#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hie h ALA 79 N 0.00 0.92 -0.03 1.96 0.00 -2.06 -2.94 119.26 117.11 3hie h ALA 79 Ca 0.00 -0.38 -0.20 0.00 0.00 0.00 0.00 54.91 54.33 3hie h ALA 79 Cb 0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3hie h ALA 79 CO 0.00 0.52 -0.83 1.49 0.00 0.00 0.00 179.25 180.43 3hie h GLU 80 N 0.00 0.34 -0.69 0.00 4.57 -2.05 -2.01 114.58 114.75 3hie h GLU 80 Ca -0.00 -0.33 0.13 0.00 -1.18 0.00 0.00 59.36 57.98 3hie h GLU 80 Cb 1.01 0.08 -0.13 0.00 -0.16 0.00 0.00 28.75 29.56 3hie h GLU 80 CO 0.05 1.00 -0.22 0.37 -1.18 0.00 0.00 179.01 179.04 3hie h GLN 81 N 0.21 -0.04 -0.80 1.92 4.15 -1.95 0.56 115.11 119.16 3hie h GLN 81 Ca -0.05 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.48 3hie h GLN 81 Cb 1.44 0.01 -0.06 0.00 0.21 0.00 0.00 27.48 29.08 3hie h GLN 81 CO 0.14 -0.03 0.52 -0.92 -1.93 0.00 0.00 178.83 176.61 3hie h TYR 82 N -0.04 0.74 -0.23 3.99 5.03 -1.35 0.14 116.97 125.25 3hie h TYR 82 Ca 0.32 0.02 -0.19 0.00 2.58 0.00 0.00 58.73 61.46 3hie h TYR 82 Cb 0.53 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.57 3hie h TYR 82 CO -0.59 0.33 -0.61 1.49 -1.32 0.00 0.00 178.16 177.46 3hie h GLU 83 N 0.68 0.77 0.08 1.82 4.57 0.20 -2.17 114.58 120.54 3hie h GLU 83 Ca 0.38 -0.52 0.00 0.00 -1.18 0.00 0.00 59.36 58.04 3hie h GLU 83 Cb 0.54 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 3hie h GLU 83 CO -0.15 1.15 -0.19 -0.09 -1.18 0.00 0.00 179.01 178.55 3hie h ARG 84 N 0.58 -0.29 -0.87 1.92 2.43 0.24 -2.48 114.38 115.91 3hie h ARG 84 Ca -0.00 0.02 0.18 0.00 -0.81 0.00 0.00 59.98 59.37 3hie h ARG 84 Cb 1.20 0.07 -0.16 0.00 -0.42 0.00 0.00 29.97 30.66 3hie h ARG 84 CO 0.13 -0.19 -0.19 -0.44 -1.51 0.00 0.00 179.97 177.77 3hie h ASP 85 N -0.30 -0.75 -0.10 -3.80 5.19 -1.14 -1.75 116.42 113.76 3hie h ASP 85 Ca -0.01 0.26 0.02 0.00 -0.62 0.00 0.00 57.03 56.68 3hie h ASP 85 Cb 0.29 0.52 -0.04 0.00 0.18 0.00 0.00 39.33 40.28 3hie h ASP 85 CO -0.08 -0.28 -0.36 -0.09 -3.12 0.00 0.00 179.24 175.30 3hie h ARG 86 N 0.01 -0.36 -0.72 3.56 2.43 -0.95 -0.84 114.38 117.50 3hie h ARG 86 Ca 0.43 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.77 3hie h ARG 86 Cb 0.68 0.08 -0.14 0.00 -0.42 0.00 0.00 29.97 30.18 3hie h ARG 86 CO -0.88 -0.24 -0.19 0.87 -1.51 0.00 0.00 179.97 178.02 3hie h LYS 87 N -0.38 -0.01 -0.36 0.20 6.56 -0.96 0.55 116.57 122.18 3hie h LYS 87 Ca 0.02 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.59 3hie h LYS 87 Cb 0.45 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.09 3hie h LYS 87 CO -0.30 -0.00 0.11 0.00 -2.06 0.00 0.00 179.45 177.20 3hie h ALA 88 N 1.70 1.53 -0.32 3.86 0.00 -1.11 -0.86 119.26 124.05 3hie h ALA 88 Ca 0.34 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3hie h ALA 88 Cb 0.53 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3hie h ALA 88 CO -0.75 0.36 -0.26 0.82 0.00 0.00 0.00 179.25 179.43 3hie h ILE 89 N 0.51 1.29 -0.36 0.00 2.04 0.46 0.31 117.51 121.76 3hie h ILE 89 Ca 0.12 -1.41 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 3hie h ILE 89 Cb 0.16 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 3hie h ILE 89 CO -0.01 0.46 0.10 0.40 0.00 0.00 0.00 178.15 179.10 3hie h ILE 90 N 0.50 1.22 -0.13 -0.67 2.04 -1.07 0.28 117.51 119.68 3hie h ILE 90 Ca 0.06 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.12 3hie h ILE 90 Cb 0.82 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 3hie h ILE 90 CO 0.07 0.25 -0.26 0.78 0.00 0.00 0.00 178.15 178.98 3hie h ASN 91 N 0.43 0.23 0.08 1.72 4.21 -1.06 0.18 115.58 121.37 3hie h ASN 91 Ca 0.11 -0.07 -0.20 0.00 1.21 0.00 0.00 56.30 57.35 3hie h ASN 91 Cb 0.28 -0.06 -0.00 0.00 -1.12 0.00 0.00 38.32 37.42 3hie h ASN 91 CO -0.00 0.50 -1.03 0.00 -1.29 0.00 0.00 177.43 175.61 3hie n PHE 94 N -0.24 0.44 0.02 0.00 3.01 0.58 -4.80 117.46 116.48 3hie n PHE 94 Ca 0.00 -1.23 0.04 0.00 1.01 0.00 0.00 57.45 57.27 3hie n PHE 94 Cb 0.03 -0.21 -0.05 0.00 -0.01 0.00 0.00 39.48 39.23 3hie n PHE 94 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3hie n SER 95 N -0.32 3.11 -4.37 4.37 3.41 -0.87 -4.76 113.62 114.19 3hie n SER 95 Ca 0.15 -0.05 -0.24 0.00 -0.26 0.00 0.00 58.87 58.47 3hie n SER 95 Cb 0.93 1.30 -0.11 0.00 -0.26 0.00 0.00 64.21 66.07 3hie n SER 95 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hie s ARG 96 N -2.43 1.39 0.74 4.33 1.70 -1.26 -4.85 118.95 118.57 3hie s ARG 96 Ca -0.02 -1.48 -0.15 0.00 -0.47 0.00 0.00 55.73 53.61 3hie s ARG 96 Cb 0.05 -1.54 0.03 0.00 -0.57 0.00 0.00 34.95 32.92 3hie s ARG 96 CO 0.30 0.32 1.13 -2.30 -1.08 0.00 0.00 175.30 173.67 3hie n PRO 97 N 0.21 0.51 -1.81 3.89 -0.02 -1.26 -4.00 135.00 132.52 3hie n PRO 97 Ca -0.12 0.24 -0.42 0.00 -2.02 0.00 0.00 63.50 61.17 3hie n PRO 97 Cb 0.57 -2.38 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 3hie n PRO 97 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3hie s ASP 98 N -1.78 6.46 0.00 2.55 -1.08 0.56 -4.87 116.67 118.52 3hie s ASP 98 Ca 0.75 2.76 0.17 0.00 -0.52 0.00 0.00 52.55 55.71 3hie s ASP 98 Cb -0.33 -2.59 1.01 0.00 -1.46 0.00 0.00 42.92 39.55 3hie s ASP 98 CO 0.48 -0.92 1.56 0.00 0.52 0.00 0.00 175.17 176.81 3hie n HIS 99 N 4.16 0.00 0.00 -5.34 1.44 -1.26 -1.01 115.22 113.21 3hie n HIS 99 Ca 0.15 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.86 3hie n HIS 99 Cb 0.37 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.48 3hie n HIS 99 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3hie n LYS 100 N -0.81 4.26 0.00 -1.40 5.02 -1.26 -4.78 118.16 119.20 3hie n LYS 100 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 3hie n LYS 100 Cb 0.06 -0.55 0.00 0.00 -0.02 0.00 0.00 35.03 34.52 3hie n LYS 100 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 3hie n THR 101 N -0.91 0.00 -1.18 -0.18 5.66 -1.13 -4.94 114.28 111.59 3hie n THR 101 Ca 0.00 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.94 3hie n THR 101 Cb 0.00 -0.75 -0.03 0.00 -1.55 0.00 0.00 70.33 68.00 3hie n THR 101 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3hie n GLY 102 N 2.47 0.76 3.82 1.09 0.00 -0.18 -4.95 105.19 108.20 3hie n GLY 102 Ca 0.00 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 3hie n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hie s GLU 103 N -2.15 4.00 0.84 1.61 2.02 -1.26 -4.81 118.70 118.95 3hie s GLU 103 Ca 0.00 1.10 -0.13 0.00 0.02 0.00 0.00 54.97 55.96 3hie s GLU 103 Cb 0.00 -2.14 0.07 0.00 0.10 0.00 0.00 34.13 32.16 3hie s GLU 103 CO 0.00 -0.23 1.00 -2.30 0.02 0.00 0.00 175.26 173.75 3hie n PRO 104 N -1.14 0.01 -0.83 0.39 -0.02 -1.26 -0.32 135.00 131.83 3hie n PRO 104 Ca 0.07 0.08 -0.31 0.00 -2.02 0.00 0.00 63.50 61.32 3hie n PRO 104 Cb 0.54 -2.27 0.16 0.00 -0.02 0.00 0.00 33.50 31.90 3hie n PRO 104 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hie s PRO 105 N -3.98 1.02 0.84 0.52 0.04 -1.26 -4.44 135.00 127.74 3hie s PRO 105 Ca 0.69 1.31 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 3hie s PRO 105 Cb -0.28 -1.74 0.10 0.00 0.04 0.00 0.00 34.50 32.62 3hie s PRO 105 CO 0.55 -2.55 1.19 -0.80 0.04 0.00 0.00 177.00 175.43 3hie s ASN 106 N -2.86 3.38 -0.27 6.66 -0.87 -1.26 -4.24 114.94 115.48 3hie s ASN 106 Ca 0.66 2.33 -0.12 0.00 -1.57 0.00 0.00 52.86 54.16 3hie s ASN 106 Cb -0.21 -2.58 -0.05 0.00 -0.02 0.00 0.00 41.25 38.38 3hie s ASN 106 CO 0.58 -2.80 0.21 0.20 -2.57 0.00 0.00 177.10 172.72 3hie s ASN 107 N -2.29 6.07 0.35 -1.22 -0.87 0.12 -4.82 114.94 112.28 3hie s ASN 107 Ca 0.72 0.05 -0.28 0.00 -1.57 0.00 0.00 52.86 51.78 3hie s ASN 107 Cb -0.27 -2.13 -0.12 0.00 -0.02 0.00 0.00 41.25 38.70 3hie s ASN 107 CO 0.53 -0.06 1.28 0.00 -2.57 0.00 0.00 177.10 176.28 3hie n TYR 108 N 5.01 2.23 -0.00 2.20 9.36 -1.26 -1.13 117.16 133.57 3hie n TYR 108 Ca -0.13 0.55 -0.04 0.00 3.32 0.00 0.00 57.90 61.60 3hie n TYR 108 Cb 0.52 -2.41 -0.01 0.00 -0.63 0.00 0.00 39.34 36.81 3hie n TYR 108 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 3hie n ILE 109 N 0.28 0.96 -3.80 2.97 5.41 0.70 -4.85 119.36 121.03 3hie n ILE 109 Ca 0.05 0.18 -0.05 0.00 1.00 0.00 0.00 62.75 63.93 3hie n ILE 109 Cb 0.36 -1.71 -0.01 0.00 -0.71 0.00 0.00 39.64 37.58 3hie n ILE 109 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 3hie s THR 110 N -2.19 0.00 0.23 1.39 -1.32 -1.06 -4.99 115.64 107.70 3hie s THR 110 Ca -0.08 -0.76 -0.10 0.00 -1.21 0.00 0.00 61.69 59.54 3hie s THR 110 Cb 0.02 -2.16 -0.01 0.00 -1.51 0.00 0.00 72.50 68.84 3hie s THR 110 CO 0.11 0.00 0.38 -1.38 -2.21 0.00 0.00 174.62 171.52 3hie s HIS 111 N -3.25 0.56 -0.09 9.09 -3.43 -1.26 0.45 115.29 117.37 3hie s HIS 111 Ca 0.13 -0.89 -0.15 0.00 -0.80 0.00 0.00 55.06 53.35 3hie s HIS 111 Cb -0.03 -0.01 0.03 0.00 -1.43 0.00 0.00 32.58 31.14 3hie s HIS 111 CO 0.04 -0.89 0.38 0.54 -2.00 0.00 0.00 174.74 172.81 3hie s VAL 112 N -4.05 0.02 0.21 -5.38 0.11 0.12 -4.99 120.40 106.45 3hie s VAL 112 Ca 0.26 -0.18 -0.30 0.00 -2.93 0.00 0.00 61.98 58.84 3hie s VAL 112 Cb 0.01 -0.60 -0.08 0.00 -1.53 0.00 0.00 36.38 34.18 3hie s VAL 112 CO 0.09 -0.10 1.01 -0.13 -3.33 0.00 0.00 175.10 172.65 3hie s ARG 113 N -0.45 4.73 0.14 1.54 0.52 -1.26 -0.99 118.95 123.18 3hie s ARG 113 Ca -0.06 1.60 0.05 0.00 -0.52 0.00 0.00 55.73 56.80 3hie s ARG 113 Cb -0.04 -3.28 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 3hie s ARG 113 CO 0.02 0.31 -0.11 0.96 0.02 0.00 0.00 175.30 176.50 3hie s ILE 114 N -0.77 1.19 -0.18 1.52 -4.36 -0.45 -4.26 121.20 113.88 3hie s ILE 114 Ca 0.45 -1.98 -0.03 0.00 -0.26 0.00 0.00 60.65 58.82 3hie s ILE 114 Cb -0.28 -1.76 -0.02 0.00 1.25 0.00 0.00 42.46 41.65 3hie s ILE 114 CO 0.34 -0.68 -0.06 -0.63 0.24 0.00 0.00 174.94 174.15 3hie s ILE 115 N -3.08 3.47 -0.08 8.37 1.01 0.23 -1.52 121.20 129.61 3hie s ILE 115 Ca 0.15 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.31 3hie s ILE 115 Cb 0.01 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 3hie s ILE 115 CO 0.01 0.47 -0.06 -0.70 0.00 0.00 0.00 174.94 174.65 3hie s GLU 116 N 0.85 2.84 -0.33 2.79 2.12 -0.36 -2.05 118.70 124.56 3hie s GLU 116 Ca -0.02 -0.54 -0.11 0.00 0.36 0.00 0.00 54.97 54.66 3hie s GLU 116 Cb -0.15 -2.62 -0.01 0.00 0.26 0.00 0.00 34.13 31.61 3hie s GLU 116 CO 0.01 0.62 0.20 0.34 -0.54 0.00 0.00 175.26 175.89 3hie s ASP 117 N -0.70 5.77 0.50 -1.70 3.68 -1.26 -0.24 116.67 122.72 3hie s ASP 117 Ca 0.11 -0.56 0.19 0.00 2.13 0.00 0.00 52.55 54.42 3hie s ASP 117 Cb -0.11 -2.06 1.28 0.00 -1.45 0.00 0.00 42.92 40.58 3hie s ASP 117 CO 0.02 -0.24 2.09 0.77 0.13 0.00 0.00 175.17 177.93 3hie h SER 118 N 8.42 0.00 0.62 -0.34 4.64 -1.65 -2.42 113.55 122.83 3hie h SER 118 Ca -0.31 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.81 3hie h SER 118 Cb 1.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.20 3hie h SER 118 CO 0.63 0.09 -1.52 0.29 -0.87 0.00 0.00 176.83 175.46 3hie n LYS 119 N -4.19 0.63 -3.71 4.77 5.02 -1.26 -4.53 118.16 114.89 3hie n LYS 119 Ca -0.03 0.23 -0.28 0.00 -2.02 0.00 0.00 58.31 56.22 3hie n LYS 119 Cb 0.18 -1.79 -0.11 0.00 -0.02 0.00 0.00 35.03 33.29 3hie n LYS 119 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3hie n PHE 120 N -2.91 2.85 0.25 2.13 3.01 -0.93 -4.91 117.46 116.96 3hie n PHE 120 Ca -0.12 -4.16 0.12 0.00 1.01 0.00 0.00 57.45 54.31 3hie n PHE 120 Cb 0.89 -0.52 0.20 0.00 -0.01 0.00 0.00 39.48 40.05 3hie n PHE 120 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 3hie h PRO 121 N 5.04 0.00 0.00 -1.08 0.11 -1.75 -3.36 132.00 130.96 3hie h PRO 121 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 3hie h PRO 121 Cb 0.75 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.86 3hie h PRO 121 CO 0.71 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.93 3hie n SER 122 N -3.04 1.12 -3.70 -2.05 7.64 -1.26 -1.33 113.62 111.00 3hie n SER 122 Ca 0.04 -1.18 -0.10 0.00 1.01 0.00 0.00 58.87 58.65 3hie n SER 122 Cb 0.52 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.68 3hie n SER 122 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hie s SER 123 N -0.18 -0.31 -0.03 6.43 1.04 -1.26 -4.44 113.70 114.95 3hie s SER 123 Ca 0.00 -0.42 -0.32 0.00 0.48 0.00 0.00 55.95 55.69 3hie s SER 123 Cb 0.00 0.61 -0.10 0.00 0.10 0.00 0.00 66.02 66.62 3hie s SER 123 CO 0.00 -1.09 1.95 -1.14 0.98 0.00 0.00 173.24 173.94 3hie n ARG 124 N -0.37 2.55 -2.12 4.02 0.63 -1.26 -4.87 116.66 115.24 3hie n ARG 124 Ca -0.10 0.93 -0.33 0.00 -0.92 0.00 0.00 57.85 57.43 3hie n ARG 124 Cb 0.62 -2.86 0.00 0.00 0.45 0.00 0.00 32.46 30.68 3hie n ARG 124 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3hie s PRO 125 N 4.37 3.41 0.28 -0.14 0.02 -1.26 -5.02 135.00 136.65 3hie s PRO 125 Ca 0.91 1.22 -0.29 0.00 0.02 0.00 0.00 61.00 62.85 3hie s PRO 125 Cb -0.55 -2.04 -0.10 0.00 0.02 0.00 0.00 34.50 31.83 3hie s PRO 125 CO 0.46 -0.74 1.25 -2.14 -0.33 0.00 0.00 177.00 175.50 3hie s PRO 126 N -3.97 4.44 0.66 5.54 0.02 -1.26 -4.87 135.00 135.56 3hie s PRO 126 Ca 0.64 2.05 0.29 0.00 0.02 0.00 0.00 61.00 64.00 3hie s PRO 126 Cb -0.16 -3.14 1.55 0.00 0.02 0.00 0.00 34.50 32.77 3hie s PRO 126 CO 0.34 -0.10 1.88 -1.00 -0.33 0.00 0.00 177.00 177.80 3hie h PRO 127 N 4.11 0.00 -0.89 5.54 0.14 -2.05 0.18 132.00 139.03 3hie h PRO 127 Ca -0.47 0.00 -0.17 0.00 0.14 0.00 0.00 66.00 65.50 3hie h PRO 127 Cb 1.22 0.00 -0.10 0.00 0.14 0.00 0.00 31.00 32.26 3hie h PRO 127 CO 0.69 0.00 0.22 -0.40 0.14 0.00 0.00 178.00 178.65 3hie n ASP 128 N -2.96 3.60 -4.86 1.44 5.68 -1.26 -4.96 116.55 113.23 3hie n ASP 128 Ca -0.01 -2.78 -0.34 0.00 -0.50 0.00 0.00 54.79 51.16 3hie n ASP 128 Cb 0.43 -0.66 -0.05 0.00 -1.14 0.00 0.00 41.12 39.70 3hie n ASP 128 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3hie s SER 129 N -0.40 6.70 0.28 -1.12 0.15 0.62 -5.00 113.70 114.94 3hie s SER 129 Ca 0.33 0.91 -0.30 0.00 0.70 0.00 0.00 55.95 57.59 3hie s SER 129 Cb 0.27 -2.22 -0.12 0.00 -1.71 0.00 0.00 66.02 62.24 3hie s SER 129 CO 0.08 0.10 1.59 1.17 1.20 0.00 0.00 173.24 177.38 3hie n LYS 130 N 0.66 2.65 0.24 5.44 4.81 -1.26 -4.91 118.16 125.79 3hie n LYS 130 Ca -0.05 0.94 0.10 0.00 -0.87 0.00 0.00 58.31 58.43 3hie n LYS 130 Cb 0.52 -2.72 0.57 0.00 0.02 0.00 0.00 35.03 33.42 3hie n LYS 130 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 3hie h LEU 131 N 4.92 0.00 -0.81 3.14 4.07 -1.96 -2.47 115.31 122.20 3hie h LEU 131 Ca -0.46 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.48 3hie h LEU 131 Cb 1.23 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.97 3hie h LEU 131 CO 0.80 0.20 -0.06 1.05 -1.08 0.00 0.00 178.44 179.35 3hie h GLU 132 N 0.00 0.00 -0.44 1.13 4.11 -2.03 -3.14 114.58 114.20 3hie h GLU 132 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3hie h GLU 132 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3hie h GLU 132 CO 0.03 0.06 0.00 0.27 0.07 0.00 0.00 179.01 179.43 3hie n ASN 133 N -3.14 3.06 -4.61 3.06 2.04 -0.93 -4.83 115.26 109.91 3hie n ASN 133 Ca 0.02 -1.95 -0.41 0.00 -0.44 0.00 0.00 54.58 51.80 3hie n ASN 133 Cb 0.43 -0.29 -0.06 0.00 -2.53 0.00 0.00 39.78 37.32 3hie n ASN 133 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 3hie s LYS 134 N -1.42 4.02 -0.02 -3.83 -0.14 -1.19 -1.44 119.74 115.72 3hie s LYS 134 Ca 0.38 0.43 0.03 0.00 -1.36 0.00 0.00 55.97 55.46 3hie s LYS 134 Cb 0.21 -3.68 -0.03 0.00 -1.68 0.00 0.00 37.83 32.65 3hie s LYS 134 CO 0.29 -0.48 -0.09 0.15 -0.76 0.00 0.00 175.35 174.46 3hie s LYS 135 N 2.55 2.54 -0.07 1.68 -0.14 0.67 -4.93 119.74 122.02 3hie s LYS 135 Ca 0.26 -0.70 -0.26 0.00 -1.36 0.00 0.00 55.97 53.90 3hie s LYS 135 Cb -0.15 -2.47 -0.03 0.00 -1.68 0.00 0.00 37.83 33.50 3hie s LYS 135 CO 0.10 0.61 0.83 0.15 -0.76 0.00 0.00 175.35 176.29 3hie s LYS 136 N -1.16 4.44 0.29 1.68 1.02 -1.26 -1.22 119.74 123.52 3hie s LYS 136 Ca 0.15 1.11 0.05 0.00 0.02 0.00 0.00 55.97 57.30 3hie s LYS 136 Cb -0.11 -3.49 -0.02 0.00 -0.52 0.00 0.00 37.83 33.70 3hie s LYS 136 CO 0.05 -0.09 0.28 0.54 -0.92 0.00 0.00 175.35 175.21 3hie n ARG 137 N 4.23 0.40 -3.91 1.68 5.12 -0.57 -4.66 116.66 118.95 3hie n ARG 137 Ca 0.03 -2.77 -0.11 0.00 -1.93 0.00 0.00 57.85 53.08 3hie n ARG 137 Cb 0.50 2.34 -0.11 0.00 -1.16 0.00 0.00 32.46 34.03 3hie n ARG 137 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3hie s LEU 138 N 0.00 1.91 -0.15 0.55 1.02 0.16 -1.35 118.68 120.83 3hie s LEU 138 Ca 0.32 -0.23 -0.04 0.00 0.02 0.00 0.00 54.13 54.20 3hie s LEU 138 Cb 0.01 0.28 -0.03 0.00 0.02 0.00 0.00 46.19 46.47 3hie s LEU 138 CO 0.23 -0.23 0.00 -0.76 0.02 0.00 0.00 176.35 175.61 3hie s LEU 139 N -0.97 3.51 -0.02 1.79 1.02 -0.16 -0.42 118.68 123.43 3hie s LEU 139 Ca -0.11 0.01 0.05 0.00 0.02 0.00 0.00 54.13 54.11 3hie s LEU 139 Cb -0.06 -1.85 -0.01 0.00 0.02 0.00 0.00 46.19 44.29 3hie s LEU 139 CO 0.00 0.22 -0.18 -0.63 0.02 0.00 0.00 176.35 175.78 3hie s ILE 140 N 0.04 1.46 -0.04 -0.59 1.01 0.10 -0.70 121.20 122.48 3hie s ILE 140 Ca 0.02 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 59.92 3hie s ILE 140 Cb -0.13 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 3hie s ILE 140 CO 0.02 0.42 -0.07 -0.76 0.00 0.00 0.00 174.94 174.54 3hie s LEU 141 N -0.29 3.15 0.19 2.97 1.43 0.17 0.04 118.68 126.34 3hie s LEU 141 Ca 0.04 -0.07 -0.14 0.00 -1.03 0.00 0.00 54.13 52.93 3hie s LEU 141 Cb -0.09 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.42 3hie s LEU 141 CO 0.00 0.33 0.44 -0.94 0.23 0.00 0.00 176.35 176.41 3hie s SER 142 N -1.02 -0.14 0.08 2.29 1.04 -0.71 -0.21 113.70 115.03 3hie s SER 142 Ca 0.14 -0.66 0.07 0.00 0.48 0.00 0.00 55.95 55.97 3hie s SER 142 Cb -0.11 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 3hie s SER 142 CO 0.04 -1.01 -0.17 0.00 0.98 0.00 0.00 173.24 173.08 3hie s ALA 143 N -3.92 1.46 0.41 5.32 0.00 -0.29 -0.58 121.76 124.16 3hie s ALA 143 Ca 0.13 -1.11 -0.26 0.00 0.00 0.00 0.00 51.96 50.72 3hie s ALA 143 Cb 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 23.12 22.87 3hie s ALA 143 CO -0.01 0.26 1.31 0.21 0.00 0.00 0.00 175.76 177.53 3hie s LYS 144 N -1.81 3.95 0.23 0.00 2.47 -0.36 0.14 119.74 124.36 3hie s LYS 144 Ca 0.02 2.18 -0.12 0.00 -1.56 0.00 0.00 55.97 56.49 3hie s LYS 144 Cb -0.10 -2.75 0.31 0.00 -1.46 0.00 0.00 37.83 33.82 3hie s LYS 144 CO 0.03 -0.51 1.40 -2.30 0.16 0.00 0.00 175.35 174.13 3hie n PRO 145 N 0.12 -0.15 0.00 4.03 -0.02 -1.26 -1.79 135.00 135.92 3hie n PRO 145 Ca 0.04 1.39 0.05 0.00 -2.02 0.00 0.00 63.50 62.96 3hie n PRO 145 Cb 0.43 -2.07 -0.00 0.00 -0.02 0.00 0.00 33.50 31.84 3hie n PRO 145 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hie n ASN 146 N -5.39 1.27 -3.99 2.55 3.02 -1.26 -4.82 115.26 106.65 3hie n ASN 146 Ca 0.12 -1.14 -0.32 0.00 -0.03 0.00 0.00 54.58 53.21 3hie n ASN 146 Cb 0.40 0.48 -0.11 0.00 -0.61 0.00 0.00 39.78 39.94 3hie n ASN 146 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3hie s ASN 147 N -1.46 5.04 0.00 6.41 3.04 -0.74 -4.91 114.94 122.32 3hie s ASN 147 Ca 0.09 -3.47 0.08 0.00 0.04 0.00 0.00 52.86 49.60 3hie s ASN 147 Cb 0.09 -1.74 0.46 0.00 -1.54 0.00 0.00 41.25 38.52 3hie s ASN 147 CO 0.28 -0.19 1.04 0.00 -3.04 0.00 0.00 177.10 175.19 3hie n ALA 148 N 2.56 1.70 1.05 1.71 0.00 -1.26 0.26 120.51 126.53 3hie n ALA 148 Ca 0.15 -0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.66 3hie n ALA 148 Cb 0.35 -1.14 0.07 0.00 0.00 0.00 0.00 19.45 18.74 3hie n ALA 148 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hie n LYS 149 N -1.13 1.16 -3.60 0.00 5.02 -1.26 -4.79 118.16 113.55 3hie n LYS 149 Ca 0.05 -0.92 -0.40 0.00 -2.02 0.00 0.00 58.31 55.02 3hie n LYS 149 Cb 0.05 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 3hie n LYS 149 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3hie s LEU 150 N -2.47 4.97 0.01 -0.35 1.98 0.14 -4.71 118.68 118.25 3hie s LEU 150 Ca 0.20 -1.30 0.08 0.00 -2.89 0.00 0.00 54.13 50.22 3hie s LEU 150 Cb 0.18 -2.00 -0.02 0.00 0.66 0.00 0.00 46.19 45.01 3hie s LEU 150 CO 0.56 -0.48 -0.24 -0.63 -1.89 0.00 0.00 176.35 173.67 3hie s ILE 151 N 1.47 1.95 0.06 6.68 1.01 -1.26 -1.23 121.20 129.88 3hie s ILE 151 Ca 0.02 -1.17 0.08 0.00 0.00 0.00 0.00 60.65 59.58 3hie s ILE 151 Cb -0.22 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.58 3hie s ILE 151 CO 0.04 0.43 -0.22 -1.10 0.00 0.00 0.00 174.94 174.09 3hie s GLN 152 N -0.88 1.41 -0.14 2.79 -0.21 0.25 -0.46 119.66 122.42 3hie s GLN 152 Ca 0.10 -1.02 -0.05 0.00 0.02 0.00 0.00 55.36 54.40 3hie s GLN 152 Cb -0.09 -1.58 -0.04 0.00 1.00 0.00 0.00 33.01 32.30 3hie s GLN 152 CO 0.00 0.40 0.04 0.42 -2.12 0.00 0.00 175.29 174.04 3hie s ILE 153 N -0.87 4.66 -0.02 1.08 1.01 -0.23 -1.73 121.20 125.10 3hie s ILE 153 Ca 0.08 -0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.71 3hie s ILE 153 Cb -0.09 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 3hie s ILE 153 CO 0.02 0.53 -0.23 -1.00 0.00 0.00 0.00 174.94 174.27 3hie s HIS 154 N -0.21 2.07 -0.22 3.97 3.76 0.11 -1.12 115.29 123.64 3hie s HIS 154 Ca 0.07 -0.41 -0.10 0.00 -0.15 0.00 0.00 55.06 54.48 3hie s HIS 154 Cb -0.12 -1.33 -0.05 0.00 1.11 0.00 0.00 32.58 32.19 3hie s HIS 154 CO 0.02 -0.05 0.13 0.21 -0.85 0.00 0.00 174.74 174.19 3hie s LYS 155 N -0.50 4.04 0.34 1.40 2.20 -0.76 0.03 119.74 126.48 3hie s LYS 155 Ca 0.08 -0.29 0.04 0.00 -0.36 0.00 0.00 55.97 55.43 3hie s LYS 155 Cb -0.09 -3.44 -0.03 0.00 -1.51 0.00 0.00 37.83 32.76 3hie s LYS 155 CO -0.01 0.12 0.16 0.00 -0.36 0.00 0.00 175.35 175.26 3hie s ALA 156 N 0.84 2.23 0.04 3.13 0.00 0.44 0.14 121.76 128.58 3hie s ALA 156 Ca 0.07 -1.66 -0.12 0.00 0.00 0.00 0.00 51.96 50.24 3hie s ALA 156 Cb -0.13 1.04 0.01 0.00 0.00 0.00 0.00 23.12 24.05 3hie s ALA 156 CO 0.03 -0.46 0.26 -0.98 0.00 0.00 0.00 175.76 174.60 3hie s ARG 157 N -3.76 0.74 -0.41 0.00 3.03 -0.89 0.35 118.95 118.02 3hie s ARG 157 Ca 0.33 -0.53 -0.11 0.00 2.03 0.00 0.00 55.73 57.45 3hie s ARG 157 Cb 0.04 0.32 0.05 0.00 -1.03 0.00 0.00 34.95 34.33 3hie s ARG 157 CO 0.17 -0.23 0.26 -2.00 -1.13 0.00 0.00 175.30 172.38 3hie s GLU 158 N -2.43 2.79 0.99 3.89 2.12 -1.26 -1.67 118.70 123.12 3hie s GLU 158 Ca -0.06 -1.24 -0.11 0.00 0.36 0.00 0.00 54.97 53.92 3hie s GLU 158 Cb -0.01 -3.83 0.19 0.00 0.26 0.00 0.00 34.13 30.73 3hie s GLU 158 CO -0.03 -0.84 1.09 -0.80 -0.54 0.00 0.00 175.26 174.15 3hie s ASN 159 N 1.91 2.40 0.14 -1.70 0.01 -0.16 -4.88 114.94 112.66 3hie s ASN 159 Ca 0.03 1.82 -0.15 0.00 -0.71 0.00 0.00 52.86 53.85 3hie s ASN 159 Cb -0.21 -2.41 0.01 0.00 0.41 0.00 0.00 41.25 39.05 3hie s ASN 159 CO 0.05 -3.36 1.68 0.77 -1.51 0.00 0.00 177.10 174.74 3hie h SER 160 N -2.05 0.62 -0.97 -1.22 4.64 -1.98 0.46 113.55 113.04 3hie h SER 160 Ca -0.51 -0.18 0.28 0.00 -0.47 0.00 0.00 61.79 60.92 3hie h SER 160 Cb 1.29 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 63.18 3hie h SER 160 CO 0.47 0.63 1.15 0.44 -0.87 0.00 0.00 176.83 178.65 3hie h ASP 161 N 0.58 0.00 0.00 4.97 3.32 -2.04 -3.41 116.42 119.83 3hie h ASP 161 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3hie h ASP 161 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3hie h ASP 161 CO -0.01 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.12 3hie n GLY 162 N -1.70 0.91 3.95 2.75 0.00 0.15 -5.08 105.19 106.17 3hie n GLY 162 Ca 0.22 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 3hie n GLY 162 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hie s SER 163 N -2.01 6.13 0.11 1.61 1.04 -1.24 -4.86 113.70 114.49 3hie s SER 163 Ca 0.00 0.34 0.07 0.00 0.48 0.00 0.00 55.95 56.85 3hie s SER 163 Cb 0.00 -1.82 -0.04 0.00 0.10 0.00 0.00 66.02 64.26 3hie s SER 163 CO 0.00 -0.42 -0.09 -0.36 0.98 0.00 0.00 173.24 173.35 3hie s PHE 164 N -2.37 2.75 -0.14 5.02 0.08 -1.26 -0.99 117.98 121.06 3hie s PHE 164 Ca 0.43 -0.16 -0.07 0.00 0.12 0.00 0.00 56.93 57.25 3hie s PHE 164 Cb -0.10 -1.42 0.06 0.00 -0.57 0.00 0.00 43.02 40.99 3hie s PHE 164 CO 0.36 0.44 0.33 1.14 -0.10 0.00 0.00 175.22 177.39 3hie s GLN 165 N -2.31 0.27 0.06 0.44 -2.07 -0.67 -4.85 119.66 110.53 3hie s GLN 165 Ca 0.22 0.74 -0.31 0.00 -1.82 0.00 0.00 55.36 54.19 3hie s GLN 165 Cb -0.11 -0.00 -0.06 0.00 -1.09 0.00 0.00 33.01 31.75 3hie s GLN 165 CO 0.14 -0.20 1.20 0.42 -1.32 0.00 0.00 175.29 175.53 3hie s ILE 166 N 1.76 4.03 -0.03 3.63 1.01 -1.26 -2.10 121.20 128.24 3hie s ILE 166 Ca -0.06 1.46 0.12 0.00 0.00 0.00 0.00 60.65 62.17 3hie s ILE 166 Cb -0.10 -3.94 -0.19 0.00 0.01 0.00 0.00 42.46 38.24 3hie s ILE 166 CO -0.11 0.12 0.25 0.61 0.00 0.00 0.00 174.94 175.81 3hie n GLY 167 N 3.19 -0.56 3.14 6.18 0.00 0.12 -4.96 105.19 112.30 3hie n GLY 167 Ca 0.09 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.71 3hie n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hie s ARG 168 N -2.80 0.55 -0.06 1.61 1.81 -1.00 -4.98 118.95 114.09 3hie s ARG 168 Ca -0.05 -0.40 -0.03 0.00 -1.72 0.00 0.00 55.73 53.54 3hie s ARG 168 Cb 0.07 0.23 0.03 0.00 -0.45 0.00 0.00 34.95 34.84 3hie s ARG 168 CO 0.51 -0.14 0.13 0.99 -0.68 0.00 0.00 175.30 176.11 3hie s THR 169 N -1.56 -0.04 0.25 0.02 2.01 -1.26 -1.82 115.64 113.24 3hie s THR 169 Ca -0.13 0.15 0.10 0.00 0.31 0.00 0.00 61.69 62.12 3hie s THR 169 Cb -0.06 -0.21 -0.05 0.00 0.01 0.00 0.00 72.50 72.19 3hie s THR 169 CO 0.01 0.06 -0.18 0.26 -0.69 0.00 0.00 174.62 174.09 3hie s TRP 170 N 0.95 2.05 0.41 4.92 0.51 -0.27 -5.00 118.94 122.51 3hie s TRP 170 Ca -0.07 -0.43 -0.23 0.00 -2.12 0.00 0.00 56.10 53.24 3hie s TRP 170 Cb -0.10 -0.91 -0.09 0.00 -0.81 0.00 0.00 33.47 31.57 3hie s TRP 170 CO -0.05 0.57 1.06 -0.65 -0.51 0.00 0.00 176.95 177.37 3hie s GLN 171 N -3.57 4.09 0.35 4.98 1.11 -1.26 -1.06 119.66 124.30 3hie s GLN 171 Ca 0.27 1.51 0.03 0.00 0.01 0.00 0.00 55.36 57.19 3hie s GLN 171 Cb -0.03 -2.48 0.65 0.00 -1.01 0.00 0.00 33.01 30.15 3hie s GLN 171 CO 0.12 -0.21 1.97 1.25 0.01 0.00 0.00 175.29 178.43 3hie h LEU 172 N 2.35 0.63 -0.26 2.90 5.85 -1.09 -0.86 115.31 124.83 3hie h LEU 172 Ca -0.48 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.19 3hie h LEU 172 Cb 1.22 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.09 3hie h LEU 172 CO 0.62 0.52 0.00 0.35 -0.34 0.00 0.00 178.44 179.58 3hie n THR 173 N -4.40 1.51 0.23 1.05 -2.24 -1.26 -0.48 114.28 108.69 3hie n THR 173 Ca 0.04 0.45 0.13 0.00 -2.27 0.00 0.00 64.05 62.40 3hie n THR 173 Cb 0.11 -1.38 0.28 0.00 -2.10 0.00 0.00 70.33 67.24 3hie n THR 173 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3hie h GLU 174 N 0.00 0.00 -6.37 -0.78 5.08 -1.53 -3.44 114.58 107.54 3hie h GLU 174 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 3hie h GLU 174 Cb 0.09 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 3hie h GLU 174 CO 0.00 0.03 0.94 -1.17 -1.00 0.00 0.00 179.01 177.81 3hie s LEU 175 N -6.23 3.87 -0.03 1.33 2.96 0.37 -4.52 118.68 116.44 3hie s LEU 175 Ca 0.05 1.11 0.20 0.00 -0.22 0.00 0.00 54.13 55.27 3hie s LEU 175 Cb 0.06 -3.54 -0.30 0.00 0.50 0.00 0.00 46.19 42.91 3hie s LEU 175 CO 0.65 -1.05 0.46 1.33 -1.32 0.00 0.00 176.35 176.42 3hie n VAL 176 N 6.18 0.00 -3.70 1.68 0.24 0.95 -4.97 118.33 118.71 3hie n VAL 176 Ca 0.14 -0.43 -0.12 0.00 -2.04 0.00 0.00 64.34 61.89 3hie n VAL 176 Cb 0.47 0.10 -0.09 0.00 -1.47 0.00 0.00 33.84 32.85 3hie n VAL 176 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3hie s ARG 177 N -3.35 0.56 -0.07 7.34 3.52 -1.13 -5.00 118.95 120.83 3hie s ARG 177 Ca -0.06 0.76 0.04 0.00 -0.13 0.00 0.00 55.73 56.34 3hie s ARG 177 Cb 0.13 0.21 -0.00 0.00 -1.56 0.00 0.00 34.95 33.73 3hie s ARG 177 CO 0.83 -0.09 -0.20 0.08 -0.81 0.00 0.00 175.30 175.10 3hie s VAL 178 N 0.60 1.70 -0.13 7.11 1.01 -1.26 -1.09 120.40 128.33 3hie s VAL 178 Ca -0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 3hie s VAL 178 Cb -0.05 -1.47 0.07 0.00 0.00 0.00 0.00 36.38 34.93 3hie s VAL 178 CO -0.04 0.48 0.25 -0.70 0.00 0.00 0.00 175.10 175.09 3hie s GLU 179 N 0.22 0.14 0.32 2.72 2.12 -0.62 -5.02 118.70 118.57 3hie s GLU 179 Ca -0.11 0.65 -0.28 0.00 0.36 0.00 0.00 54.97 55.60 3hie s GLU 179 Cb -0.15 -0.22 -0.09 0.00 0.26 0.00 0.00 34.13 33.93 3hie s GLU 179 CO 0.05 -0.34 1.09 0.15 -0.54 0.00 0.00 175.26 175.67 3hie s LYS 180 N 2.39 4.49 -0.43 4.30 1.02 -1.26 -0.74 119.74 129.51 3hie s LYS 180 Ca 0.02 1.73 -0.29 0.00 0.02 0.00 0.00 55.97 57.46 3hie s LYS 180 Cb -0.13 -3.00 0.02 0.00 -0.52 0.00 0.00 37.83 34.20 3hie s LYS 180 CO -0.09 0.10 1.22 0.34 -0.92 0.00 0.00 175.35 176.00 3hie s ASP 181 N -1.06 6.58 0.27 2.83 -1.08 -0.30 -4.88 116.67 119.02 3hie s ASP 181 Ca 0.48 0.67 0.25 0.00 -0.52 0.00 0.00 52.55 53.43 3hie s ASP 181 Cb -0.29 -2.55 0.96 0.00 -1.46 0.00 0.00 42.92 39.58 3hie s ASP 181 CO 0.38 -1.26 1.74 -0.07 0.52 0.00 0.00 175.17 176.48 3hie h LEU 182 N 11.38 0.00 0.00 -1.34 3.38 -1.94 -3.06 115.31 123.73 3hie h LEU 182 Ca -0.24 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.44 3hie h LEU 182 Cb 1.08 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.77 3hie h LEU 182 CO 1.10 0.00 -1.83 -0.62 0.09 0.00 0.00 178.44 177.18 3hie n GLU 183 N -2.31 0.64 -4.00 1.13 -0.58 -1.26 -4.85 120.64 109.40 3hie n GLU 183 Ca 0.03 0.21 -0.30 0.00 -0.42 0.00 0.00 57.16 56.67 3hie n GLU 183 Cb 0.29 -1.73 -0.16 0.00 -0.57 0.00 0.00 31.44 29.27 3hie n GLU 183 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3hie s ILE 184 N -2.63 1.63 -0.43 -3.67 -1.09 -1.16 -5.02 121.20 108.84 3hie s ILE 184 Ca -0.06 -0.91 0.17 0.00 -2.23 0.00 0.00 60.65 57.63 3hie s ILE 184 Cb 0.08 -1.66 0.17 0.00 -1.58 0.00 0.00 42.46 39.48 3hie s ILE 184 CO 0.83 0.26 1.53 -1.54 -1.23 0.00 0.00 174.94 174.78 3hie n SER 185 N 4.71 0.45 -0.00 3.58 3.41 -1.26 -1.33 113.62 123.17 3hie n SER 185 Ca -0.15 0.69 0.07 0.00 -0.26 0.00 0.00 58.87 59.21 3hie n SER 185 Cb 0.48 -0.75 -0.08 0.00 -0.26 0.00 0.00 64.21 63.59 3hie n SER 185 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hie n GLU 186 N -2.08 2.24 -3.04 4.33 4.71 -1.26 -4.47 120.64 121.08 3hie n GLU 186 Ca -0.00 -0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 3hie n GLU 186 Cb 0.06 -1.18 -0.04 0.00 -1.01 0.00 0.00 31.44 29.28 3hie n GLU 186 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 3hie s GLY 187 N -2.38 2.03 -0.16 0.62 0.00 -0.45 -0.96 107.32 106.02 3hie s GLY 187 Ca 0.05 -0.22 -0.30 0.00 0.00 0.00 0.00 44.72 44.25 3hie s GLY 187 CO 0.58 -0.05 1.01 -0.11 0.00 0.00 0.00 173.10 174.54 3hie s PHE 188 N -2.20 -0.36 -0.14 1.90 -0.12 -0.30 -1.16 117.98 115.61 3hie s PHE 188 Ca 0.50 0.61 0.02 0.00 -0.05 0.00 0.00 56.93 58.01 3hie s PHE 188 Cb -0.10 0.45 0.00 0.00 -0.63 0.00 0.00 43.02 42.74 3hie s PHE 188 CO 0.27 -0.33 -0.20 0.42 -0.05 0.00 0.00 175.22 175.33 3hie s ILE 189 N -1.12 2.25 -0.20 -4.49 1.01 0.08 -1.15 121.20 117.57 3hie s ILE 189 Ca -0.01 -0.92 -0.06 0.00 0.00 0.00 0.00 60.65 59.65 3hie s ILE 189 Cb -0.00 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 3hie s ILE 189 CO 0.01 0.54 0.04 -0.76 0.00 0.00 0.00 174.94 174.77 3hie s LEU 190 N 0.70 3.53 -0.09 2.97 1.02 -0.23 -1.60 118.68 124.99 3hie s LEU 190 Ca -0.09 -0.08 -0.02 0.00 0.02 0.00 0.00 54.13 53.96 3hie s LEU 190 Cb -0.16 -1.90 -0.03 0.00 0.02 0.00 0.00 46.19 44.11 3hie s LEU 190 CO 0.01 0.09 -0.00 -0.89 0.02 0.00 0.00 176.35 175.58 3hie s THR 191 N 0.84 4.29 0.61 5.49 2.01 -0.25 -0.72 115.64 127.92 3hie s THR 191 Ca 0.02 -0.25 0.25 0.00 0.31 0.00 0.00 61.69 62.02 3hie s THR 191 Cb -0.14 -2.81 0.36 0.00 0.01 0.00 0.00 72.50 69.92 3hie s THR 191 CO 0.02 0.60 1.34 0.77 -0.69 0.00 0.00 174.62 176.66 3hie h SER 193 N 5.25 0.00 -2.98 3.53 4.64 -2.02 0.27 113.55 122.25 3hie h SER 193 Ca -0.50 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.72 3hie h SER 193 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 3hie h SER 193 CO 0.55 0.00 0.09 2.29 -0.87 0.00 0.00 176.83 178.88 3hie n LYS 194 N -3.22 0.78 -2.93 4.77 2.85 -1.26 -5.16 118.16 113.99 3hie n LYS 194 Ca 0.20 -1.99 -0.39 0.00 -1.05 0.00 0.00 58.31 55.08 3hie n LYS 194 Cb 1.40 2.23 -0.06 0.00 -0.65 0.00 0.00 35.03 37.94 3hie n LYS 194 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 3hie s LYS 195 N -2.30 4.59 -0.10 -1.58 1.02 -1.26 -4.96 119.74 115.14 3hie s LYS 195 Ca 0.17 1.21 -0.01 0.00 0.02 0.00 0.00 55.97 57.36 3hie s LYS 195 Cb -0.03 -3.16 0.03 0.00 -0.52 0.00 0.00 37.83 34.16 3hie s LYS 195 CO 0.13 0.50 -0.03 0.71 -0.92 0.00 0.00 175.35 175.74 3hie s TYR 196 N -1.26 1.02 -0.18 3.18 2.02 0.10 -4.55 117.35 117.67 3hie s TYR 196 Ca 0.40 -0.44 -0.14 0.00 -0.37 0.00 0.00 57.07 56.52 3hie s TYR 196 Cb -0.22 -0.99 -0.05 0.00 -0.40 0.00 0.00 41.96 40.31 3hie s TYR 196 CO 0.26 -0.42 0.29 -0.47 -1.57 0.00 0.00 175.55 173.65 3hie s TYR 197 N 1.86 3.42 0.07 2.71 5.04 -0.44 -1.07 117.35 128.94 3hie s TYR 197 Ca 0.05 0.54 0.01 0.00 -2.44 0.00 0.00 57.07 55.22 3hie s TYR 197 Cb -0.13 -2.37 -0.03 0.00 0.35 0.00 0.00 41.96 39.78 3hie s TYR 197 CO -0.07 0.15 -0.06 -1.58 -1.34 0.00 0.00 175.55 172.66 3hie s TRP 198 N 0.76 0.72 0.04 4.97 0.51 -0.30 -4.69 118.94 120.95 3hie s TRP 198 Ca 0.15 -0.78 0.09 0.00 -2.12 0.00 0.00 56.10 53.44 3hie s TRP 198 Cb -0.13 -0.44 -0.03 0.00 -0.81 0.00 0.00 33.47 32.06 3hie s TRP 198 CO 0.05 -0.16 -0.24 -1.21 -0.51 0.00 0.00 176.95 174.87 3hie s GLU 199 N -2.96 1.88 0.75 4.98 2.02 -0.87 -1.15 118.70 123.34 3hie s GLU 199 Ca 0.02 -1.08 -0.02 0.00 0.02 0.00 0.00 54.97 53.92 3hie s GLU 199 Cb -0.00 -2.04 0.14 0.00 0.10 0.00 0.00 34.13 32.33 3hie s GLU 199 CO -0.04 0.52 1.03 0.95 0.02 0.00 0.00 175.26 177.74 3hie s THR 200 N -0.83 2.09 -1.07 3.63 -4.23 -0.14 0.77 115.64 115.86 3hie s THR 200 Ca 0.12 -0.56 0.25 0.00 -1.18 0.00 0.00 61.69 60.33 3hie s THR 200 Cb -0.10 -2.53 0.05 0.00 1.34 0.00 0.00 72.50 71.26 3hie s THR 200 CO 0.03 0.00 1.47 0.59 -0.54 0.00 0.00 174.62 176.17 3hie n ASN 201 N -2.93 0.51 -3.46 3.99 5.03 -1.26 -4.79 115.26 112.34 3hie n ASN 201 Ca 0.16 -0.25 -0.12 0.00 0.87 0.00 0.00 54.58 55.23 3hie n ASN 201 Cb 0.61 0.18 -0.03 0.00 -1.02 0.00 0.00 39.78 39.52 3hie n ASN 201 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 3hie s SER 202 N -2.95 -0.52 0.28 6.41 1.04 -1.26 -5.04 113.70 111.66 3hie s SER 202 Ca 0.13 -0.01 -0.03 0.00 0.48 0.00 0.00 55.95 56.51 3hie s SER 202 Cb 0.18 0.57 0.38 0.00 0.10 0.00 0.00 66.02 67.25 3hie s SER 202 CO 0.67 -0.93 1.92 0.00 0.98 0.00 0.00 173.24 175.88 3hie h ALA 203 N 2.13 1.32 -0.36 5.32 0.00 -1.92 -2.36 119.26 123.39 3hie h ALA 203 Ca -0.34 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.42 3hie h ALA 203 Cb 1.29 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3hie h ALA 203 CO 0.40 0.58 -0.00 -0.22 0.00 0.00 0.00 179.25 180.00 3hie h LYS 204 N 1.10 0.56 -0.22 0.00 1.63 -1.96 -1.34 116.57 116.34 3hie h LYS 204 Ca 0.29 -0.12 -0.18 0.00 -0.85 0.00 0.00 60.65 59.78 3hie h LYS 204 Cb -0.02 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.53 3hie h LYS 204 CO -0.05 0.58 -0.58 0.93 -3.45 0.00 0.00 179.45 176.88 3hie h GLU 205 N 0.53 0.71 0.40 1.90 5.08 -1.84 -0.90 114.58 120.47 3hie h GLU 205 Ca 0.11 -0.47 -0.02 0.00 -1.00 0.00 0.00 59.36 57.98 3hie h GLU 205 Cb 0.35 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3hie h GLU 205 CO 0.01 1.09 -0.19 -0.09 -1.00 0.00 0.00 179.01 178.83 3hie h ARG 206 N 0.54 -0.52 -0.30 2.33 9.65 -1.23 -0.49 114.38 124.36 3hie h ARG 206 Ca 0.00 0.04 0.07 0.00 -1.10 0.00 0.00 59.98 58.99 3hie h ARG 206 Cb 1.17 0.12 -0.08 0.00 -1.39 0.00 0.00 29.97 29.78 3hie h ARG 206 CO 0.12 -0.31 -0.32 1.15 2.80 0.00 0.00 179.97 183.41 3hie h THR 207 N -0.61 0.26 0.12 0.20 2.02 -1.11 -0.77 112.91 113.03 3hie h THR 207 Ca -0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 3hie h THR 207 Cb 0.45 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 3hie h THR 207 CO 0.09 0.00 -0.06 0.58 0.37 0.00 0.00 175.52 176.50 3hie h VAL 208 N -0.30 0.89 -0.12 3.16 2.07 -1.13 -2.53 116.25 118.29 3hie h VAL 208 Ca 0.14 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.61 3hie h VAL 208 Cb 0.53 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3hie h VAL 208 CO -0.46 0.01 0.05 0.15 0.02 0.00 0.00 177.57 177.35 3hie h PHE 209 N -0.19 0.10 -0.90 1.57 3.04 -0.82 -1.38 116.94 118.35 3hie h PHE 209 Ca -0.02 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.94 3hie h PHE 209 Cb 0.15 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.59 3hie h PHE 209 CO -0.06 0.06 0.55 0.82 -2.02 0.00 0.00 178.31 177.66 3hie h ILE 210 N 0.12 1.25 -0.29 1.41 1.08 -1.12 0.12 117.51 120.08 3hie h ILE 210 Ca 0.05 -0.53 -0.06 0.00 -0.39 0.00 0.00 64.86 63.93 3hie h ILE 210 Cb 0.01 -0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 33.73 3hie h ILE 210 CO -0.04 0.26 -0.07 0.50 -0.69 0.00 0.00 178.15 178.11 3hie h LYS 211 N 1.24 0.56 -0.61 2.37 3.64 -1.32 -1.62 116.57 120.83 3hie h LYS 211 Ca 0.32 -0.21 0.08 0.00 -1.27 0.00 0.00 60.65 59.57 3hie h LYS 211 Cb -0.06 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 31.66 3hie h LYS 211 CO -0.06 0.76 0.28 1.03 -2.27 0.00 0.00 179.45 179.18 3hie h SER 212 N 0.32 0.35 -0.07 4.20 0.87 -0.83 -1.49 113.55 116.91 3hie h SER 212 Ca 0.07 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 3hie h SER 212 Cb 0.55 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3hie h SER 212 CO 0.03 0.22 0.03 0.25 -0.53 0.00 0.00 176.83 176.82 3hie h LEU 213 N 0.50 0.09 -0.43 2.23 5.85 -0.49 -2.29 115.31 120.77 3hie h LEU 213 Ca 0.29 -0.17 -0.16 0.00 0.84 0.00 0.00 57.88 58.68 3hie h LEU 213 Cb 0.29 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 3hie h LEU 213 CO -0.25 0.23 -0.47 0.40 -0.34 0.00 0.00 178.44 178.01 3hie h ILE 214 N -0.06 1.29 -0.43 4.05 2.04 -1.20 -1.79 117.51 121.42 3hie h ILE 214 Ca 0.02 -1.66 -0.08 0.00 1.00 0.00 0.00 64.86 64.13 3hie h ILE 214 Cb 0.17 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 3hie h ILE 214 CO -0.00 0.54 -0.08 0.71 0.00 0.00 0.00 178.15 179.32 3hie h THR 215 N 0.62 1.25 -0.33 -0.27 1.35 -1.29 -1.29 112.91 112.95 3hie h THR 215 Ca 0.03 -1.10 -0.02 0.00 -0.55 0.00 0.00 66.41 64.77 3hie h THR 215 Cb 1.05 1.01 -0.01 0.00 -1.73 0.00 0.00 68.15 68.47 3hie h THR 215 CO 0.10 0.38 0.12 -0.07 -0.25 0.00 0.00 175.52 175.80 3hie h LEU 216 N 0.68 0.47 -0.53 3.87 3.38 -1.28 -1.60 115.31 120.30 3hie h LEU 216 Ca 0.12 -0.18 0.08 0.00 0.09 0.00 0.00 57.88 57.99 3hie h LEU 216 Cb 0.54 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 3hie h LEU 216 CO 0.03 0.52 0.17 0.22 0.09 0.00 0.00 178.44 179.47 3hie h TYR 217 N 0.39 0.29 -0.18 1.13 5.03 -1.07 -0.65 116.97 121.91 3hie h TYR 217 Ca 0.11 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.42 3hie h TYR 217 Cb 0.21 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.43 3hie h TYR 217 CO 0.00 0.07 -0.02 0.82 -1.32 0.00 0.00 178.16 177.71 3hie h ILE 218 N 0.34 1.13 0.00 1.81 2.04 -0.97 -1.10 117.51 120.76 3hie h ILE 218 Ca 0.26 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3hie h ILE 218 Cb 0.31 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3hie h ILE 218 CO -0.28 0.17 0.00 0.00 0.00 0.00 0.00 178.15 178.03 3hie n GLN 219 N -4.37 0.23 0.10 2.37 6.02 -0.31 -2.31 117.38 119.12 3hie n GLN 219 Ca -0.00 0.37 0.13 0.00 -0.01 0.00 0.00 57.00 57.49 3hie n GLN 219 Cb 0.19 -1.88 0.32 0.00 1.02 0.00 0.00 30.24 29.89 3hie n GLN 219 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 3hie h THR 220 N 0.00 0.00 -3.48 5.09 1.35 -0.57 -3.47 112.91 111.83 3hie h THR 220 Ca 0.00 -0.53 -0.56 0.00 -0.55 0.00 0.00 66.41 64.77 3hie h THR 220 Cb 0.48 1.41 0.11 0.00 -1.73 0.00 0.00 68.15 68.42 3hie h THR 220 CO 0.00 0.00 0.57 0.49 -0.25 0.00 0.00 175.52 176.33 3hie n PHE 221 N -2.29 2.44 -3.35 4.73 0.99 -0.98 -4.96 117.46 114.04 3hie n PHE 221 Ca 0.05 0.52 -0.40 0.00 -0.00 0.00 0.00 57.45 57.62 3hie n PHE 221 Cb 0.44 -2.44 -0.09 0.00 -1.00 0.00 0.00 39.48 36.40 3hie n PHE 221 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 3hie s GLU 222 N -1.96 3.86 3.17 -1.08 0.41 -1.26 -4.97 118.70 116.86 3hie s GLU 222 Ca 0.55 -0.07 0.00 0.00 -0.41 0.00 0.00 54.97 55.05 3hie s GLU 222 Cb -0.54 -3.71 0.00 0.00 -1.78 0.00 0.00 34.13 28.09 3hie s GLU 222 CO 0.62 -0.40 0.00 0.41 -0.49 0.00 0.00 175.26 175.40 3hie n GLY 223 N 4.74 0.29 3.20 -1.39 0.00 -1.26 -4.62 105.19 106.15 3hie n GLY 223 Ca -0.07 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 3hie n GLY 223 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3hie s HIS 224 N 0.00 3.44 -0.46 1.61 2.46 -1.26 -4.97 115.29 116.11 3hie s HIS 224 Ca 0.00 -1.92 0.09 0.00 0.47 0.00 0.00 55.06 53.70 3hie s HIS 224 Cb 0.00 -3.46 0.33 0.00 -0.13 0.00 0.00 32.58 29.32 3hie s HIS 224 CO 0.00 -0.99 0.78 1.33 -2.47 0.00 0.00 174.74 173.39 3hie n VAL 225 N 4.88 1.03 0.21 0.89 0.24 -1.26 -4.90 118.33 119.42 3hie n VAL 225 Ca -0.07 -4.90 0.06 0.00 -2.04 0.00 0.00 64.34 57.39 3hie n VAL 225 Cb 0.41 -0.98 0.46 0.00 -1.47 0.00 0.00 33.84 32.26 3hie n VAL 225 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3hie h PRO 226 N 3.21 0.00 0.00 7.34 0.13 -1.96 -2.98 132.00 137.73 3hie h PRO 226 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.24 3hie h PRO 226 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 3hie h PRO 226 CO 0.63 0.28 -0.03 1.05 -0.23 0.00 0.00 178.00 179.70 3hie h GLU 227 N 0.00 0.00 0.00 0.86 9.09 -2.04 -1.05 114.58 121.43 3hie h GLU 227 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hie h GLU 227 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 3hie h GLU 227 CO 0.04 0.03 -0.18 -0.07 0.05 0.00 0.00 179.01 178.87 3hie h LEU 228 N 0.00 0.00 -9.38 3.06 3.38 -1.95 -3.46 115.31 106.96 3hie h LEU 228 Ca -0.00 -0.01 -0.55 0.00 0.09 0.00 0.00 57.88 57.41 3hie h LEU 228 Cb 0.22 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3hie h LEU 228 CO 0.00 0.01 0.33 -0.69 0.09 0.00 0.00 178.44 178.18 3hie s VAL 229 N -3.21 4.90 -0.05 1.22 1.01 -0.40 -5.05 120.40 118.81 3hie s VAL 229 Ca 0.07 1.93 0.04 0.00 0.00 0.00 0.00 61.98 64.02 3hie s VAL 229 Cb 0.08 -4.26 -0.00 0.00 0.00 0.00 0.00 36.38 32.19 3hie s VAL 229 CO 0.68 0.16 -0.17 0.20 0.00 0.00 0.00 175.10 175.97 3hie s ASN 230 N 0.98 2.19 0.38 3.32 0.01 -1.26 -5.05 114.94 115.51 3hie s ASN 230 Ca 0.49 -0.36 -0.16 0.00 -0.71 0.00 0.00 52.86 52.11 3hie s ASN 230 Cb -0.20 -0.71 0.06 0.00 0.41 0.00 0.00 41.25 40.81 3hie s ASN 230 CO 0.25 0.14 0.81 -1.66 -1.51 0.00 0.00 177.10 175.13 3hie s TRP 231 N 0.16 0.14 -0.27 2.20 -2.14 -1.26 -5.05 118.94 112.71 3hie s TRP 231 Ca -0.07 -0.81 0.08 0.00 2.66 0.00 0.00 56.10 57.96 3hie s TRP 231 Cb -0.13 0.84 0.45 0.00 -3.10 0.00 0.00 33.47 31.53 3hie s TRP 231 CO 0.03 -1.55 1.24 -0.40 -2.66 0.00 0.00 176.95 173.60 3hie n ASP 232 N -1.46 3.83 -4.75 -2.66 5.75 -1.26 -5.05 116.55 110.96 3hie n ASP 232 Ca -0.08 -3.81 -0.40 0.00 -0.01 0.00 0.00 54.79 50.49 3hie n ASP 232 Cb 0.60 -0.43 -0.05 0.00 -1.03 0.00 0.00 41.12 40.20 3hie n ASP 232 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 3hie s LEU 233 N -3.47 4.50 0.00 -2.12 0.20 -1.26 -4.93 118.68 111.60 3hie s LEU 233 Ca 0.47 1.59 0.00 0.00 0.69 0.00 0.00 54.13 56.88 3hie s LEU 233 Cb 0.40 -3.35 0.00 0.00 -0.43 0.00 0.00 46.19 42.81 3hie s LEU 233 CO 0.00 0.04 0.00 -1.54 -0.29 0.00 0.00 176.35 174.56 3hie n SER 234 N 2.53 0.52 -3.91 3.68 3.41 -1.26 -5.07 113.62 113.51 3hie n SER 234 Ca -0.02 -0.23 -0.14 0.00 -0.26 0.00 0.00 58.87 58.22 3hie n SER 234 Cb 0.50 0.57 -0.14 0.00 -0.26 0.00 0.00 64.21 64.87 3hie n SER 234 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hie s LEU 235 N -1.23 1.94 -0.09 1.04 2.96 -1.26 -5.14 118.68 116.90 3hie s LEU 235 Ca 0.00 -0.05 -0.04 0.00 -0.22 0.00 0.00 54.13 53.82 3hie s LEU 235 Cb 0.00 -0.16 0.04 0.00 0.50 0.00 0.00 46.19 46.58 3hie s LEU 235 CO 0.00 0.03 0.21 0.12 -1.32 0.00 0.00 176.35 175.39 3hie s PHE 236 N 0.01 -0.27 0.26 5.38 2.19 -1.26 -5.16 117.98 119.12 3hie s PHE 236 Ca 0.00 0.68 -0.18 0.00 0.33 0.00 0.00 56.93 57.76 3hie s PHE 236 Cb -0.02 -0.01 0.02 0.00 -1.31 0.00 0.00 43.02 41.69 3hie s PHE 236 CO -0.00 -0.22 0.63 1.52 1.83 0.00 0.00 175.22 178.98 3hie s TYR 237 N 1.33 -0.04 -0.31 10.12 1.13 -1.26 -5.15 117.35 123.17 3hie s TYR 237 Ca -0.08 -0.37 -0.11 0.00 -1.41 0.00 0.00 57.07 55.09 3hie s TYR 237 Cb -0.11 0.53 -0.02 0.00 -1.10 0.00 0.00 41.96 41.26 3hie s TYR 237 CO -0.08 -1.13 0.19 -0.51 -2.51 0.00 0.00 175.55 171.52 3hie s LEU 238 N -2.94 4.22 0.75 -3.49 2.01 -1.26 -5.09 118.68 112.88 3hie s LEU 238 Ca 0.14 -0.36 -0.11 0.00 0.01 0.00 0.00 54.13 53.81 3hie s LEU 238 Cb -0.04 -2.08 0.04 0.00 0.01 0.00 0.00 46.19 44.13 3hie s LEU 238 CO 0.06 -0.17 1.08 -1.81 1.01 0.00 0.00 176.35 176.52 3hie s ASP 239 N 1.69 4.80 0.19 2.29 1.01 -1.26 -5.06 116.67 120.33 3hie s ASP 239 Ca 0.06 1.69 -0.04 0.00 0.71 0.00 0.00 52.55 54.97 3hie s ASP 239 Cb -0.17 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 3hie s ASP 239 CO 0.09 -1.83 0.43 -1.61 0.21 0.00 0.00 175.17 172.46 3hie s GLU 240 N -4.98 3.61 0.00 8.23 0.41 -1.26 -5.36 118.70 119.35 3hie s GLU 240 Ca 0.60 -0.11 0.19 0.00 -0.41 0.00 0.00 54.97 55.25 3hie s GLU 240 Cb -0.16 -2.79 1.15 0.00 -1.78 0.00 0.00 34.13 30.56 3hie s GLU 240 CO 0.56 0.39 1.55 2.89 -0.49 0.00 0.00 175.26 180.15