#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1miq n LEU 79 N 0.00 3.10 -3.92 2.41 7.94 -1.20 -4.80 117.00 120.52 1miq n LEU 79 Ca 0.00 1.06 -0.29 0.00 -1.11 0.00 0.00 56.01 55.67 1miq n LEU 79 Cb 0.00 -1.40 -0.16 0.00 0.53 0.00 0.00 43.42 42.38 1miq n LEU 79 CO 0.00 -0.27 -0.44 -0.89 -1.11 0.00 0.00 177.39 174.68 1miq s THR 80 N 1.59 1.26 -0.31 1.96 2.01 -1.26 0.12 115.64 121.01 1miq s THR 80 Ca 0.82 -0.69 -0.13 0.00 0.31 0.00 0.00 61.69 62.00 1miq s THR 80 Cb -0.70 -1.38 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 1miq s THR 80 CO 0.41 0.18 0.26 -0.76 -0.69 0.00 0.00 174.62 174.02 1miq s LEU 81 N 1.57 4.29 0.12 4.42 1.43 0.17 -4.91 118.68 125.78 1miq s LEU 81 Ca 0.01 -0.17 -0.30 0.00 -1.03 0.00 0.00 54.13 52.63 1miq s LEU 81 Cb -0.15 -2.20 -0.06 0.00 0.03 0.00 0.00 46.19 43.81 1miq s LEU 81 CO -0.08 -0.18 0.99 0.00 0.23 0.00 0.00 176.35 177.30 1miq s ALA 82 N 1.82 3.27 0.11 4.21 0.00 -1.26 -0.57 121.76 129.34 1miq s ALA 82 Ca 0.08 0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.69 1miq s ALA 82 Cb -0.17 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 1miq s ALA 82 CO 0.11 -0.06 -0.08 -0.59 0.00 0.00 0.00 175.76 175.14 1miq s PHE 83 N -0.04 1.02 0.05 0.00 -0.12 0.20 -4.82 117.98 114.27 1miq s PHE 83 Ca 0.47 -0.81 0.01 0.00 -0.05 0.00 0.00 56.93 56.55 1miq s PHE 83 Cb -0.24 -0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 41.55 1miq s PHE 83 CO 0.31 -0.06 0.12 0.21 -0.05 0.00 0.00 175.22 175.76 1miq s LYS 84 N -3.56 3.13 -0.07 1.99 2.20 -0.44 -2.06 119.74 120.93 1miq s LYS 84 Ca 0.11 -0.54 0.04 0.00 -0.36 0.00 0.00 55.97 55.23 1miq s LYS 84 Cb 0.03 -2.88 -0.00 0.00 -1.51 0.00 0.00 37.83 33.47 1miq s LYS 84 CO -0.02 0.61 -0.20 0.42 -0.36 0.00 0.00 175.35 175.79 1miq s ILE 85 N -1.37 1.71 -0.11 5.43 1.01 0.69 -1.10 121.20 127.47 1miq s ILE 85 Ca 0.29 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 60.12 1miq s ILE 85 Cb -0.12 -1.48 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 1miq s ILE 85 CO 0.21 0.48 -0.20 -0.70 0.00 0.00 0.00 174.94 174.74 1miq s GLU 86 N 0.18 3.13 0.25 2.79 2.12 -0.80 -4.61 118.70 121.76 1miq s GLU 86 Ca -0.10 -0.81 0.09 0.00 0.36 0.00 0.00 54.97 54.51 1miq s GLU 86 Cb -0.15 -2.41 -0.04 0.00 0.26 0.00 0.00 34.13 31.79 1miq s GLU 86 CO 0.05 0.21 0.05 1.03 -0.54 0.00 0.00 175.26 176.06 1miq s ARG 87 N 0.29 2.48 0.32 4.30 0.52 -1.26 -1.82 118.95 123.78 1miq s ARG 87 Ca -0.15 -1.27 0.09 0.00 -0.52 0.00 0.00 55.73 53.88 1miq s ARG 87 Cb -0.17 -2.30 0.86 0.00 0.52 0.00 0.00 34.95 33.86 1miq s ARG 87 CO 0.07 0.39 1.75 -1.35 0.02 0.00 0.00 175.30 176.19 1miq h PRO 88 N 1.90 0.61 -1.00 3.54 0.11 -1.87 0.27 132.00 135.56 1miq h PRO 88 Ca -0.46 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1miq h PRO 88 Cb 1.24 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1miq h PRO 88 CO 0.60 0.40 0.66 -0.92 -0.21 0.00 0.00 178.00 178.54 1miq h TYR 89 N 0.63 1.24 -0.48 0.65 3.20 -1.95 0.22 116.97 120.48 1miq h TYR 89 Ca 0.61 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 62.39 1miq h TYR 89 Cb 1.13 -0.42 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1miq h TYR 89 CO -0.00 0.74 -0.20 -0.44 -1.64 0.00 0.00 178.16 176.62 1miq h ASP 90 N 1.31 1.00 0.12 -2.11 3.32 -0.93 -2.12 116.42 117.00 1miq h ASP 90 Ca 0.39 -0.39 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1miq h ASP 90 Cb -0.07 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.18 1miq h ASP 90 CO -0.11 1.17 -0.24 0.50 -1.72 0.00 0.00 179.24 178.84 1miq h LYS 91 N 0.82 -0.42 -0.79 3.56 3.64 -0.17 -1.86 116.57 121.36 1miq h LYS 91 Ca 0.11 0.03 0.19 0.00 -1.27 0.00 0.00 60.65 59.71 1miq h LYS 91 Cb 0.77 0.10 -0.13 0.00 -0.41 0.00 0.00 32.23 32.56 1miq h LYS 91 CO 0.06 -0.28 0.10 0.28 -2.27 0.00 0.00 179.45 177.34 1miq h VAL 92 N -0.44 0.37 0.00 2.00 2.07 -0.22 0.21 116.25 120.24 1miq h VAL 92 Ca 0.03 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1miq h VAL 92 Cb 0.46 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1miq h VAL 92 CO -0.13 0.03 0.00 -0.07 0.02 0.00 0.00 177.57 177.42 1miq h LEU 93 N 0.16 0.00 -1.35 2.57 3.38 -0.69 -0.89 115.31 118.49 1miq h LEU 93 Ca 0.45 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.38 1miq h LEU 93 Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1miq h LEU 93 CO -0.63 0.00 -0.05 0.11 0.09 0.00 0.00 178.44 177.95 1miq h LYS 94 N 0.00 0.37 0.00 1.13 1.57 -0.09 -3.33 116.57 116.22 1miq h LYS 94 Ca 0.00 -0.08 -0.25 0.00 -1.87 0.00 0.00 60.65 58.45 1miq h LYS 94 Cb 0.28 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.49 1miq h LYS 94 CO 0.00 0.44 -1.95 2.41 -0.57 0.00 0.00 179.45 179.78 1miq n THR 95 N -4.29 0.95 -4.29 -0.16 -1.04 -0.57 -4.96 114.28 99.92 1miq n THR 95 Ca 0.00 -0.55 -0.35 0.00 -2.04 0.00 0.00 64.05 61.12 1miq n THR 95 Cb 0.24 -0.72 -0.09 0.00 -1.82 0.00 0.00 70.33 67.94 1miq n THR 95 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1miq s ILE 96 N -2.34 4.46 0.62 12.58 1.09 -0.45 -5.10 121.20 132.07 1miq s ILE 96 Ca -0.10 -0.26 -0.15 0.00 -1.10 0.00 0.00 60.65 59.05 1miq s ILE 96 Cb 0.04 -2.91 -0.03 0.00 -1.06 0.00 0.00 42.46 38.51 1miq s ILE 96 CO 0.53 0.55 1.06 -0.94 -0.10 0.00 0.00 174.94 176.04 1miq s SER 97 N -1.06 5.70 0.18 3.58 1.04 -1.26 -4.35 113.70 117.52 1miq s SER 97 Ca 0.15 1.77 -0.13 0.00 0.48 0.00 0.00 55.95 58.22 1miq s SER 97 Cb -0.11 -2.52 0.10 0.00 0.10 0.00 0.00 66.02 63.58 1miq s SER 97 CO 0.05 -1.23 1.84 0.11 0.98 0.00 0.00 173.24 174.99 1miq h LYS 98 N 0.17 0.73 0.00 4.02 1.57 -1.98 -2.10 116.57 118.98 1miq h LYS 98 Ca -0.46 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1miq h LYS 98 Cb 1.22 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1miq h LYS 98 CO 0.57 0.48 0.00 1.17 -0.57 0.00 0.00 179.45 181.11 1miq n LYS 99 N -4.71 0.00 0.28 3.15 4.81 -1.26 -1.12 118.16 119.32 1miq n LYS 99 Ca 0.04 0.70 0.13 0.00 -0.87 0.00 0.00 58.31 58.32 1miq n LYS 99 Cb 0.04 -1.44 0.84 0.00 0.02 0.00 0.00 35.03 34.49 1miq n LYS 99 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1miq h ASN 100 N 0.00 0.00 -0.38 3.14 -0.26 -1.95 -0.44 115.58 115.68 1miq h ASN 100 Ca 0.00 0.00 -0.11 0.00 -0.56 0.00 0.00 56.30 55.63 1miq h ASN 100 Cb 0.00 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 1miq h ASN 100 CO 0.00 0.02 -0.15 0.25 -1.06 0.00 0.00 177.43 176.49 1miq h LEU 101 N 0.00 0.85 -0.37 1.61 5.85 -0.89 0.37 115.31 122.74 1miq h LEU 101 Ca -0.00 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.34 1miq h LEU 101 Cb 0.06 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 1miq h LEU 101 CO 0.00 1.00 -0.14 0.50 -0.34 0.00 0.00 178.44 179.47 1miq h LYS 102 N 0.75 0.74 -0.17 1.25 3.64 0.49 -1.94 116.57 121.35 1miq h LYS 102 Ca 0.12 -0.31 -0.20 0.00 -1.27 0.00 0.00 60.65 58.99 1miq h LYS 102 Cb 0.67 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1miq h LYS 102 CO 0.05 0.91 -0.68 -0.91 -2.27 0.00 0.00 179.45 176.55 1miq h ASN 103 N 0.54 0.79 -0.24 4.20 2.35 -1.22 0.58 115.58 122.58 1miq h ASN 103 Ca 0.09 -0.48 0.01 0.00 -0.55 0.00 0.00 56.30 55.37 1miq h ASN 103 Cb 0.67 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.79 1miq h ASN 103 CO 0.05 1.25 0.12 0.22 -1.65 0.00 0.00 177.43 177.41 1miq h TYR 104 N 0.48 0.22 -0.24 1.19 3.20 -0.21 0.36 116.97 121.96 1miq h TYR 104 Ca -0.02 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 1miq h TYR 104 Cb 1.28 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1miq h TYR 104 CO 0.07 0.12 0.06 0.82 -1.64 0.00 0.00 178.16 177.59 1miq h ILE 105 N 0.25 1.21 -0.02 1.81 2.04 -1.24 -0.66 117.51 120.90 1miq h ILE 105 Ca 0.10 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1miq h ILE 105 Cb 0.03 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1miq h ILE 105 CO -0.07 0.22 0.01 0.50 0.00 0.00 0.00 178.15 178.81 1miq h LYS 106 N 0.22 0.02 0.00 2.37 3.64 -0.63 0.07 116.57 122.27 1miq h LYS 106 Ca 0.08 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1miq h LYS 106 Cb 0.28 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1miq h LYS 106 CO 0.00 0.04 -0.15 1.49 -2.27 0.00 0.00 179.45 178.56 1miq h GLU 107 N 0.00 0.00 -0.04 1.90 4.57 -0.25 -0.87 114.58 119.89 1miq h GLU 107 Ca 0.01 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 58.02 1miq h GLU 107 Cb 0.02 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1miq h GLU 107 CO -0.00 0.15 -0.63 1.15 -1.18 0.00 0.00 179.01 178.49 1miq h THR 108 N 0.00 1.39 -0.32 0.32 2.02 -0.13 -2.67 112.91 113.52 1miq h THR 108 Ca -0.00 -2.02 -0.05 0.00 0.77 0.00 0.00 66.41 65.11 1miq h THR 108 Cb 0.40 2.43 -0.01 0.00 -1.74 0.00 0.00 68.15 69.23 1miq h THR 108 CO 0.02 0.60 0.02 0.15 0.37 0.00 0.00 175.52 176.68 1miq h PHE 109 N 0.05 0.60 -0.99 3.16 3.57 -0.51 -2.11 116.94 120.70 1miq h PHE 109 Ca -0.07 -0.10 0.18 0.00 3.53 0.00 0.00 57.97 61.51 1miq h PHE 109 Cb 1.32 -0.16 -0.10 0.00 2.79 0.00 0.00 35.95 39.80 1miq h PHE 109 CO 0.13 0.67 0.62 -0.91 -2.23 0.00 0.00 178.31 176.58 1miq h ASN 110 N 0.37 0.77 0.02 0.41 2.35 -1.24 0.11 115.58 118.36 1miq h ASN 110 Ca 0.09 0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1miq h ASN 110 Cb 0.41 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1miq h ASN 110 CO 0.01 0.31 -0.21 0.15 -1.65 0.00 0.00 177.43 176.04 1miq h PHE 111 N 0.77 0.37 0.00 1.19 3.57 -1.03 -2.87 116.94 118.95 1miq h PHE 111 Ca 0.55 -0.06 -0.15 0.00 3.53 0.00 0.00 57.97 61.84 1miq h PHE 111 Cb 0.84 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1miq h PHE 111 CO -0.00 0.54 -0.71 0.35 -2.23 0.00 0.00 178.31 176.26 1miq h PHE 112 N 0.31 0.00 -0.09 0.41 3.57 -0.31 2.18 116.94 123.01 1miq h PHE 112 Ca 0.05 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1miq h PHE 112 Cb 0.55 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.29 1miq h PHE 112 CO 0.01 0.71 0.00 0.36 -2.23 0.00 0.00 178.31 177.16 1miq n LYS 113 N -3.67 1.24 0.00 1.11 2.85 -0.68 -4.35 118.16 114.67 1miq n LYS 113 Ca -0.01 -0.37 0.00 0.00 -1.05 0.00 0.00 58.31 56.89 1miq n LYS 113 Cb 0.70 -1.13 0.00 0.00 -0.65 0.00 0.00 35.03 33.95 1miq n LYS 113 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1miq n SER 114 N -0.25 0.00 0.00 -5.58 7.64 -1.13 -5.09 113.62 109.21 1miq n SER 114 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1miq n SER 114 Cb 0.10 0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1miq n SER 114 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1miq n GLY 115 N -0.43 -2.07 3.56 0.23 0.00 0.74 -4.51 105.19 102.70 1miq n GLY 115 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1miq n GLY 115 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1miq s TYR 116 N 0.00 1.26 0.00 1.61 1.13 -1.25 -4.85 117.35 115.24 1miq s TYR 116 Ca 0.00 1.62 0.00 0.00 -1.41 0.00 0.00 57.07 57.28 1miq s TYR 116 Cb 0.00 -3.60 0.00 0.00 -1.10 0.00 0.00 41.96 37.26 1miq s TYR 116 CO 0.00 -1.85 0.56 0.00 -2.51 0.00 0.00 175.55 171.74 1miq n MET 117 N 8.89 0.00 -0.34 -3.49 0.00 -1.26 -0.75 117.12 120.17 1miq n MET 117 Ca 0.42 0.44 -0.09 0.00 0.00 0.00 0.00 57.70 58.47 1miq n MET 117 Cb 0.47 -1.06 -0.02 0.00 0.00 0.00 0.00 33.22 32.62 1miq n MET 117 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 175.97 176.33 1miq n LYS 118 N -1.10 0.92 0.00 3.17 0.00 -1.26 -4.48 118.16 115.41 1miq n LYS 118 Ca 0.00 -0.82 0.00 0.00 -0.00 0.00 0.00 58.31 57.49 1miq n LYS 118 Cb 0.00 -2.09 0.00 0.00 -0.00 0.00 0.00 35.03 32.94 1miq n LYS 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1miq n GLN 119 N 4.22 0.00 -2.88 -1.58 0.00 0.07 -4.97 117.38 112.25 1miq n GLN 119 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 57.00 57.08 1miq n GLN 119 Cb 0.11 0.00 0.06 0.00 0.00 0.00 0.00 30.24 30.40 1miq n GLN 119 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1miq n ASN 120 N 0.00 -5.31 -4.70 2.61 4.05 -1.26 -4.92 115.26 105.73 1miq n ASN 120 Ca 0.00 -0.54 -0.42 0.00 0.45 0.00 0.00 54.58 54.06 1miq n ASN 120 Cb 0.00 -4.15 -0.03 0.00 1.23 0.00 0.00 39.78 36.83 1miq n ASN 120 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1miq n TYR 121 N -2.89 2.69 -1.76 1.20 9.36 -1.26 -4.91 117.16 119.59 1miq n TYR 121 Ca -0.07 -0.07 0.06 0.00 3.32 0.00 0.00 57.90 61.14 1miq n TYR 121 Cb 0.60 -2.71 0.13 0.00 -0.63 0.00 0.00 39.34 36.73 1miq n TYR 121 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1miq n LEU 122 N 4.91 1.94 0.00 2.98 4.77 -1.26 -1.66 117.00 128.69 1miq n LEU 122 Ca 0.17 -2.98 0.00 0.00 -0.03 0.00 0.00 56.01 53.17 1miq n LEU 122 Cb 0.36 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1miq n LEU 122 CO 0.65 0.93 0.00 0.61 -1.33 0.00 0.00 177.39 178.25 1miq n GLY 123 N -0.67 -1.28 3.81 -0.72 0.00 -1.26 -4.88 105.19 100.18 1miq n GLY 123 Ca 0.13 -2.11 -0.02 0.00 0.00 0.00 0.00 46.02 44.02 1miq n GLY 123 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1miq s SER 1 N -4.00 -0.07 0.65 1.61 1.04 -0.97 -4.95 113.70 107.02 1miq s SER 1 Ca 0.00 -0.49 0.40 0.00 0.48 0.00 0.00 55.95 56.34 1miq s SER 1 Cb 0.00 0.43 2.17 0.00 0.10 0.00 0.00 66.02 68.72 1miq s SER 1 CO 0.00 -0.84 2.22 1.05 0.98 0.00 0.00 173.24 176.66 1miq h GLU 2 N 2.00 0.00 -0.29 4.02 9.09 -2.02 0.10 114.58 127.49 1miq h GLU 2 Ca -0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.15 1miq h GLU 2 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 1miq h GLU 2 CO 0.31 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.46 1miq n ASN 3 N -2.98 3.85 -2.97 3.06 5.03 -1.26 -4.71 115.26 115.28 1miq n ASN 3 Ca -0.03 -2.89 -0.08 0.00 0.87 0.00 0.00 54.58 52.45 1miq n ASN 3 Cb 0.14 -0.51 -0.02 0.00 -1.02 0.00 0.00 39.78 38.37 1miq n ASN 3 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1miq s ASP 4 N -1.77 -0.84 0.23 6.41 2.15 0.35 -4.95 116.67 118.25 1miq s ASP 4 Ca 0.41 -1.80 0.11 0.00 0.43 0.00 0.00 52.55 51.70 1miq s ASP 4 Cb 0.32 1.45 -0.05 0.00 -0.30 0.00 0.00 42.92 44.35 1miq s ASP 4 CO 0.10 -0.10 -0.16 -0.69 -0.17 0.00 0.00 175.17 174.15 1miq s VAL 5 N 0.93 2.74 -0.34 1.11 1.01 -1.23 -2.28 120.40 122.34 1miq s VAL 5 Ca 0.28 -2.07 -0.28 0.00 0.00 0.00 0.00 61.98 59.91 1miq s VAL 5 Cb -0.01 -2.39 0.02 0.00 0.00 0.00 0.00 36.38 34.00 1miq s VAL 5 CO -0.07 -0.25 1.03 -0.63 0.00 0.00 0.00 175.10 175.18 1miq s ILE 6 N -2.06 4.52 0.34 2.22 -1.09 -1.26 -4.98 121.20 118.88 1miq s ILE 6 Ca 0.26 1.57 -0.05 0.00 -2.23 0.00 0.00 60.65 60.20 1miq s ILE 6 Cb -0.07 -4.40 -0.05 0.00 -1.58 0.00 0.00 42.46 36.37 1miq s ILE 6 CO 0.14 -0.51 0.61 -1.61 -1.23 0.00 0.00 174.94 172.34 1miq s GLU 7 N 3.63 3.62 0.48 2.79 2.02 -1.26 -4.98 118.70 125.00 1miq s GLU 7 Ca 0.43 0.04 0.13 0.00 0.02 0.00 0.00 54.97 55.59 1miq s GLU 7 Cb -0.12 -2.58 1.12 0.00 0.10 0.00 0.00 34.13 32.65 1miq s GLU 7 CO 0.17 0.12 2.12 -0.07 0.02 0.00 0.00 175.26 177.62 1miq h LEU 8 N 1.31 0.17 -2.22 1.80 -0.00 -1.98 0.46 115.31 114.83 1miq h LEU 8 Ca -0.48 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.39 1miq h LEU 8 Cb 1.20 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 41.81 1miq h LEU 8 CO 0.65 0.12 -0.04 0.44 -0.00 0.00 0.00 178.44 179.61 1miq h ASP 9 N 0.20 0.00 -0.11 -0.43 3.45 -1.95 0.04 116.42 117.61 1miq h ASP 9 Ca 0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1miq h ASP 9 Cb -0.02 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.75 1miq h ASP 9 CO -0.01 0.04 0.00 0.47 -1.57 0.00 0.00 179.24 178.17 1miq n ASP 10 N -3.29 1.08 -0.00 6.45 8.00 0.16 -3.71 116.55 125.24 1miq n ASP 10 Ca -0.02 -1.62 0.02 0.00 0.71 0.00 0.00 54.79 53.88 1miq n ASP 10 Cb 0.19 -0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.20 1miq n ASP 10 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1miq n VAL 11 N -0.06 0.00 -4.08 2.53 0.31 -0.02 -4.89 118.33 112.12 1miq n VAL 11 Ca 0.15 -0.42 -0.35 0.00 -0.01 0.00 0.00 64.34 63.72 1miq n VAL 11 Cb 0.23 1.00 -0.09 0.00 -0.91 0.00 0.00 33.84 34.07 1miq n VAL 11 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1miq s ALA 12 N -1.33 3.42 0.46 3.52 0.00 -1.11 -0.04 121.76 126.69 1miq s ALA 12 Ca 0.01 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.17 1miq s ALA 12 Cb 0.03 -1.82 -0.04 0.00 0.00 0.00 0.00 23.12 21.28 1miq s ALA 12 CO 0.14 0.32 0.77 -0.80 0.00 0.00 0.00 175.76 176.19 1miq s ASN 13 N -0.05 6.30 -0.11 0.00 0.02 0.69 -4.35 114.94 117.45 1miq s ASN 13 Ca 0.06 0.93 0.02 0.00 -1.02 0.00 0.00 52.86 52.85 1miq s ASN 13 Cb -0.12 -2.25 -0.01 0.00 0.02 0.00 0.00 41.25 38.89 1miq s ASN 13 CO 0.01 -0.54 -0.17 -0.63 0.02 0.00 0.00 177.10 175.79 1miq s ILE 14 N -2.67 2.72 -0.37 0.60 1.01 -0.76 -4.78 121.20 116.95 1miq s ILE 14 Ca 0.47 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 60.26 1miq s ILE 14 Cb -0.10 -2.10 0.06 0.00 0.01 0.00 0.00 42.46 40.33 1miq s ILE 14 CO 0.43 0.55 0.16 -0.04 0.00 0.00 0.00 174.94 176.04 1miq s MET 15 N 0.16 2.55 -0.20 2.79 -1.94 -1.26 -1.91 119.30 119.48 1miq s MET 15 Ca -0.09 -1.33 -0.14 0.00 -1.71 0.00 0.00 55.69 52.41 1miq s MET 15 Cb -0.16 -3.57 -0.04 0.00 2.01 0.00 0.00 34.83 33.07 1miq s MET 15 CO 0.06 -0.80 0.32 -0.06 -0.01 0.00 0.00 175.02 174.53 1miq s PHE 16 N 1.38 3.38 -0.15 -0.03 0.40 -0.26 -2.07 117.98 120.62 1miq s PHE 16 Ca 0.01 0.52 -0.01 0.00 -0.60 0.00 0.00 56.93 56.85 1miq s PHE 16 Cb -0.21 -2.43 0.04 0.00 0.51 0.00 0.00 43.02 40.93 1miq s PHE 16 CO 0.02 0.06 -0.04 -0.47 0.70 0.00 0.00 175.22 175.48 1miq s TYR 17 N 1.09 1.53 -0.27 0.36 5.04 0.07 -1.33 117.35 123.83 1miq s TYR 17 Ca 0.16 -0.93 0.10 0.00 -2.44 0.00 0.00 57.07 53.96 1miq s TYR 17 Cb -0.14 -1.24 0.52 0.00 0.35 0.00 0.00 41.96 41.45 1miq s TYR 17 CO 0.06 -0.58 1.48 0.41 -1.34 0.00 0.00 175.55 175.59 1miq n GLY 18 N 4.92 4.69 0.06 8.97 0.00 -1.26 -1.47 105.19 121.10 1miq n GLY 18 Ca -0.11 -1.18 0.01 0.00 0.00 0.00 0.00 46.02 44.74 1miq n GLY 18 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1miq n GLU 19 N -1.00 1.94 -1.44 1.61 -0.58 -1.26 -4.66 120.64 115.26 1miq n GLU 19 Ca 0.32 -0.40 -0.33 0.00 -0.42 0.00 0.00 57.16 56.33 1miq n GLU 19 Cb 1.04 -0.87 0.09 0.00 -0.57 0.00 0.00 31.44 31.12 1miq n GLU 19 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1miq s GLY 20 N -0.56 2.15 0.05 0.62 0.00 -1.26 -4.68 107.32 103.63 1miq s GLY 20 Ca 0.02 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.42 1miq s GLY 20 CO 0.05 1.07 -0.05 -0.54 0.00 0.00 0.00 173.10 173.63 1miq s GLU 21 N -4.15 0.55 -0.04 2.90 2.02 -0.28 -3.10 118.70 116.60 1miq s GLU 21 Ca 0.70 -0.97 0.03 0.00 0.02 0.00 0.00 54.97 54.74 1miq s GLU 21 Cb -0.24 0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.00 1miq s GLU 21 CO 0.46 -0.05 -0.11 0.08 0.02 0.00 0.00 175.26 175.67 1miq s VAL 22 N -2.66 0.95 0.00 2.63 1.01 -0.89 -0.37 120.40 121.07 1miq s VAL 22 Ca -0.02 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1miq s VAL 22 Cb -0.01 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1miq s VAL 22 CO -0.04 0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.96 1miq n GLY 23 N 3.37 0.75 0.38 4.51 0.00 0.07 -2.94 105.19 111.32 1miq n GLY 23 Ca -0.19 -1.74 0.02 0.00 0.00 0.00 0.00 46.02 44.11 1miq n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1miq n ASP 24 N -0.59 1.06 -0.43 1.61 5.75 -1.26 -3.31 116.55 119.37 1miq n ASP 24 Ca 0.00 -2.03 0.09 0.00 -0.01 0.00 0.00 54.79 52.84 1miq n ASP 24 Cb 0.00 -0.18 0.19 0.00 -1.03 0.00 0.00 41.12 40.10 1miq n ASP 24 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1miq n ASN 25 N -0.00 3.02 -1.14 -1.12 6.94 -1.26 -4.96 115.26 116.74 1miq n ASN 25 Ca 0.05 -3.04 -0.10 0.00 -0.02 0.00 0.00 54.58 51.47 1miq n ASN 25 Cb 0.19 -0.47 -0.01 0.00 -2.36 0.00 0.00 39.78 37.13 1miq n ASN 25 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 1miq n HIS 26 N -1.01 -0.44 -1.96 -2.53 8.25 -1.21 -4.93 115.22 111.39 1miq n HIS 26 Ca 0.18 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 1miq n HIS 26 Cb 0.74 -2.42 -0.03 0.00 1.12 0.00 0.00 29.99 29.40 1miq n HIS 26 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1miq s GLN 27 N -4.35 4.22 -0.00 -0.41 -0.21 -1.15 -4.88 119.66 112.87 1miq s GLN 27 Ca 0.00 2.31 -0.08 0.00 0.02 0.00 0.00 55.36 57.61 1miq s GLN 27 Cb 0.00 -3.39 -0.05 0.00 1.00 0.00 0.00 33.01 30.57 1miq s GLN 27 CO 0.00 -0.65 0.28 0.15 -2.12 0.00 0.00 175.29 172.94 1miq s LYS 28 N 1.91 3.61 0.02 2.91 -0.14 -1.26 -2.10 119.74 124.68 1miq s LYS 28 Ca 0.71 -0.02 0.00 0.00 -1.36 0.00 0.00 55.97 55.31 1miq s LYS 28 Cb -0.41 -3.10 -0.02 0.00 -1.68 0.00 0.00 37.83 32.63 1miq s LYS 28 CO 0.31 0.66 -0.03 -0.06 -0.76 0.00 0.00 175.35 175.48 1miq s PHE 29 N -1.25 0.22 -0.31 3.18 0.08 -1.18 -4.88 117.98 113.83 1miq s PHE 29 Ca 0.26 -0.43 -0.18 0.00 0.12 0.00 0.00 56.93 56.70 1miq s PHE 29 Cb -0.13 -0.16 -0.01 0.00 -0.57 0.00 0.00 43.02 42.15 1miq s PHE 29 CO 0.14 -0.15 0.53 1.41 -0.10 0.00 0.00 175.22 177.05 1miq s MET 30 N -1.18 3.83 0.21 0.44 -2.45 -1.26 -4.23 119.30 114.66 1miq s MET 30 Ca -0.13 0.08 0.07 0.00 -1.25 0.00 0.00 55.69 54.47 1miq s MET 30 Cb -0.08 -3.74 -0.04 0.00 1.25 0.00 0.00 34.83 32.22 1miq s MET 30 CO -0.01 -0.53 0.05 -0.51 1.05 0.00 0.00 175.02 175.08 1miq s LEU 31 N 2.41 3.44 0.05 4.11 1.43 -0.54 0.14 118.68 129.72 1miq s LEU 31 Ca 0.21 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.99 1miq s LEU 31 Cb -0.15 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1miq s LEU 31 CO 0.12 0.04 -0.22 0.27 0.23 0.00 0.00 176.35 176.79 1miq s ILE 32 N -1.94 1.76 0.21 -0.59 -4.36 -0.47 -0.75 121.20 115.06 1miq s ILE 32 Ca 0.30 -1.28 -0.23 0.00 -0.26 0.00 0.00 60.65 59.17 1miq s ILE 32 Cb -0.08 -1.54 -0.08 0.00 1.25 0.00 0.00 42.46 42.00 1miq s ILE 32 CO 0.21 0.20 0.78 -0.36 0.24 0.00 0.00 174.94 176.00 1miq s PHE 33 N -0.85 3.76 -0.12 1.37 2.99 -0.88 -1.09 117.98 123.16 1miq s PHE 33 Ca 0.08 1.55 -0.02 0.00 0.00 0.00 0.00 56.93 58.54 1miq s PHE 33 Cb -0.09 -2.72 0.04 0.00 0.00 0.00 0.00 43.02 40.24 1miq s PHE 33 CO 0.02 0.39 0.00 0.34 -0.00 0.00 0.00 175.22 175.98 1miq s ASP 34 N -1.44 2.19 0.00 1.36 2.15 -0.78 -4.70 116.67 115.46 1miq s ASP 34 Ca 0.41 -0.40 0.30 0.00 0.43 0.00 0.00 52.55 53.29 1miq s ASP 34 Cb -0.20 -0.56 1.47 0.00 -0.30 0.00 0.00 42.92 43.33 1miq s ASP 34 CO 0.23 -0.23 1.99 0.35 -0.17 0.00 0.00 175.17 177.35 1miq n THR 35 N 5.08 0.00 1.20 1.71 -2.24 -1.26 0.16 114.28 118.92 1miq n THR 35 Ca -0.09 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.75 1miq n THR 35 Cb 0.49 -0.16 0.37 0.00 -2.10 0.00 0.00 70.33 68.93 1miq n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1miq n GLY 36 N 1.16 0.45 3.35 3.38 0.00 -1.26 -3.26 105.19 109.00 1miq n GLY 36 Ca 0.19 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 1miq n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1miq s SER 37 N -1.82 -0.14 0.00 1.61 1.04 -1.24 -4.44 113.70 108.71 1miq s SER 37 Ca 0.35 -0.49 0.24 0.00 0.48 0.00 0.00 55.95 56.52 1miq s SER 37 Cb 0.20 0.47 0.27 0.00 0.10 0.00 0.00 66.02 67.06 1miq s SER 37 CO 0.31 -0.89 1.25 0.00 0.98 0.00 0.00 173.24 174.89 1miq n ALA 38 N -0.23 3.91 -2.05 5.32 0.00 0.12 0.44 120.51 128.02 1miq n ALA 38 Ca -0.13 -0.44 -0.35 0.00 0.00 0.00 0.00 53.44 52.51 1miq n ALA 38 Cb 0.63 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.02 1miq n ALA 38 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1miq s ASN 39 N -2.95 7.03 -0.09 0.00 -0.87 -1.26 -4.11 114.94 112.69 1miq s ASN 39 Ca 0.11 1.46 -0.01 0.00 -1.57 0.00 0.00 52.86 52.86 1miq s ASN 39 Cb 0.17 -2.44 -0.03 0.00 -0.02 0.00 0.00 41.25 38.93 1miq s ASN 39 CO 0.74 -0.06 -0.05 -0.22 -2.57 0.00 0.00 177.10 174.94 1miq s LEU 40 N -2.27 3.26 -0.05 0.60 2.96 -1.26 0.49 118.68 122.41 1miq s LEU 40 Ca 0.47 -0.02 -0.13 0.00 -0.22 0.00 0.00 54.13 54.24 1miq s LEU 40 Cb -0.15 -1.73 0.02 0.00 0.50 0.00 0.00 46.19 44.83 1miq s LEU 40 CO 0.20 0.32 0.30 -1.66 -1.32 0.00 0.00 176.35 174.19 1miq s TRP 41 N -0.54 -0.22 0.08 5.38 1.48 -0.58 -1.18 118.94 123.36 1miq s TRP 41 Ca 0.08 0.45 0.05 0.00 -1.06 0.00 0.00 56.10 55.63 1miq s TRP 41 Cb -0.12 0.09 -0.03 0.00 -1.16 0.00 0.00 33.47 32.25 1miq s TRP 41 CO 0.02 -0.30 -0.14 0.14 -4.06 0.00 0.00 176.95 172.61 1miq s VAL 42 N -0.78 1.17 0.20 -0.66 -7.23 -0.96 -2.52 120.40 109.63 1miq s VAL 42 Ca -0.09 -1.38 -0.30 0.00 -1.81 0.00 0.00 61.98 58.40 1miq s VAL 42 Cb -0.04 -1.17 -0.09 0.00 0.56 0.00 0.00 36.38 35.64 1miq s VAL 42 CO 0.03 -0.25 1.30 -2.16 -0.31 0.00 0.00 175.10 173.71 1miq s PRO 43 N -1.89 4.39 0.38 4.82 0.04 -1.26 -1.13 135.00 140.36 1miq s PRO 43 Ca 0.00 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 1miq s PRO 43 Cb -0.09 -3.19 -0.06 0.00 0.04 0.00 0.00 34.50 31.20 1miq s PRO 43 CO 0.02 -0.24 0.72 0.45 0.04 0.00 0.00 177.00 177.99 1miq s SER 44 N 0.29 6.47 0.42 6.66 0.15 0.40 -0.29 113.70 127.80 1miq s SER 44 Ca 0.56 1.00 0.08 0.00 0.70 0.00 0.00 55.95 58.29 1miq s SER 44 Cb -0.36 -2.27 0.90 0.00 -1.71 0.00 0.00 66.02 62.57 1miq s SER 44 CO 0.39 -0.37 2.06 0.50 1.20 0.00 0.00 173.24 177.02 1miq h LYS 45 N 1.24 0.50 0.00 5.44 1.63 -0.31 0.52 116.57 125.59 1miq h LYS 45 Ca -0.47 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 1miq h LYS 45 Cb 1.19 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1miq h LYS 45 CO 0.64 0.33 0.00 1.63 -3.45 0.00 0.00 179.45 178.60 1miq n LYS 46 N -4.48 0.25 -2.21 1.90 5.02 -1.26 -4.80 118.16 112.59 1miq n LYS 46 Ca 0.03 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 56.02 1miq n LYS 46 Cb 0.08 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 1miq n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1miq n ASN 48 N 6.80 3.06 -4.73 0.00 6.94 -1.23 -4.87 115.26 121.22 1miq n ASN 48 Ca 0.15 -1.89 -0.31 0.00 -0.02 0.00 0.00 54.58 52.51 1miq n ASN 48 Cb 0.44 -0.18 0.12 0.00 -2.36 0.00 0.00 39.78 37.79 1miq n ASN 48 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 1miq s SER 49 N -1.34 3.94 0.15 0.53 0.01 -1.26 -4.94 113.70 110.79 1miq s SER 49 Ca 0.31 2.02 -0.16 0.00 1.31 0.00 0.00 55.95 59.43 1miq s SER 49 Cb 0.18 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.88 1miq s SER 49 CO 0.26 -2.42 1.76 -1.28 0.41 0.00 0.00 173.24 171.97 1miq h SER 50 N -1.24 0.52 -0.38 2.44 0.87 -1.97 -2.59 113.55 111.21 1miq h SER 50 Ca -0.44 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 1miq h SER 50 Cb 1.25 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 63.06 1miq h SER 50 CO 0.48 0.45 0.24 1.23 -0.53 0.00 0.00 176.83 178.70 1miq h GLY 51 N 0.55 0.54 2.00 5.77 0.00 -1.93 -2.03 103.07 107.98 1miq h GLY 51 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1miq h GLY 51 CO -0.03 0.20 0.00 0.00 0.00 0.00 0.00 176.54 176.72 1miq n SER 53 N -2.72 0.59 -0.67 0.00 3.41 -0.76 -2.49 113.62 110.98 1miq n SER 53 Ca -0.00 0.65 0.08 0.00 -0.26 0.00 0.00 58.87 59.33 1miq n SER 53 Cb 0.17 -0.77 0.21 0.00 -0.26 0.00 0.00 64.21 63.56 1miq n SER 53 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1miq n ILE 54 N -2.15 1.98 -4.24 -1.33 -5.35 -1.02 -5.03 119.36 102.21 1miq n ILE 54 Ca 0.02 -1.78 -0.24 0.00 -0.27 0.00 0.00 62.75 60.48 1miq n ILE 54 Cb 0.22 -0.11 -0.08 0.00 -1.74 0.00 0.00 39.64 37.94 1miq n ILE 54 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1miq s LYS 55 N -2.49 2.21 -0.34 6.28 -0.14 -1.04 -5.06 119.74 119.16 1miq s LYS 55 Ca 0.36 -1.64 -0.29 0.00 -1.36 0.00 0.00 55.97 53.04 1miq s LYS 55 Cb 0.28 -2.05 0.01 0.00 -1.68 0.00 0.00 37.83 34.40 1miq s LYS 55 CO 0.08 0.15 1.19 -0.80 -0.76 0.00 0.00 175.35 175.21 1miq s ASN 56 N -3.76 6.77 -0.05 2.83 0.01 -1.26 -5.01 114.94 114.47 1miq s ASN 56 Ca 0.35 1.03 -0.14 0.00 -0.71 0.00 0.00 52.86 53.39 1miq s ASN 56 Cb -0.02 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.05 1miq s ASN 56 CO 0.21 -1.03 0.38 -0.76 -1.51 0.00 0.00 177.10 174.38 1miq s LEU 57 N 4.11 4.41 -0.03 0.60 1.43 -1.26 -4.47 118.68 123.47 1miq s LEU 57 Ca 0.51 0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 54.15 1miq s LEU 57 Cb -0.13 -2.53 -0.03 0.00 0.03 0.00 0.00 46.19 43.54 1miq s LEU 57 CO 0.21 0.26 0.96 -0.47 0.23 0.00 0.00 176.35 177.55 1miq s TYR 58 N -0.65 3.62 -0.32 0.29 6.14 0.60 -4.69 117.35 122.33 1miq s TYR 58 Ca 0.22 1.64 0.04 0.00 0.64 0.00 0.00 57.07 59.61 1miq s TYR 58 Cb -0.16 -3.11 0.09 0.00 0.42 0.00 0.00 41.96 39.21 1miq s TYR 58 CO 0.11 -0.05 0.02 0.34 0.64 0.00 0.00 175.55 176.60 1miq s ASP 59 N 1.02 4.70 0.54 4.32 -1.08 -1.26 0.43 116.67 125.34 1miq s ASP 59 Ca 0.50 -1.99 0.30 0.00 -0.52 0.00 0.00 52.55 50.84 1miq s ASP 59 Cb -0.20 -1.61 1.55 0.00 -1.46 0.00 0.00 42.92 41.20 1miq s ASP 59 CO 0.25 -0.34 2.09 0.77 0.52 0.00 0.00 175.17 178.46 1miq h SER 60 N 7.65 0.00 0.67 -0.34 4.64 -1.95 -2.79 113.55 121.42 1miq h SER 60 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1miq h SER 60 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1miq h SER 60 CO 0.51 0.09 0.00 -1.54 -0.87 0.00 0.00 176.83 175.02 1miq n SER 61 N -3.50 0.13 -1.17 4.97 3.41 -1.26 -2.56 113.62 113.64 1miq n SER 61 Ca -0.02 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 1miq n SER 61 Cb 0.23 -0.55 0.24 0.00 -0.26 0.00 0.00 64.21 63.87 1miq n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1miq n LYS 62 N -1.63 2.56 -3.91 4.33 5.02 -1.05 -4.87 118.16 118.60 1miq n LYS 62 Ca 0.04 -2.38 -0.27 0.00 -2.02 0.00 0.00 58.31 53.68 1miq n LYS 62 Cb 0.22 -1.51 -0.17 0.00 -0.02 0.00 0.00 35.03 33.56 1miq n LYS 62 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1miq s SER 63 N -1.25 2.22 0.00 4.39 0.15 -1.06 -4.56 113.70 113.59 1miq s SER 63 Ca 0.40 -0.32 0.25 0.00 0.70 0.00 0.00 55.95 56.98 1miq s SER 63 Cb 0.22 -0.85 1.34 0.00 -1.71 0.00 0.00 66.02 65.02 1miq s SER 63 CO 0.30 -0.12 1.88 2.29 1.20 0.00 0.00 173.24 178.79 1miq n LYS 64 N 4.94 1.16 0.00 5.44 2.85 -1.26 -2.57 118.16 128.71 1miq n LYS 64 Ca -0.13 -0.24 0.12 0.00 -1.05 0.00 0.00 58.31 57.01 1miq n LYS 64 Cb 0.50 -1.40 0.11 0.00 -0.65 0.00 0.00 35.03 33.59 1miq n LYS 64 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1miq n SER 65 N -0.62 1.46 -4.70 -5.58 7.64 -1.26 -4.96 113.62 105.59 1miq n SER 65 Ca 0.18 -1.15 -0.43 0.00 1.01 0.00 0.00 58.87 58.48 1miq n SER 65 Cb 0.14 0.44 -0.01 0.00 -1.01 0.00 0.00 64.21 63.77 1miq n SER 65 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1miq n TYR 66 N -0.55 2.36 -3.88 1.43 9.36 -1.06 -4.48 117.16 120.34 1miq n TYR 66 Ca 0.09 0.50 -0.25 0.00 3.32 0.00 0.00 57.90 61.56 1miq n TYR 66 Cb 0.40 -2.45 -0.17 0.00 -0.63 0.00 0.00 39.34 36.49 1miq n TYR 66 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1miq s GLU 67 N -1.54 1.16 0.51 2.98 2.02 0.68 -4.99 118.70 119.51 1miq s GLU 67 Ca 0.58 -0.12 -0.21 0.00 0.02 0.00 0.00 54.97 55.25 1miq s GLU 67 Cb -0.57 -1.32 -0.07 0.00 0.10 0.00 0.00 34.13 32.27 1miq s GLU 67 CO 0.59 -0.27 1.11 -1.59 0.02 0.00 0.00 175.26 175.13 1miq s LYS 68 N 1.75 3.58 0.02 1.61 -2.85 -1.26 -2.11 119.74 120.48 1miq s LYS 68 Ca 0.04 1.58 0.00 0.00 -1.00 0.00 0.00 55.97 56.59 1miq s LYS 68 Cb -0.13 -2.13 0.00 0.00 -2.06 0.00 0.00 37.83 33.51 1miq s LYS 68 CO -0.06 -0.65 0.00 -3.47 0.10 0.00 0.00 175.35 171.26 1miq n ASP 69 N -0.99 0.08 0.00 0.03 -0.08 -1.22 -4.87 116.55 109.49 1miq n ASP 69 Ca 0.10 0.03 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 1miq n ASP 69 Cb 0.51 -0.01 0.00 0.00 2.34 0.00 0.00 41.12 43.96 1miq n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1miq n GLY 70 N 2.79 0.74 3.68 0.27 0.00 -0.53 -4.99 105.19 107.15 1miq n GLY 70 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 1miq n GLY 70 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1miq n THR 71 N -2.00 0.51 -2.41 2.61 -1.04 -1.26 -4.59 114.28 106.11 1miq n THR 71 Ca 0.00 -0.09 -0.37 0.00 -2.04 0.00 0.00 64.05 61.55 1miq n THR 71 Cb 0.00 -1.95 -0.03 0.00 -1.82 0.00 0.00 70.33 66.53 1miq n THR 71 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1miq s LYS 72 N 3.53 4.06 0.17 -2.82 -0.14 -1.26 -1.54 119.74 121.73 1miq s LYS 72 Ca 0.89 1.67 -0.15 0.00 -1.36 0.00 0.00 55.97 57.01 1miq s LYS 72 Cb -0.61 -2.57 0.02 0.00 -1.68 0.00 0.00 37.83 32.99 1miq s LYS 72 CO 0.46 -0.27 0.44 0.14 -0.76 0.00 0.00 175.35 175.36 1miq s VAL 73 N -1.55 0.04 0.03 3.17 -7.23 -0.48 -4.95 120.40 109.44 1miq s VAL 73 Ca 0.58 -0.89 0.02 0.00 -1.81 0.00 0.00 61.98 59.88 1miq s VAL 73 Cb -0.26 -1.56 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 1miq s VAL 73 CO 0.33 -0.20 -0.07 -1.81 -0.31 0.00 0.00 175.10 173.04 1miq s ASP 74 N -2.88 0.71 -0.07 4.85 -0.00 -1.26 -2.03 116.67 115.98 1miq s ASP 74 Ca 0.10 -0.44 -0.06 0.00 -0.00 0.00 0.00 52.55 52.15 1miq s ASP 74 Cb 0.01 0.02 0.02 0.00 -0.00 0.00 0.00 42.92 42.97 1miq s ASP 74 CO -0.04 -0.16 0.17 0.27 -0.00 0.00 0.00 175.17 175.41 1miq s ILE 75 N -1.12 -0.01 -0.11 0.77 -4.36 -0.51 -4.37 121.20 111.49 1miq s ILE 75 Ca -0.08 0.02 -0.00 0.00 -0.26 0.00 0.00 60.65 60.33 1miq s ILE 75 Cb -0.08 -0.25 -0.02 0.00 1.25 0.00 0.00 42.46 43.35 1miq s ILE 75 CO 0.00 0.01 -0.10 -0.89 0.24 0.00 0.00 174.94 174.20 1miq s THR 76 N 0.26 3.36 0.40 8.37 2.01 -1.26 -1.43 115.64 127.35 1miq s THR 76 Ca -0.01 -0.57 0.08 0.00 0.31 0.00 0.00 61.69 61.49 1miq s THR 76 Cb -0.03 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 70.03 1miq s THR 76 CO -0.01 0.54 0.20 -0.31 -0.69 0.00 0.00 174.62 174.35 1miq s TYR 77 N -0.01 2.63 0.40 4.92 1.51 0.73 -4.98 117.35 122.55 1miq s TYR 77 Ca -0.02 -0.55 0.08 0.00 -1.01 0.00 0.00 57.07 55.57 1miq s TYR 77 Cb -0.14 -1.94 0.85 0.00 -0.11 0.00 0.00 41.96 40.63 1miq s TYR 77 CO 0.04 0.17 2.01 0.78 -1.11 0.00 0.00 175.55 177.44 1miq h GLY 78 N 1.40 0.70 0.31 0.71 0.00 -2.03 -1.01 103.07 103.15 1miq h GLY 78 Ca -0.43 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1miq h GLY 78 CO 0.67 0.20 0.00 -1.14 0.00 0.00 0.00 176.54 176.27 1miq n SER 79 N -4.47 0.56 0.00 0.19 3.41 -1.26 -5.01 113.62 107.04 1miq n SER 79 Ca 0.07 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.35 1miq n SER 79 Cb 0.18 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1miq n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1miq n GLY 80 N 1.00 1.02 3.66 5.00 0.00 -0.38 -4.63 105.19 110.85 1miq n GLY 80 Ca 0.19 -1.95 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 1miq n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1miq s THR 81 N -1.20 3.91 0.06 2.61 2.01 -1.18 -0.19 115.64 121.66 1miq s THR 81 Ca 0.00 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.06 1miq s THR 81 Cb 0.00 -2.84 -0.03 0.00 0.01 0.00 0.00 72.50 69.64 1miq s THR 81 CO 0.00 0.16 -0.12 0.68 -0.69 0.00 0.00 174.62 174.65 1miq s VAL 82 N -1.26 0.92 0.08 3.82 -7.23 -0.51 -3.48 120.40 112.74 1miq s VAL 82 Ca 0.24 -1.26 0.07 0.00 -1.81 0.00 0.00 61.98 59.22 1miq s VAL 82 Cb -0.12 -0.95 -0.03 0.00 0.56 0.00 0.00 36.38 35.85 1miq s VAL 82 CO 0.16 -0.30 -0.17 -0.54 -0.31 0.00 0.00 175.10 173.94 1miq s LYS 83 N -1.76 0.99 0.00 4.82 1.02 -0.74 -1.42 119.74 122.64 1miq s LYS 83 Ca -0.04 -1.03 0.00 0.00 0.02 0.00 0.00 55.97 54.92 1miq s LYS 83 Cb -0.10 -1.11 0.00 0.00 -0.52 0.00 0.00 37.83 36.10 1miq s LYS 83 CO 0.02 0.26 0.00 0.41 -0.92 0.00 0.00 175.35 175.11 1miq n GLY 84 N 1.27 1.94 3.28 -3.33 0.00 -0.86 -0.34 105.19 107.15 1miq n GLY 84 Ca -0.20 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 1miq n GLY 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1miq s PHE 85 N -0.47 0.37 0.28 1.61 -0.71 -0.61 -1.38 117.98 117.07 1miq s PHE 85 Ca 0.00 -0.76 -0.29 0.00 -1.04 0.00 0.00 56.93 54.85 1miq s PHE 85 Cb 0.00 -0.10 -0.09 0.00 -1.21 0.00 0.00 43.02 41.62 1miq s PHE 85 CO 0.00 -0.65 0.97 -0.06 -1.34 0.00 0.00 175.22 174.14 1miq s PHE 86 N -3.94 3.81 0.08 3.49 0.40 -0.59 0.72 117.98 121.94 1miq s PHE 86 Ca 0.14 1.84 -0.06 0.00 -0.60 0.00 0.00 56.93 58.25 1miq s PHE 86 Cb 0.04 -3.02 -0.02 0.00 0.51 0.00 0.00 43.02 40.54 1miq s PHE 86 CO -0.03 0.18 0.11 -1.12 0.70 0.00 0.00 175.22 175.06 1miq s SER 87 N -1.27 0.25 -0.05 1.36 0.01 -0.48 -1.45 113.70 112.08 1miq s SER 87 Ca 0.45 -0.79 0.02 0.00 1.31 0.00 0.00 55.95 56.94 1miq s SER 87 Cb -0.25 0.29 0.01 0.00 0.21 0.00 0.00 66.02 66.29 1miq s SER 87 CO 0.31 -0.69 -0.09 -0.75 0.41 0.00 0.00 173.24 172.43 1miq s LYS 88 N -3.89 1.22 0.24 12.44 2.20 -0.90 -0.20 119.74 130.86 1miq s LYS 88 Ca 0.06 -0.29 -0.22 0.00 -0.36 0.00 0.00 55.97 55.16 1miq s LYS 88 Cb 0.06 -1.09 0.05 0.00 -1.51 0.00 0.00 37.83 35.34 1miq s LYS 88 CO -0.10 0.03 0.84 0.34 -0.36 0.00 0.00 175.35 176.10 1miq s ASP 89 N 0.58 -0.17 0.05 1.43 -1.08 -1.04 -0.23 116.67 116.21 1miq s ASP 89 Ca -0.10 -0.62 -0.30 0.00 -0.52 0.00 0.00 52.55 51.00 1miq s ASP 89 Cb -0.13 0.64 -0.08 0.00 -1.46 0.00 0.00 42.92 41.89 1miq s ASP 89 CO 0.02 -1.21 1.67 -0.22 0.52 0.00 0.00 175.17 175.95 1miq s LEU 90 N -2.99 4.36 -0.17 -1.34 2.96 -1.26 -1.27 118.68 118.96 1miq s LEU 90 Ca 0.13 2.47 -0.02 0.00 -0.22 0.00 0.00 54.13 56.49 1miq s LEU 90 Cb -0.04 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.08 1miq s LEU 90 CO 0.06 -0.90 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.40 1miq s VAL 91 N 2.93 3.11 -0.13 1.68 1.01 0.98 -0.75 120.40 129.23 1miq s VAL 91 Ca 0.75 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 1miq s VAL 91 Cb -0.39 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1miq s VAL 91 CO 0.33 0.48 -0.06 -0.89 0.00 0.00 0.00 175.10 174.96 1miq s THR 92 N 0.91 3.68 -0.22 3.92 2.01 0.50 -1.70 115.64 124.73 1miq s THR 92 Ca -0.02 -0.45 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 1miq s THR 92 Cb -0.15 -2.57 0.07 0.00 0.01 0.00 0.00 72.50 69.86 1miq s THR 92 CO -0.00 0.53 0.07 -0.76 -0.69 0.00 0.00 174.62 173.77 1miq s LEU 93 N 0.03 1.05 0.00 4.42 1.43 0.12 -1.13 118.68 124.60 1miq s LEU 93 Ca -0.01 -0.99 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 1miq s LEU 93 Cb -0.14 -0.52 0.00 0.00 0.03 0.00 0.00 46.19 45.57 1miq s LEU 93 CO 0.03 -0.36 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1miq n GLY 94 N 5.10 3.28 0.01 -3.19 0.00 -1.26 -0.93 105.19 108.20 1miq n GLY 94 Ca -0.07 -0.19 0.15 0.00 0.00 0.00 0.00 46.02 45.92 1miq n GLY 94 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1miq n HIS 95 N 14.00 0.00 -3.32 1.61 1.44 -1.26 -4.79 115.22 122.90 1miq n HIS 95 Ca 0.00 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.33 1miq n HIS 95 Cb 0.00 -0.15 -0.06 0.00 0.12 0.00 0.00 29.99 29.90 1miq n HIS 95 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1miq s LEU 96 N -2.30 4.43 -0.08 2.39 1.43 -0.11 -5.08 118.68 119.36 1miq s LEU 96 Ca 0.38 1.07 -0.04 0.00 -1.03 0.00 0.00 54.13 54.50 1miq s LEU 96 Cb 0.21 -2.79 0.04 0.00 0.03 0.00 0.00 46.19 43.68 1miq s LEU 96 CO 0.42 0.18 0.18 -0.44 0.23 0.00 0.00 176.35 176.92 1miq s SER 97 N -0.48 -0.16 -0.01 2.29 0.01 -1.26 0.15 113.70 114.23 1miq s SER 97 Ca 0.28 0.37 -0.29 0.00 1.31 0.00 0.00 55.95 57.62 1miq s SER 97 Cb -0.18 0.27 0.08 0.00 0.21 0.00 0.00 66.02 66.41 1miq s SER 97 CO 0.15 -0.14 0.71 0.00 0.41 0.00 0.00 173.24 174.37 1miq s MET 98 N 1.05 1.04 0.24 12.44 0.23 -0.69 -4.95 119.30 128.66 1miq s MET 98 Ca -0.08 0.04 -0.30 0.00 -1.03 0.00 0.00 55.69 54.32 1miq s MET 98 Cb -0.10 0.49 -0.10 0.00 -1.53 0.00 0.00 34.83 33.59 1miq s MET 98 CO -0.06 -0.37 1.46 -2.14 -2.03 0.00 0.00 175.02 171.88 1miq s PRO 99 N -1.89 4.26 -0.16 3.16 0.02 -1.26 -0.01 135.00 139.11 1miq s PRO 99 Ca -0.06 2.32 -0.13 0.00 0.02 0.00 0.00 61.00 63.15 1miq s PRO 99 Cb -0.00 -3.11 0.04 0.00 0.02 0.00 0.00 34.50 31.45 1miq s PRO 99 CO 0.02 -0.45 0.41 -0.47 -0.33 0.00 0.00 177.00 176.19 1miq s TYR 100 N 0.12 -0.49 -0.13 6.54 5.04 -0.40 -4.88 117.35 123.15 1miq s TYR 100 Ca 0.61 1.15 -0.28 0.00 -2.44 0.00 0.00 57.07 56.11 1miq s TYR 100 Cb -0.42 0.18 -0.01 0.00 0.35 0.00 0.00 41.96 42.06 1miq s TYR 100 CO 0.42 -0.25 0.93 0.21 -1.34 0.00 0.00 175.55 175.52 1miq s LYS 101 N 0.52 4.38 0.34 4.97 2.20 -1.26 -2.50 119.74 128.39 1miq s LYS 101 Ca -0.02 1.23 0.05 0.00 -0.36 0.00 0.00 55.97 56.86 1miq s LYS 101 Cb -0.04 -3.55 -0.03 0.00 -1.51 0.00 0.00 37.83 32.70 1miq s LYS 101 CO -0.03 -0.30 0.19 -0.59 -0.36 0.00 0.00 175.35 174.26 1miq s PHE 102 N 2.00 1.70 -0.18 4.03 -0.71 0.72 -4.82 117.98 120.71 1miq s PHE 102 Ca 0.44 -1.45 -0.08 0.00 -1.04 0.00 0.00 56.93 54.80 1miq s PHE 102 Cb -0.18 -0.89 -0.04 0.00 -1.21 0.00 0.00 43.02 40.70 1miq s PHE 102 CO 0.16 -0.58 0.10 0.42 -1.34 0.00 0.00 175.22 173.97 1miq s ILE 103 N -3.45 5.12 -0.43 -4.49 1.01 -0.32 -1.38 121.20 117.26 1miq s ILE 103 Ca 0.34 0.08 -0.20 0.00 0.00 0.00 0.00 60.65 60.87 1miq s ILE 103 Cb 0.03 -3.31 0.02 0.00 0.01 0.00 0.00 42.46 39.22 1miq s ILE 103 CO 0.20 0.47 0.57 -0.70 0.00 0.00 0.00 174.94 175.49 1miq s GLU 104 N 0.18 3.22 -0.05 2.79 2.12 0.22 -2.27 118.70 124.91 1miq s GLU 104 Ca 0.07 -0.50 -0.26 0.00 0.36 0.00 0.00 54.97 54.63 1miq s GLU 104 Cb -0.12 -3.96 -0.03 0.00 0.26 0.00 0.00 34.13 30.29 1miq s GLU 104 CO -0.00 -0.96 0.84 0.08 -0.54 0.00 0.00 175.26 174.68 1miq s VAL 105 N 2.59 4.95 -0.18 3.70 1.01 -0.28 -1.57 120.40 130.62 1miq s VAL 105 Ca 0.19 1.73 0.04 0.00 0.00 0.00 0.00 61.98 63.95 1miq s VAL 105 Cb -0.15 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1miq s VAL 105 CO 0.17 0.18 0.18 0.35 0.00 0.00 0.00 175.10 175.98 1miq n THR 106 N 3.95 0.00 -3.76 3.92 -2.24 0.54 -0.45 114.28 116.24 1miq n THR 106 Ca 0.03 -0.35 -0.23 0.00 -2.27 0.00 0.00 64.05 61.22 1miq n THR 106 Cb 0.51 0.91 -0.17 0.00 -2.10 0.00 0.00 70.33 69.48 1miq n THR 106 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1miq s ASP 107 N -1.58 1.70 0.00 3.42 -1.08 -0.46 -3.54 116.67 115.11 1miq s ASP 107 Ca 0.01 -0.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.89 1miq s ASP 107 Cb 0.03 -0.43 0.00 0.00 -1.46 0.00 0.00 42.92 41.07 1miq s ASP 107 CO 0.19 -0.21 0.79 0.35 0.52 0.00 0.00 175.17 176.80 1miq n THR 108 N 5.15 0.62 -0.25 1.71 -2.24 -1.26 -1.79 114.28 116.23 1miq n THR 108 Ca -0.07 -0.70 0.05 0.00 -2.27 0.00 0.00 64.05 61.06 1miq n THR 108 Cb 0.50 0.73 0.18 0.00 -2.10 0.00 0.00 70.33 69.64 1miq n THR 108 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1miq h ASP 109 N 0.00 0.15 0.00 3.42 3.32 -1.94 0.11 116.42 121.48 1miq h ASP 109 Ca 0.00 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1miq h ASP 109 Cb 0.51 0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1miq h ASP 109 CO 0.00 0.04 0.00 -0.67 -1.72 0.00 0.00 179.24 176.89 1miq n ASP 110 N -5.08 0.00 -1.11 6.45 2.03 -1.26 -2.51 116.55 115.08 1miq n ASP 110 Ca 0.14 -0.83 0.08 0.00 0.52 0.00 0.00 54.79 54.70 1miq n ASP 110 Cb 0.42 0.00 0.27 0.00 -0.72 0.00 0.00 41.12 41.09 1miq n ASP 110 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1miq n LEU 111 N -0.91 3.92 -4.91 -2.67 7.94 0.03 -3.11 117.00 117.29 1miq n LEU 111 Ca 0.13 -2.40 -0.30 0.00 -1.11 0.00 0.00 56.01 52.34 1miq n LEU 111 Cb 0.06 -0.45 -0.04 0.00 0.53 0.00 0.00 43.42 43.52 1miq n LEU 111 CO 0.10 0.77 0.07 -1.61 -1.11 0.00 0.00 177.39 175.60 1miq s GLU 112 N -1.74 3.60 0.00 1.96 0.41 -1.04 -0.96 118.70 120.93 1miq s GLU 112 Ca 0.40 -0.14 0.29 0.00 -0.41 0.00 0.00 54.97 55.12 1miq s GLU 112 Cb 0.26 -2.80 1.40 0.00 -1.78 0.00 0.00 34.13 31.20 1miq s GLU 112 CO 0.19 0.40 1.94 -0.35 -0.49 0.00 0.00 175.26 176.94 1miq n PRO 113 N -0.33 1.39 -0.04 0.39 -0.04 -1.26 -4.92 135.00 130.19 1miq n PRO 113 Ca -0.03 -0.56 -0.08 0.00 -0.04 0.00 0.00 63.50 62.79 1miq n PRO 113 Cb 0.53 -1.48 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 1miq n PRO 113 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1miq h ILE 114 N 1.37 0.71 -0.53 0.52 5.03 -1.85 -2.95 117.51 119.81 1miq h ILE 114 Ca 0.00 0.00 0.10 0.00 -0.12 0.00 0.00 64.86 64.84 1miq h ILE 114 Cb 0.29 0.71 -0.09 0.00 -3.03 0.00 0.00 36.82 34.70 1miq h ILE 114 CO 0.00 0.00 -0.01 0.22 -0.68 0.00 0.00 178.15 177.68 1miq h TYR 115 N -0.06 -0.05 0.00 1.37 3.20 -1.37 0.95 116.97 121.00 1miq h TYR 115 Ca 0.11 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.02 1miq h TYR 115 Cb 0.22 0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1miq h TYR 115 CO -0.25 -0.13 0.00 0.43 -1.64 0.00 0.00 178.16 176.57 1miq n SER 116 N -5.25 0.00 0.01 -2.11 7.64 -1.22 -3.39 113.62 109.30 1miq n SER 116 Ca 0.06 0.42 0.11 0.00 1.01 0.00 0.00 58.87 60.47 1miq n SER 116 Cb 0.29 -0.47 -0.12 0.00 -1.01 0.00 0.00 64.21 62.89 1miq n SER 116 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1miq n SER 117 N -1.47 0.34 -4.26 6.43 7.64 0.14 -4.90 113.62 117.55 1miq n SER 117 Ca 0.08 -0.20 -0.32 0.00 1.01 0.00 0.00 58.87 59.43 1miq n SER 117 Cb 0.31 1.53 -0.16 0.00 -1.01 0.00 0.00 64.21 64.87 1miq n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1miq s VAL 118 N -3.36 2.17 -1.21 0.44 1.01 -0.14 -5.03 120.40 114.28 1miq s VAL 118 Ca -0.03 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.83 1miq s VAL 118 Cb 0.14 -1.82 -0.06 0.00 0.00 0.00 0.00 36.38 34.64 1miq s VAL 118 CO 0.88 0.56 2.36 -0.62 0.00 0.00 0.00 175.10 178.28 1miq n GLU 119 N 3.22 2.62 -4.19 2.72 1.02 -1.26 -4.83 120.64 119.94 1miq n GLU 119 Ca -0.18 -1.98 -0.15 0.00 -0.02 0.00 0.00 57.16 54.82 1miq n GLU 119 Cb 0.52 -2.81 -0.11 0.00 -0.02 0.00 0.00 31.44 29.02 1miq n GLU 119 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1miq s PHE 120 N 3.29 1.14 -0.22 -0.32 -0.71 -1.26 -4.94 117.98 114.95 1miq s PHE 120 Ca 0.53 -0.62 -0.16 0.00 -1.04 0.00 0.00 56.93 55.64 1miq s PHE 120 Cb 0.14 -0.62 -0.11 0.00 -1.21 0.00 0.00 43.02 41.22 1miq s PHE 120 CO -0.03 0.04 -0.18 -0.25 -1.34 0.00 0.00 175.22 173.46 1miq n ASP 121 N 0.59 1.91 -1.73 1.98 8.00 0.12 -4.98 116.55 122.44 1miq n ASP 121 Ca -0.16 0.40 -0.06 0.00 0.71 0.00 0.00 54.79 55.68 1miq n ASP 121 Cb 0.57 -0.85 -0.02 0.00 -0.02 0.00 0.00 41.12 40.80 1miq n ASP 121 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1miq n GLY 122 N 1.39 3.38 3.14 0.44 0.00 -0.79 -4.22 105.19 108.52 1miq n GLY 122 Ca -0.34 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 43.78 1miq n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1miq s ILE 123 N -2.49 1.33 -0.23 -0.61 1.01 -1.05 -1.37 121.20 117.79 1miq s ILE 123 Ca 0.12 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 60.07 1miq s ILE 123 Cb 0.00 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.37 1miq s ILE 123 CO 0.09 0.38 -0.10 -0.22 0.00 0.00 0.00 174.94 175.09 1miq s LEU 124 N -0.19 2.92 0.06 2.97 0.20 -0.25 -1.53 118.68 122.86 1miq s LEU 124 Ca 0.02 -0.81 -0.30 0.00 0.69 0.00 0.00 54.13 53.72 1miq s LEU 124 Cb -0.09 -1.62 -0.05 0.00 -0.43 0.00 0.00 46.19 44.01 1miq s LEU 124 CO 0.00 -0.09 1.08 -0.83 -0.29 0.00 0.00 176.35 176.23 1miq s GLY 125 N 1.31 2.71 -0.09 7.98 0.00 0.18 -1.86 107.32 117.55 1miq s GLY 125 Ca 0.01 0.71 0.13 0.00 0.00 0.00 0.00 44.72 45.57 1miq s GLY 125 CO -0.06 1.80 1.31 1.04 0.00 0.00 0.00 173.10 177.18 1miq n LEU 126 N 3.57 3.26 0.00 0.66 4.77 0.41 -4.48 117.00 125.19 1miq n LEU 126 Ca 0.06 -2.53 0.00 0.00 -0.03 0.00 0.00 56.01 53.51 1miq n LEU 126 Cb 0.48 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1miq n LEU 126 CO 0.54 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.89 1miq n GLY 127 N -0.15 1.84 0.00 -0.72 0.00 0.17 -4.70 105.19 101.63 1miq n GLY 127 Ca 0.15 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1miq n GLY 127 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1miq n TRP 128 N 0.00 0.00 -2.64 1.61 7.02 -1.25 -4.44 117.44 117.73 1miq n TRP 128 Ca 0.00 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.05 1miq n TRP 128 Cb 0.00 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 28.87 1miq n TRP 128 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1miq s LYS 129 N -1.95 4.27 -0.35 -0.99 2.20 -1.25 -4.44 119.74 117.23 1miq s LYS 129 Ca 0.00 1.39 -0.29 0.00 -0.36 0.00 0.00 55.97 56.71 1miq s LYS 129 Cb 0.00 -3.64 0.02 0.00 -1.51 0.00 0.00 37.83 32.70 1miq s LYS 129 CO 0.00 -0.60 1.10 0.34 -0.36 0.00 0.00 175.35 175.83 1miq s ASP 130 N 1.25 6.85 0.21 1.43 -1.08 -1.26 0.10 116.67 124.17 1miq s ASP 130 Ca 0.45 0.93 0.23 0.00 -0.52 0.00 0.00 52.55 53.64 1miq s ASP 130 Cb -0.16 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.68 1miq s ASP 130 CO 0.08 -0.97 1.69 0.18 0.52 0.00 0.00 175.17 176.67 1miq n LEU 131 N 7.12 0.58 -0.55 -1.34 4.77 -1.26 -1.82 117.00 124.51 1miq n LEU 131 Ca 0.12 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.86 1miq n LEU 131 Cb 0.47 -0.54 0.27 0.00 -2.33 0.00 0.00 43.42 41.30 1miq n LEU 131 CO 0.62 -0.47 0.64 -1.54 -1.33 0.00 0.00 177.39 175.31 1miq n SER 132 N -2.13 1.88 -4.08 -1.43 3.41 -1.26 -4.65 113.62 105.37 1miq n SER 132 Ca 0.03 -1.48 -0.28 0.00 -0.26 0.00 0.00 58.87 56.88 1miq n SER 132 Cb 0.24 0.13 -0.04 0.00 -0.26 0.00 0.00 64.21 64.28 1miq n SER 132 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1miq n ILE 133 N 0.23 -2.34 -2.99 -1.33 -5.35 -0.75 -4.93 119.36 101.89 1miq n ILE 133 Ca 0.14 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 62.15 1miq n ILE 133 Cb 0.44 -2.11 0.00 0.00 -1.74 0.00 0.00 39.64 36.23 1miq n ILE 133 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1miq n GLY 134 N -2.12 3.09 2.64 3.28 0.00 -1.26 -5.02 105.19 105.80 1miq n GLY 134 Ca -0.29 -2.12 -0.36 0.00 0.00 0.00 0.00 46.02 43.25 1miq n GLY 134 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1miq n SER 135 N -1.54 7.14 -4.71 1.61 3.41 -1.26 -4.94 113.62 113.33 1miq n SER 135 Ca 0.00 -3.81 -0.38 0.00 -0.26 0.00 0.00 58.87 54.42 1miq n SER 135 Cb 0.00 -0.94 -0.06 0.00 -0.26 0.00 0.00 64.21 62.96 1miq n SER 135 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1miq s ILE 136 N -5.03 5.14 0.04 -1.33 -1.09 -1.26 -5.07 121.20 112.61 1miq s ILE 136 Ca 0.55 1.06 -0.05 0.00 -2.23 0.00 0.00 60.65 59.98 1miq s ILE 136 Cb 0.46 -3.87 -0.05 0.00 -1.58 0.00 0.00 42.46 37.42 1miq s ILE 136 CO -0.25 0.28 0.29 -1.81 -1.23 0.00 0.00 174.94 172.22 1miq s ASP 137 N 0.75 6.48 0.50 3.58 -0.00 -1.26 -4.62 116.67 122.10 1miq s ASP 137 Ca 0.28 0.54 -0.22 0.00 -0.00 0.00 0.00 52.55 53.15 1miq s ASP 137 Cb -0.16 -2.08 -0.08 0.00 -0.00 0.00 0.00 42.92 40.61 1miq s ASP 137 CO 0.12 0.20 1.00 -2.65 -0.00 0.00 0.00 175.17 173.84 1miq n PRO 138 N 0.80 1.21 0.22 8.23 -0.02 -1.26 -4.73 135.00 139.45 1miq n PRO 138 Ca -0.09 0.44 0.06 0.00 -2.02 0.00 0.00 63.50 61.90 1miq n PRO 138 Cb 0.52 -2.12 0.56 0.00 -0.02 0.00 0.00 33.50 32.44 1miq n PRO 138 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1miq h ILE 139 N 1.13 1.06 -0.51 4.25 2.10 -1.79 -1.67 117.51 122.09 1miq h ILE 139 Ca -0.47 -0.27 -0.04 0.00 1.08 0.00 0.00 64.86 65.16 1miq h ILE 139 Cb 1.35 1.09 -0.02 0.00 -1.09 0.00 0.00 36.82 38.14 1miq h ILE 139 CO 0.54 0.08 0.16 0.58 -1.08 0.00 0.00 178.15 178.44 1miq h VAL 140 N 0.06 1.23 -0.33 2.19 2.07 -1.89 0.50 116.25 120.08 1miq h VAL 140 Ca 0.01 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.70 1miq h VAL 140 Cb 0.13 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1miq h VAL 140 CO 0.01 0.28 -0.02 0.58 0.02 0.00 0.00 177.57 178.44 1miq h VAL 141 N 0.69 1.26 -0.83 2.57 2.07 -1.73 -1.75 116.25 118.53 1miq h VAL 141 Ca 0.16 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.69 1miq h VAL 141 Cb 0.27 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1miq h VAL 141 CO -0.01 0.33 0.55 -0.08 0.02 0.00 0.00 177.57 178.38 1miq h GLU 142 N 0.40 1.09 -0.93 1.57 4.57 -1.04 0.43 114.58 120.66 1miq h GLU 142 Ca 0.09 -0.07 0.04 0.00 -1.18 0.00 0.00 59.36 58.25 1miq h GLU 142 Cb 0.48 -0.25 -0.06 0.00 -0.16 0.00 0.00 28.75 28.77 1miq h GLU 142 CO 0.02 0.72 0.61 -0.07 -1.18 0.00 0.00 179.01 179.12 1miq h LEU 143 N 1.12 0.99 -0.08 1.64 3.38 0.43 -0.10 115.31 122.70 1miq h LEU 143 Ca 0.30 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 1miq h LEU 143 Cb -0.13 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.40 1miq h LEU 143 CO -0.07 0.67 -0.03 0.50 0.09 0.00 0.00 178.44 179.60 1miq h LYS 144 N 1.14 0.16 -0.98 1.13 1.63 -0.39 0.66 116.57 119.92 1miq h LYS 144 Ca 0.38 -0.07 0.27 0.00 -0.85 0.00 0.00 60.65 60.38 1miq h LYS 144 Cb 0.07 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.64 1miq h LYS 144 CO -0.13 0.51 0.69 -0.91 -3.45 0.00 0.00 179.45 176.16 1miq h ASN 145 N -0.19 0.14 -0.56 4.20 2.35 0.10 0.14 115.58 121.77 1miq h ASN 145 Ca 0.02 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1miq h ASN 145 Cb 0.45 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1miq h ASN 145 CO 0.01 0.04 0.00 0.00 -1.65 0.00 0.00 177.43 175.83 1miq n GLN 146 N -4.35 3.96 -3.04 0.81 1.13 -0.17 -4.94 117.38 110.78 1miq n GLN 146 Ca 0.21 -2.93 -0.21 0.00 -1.94 0.00 0.00 57.00 52.13 1miq n GLN 146 Cb 0.97 -1.97 0.01 0.00 0.11 0.00 0.00 30.24 29.36 1miq n GLN 146 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1miq n ASN 147 N 0.72 -4.84 0.17 1.08 3.02 0.51 -4.84 115.26 111.08 1miq n ASN 147 Ca 0.25 -0.25 0.09 0.00 -0.03 0.00 0.00 54.58 54.64 1miq n ASN 147 Cb 0.97 -3.97 0.10 0.00 -0.61 0.00 0.00 39.78 36.26 1miq n ASN 147 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1miq h LYS 148 N -0.95 0.00 -4.51 3.52 1.79 -1.09 -3.47 116.57 111.87 1miq h LYS 148 Ca -0.46 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 57.83 1miq h LYS 148 Cb 1.31 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.81 1miq h LYS 148 CO 0.52 0.15 -0.69 0.96 -1.08 0.00 0.00 179.45 179.31 1miq s ILE 149 N -3.15 0.53 0.07 1.86 -4.36 -1.22 -5.02 121.20 109.91 1miq s ILE 149 Ca 0.05 -1.87 -0.15 0.00 -0.26 0.00 0.00 60.65 58.42 1miq s ILE 149 Cb 0.06 -1.60 -0.18 0.00 1.25 0.00 0.00 42.46 42.00 1miq s ILE 149 CO 0.71 -0.90 1.25 0.44 0.24 0.00 0.00 174.94 176.68 1miq h ASP 150 N 3.07 0.83 -4.34 4.36 3.45 -1.91 -3.43 116.42 118.46 1miq h ASP 150 Ca -0.35 -0.66 -0.27 0.00 0.43 0.00 0.00 57.03 56.18 1miq h ASP 150 Cb 1.16 -0.25 -0.25 0.00 -0.56 0.00 0.00 39.33 39.43 1miq h ASP 150 CO 0.64 1.37 -0.73 0.20 -1.57 0.00 0.00 179.24 179.15 1miq s ASN 151 N -7.01 0.55 -1.24 6.45 0.01 -0.76 -5.05 114.94 107.88 1miq s ASN 151 Ca -0.11 -0.30 -0.17 0.00 -0.71 0.00 0.00 52.86 51.57 1miq s ASN 151 Cb 0.07 0.00 0.10 0.00 0.41 0.00 0.00 41.25 41.83 1miq s ASN 151 CO 0.88 -0.09 1.62 0.00 -1.51 0.00 0.00 177.10 178.00 1miq s ALA 152 N -0.74 3.45 0.19 0.60 0.00 -1.26 -3.99 121.76 120.01 1miq s ALA 152 Ca -0.05 -2.98 -0.23 0.00 0.00 0.00 0.00 51.96 48.71 1miq s ALA 152 Cb -0.06 -4.49 0.05 0.00 0.00 0.00 0.00 23.12 18.63 1miq s ALA 152 CO -0.00 -3.18 0.67 -0.48 0.00 0.00 0.00 175.76 172.77 1miq s LEU 153 N 3.56 -0.44 0.15 0.00 0.05 -1.26 -0.72 118.68 120.00 1miq s LEU 153 Ca 0.50 -0.22 -0.07 0.00 0.05 0.00 0.00 54.13 54.39 1miq s LEU 153 Cb 0.02 2.60 -0.02 0.00 -2.05 0.00 0.00 46.19 46.74 1miq s LEU 153 CO 0.04 -1.07 0.21 0.72 -0.55 0.00 0.00 176.35 175.70 1miq s PHE 154 N -3.76 0.49 0.12 3.48 -0.71 -0.38 -0.54 117.98 116.68 1miq s PHE 154 Ca 0.05 -0.87 0.03 0.00 -1.04 0.00 0.00 56.93 55.10 1miq s PHE 154 Cb -0.03 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.57 1miq s PHE 154 CO -0.06 -0.64 -0.08 0.95 -1.34 0.00 0.00 175.22 174.05 1miq s THR 155 N -3.97 0.92 -0.12 -4.49 -4.23 0.14 -0.87 115.64 103.01 1miq s THR 155 Ca 0.17 -1.99 0.03 0.00 -1.18 0.00 0.00 61.69 58.72 1miq s THR 155 Cb 0.05 -1.76 0.01 0.00 1.34 0.00 0.00 72.50 72.13 1miq s THR 155 CO -0.01 -0.81 -0.23 -0.36 -0.54 0.00 0.00 174.62 172.67 1miq s PHE 156 N -3.48 2.61 -0.19 3.99 2.99 -0.66 -0.93 117.98 122.32 1miq s PHE 156 Ca 0.14 -1.20 0.01 0.00 0.00 0.00 0.00 56.93 55.88 1miq s PHE 156 Cb 0.04 -1.76 0.03 0.00 0.00 0.00 0.00 43.02 41.33 1miq s PHE 156 CO -0.02 -0.52 -0.15 -0.47 -0.00 0.00 0.00 175.22 174.06 1miq s TYR 157 N 0.58 2.60 -0.42 0.36 5.04 -0.65 -2.67 117.35 122.20 1miq s TYR 157 Ca -0.13 -1.62 -0.00 0.00 -2.44 0.00 0.00 57.07 52.88 1miq s TYR 157 Cb -0.17 -1.77 0.11 0.00 0.35 0.00 0.00 41.96 40.48 1miq s TYR 157 CO 0.03 -0.77 0.19 -0.51 -1.34 0.00 0.00 175.55 173.15 1miq s LEU 158 N 1.34 5.03 -0.03 6.97 1.43 -1.26 -1.62 118.68 130.55 1miq s LEU 158 Ca 0.02 -2.24 -0.36 0.00 -1.03 0.00 0.00 54.13 50.52 1miq s LEU 158 Cb -0.15 -1.76 -0.15 0.00 0.03 0.00 0.00 46.19 44.17 1miq s LEU 158 CO -0.10 -0.45 1.61 -2.65 0.23 0.00 0.00 176.35 174.99 1miq n PRO 159 N 4.25 1.60 0.00 1.29 -0.01 -1.26 -4.41 135.00 136.46 1miq n PRO 159 Ca 0.01 0.58 0.10 0.00 -0.01 0.00 0.00 63.50 64.18 1miq n PRO 159 Cb 0.40 -2.31 0.52 0.00 -0.01 0.00 0.00 33.50 32.10 1miq n PRO 159 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 175.50 175.25 1miq h VAL 160 N 4.33 0.96 0.00 -1.45 3.04 -1.73 -2.76 116.25 118.63 1miq h VAL 160 Ca -0.47 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.10 1miq h VAL 160 Cb 1.30 0.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 1miq h VAL 160 CO 0.89 0.06 -0.11 0.00 -1.01 0.00 0.00 177.57 177.40 1miq n HIS 161 N -4.47 0.08 -3.62 3.17 1.44 -1.26 -4.57 115.22 105.98 1miq n HIS 161 Ca 0.06 0.02 -0.29 0.00 -2.01 0.00 0.00 57.72 55.51 1miq n HIS 161 Cb 0.26 -0.49 -0.12 0.00 0.12 0.00 0.00 29.99 29.76 1miq n HIS 161 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1miq s ASP 162 N -3.14 3.19 0.57 4.39 -1.08 -1.04 -4.96 116.67 114.60 1miq s ASP 162 Ca 0.13 -2.83 0.27 0.00 -0.52 0.00 0.00 52.55 49.60 1miq s ASP 162 Cb 0.18 -0.88 1.52 0.00 -1.46 0.00 0.00 42.92 42.28 1miq s ASP 162 CO 0.57 -0.23 2.03 -0.37 0.52 0.00 0.00 175.17 177.70 1miq h VAL 163 N 4.95 0.56 -0.07 1.11 -1.51 -1.81 0.11 116.25 119.61 1miq h VAL 163 Ca 0.09 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.56 1miq h VAL 163 Cb 0.91 0.77 0.00 0.00 -2.13 0.00 0.00 31.29 30.84 1miq h VAL 163 CO 0.45 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 178.20 1miq n HIS 164 N -4.01 0.08 -4.31 5.19 8.25 -1.26 -4.75 115.22 114.41 1miq n HIS 164 Ca 0.05 -0.04 -0.22 0.00 -0.26 0.00 0.00 57.72 57.25 1miq n HIS 164 Cb 0.47 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.46 1miq n HIS 164 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1miq s ALA 165 N -1.92 1.89 0.13 -1.41 0.00 0.39 -0.22 121.76 120.62 1miq s ALA 165 Ca 0.33 -1.41 -0.19 0.00 0.00 0.00 0.00 51.96 50.69 1miq s ALA 165 Cb 0.16 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 23.15 1miq s ALA 165 CO 0.26 0.25 0.48 0.20 0.00 0.00 0.00 175.76 176.95 1miq s GLY 166 N -2.46 -0.41 -0.07 0.00 0.00 -0.87 -4.26 107.32 99.25 1miq s GLY 166 Ca 0.13 0.18 -0.00 0.00 0.00 0.00 0.00 44.72 45.03 1miq s GLY 166 CO 0.06 -0.10 -0.03 -0.19 0.00 0.00 0.00 173.10 172.83 1miq s TYR 167 N -3.69 0.83 -0.26 1.90 1.51 -0.64 -0.63 117.35 116.37 1miq s TYR 167 Ca 0.02 -0.27 -0.07 0.00 -1.01 0.00 0.00 57.07 55.73 1miq s TYR 167 Cb 0.01 -0.82 -0.02 0.00 -0.11 0.00 0.00 41.96 41.02 1miq s TYR 167 CO -0.12 -0.30 0.07 -1.17 -1.11 0.00 0.00 175.55 172.92 1miq s LEU 168 N 1.51 3.52 -0.14 -1.29 2.96 0.26 -1.63 118.68 123.87 1miq s LEU 168 Ca -0.02 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.50 1miq s LEU 168 Cb -0.13 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1miq s LEU 168 CO -0.03 -0.08 0.00 -0.89 -1.32 0.00 0.00 176.35 174.03 1miq s THR 169 N 1.58 4.29 -0.12 3.68 2.01 -0.10 0.46 115.64 127.43 1miq s THR 169 Ca 0.05 -0.23 0.01 0.00 0.31 0.00 0.00 61.69 61.83 1miq s THR 169 Cb -0.16 -2.87 -0.01 0.00 0.01 0.00 0.00 72.50 69.48 1miq s THR 169 CO 0.03 0.52 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.70 1miq s ILE 170 N -0.07 2.82 0.00 1.82 1.01 0.12 0.23 121.20 127.12 1miq s ILE 170 Ca 0.04 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.94 1miq s ILE 170 Cb -0.13 -2.16 0.00 0.00 0.01 0.00 0.00 42.46 40.19 1miq s ILE 170 CO 0.02 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.10 1miq n GLY 171 N 3.47 3.22 3.76 6.18 0.00 0.30 -3.27 105.19 118.84 1miq n GLY 171 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1miq n GLY 171 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1miq s GLY 172 N -2.81 -0.25 -0.23 -0.02 0.00 -1.26 -1.83 107.32 100.91 1miq s GLY 172 Ca 0.00 0.32 -0.07 0.00 0.00 0.00 0.00 44.72 44.97 1miq s GLY 172 CO 0.00 1.68 0.06 -0.42 0.00 0.00 0.00 173.10 174.42 1miq s ILE 173 N -2.42 4.32 -0.27 0.90 1.01 -1.26 -4.75 121.20 118.73 1miq s ILE 173 Ca 0.18 -0.17 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 1miq s ILE 173 Cb 0.02 -3.00 -0.02 0.00 0.01 0.00 0.00 42.46 39.46 1miq s ILE 173 CO -0.01 0.37 0.56 -1.61 0.00 0.00 0.00 174.94 174.25 1miq s GLU 174 N 1.36 4.02 0.60 2.79 0.41 -1.26 -4.94 118.70 121.69 1miq s GLU 174 Ca 0.05 0.34 0.31 0.00 -0.41 0.00 0.00 54.97 55.26 1miq s GLU 174 Cb -0.15 -3.67 1.85 0.00 -1.78 0.00 0.00 34.13 30.38 1miq s GLU 174 CO 0.03 -0.42 2.22 0.93 -0.49 0.00 0.00 175.26 177.53 1miq h GLU 175 N 8.05 0.00 0.00 1.61 4.39 -1.97 -2.35 114.58 124.30 1miq h GLU 175 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 1miq h GLU 175 Cb 1.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1miq h GLU 175 CO 0.75 0.00 0.00 1.17 -1.16 0.00 0.00 179.01 179.77 1miq n LYS 176 N -3.71 0.06 0.02 2.33 4.81 -1.26 -2.83 118.16 117.58 1miq n LYS 176 Ca -0.02 0.32 0.11 0.00 -0.87 0.00 0.00 58.31 57.85 1miq n LYS 176 Cb 0.16 -1.62 0.04 0.00 0.02 0.00 0.00 35.03 33.62 1miq n LYS 176 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1miq n PHE 177 N -1.74 0.22 -4.08 5.64 0.99 -0.88 -4.74 117.46 112.87 1miq n PHE 177 Ca 0.03 0.06 -0.09 0.00 -0.00 0.00 0.00 57.45 57.45 1miq n PHE 177 Cb 0.18 -0.39 -0.09 0.00 -1.00 0.00 0.00 39.48 38.18 1miq n PHE 177 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.76 178.28 1miq s TYR 178 N -3.16 0.66 0.29 1.38 -0.85 -1.13 -0.13 117.35 114.40 1miq s TYR 178 Ca 0.05 -1.06 0.07 0.00 -0.52 0.00 0.00 57.07 55.60 1miq s TYR 178 Cb 0.15 -0.35 -0.06 0.00 0.38 0.00 0.00 41.96 42.08 1miq s TYR 178 CO 0.79 -0.54 -0.07 -1.83 -1.52 0.00 0.00 175.55 172.39 1miq s GLU 179 N -4.00 1.59 3.13 -3.49 -1.05 -0.01 -4.64 118.70 110.22 1miq s GLU 179 Ca 0.18 -1.80 0.00 0.00 -0.15 0.00 0.00 54.97 53.20 1miq s GLU 179 Cb 0.07 -1.23 0.00 0.00 -0.44 0.00 0.00 34.13 32.52 1miq s GLU 179 CO -0.02 0.06 0.00 0.41 0.95 0.00 0.00 175.26 176.66 1miq n GLY 180 N -0.61 0.46 3.97 -3.83 0.00 -1.26 -3.88 105.19 100.03 1miq n GLY 180 Ca -0.05 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 44.90 1miq n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1miq s ASN 181 N -4.00 5.94 -0.21 1.61 4.22 -1.26 -4.99 114.94 116.25 1miq s ASN 181 Ca 0.00 -0.18 -0.09 0.00 -2.14 0.00 0.00 52.86 50.45 1miq s ASN 181 Cb 0.00 -1.32 -0.05 0.00 1.28 0.00 0.00 41.25 41.16 1miq s ASN 181 CO 0.00 -0.34 0.12 -0.63 -2.04 0.00 0.00 177.10 174.21 1miq s ILE 182 N -2.15 5.13 -0.11 0.54 1.01 -1.26 -4.47 121.20 119.89 1miq s ILE 182 Ca 0.42 0.09 -0.03 0.00 0.00 0.00 0.00 60.65 61.13 1miq s ILE 182 Cb -0.09 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 1miq s ILE 182 CO 0.30 0.40 0.02 0.42 0.00 0.00 0.00 174.94 176.09 1miq s THR 183 N 0.71 4.49 0.05 2.92 -4.23 -0.28 -4.83 115.64 114.48 1miq s THR 183 Ca 0.06 -0.17 0.01 0.00 -1.18 0.00 0.00 61.69 60.41 1miq s THR 183 Cb -0.13 -2.92 -0.04 0.00 1.34 0.00 0.00 72.50 70.75 1miq s THR 183 CO 0.01 0.58 0.13 -0.31 -0.54 0.00 0.00 174.62 174.50 1miq s TYR 184 N -0.67 3.34 -0.06 3.99 1.51 -1.26 -0.73 117.35 123.46 1miq s TYR 184 Ca 0.11 0.18 0.01 0.00 -1.01 0.00 0.00 57.07 56.36 1miq s TYR 184 Cb -0.12 -1.70 0.02 0.00 -0.11 0.00 0.00 41.96 40.05 1miq s TYR 184 CO 0.02 0.56 -0.08 -1.21 -1.11 0.00 0.00 175.55 173.73 1miq s GLU 185 N -2.26 1.26 0.20 -0.62 0.41 0.00 -4.97 118.70 112.72 1miq s GLU 185 Ca 0.30 -0.25 -0.30 0.00 -0.41 0.00 0.00 54.97 54.31 1miq s GLU 185 Cb -0.12 -1.14 -0.08 0.00 -1.78 0.00 0.00 34.13 31.00 1miq s GLU 185 CO 0.22 -0.05 1.22 0.21 -0.49 0.00 0.00 175.26 176.37 1miq s LYS 186 N 0.87 4.47 0.40 1.61 2.36 -1.26 -1.09 119.74 127.10 1miq s LYS 186 Ca -0.11 1.92 -0.27 0.00 -2.55 0.00 0.00 55.97 54.96 1miq s LYS 186 Cb -0.15 -3.22 -0.10 0.00 -1.05 0.00 0.00 37.83 33.31 1miq s LYS 186 CO 0.01 -0.11 1.44 -0.51 1.55 0.00 0.00 175.35 177.73 1miq s LEU 187 N -0.34 4.25 -0.10 5.43 1.43 -0.90 -4.53 118.68 123.91 1miq s LEU 187 Ca 0.53 2.96 0.19 0.00 -1.03 0.00 0.00 54.13 56.78 1miq s LEU 187 Cb -0.34 -3.78 0.71 0.00 0.03 0.00 0.00 46.19 42.81 1miq s LEU 187 CO 0.38 -0.96 1.61 -0.46 0.23 0.00 0.00 176.35 177.15 1miq n ASN 188 N 0.23 4.65 -3.77 2.29 0.23 -0.42 -4.91 115.26 113.56 1miq n ASN 188 Ca 0.02 -2.41 -0.13 0.00 -0.53 0.00 0.00 54.58 51.54 1miq n ASN 188 Cb 0.41 -0.56 -0.10 0.00 -2.08 0.00 0.00 39.78 37.44 1miq n ASN 188 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 1miq s HIS 189 N -1.77 -0.24 0.27 -2.53 5.04 -1.26 -5.00 115.29 109.79 1miq s HIS 189 Ca 0.50 0.52 0.09 0.00 -1.54 0.00 0.00 55.06 54.63 1miq s HIS 189 Cb 0.32 0.09 0.34 0.00 0.04 0.00 0.00 32.58 33.37 1miq s HIS 189 CO 0.25 -0.27 1.60 -0.44 -2.34 0.00 0.00 174.74 173.54 1miq h ASP 190 N 4.79 0.04 -0.07 9.88 3.32 -1.96 -3.36 116.42 129.06 1miq h ASP 190 Ca -0.28 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1miq h ASP 190 Cb 1.18 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1miq h ASP 190 CO 0.36 0.65 0.00 0.18 -1.72 0.00 0.00 179.24 178.71 1miq n LEU 191 N -3.82 1.83 -3.98 1.55 4.77 -1.26 -4.99 117.00 111.10 1miq n LEU 191 Ca -0.01 -1.38 -0.10 0.00 -0.03 0.00 0.00 56.01 54.49 1miq n LEU 191 Cb 0.62 -0.04 -0.11 0.00 -2.33 0.00 0.00 43.42 41.55 1miq n LEU 191 CO 0.42 0.42 -0.36 -0.31 -1.33 0.00 0.00 177.39 176.23 1miq s TYR 192 N -0.66 0.29 -1.06 -1.77 1.51 -1.26 -3.87 117.35 110.53 1miq s TYR 192 Ca 0.08 -0.49 -0.21 0.00 -1.01 0.00 0.00 57.07 55.44 1miq s TYR 192 Cb 0.05 -0.20 -0.08 0.00 -0.11 0.00 0.00 41.96 41.61 1miq s TYR 192 CO 0.07 -0.16 1.93 0.91 -1.11 0.00 0.00 175.55 177.19 1miq n TRP 193 N 1.70 2.71 -4.25 2.71 7.02 -1.26 -4.60 117.44 121.47 1miq n TRP 193 Ca -0.23 -1.90 -0.17 0.00 -1.02 0.00 0.00 57.50 54.18 1miq n TRP 193 Cb 0.55 -2.26 -0.13 0.00 -2.42 0.00 0.00 31.31 27.05 1miq n TRP 193 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1miq s GLN 194 N 5.33 0.69 0.13 -0.99 0.74 -1.26 -1.78 119.66 122.51 1miq s GLN 194 Ca 0.60 -0.55 -0.08 0.00 0.05 0.00 0.00 55.36 55.39 1miq s GLN 194 Cb 0.07 -0.62 -0.01 0.00 1.10 0.00 0.00 33.01 33.55 1miq s GLN 194 CO 0.10 0.15 0.21 0.96 -0.55 0.00 0.00 175.29 176.17 1miq s ILE 195 N -0.69 0.10 -0.11 -2.34 -4.36 -0.47 -1.29 121.20 112.04 1miq s ILE 195 Ca -0.01 -1.38 -0.22 0.00 -0.26 0.00 0.00 60.65 58.78 1miq s ILE 195 Cb -0.06 -1.66 -0.03 0.00 1.25 0.00 0.00 42.46 41.95 1miq s ILE 195 CO 0.00 -0.47 0.68 -1.81 0.24 0.00 0.00 174.94 173.58 1miq s ASP 196 N -2.93 6.89 0.00 4.36 1.01 -1.26 -0.76 116.67 123.98 1miq s ASP 196 Ca 0.13 1.07 -0.09 0.00 0.71 0.00 0.00 52.55 54.37 1miq s ASP 196 Cb 0.04 -2.39 0.00 0.00 1.01 0.00 0.00 42.92 41.59 1miq s ASP 196 CO -0.04 -0.17 0.17 -0.76 0.21 0.00 0.00 175.17 174.57 1miq s LEU 197 N 1.18 1.44 -0.07 1.23 1.43 -0.89 -4.76 118.68 118.23 1miq s LEU 197 Ca 0.34 -0.19 -0.22 0.00 -1.03 0.00 0.00 54.13 53.03 1miq s LEU 197 Cb -0.17 0.79 -0.04 0.00 0.03 0.00 0.00 46.19 46.80 1miq s LEU 197 CO 0.15 -0.40 0.65 -1.81 0.23 0.00 0.00 176.35 175.16 1miq s ASP 198 N -1.47 6.93 -0.20 2.29 -0.00 -0.02 -0.13 116.67 124.06 1miq s ASP 198 Ca -0.13 1.11 -0.08 0.00 -0.00 0.00 0.00 52.55 53.45 1miq s ASP 198 Cb -0.06 -2.38 -0.04 0.00 -0.00 0.00 0.00 42.92 40.43 1miq s ASP 198 CO 0.01 -0.08 0.08 -0.69 -0.00 0.00 0.00 175.17 174.49 1miq s VAL 199 N 0.69 4.80 -0.20 -1.27 1.01 0.37 -1.23 120.40 124.58 1miq s VAL 199 Ca 0.35 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1miq s VAL 199 Cb -0.17 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 33.05 1miq s VAL 199 CO 0.16 0.42 -0.16 -1.00 0.00 0.00 0.00 175.10 174.53 1miq s HIS 200 N 0.67 2.76 -0.77 5.22 3.76 0.88 -0.86 115.29 126.95 1miq s HIS 200 Ca 0.04 -1.74 -0.01 0.00 -0.15 0.00 0.00 55.06 53.20 1miq s HIS 200 Cb -0.13 -1.85 0.19 0.00 1.11 0.00 0.00 32.58 31.91 1miq s HIS 200 CO 0.02 -0.80 0.61 -0.06 -0.85 0.00 0.00 174.74 173.66 1miq s PHE 201 N 1.29 3.66 0.00 1.40 0.40 0.77 -1.04 117.98 124.46 1miq s PHE 201 Ca 0.01 -2.96 0.00 0.00 -0.60 0.00 0.00 56.93 53.38 1miq s PHE 201 Cb -0.15 -3.15 0.00 0.00 0.51 0.00 0.00 43.02 40.23 1miq s PHE 201 CO -0.10 -0.75 0.00 0.41 0.70 0.00 0.00 175.22 175.48 1miq n GLY 202 N 2.71 2.91 0.20 4.36 0.00 -1.26 -1.45 105.19 112.67 1miq n GLY 202 Ca 0.16 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 46.10 1miq n GLY 202 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1miq h LYS 203 N 0.00 0.00 -6.42 1.61 1.57 -1.99 -3.44 116.57 107.91 1miq h LYS 203 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1miq h LYS 203 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1miq h LYS 203 CO 0.00 0.00 0.86 -0.65 -0.57 0.00 0.00 179.45 179.09 1miq s GLN 204 N -3.34 4.27 -0.01 3.15 -1.52 -0.52 -5.02 119.66 116.67 1miq s GLN 204 Ca 0.06 2.07 0.02 0.00 -1.95 0.00 0.00 55.36 55.55 1miq s GLN 204 Cb 0.08 -3.53 -0.00 0.00 -0.22 0.00 0.00 33.01 29.33 1miq s GLN 204 CO 0.58 -0.60 -0.06 0.99 -0.25 0.00 0.00 175.29 175.96 1miq s THR 205 N 2.28 0.45 -0.09 -0.19 2.01 -1.26 -0.16 115.64 118.68 1miq s THR 205 Ca 0.66 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 62.41 1miq s THR 205 Cb -0.34 -0.38 0.03 0.00 0.01 0.00 0.00 72.50 71.81 1miq s THR 205 CO 0.28 0.13 -0.02 -0.32 -0.69 0.00 0.00 174.62 174.00 1miq s MET 206 N -0.10 0.89 0.10 4.92 1.75 -0.04 -4.99 119.30 121.83 1miq s MET 206 Ca 0.02 -0.05 -0.25 0.00 -1.25 0.00 0.00 55.69 54.16 1miq s MET 206 Cb -0.03 -1.26 -0.07 0.00 2.84 0.00 0.00 34.83 36.32 1miq s MET 206 CO -0.00 -0.32 0.76 -1.21 -0.65 0.00 0.00 175.02 173.59 1miq s GLU 207 N 1.88 4.51 -1.32 4.11 2.02 -1.26 -0.48 118.70 128.16 1miq s GLU 207 Ca 0.04 1.08 -0.01 0.00 0.02 0.00 0.00 54.97 56.11 1miq s GLU 207 Cb -0.13 -3.31 0.00 0.00 0.10 0.00 0.00 34.13 30.80 1miq s GLU 207 CO -0.06 0.44 0.71 1.63 0.02 0.00 0.00 175.26 177.99 1miq n LYS 208 N 2.18 -4.92 -1.70 1.61 5.02 -1.20 -4.94 118.16 114.20 1miq n LYS 208 Ca -0.04 0.62 -0.31 0.00 -2.02 0.00 0.00 58.31 56.55 1miq n LYS 208 Cb 0.50 -5.18 0.03 0.00 -0.02 0.00 0.00 35.03 30.36 1miq n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1miq s ALA 209 N -3.66 2.85 -0.19 7.82 0.00 0.82 -4.75 121.76 124.64 1miq s ALA 209 Ca 0.03 0.02 -0.21 0.00 0.00 0.00 0.00 51.96 51.80 1miq s ALA 209 Cb -0.02 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.94 1miq s ALA 209 CO 0.81 -1.00 0.65 -0.80 0.00 0.00 0.00 175.76 175.43 1miq s ASN 210 N -3.93 6.71 -0.19 0.00 0.01 -0.26 -2.10 114.94 115.18 1miq s ASN 210 Ca 0.57 0.86 0.01 0.00 -0.71 0.00 0.00 52.86 53.59 1miq s ASN 210 Cb -0.13 -2.36 0.04 0.00 0.41 0.00 0.00 41.25 39.22 1miq s ASN 210 CO 0.54 -0.28 -0.09 -0.69 -1.51 0.00 0.00 177.10 175.07 1miq s VAL 211 N 1.93 1.52 0.16 1.60 1.01 0.07 -0.14 120.40 126.53 1miq s VAL 211 Ca 0.30 -0.92 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 1miq s VAL 211 Cb -0.16 -1.62 -0.08 0.00 0.00 0.00 0.00 36.38 34.53 1miq s VAL 211 CO 0.11 0.15 0.69 -0.63 0.00 0.00 0.00 175.10 175.42 1miq s ILE 212 N 1.45 4.57 -0.23 2.22 1.01 0.19 -1.37 121.20 129.03 1miq s ILE 212 Ca -0.01 1.38 -0.04 0.00 0.00 0.00 0.00 60.65 61.97 1miq s ILE 212 Cb -0.16 -3.96 -0.01 0.00 0.01 0.00 0.00 42.46 38.35 1miq s ILE 212 CO -0.08 0.41 -0.02 -0.69 0.00 0.00 0.00 174.94 174.56 1miq s VAL 213 N -1.28 3.48 -0.27 2.92 1.01 -0.73 0.12 120.40 125.66 1miq s VAL 213 Ca 0.36 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1miq s VAL 213 Cb -0.19 -2.63 0.15 0.00 0.00 0.00 0.00 36.38 33.71 1miq s VAL 213 CO 0.22 0.36 0.45 -0.62 0.00 0.00 0.00 175.10 175.50 1miq s ASP 214 N 1.48 -0.23 0.56 3.32 3.68 -0.44 -4.86 116.67 120.18 1miq s ASP 214 Ca 0.05 0.31 0.36 0.00 2.13 0.00 0.00 52.55 55.41 1miq s ASP 214 Cb -0.15 1.42 1.74 0.00 -1.45 0.00 0.00 42.92 44.48 1miq s ASP 214 CO -0.02 -0.30 2.09 0.77 0.13 0.00 0.00 175.17 177.85 1miq h SER 215 N 8.13 0.00 0.66 -0.34 4.64 -1.88 0.00 113.55 124.76 1miq h SER 215 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1miq h SER 215 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1miq h SER 215 CO 0.26 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 1miq n GLY 216 N -0.47 -1.18 3.84 -0.77 0.00 -1.26 -4.28 105.19 101.06 1miq n GLY 216 Ca -0.01 0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1miq n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1miq s THR 217 N -3.20 5.23 0.04 2.61 2.01 -0.01 -0.22 115.64 122.11 1miq s THR 217 Ca 0.05 0.58 0.18 0.00 0.31 0.00 0.00 61.69 62.81 1miq s THR 217 Cb 0.09 -3.59 0.11 0.00 0.01 0.00 0.00 72.50 69.13 1miq s THR 217 CO 0.35 0.57 1.63 0.00 -0.69 0.00 0.00 174.62 176.48 1miq h THR 218 N 3.91 0.85 -2.01 -0.82 1.03 -0.74 0.32 112.91 115.44 1miq h THR 218 Ca -0.52 -1.77 0.00 0.00 -0.01 0.00 0.00 66.41 64.12 1miq h THR 218 Cb 1.22 2.11 0.00 0.00 -1.07 0.00 0.00 68.15 70.41 1miq h THR 218 CO 0.62 0.41 0.00 0.35 -0.01 0.00 0.00 175.52 176.88 1miq n THR 219 N -3.39 0.00 -2.86 0.00 -2.24 -1.26 -4.38 114.28 100.14 1miq n THR 219 Ca 0.01 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.38 1miq n THR 219 Cb 0.59 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 1miq n THR 219 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1miq s ILE 220 N -1.74 4.50 0.15 2.28 -1.09 -0.67 -2.27 121.20 122.36 1miq s ILE 220 Ca 0.00 1.86 0.09 0.00 -2.23 0.00 0.00 60.65 60.37 1miq s ILE 220 Cb 0.00 -4.22 -0.04 0.00 -1.58 0.00 0.00 42.46 36.62 1miq s ILE 220 CO 0.00 0.39 -0.12 0.42 -1.23 0.00 0.00 174.94 174.40 1miq s THR 221 N -0.37 3.12 0.03 2.92 -4.23 -0.07 -0.96 115.64 116.09 1miq s THR 221 Ca 0.41 -1.57 -0.07 0.00 -1.18 0.00 0.00 61.69 59.28 1miq s THR 221 Cb -0.23 -2.50 -0.00 0.00 1.34 0.00 0.00 72.50 71.10 1miq s THR 221 CO 0.27 -0.03 0.13 0.00 -0.54 0.00 0.00 174.62 174.46 1miq s ALA 222 N -1.50 -0.21 0.22 3.99 0.00 -0.79 -2.30 121.76 121.17 1miq s ALA 222 Ca 0.23 -0.38 -0.31 0.00 0.00 0.00 0.00 51.96 51.49 1miq s ALA 222 Cb -0.10 0.23 -0.15 0.00 0.00 0.00 0.00 23.12 23.11 1miq s ALA 222 CO 0.14 -0.31 1.22 -2.30 0.00 0.00 0.00 175.76 174.51 1miq n PRO 223 N 0.89 1.50 -0.31 0.00 -0.02 -1.22 -0.17 135.00 135.66 1miq n PRO 223 Ca -0.20 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 61.90 1miq n PRO 223 Cb 0.58 -2.06 0.29 0.00 -0.02 0.00 0.00 33.50 32.29 1miq n PRO 223 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1miq h SER 224 N 3.38 0.82 0.11 2.55 4.64 -1.89 -1.69 113.55 121.47 1miq h SER 224 Ca -0.43 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 60.92 1miq h SER 224 Cb 1.32 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1miq h SER 224 CO 0.70 0.45 -0.05 -0.33 -0.87 0.00 0.00 176.83 176.73 1miq h GLU 225 N 0.89 -0.15 -0.27 4.77 5.08 -1.98 0.28 114.58 123.20 1miq h GLU 225 Ca 0.45 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.88 1miq h GLU 225 Cb 0.51 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 1miq h GLU 225 CO -0.22 0.12 -0.03 0.35 -1.00 0.00 0.00 179.01 178.23 1miq h PHE 226 N -0.41 -0.08 -0.13 4.33 3.04 -1.85 -1.16 116.94 120.69 1miq h PHE 226 Ca -0.02 0.02 -0.09 0.00 3.98 0.00 0.00 57.97 61.87 1miq h PHE 226 Cb 0.33 0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.92 1miq h PHE 226 CO 0.01 -0.08 -0.25 1.25 -2.02 0.00 0.00 178.31 177.22 1miq h LEU 227 N 0.04 0.45 -0.82 0.59 5.85 -1.30 -0.82 115.31 119.31 1miq h LEU 227 Ca 0.13 -0.55 0.08 0.00 0.84 0.00 0.00 57.88 58.37 1miq h LEU 227 Cb 0.19 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 1miq h LEU 227 CO -0.25 0.92 0.49 0.78 -0.34 0.00 0.00 178.44 180.04 1miq h ASN 228 N 0.00 0.74 0.20 1.25 2.35 -0.30 0.72 115.58 120.54 1miq h ASN 228 Ca 0.01 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1miq h ASN 228 Cb 0.84 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.08 1miq h ASN 228 CO 0.06 0.45 -0.21 0.50 -1.65 0.00 0.00 177.43 176.58 1miq h LYS 229 N 0.86 -0.43 -0.52 0.81 3.64 -1.18 0.99 116.57 120.74 1miq h LYS 229 Ca 0.38 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.89 1miq h LYS 229 Cb 0.26 0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.08 1miq h LYS 229 CO -0.21 -0.29 -0.08 0.35 -2.27 0.00 0.00 179.45 176.95 1miq h PHE 230 N -0.45 -0.18 -0.59 1.91 3.57 0.79 -1.07 116.94 120.91 1miq h PHE 230 Ca 0.00 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1miq h PHE 230 Cb 0.43 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 1miq h PHE 230 CO -0.16 -0.19 0.17 0.74 -2.23 0.00 0.00 178.31 176.65 1miq h PHE 231 N 0.04 0.92 0.00 0.41 0.05 0.87 -2.63 116.94 116.60 1miq h PHE 231 Ca 0.26 -0.08 0.00 0.00 3.82 0.00 0.00 57.97 61.97 1miq h PHE 231 Cb 0.40 -0.27 0.00 0.00 2.00 0.00 0.00 35.95 38.08 1miq h PHE 231 CO -0.39 0.74 0.00 0.00 -0.18 0.00 0.00 178.31 178.48 1miq h ALA 232 N 1.32 1.00 0.07 2.45 0.00 0.53 -2.59 119.26 122.04 1miq h ALA 232 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.73 1miq h ALA 232 Cb 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1miq h ALA 232 CO -0.01 0.00 -2.19 0.09 0.00 0.00 0.00 179.25 177.15 1miq n ASN 233 N -2.40 1.94 0.00 0.00 3.02 -1.00 -4.23 115.26 112.59 1miq n ASN 233 Ca -0.00 0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.74 1miq n ASN 233 Cb 0.12 -0.59 0.63 0.00 -0.61 0.00 0.00 39.78 39.33 1miq n ASN 233 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1miq n LEU 234 N -3.35 0.00 -3.32 3.41 7.99 -1.01 -4.87 117.00 115.85 1miq n LEU 234 Ca -0.37 0.13 -0.18 0.00 -0.01 0.00 0.00 56.01 55.59 1miq n LEU 234 Cb 1.03 -0.13 0.08 0.00 -0.11 0.00 0.00 43.42 44.29 1miq n LEU 234 CO 0.37 -0.04 0.13 0.59 -1.51 0.00 0.00 177.39 176.93 1miq n ASN 235 N -1.13 -2.97 -4.90 -1.43 5.03 -1.01 -5.00 115.26 103.85 1miq n ASN 235 Ca 0.14 -0.57 -0.33 0.00 0.87 0.00 0.00 54.58 54.69 1miq n ASN 235 Cb 0.12 -4.85 -0.05 0.00 -1.02 0.00 0.00 39.78 33.99 1miq n ASN 235 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1miq s VAL 236 N -3.33 5.35 0.24 2.41 1.01 -1.04 -4.79 120.40 120.24 1miq s VAL 236 Ca 0.13 -0.04 0.10 0.00 0.00 0.00 0.00 61.98 62.17 1miq s VAL 236 Cb -0.06 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 1miq s VAL 236 CO 0.69 0.29 -0.18 0.27 0.00 0.00 0.00 175.10 176.17 1miq s ILE 237 N -1.37 2.16 -0.04 2.22 -4.36 -0.45 -4.76 121.20 114.59 1miq s ILE 237 Ca 0.30 -2.29 -0.15 0.00 -0.26 0.00 0.00 60.65 58.25 1miq s ILE 237 Cb -0.13 -2.17 -0.05 0.00 1.25 0.00 0.00 42.46 41.36 1miq s ILE 237 CO 0.19 -0.46 0.40 -0.75 0.24 0.00 0.00 174.94 174.56 1miq s LYS 238 N -3.48 4.01 -0.15 0.37 2.20 -0.67 -0.80 119.74 121.23 1miq s LYS 238 Ca 0.26 0.36 -0.29 0.00 -0.36 0.00 0.00 55.97 55.94 1miq s LYS 238 Cb -0.04 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.99 1miq s LYS 238 CO 0.11 0.55 1.17 0.08 -0.36 0.00 0.00 175.35 176.90 1miq s VAL 239 N -0.60 4.42 0.26 4.02 1.01 -0.80 -4.84 120.40 123.87 1miq s VAL 239 Ca 0.23 1.72 -0.30 0.00 0.00 0.00 0.00 61.98 63.62 1miq s VAL 239 Cb -0.16 -4.11 -0.13 0.00 0.00 0.00 0.00 36.38 31.99 1miq s VAL 239 CO 0.11 -0.10 1.42 -2.65 0.00 0.00 0.00 175.10 173.89 1miq n PRO 240 N 6.03 2.17 -0.88 2.72 -0.02 -1.26 -2.21 135.00 141.55 1miq n PRO 240 Ca 0.12 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 1miq n PRO 240 Cb 0.46 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 1miq n PRO 240 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1miq n PHE 241 N 1.70 0.00 -4.21 6.00 0.99 -1.26 -4.97 117.46 115.71 1miq n PHE 241 Ca 0.10 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.37 1miq n PHE 241 Cb 0.33 -0.80 -0.12 0.00 -1.00 0.00 0.00 39.48 37.88 1miq n PHE 241 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1miq s LEU 242 N 0.00 2.21 -0.05 4.37 1.43 -0.94 -5.03 118.68 120.67 1miq s LEU 242 Ca 0.00 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 52.55 1miq s LEU 242 Cb 0.00 -0.45 -0.20 0.00 0.03 0.00 0.00 46.19 45.57 1miq s LEU 242 CO 0.00 -0.06 3.33 -0.81 0.23 0.00 0.00 176.35 179.05 1miq n PRO 243 N 1.67 1.92 -4.20 1.29 -0.04 -1.26 -4.45 135.00 129.93 1miq n PRO 243 Ca -0.20 -1.03 -0.19 0.00 -0.04 0.00 0.00 63.50 62.04 1miq n PRO 243 Cb 0.55 -1.90 -0.12 0.00 -0.04 0.00 0.00 33.50 31.99 1miq n PRO 243 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1miq s PHE 244 N 0.56 1.35 -0.07 0.54 2.99 -1.26 -5.04 117.98 117.05 1miq s PHE 244 Ca 0.58 -0.47 0.03 0.00 0.00 0.00 0.00 56.93 57.07 1miq s PHE 244 Cb 0.29 -0.74 0.01 0.00 0.00 0.00 0.00 43.02 42.57 1miq s PHE 244 CO -0.02 0.10 -0.16 0.71 -0.00 0.00 0.00 175.22 175.85 1miq s TYR 245 N -1.43 1.74 0.07 0.36 1.51 -1.26 -1.91 117.35 116.42 1miq s TYR 245 Ca 0.02 -0.64 0.02 0.00 -1.01 0.00 0.00 57.07 55.45 1miq s TYR 245 Cb -0.09 -1.22 -0.03 0.00 -0.11 0.00 0.00 41.96 40.51 1miq s TYR 245 CO 0.03 -0.29 -0.07 0.14 -1.11 0.00 0.00 175.55 174.24 1miq s VAL 246 N 0.50 0.60 0.12 0.71 -7.23 0.02 0.70 120.40 115.82 1miq s VAL 246 Ca -0.14 -1.46 -0.05 0.00 -1.81 0.00 0.00 61.98 58.52 1miq s VAL 246 Cb -0.16 -1.08 0.02 0.00 0.56 0.00 0.00 36.38 35.72 1miq s VAL 246 CO 0.05 -0.60 0.28 1.07 -0.31 0.00 0.00 175.10 175.59 1miq n THR 247 N 0.80 0.00 -2.30 5.32 5.66 -0.12 -1.34 114.28 122.29 1miq n THR 247 Ca -0.18 -0.31 -0.42 0.00 -3.05 0.00 0.00 64.05 60.09 1miq n THR 247 Cb 0.57 0.32 -0.03 0.00 -1.55 0.00 0.00 70.33 69.65 1miq n THR 247 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1miq s THR 248 N -2.65 3.50 0.29 1.09 -4.23 -1.26 0.16 115.64 112.53 1miq s THR 248 Ca 0.06 1.18 0.03 0.00 -1.18 0.00 0.00 61.69 61.78 1miq s THR 248 Cb -0.02 -3.76 0.28 0.00 1.34 0.00 0.00 72.50 70.34 1miq s THR 248 CO 0.04 0.15 1.77 0.00 -0.54 0.00 0.00 174.62 176.04 1miq n ASP 250 N -4.80 7.33 -4.63 0.00 5.68 -1.26 -4.95 116.55 113.92 1miq n ASP 250 Ca 0.21 -3.63 -0.43 0.00 -0.50 0.00 0.00 54.79 50.44 1miq n ASP 250 Cb 0.50 -1.15 -0.02 0.00 -1.14 0.00 0.00 41.12 39.31 1miq n ASP 250 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1miq s ASN 251 N -0.74 6.66 0.38 -1.12 3.84 -0.31 -4.91 114.94 118.73 1miq s ASN 251 Ca 0.51 1.37 0.08 0.00 0.21 0.00 0.00 52.86 55.02 1miq s ASN 251 Cb 0.36 -2.54 0.81 0.00 -0.55 0.00 0.00 41.25 39.33 1miq s ASN 251 CO -0.29 -1.07 1.96 0.07 -2.79 0.00 0.00 177.10 174.98 1miq h LYS 252 N 9.41 0.65 -0.00 0.43 5.09 -1.92 -2.95 116.57 127.28 1miq h LYS 252 Ca -0.28 -0.04 0.00 0.00 0.09 0.00 0.00 60.65 60.42 1miq h LYS 252 Cb 1.11 -0.15 0.00 0.00 0.10 0.00 0.00 32.23 33.29 1miq h LYS 252 CO 1.02 0.43 -0.02 0.39 -2.09 0.00 0.00 179.45 179.18 1miq n GLU 253 N -4.48 0.13 -1.96 0.07 -0.58 -1.26 -4.87 120.64 107.68 1miq n GLU 253 Ca 0.11 -0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.42 1miq n GLU 253 Cb 0.27 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.62 1miq n GLU 253 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1miq s MET 254 N -2.88 3.65 0.82 3.49 -1.94 -1.12 -4.97 119.30 116.36 1miq s MET 254 Ca 0.18 1.80 -0.08 0.00 -1.71 0.00 0.00 55.69 55.88 1miq s MET 254 Cb 0.19 -4.13 0.14 0.00 2.01 0.00 0.00 34.83 33.05 1miq s MET 254 CO 0.52 -1.48 1.13 -1.25 -0.01 0.00 0.00 175.02 173.93 1miq s PRO 255 N 5.08 1.36 -0.25 2.03 0.05 -1.26 -4.73 135.00 137.27 1miq s PRO 255 Ca 0.80 -0.66 -0.13 0.00 0.05 0.00 0.00 61.00 61.06 1miq s PRO 255 Cb -0.28 -2.10 -0.04 0.00 0.05 0.00 0.00 34.50 32.13 1miq s PRO 255 CO 0.32 -1.80 0.28 0.99 0.05 0.00 0.00 177.00 176.84 1miq s THR 256 N -3.47 5.26 0.46 1.26 2.01 -1.26 -3.94 115.64 115.95 1miq s THR 256 Ca 0.68 0.40 -0.22 0.00 0.31 0.00 0.00 61.69 62.86 1miq s THR 256 Cb -0.06 -3.61 -0.08 0.00 0.01 0.00 0.00 72.50 68.76 1miq s THR 256 CO 0.48 0.24 1.07 -0.76 -0.69 0.00 0.00 174.62 174.96 1miq s LEU 257 N 1.64 3.96 -0.02 4.42 1.43 -0.14 -4.50 118.68 125.47 1miq s LEU 257 Ca 0.12 2.05 0.03 0.00 -1.03 0.00 0.00 54.13 55.29 1miq s LEU 257 Cb -0.15 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 41.68 1miq s LEU 257 CO 0.09 -0.75 -0.09 -1.61 0.23 0.00 0.00 176.35 174.21 1miq s GLU 258 N -2.91 0.95 -0.18 1.70 2.02 -0.21 -0.78 118.70 119.28 1miq s GLU 258 Ca 0.64 -0.32 -0.01 0.00 0.02 0.00 0.00 54.97 55.30 1miq s GLU 258 Cb -0.21 -0.89 0.05 0.00 0.10 0.00 0.00 34.13 33.18 1miq s GLU 258 CO 0.25 0.13 -0.01 -0.06 0.02 0.00 0.00 175.26 175.60 1miq s PHE 259 N 0.11 1.39 0.01 1.61 0.08 -0.05 -0.09 117.98 121.05 1miq s PHE 259 Ca -0.02 -1.00 0.07 0.00 0.12 0.00 0.00 56.93 56.11 1miq s PHE 259 Cb -0.08 -1.17 -0.03 0.00 -0.57 0.00 0.00 43.02 41.17 1miq s PHE 259 CO 0.00 -0.61 -0.21 0.15 -0.10 0.00 0.00 175.22 174.45 1miq s LYS 260 N 1.73 2.09 0.20 0.44 1.02 -0.37 -0.59 119.74 124.27 1miq s LYS 260 Ca -0.01 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.03 1miq s LYS 260 Cb -0.16 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 1miq s LYS 260 CO -0.07 0.55 0.01 -1.13 -0.92 0.00 0.00 175.35 173.79 1miq n SER 261 N 1.90 2.46 0.01 2.83 3.41 0.71 -0.85 113.62 124.09 1miq n SER 261 Ca -0.16 -1.84 -0.10 0.00 -0.26 0.00 0.00 58.87 56.51 1miq n SER 261 Cb 0.52 0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 1miq n SER 261 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1miq h ALA 262 N 1.06 -0.06 0.00 7.33 0.00 -2.00 -3.27 119.26 122.33 1miq h ALA 262 Ca -0.16 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1miq h ALA 262 Cb 0.49 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1miq h ALA 262 CO 0.26 -0.59 -1.10 0.09 0.00 0.00 0.00 179.25 177.91 1miq n ASN 263 N -5.27 0.85 -4.13 0.00 3.02 -1.26 -5.03 115.26 103.43 1miq n ASN 263 Ca -0.03 -0.84 -0.09 0.00 -0.03 0.00 0.00 54.58 53.59 1miq n ASN 263 Cb 0.19 1.14 -0.10 0.00 -0.61 0.00 0.00 39.78 40.40 1miq n ASN 263 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1miq s ASN 264 N -3.13 0.74 -0.03 6.41 0.01 -1.23 -5.14 114.94 112.55 1miq s ASN 264 Ca 0.05 -1.03 0.02 0.00 -0.71 0.00 0.00 52.86 51.20 1miq s ASN 264 Cb 0.15 0.17 0.01 0.00 0.41 0.00 0.00 41.25 41.99 1miq s ASN 264 CO 0.84 -0.56 -0.09 -0.89 -1.51 0.00 0.00 177.10 174.89 1miq s THR 265 N -3.82 0.79 -0.04 1.60 2.01 -1.26 -0.21 115.64 114.71 1miq s THR 265 Ca 0.11 -0.34 0.07 0.00 0.31 0.00 0.00 61.69 61.84 1miq s THR 265 Cb 0.07 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.85 1miq s THR 265 CO -0.06 0.25 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.57 1miq s TYR 266 N 0.34 2.31 0.22 4.92 2.02 0.25 -4.97 117.35 122.42 1miq s TYR 266 Ca -0.06 -0.60 0.11 0.00 -0.37 0.00 0.00 57.07 56.16 1miq s TYR 266 Cb -0.10 -1.50 -0.05 0.00 -0.40 0.00 0.00 41.96 39.91 1miq s TYR 266 CO 0.01 -0.15 -0.20 0.95 -1.57 0.00 0.00 175.55 174.59 1miq s THR 267 N -0.30 2.22 -0.31 -0.71 -4.23 -1.26 -0.87 115.64 110.18 1miq s THR 267 Ca 0.01 -2.15 -0.01 0.00 -1.18 0.00 0.00 61.69 58.36 1miq s THR 267 Cb -0.12 -2.12 0.10 0.00 1.34 0.00 0.00 72.50 71.70 1miq s THR 267 CO 0.02 -0.30 0.10 -0.22 -0.54 0.00 0.00 174.62 173.68 1miq s LEU 268 N -3.02 2.06 0.57 4.79 2.96 0.04 -4.94 118.68 121.14 1miq s LEU 268 Ca 0.23 -1.62 -0.18 0.00 -0.22 0.00 0.00 54.13 52.34 1miq s LEU 268 Cb -0.06 -0.81 -0.04 0.00 0.50 0.00 0.00 46.19 45.78 1miq s LEU 268 CO 0.11 -0.42 1.12 -1.61 -1.32 0.00 0.00 176.35 174.23 1miq s GLU 269 N 1.65 3.23 0.33 1.98 8.01 -1.26 -0.96 118.70 131.68 1miq s GLU 269 Ca 0.10 1.52 0.13 0.00 0.01 0.00 0.00 54.97 56.73 1miq s GLU 269 Cb -0.17 -2.00 1.06 0.00 -4.31 0.00 0.00 34.13 28.71 1miq s GLU 269 CO -0.26 -0.93 1.49 -2.30 0.01 0.00 0.00 175.26 173.28 1miq n PRO 270 N -1.61 -0.06 0.07 0.39 -0.02 -1.25 0.13 135.00 132.65 1miq n PRO 270 Ca 0.11 1.35 0.07 0.00 -2.02 0.00 0.00 63.50 63.01 1miq n PRO 270 Cb 0.51 -2.32 0.32 0.00 -0.02 0.00 0.00 33.50 31.99 1miq n PRO 270 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1miq n GLU 271 N -5.25 0.07 0.02 -0.52 0.00 -1.26 -1.75 120.64 111.95 1miq n GLU 271 Ca 0.31 0.47 0.11 0.00 0.00 0.00 0.00 57.16 58.05 1miq n GLU 271 Cb 1.03 -1.69 -0.08 0.00 0.00 0.00 0.00 31.44 30.69 1miq n GLU 271 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1miq n TYR 272 N -1.84 0.21 -1.26 -1.84 4.02 0.12 -4.33 117.16 112.23 1miq n TYR 272 Ca 0.01 0.06 0.08 0.00 -0.01 0.00 0.00 57.90 58.04 1miq n TYR 272 Cb 0.09 -0.47 0.17 0.00 -0.02 0.00 0.00 39.34 39.11 1miq n TYR 272 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 176.86 178.33 1miq n TYR 273 N -2.11 0.05 -3.80 -0.72 0.18 -0.72 -4.80 117.16 105.23 1miq n TYR 273 Ca -0.01 -1.19 -0.19 0.00 1.88 0.00 0.00 57.90 58.40 1miq n TYR 273 Cb 0.49 -0.20 -0.17 0.00 -0.38 0.00 0.00 39.34 39.08 1miq n TYR 273 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 1miq s MET 274 N -3.01 0.24 -0.03 -3.48 -1.94 -1.06 -0.50 119.30 109.52 1miq s MET 274 Ca 0.35 0.18 0.04 0.00 -1.71 0.00 0.00 55.69 54.55 1miq s MET 274 Cb 0.32 -0.59 -0.00 0.00 2.01 0.00 0.00 34.83 36.56 1miq s MET 274 CO -0.00 -0.24 -0.15 -0.80 -0.01 0.00 0.00 175.02 173.82 1miq s ASN 275 N 1.59 1.82 0.30 3.03 0.02 -0.59 -4.87 114.94 116.23 1miq s ASN 275 Ca -0.02 -0.29 -0.30 0.00 -1.02 0.00 0.00 52.86 51.23 1miq s ASN 275 Cb -0.13 -0.39 -0.12 0.00 0.02 0.00 0.00 41.25 40.63 1miq s ASN 275 CO -0.03 0.15 1.53 -2.65 0.02 0.00 0.00 177.10 176.12 1miq n PRO 276 N 3.01 2.55 -0.01 -0.60 -0.02 -1.26 0.49 135.00 139.16 1miq n PRO 276 Ca -0.17 0.90 0.23 0.00 -2.02 0.00 0.00 63.50 62.45 1miq n PRO 276 Cb 0.54 -2.65 0.67 0.00 -0.02 0.00 0.00 33.50 32.04 1miq n PRO 276 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 1miq h ILE 277 N 3.21 0.26 0.00 4.25 3.07 -1.80 -3.39 117.51 123.12 1miq h ILE 277 Ca -0.47 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.94 1miq h ILE 277 Cb 1.24 0.46 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 1miq h ILE 277 CO 0.76 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.86 1miq n LEU 278 N -3.59 0.00 -4.58 0.16 -0.00 -1.26 -5.01 117.00 102.72 1miq n LEU 278 Ca 0.13 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.73 1miq n LEU 278 Cb 0.90 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 44.29 1miq n LEU 278 CO 0.27 0.00 1.77 -1.83 -0.00 0.00 0.00 177.39 177.60 1miq s GLU 279 N -0.56 2.85 0.23 1.47 -1.05 -1.26 -4.81 118.70 115.58 1miq s GLU 279 Ca 0.00 1.51 0.04 0.00 -0.15 0.00 0.00 54.97 56.38 1miq s GLU 279 Cb 0.00 -4.38 0.24 0.00 -0.44 0.00 0.00 34.13 29.55 1miq s GLU 279 CO 0.00 -2.43 0.90 1.55 0.95 0.00 0.00 175.26 176.24 1miq n VAL 280 N 7.65 0.37 -2.88 1.83 3.14 -1.26 -4.00 118.33 123.19 1miq n VAL 280 Ca 0.28 0.67 -0.42 0.00 -2.96 0.00 0.00 64.34 61.91 1miq n VAL 280 Cb 0.49 -1.67 -0.04 0.00 -1.06 0.00 0.00 33.84 31.55 1miq n VAL 280 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1miq s ASP 281 N -2.75 6.64 -0.92 6.55 1.47 -1.26 -4.94 116.67 121.46 1miq s ASP 281 Ca -0.00 0.53 -0.24 0.00 1.18 0.00 0.00 52.55 54.01 1miq s ASP 281 Cb 0.01 -2.43 0.04 0.00 -0.34 0.00 0.00 42.92 40.20 1miq s ASP 281 CO 0.04 -0.77 1.39 -1.81 0.68 0.00 0.00 175.17 174.70 1miq s ASP 282 N 1.81 6.37 0.00 2.11 1.11 -1.26 -4.74 116.67 122.08 1miq s ASP 282 Ca 0.35 -1.09 0.00 0.00 0.18 0.00 0.00 52.55 51.99 1miq s ASP 282 Cb -0.13 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.30 1miq s ASP 282 CO 0.17 -1.63 0.00 0.41 1.18 0.00 0.00 175.17 175.29 1miq n THR 283 N 6.71 0.00 -3.49 -1.27 -1.04 -1.26 -4.64 114.28 109.29 1miq n THR 283 Ca 0.22 0.18 -0.31 0.00 -2.04 0.00 0.00 64.05 62.11 1miq n THR 283 Cb 0.50 -1.11 -0.05 0.00 -1.82 0.00 0.00 70.33 67.86 1miq n THR 283 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1miq s LEU 284 N -4.01 4.18 0.06 -4.42 1.43 -1.26 0.10 118.68 114.76 1miq s LEU 284 Ca 0.00 0.77 0.05 0.00 -1.03 0.00 0.00 54.13 53.92 1miq s LEU 284 Cb 0.00 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 1miq s LEU 284 CO 0.00 -0.05 -0.14 0.00 0.23 0.00 0.00 176.35 176.38 1miq s MET 286 N -1.60 3.85 -0.21 0.00 0.23 0.18 -0.95 119.30 120.80 1miq s MET 286 Ca -0.01 0.30 -0.14 0.00 -1.03 0.00 0.00 55.69 54.82 1miq s MET 286 Cb -0.09 -2.88 -0.04 0.00 -1.53 0.00 0.00 34.83 30.28 1miq s MET 286 CO 0.02 0.47 0.30 0.42 -2.03 0.00 0.00 175.02 174.19 1miq s ILE 287 N -1.54 5.27 -1.57 3.16 1.09 0.22 -1.55 121.20 126.28 1miq s ILE 287 Ca 0.39 0.49 -0.11 0.00 -1.10 0.00 0.00 60.65 60.32 1miq s ILE 287 Cb -0.14 -3.63 -0.05 0.00 -1.06 0.00 0.00 42.46 37.58 1miq s ILE 287 CO 0.20 0.31 2.74 0.35 -0.10 0.00 0.00 174.94 178.43 1miq n THR 288 N 4.18 4.05 -3.82 2.92 -2.24 0.34 -4.49 114.28 115.21 1miq n THR 288 Ca -0.11 -2.71 -0.12 0.00 -2.27 0.00 0.00 64.05 58.83 1miq n THR 288 Cb 0.52 -2.61 -0.13 0.00 -2.10 0.00 0.00 70.33 66.00 1miq n THR 288 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1miq s MET 289 N 2.50 0.13 -0.00 -0.78 -1.94 -1.26 -1.67 119.30 116.27 1miq s MET 289 Ca 0.63 0.18 0.01 0.00 -1.71 0.00 0.00 55.69 54.79 1miq s MET 289 Cb 0.17 0.04 -0.00 0.00 2.01 0.00 0.00 34.83 37.04 1miq s MET 289 CO -0.07 -0.03 -0.02 -0.51 -0.01 0.00 0.00 175.02 174.38 1miq s LEU 290 N 0.18 1.98 -0.11 -0.03 1.43 -0.13 -4.84 118.68 117.16 1miq s LEU 290 Ca -0.01 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.76 1miq s LEU 290 Cb -0.02 -0.10 -0.02 0.00 0.03 0.00 0.00 46.19 46.08 1miq s LEU 290 CO -0.00 0.02 1.13 -2.16 0.23 0.00 0.00 176.35 175.56 1miq s PRO 291 N -0.02 4.34 -0.05 1.29 0.04 -1.26 -1.88 135.00 137.46 1miq s PRO 291 Ca 0.00 1.54 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 1miq s PRO 291 Cb -0.01 -3.60 0.04 0.00 0.04 0.00 0.00 34.50 30.97 1miq s PRO 291 CO -0.00 -0.47 0.09 0.08 0.04 0.00 0.00 177.00 176.74 1miq s VAL 292 N 2.50 -0.13 -0.42 -0.36 1.01 0.76 -4.85 120.40 118.91 1miq s VAL 292 Ca 0.52 0.32 -0.15 0.00 0.00 0.00 0.00 61.98 62.66 1miq s VAL 292 Cb -0.21 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.01 1miq s VAL 292 CO 0.17 0.13 0.34 -1.81 0.00 0.00 0.00 175.10 173.93 1miq s ASP 293 N 1.77 6.13 -0.19 3.32 1.01 -1.26 -3.46 116.67 123.99 1miq s ASP 293 Ca -0.01 -0.95 0.08 0.00 0.71 0.00 0.00 52.55 52.37 1miq s ASP 293 Cb -0.12 -2.17 -0.17 0.00 1.01 0.00 0.00 42.92 41.47 1miq s ASP 293 CO -0.04 -0.51 -0.07 -0.38 0.21 0.00 0.00 175.17 174.38 1miq n ILE 294 N 5.21 1.16 -1.75 0.77 5.41 -1.26 -5.08 119.36 123.82 1miq n ILE 294 Ca -0.11 -0.57 0.00 0.00 1.00 0.00 0.00 62.75 63.07 1miq n ILE 294 Cb 0.46 -0.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.48 1miq n ILE 294 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1miq n ASP 295 N -2.87 0.00 0.06 4.38 5.68 -1.26 -5.01 116.55 117.53 1miq n ASP 295 Ca -0.32 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.09 1miq n ASP 295 Cb 0.96 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 41.15 1miq n ASP 295 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1miq n SER 296 N 0.00 0.68 -0.11 -1.12 2.88 -1.26 -4.33 113.62 110.36 1miq n SER 296 Ca 0.00 0.15 0.03 0.00 -1.33 0.00 0.00 58.87 57.71 1miq n SER 296 Cb 0.00 0.05 -0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1miq n SER 296 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1miq n ASN 297 N -2.06 0.82 -4.60 -3.46 5.15 -1.26 -4.91 115.26 104.94 1miq n ASN 297 Ca 0.04 -0.91 -0.34 0.00 -0.60 0.00 0.00 54.58 52.76 1miq n ASN 297 Cb 0.43 0.52 -0.10 0.00 -0.53 0.00 0.00 39.78 40.10 1miq n ASN 297 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1miq s THR 298 N -1.00 4.59 0.23 -0.44 2.01 -1.26 -1.10 115.64 118.68 1miq s THR 298 Ca 0.04 -0.10 0.11 0.00 0.31 0.00 0.00 61.69 62.05 1miq s THR 298 Cb 0.04 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.44 1miq s THR 298 CO 0.14 0.46 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.98 1miq s PHE 299 N 0.45 2.38 -0.10 4.92 0.08 0.80 -3.88 117.98 122.63 1miq s PHE 299 Ca 0.02 -0.32 0.04 0.00 0.12 0.00 0.00 56.93 56.79 1miq s PHE 299 Cb -0.13 -1.11 -0.00 0.00 -0.57 0.00 0.00 43.02 41.21 1miq s PHE 299 CO 0.01 0.59 -0.24 0.42 -0.10 0.00 0.00 175.22 175.90 1miq s ILE 300 N -2.01 2.08 -0.55 0.64 1.01 -0.97 -0.64 121.20 120.75 1miq s ILE 300 Ca 0.25 -1.02 -0.20 0.00 0.00 0.00 0.00 60.65 59.69 1miq s ILE 300 Cb -0.07 -1.79 0.08 0.00 0.01 0.00 0.00 42.46 40.69 1miq s ILE 300 CO 0.13 0.56 0.70 -0.76 0.00 0.00 0.00 174.94 175.57 1miq s LEU 301 N 0.29 5.05 0.00 2.97 1.43 0.12 -0.89 118.68 127.65 1miq s LEU 301 Ca -0.17 -1.10 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 1miq s LEU 301 Cb -0.18 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.64 1miq s LEU 301 CO 0.08 -1.04 0.00 0.61 0.23 0.00 0.00 176.35 176.23 1miq n GLY 302 N 5.23 1.44 0.36 -3.19 0.00 -0.96 -1.33 105.19 106.74 1miq n GLY 302 Ca -0.07 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.03 1miq n GLY 302 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1miq n ASP 303 N 0.00 -0.57 -0.30 1.61 -0.08 0.10 -2.30 116.55 115.01 1miq n ASP 303 Ca 0.00 1.67 -0.02 0.00 -1.51 0.00 0.00 54.79 54.93 1miq n ASP 303 Cb 0.00 -0.41 0.10 0.00 2.34 0.00 0.00 41.12 43.16 1miq n ASP 303 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1miq h PRO 304 N 0.00 1.00 -0.60 -0.67 0.11 -1.86 0.11 132.00 130.09 1miq h PRO 304 Ca 0.36 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 1miq h PRO 304 Cb 0.60 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.45 1miq h PRO 304 CO -0.96 0.66 0.17 0.35 -0.21 0.00 0.00 178.00 178.02 1miq h PHE 305 N 1.03 0.94 0.00 0.65 3.04 -1.77 -2.44 116.94 118.39 1miq h PHE 305 Ca 0.33 -0.08 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1miq h PHE 305 Cb 0.01 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.24 1miq h PHE 305 CO -0.03 0.76 0.00 -1.33 -2.02 0.00 0.00 178.31 175.70 1miq n MET 306 N -4.28 0.10 0.07 1.11 2.81 -0.11 -0.89 117.12 115.93 1miq n MET 306 Ca 0.05 0.11 -0.04 0.00 -1.81 0.00 0.00 57.70 56.01 1miq n MET 306 Cb 0.22 -1.62 0.18 0.00 -0.71 0.00 0.00 33.22 31.28 1miq n MET 306 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1miq h ARG 307 N 0.00 0.32 0.08 0.03 2.47 -0.36 -3.31 114.38 113.61 1miq h ARG 307 Ca 0.00 -0.16 -0.29 0.00 -1.26 0.00 0.00 59.98 58.27 1miq h ARG 307 Cb 0.55 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.86 1miq h ARG 307 CO 0.00 0.71 -1.54 -0.22 0.56 0.00 0.00 179.97 179.47 1miq h LYS 308 N 0.26 0.17 -4.94 0.04 3.64 -1.52 -3.40 116.57 110.82 1miq h LYS 308 Ca 0.02 -0.28 -0.64 0.00 -1.27 0.00 0.00 60.65 58.48 1miq h LYS 308 Cb 0.89 0.11 -0.18 0.00 -0.41 0.00 0.00 32.23 32.64 1miq h LYS 308 CO 0.07 1.14 -0.55 0.71 -2.27 0.00 0.00 179.45 178.55 1miq s TYR 309 N -2.46 3.19 0.34 1.91 1.51 -0.06 -1.05 117.35 120.72 1miq s TYR 309 Ca -0.24 -0.02 -0.28 0.00 -1.01 0.00 0.00 57.07 55.53 1miq s TYR 309 Cb 0.06 -2.33 -0.10 0.00 -0.11 0.00 0.00 41.96 39.48 1miq s TYR 309 CO 0.71 -0.19 1.24 0.12 -1.11 0.00 0.00 175.55 176.32 1miq s PHE 310 N 1.63 3.12 0.05 2.71 2.19 0.21 -4.34 117.98 123.54 1miq s PHE 310 Ca 0.07 1.49 0.05 0.00 0.33 0.00 0.00 56.93 58.87 1miq s PHE 310 Cb -0.15 -3.56 -0.02 0.00 -1.31 0.00 0.00 43.02 37.98 1miq s PHE 310 CO 0.08 -1.55 -0.13 0.95 1.83 0.00 0.00 175.22 176.40 1miq s THR 311 N -1.21 1.04 -0.05 0.12 -4.23 -1.09 -1.03 115.64 109.19 1miq s THR 311 Ca 0.50 -1.05 0.06 0.00 -1.18 0.00 0.00 61.69 60.03 1miq s THR 311 Cb -0.37 -0.96 -0.01 0.00 1.34 0.00 0.00 72.50 72.50 1miq s THR 311 CO 0.48 -0.08 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.57 1miq s VAL 312 N -0.97 1.83 -0.29 2.29 1.01 0.34 -1.65 120.40 122.97 1miq s VAL 312 Ca -0.00 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1miq s VAL 312 Cb -0.08 -1.55 0.08 0.00 0.00 0.00 0.00 36.38 34.83 1miq s VAL 312 CO 0.01 0.51 -0.02 -0.36 0.00 0.00 0.00 175.10 175.25 1miq s PHE 313 N -0.18 3.13 -0.32 5.22 0.40 -0.04 0.18 117.98 126.37 1miq s PHE 313 Ca -0.01 -2.42 -0.03 0.00 -0.60 0.00 0.00 56.93 53.87 1miq s PHE 313 Cb -0.12 -2.23 0.05 0.00 0.51 0.00 0.00 43.02 41.23 1miq s PHE 313 CO 0.02 -0.89 0.04 0.34 0.70 0.00 0.00 175.22 175.44 1miq s ASP 314 N 1.13 5.03 0.11 1.36 -1.08 -0.62 -1.25 116.67 121.36 1miq s ASP 314 Ca 0.01 -1.26 -0.14 0.00 -0.52 0.00 0.00 52.55 50.64 1miq s ASP 314 Cb -0.19 -1.76 -0.07 0.00 -1.46 0.00 0.00 42.92 39.44 1miq s ASP 314 CO -0.08 -0.29 1.45 1.88 0.52 0.00 0.00 175.17 178.64 1miq h TYR 315 N 8.06 0.92 -0.29 -5.34 -1.99 -1.22 0.22 116.97 117.33 1miq h TYR 315 Ca -0.21 -0.27 0.02 0.00 2.00 0.00 0.00 58.73 60.27 1miq h TYR 315 Cb 1.07 -0.20 -0.02 0.00 2.00 0.00 0.00 36.73 39.58 1miq h TYR 315 CO 0.61 1.03 0.15 -0.44 -0.00 0.00 0.00 178.16 179.51 1miq h ASP 316 N 0.54 0.22 0.75 3.88 3.32 -1.94 -2.62 116.42 120.58 1miq h ASP 316 Ca 0.06 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1miq h ASP 316 Cb 0.86 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1miq h ASP 316 CO 0.07 0.17 -0.25 0.29 -1.72 0.00 0.00 179.24 177.80 1miq n LYS 317 N -4.96 0.00 -3.58 3.56 5.02 -1.18 -4.94 118.16 112.08 1miq n LYS 317 Ca -0.01 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.07 1miq n LYS 317 Cb 0.07 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.62 1miq n LYS 317 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1miq n GLU 318 N -1.51 -4.35 -3.71 1.97 1.02 0.73 -4.89 120.64 109.90 1miq n GLU 318 Ca 0.06 0.68 -0.09 0.00 -0.02 0.00 0.00 57.16 57.78 1miq n GLU 318 Cb 0.34 -5.26 -0.03 0.00 -0.02 0.00 0.00 31.44 26.47 1miq n GLU 318 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1miq s SER 319 N -4.11 -0.33 -0.13 1.62 0.01 -0.91 -2.12 113.70 107.74 1miq s SER 319 Ca 0.13 -0.42 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 1miq s SER 319 Cb -0.03 0.63 -0.02 0.00 0.21 0.00 0.00 66.02 66.80 1miq s SER 319 CO 0.79 -1.12 -0.09 -0.69 0.41 0.00 0.00 173.24 172.55 1miq s VAL 320 N -3.86 3.43 0.00 3.43 1.01 -0.25 -1.59 120.40 122.58 1miq s VAL 320 Ca 0.08 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1miq s VAL 320 Cb -0.02 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1miq s VAL 320 CO -0.02 0.53 0.14 -0.83 0.00 0.00 0.00 175.10 174.91 1miq s GLY 321 N 0.15 2.10 -0.02 4.51 0.00 0.13 -0.82 107.32 113.37 1miq s GLY 321 Ca -0.05 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 43.88 1miq s GLY 321 CO 0.04 -0.72 -0.13 -1.36 0.00 0.00 0.00 173.10 170.93 1miq s PHE 322 N -1.29 1.24 0.03 1.90 0.40 0.09 -0.50 117.98 119.84 1miq s PHE 322 Ca 0.26 -0.29 -0.14 0.00 -0.60 0.00 0.00 56.93 56.16 1miq s PHE 322 Cb -0.12 -0.83 0.02 0.00 0.51 0.00 0.00 43.02 42.60 1miq s PHE 322 CO 0.18 -0.08 0.31 0.00 0.70 0.00 0.00 175.22 176.33 1miq s ALA 323 N -0.07 -0.73 -0.00 5.36 0.00 -0.20 -1.12 121.76 125.00 1miq s ALA 323 Ca 0.01 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 1miq s ALA 323 Cb -0.08 0.25 -0.07 0.00 0.00 0.00 0.00 23.12 23.22 1miq s ALA 323 CO 0.00 -0.37 1.81 0.42 0.00 0.00 0.00 175.76 177.62 1miq s ILE 324 N -2.21 3.26 0.19 0.00 -1.09 -1.25 0.64 121.20 120.74 1miq s ILE 324 Ca -0.07 0.36 -0.30 0.00 -2.23 0.00 0.00 60.65 58.40 1miq s ILE 324 Cb -0.02 -3.23 -0.08 0.00 -1.58 0.00 0.00 42.46 37.55 1miq s ILE 324 CO -0.01 -0.03 1.24 0.00 -1.23 0.00 0.00 174.94 174.91 1miq s ALA 325 N 4.13 3.47 -0.20 9.38 0.00 -0.22 -0.83 121.76 137.49 1miq s ALA 325 Ca 0.81 1.01 -0.29 0.00 0.00 0.00 0.00 51.96 53.49 1miq s ALA 325 Cb -0.38 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.27 1miq s ALA 325 CO 0.35 -0.44 1.43 0.21 0.00 0.00 0.00 175.76 177.31 1miq s LYS 326 N -0.17 4.03 0.00 0.00 2.20 0.81 -4.75 119.74 121.86 1miq s LYS 326 Ca 0.54 1.64 0.00 0.00 -0.36 0.00 0.00 55.97 57.79 1miq s LYS 326 Cb -0.34 -3.90 0.00 0.00 -1.51 0.00 0.00 37.83 32.08 1miq s LYS 326 CO 0.37 -0.99 0.00 0.09 -0.36 0.00 0.00 175.35 174.46