalsContact C-N 3.26Å; V57-H59 PolarHBondContact O-N 3.11Å | ||
| 58 | R | 46.1 | Very low | 45.9 | Very low | 232 Ų | 232 | 143.8 Ų | 143.8 | 88% | 0.875 | 78% | 0.78 | S | S | * | * | trans | -53.3 | 94 | 167.5 | -85.5 | 174.8 | 146.7 | 179 | -5.8 | 108 | K60 | R58-K60 PolarHBondContact O-N 2.98Š| ||
| 59 | H | 45.7 | Very low | 46.1 | Very low | 168 Ų | 168 | 141.1 Ų | 141.1 | 78% | 0.778 | 76% | 0.763 | S | S | * | * | trans | -64.8 | 85.7 | 154 | -75.1 | 156.1 | 0 | 0 | 0 | 106.3 | V57 V61 | V57-H59 VanDerWaalsContact C-N 3.26Å; V57-H59 PolarHBondContact O-N 3.11Å; H59-V61 HydrophobicContact CB-CG2 4.18Å; H59-V61 PolarHBondContact O-N 2.77Å | ||
| 60 | K | 45.8 | Very low | 46.8 | Very low | 193 Ų | 193 | 139.6 Ų | 139.6 | 84% | 0.839 | 75% | 0.75 | S | S | * | * | trans | -70.4 | 76.4 | 158.2 | -155.9 | 177.3 | -173.2 | -176.3 | 0 | 105.3 | R58 V62 | R58-K60 PolarHBondContact O-N 2.98Å; K60-V62 PolarHBondContact O-N 3.17Å | ||
| 61 | V | 50.7 | Low | 47.5 | Very low | 107 Ų | 107 | 138.7 Ų | 138.7 | 65% | 0.648 | 74% | 0.74 | S | S | * | * | trans | -52.2 | 110.2 | 164 | 176.7 | 0 | 0 | 0 | 0 | 104.2 | H59 E63 | H59-V61 HydrophobicContact CB-CG2 4.18Å; H59-V61 PolarHBondContact O-N 2.77Å; V61-E63 PolarHBondContact O-N 3.3Å | ||
| 62 | V | 44 | Very low | 48.3 | Very low | 120 Ų | 120 | 135.4 Ų | 135.4 | 73% | 0.727 | 73% | 0.725 | S | S | * | * | trans | -65.5 | 93.7 | 167.1 | 167.9 | 0 | 0 | 0 | 0 | 105.2 | K60 A64 | K60-V62 PolarHBondContact O-N 3.17Å; V62-A64 PolarHBondContact O-N 3.47Å | ||
| 63 | E | 46.9 | Very low | 49.1 | Very low | 169 Ų | 169 | 134.1 Ų | 134.1 | 79% | 0.79 | 71% | 0.712 | S | S | * | * | trans | -35.7 | 121.2 | 160.9 | -95.2 | 166.1 | 114.2 | 0 | 0 | 110.6 | V61 A65 | V61-E63 PolarHBondContact O-N 3.3Å; E63-A65 PolarHBondContact O-N 2.97Å | ||
| 64 | A | 48.9 | Very low | 50.2 | Low | 103 Ų | 103 | 135 Ų | 135 | 85% | 0.851 | 70% | 0.703 | S | S | * | * | trans | 54.7 | 35.2 | 138 | 0 | 0 | 0 | 0 | 0 | 118.4 | V62 K66 | V62-A64 PolarHBondContact O-N 3.47Å; A64-K66 PolarHBondContact O-N 3.44Å | ||
| 65 | A | 45.4 | Very low | 51 | Low | 54 Ų | 54 | 134.4 Ų | 134.4 | 45% | 0.446 | 69% | 0.69 | S | S | . | * | trans | -82.1 | 97.9 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | E63 | E63-A65 PolarHBondContact O-N 2.97Š| ||
| 66 | K | 52.3 | Low | 51.9 | Low | 165 Ų | 165 | 135.8 Ų | 135.8 | 72% | 0.717 | 69% | 0.685 | S | S | * | * | trans | 7.1 | 130.4 | 164 | -65.7 | 175.3 | 179.9 | 178.9 | 0 | 117.5 | A64 H68 H69 | A64-K66 PolarHBondContact O-N 3.44Å; K66-H68 PolarHBondContact O-N 3.44Å; K66-H69 PolarHBondContact O-N 3.39Å; K66-H69 VanDerWaalsContact O-N 3.1Å | ||
| 67 | P | 55.6 | Low | 53.2 | Low | 117 Ų | 117 | 131.9 Ų | 131.9 | 76% | 0.76 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.4 | -16.3 | -173.3 | 21.8 | -32.6 | 0 | 0 | 0 | 115.9 | H69 | P67-H69 PolarHBondContact O-N 2.98Š|
| 68 | H | 53.8 | Low | 54 | Low | 169 Ų | 169 | 132.3 Ų | 132.3 | 78% | 0.782 | 66% | 0.663 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.8 | -19.9 | 177.2 | -81.5 | -85.7 | 0 | 0 | 0 | 114.9 | K66 | K66-H68 PolarHBondContact O-N 3.44Š|
| 69 | H | 50.2 | Low | 55 | Low | 121 Ų | 121 | 129.9 Ų | 129.9 | 56% | 0.56 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -87.7 | -20 | 179.4 | -89.8 | 125.4 | 0 | 0 | 0 | 114.2 | K66 P67 G71 Q72 L73 | K66-H69 PolarHBondContact O-N 3.39Å; K66-H69 VanDerWaalsContact O-N 3.1Å; P67-H69 PolarHBondContact O-N 2.98Å; H69-G71 VanDerWaalsContact C-N 3.34Å; H69-G71 PolarHBondContact O-N 3.31Å; H69-Q72 PolarHBondContact O-N 2.96Å; H69-L73 PolarHBondContact O-N 3.47Å |
| 70 | Y | 51.2 | Low | 56.1 | Low | 162 Ų | 162 | 126.9 Ų | 126.9 | 64% | 0.635 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -67.6 | -32.6 | 178.4 | -99.2 | -92.5 | 0 | 0 | 0 | 112.7 | Q72 L73 V74 | Y70-Q72 PolarHBondContact O-N 3.48Å; Y70-L73 PolarHBondContact O-N 2.99Å; Y70-V74 VanDerWaalsContact O-CG2 3.31Å; Y70-V74 WeakPolarHBondContact O-CG2 3.41Å; Y70-V74 PolarHBondContact O-N 3.47Å |
| 71 | G | 55.2 | Low | 57.3 | Low | 46 Ų | 46 | 119.5 Ų | 119.5 | 47% | 0.474 | 62% | 0.622 | S | S | . | * | H | α-helix | trans | -63.4 | -38.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | H69 Q75 | H69-G71 VanDerWaalsContact C-N 3.34Å; H69-G71 PolarHBondContact O-N 3.31Å; G71-Q75 PolarHBondContact O-N 2.89Å; G71-Q75 VanDerWaalsContact O-N 3.11Å |
| 72 | Q | 59.6 | Low | 58.1 | Low | 112 Ų | 112 | 118.6 Ų | 118.6 | 52% | 0.523 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -71.9 | -35.2 | 177 | -66.9 | -175.6 | -3.8 | 0 | 0 | 112 | H69 Y70 Q75 R76 | H69-Q72 PolarHBondContact O-N 2.96Å; Y70-Q72 PolarHBondContact O-N 3.48Å; Q72-Q75 PolarHBondContact O-N 2.89Å; Q72-R76 WeakPolarHBondContact O-CG 3.32Å; Q72-R76 PolarHBondContact O-N 3.19Å |
| 73 | L | 60.6 | Low | 59.2 | Low | 103 Ų | 103 | 122.3 Ų | 122.3 | 54% | 0.539 | 61% | 0.614 | S | S | . | * | H | α-helix | trans | -70.5 | -40 | 179.8 | -152.3 | 130.3 | 0 | 0 | 0 | 111.2 | H69 Y70 R76 I77 | H69-L73 PolarHBondContact O-N 3.47Å; Y70-L73 PolarHBondContact O-N 2.99Å; L73-R76 PolarHBondContact O-N 2.91Å; L73-I77 HydrophobicContact CD2-CD1 3.69Å; L73-I77 VanDerWaalsContact O-CG1 3.32Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.03Å |
| 74 | V | 60.7 | Low | 60.1 | Low | 91 Ų | 91 | 119 Ų | 119 | 55% | 0.552 | 60% | 0.601 | S | S | * | * | H | α-helix | trans | -64.6 | -41.8 | 173.1 | 174.8 | 0 | 0 | 0 | 0 | 111.4 | Y70 R76 I77 H78 | Y70-V74 VanDerWaalsContact O-CG2 3.31Å; Y70-V74 WeakPolarHBondContact O-CG2 3.41Å; Y70-V74 PolarHBondContact O-N 3.47Å; V74-R76 PolarHBondContact O-N 3.24Å; V74-I77 PolarHBondContact O-N 3.25Å; V74-H78 WeakPolarHBondContact O-CB 3.32Å; V74-H78 PolarHBondContact O-N 3.33Å |
| 75 | Q | 62.8 | Low | 60.6 | Low | 131 Ų | 131 | 120.5 Ų | 120.5 | 61% | 0.612 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -63.2 | -38.7 | 174.1 | -82.8 | -171.9 | -5.6 | 0 | 0 | 113 | G71 Q72 H78 R79 | G71-Q75 PolarHBondContact O-N 2.89Å; G71-Q75 VanDerWaalsContact O-N 3.11Å; Q72-Q75 PolarHBondContact O-N 2.89Å; Q75-H78 PolarHBondContact O-N 3.5Å; Q75-R79 PolarHBondContact O-N 3.01Å |
| 76 | R | 65.4 | Low | 61.5 | Low | 185 Ų | 185 | 124.9 Ų | 124.9 | 70% | 0.698 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -66.8 | -42.1 | 176.7 | -77.2 | -175.4 | -178.8 | -161.8 | 2 | 111.9 | Q72 L73 V74 R79 L80 | Q72-R76 WeakPolarHBondContact O-CG 3.32Å; Q72-R76 PolarHBondContact O-N 3.19Å; L73-R76 PolarHBondContact O-N 2.91Å; V74-R76 PolarHBondContact O-N 3.24Å; R76-R79 PolarHBondContact O-N 2.99Å; R76-L80 PolarHBondContact O-N 3.41Å |
| 77 | I | 66.6 | Low | 61.9 | Low | 105 Ų | 105 | 120.5 Ų | 120.5 | 54% | 0.538 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.7 | -41.9 | 176 | -66.8 | 169.4 | 0 | 0 | 0 | 110.6 | L73 V74 R79 L80 G81 | L73-I77 HydrophobicContact CD2-CD1 3.69Å; L73-I77 VanDerWaalsContact O-CG1 3.32Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.03Å; V74-I77 PolarHBondContact O-N 3.25Å; I77-R79 PolarHBondContact O-N 3.07Å; I77-L80 WeakPolarHBondContact O-CB 3.45Å; I77-L80 PolarHBondContact O-N 3.41Å; I77-G81 PolarHBondContact O-N 2.9Å |
| 78 | H | 67.5 | Low | 62 | Low | 126 Ų | 126 | 121.6 Ų | 121.6 | 58% | 0.583 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -62.4 | -41.5 | 176.5 | -171.2 | -104 | 0 | 0 | 0 | 112.2 | V74 Q75 L80 G81 L82 | V74-H78 WeakPolarHBondContact O-CB 3.32Å; V74-H78 PolarHBondContact O-N 3.33Å; Q75-H78 PolarHBondContact O-N 3.5Å; H78-L80 VanDerWaalsContact C-N 3.35Å; H78-L80 PolarHBondContact O-N 3.46Å; H78-G81 PolarHBondContact O-N 3.26Å; H78-L82 WeakPolarHBondContact O-CG 3.34Å; H78-L82 PolarHBondContact O-N 2.99Å |
| 79 | R | 66.8 | Low | 62.2 | Low | 181 Ų | 181 | 120.5 Ų | 120.5 | 68% | 0.683 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -64.4 | -36.8 | 173.2 | -80.7 | -176.5 | -178.2 | -174.4 | 1.6 | 112.8 | Q75 R76 I77 R83 | Q75-R79 PolarHBondContact O-N 3.01Å; R76-R79 PolarHBondContact O-N 2.99Å; I77-R79 PolarHBondContact O-N 3.07Å; R79-R83 WeakPolarHBondContact O-CG 3.45Å; R79-R83 PolarHBondContact O-N 3.21Å; R79-R83 VanDerWaalsContact O-N 3.07Å |
| 80 | L | 68.8 | Low | 62 | Low | 104 Ų | 104 | 124.7 Ų | 124.7 | 55% | 0.545 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -65 | -43.9 | 173.9 | -97.6 | 153.6 | 0 | 0 | 0 | 111.4 | R76 I77 H78 R83 I84 | R76-L80 PolarHBondContact O-N 3.41Å; I77-L80 WeakPolarHBondContact O-CB 3.45Å; I77-L80 PolarHBondContact O-N 3.41Å; H78-L80 VanDerWaalsContact C-N 3.35Å; H78-L80 PolarHBondContact O-N 3.46Å; L80-R83 PolarHBondContact O-N 3.39Å; L80-I84 WeakPolarHBondContact O-CG1 3.43Å; L80-I84 PolarHBondContact O-N 2.95Å |
| 81 | G | 70.1 | Confident | 62.5 | Low | 38 Ų | 38 | 122.9 Ų | 122.9 | 39% | 0.392 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -59.6 | -46.1 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I77 H78 R83 I84 Q85 | I77-G81 PolarHBondContact O-N 2.9Å; H78-G81 PolarHBondContact O-N 3.26Å; G81-R83 VanDerWaalsContact C-N 3.33Å; G81-R83 PolarHBondContact O-N 3.48Å; G81-I84 PolarHBondContact O-N 3.06Å; G81-Q85 WeakPolarHBondContact O-CB 3.47Å; G81-Q85 PolarHBondContact O-N 3.29Å |
| 82 | L | 67.5 | Low | 62.9 | Low | 89 Ų | 89 | 126.9 Ų | 126.9 | 47% | 0.466 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -62.6 | -36.5 | 176.1 | -75 | 168.6 | 0 | 0 | 0 | 112.9 | H78 Q85 K86 | H78-L82 WeakPolarHBondContact O-CG 3.34Å; H78-L82 PolarHBondContact O-N 2.99Å; L82-Q85 PolarHBondContact O-N 3.37Å; L82-K86 PolarHBondContact O-N 2.99Å |
| 83 | R | 67.4 | Low | 63.1 | Low | 198 Ų | 198 | 127.7 Ų | 127.7 | 75% | 0.747 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.6 | -41.4 | 175.5 | -81.9 | -177.2 | 164.4 | -179.4 | -5.1 | 112.1 | R79 L80 G81 Q85 K86 A87 | R79-R83 WeakPolarHBondContact O-CG 3.45Å; R79-R83 PolarHBondContact O-N 3.21Å; R79-R83 VanDerWaalsContact O-N 3.07Å; L80-R83 PolarHBondContact O-N 3.39Å; G81-R83 VanDerWaalsContact C-N 3.33Å; G81-R83 PolarHBondContact O-N 3.48Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; R83-K86 PolarHBondContact O-N 3.32Å; R83-A87 WeakPolarHBondContact O-CB 3.48Å; R83-A87 PolarHBondContact O-N 2.9Å |
| 84 | I | 65.9 | Low | 63.3 | Low | 100 Ų | 100 | 129.2 Ų | 129.2 | 51% | 0.513 | 63% | 0.631 | S | S | . | * | H | α-helix | trans | -67.3 | -39.6 | 176.6 | -65.5 | 164.8 | 0 | 0 | 0 | 110.3 | L80 G81 K86 A87 L88 | L80-I84 WeakPolarHBondContact O-CG1 3.43Å; L80-I84 PolarHBondContact O-N 2.95Å; G81-I84 PolarHBondContact O-N 3.06Å; I84-K86 PolarHBondContact O-N 3.04Å; I84-A87 PolarHBondContact O-N 3.43Å; I84-L88 HydrophobicContact CG2-CD1 3.88Å; I84-L88 WeakPolarHBondContact O-CG 3.47Å; I84-L88 PolarHBondContact O-N 3.47Å |
| 85 | Q | 59.2 | Low | 63.4 | Low | 133 Ų | 133 | 131.6 Ų | 131.6 | 62% | 0.621 | 64% | 0.636 | S | S | * | * | H | α-helix | trans | -66 | -36.8 | 177.4 | -164.9 | 170.1 | 11.1 | 0 | 0 | 112.4 | G81 L82 R83 L88 N89 | G81-Q85 WeakPolarHBondContact O-CB 3.47Å; G81-Q85 PolarHBondContact O-N 3.29Å; L82-Q85 PolarHBondContact O-N 3.37Å; R83-Q85 VanDerWaalsContact C-N 3.35Å; Q85-L88 PolarHBondContact O-N 2.82Å; Q85-N89 WeakPolarHBondContact O-CB 3.44Å; Q85-N89 PolarHBondContact O-N 2.7Å |
| 86 | K | 64.2 | Low | 63.5 | Low | 147 Ų | 147 | 131.6 Ų | 131.6 | 64% | 0.639 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -68.5 | -35.2 | 172.9 | -170.3 | 173.3 | -178.2 | 177.8 | 0 | 112.3 | L82 R83 I84 L88 | L82-K86 PolarHBondContact O-N 2.99Å; R83-K86 PolarHBondContact O-N 3.32Å; I84-K86 PolarHBondContact O-N 3.04Å; K86-L88 VanDerWaalsContact C-N 3.35Å |
| 87 | A | 59.8 | Low | 63.3 | Low | 72 Ų | 72 | 127.8 Ų | 127.8 | 60% | 0.595 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -72.9 | -25.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | R83 I84 | R83-A87 WeakPolarHBondContact O-CB 3.48Å; R83-A87 PolarHBondContact O-N 2.9Å; I84-A87 PolarHBondContact O-N 3.43Å |
| 88 | L | 59.5 | Low | 63.1 | Low | 140 Ų | 140 | 129.5 Ų | 129.5 | 73% | 0.733 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -87.2 | -12 | 176.1 | -76.3 | 165.3 | 0 | 0 | 0 | 113.8 | I84 Q85 K86 | I84-L88 HydrophobicContact CG2-CD1 3.88Å; I84-L88 WeakPolarHBondContact O-CG 3.47Å; I84-L88 PolarHBondContact O-N 3.47Å; Q85-L88 PolarHBondContact O-N 2.82Å; K86-L88 VanDerWaalsContact C-N 3.35Å |
| 89 | N | 56.7 | Low | 62.7 | Low | 146 Ų | 146 | 129.8 Ų | 129.8 | 78% | 0.781 | 65% | 0.646 | S | S | * | * | trans | -109.4 | 20.7 | -178.6 | -158.7 | 74.9 | 0 | 0 | 0 | 112.4 | Q85 | Q85-N89 WeakPolarHBondContact O-CB 3.44Å; Q85-N89 PolarHBondContact O-N 2.7Å | ||
| 90 | M | 46.6 | Very low | 62.3 | Low | 210 Ų | 210 | 125.2 Ų | 125.2 | 100% | 1.034 | 64% | 0.642 | S | S | * | * | trans | -111 | 0 | 162.1 | -79.6 | -176.4 | 171.3 | 0 | 0 | 107.9 |
Retrieved 90 of 90 residues in 187.6 ms
(Link to these results)