#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nmq n ASN 35 N 0.00 0.61 -4.40 -1.12 3.02 -1.26 -4.88 115.26 107.24 1nmq n ASN 35 Ca 0.00 0.08 -0.29 0.00 -0.03 0.00 0.00 54.58 54.33 1nmq n ASN 35 Cb 0.00 0.10 -0.13 0.00 -0.61 0.00 0.00 39.78 39.14 1nmq n ASN 35 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1nmq s SER 36 N -3.86 3.37 0.44 6.41 1.04 -1.26 -0.75 113.70 119.08 1nmq s SER 36 Ca 0.08 -0.70 -0.25 0.00 0.48 0.00 0.00 55.95 55.56 1nmq s SER 36 Cb 0.15 -0.27 -0.09 0.00 0.10 0.00 0.00 66.02 65.91 1nmq s SER 36 CO 0.70 0.19 1.39 -1.22 0.98 0.00 0.00 173.24 175.28 1nmq n TYR 37 N 1.04 2.54 -1.98 5.02 4.01 -0.30 -4.85 117.16 122.64 1nmq n TYR 37 Ca -0.18 0.46 -0.43 0.00 -0.16 0.00 0.00 57.90 57.59 1nmq n TYR 37 Cb 0.53 -2.44 -0.03 0.00 -0.31 0.00 0.00 39.34 37.09 1nmq n TYR 37 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1nmq s LYS 38 N -2.38 3.56 -0.19 -0.72 2.20 -1.26 -4.83 119.74 116.12 1nmq s LYS 38 Ca 0.61 1.68 0.14 0.00 -0.36 0.00 0.00 55.97 58.04 1nmq s LYS 38 Cb -0.47 -4.15 0.40 0.00 -1.51 0.00 0.00 37.83 32.11 1nmq s LYS 38 CO 0.58 -1.58 1.26 -1.33 -0.36 0.00 0.00 175.35 173.91 1nmq n MET 39 N 8.08 1.67 -0.56 4.03 2.81 -1.26 -4.68 117.12 127.21 1nmq n MET 39 Ca 0.22 -2.97 0.03 0.00 -1.81 0.00 0.00 57.70 53.17 1nmq n MET 39 Cb 0.45 -1.63 0.20 0.00 -0.71 0.00 0.00 33.22 31.53 1nmq n MET 39 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1nmq n ASP 40 N -1.17 2.39 -4.63 7.83 5.68 -1.26 -4.80 116.55 120.59 1nmq n ASP 40 Ca 0.20 -3.60 -0.28 0.00 -0.50 0.00 0.00 54.79 50.61 1nmq n ASP 40 Cb 0.75 -0.55 0.20 0.00 -1.14 0.00 0.00 41.12 40.38 1nmq n ASP 40 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1nmq s TYR 41 N -3.12 1.89 0.51 2.11 1.51 -1.26 -4.90 117.35 114.08 1nmq s TYR 41 Ca 0.40 1.02 0.26 0.00 -1.01 0.00 0.00 57.07 57.74 1nmq s TYR 41 Cb 0.36 -3.22 1.54 0.00 -0.11 0.00 0.00 41.96 40.53 1nmq s TYR 41 CO -0.01 -3.19 2.15 -1.35 -1.11 0.00 0.00 175.55 172.05 1nmq h PRO 42 N -2.11 0.00 -4.67 -1.71 0.11 -1.95 -3.42 132.00 118.24 1nmq h PRO 42 Ca -0.57 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.16 1nmq h PRO 42 Cb 1.33 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.16 1nmq h PRO 42 CO 0.56 0.07 -0.77 -1.21 -0.21 0.00 0.00 178.00 176.43 1nmq s GLU 43 N -4.51 0.68 0.09 1.05 2.02 -0.96 -5.04 118.70 112.02 1nmq s GLU 43 Ca -0.04 -0.33 -0.21 0.00 0.02 0.00 0.00 54.97 54.41 1nmq s GLU 43 Cb 0.15 -0.65 -0.11 0.00 0.10 0.00 0.00 34.13 33.62 1nmq s GLU 43 CO 0.59 0.18 1.70 0.52 0.02 0.00 0.00 175.26 178.26 1nmq h MET 44 N 5.85 0.17 0.00 1.61 2.86 -1.82 0.33 114.93 123.92 1nmq h MET 44 Ca -0.31 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1nmq h MET 44 Cb 1.18 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1nmq h MET 44 CO 0.49 0.18 0.00 0.41 1.06 0.00 0.00 176.91 179.05 1nmq n GLY 45 N -0.93 1.37 3.81 8.32 0.00 -1.26 -0.10 105.19 116.39 1nmq n GLY 45 Ca -0.05 -1.90 -0.33 0.00 0.00 0.00 0.00 46.02 43.73 1nmq n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nmq s LEU 46 N 0.00 3.81 -0.33 0.99 1.43 -1.26 -0.44 118.68 122.88 1nmq s LEU 46 Ca 0.00 1.80 -0.01 0.00 -1.03 0.00 0.00 54.13 54.89 1nmq s LEU 46 Cb 0.00 -4.54 0.11 0.00 0.03 0.00 0.00 46.19 41.79 1nmq s LEU 46 CO 0.00 -0.66 0.15 0.00 0.23 0.00 0.00 176.35 176.07 1nmq s ILE 48 N 1.46 4.98 -0.29 0.00 -1.09 0.15 -2.05 121.20 124.35 1nmq s ILE 48 Ca 0.12 1.26 -0.03 0.00 -2.23 0.00 0.00 60.65 59.78 1nmq s ILE 48 Cb -0.19 -3.98 0.04 0.00 -1.58 0.00 0.00 42.46 36.74 1nmq s ILE 48 CO -0.20 0.06 0.00 -0.63 -1.23 0.00 0.00 174.94 172.95 1nmq s ILE 49 N 2.18 3.18 -0.41 2.92 1.01 -0.92 0.53 121.20 129.69 1nmq s ILE 49 Ca 0.30 -1.16 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 1nmq s ILE 49 Cb -0.16 -2.73 0.02 0.00 0.01 0.00 0.00 42.46 39.59 1nmq s ILE 49 CO 0.10 -0.00 0.37 -0.63 0.00 0.00 0.00 174.94 174.78 1nmq s ILE 50 N 1.32 5.17 -0.56 2.92 1.01 0.07 0.11 121.20 131.25 1nmq s ILE 50 Ca -0.02 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.14 1nmq s ILE 50 Cb -0.18 -3.97 0.15 0.00 0.01 0.00 0.00 42.46 38.46 1nmq s ILE 50 CO -0.01 -0.34 0.39 0.21 0.00 0.00 0.00 174.94 175.19 1nmq s ASN 51 N 1.75 5.42 -0.33 3.58 2.47 0.12 -0.99 114.94 126.95 1nmq s ASN 51 Ca 0.09 -2.50 -0.16 0.00 0.42 0.00 0.00 52.86 50.71 1nmq s ASN 51 Cb -0.18 -1.90 -0.01 0.00 -1.45 0.00 0.00 41.25 37.71 1nmq s ASN 51 CO 0.12 -0.47 0.39 0.20 -3.72 0.00 0.00 177.10 173.61 1nmq s ASN 52 N 1.37 6.21 -0.08 -4.21 0.01 -0.47 -0.62 114.94 117.14 1nmq s ASN 52 Ca 0.13 -0.13 -0.00 0.00 -0.71 0.00 0.00 52.86 52.15 1nmq s ASN 52 Cb -0.21 -2.21 -0.05 0.00 0.41 0.00 0.00 41.25 39.19 1nmq s ASN 52 CO -0.04 -0.34 -0.08 1.17 -1.51 0.00 0.00 177.10 176.30 1nmq n LYS 53 N 5.44 0.20 -4.36 -0.60 4.81 -1.26 -4.51 118.16 117.88 1nmq n LYS 53 Ca -0.08 0.05 -0.34 0.00 -0.87 0.00 0.00 58.31 57.07 1nmq n LYS 53 Cb 0.49 -1.09 -0.14 0.00 0.02 0.00 0.00 35.03 34.31 1nmq n LYS 53 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1nmq s ASN 54 N -5.00 4.33 0.28 3.14 0.01 -1.26 -1.05 114.94 115.40 1nmq s ASN 54 Ca -0.11 -0.29 0.09 0.00 -0.71 0.00 0.00 52.86 51.83 1nmq s ASN 54 Cb 0.03 -1.70 -0.04 0.00 0.41 0.00 0.00 41.25 39.95 1nmq s ASN 54 CO 0.18 0.10 0.07 -0.36 -1.51 0.00 0.00 177.10 175.58 1nmq s PHE 55 N 0.75 2.76 0.21 2.20 0.40 -1.26 -4.77 117.98 118.27 1nmq s PHE 55 Ca -0.03 -0.25 -0.30 0.00 -0.60 0.00 0.00 56.93 55.75 1nmq s PHE 55 Cb -0.15 -1.35 -0.09 0.00 0.51 0.00 0.00 43.02 41.94 1nmq s PHE 55 CO 0.02 0.53 1.34 -1.01 0.70 0.00 0.00 175.22 176.80 1nmq s HIS 56 N -2.32 3.19 0.33 0.36 3.76 -0.28 -4.88 115.29 115.45 1nmq s HIS 56 Ca 0.33 1.17 0.11 0.00 -0.15 0.00 0.00 55.06 56.52 1nmq s HIS 56 Cb -0.06 -3.66 0.91 0.00 1.11 0.00 0.00 32.58 30.89 1nmq s HIS 56 CO 0.21 -2.09 1.74 0.87 -0.85 0.00 0.00 174.74 174.63 1nmq h LYS 57 N 5.27 0.55 0.00 1.40 6.56 -1.91 0.12 116.57 128.57 1nmq h LYS 57 Ca -0.45 -0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 1nmq h LYS 57 Cb 1.22 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.75 1nmq h LYS 57 CO 0.77 0.36 0.26 0.77 -2.06 0.00 0.00 179.45 179.56 1nmq h SER 58 N 0.57 0.00 0.76 0.86 0.02 -1.95 -0.08 113.55 113.73 1nmq h SER 58 Ca 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.58 1nmq h SER 58 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1nmq h SER 58 CO -0.43 0.00 -1.16 0.35 -1.14 0.00 0.00 176.83 174.45 1nmq n THR 59 N -2.79 0.46 -2.90 -2.27 -2.24 0.42 -4.99 114.28 99.97 1nmq n THR 59 Ca -0.02 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 61.15 1nmq n THR 59 Cb 0.31 -0.22 0.06 0.00 -2.10 0.00 0.00 70.33 68.37 1nmq n THR 59 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nmq n GLY 60 N 1.22 -0.10 3.02 3.38 0.00 -0.04 -5.04 105.19 107.62 1nmq n GLY 60 Ca -0.00 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1nmq n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nmq s MET 61 N -4.80 1.16 0.69 1.61 -1.94 -1.26 -5.14 119.30 109.63 1nmq s MET 61 Ca 0.02 -0.35 -0.14 0.00 -1.71 0.00 0.00 55.69 53.51 1nmq s MET 61 Cb -0.00 -1.05 0.02 0.00 2.01 0.00 0.00 34.83 35.80 1nmq s MET 61 CO 0.47 0.11 1.11 0.95 -0.01 0.00 0.00 175.02 177.65 1nmq s THR 62 N 0.26 3.26 0.49 2.05 -4.23 -1.26 -4.59 115.64 111.62 1nmq s THR 62 Ca -0.05 0.53 -0.21 0.00 -1.18 0.00 0.00 61.69 60.78 1nmq s THR 62 Cb -0.10 -3.04 -0.07 0.00 1.34 0.00 0.00 72.50 70.63 1nmq s THR 62 CO 0.01 -0.41 1.15 -0.44 -0.54 0.00 0.00 174.62 174.39 1nmq s SER 63 N -2.81 5.98 -1.23 3.99 0.01 -1.26 -4.72 113.70 113.65 1nmq s SER 63 Ca 0.65 2.25 -0.07 0.00 1.31 0.00 0.00 55.95 60.10 1nmq s SER 63 Cb -0.20 -2.59 0.20 0.00 0.21 0.00 0.00 66.02 63.64 1nmq s SER 63 CO 0.46 -1.04 1.93 0.54 0.41 0.00 0.00 173.24 175.53 1nmq n ARG 64 N -0.83 4.21 -1.56 12.44 1.74 -0.22 -5.00 116.66 127.45 1nmq n ARG 64 Ca 0.09 -3.81 -0.54 0.00 -0.77 0.00 0.00 57.85 52.82 1nmq n ARG 64 Cb 0.49 -2.73 -0.06 0.00 -1.02 0.00 0.00 32.46 29.14 1nmq n ARG 64 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1nmq n SER 65 N 2.45 1.13 0.00 0.55 7.64 -1.26 -1.41 113.62 122.72 1nmq n SER 65 Ca 0.43 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.45 1nmq n SER 65 Cb 0.32 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1nmq n SER 65 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nmq n GLY 66 N 2.20 2.77 0.29 0.23 0.00 -1.20 -4.33 105.19 105.15 1nmq n GLY 66 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.35 1nmq n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nmq h THR 67 N 0.00 0.57 -0.64 2.61 1.03 -1.57 -0.71 112.91 114.20 1nmq h THR 67 Ca 0.00 -0.04 -0.05 0.00 -0.01 0.00 0.00 66.41 66.31 1nmq h THR 67 Cb 0.00 1.03 -0.03 0.00 -1.07 0.00 0.00 68.15 68.08 1nmq h THR 67 CO 0.00 0.01 0.20 0.44 -0.01 0.00 0.00 175.52 176.16 1nmq h ASP 68 N 0.00 0.94 -0.87 0.00 3.32 -1.92 0.19 116.42 118.08 1nmq h ASP 68 Ca -0.00 -0.21 0.02 0.00 0.02 0.00 0.00 57.03 56.86 1nmq h ASP 68 Cb 0.03 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.28 1nmq h ASP 68 CO 0.00 0.90 0.56 0.58 -1.72 0.00 0.00 179.24 179.57 1nmq h VAL 69 N 0.93 1.17 -0.03 -1.35 2.07 -1.50 0.34 116.25 117.88 1nmq h VAL 69 Ca 0.21 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1nmq h VAL 69 Cb 0.30 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.99 1nmq h VAL 69 CO -0.01 0.20 -0.13 0.44 0.02 0.00 0.00 177.57 178.10 1nmq h ASP 70 N 1.12 -0.38 -0.32 0.57 5.19 -1.14 -1.36 116.42 120.12 1nmq h ASP 70 Ca 0.33 0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.84 1nmq h ASP 70 Cb -0.05 0.17 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 1nmq h ASP 70 CO -0.10 -0.18 0.12 0.00 -3.12 0.00 0.00 179.24 175.96 1nmq h ALA 71 N 0.79 0.37 -0.83 3.45 0.00 -0.22 -1.32 119.26 121.50 1nmq h ALA 71 Ca 0.06 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1nmq h ALA 71 Cb 0.27 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1nmq h ALA 71 CO -0.15 -0.28 0.39 0.00 0.00 0.00 0.00 179.25 179.21 1nmq h ALA 72 N 1.20 1.13 -0.30 0.00 0.00 -0.77 -1.18 119.26 119.33 1nmq h ALA 72 Ca 0.14 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1nmq h ALA 72 Cb 0.10 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1nmq h ALA 72 CO -0.14 0.65 -0.05 -0.97 0.00 0.00 0.00 179.25 178.75 1nmq h ASN 73 N 1.18 0.57 -0.61 0.00 -1.24 -0.81 -2.18 115.58 112.49 1nmq h ASN 73 Ca 0.28 -0.35 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 1nmq h ASN 73 Cb 0.13 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 38.99 1nmq h ASN 73 CO -0.03 0.78 0.36 -0.07 -1.29 0.00 0.00 177.43 177.18 1nmq h LEU 74 N 0.35 0.75 -0.09 0.34 3.38 -1.04 0.13 115.31 119.12 1nmq h LEU 74 Ca 0.08 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1nmq h LEU 74 Cb 0.52 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1nmq h LEU 74 CO 0.03 0.60 -0.06 -0.09 0.09 0.00 0.00 178.44 179.01 1nmq h ARG 75 N 0.83 -0.06 -0.36 1.13 2.43 -1.12 0.36 114.38 117.59 1nmq h ARG 75 Ca 0.22 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1nmq h ARG 75 Cb 0.00 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1nmq h ARG 75 CO -0.04 -0.04 0.04 1.49 -1.51 0.00 0.00 179.97 179.91 1nmq h GLU 76 N -0.07 0.61 -0.41 0.20 4.57 -1.25 -0.29 114.58 117.95 1nmq h GLU 76 Ca 0.06 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 1nmq h GLU 76 Cb 0.15 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1nmq h GLU 76 CO -0.13 0.70 0.20 1.15 -1.18 0.00 0.00 179.01 179.74 1nmq h THR 77 N 0.44 1.18 0.00 0.32 2.02 -0.69 -2.12 112.91 114.06 1nmq h THR 77 Ca 0.11 -0.50 -0.07 0.00 0.77 0.00 0.00 66.41 66.71 1nmq h THR 77 Cb 0.40 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1nmq h THR 77 CO 0.01 0.19 -0.34 -0.26 0.37 0.00 0.00 175.52 175.49 1nmq h PHE 78 N 0.52 0.00 -0.46 3.16 0.04 -0.14 -2.76 116.94 117.30 1nmq h PHE 78 Ca 0.14 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.87 1nmq h PHE 78 Cb 0.12 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.25 1nmq h PHE 78 CO -0.01 0.34 0.13 -0.09 -0.60 0.00 0.00 178.31 178.09 1nmq h ARG 79 N 0.00 0.72 0.00 1.51 2.43 -0.74 -1.85 114.38 116.45 1nmq h ARG 79 Ca -0.00 -0.16 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1nmq h ARG 79 Cb 1.02 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1nmq h ARG 79 CO 0.04 0.70 -0.01 -0.91 -1.51 0.00 0.00 179.97 178.28 1nmq h ASN 80 N 0.61 0.00 0.15 -3.80 2.35 -1.11 -1.25 115.58 112.53 1nmq h ASN 80 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1nmq h ASN 80 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1nmq h ASN 80 CO -0.00 0.01 -0.05 0.18 -1.65 0.00 0.00 177.43 175.92 1nmq n LEU 81 N -3.13 0.67 -0.47 1.61 4.77 -0.81 -4.92 117.00 114.72 1nmq n LEU 81 Ca -0.01 -0.15 -0.03 0.00 -0.03 0.00 0.00 56.01 55.79 1nmq n LEU 81 Cb 0.23 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1nmq n LEU 81 CO 0.25 0.12 -0.02 0.29 -1.33 0.00 0.00 177.39 176.70 1nmq n LYS 82 N -0.62 -0.43 -3.64 3.23 4.76 -0.47 -4.95 118.16 116.03 1nmq n LYS 82 Ca 0.18 0.14 -0.35 0.00 -2.87 0.00 0.00 58.31 55.41 1nmq n LYS 82 Cb 0.26 -3.64 -0.06 0.00 -1.84 0.00 0.00 35.03 29.76 1nmq n LYS 82 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1nmq s TYR 83 N -2.34 3.61 -0.51 2.13 1.51 -0.76 -3.97 117.35 117.01 1nmq s TYR 83 Ca 0.02 0.74 -0.29 0.00 -1.01 0.00 0.00 57.07 56.53 1nmq s TYR 83 Cb -0.01 -2.11 0.03 0.00 -0.11 0.00 0.00 41.96 39.75 1nmq s TYR 83 CO 0.02 0.58 1.22 -2.00 -1.11 0.00 0.00 175.55 174.27 1nmq s GLU 84 N -1.67 3.59 -0.18 -0.62 2.12 0.42 -4.52 118.70 117.84 1nmq s GLU 84 Ca 0.29 0.51 -0.14 0.00 0.36 0.00 0.00 54.97 55.98 1nmq s GLU 84 Cb -0.14 -3.98 -0.04 0.00 0.26 0.00 0.00 34.13 30.22 1nmq s GLU 84 CO 0.16 -1.56 0.31 0.08 -0.54 0.00 0.00 175.26 173.70 1nmq s VAL 85 N 4.93 5.29 -0.25 3.70 1.01 -1.26 -0.58 120.40 133.23 1nmq s VAL 85 Ca 0.49 0.56 0.01 0.00 0.00 0.00 0.00 61.98 63.03 1nmq s VAL 85 Cb -0.08 -3.64 0.07 0.00 0.00 0.00 0.00 36.38 32.72 1nmq s VAL 85 CO 0.29 0.35 -0.03 -0.13 0.00 0.00 0.00 175.10 175.59 1nmq s ARG 86 N 0.71 1.55 0.20 2.72 0.52 -0.87 -4.97 118.95 118.81 1nmq s ARG 86 Ca 0.16 -1.10 -0.21 0.00 -0.52 0.00 0.00 55.73 54.07 1nmq s ARG 86 Cb -0.13 -2.61 -0.08 0.00 0.52 0.00 0.00 34.95 32.65 1nmq s ARG 86 CO 0.05 -0.66 0.72 -0.80 0.02 0.00 0.00 175.30 174.62 1nmq s ASN 87 N 1.35 7.12 -0.08 0.23 -0.87 -1.26 -2.16 114.94 119.28 1nmq s ASN 87 Ca -0.03 1.44 -0.01 0.00 -1.57 0.00 0.00 52.86 52.69 1nmq s ASN 87 Cb -0.19 -2.43 0.03 0.00 -0.02 0.00 0.00 41.25 38.64 1nmq s ASN 87 CO -0.08 0.09 -0.00 -0.54 -2.57 0.00 0.00 177.10 174.00 1nmq s LYS 88 N -1.74 0.70 -0.13 -0.60 -0.14 0.12 -4.94 119.74 113.01 1nmq s LYS 88 Ca 0.40 0.05 -0.06 0.00 -1.36 0.00 0.00 55.97 55.00 1nmq s LYS 88 Cb -0.18 -1.09 -0.04 0.00 -1.68 0.00 0.00 37.83 34.84 1nmq s LYS 88 CO 0.22 -0.32 0.09 -0.80 -0.76 0.00 0.00 175.35 173.78 1nmq s ASN 89 N 1.94 5.93 -0.83 2.83 -0.87 -1.26 0.12 114.94 122.80 1nmq s ASN 89 Ca 0.05 0.28 -0.02 0.00 -1.57 0.00 0.00 52.86 51.60 1nmq s ASN 89 Cb -0.13 -1.90 -0.00 0.00 -0.02 0.00 0.00 41.25 39.20 1nmq s ASN 89 CO -0.06 0.33 0.66 0.47 -2.57 0.00 0.00 177.10 175.93 1nmq n ASP 90 N 2.51 -6.05 -4.89 -1.22 8.00 0.21 -4.94 116.55 110.15 1nmq n ASP 90 Ca -0.19 -0.62 -0.34 0.00 0.71 0.00 0.00 54.79 54.35 1nmq n ASP 90 Cb 0.54 -3.27 -0.05 0.00 -0.02 0.00 0.00 41.12 38.32 1nmq n ASP 90 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nmq s LEU 91 N -4.75 4.36 0.60 0.64 1.43 -1.26 -4.88 118.68 114.82 1nmq s LEU 91 Ca 0.05 0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 53.53 1nmq s LEU 91 Cb -0.02 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.43 1nmq s LEU 91 CO 0.84 0.23 1.00 0.42 0.23 0.00 0.00 176.35 179.07 1nmq s THR 92 N -1.35 4.72 0.26 5.49 -4.23 -1.26 -0.97 115.64 118.31 1nmq s THR 92 Ca 0.29 0.82 -0.02 0.00 -1.18 0.00 0.00 61.69 61.61 1nmq s THR 92 Cb -0.13 -3.86 0.27 0.00 1.34 0.00 0.00 72.50 70.12 1nmq s THR 92 CO 0.18 -1.10 1.67 0.08 -0.54 0.00 0.00 174.62 174.92 1nmq h ARG 93 N -0.20 0.27 -0.28 3.99 0.11 -1.85 0.21 114.38 116.62 1nmq h ARG 93 Ca -0.44 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.59 1nmq h ARG 93 Cb 1.19 -0.06 -0.01 0.00 1.11 0.00 0.00 29.97 32.20 1nmq h ARG 93 CO 0.62 0.18 0.08 0.93 0.10 0.00 0.00 179.97 181.87 1nmq h GLU 94 N 0.27 0.45 -0.09 0.08 3.07 -1.95 -2.33 114.58 114.09 1nmq h GLU 94 Ca 0.48 -0.10 -0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1nmq h GLU 94 Cb 0.88 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.72 1nmq h GLU 94 CO -0.56 0.52 0.05 0.93 -1.40 0.00 0.00 179.01 178.55 1nmq h GLU 95 N 0.29 0.12 0.00 2.33 5.08 -1.06 -0.30 114.58 121.05 1nmq h GLU 95 Ca 0.09 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1nmq h GLU 95 Cb 0.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1nmq h GLU 95 CO -0.00 0.09 -0.00 0.82 -1.00 0.00 0.00 179.01 178.92 1nmq h ILE 96 N 0.12 1.49 -0.67 3.13 2.04 -0.60 0.85 117.51 123.88 1nmq h ILE 96 Ca 0.03 -1.48 0.11 0.00 1.00 0.00 0.00 64.86 64.52 1nmq h ILE 96 Cb 0.00 2.50 -0.08 0.00 -0.74 0.00 0.00 36.82 38.50 1nmq h ILE 96 CO -0.01 0.38 0.26 0.58 0.00 0.00 0.00 178.15 179.36 1nmq h VAL 97 N -0.64 0.73 -0.48 1.67 2.07 -1.09 -0.81 116.25 117.71 1nmq h VAL 97 Ca -0.00 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1nmq h VAL 97 Cb 0.63 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1nmq h VAL 97 CO 0.00 0.08 0.21 -0.08 0.02 0.00 0.00 177.57 177.80 1nmq h GLU 98 N 0.43 0.70 -0.68 1.57 4.81 -1.00 -0.34 114.58 120.06 1nmq h GLU 98 Ca 0.35 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1nmq h GLU 98 Cb 0.47 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1nmq h GLU 98 CO -0.35 0.61 0.36 1.25 -0.73 0.00 0.00 179.01 180.16 1nmq h LEU 99 N 0.63 0.87 -0.29 1.64 5.85 0.24 -1.56 115.31 122.67 1nmq h LEU 99 Ca 0.16 -0.11 -0.12 0.00 0.84 0.00 0.00 57.88 58.65 1nmq h LEU 99 Cb 0.16 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 1nmq h LEU 99 CO -0.02 0.72 -0.29 0.24 -0.34 0.00 0.00 178.44 178.76 1nmq h MET 100 N 0.94 0.71 0.10 1.25 2.86 -1.02 -0.82 114.93 118.95 1nmq h MET 100 Ca 0.24 -0.38 0.02 0.00 -2.06 0.00 0.00 59.70 57.52 1nmq h MET 100 Cb 0.06 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.70 1nmq h MET 100 CO -0.04 0.99 -0.25 -0.09 1.06 0.00 0.00 176.91 178.58 1nmq h ARG 101 N 0.46 -0.43 -0.30 1.72 2.43 -0.86 -0.10 114.38 117.30 1nmq h ARG 101 Ca 0.05 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 1nmq h ARG 101 Cb 0.86 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 1nmq h ARG 101 CO 0.07 -0.29 0.13 -0.44 -1.51 0.00 0.00 179.97 177.93 1nmq h ASP 102 N -0.45 0.17 -0.17 -3.80 5.19 -1.17 -1.37 116.42 114.82 1nmq h ASP 102 Ca 0.03 0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.41 1nmq h ASP 102 Cb 0.48 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 1nmq h ASP 102 CO -0.16 0.14 -0.07 0.58 -3.12 0.00 0.00 179.24 176.61 1nmq h VAL 103 N 0.28 1.21 0.00 -1.35 2.07 -0.92 0.12 116.25 117.66 1nmq h VAL 103 Ca 0.13 -0.91 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 1nmq h VAL 103 Cb 0.07 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1nmq h VAL 103 CO -0.11 0.30 -0.07 0.77 0.02 0.00 0.00 177.57 178.48 1nmq h SER 104 N 0.47 0.00 0.04 0.57 4.64 -0.27 -2.54 113.55 116.46 1nmq h SER 104 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1nmq h SER 104 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1nmq h SER 104 CO 0.02 0.07 -0.03 0.29 -0.87 0.00 0.00 176.83 176.32 1nmq n LYS 105 N -3.25 1.38 -1.61 4.77 5.02 0.01 -4.82 118.16 119.67 1nmq n LYS 105 Ca -0.00 -0.66 -0.30 0.00 -2.02 0.00 0.00 58.31 55.32 1nmq n LYS 105 Cb 0.30 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 33.89 1nmq n LYS 105 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1nmq s GLU 106 N -2.07 2.53 -0.53 1.97 2.02 -0.96 -4.99 118.70 116.67 1nmq s GLU 106 Ca 0.39 0.74 -0.22 0.00 0.02 0.00 0.00 54.97 55.89 1nmq s GLU 106 Cb 0.21 -1.96 0.05 0.00 0.10 0.00 0.00 34.13 32.52 1nmq s GLU 106 CO 0.37 -1.33 0.83 0.34 0.02 0.00 0.00 175.26 175.48 1nmq s ASP 107 N -3.93 6.30 -0.07 -0.19 -1.08 -1.26 -4.87 116.67 111.58 1nmq s ASP 107 Ca 0.59 -0.52 0.18 0.00 -0.52 0.00 0.00 52.55 52.28 1nmq s ASP 107 Cb -0.14 -2.38 0.65 0.00 -1.46 0.00 0.00 42.92 39.58 1nmq s ASP 107 CO 0.54 -1.10 1.54 1.41 0.52 0.00 0.00 175.17 178.09 1nmq n HIS 108 N 6.99 1.22 -0.33 -5.34 8.25 -1.26 -4.59 115.22 120.16 1nmq n HIS 108 Ca -0.01 -0.52 0.19 0.00 -0.26 0.00 0.00 57.72 57.13 1nmq n HIS 108 Cb 0.47 -0.15 0.41 0.00 1.12 0.00 0.00 29.99 31.83 1nmq n HIS 108 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1nmq h SER 109 N 3.86 0.48 -0.34 0.41 0.02 -1.90 0.34 113.55 116.42 1nmq h SER 109 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1nmq h SER 109 Cb 1.21 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.87 1nmq h SER 109 CO 0.14 -0.05 0.00 0.29 -1.14 0.00 0.00 176.83 176.07 1nmq n LYS 110 N -5.02 1.84 -4.48 3.45 5.02 -1.26 -4.89 118.16 112.83 1nmq n LYS 110 Ca 0.28 -1.31 -0.34 0.00 -2.02 0.00 0.00 58.31 54.92 1nmq n LYS 110 Cb 0.84 -1.31 -0.10 0.00 -0.02 0.00 0.00 35.03 34.43 1nmq n LYS 110 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1nmq s ARG 111 N -1.55 2.97 0.18 1.97 0.52 0.12 -2.28 118.95 120.88 1nmq s ARG 111 Ca 0.26 -0.48 0.00 0.00 -0.52 0.00 0.00 55.73 55.00 1nmq s ARG 111 Cb 0.14 -2.73 0.06 0.00 0.52 0.00 0.00 34.95 32.93 1nmq s ARG 111 CO 0.19 0.63 1.43 0.77 0.02 0.00 0.00 175.30 178.33 1nmq h SER 112 N 5.38 0.40 -1.30 0.23 0.02 0.17 -3.47 113.55 114.98 1nmq h SER 112 Ca -0.48 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 1nmq h SER 112 Cb 1.18 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1nmq h SER 112 CO 0.55 1.02 0.00 -1.54 -1.14 0.00 0.00 176.83 175.72 1nmq n SER 113 N -3.79 0.00 -3.69 3.07 3.41 0.85 -4.31 113.62 109.16 1nmq n SER 113 Ca -0.04 -0.95 -0.11 0.00 -0.26 0.00 0.00 58.87 57.51 1nmq n SER 113 Cb 0.73 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.57 1nmq n SER 113 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1nmq s PHE 114 N -6.21 -0.59 -0.07 7.33 5.36 -0.90 -4.01 117.98 118.89 1nmq s PHE 114 Ca 0.00 1.23 0.04 0.00 -0.96 0.00 0.00 56.93 57.25 1nmq s PHE 114 Cb 0.00 0.21 0.00 0.00 -0.34 0.00 0.00 43.02 42.89 1nmq s PHE 114 CO 0.00 -0.36 -0.19 0.08 -1.46 0.00 0.00 175.22 173.29 1nmq s VAL 115 N 1.74 1.64 -0.06 3.12 1.01 -0.56 0.88 120.40 128.17 1nmq s VAL 115 Ca -0.07 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1nmq s VAL 115 Cb -0.10 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.88 1nmq s VAL 115 CO -0.12 0.47 -0.06 0.00 0.00 0.00 0.00 175.10 175.38 1nmq s VAL 117 N 1.09 2.36 -0.29 0.00 1.01 0.19 -0.51 120.40 124.24 1nmq s VAL 117 Ca -0.08 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 1nmq s VAL 117 Cb -0.14 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1nmq s VAL 117 CO -0.01 0.52 0.07 -0.76 0.00 0.00 0.00 175.10 174.93 1nmq s LEU 118 N 1.14 3.82 -0.27 3.92 1.43 0.40 -0.75 118.68 128.37 1nmq s LEU 118 Ca 0.01 -0.73 -0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1nmq s LEU 118 Cb -0.14 -1.87 0.04 0.00 0.03 0.00 0.00 46.19 44.25 1nmq s LEU 118 CO -0.07 -0.19 -0.04 -0.76 0.23 0.00 0.00 176.35 175.52 1nmq s LEU 119 N 1.49 3.52 0.05 1.79 1.43 -0.16 -0.95 118.68 125.85 1nmq s LEU 119 Ca 0.02 -1.10 -0.26 0.00 -1.03 0.00 0.00 54.13 51.76 1nmq s LEU 119 Cb -0.17 -1.67 0.09 0.00 0.03 0.00 0.00 46.19 44.46 1nmq s LEU 119 CO 0.02 -0.19 1.21 -0.55 0.23 0.00 0.00 176.35 177.07 1nmq s SER 120 N 1.27 0.01 0.78 2.29 0.15 -0.87 -1.37 113.70 115.95 1nmq s SER 120 Ca -0.03 -0.36 -0.12 0.00 0.70 0.00 0.00 55.95 56.14 1nmq s SER 120 Cb -0.18 0.26 0.06 0.00 -1.71 0.00 0.00 66.02 64.45 1nmq s SER 120 CO -0.03 -0.52 1.11 -1.00 1.20 0.00 0.00 173.24 174.00 1nmq s HIS 121 N -2.05 2.95 0.08 3.44 3.76 -1.26 -4.06 115.29 118.15 1nmq s HIS 121 Ca 0.27 1.07 -0.26 0.00 -0.15 0.00 0.00 55.06 55.99 1nmq s HIS 121 Cb -0.01 -3.15 0.09 0.00 1.11 0.00 0.00 32.58 30.61 1nmq s HIS 121 CO 0.01 -1.65 1.16 0.20 -0.85 0.00 0.00 174.74 173.61 1nmq s GLY 122 N -4.09 -0.11 0.29 -2.22 0.00 -1.26 -1.25 107.32 98.68 1nmq s GLY 122 Ca 0.60 0.05 0.05 0.00 0.00 0.00 0.00 44.72 45.43 1nmq s GLY 122 CO 0.53 2.65 0.23 -0.54 0.00 0.00 0.00 173.10 175.98 1nmq s GLU 123 N -2.31 1.60 -0.06 2.90 2.02 -0.81 -4.01 118.70 118.03 1nmq s GLU 123 Ca 0.21 -1.91 -0.36 0.00 0.02 0.00 0.00 54.97 52.94 1nmq s GLU 123 Cb -0.00 0.28 -0.13 0.00 0.10 0.00 0.00 34.13 34.38 1nmq s GLU 123 CO 0.01 -0.57 1.74 -1.91 0.02 0.00 0.00 175.26 174.55 1nmq n GLU 124 N -0.53 1.85 -0.98 1.61 4.07 -1.23 -0.44 120.64 125.00 1nmq n GLU 124 Ca 0.06 0.68 0.00 0.00 -0.06 0.00 0.00 57.16 57.83 1nmq n GLU 124 Cb 0.63 -2.45 0.00 0.00 -0.06 0.00 0.00 31.44 29.56 1nmq n GLU 124 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1nmq n GLY 125 N 3.97 0.22 3.13 8.31 0.00 -1.26 -4.97 105.19 114.59 1nmq n GLY 125 Ca 0.22 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 1nmq n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nmq s ILE 126 N -1.47 1.10 0.01 -0.61 1.01 0.41 -1.20 121.20 120.45 1nmq s ILE 126 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.81 1nmq s ILE 126 Cb 0.00 -0.98 -0.01 0.00 0.01 0.00 0.00 42.46 41.48 1nmq s ILE 126 CO 0.00 0.09 -0.13 -0.51 0.00 0.00 0.00 174.94 174.40 1nmq s ILE 127 N -0.69 0.99 -0.17 2.92 1.10 0.17 -2.26 121.20 123.25 1nmq s ILE 127 Ca 0.03 -0.68 -0.11 0.00 -0.51 0.00 0.00 60.65 59.38 1nmq s ILE 127 Cb -0.07 -0.85 -0.05 0.00 0.15 0.00 0.00 42.46 41.64 1nmq s ILE 127 CO 0.01 0.17 0.21 -0.36 -2.11 0.00 0.00 174.94 172.85 1nmq s PHE 128 N -0.48 3.47 0.80 3.50 0.08 -0.38 0.98 117.98 125.93 1nmq s PHE 128 Ca 0.03 0.48 -0.10 0.00 0.12 0.00 0.00 56.93 57.46 1nmq s PHE 128 Cb -0.06 -2.21 0.09 0.00 -0.57 0.00 0.00 43.02 40.28 1nmq s PHE 128 CO 0.00 0.34 1.14 0.20 -0.10 0.00 0.00 175.22 176.80 1nmq s GLY 129 N 0.17 1.66 0.55 4.36 0.00 0.57 -4.60 107.32 110.04 1nmq s GLY 129 Ca 0.13 -0.87 0.26 0.00 0.00 0.00 0.00 44.72 44.23 1nmq s GLY 129 CO 0.02 -0.36 2.02 -0.91 0.00 0.00 0.00 173.10 173.87 1nmq h THR 130 N -0.98 0.65 -0.15 0.90 1.35 -1.35 -2.50 112.91 110.84 1nmq h THR 130 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1nmq h THR 130 Cb 1.31 0.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 1nmq h THR 130 CO 0.59 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.40 1nmq n ASN 131 N -4.18 2.28 0.00 5.36 6.94 -1.26 -1.13 115.26 123.28 1nmq n ASN 131 Ca 0.07 -1.84 0.00 0.00 -0.02 0.00 0.00 54.58 52.78 1nmq n ASN 131 Cb 0.50 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 1nmq n ASN 131 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nmq n GLY 132 N 0.10 0.73 3.86 4.83 0.00 -0.94 -4.93 105.19 108.84 1nmq n GLY 132 Ca 0.06 -1.25 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 1nmq n GLY 132 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1nmq s PRO 133 N -1.97 3.88 -0.02 1.61 0.04 -1.26 0.21 135.00 137.50 1nmq s PRO 133 Ca 0.00 0.44 0.06 0.00 0.04 0.00 0.00 61.00 61.54 1nmq s PRO 133 Cb 0.00 -2.55 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 1nmq s PRO 133 CO 0.00 0.24 -0.20 0.08 0.04 0.00 0.00 177.00 177.16 1nmq s VAL 134 N -1.90 1.57 0.10 -0.36 1.01 0.28 -4.81 120.40 116.28 1nmq s VAL 134 Ca 0.50 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 1nmq s VAL 134 Cb -0.11 -1.31 -0.06 0.00 0.00 0.00 0.00 36.38 34.90 1nmq s VAL 134 CO 0.20 0.45 1.13 -1.81 0.00 0.00 0.00 175.10 175.06 1nmq s ASP 135 N -0.37 7.19 0.35 3.32 1.11 -1.26 -0.65 116.67 126.37 1nmq s ASP 135 Ca 0.05 1.99 0.03 0.00 0.18 0.00 0.00 52.55 54.81 1nmq s ASP 135 Cb -0.09 -2.59 0.66 0.00 1.07 0.00 0.00 42.92 41.97 1nmq s ASP 135 CO -0.00 -0.34 2.00 -0.07 1.18 0.00 0.00 175.17 177.94 1nmq h LEU 136 N 6.12 0.67 -1.15 1.23 3.38 -1.50 -2.16 115.31 121.91 1nmq h LEU 136 Ca -0.43 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1nmq h LEU 136 Cb 1.21 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1nmq h LEU 136 CO 0.77 0.51 0.50 0.50 0.09 0.00 0.00 178.44 180.81 1nmq h LYS 137 N 0.78 1.08 -0.72 1.13 1.63 -1.92 0.00 116.57 118.55 1nmq h LYS 137 Ca 0.21 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1nmq h LYS 137 Cb -0.04 -0.23 -0.04 0.00 -0.60 0.00 0.00 32.23 31.33 1nmq h LYS 137 CO -0.04 0.74 0.46 -0.22 -3.45 0.00 0.00 179.45 176.94 1nmq h LYS 138 N 1.10 0.97 0.07 1.90 3.64 -1.78 0.12 116.57 122.59 1nmq h LYS 138 Ca 0.29 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1nmq h LYS 138 Cb -0.07 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.54 1nmq h LYS 138 CO -0.06 0.66 -0.04 0.82 -2.27 0.00 0.00 179.45 178.57 1nmq h ILE 139 N 0.98 1.06 0.00 2.00 2.04 -1.10 -3.22 117.51 119.28 1nmq h ILE 139 Ca 0.26 -0.46 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1nmq h ILE 139 Cb -0.07 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1nmq h ILE 139 CO -0.05 0.11 -0.13 0.71 0.00 0.00 0.00 178.15 178.79 1nmq h THR 140 N -0.30 0.28 -0.11 -0.27 1.35 -0.84 -3.19 112.91 109.84 1nmq h THR 140 Ca -0.01 -1.05 -0.03 0.00 -0.55 0.00 0.00 66.41 64.77 1nmq h THR 140 Cb 0.26 1.83 -0.01 0.00 -1.73 0.00 0.00 68.15 68.51 1nmq h THR 140 CO 0.02 0.13 -0.07 0.78 -0.25 0.00 0.00 175.52 176.13 1nmq h ASN 141 N 0.00 0.15 -0.13 5.36 2.35 -0.77 -0.98 115.58 121.56 1nmq h ASN 141 Ca -0.00 -0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1nmq h ASN 141 Cb 0.82 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.15 1nmq h ASN 141 CO 0.02 0.25 0.18 -0.26 -1.65 0.00 0.00 177.43 175.97 1nmq h PHE 142 N 0.16 0.00 -0.06 1.19 0.04 -1.66 -1.71 116.94 114.90 1nmq h PHE 142 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1nmq h PHE 142 Cb 0.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 1nmq h PHE 142 CO 0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 1nmq n PHE 143 N -3.63 0.05 -1.44 -0.55 3.72 -0.38 -3.98 117.46 111.25 1nmq n PHE 143 Ca 0.00 -0.03 -0.45 0.00 -0.05 0.00 0.00 57.45 56.93 1nmq n PHE 143 Cb 0.29 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.81 1nmq n PHE 143 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1nmq n ARG 144 N 1.27 0.41 0.08 -1.08 1.74 -0.64 -4.52 116.66 113.92 1nmq n ARG 144 Ca 0.14 0.15 0.21 0.00 -0.77 0.00 0.00 57.85 57.57 1nmq n ARG 144 Cb 0.56 -1.29 0.70 0.00 -1.02 0.00 0.00 32.46 31.41 1nmq n ARG 144 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1nmq h GLY 145 N 1.06 0.00 1.00 -0.13 0.00 -1.45 0.18 103.07 103.73 1nmq h GLY 145 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1nmq h GLY 145 CO 0.55 0.00 -0.90 2.09 0.00 0.00 0.00 176.54 178.28 1nmq n ASP 146 N -3.53 0.78 -0.05 0.19 5.75 -1.26 -4.34 116.55 114.09 1nmq n ASP 146 Ca 0.08 0.21 0.08 0.00 -0.01 0.00 0.00 54.79 55.15 1nmq n ASP 146 Cb 0.73 0.40 -0.08 0.00 -1.03 0.00 0.00 41.12 41.15 1nmq n ASP 146 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1nmq n ARG 147 N -2.44 1.76 -3.33 0.11 1.74 0.54 -4.67 116.66 110.37 1nmq n ARG 147 Ca 0.01 -0.12 -0.26 0.00 -0.77 0.00 0.00 57.85 56.72 1nmq n ARG 147 Cb 0.51 -1.25 -0.09 0.00 -1.02 0.00 0.00 32.46 30.61 1nmq n ARG 147 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nmq h ARG 149 N 4.71 0.00 -0.03 0.00 2.47 -1.83 0.12 114.38 119.82 1nmq h ARG 149 Ca 0.16 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.88 1nmq h ARG 149 Cb 0.86 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.18 1nmq h ARG 149 CO 0.48 0.00 0.00 -1.13 0.56 0.00 0.00 179.97 179.88 1nmq n SER 150 N -3.62 0.77 -0.10 7.04 3.41 -1.26 -3.16 113.62 116.70 1nmq n SER 150 Ca 0.05 -1.35 0.01 0.00 -0.26 0.00 0.00 58.87 57.32 1nmq n SER 150 Cb 0.56 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.50 1nmq n SER 150 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1nmq n LEU 151 N -0.36 1.18 -4.68 1.04 4.77 0.42 -4.16 117.00 115.21 1nmq n LEU 151 Ca 0.19 -0.99 -0.46 0.00 -0.03 0.00 0.00 56.01 54.73 1nmq n LEU 151 Cb 0.22 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 1nmq n LEU 151 CO 0.15 0.27 1.28 0.41 -1.33 0.00 0.00 177.39 178.17 1nmq n THR 152 N 0.11 0.12 -0.85 -5.08 -1.04 -1.17 -0.13 114.28 106.24 1nmq n THR 152 Ca 0.01 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1nmq n THR 152 Cb 0.06 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 66.89 1nmq n THR 152 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nmq n GLY 153 N 3.69 0.62 3.33 3.41 0.00 -1.26 -5.02 105.19 109.95 1nmq n GLY 153 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1nmq n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nmq s LYS 154 N -0.15 1.91 0.12 1.61 1.02 0.82 -4.93 119.74 120.14 1nmq s LYS 154 Ca 0.00 -1.04 -0.31 0.00 0.02 0.00 0.00 55.97 54.64 1nmq s LYS 154 Cb 0.00 -1.99 -0.08 0.00 -0.52 0.00 0.00 37.83 35.24 1nmq s LYS 154 CO 0.00 0.53 1.39 -1.25 -0.92 0.00 0.00 175.35 175.10 1nmq s PRO 155 N -1.00 4.32 -0.34 -1.68 0.04 -1.26 -4.85 135.00 130.22 1nmq s PRO 155 Ca 0.11 2.09 -0.00 0.00 0.04 0.00 0.00 61.00 63.24 1nmq s PRO 155 Cb -0.10 -3.24 0.08 0.00 0.04 0.00 0.00 34.50 31.29 1nmq s PRO 155 CO 0.01 -0.43 0.07 0.15 0.04 0.00 0.00 177.00 176.83 1nmq s LYS 156 N 1.01 2.04 -0.18 4.56 1.02 -0.27 -2.11 119.74 125.81 1nmq s LYS 156 Ca 0.64 -1.61 -0.14 0.00 0.02 0.00 0.00 55.97 54.88 1nmq s LYS 156 Cb -0.37 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.60 1nmq s LYS 156 CO 0.31 -0.84 0.32 -0.51 -0.92 0.00 0.00 175.35 173.71 1nmq s LEU 157 N 1.11 4.21 -0.23 3.17 1.43 0.25 -1.81 118.68 126.82 1nmq s LEU 157 Ca 0.03 0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 53.61 1nmq s LEU 157 Cb -0.21 -2.40 0.02 0.00 0.03 0.00 0.00 46.19 43.63 1nmq s LEU 157 CO -0.04 0.04 -0.09 -0.36 0.23 0.00 0.00 176.35 176.13 1nmq s PHE 158 N 0.75 3.00 -0.20 0.29 0.40 0.58 -0.71 117.98 122.08 1nmq s PHE 158 Ca 0.17 -1.54 -0.06 0.00 -0.60 0.00 0.00 56.93 54.90 1nmq s PHE 158 Cb -0.14 -2.02 -0.03 0.00 0.51 0.00 0.00 43.02 41.34 1nmq s PHE 158 CO 0.05 -0.73 0.03 0.42 0.70 0.00 0.00 175.22 175.69 1nmq s ILE 159 N 1.32 4.22 -0.21 0.64 1.01 0.33 -0.18 121.20 128.34 1nmq s ILE 159 Ca 0.01 -0.22 -0.00 0.00 0.00 0.00 0.00 60.65 60.44 1nmq s ILE 159 Cb -0.16 -2.92 0.06 0.00 0.01 0.00 0.00 42.46 39.45 1nmq s ILE 159 CO -0.06 0.42 -0.04 -0.63 0.00 0.00 0.00 174.94 174.63 1nmq s ILE 160 N 0.93 1.24 -0.51 2.92 1.01 -0.72 -0.45 121.20 125.62 1nmq s ILE 160 Ca 0.02 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.59 1nmq s ILE 160 Cb -0.14 -1.53 0.12 0.00 0.01 0.00 0.00 42.46 40.92 1nmq s ILE 160 CO 0.02 -0.06 0.43 -1.58 0.00 0.00 0.00 174.94 173.75 1nmq s GLN 161 N 1.54 2.79 -0.11 2.79 2.00 -0.13 -1.43 119.66 127.12 1nmq s GLN 161 Ca -0.03 -1.71 -0.30 0.00 -2.00 0.00 0.00 55.36 51.32 1nmq s GLN 161 Cb -0.18 -4.14 0.12 0.00 0.80 0.00 0.00 33.01 29.61 1nmq s GLN 161 CO -0.07 -1.26 1.00 0.00 -0.50 0.00 0.00 175.29 174.46 1nmq s ALA 162 N 1.51 -1.92 0.65 1.58 0.00 -1.26 -2.05 121.76 120.27 1nmq s ALA 162 Ca 0.04 1.37 -0.15 0.00 0.00 0.00 0.00 51.96 53.22 1nmq s ALA 162 Cb -0.28 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1nmq s ALA 162 CO 0.02 -0.50 1.11 0.00 0.00 0.00 0.00 175.76 176.39 1nmq n ARG 164 N -2.32 0.86 -1.21 0.00 1.74 -0.01 -1.93 116.66 113.78 1nmq n ARG 164 Ca 0.10 -2.23 0.00 0.00 -0.77 0.00 0.00 57.85 54.95 1nmq n ARG 164 Cb 0.52 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 1nmq n ARG 164 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nmq n GLY 165 N -0.79 0.44 0.02 -0.13 0.00 -1.11 -1.05 105.19 102.57 1nmq n GLY 165 Ca 0.11 -1.67 0.02 0.00 0.00 0.00 0.00 46.02 44.48 1nmq n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nmq n THR 166 N 9.00 1.04 -2.50 2.61 -2.24 -0.97 -3.46 114.28 117.75 1nmq n THR 166 Ca 0.00 -1.10 -0.38 0.00 -2.27 0.00 0.00 64.05 60.30 1nmq n THR 166 Cb 0.00 0.42 -0.04 0.00 -2.10 0.00 0.00 70.33 68.61 1nmq n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1nmq s GLU 167 N -1.20 4.33 0.06 -0.78 2.02 -0.55 -4.78 118.70 117.81 1nmq s GLU 167 Ca 0.05 1.64 0.07 0.00 0.02 0.00 0.00 54.97 56.75 1nmq s GLU 167 Cb 0.05 -2.78 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 1nmq s GLU 167 CO 0.00 -0.03 -0.14 -0.51 0.02 0.00 0.00 175.26 174.61 1nmq s LEU 168 N -2.20 2.83 -0.34 1.80 1.43 -1.26 -1.54 118.68 119.39 1nmq s LEU 168 Ca 0.53 -0.39 -0.05 0.00 -1.03 0.00 0.00 54.13 53.20 1nmq s LEU 168 Cb -0.26 -1.65 0.06 0.00 0.03 0.00 0.00 46.19 44.36 1nmq s LEU 168 CO 0.33 0.23 0.10 -0.62 0.23 0.00 0.00 176.35 176.62 1nmq s ASP 169 N -1.74 5.20 0.07 2.29 -1.08 -1.26 -4.96 116.67 115.19 1nmq s ASP 169 Ca 0.17 -1.36 0.27 0.00 -0.52 0.00 0.00 52.55 51.12 1nmq s ASP 169 Cb -0.11 -1.82 0.99 0.00 -1.46 0.00 0.00 42.92 40.52 1nmq s ASP 169 CO 0.09 -0.36 1.80 0.00 0.52 0.00 0.00 175.17 177.22 1nmq n GLY 171 N 1.43 -1.87 2.91 0.00 0.00 -1.26 -4.79 105.19 101.62 1nmq n GLY 171 Ca 0.06 -1.30 -0.15 0.00 0.00 0.00 0.00 46.02 44.63 1nmq n GLY 171 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1nmq s ILE 172 N -2.04 0.26 0.55 -0.61 1.10 -1.26 -5.11 121.20 114.08 1nmq s ILE 172 Ca 0.00 -0.10 -0.21 0.00 -0.51 0.00 0.00 60.65 59.83 1nmq s ILE 172 Cb 0.00 -0.25 -0.05 0.00 0.15 0.00 0.00 42.46 42.32 1nmq s ILE 172 CO 0.00 0.09 1.28 -1.61 -2.11 0.00 0.00 174.94 172.59 1nmq s GLU 173 N 0.14 3.18 0.47 3.50 2.02 -1.26 -5.23 118.70 121.51 1nmq s GLU 173 Ca -0.01 2.03 0.06 0.00 0.02 0.00 0.00 54.97 57.07 1nmq s GLU 173 Cb -0.04 -2.18 -0.02 0.00 0.10 0.00 0.00 34.13 31.99 1nmq s GLU 173 CO -0.00 -1.10 0.23 0.95 0.02 0.00 0.00 175.26 175.36 1nmq s THR 174 N -1.42 1.96 0.02 3.63 -4.23 -1.26 -5.35 115.64 108.99 1nmq s THR 174 Ca 0.72 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1nmq s THR 174 Cb -0.36 -2.62 0.00 0.00 1.34 0.00 0.00 72.50 70.86 1nmq s THR 174 CO 0.41 0.00 0.00 0.47 -0.54 0.00 0.00 174.62 174.96 1nmq n ASP 179 N -1.41 -3.48 0.00 3.99 8.00 -1.26 -5.35 116.55 117.03 1nmq n ASP 179 Ca -0.04 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.54 1nmq n ASP 179 Cb 0.65 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 1nmq n ASP 179 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1nmq n ASP 180 N -3.52 0.00 0.00 -2.24 2.03 -1.26 -5.39 116.55 106.17 1nmq n ASP 180 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1nmq n ASP 180 Cb 0.03 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 1nmq n ASP 180 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1nmq n ASP 181 N 0.00 0.00 -2.90 1.67 8.00 -1.26 -5.32 116.55 116.74 1nmq n ASP 181 Ca 0.00 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.48 1nmq n ASP 181 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1nmq n ASP 181 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nmq s HIS 185 N -0.40 3.04 0.22 0.00 2.46 -1.26 -5.09 115.29 114.26 1nmq s HIS 185 Ca -0.11 -3.09 0.06 0.00 0.47 0.00 0.00 55.06 52.39 1nmq s HIS 185 Cb 0.01 -2.52 -0.04 0.00 -0.13 0.00 0.00 32.58 29.90 1nmq s HIS 185 CO 0.33 -0.67 0.21 0.15 -2.47 0.00 0.00 174.74 172.29 1nmq s LYS 186 N -0.66 3.03 0.12 2.88 1.02 -1.26 -5.13 119.74 119.74 1nmq s LYS 186 Ca 0.21 -0.92 0.08 0.00 0.02 0.00 0.00 55.97 55.36 1nmq s LYS 186 Cb -0.15 -2.66 -0.04 0.00 -0.52 0.00 0.00 37.83 34.46 1nmq s LYS 186 CO -0.08 0.44 -0.18 0.96 -0.92 0.00 0.00 175.35 175.57 1nmq s ILE 187 N -1.97 1.61 0.47 2.17 -4.36 -1.26 -5.13 121.20 112.74 1nmq s ILE 187 Ca 0.33 -1.65 -0.23 0.00 -0.26 0.00 0.00 60.65 58.84 1nmq s ILE 187 Cb -0.09 -1.58 -0.09 0.00 1.25 0.00 0.00 42.46 41.96 1nmq s ILE 187 CO 0.25 -0.21 1.11 -2.65 0.24 0.00 0.00 174.94 173.68 1nmq n PRO 188 N 0.80 1.46 0.26 0.37 -0.02 -1.26 -4.90 135.00 131.70 1nmq n PRO 188 Ca -0.17 0.53 0.15 0.00 -2.02 0.00 0.00 63.50 61.99 1nmq n PRO 188 Cb 0.55 -2.22 0.51 0.00 -0.02 0.00 0.00 33.50 32.32 1nmq n PRO 188 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1nmq h VAL 189 N 1.47 0.03 -0.02 -1.45 -1.51 -1.98 -3.02 116.25 109.78 1nmq h VAL 189 Ca -0.47 -0.70 0.00 0.00 -1.23 0.00 0.00 66.70 64.30 1nmq h VAL 189 Cb 1.33 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 32.17 1nmq h VAL 189 CO 0.56 0.01 -0.01 0.47 -1.23 0.00 0.00 177.57 177.38 1nmq n ASP 190 N -3.11 2.01 -4.84 4.19 8.00 -1.26 -1.20 116.55 120.34 1nmq n ASP 190 Ca 0.02 -1.66 -0.31 0.00 0.71 0.00 0.00 54.79 53.55 1nmq n ASP 190 Cb 0.38 0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.52 1nmq n ASP 190 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nmq s ALA 191 N -2.02 2.89 -0.76 2.24 0.00 -1.14 -4.05 121.76 118.93 1nmq s ALA 191 Ca 0.34 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1nmq s ALA 191 Cb 0.21 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1nmq s ALA 191 CO 0.33 -0.91 0.00 -0.25 0.00 0.00 0.00 175.76 174.93 1nmq n ASP 192 N -2.83 -3.24 -4.67 0.00 8.00 0.05 -4.78 116.55 109.08 1nmq n ASP 192 Ca 0.07 0.05 -0.31 0.00 0.71 0.00 0.00 54.79 55.31 1nmq n ASP 192 Cb 0.54 -2.25 -0.09 0.00 -0.02 0.00 0.00 41.12 39.30 1nmq n ASP 192 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1nmq s PHE 193 N -2.38 3.01 -0.04 1.24 0.08 -1.24 -1.11 117.98 117.53 1nmq s PHE 193 Ca 0.00 0.01 -0.01 0.00 0.12 0.00 0.00 56.93 57.06 1nmq s PHE 193 Cb 0.00 -1.60 0.03 0.00 -0.57 0.00 0.00 43.02 40.88 1nmq s PHE 193 CO 0.00 0.46 0.02 -1.17 -0.10 0.00 0.00 175.22 174.43 1nmq s LEU 194 N -1.92 0.79 -0.29 -0.37 0.20 -0.75 -0.70 118.68 115.64 1nmq s LEU 194 Ca 0.22 -0.01 -0.01 0.00 0.69 0.00 0.00 54.13 55.03 1nmq s LEU 194 Cb -0.12 -0.24 0.05 0.00 -0.43 0.00 0.00 46.19 45.46 1nmq s LEU 194 CO 0.14 -0.16 -0.02 -0.31 -0.29 0.00 0.00 176.35 175.71 1nmq s TYR 195 N 1.50 3.28 -0.69 5.38 1.51 0.02 -0.31 117.35 128.04 1nmq s TYR 195 Ca -0.03 -2.00 -0.17 0.00 -1.01 0.00 0.00 57.07 53.87 1nmq s TYR 195 Cb -0.13 -2.10 0.15 0.00 -0.11 0.00 0.00 41.96 39.77 1nmq s TYR 195 CO -0.03 -0.83 0.73 0.00 -1.11 0.00 0.00 175.55 174.32 1nmq s ALA 196 N 1.21 3.65 0.12 3.71 0.00 0.75 -0.53 121.76 130.67 1nmq s ALA 196 Ca -0.06 -2.67 -0.24 0.00 0.00 0.00 0.00 51.96 48.99 1nmq s ALA 196 Cb -0.20 -3.53 -0.07 0.00 0.00 0.00 0.00 23.12 19.32 1nmq s ALA 196 CO -0.02 -2.34 0.73 0.71 0.00 0.00 0.00 175.76 174.84 1nmq s TYR 197 N 1.73 3.86 -0.57 0.00 2.02 0.09 -1.76 117.35 122.73 1nmq s TYR 197 Ca 0.14 1.52 0.20 0.00 -0.37 0.00 0.00 57.07 58.56 1nmq s TYR 197 Cb -0.19 -2.71 0.88 0.00 -0.40 0.00 0.00 41.96 39.54 1nmq s TYR 197 CO -0.01 0.49 1.61 -1.13 -1.57 0.00 0.00 175.55 174.95 1nmq n SER 198 N 1.82 0.48 -3.73 2.29 3.41 -0.52 -1.00 113.62 116.38 1nmq n SER 198 Ca -0.06 0.64 -0.09 0.00 -0.26 0.00 0.00 58.87 59.10 1nmq n SER 198 Cb 0.49 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.69 1nmq n SER 198 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1nmq s THR 199 N -3.27 0.01 0.65 6.66 -1.32 -1.26 -3.91 115.64 113.19 1nmq s THR 199 Ca 0.03 -0.72 -0.15 0.00 -1.21 0.00 0.00 61.69 59.65 1nmq s THR 199 Cb 0.08 -1.66 -0.01 0.00 -1.51 0.00 0.00 72.50 69.40 1nmq s THR 199 CO 0.31 -0.03 1.09 0.00 -2.21 0.00 0.00 174.62 173.78 1nmq s ALA 200 N -3.87 2.57 0.27 11.08 0.00 -0.79 -4.01 121.76 127.00 1nmq s ALA 200 Ca 0.09 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.18 1nmq s ALA 200 Cb -0.03 -3.27 -0.13 0.00 0.00 0.00 0.00 23.12 19.69 1nmq s ALA 200 CO -0.00 -1.14 1.41 -2.30 0.00 0.00 0.00 175.76 173.72 1nmq n PRO 201 N -2.42 2.14 0.00 0.00 -0.02 -1.26 -2.47 135.00 130.97 1nmq n PRO 201 Ca 0.09 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1nmq n PRO 201 Cb 0.52 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1nmq n PRO 201 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nmq n GLY 202 N 1.86 2.31 3.97 -1.23 0.00 -0.22 -5.00 105.19 106.88 1nmq n GLY 202 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1nmq n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nmq s TYR 203 N -2.58 3.45 0.62 1.61 1.51 -1.03 -1.48 117.35 119.46 1nmq s TYR 203 Ca 0.00 -0.00 -0.16 0.00 -1.01 0.00 0.00 57.07 55.90 1nmq s TYR 203 Cb 0.00 -1.59 -0.02 0.00 -0.11 0.00 0.00 41.96 40.24 1nmq s TYR 203 CO 0.00 0.44 1.10 0.71 -1.11 0.00 0.00 175.55 176.69 1nmq s TYR 204 N -1.97 2.74 -0.06 2.71 1.51 -0.59 -0.83 117.35 120.86 1nmq s TYR 204 Ca 0.34 1.54 0.05 0.00 -1.01 0.00 0.00 57.07 57.99 1nmq s TYR 204 Cb -0.09 -3.14 -0.01 0.00 -0.11 0.00 0.00 41.96 38.61 1nmq s TYR 204 CO 0.29 -1.49 -0.23 0.45 -1.11 0.00 0.00 175.55 173.46 1nmq s SER 205 N -2.51 2.91 -0.07 2.29 0.15 -1.26 -4.84 113.70 110.36 1nmq s SER 205 Ca 0.67 -0.49 -0.15 0.00 0.70 0.00 0.00 55.95 56.67 1nmq s SER 205 Cb -0.20 -0.91 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 1nmq s SER 205 CO 0.38 0.21 0.39 0.26 1.20 0.00 0.00 173.24 175.68 1nmq s TRP 206 N -0.02 3.60 -0.08 3.44 0.52 -1.26 -4.77 118.94 120.37 1nmq s TRP 206 Ca -0.07 0.86 -0.00 0.00 0.02 0.00 0.00 56.10 56.91 1nmq s TRP 206 Cb -0.14 -2.36 0.02 0.00 -1.15 0.00 0.00 33.47 29.84 1nmq s TRP 206 CO 0.04 0.42 -0.04 0.50 0.02 0.00 0.00 176.95 177.90 1nmq s ARG 207 N -0.24 1.01 -0.07 4.98 3.52 -1.26 -2.08 118.95 124.81 1nmq s ARG 207 Ca 0.22 -0.08 -0.20 0.00 -0.13 0.00 0.00 55.73 55.55 1nmq s ARG 207 Cb -0.15 -1.17 -0.04 0.00 -1.56 0.00 0.00 34.95 32.03 1nmq s ARG 207 CO 0.10 -0.23 0.56 1.21 -0.81 0.00 0.00 175.30 176.13 1nmq s ASN 208 N 1.61 6.84 0.46 -2.12 3.84 0.26 -4.89 114.94 120.94 1nmq s ASN 208 Ca 0.01 1.00 0.24 0.00 0.21 0.00 0.00 52.86 54.31 1nmq s ASN 208 Cb -0.13 -2.33 1.25 0.00 -0.55 0.00 0.00 41.25 39.49 1nmq s ASN 208 CO -0.05 0.01 1.85 0.28 -2.79 0.00 0.00 177.10 176.41 1nmq h SER 209 N 6.36 0.25 0.00 -4.21 0.02 -1.82 0.11 113.55 114.26 1nmq h SER 209 Ca -0.43 0.03 -0.21 0.00 -0.84 0.00 0.00 61.79 60.35 1nmq h SER 209 Cb 1.19 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 63.68 1nmq h SER 209 CO 0.73 0.08 -1.78 2.29 -1.14 0.00 0.00 176.83 177.01 1nmq n LYS 210 N -4.43 2.10 0.00 3.45 2.85 -1.26 -3.26 118.16 117.61 1nmq n LYS 210 Ca 0.20 -0.00 0.09 0.00 -1.05 0.00 0.00 58.31 57.55 1nmq n LYS 210 Cb 0.85 -1.29 -0.09 0.00 -0.65 0.00 0.00 35.03 33.84 1nmq n LYS 210 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1nmq n ASP 211 N -2.43 0.94 0.00 -5.58 8.00 -1.17 -4.94 116.55 111.36 1nmq n ASP 211 Ca -0.19 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.34 1nmq n ASP 211 Cb 0.87 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.92 1nmq n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nmq n GLY 212 N 1.41 -1.58 3.79 0.44 0.00 0.36 -4.72 105.19 104.88 1nmq n GLY 212 Ca 0.04 -2.06 -0.36 0.00 0.00 0.00 0.00 46.02 43.64 1nmq n GLY 212 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nmq s SER 213 N -4.00 6.56 0.19 1.61 1.04 -1.26 0.91 113.70 118.74 1nmq s SER 213 Ca 0.00 2.03 -0.12 0.00 0.48 0.00 0.00 55.95 58.34 1nmq s SER 213 Cb 0.00 -2.58 0.11 0.00 0.10 0.00 0.00 66.02 63.65 1nmq s SER 213 CO 0.00 -0.63 1.85 -0.50 0.98 0.00 0.00 173.24 174.93 1nmq h TRP 214 N 2.15 0.83 -0.01 5.02 6.55 -1.79 -2.30 115.95 126.39 1nmq h TRP 214 Ca -0.49 0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.36 1nmq h TRP 214 Cb 1.22 -0.28 -0.00 0.00 -0.86 0.00 0.00 29.16 29.24 1nmq h TRP 214 CO 0.57 0.54 0.00 0.35 -1.05 0.00 0.00 178.44 178.85 1nmq h PHE 215 N 0.87 0.02 -0.58 0.49 3.57 -1.89 -2.55 116.94 116.87 1nmq h PHE 215 Ca 0.23 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.64 1nmq h PHE 215 Cb -0.07 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1nmq h PHE 215 CO -0.02 0.21 0.01 0.82 -2.23 0.00 0.00 178.31 177.10 1nmq h ILE 216 N -0.17 1.26 -0.86 1.41 1.08 -1.93 0.53 117.51 118.83 1nmq h ILE 216 Ca 0.00 -1.12 0.01 0.00 -0.39 0.00 0.00 64.86 63.36 1nmq h ILE 216 Cb 0.20 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.74 1nmq h ILE 216 CO -0.00 0.41 0.57 0.06 -0.69 0.00 0.00 178.15 178.50 1nmq h GLN 217 N 0.92 1.13 -0.22 2.37 3.07 -1.42 -1.27 115.11 119.68 1nmq h GLN 217 Ca 0.17 -0.07 -0.17 0.00 0.09 0.00 0.00 58.65 58.67 1nmq h GLN 217 Cb 0.54 -0.25 0.00 0.00 0.08 0.00 0.00 27.48 27.85 1nmq h GLN 217 CO 0.03 0.75 -0.52 0.77 0.09 0.00 0.00 178.83 179.94 1nmq h SER 218 N 1.16 0.85 -0.12 0.06 0.02 -1.13 -2.02 113.55 112.36 1nmq h SER 218 Ca 0.32 -0.56 0.02 0.00 -0.84 0.00 0.00 61.79 60.73 1nmq h SER 218 Cb -0.12 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.15 1nmq h SER 218 CO -0.07 1.25 -0.01 0.25 -1.14 0.00 0.00 176.83 177.11 1nmq h LEU 219 N 0.48 -0.07 -0.25 5.07 5.85 -0.67 0.15 115.31 125.87 1nmq h LEU 219 Ca -0.00 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1nmq h LEU 219 Cb 1.14 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1nmq h LEU 219 CO 0.11 -0.02 0.09 0.00 -0.34 0.00 0.00 178.44 178.29 1nmq h ALA 221 N 1.16 0.58 -0.41 0.00 0.00 -1.11 0.29 119.26 119.76 1nmq h ALA 221 Ca 0.11 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1nmq h ALA 221 Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1nmq h ALA 221 CO -0.11 -0.02 -0.13 0.52 0.00 0.00 0.00 179.25 179.51 1nmq h MET 222 N 0.57 0.75 -0.62 0.00 2.07 -0.43 -0.87 114.93 116.41 1nmq h MET 222 Ca 0.18 -0.26 -0.07 0.00 -2.07 0.00 0.00 59.70 57.47 1nmq h MET 222 Cb -0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.63 1nmq h MET 222 CO -0.06 0.85 0.10 -0.07 1.07 0.00 0.00 176.91 178.79 1nmq h LEU 223 N 0.68 0.98 -0.77 1.22 3.38 -0.07 0.15 115.31 120.88 1nmq h LEU 223 Ca 0.11 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 1nmq h LEU 223 Cb 0.61 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1nmq h LEU 223 CO 0.04 1.00 0.24 0.11 0.09 0.00 0.00 178.44 179.91 1nmq h LYS 224 N 0.93 1.16 0.13 1.13 1.57 -0.51 -0.09 116.57 120.89 1nmq h LYS 224 Ca 0.19 -0.25 -0.27 0.00 -1.87 0.00 0.00 60.65 58.45 1nmq h LYS 224 Cb 0.43 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.58 1nmq h LYS 224 CO 0.01 0.98 -1.23 0.37 -0.57 0.00 0.00 179.45 179.01 1nmq h GLN 225 N 1.11 0.30 0.00 3.15 4.15 -0.93 -3.41 115.11 119.48 1nmq h GLN 225 Ca 0.24 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.17 1nmq h GLN 225 Cb 0.30 0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.17 1nmq h GLN 225 CO -0.01 1.23 0.00 0.66 -1.93 0.00 0.00 178.83 178.78 1nmq n TYR 226 N -3.56 0.00 0.33 3.99 4.01 0.51 -4.69 117.16 117.76 1nmq n TYR 226 Ca -0.09 0.00 0.19 0.00 -0.16 0.00 0.00 57.90 57.84 1nmq n TYR 226 Cb 1.01 0.00 1.01 0.00 -0.31 0.00 0.00 39.34 41.05 1nmq n TYR 226 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1nmq h ALA 227 N 0.00 1.17 -0.00 -0.72 0.00 -1.13 0.16 119.26 118.73 1nmq h ALA 227 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nmq h ALA 227 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1nmq h ALA 227 CO 0.00 -0.17 -0.44 -0.40 0.00 0.00 0.00 179.25 178.24 1nmq n ASP 228 N -2.96 0.68 0.00 0.00 5.75 -1.26 -4.09 116.55 114.67 1nmq n ASP 228 Ca -0.02 -0.47 0.00 0.00 -0.01 0.00 0.00 54.79 54.29 1nmq n ASP 228 Cb 0.23 0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 1nmq n ASP 228 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1nmq n LYS 229 N -1.24 1.79 -3.92 0.11 5.02 -0.23 -4.99 118.16 114.70 1nmq n LYS 229 Ca 0.07 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.04 1nmq n LYS 229 Cb 0.34 -0.75 -0.05 0.00 -0.02 0.00 0.00 35.03 34.55 1nmq n LYS 229 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nmq s LEU 230 N -2.70 4.33 0.54 -0.35 1.43 -0.12 -5.08 118.68 116.72 1nmq s LEU 230 Ca 0.00 0.30 -0.21 0.00 -1.03 0.00 0.00 54.13 53.19 1nmq s LEU 230 Cb 0.00 -2.74 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 1nmq s LEU 230 CO 0.00 0.22 1.22 -0.70 0.23 0.00 0.00 176.35 177.32 1nmq s GLU 231 N -2.18 3.28 0.14 1.70 -6.30 -1.26 -4.72 118.70 109.36 1nmq s GLU 231 Ca 0.30 1.87 -0.28 0.00 -2.50 0.00 0.00 54.97 54.36 1nmq s GLU 231 Cb -0.13 -2.15 -0.04 0.00 0.00 0.00 0.00 34.13 31.82 1nmq s GLU 231 CO 0.22 -0.97 1.58 0.35 0.02 0.00 0.00 175.26 176.46 1nmq h PHE 232 N 1.38 -1.22 -0.88 5.30 3.57 -1.16 -1.57 116.94 122.37 1nmq h PHE 232 Ca -0.50 0.05 0.22 0.00 3.53 0.00 0.00 57.97 61.28 1nmq h PHE 232 Cb 1.28 0.56 -0.13 0.00 2.79 0.00 0.00 35.95 40.45 1nmq h PHE 232 CO 0.49 -0.46 0.31 0.52 -2.23 0.00 0.00 178.31 176.94 1nmq h MET 233 N -0.44 0.29 -0.18 1.11 2.86 -1.92 0.15 114.93 116.81 1nmq h MET 233 Ca 0.10 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.60 1nmq h MET 233 Cb 0.61 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 1nmq h MET 233 CO -0.45 0.19 -0.39 0.45 1.06 0.00 0.00 176.91 177.77 1nmq h HIS 234 N 0.30 0.47 -0.52 -0.22 3.86 -1.69 -1.44 115.15 115.91 1nmq h HIS 234 Ca 0.55 -0.13 -0.08 0.00 -1.16 0.00 0.00 60.37 59.55 1nmq h HIS 234 Cb 1.07 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.42 1nmq h HIS 234 CO -0.20 0.74 0.00 0.82 0.86 0.00 0.00 177.93 180.15 1nmq h ILE 235 N 0.34 1.26 0.00 2.45 2.04 0.08 -2.24 117.51 121.43 1nmq h ILE 235 Ca 0.03 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.79 1nmq h ILE 235 Cb 0.84 0.93 -0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1nmq h ILE 235 CO 0.07 0.39 -0.08 -0.07 0.00 0.00 0.00 178.15 178.45 1nmq h LEU 236 N 0.79 0.00 0.07 1.44 3.38 -0.43 -1.47 115.31 119.09 1nmq h LEU 236 Ca 0.15 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.83 1nmq h LEU 236 Cb 0.52 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.29 1nmq h LEU 236 CO 0.03 0.08 -1.20 0.74 0.09 0.00 0.00 178.44 178.18 1nmq h THR 237 N 0.00 1.33 -0.74 0.22 2.02 -0.86 -1.85 112.91 113.03 1nmq h THR 237 Ca -0.00 -2.54 0.06 0.00 0.77 0.00 0.00 66.41 64.70 1nmq h THR 237 Cb 0.43 2.68 -0.06 0.00 -1.74 0.00 0.00 68.15 69.47 1nmq h THR 237 CO 0.01 0.77 0.43 0.03 0.37 0.00 0.00 175.52 177.13 1nmq h ARG 238 N 0.24 0.76 -0.11 6.66 2.47 -0.72 -1.40 114.38 122.28 1nmq h ARG 238 Ca -0.17 -0.05 0.02 0.00 -1.26 0.00 0.00 59.98 58.53 1nmq h ARG 238 Cb 1.87 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 30.00 1nmq h ARG 238 CO 0.22 0.50 -0.04 0.28 0.56 0.00 0.00 179.97 181.50 1nmq h VAL 239 N 0.79 0.86 -0.58 2.04 2.07 -1.19 0.14 116.25 120.38 1nmq h VAL 239 Ca 0.33 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.97 1nmq h VAL 239 Cb 0.18 0.86 -0.10 0.00 -1.52 0.00 0.00 31.29 30.71 1nmq h VAL 239 CO -0.18 0.00 -0.01 0.78 0.02 0.00 0.00 177.57 178.18 1nmq h ASN 240 N -0.02 -0.28 -0.09 0.57 4.21 -0.95 -0.52 115.58 118.51 1nmq h ASN 240 Ca 0.06 0.14 -0.01 0.00 1.21 0.00 0.00 56.30 57.71 1nmq h ASN 240 Cb 0.11 0.26 -0.00 0.00 -1.12 0.00 0.00 38.32 37.57 1nmq h ASN 240 CO -0.13 -0.11 0.03 -0.09 -1.29 0.00 0.00 177.43 175.85 1nmq h ARG 241 N 0.11 0.13 -0.04 0.81 2.43 -0.55 -1.29 114.38 115.98 1nmq h ARG 241 Ca 0.30 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.46 1nmq h ARG 241 Cb 0.47 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1nmq h ARG 241 CO -0.50 0.27 -0.08 -0.22 -1.51 0.00 0.00 179.97 177.93 1nmq h LYS 242 N -0.03 -0.11 -0.43 0.20 3.64 -0.11 -1.20 116.57 118.52 1nmq h LYS 242 Ca 0.03 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1nmq h LYS 242 Cb 0.19 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1nmq h LYS 242 CO -0.00 -0.08 0.25 0.28 -2.27 0.00 0.00 179.45 177.64 1nmq h VAL 243 N -0.12 1.05 0.00 2.00 2.07 -1.11 -0.47 116.25 119.67 1nmq h VAL 243 Ca 0.04 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1nmq h VAL 243 Cb 0.18 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1nmq h VAL 243 CO -0.11 0.09 -0.04 0.00 0.02 0.00 0.00 177.57 177.53 1nmq h ALA 244 N 1.19 1.02 0.00 1.67 0.00 -0.72 -3.13 119.26 119.29 1nmq h ALA 244 Ca 0.17 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1nmq h ALA 244 Cb 0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1nmq h ALA 244 CO -0.08 0.05 -1.73 0.25 0.00 0.00 0.00 179.25 177.74 1nmq n THR 245 N -3.17 0.74 1.28 0.00 -2.24 -0.50 -4.68 114.28 105.70 1nmq n THR 245 Ca 0.00 -0.28 0.13 0.00 -2.27 0.00 0.00 64.05 61.63 1nmq n THR 245 Cb 0.30 -0.96 0.38 0.00 -2.10 0.00 0.00 70.33 67.95 1nmq n THR 245 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nmq n GLU 246 N -2.88 1.07 -5.27 -0.78 1.02 -0.20 -4.88 120.64 108.72 1nmq n GLU 246 Ca -0.23 -0.66 -0.31 0.00 -0.02 0.00 0.00 57.16 55.94 1nmq n GLU 246 Cb 0.74 -1.49 -0.16 0.00 -0.02 0.00 0.00 31.44 30.51 1nmq n GLU 246 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1nmq s PHE 247 N -2.38 2.37 -0.15 -0.32 0.08 -1.18 -5.04 117.98 111.36 1nmq s PHE 247 Ca 0.27 -0.60 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 1nmq s PHE 247 Cb 0.20 -1.55 0.05 0.00 -0.57 0.00 0.00 43.02 41.15 1nmq s PHE 247 CO 0.48 -0.14 0.37 -2.00 -0.10 0.00 0.00 175.22 173.83 1nmq s GLU 248 N -0.34 0.37 0.59 0.44 2.12 -1.26 -4.73 118.70 115.89 1nmq s GLU 248 Ca 0.02 0.67 -0.19 0.00 0.36 0.00 0.00 54.97 55.83 1nmq s GLU 248 Cb -0.12 0.03 -0.04 0.00 0.26 0.00 0.00 34.13 34.26 1nmq s GLU 248 CO 0.02 -0.13 1.19 -1.54 -0.54 0.00 0.00 175.26 174.26 1nmq s SER 249 N 1.04 5.27 -0.09 -1.70 1.04 -0.39 -4.84 113.70 114.02 1nmq s SER 249 Ca -0.07 2.34 -0.00 0.00 0.48 0.00 0.00 55.95 58.70 1nmq s SER 249 Cb -0.07 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.48 1nmq s SER 249 CO -0.08 -1.54 -0.06 0.12 0.98 0.00 0.00 173.24 172.66 1nmq s PHE 250 N -1.65 1.23 -0.02 5.02 2.19 -1.26 -0.67 117.98 122.82 1nmq s PHE 250 Ca 0.76 -0.55 -0.10 0.00 0.33 0.00 0.00 56.93 57.37 1nmq s PHE 250 Cb -0.29 -1.08 0.01 0.00 -1.31 0.00 0.00 43.02 40.36 1nmq s PHE 250 CO 0.32 -0.43 0.21 0.45 1.83 0.00 0.00 175.22 177.61 1nmq s SER 251 N 1.65 -0.10 0.46 6.13 0.15 -1.26 -4.94 113.70 115.78 1nmq s SER 251 Ca 0.03 0.02 0.30 0.00 0.70 0.00 0.00 55.95 57.00 1nmq s SER 251 Cb -0.13 0.30 1.19 0.00 -1.71 0.00 0.00 66.02 65.66 1nmq s SER 251 CO -0.06 -0.34 1.88 -0.26 1.20 0.00 0.00 173.24 175.66 1nmq h PHE 252 N 4.44 0.00 -3.47 3.44 0.04 -2.00 -3.40 116.94 115.99 1nmq h PHE 252 Ca -0.29 0.00 -0.72 0.00 2.80 0.00 0.00 57.97 59.76 1nmq h PHE 252 Cb 1.19 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 39.13 1nmq h PHE 252 CO 0.53 0.00 -0.34 0.34 -0.60 0.00 0.00 178.31 178.24 1nmq s ASP 253 N -5.30 6.14 0.36 2.17 -1.08 -1.26 -4.97 116.67 112.74 1nmq s ASP 253 Ca 0.03 -0.92 0.22 0.00 -0.52 0.00 0.00 52.55 51.36 1nmq s ASP 253 Cb 0.09 -2.18 1.30 0.00 -1.46 0.00 0.00 42.92 40.66 1nmq s ASP 253 CO 0.51 -0.53 1.48 0.00 0.52 0.00 0.00 175.17 177.15 1nmq n ALA 254 N 5.31 1.04 -0.08 3.66 0.00 -1.26 -0.12 120.51 129.06 1nmq n ALA 254 Ca -0.10 0.92 0.09 0.00 0.00 0.00 0.00 53.44 54.35 1nmq n ALA 254 Cb 0.46 -0.96 0.46 0.00 0.00 0.00 0.00 19.45 19.41 1nmq n ALA 254 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1nmq h THR 255 N 0.00 0.97 -0.22 0.00 2.02 -1.94 -2.90 112.91 110.84 1nmq h THR 255 Ca 0.80 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.81 1nmq h THR 255 Cb 2.23 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 69.07 1nmq h THR 255 CO -0.66 0.09 0.00 0.49 0.37 0.00 0.00 175.52 175.82 1nmq n PHE 256 N -4.47 0.36 -3.59 3.16 3.01 0.83 -5.02 117.46 111.73 1nmq n PHE 256 Ca 0.08 -0.56 -0.36 0.00 1.01 0.00 0.00 57.45 57.61 1nmq n PHE 256 Cb 0.27 -0.07 -0.06 0.00 -0.01 0.00 0.00 39.48 39.61 1nmq n PHE 256 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 1nmq s HIS 257 N -1.28 3.65 -1.04 1.38 2.46 -1.05 -4.37 115.29 115.04 1nmq s HIS 257 Ca 0.19 0.83 -0.05 0.00 0.47 0.00 0.00 55.06 56.50 1nmq s HIS 257 Cb 0.12 -2.17 0.01 0.00 -0.13 0.00 0.00 32.58 30.40 1nmq s HIS 257 CO 0.10 0.61 0.67 0.00 -2.47 0.00 0.00 174.74 173.64 1nmq n ALA 258 N 1.43 -0.83 -2.87 1.58 0.00 0.16 -4.93 120.51 115.05 1nmq n ALA 258 Ca -0.12 0.26 -0.24 0.00 0.00 0.00 0.00 53.44 53.33 1nmq n ALA 258 Cb 0.53 -3.60 -0.02 0.00 0.00 0.00 0.00 19.45 16.35 1nmq n ALA 258 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1nmq s LYS 259 N -5.69 3.47 0.45 0.00 -0.14 -1.25 -4.74 119.74 111.83 1nmq s LYS 259 Ca 0.33 -0.55 0.06 0.00 -1.36 0.00 0.00 55.97 54.45 1nmq s LYS 259 Cb -0.15 -2.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.10 1nmq s LYS 259 CO 0.41 0.41 0.15 0.15 -0.76 0.00 0.00 175.35 175.70 1nmq s LYS 260 N -3.65 2.17 -0.16 1.68 -0.14 0.11 -1.27 119.74 118.50 1nmq s LYS 260 Ca 0.36 -2.02 -0.13 0.00 -1.36 0.00 0.00 55.97 52.82 1nmq s LYS 260 Cb -0.10 -1.85 0.04 0.00 -1.68 0.00 0.00 37.83 34.24 1nmq s LYS 260 CO 0.30 -0.21 0.41 -1.14 -0.76 0.00 0.00 175.35 173.94 1nmq s GLN 261 N -3.91 0.46 -0.08 1.68 0.74 -1.26 -4.29 119.66 113.00 1nmq s GLN 261 Ca 0.33 0.61 0.03 0.00 0.05 0.00 0.00 55.36 56.38 1nmq s GLN 261 Cb 0.04 0.18 0.01 0.00 1.10 0.00 0.00 33.01 34.34 1nmq s GLN 261 CO 0.18 -0.08 -0.18 -1.50 -0.55 0.00 0.00 175.29 173.17 1nmq s ILE 262 N 0.45 1.54 0.82 -2.34 1.10 -1.26 -3.72 121.20 117.78 1nmq s ILE 262 Ca -0.02 -0.72 -0.12 0.00 -0.51 0.00 0.00 60.65 59.28 1nmq s ILE 262 Cb -0.04 -1.36 0.09 0.00 0.15 0.00 0.00 42.46 41.30 1nmq s ILE 262 CO -0.02 0.44 1.14 -2.84 -2.11 0.00 0.00 174.94 171.56 1nmq s PRO 263 N 0.46 1.88 -0.21 3.50 0.02 -1.25 -1.88 135.00 137.52 1nmq s PRO 263 Ca -0.15 0.29 -0.03 0.00 0.02 0.00 0.00 61.00 61.13 1nmq s PRO 263 Cb -0.16 -1.92 0.06 0.00 0.02 0.00 0.00 34.50 32.50 1nmq s PRO 263 CO 0.06 -1.69 0.04 0.00 -0.33 0.00 0.00 177.00 175.08 1nmq s ILE 265 N 1.84 4.79 -0.29 0.00 1.01 -1.26 -0.73 121.20 126.56 1nmq s ILE 265 Ca 0.00 1.78 0.02 0.00 0.00 0.00 0.00 60.65 62.45 1nmq s ILE 265 Cb -0.17 -4.21 0.07 0.00 0.01 0.00 0.00 42.46 38.16 1nmq s ILE 265 CO -0.10 -0.08 -0.04 -0.69 0.00 0.00 0.00 174.94 174.03 1nmq s VAL 266 N 2.71 2.42 -0.17 2.92 1.01 0.31 -4.99 120.40 124.61 1nmq s VAL 266 Ca 0.40 -1.76 -0.03 0.00 0.00 0.00 0.00 61.98 60.59 1nmq s VAL 266 Cb -0.16 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1nmq s VAL 266 CO 0.09 -0.21 -0.07 -0.55 0.00 0.00 0.00 175.10 174.36 1nmq s SER 267 N 1.13 4.32 -0.18 3.32 0.15 -1.26 -0.80 113.70 120.38 1nmq s SER 267 Ca -0.03 -0.31 0.14 0.00 0.70 0.00 0.00 55.95 56.46 1nmq s SER 267 Cb -0.20 -1.70 0.37 0.00 -1.71 0.00 0.00 66.02 62.78 1nmq s SER 267 CO -0.05 0.09 1.20 0.23 1.20 0.00 0.00 173.24 175.91 1nmq n MET 268 N 4.05 1.49 -2.48 5.44 2.81 0.12 -5.03 117.12 123.52 1nmq n MET 268 Ca -0.18 -3.00 -0.34 0.00 -1.81 0.00 0.00 57.70 52.37 1nmq n MET 268 Cb 0.52 -1.58 -0.03 0.00 -0.71 0.00 0.00 33.22 31.42 1nmq n MET 268 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1nmq s LEU 269 N -3.09 3.80 0.00 4.03 1.43 -1.17 -0.77 118.68 122.91 1nmq s LEU 269 Ca 0.36 1.91 0.12 0.00 -1.03 0.00 0.00 54.13 55.49 1nmq s LEU 269 Cb 0.33 -4.56 0.14 0.00 0.03 0.00 0.00 46.19 42.13 1nmq s LEU 269 CO -0.02 -0.82 0.95 0.35 0.23 0.00 0.00 176.35 177.03 1nmq n THR 270 N -1.11 0.15 -3.96 5.49 -2.24 -1.26 -4.86 114.28 106.50 1nmq n THR 270 Ca 0.09 -0.58 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 1nmq n THR 270 Cb 0.53 1.15 -0.06 0.00 -2.10 0.00 0.00 70.33 69.84 1nmq n THR 270 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1nmq s LYS 271 N -1.03 1.32 0.51 -0.78 1.02 -1.26 -5.00 119.74 114.51 1nmq s LYS 271 Ca 0.16 -1.19 -0.20 0.00 0.02 0.00 0.00 55.97 54.76 1nmq s LYS 271 Cb 0.11 0.42 -0.07 0.00 -0.52 0.00 0.00 37.83 37.76 1nmq s LYS 271 CO 0.16 -0.51 1.08 -1.21 -0.92 0.00 0.00 175.35 173.94 1nmq s GLU 272 N -3.99 3.61 -0.17 1.68 2.02 0.07 -4.76 118.70 117.17 1nmq s GLU 272 Ca 0.19 1.47 0.01 0.00 0.02 0.00 0.00 54.97 56.66 1nmq s GLU 272 Cb 0.02 -2.06 0.03 0.00 0.10 0.00 0.00 34.13 32.22 1nmq s GLU 272 CO 0.03 -0.61 -0.15 -1.17 0.02 0.00 0.00 175.26 173.38 1nmq s LEU 273 N -3.62 1.94 -0.00 1.80 0.20 -1.26 -1.15 118.68 116.58 1nmq s LEU 273 Ca 0.70 -0.61 0.07 0.00 0.69 0.00 0.00 54.13 54.98 1nmq s LEU 273 Cb -0.19 -1.28 -0.02 0.00 -0.43 0.00 0.00 46.19 44.26 1nmq s LEU 273 CO 0.23 -0.05 -0.23 -0.31 -0.29 0.00 0.00 176.35 175.69 1nmq s TYR 274 N 1.41 2.41 -0.22 5.38 2.02 -1.26 -0.44 117.35 126.65 1nmq s TYR 274 Ca 0.04 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.38 1nmq s TYR 274 Cb -0.13 -1.49 0.28 0.00 -0.40 0.00 0.00 41.96 40.21 1nmq s TYR 274 CO -0.11 0.06 1.51 1.19 -1.57 0.00 0.00 175.55 176.64 1nmq n PHE 275 N 2.18 1.38 -3.02 2.71 3.72 -1.26 -4.86 117.46 118.31 1nmq n PHE 275 Ca -0.16 -1.24 0.00 0.00 -0.05 0.00 0.00 57.45 56.00 1nmq n PHE 275 Cb 0.52 -0.62 0.00 0.00 -0.94 0.00 0.00 39.48 38.43 1nmq n PHE 275 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 1nmq n TYR 276 N -0.12 -0.83 -1.44 1.38 0.18 -1.26 -4.94 117.16 110.13 1nmq n TYR 276 Ca 0.27 0.00 0.00 0.00 1.88 0.00 0.00 57.90 60.05 1nmq n TYR 276 Cb 0.94 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.90 1nmq n TYR 276 CO 0.00 0.00 0.00 -2.39 -2.08 0.00 0.00 176.86 172.39