#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mie s GLN 6 N 0.00 0.50 0.56 -1.09 -2.07 -1.26 -4.33 119.66 111.96 1mie s GLN 6 Ca 0.00 -0.73 -0.21 0.00 -1.82 0.00 0.00 55.36 52.60 1mie s GLN 6 Cb 0.00 -0.25 -0.05 0.00 -1.09 0.00 0.00 33.01 31.62 1mie s GLN 6 CO 0.00 0.04 1.19 -0.35 -1.32 0.00 0.00 175.29 174.85 1mie n PRO 7 N 1.50 1.35 -0.24 9.60 -0.04 -1.26 -4.60 135.00 141.32 1mie n PRO 7 Ca -0.23 0.50 -0.07 0.00 -0.04 0.00 0.00 63.50 63.67 1mie n PRO 7 Cb 0.55 -2.38 0.06 0.00 -0.04 0.00 0.00 33.50 31.70 1mie n PRO 7 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1mie h GLY 8 N 1.08 1.18 -3.38 0.55 0.00 -1.95 -3.29 103.07 97.26 1mie h GLY 8 Ca -0.49 -0.75 -0.09 0.00 0.00 0.00 0.00 47.33 46.00 1mie h GLY 8 CO 0.55 0.70 -0.36 0.00 0.00 0.00 0.00 176.54 177.43 1mie s ALA 9 N -5.27 -0.31 -0.22 3.60 0.00 -1.26 -1.49 121.76 116.81 1mie s ALA 9 Ca -0.12 -0.48 -0.04 0.00 0.00 0.00 0.00 51.96 51.33 1mie s ALA 9 Cb 0.15 0.43 0.11 0.00 0.00 0.00 0.00 23.12 23.81 1mie s ALA 9 CO 0.84 -0.47 0.34 -1.21 0.00 0.00 0.00 175.76 175.26 1mie s GLU 10 N -3.47 0.29 -1.07 0.00 0.41 -0.97 -4.80 118.70 109.09 1mie s GLU 10 Ca 0.02 0.55 -0.13 0.00 -0.41 0.00 0.00 54.97 55.00 1mie s GLU 10 Cb 0.03 -0.48 0.21 0.00 -1.78 0.00 0.00 34.13 32.11 1mie s GLU 10 CO -0.09 -0.55 1.16 -1.17 -0.49 0.00 0.00 175.26 174.12 1mie s LEU 11 N 2.49 5.80 0.01 1.80 2.96 -1.26 -1.71 118.68 128.78 1mie s LEU 11 Ca 0.08 -3.02 -0.24 0.00 -0.22 0.00 0.00 54.13 50.73 1mie s LEU 11 Cb -0.15 -2.30 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 1mie s LEU 11 CO -0.14 -0.60 0.72 -0.69 -1.32 0.00 0.00 176.35 174.32 1mie s VAL 12 N 0.49 4.83 0.52 1.68 1.01 -1.05 -4.91 120.40 122.96 1mie s VAL 12 Ca 0.33 1.52 -0.20 0.00 0.00 0.00 0.00 61.98 63.63 1mie s VAL 12 Cb -0.07 -4.06 -0.07 0.00 0.00 0.00 0.00 36.38 32.18 1mie s VAL 12 CO -0.06 0.35 1.11 -0.54 0.00 0.00 0.00 175.10 175.96 1mie s LYS 13 N 0.08 3.49 0.19 2.72 1.02 -1.25 -2.20 119.74 123.79 1mie s LYS 13 Ca 0.37 1.55 -0.32 0.00 0.02 0.00 0.00 55.97 57.59 1mie s LYS 13 Cb -0.19 -2.05 -0.12 0.00 -0.52 0.00 0.00 37.83 34.95 1mie s LYS 13 CO 0.21 -0.72 1.73 -0.35 -0.92 0.00 0.00 175.35 175.30 1mie n PRO 14 N -1.17 2.71 0.00 -1.68 -0.04 -1.26 -1.34 135.00 132.22 1mie n PRO 14 Ca 0.11 0.98 0.00 0.00 -0.04 0.00 0.00 63.50 64.55 1mie n PRO 14 Cb 0.51 -2.83 0.00 0.00 -0.04 0.00 0.00 33.50 31.15 1mie n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1mie n GLY 15 N 3.96 2.91 3.49 0.55 0.00 0.32 -4.90 105.19 111.52 1mie n GLY 15 Ca 0.17 -0.23 -0.31 0.00 0.00 0.00 0.00 46.02 45.65 1mie n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mie s ALA 16 N -2.10 0.19 0.31 4.61 0.00 -0.45 -3.20 121.76 121.12 1mie s ALA 16 Ca 0.00 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 50.99 1mie s ALA 16 Cb 0.00 -2.85 -0.06 0.00 0.00 0.00 0.00 23.12 20.20 1mie s ALA 16 CO 0.00 -4.01 -0.02 -1.12 0.00 0.00 0.00 175.76 170.61 1mie s SER 17 N -3.79 2.84 -0.09 0.00 0.01 -1.26 -1.09 113.70 110.32 1mie s SER 17 Ca 0.71 -1.26 -0.07 0.00 1.31 0.00 0.00 55.95 56.65 1mie s SER 17 Cb -0.09 -0.18 0.03 0.00 0.21 0.00 0.00 66.02 65.99 1mie s SER 17 CO 0.56 -0.42 0.23 0.54 0.41 0.00 0.00 173.24 174.56 1mie s VAL 18 N -3.03 -0.02 -0.41 3.43 0.11 0.98 -4.94 120.40 116.51 1mie s VAL 18 Ca 0.32 0.07 -0.10 0.00 -2.93 0.00 0.00 61.98 59.34 1mie s VAL 18 Cb 0.06 -0.34 0.07 0.00 -1.53 0.00 0.00 36.38 34.63 1mie s VAL 18 CO 0.14 0.03 0.26 -0.75 -3.33 0.00 0.00 175.10 171.45 1mie s LYS 19 N 0.65 2.70 0.01 1.54 2.20 -1.26 -0.70 119.74 124.88 1mie s LYS 19 Ca -0.04 -1.35 -0.11 0.00 -0.36 0.00 0.00 55.97 54.10 1mie s LYS 19 Cb -0.06 -3.81 -0.05 0.00 -1.51 0.00 0.00 37.83 32.40 1mie s LYS 19 CO -0.04 -0.90 0.36 -0.51 -0.36 0.00 0.00 175.35 173.91 1mie s LEU 20 N 1.48 4.41 0.33 5.43 1.43 -0.65 -4.97 118.68 126.14 1mie s LEU 20 Ca 0.03 0.81 0.09 0.00 -1.03 0.00 0.00 54.13 54.03 1mie s LEU 20 Cb -0.22 -2.67 -0.05 0.00 0.03 0.00 0.00 46.19 43.28 1mie s LEU 20 CO 0.04 0.28 0.01 -0.94 0.23 0.00 0.00 176.35 175.96 1mie s SER 21 N -1.36 4.22 0.00 2.29 1.04 -1.26 -1.90 113.70 116.73 1mie s SER 21 Ca 0.26 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1mie s SER 21 Cb -0.15 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.41 1mie s SER 21 CO 0.14 -0.21 0.00 0.00 0.98 0.00 0.00 173.24 174.15 1mie n TRP 33 N 0.00 0.00 -3.77 0.00 5.03 -1.25 -3.80 117.44 113.65 1mie n TRP 33 Ca 0.00 0.00 -0.35 0.00 3.03 0.00 0.00 57.50 60.18 1mie n TRP 33 Cb 0.00 0.00 -0.11 0.00 -1.03 0.00 0.00 31.31 30.17 1mie n TRP 33 CO 0.00 0.00 0.00 0.42 -0.03 0.00 0.00 177.69 178.08 1mie s ILE 34 N 0.00 3.42 0.81 -0.99 -1.09 -0.18 -4.48 121.20 118.70 1mie s ILE 34 Ca 0.00 -2.79 -0.11 0.00 -2.23 0.00 0.00 60.65 55.52 1mie s ILE 34 Cb 0.00 -3.28 0.08 0.00 -1.58 0.00 0.00 42.46 37.68 1mie s ILE 34 CO 0.00 -0.82 1.09 0.20 -1.23 0.00 0.00 174.94 174.18 1mie s ASN 35 N 0.81 4.24 -0.02 3.58 0.01 0.88 -2.43 114.94 122.01 1mie s ASN 35 Ca 0.15 1.53 0.00 0.00 -0.71 0.00 0.00 52.86 53.83 1mie s ASN 35 Cb -0.21 -2.25 0.02 0.00 0.41 0.00 0.00 41.25 39.21 1mie s ASN 35 CO -0.03 -2.16 0.02 0.26 -1.51 0.00 0.00 177.10 173.67 1mie s TRP 36 N -3.00 0.08 -0.02 2.20 0.52 -1.08 -1.47 118.94 116.17 1mie s TRP 36 Ca 0.61 0.08 0.06 0.00 0.02 0.00 0.00 56.10 56.87 1mie s TRP 36 Cb -0.16 -0.22 -0.01 0.00 -1.15 0.00 0.00 33.47 31.92 1mie s TRP 36 CO 0.56 -0.08 -0.20 0.08 0.02 0.00 0.00 176.95 177.33 1mie s VAL 37 N 0.83 1.62 0.03 4.03 1.01 -0.39 -0.58 120.40 126.95 1mie s VAL 37 Ca -0.07 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1mie s VAL 37 Cb -0.10 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.88 1mie s VAL 37 CO -0.02 0.46 0.00 -0.75 0.00 0.00 0.00 175.10 174.79 1mie s LYS 38 N -0.40 2.72 -0.27 2.72 2.20 0.71 -1.98 119.74 125.45 1mie s LYS 38 Ca 0.06 -0.68 -0.02 0.00 -0.36 0.00 0.00 55.97 54.96 1mie s LYS 38 Cb -0.09 -2.63 0.16 0.00 -1.51 0.00 0.00 37.83 33.76 1mie s LYS 38 CO -0.00 0.60 0.48 -1.14 -0.36 0.00 0.00 175.35 174.93 1mie s GLN 39 N -1.78 0.45 0.09 4.03 0.74 -0.56 -1.01 119.66 121.61 1mie s GLN 39 Ca 0.21 0.77 -0.30 0.00 0.05 0.00 0.00 55.36 56.09 1mie s GLN 39 Cb -0.12 0.01 -0.06 0.00 1.10 0.00 0.00 33.01 33.95 1mie s GLN 39 CO 0.13 -0.61 1.15 1.03 -0.55 0.00 0.00 175.29 176.43 1mie s ARG 40 N 2.69 4.49 0.05 1.67 1.81 -1.26 -0.70 118.95 127.70 1mie s ARG 40 Ca 0.15 1.72 -0.37 0.00 -1.72 0.00 0.00 55.73 55.51 1mie s ARG 40 Cb -0.15 -3.34 -0.19 0.00 -0.45 0.00 0.00 34.95 30.82 1mie s ARG 40 CO -0.18 -0.14 1.00 -2.30 -0.68 0.00 0.00 175.30 173.00 1mie n PRO 41 N 3.47 0.18 -0.80 3.54 -0.02 -1.26 0.21 135.00 140.32 1mie n PRO 41 Ca 0.07 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1mie n PRO 41 Cb 0.47 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 1mie n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mie n GLY 42 N 1.71 1.33 1.74 -1.23 0.00 -1.26 -5.00 105.19 102.48 1mie n GLY 42 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1mie n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1mie n GLN 43 N -2.00 1.20 -0.09 1.61 1.13 0.13 -5.16 117.38 114.20 1mie n GLN 43 Ca 0.00 -1.63 0.00 0.00 -1.94 0.00 0.00 57.00 53.43 1mie n GLN 43 Cb 0.00 0.25 0.00 0.00 0.11 0.00 0.00 30.24 30.60 1mie n GLN 43 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1mie n GLY 44 N 1.99 0.18 3.48 1.08 0.00 -1.26 -4.72 105.19 105.94 1mie n GLY 44 Ca -0.03 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 1mie n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mie s LEU 45 N 0.00 2.67 -0.05 0.99 1.43 -1.26 -4.17 118.68 118.29 1mie s LEU 45 Ca 0.00 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.56 1mie s LEU 45 Cb 0.00 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.71 1mie s LEU 45 CO 0.00 0.18 -0.09 -1.61 0.23 0.00 0.00 176.35 175.06 1mie s GLU 46 N -2.10 1.31 -0.33 1.70 2.02 -0.18 -4.96 118.70 116.16 1mie s GLU 46 Ca 0.18 -0.30 -0.27 0.00 0.02 0.00 0.00 54.97 54.60 1mie s GLU 46 Cb -0.11 -1.15 0.01 0.00 0.10 0.00 0.00 34.13 32.99 1mie s GLU 46 CO 0.10 0.01 0.97 -0.46 0.02 0.00 0.00 175.26 175.90 1mie s TRP 47 N 0.66 3.15 0.03 1.61 -0.00 -1.26 -0.21 118.94 122.92 1mie s TRP 47 Ca -0.12 1.01 -0.10 0.00 -0.00 0.00 0.00 56.10 56.89 1mie s TRP 47 Cb -0.14 -3.57 -0.32 0.00 -0.00 0.00 0.00 33.47 29.44 1mie s TRP 47 CO 0.02 -0.73 0.98 0.82 -0.00 0.00 0.00 176.95 178.04 1mie h ILE 48 N 5.72 1.28 0.00 5.86 2.04 -1.21 -3.44 117.51 127.76 1mie h ILE 48 Ca -0.22 -2.80 0.00 0.00 1.00 0.00 0.00 64.86 62.84 1mie h ILE 48 Cb 1.07 2.94 0.00 0.00 -0.74 0.00 0.00 36.82 40.10 1mie h ILE 48 CO 0.99 0.84 0.00 0.61 0.00 0.00 0.00 178.15 180.59 1mie n GLY 49 N 1.68 4.04 3.53 5.37 0.00 -1.23 -0.89 105.19 117.67 1mie n GLY 49 Ca -0.15 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.80 1mie n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mie s ASN 50 N 0.00 5.34 0.30 1.61 4.22 -0.87 -2.63 114.94 122.90 1mie s ASN 50 Ca 0.00 -0.08 0.07 0.00 -2.14 0.00 0.00 52.86 50.71 1mie s ASN 50 Cb 0.00 -1.94 -0.03 0.00 1.28 0.00 0.00 41.25 40.57 1mie s ASN 50 CO 0.00 0.06 0.30 0.54 -2.04 0.00 0.00 177.10 175.96 1mie s VAL 51 N 1.06 4.06 -0.27 3.54 0.11 -1.02 -2.06 120.40 125.82 1mie s VAL 51 Ca 0.04 -1.29 -0.03 0.00 -2.93 0.00 0.00 61.98 57.78 1mie s VAL 51 Cb -0.14 -3.35 0.09 0.00 -1.53 0.00 0.00 36.38 31.45 1mie s VAL 51 CO 0.03 -0.24 0.10 -0.47 -3.33 0.00 0.00 175.10 171.19 1mie s TYR 52 N -2.20 0.90 0.38 1.54 5.04 -1.09 -1.01 117.35 120.92 1mie s TYR 52 Ca 0.38 -1.10 0.13 0.00 -2.44 0.00 0.00 57.07 54.04 1mie s TYR 52 Cb -0.07 -1.17 0.94 0.00 0.35 0.00 0.00 41.96 42.00 1mie s TYR 52 CO 0.27 -0.77 1.87 -1.35 -1.34 0.00 0.00 175.55 174.22 1mie h PRO 52 N 8.27 0.54 -0.78 4.97 0.11 -1.94 0.38 132.00 143.56 1mie h PRO 52 Ca -0.17 -0.03 0.18 0.00 0.11 0.00 0.00 66.00 66.09 1mie h PRO 52 Cb 1.05 -0.12 -0.14 0.00 0.11 0.00 0.00 31.00 31.90 1mie h PRO 52 CO 0.42 0.36 -0.03 0.78 -0.21 0.00 0.00 178.00 179.32 1mie h GLY 53 N 0.56 0.83 -1.10 -0.55 0.00 -1.99 -2.93 103.07 97.89 1mie h GLY 53 Ca 0.45 0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.88 1mie h GLY 53 CO -0.19 -0.31 -0.46 -1.14 0.00 0.00 0.00 176.54 174.44 1mie n SER 54 N -5.38 1.18 -3.13 0.19 3.41 -0.99 -4.97 113.62 103.93 1mie n SER 54 Ca 0.14 -2.65 -0.18 0.00 -0.26 0.00 0.00 58.87 55.93 1mie n SER 54 Cb 0.48 -0.34 -0.01 0.00 -0.26 0.00 0.00 64.21 64.08 1mie n SER 54 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1mie n SER 55 N -0.52 -2.75 -4.58 4.04 3.41 0.13 -4.82 113.62 108.54 1mie n SER 55 Ca 0.09 -0.16 -0.41 0.00 -0.26 0.00 0.00 58.87 58.13 1mie n SER 55 Cb 0.77 -2.35 -0.01 0.00 -0.26 0.00 0.00 64.21 62.36 1mie n SER 55 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1mie s SER 56 N -2.48 6.60 0.20 4.04 0.15 -0.71 -4.84 113.70 116.66 1mie s SER 56 Ca 0.28 -2.24 -0.30 0.00 0.70 0.00 0.00 55.95 54.39 1mie s SER 56 Cb -0.15 -2.58 -0.08 0.00 -1.71 0.00 0.00 66.02 61.50 1mie s SER 56 CO 0.35 -1.42 0.98 0.42 1.20 0.00 0.00 173.24 174.77 1mie s THR 57 N 5.07 4.12 -0.16 6.45 -4.23 -1.26 -2.66 115.64 122.97 1mie s THR 57 Ca 0.55 1.98 -0.00 0.00 -1.18 0.00 0.00 61.69 63.03 1mie s THR 57 Cb 0.03 -4.26 0.04 0.00 1.34 0.00 0.00 72.50 69.65 1mie s THR 57 CO 0.06 0.41 -0.06 0.21 -0.54 0.00 0.00 174.62 174.71 1mie s ASN 58 N -0.69 2.82 0.20 3.99 3.84 -0.88 -5.00 114.94 119.23 1mie s ASN 58 Ca 0.44 -0.65 0.06 0.00 0.21 0.00 0.00 52.86 52.91 1mie s ASN 58 Cb -0.26 -0.92 -0.04 0.00 -0.55 0.00 0.00 41.25 39.48 1mie s ASN 58 CO 0.32 -0.18 0.19 -0.31 -2.79 0.00 0.00 177.10 174.34 1mie s TYR 59 N 1.63 3.19 -0.02 0.43 1.51 -1.26 -2.05 117.35 120.77 1mie s TYR 59 Ca 0.01 -0.04 -0.21 0.00 -1.01 0.00 0.00 57.07 55.82 1mie s TYR 59 Cb -0.15 -1.49 -0.05 0.00 -0.11 0.00 0.00 41.96 40.16 1mie s TYR 59 CO -0.08 0.51 0.62 1.21 -1.11 0.00 0.00 175.55 176.70 1mie s ASN 60 N -3.48 6.98 0.25 2.29 3.84 -0.07 -4.85 114.94 119.89 1mie s ASN 60 Ca 0.32 1.16 -0.08 0.00 0.21 0.00 0.00 52.86 54.47 1mie s ASN 60 Cb -0.09 -2.37 0.41 0.00 -0.55 0.00 0.00 41.25 38.64 1mie s ASN 60 CO 0.25 0.05 1.61 -0.33 -2.79 0.00 0.00 177.10 175.90 1mie h GLU 61 N 5.89 0.04 -0.29 0.43 4.39 -1.95 0.70 114.58 123.79 1mie h GLU 61 Ca -0.44 -0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.34 1mie h GLU 61 Cb 1.20 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1mie h GLU 61 CO 0.71 0.03 0.27 0.87 -1.16 0.00 0.00 179.01 179.73 1mie h LYS 62 N 0.04 0.00 0.00 2.33 1.57 -1.95 -2.68 116.57 115.88 1mie h LYS 62 Ca 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 1mie h LYS 62 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1mie h LYS 62 CO -0.75 0.00 -1.07 1.19 -0.57 0.00 0.00 179.45 178.25 1mie n PHE 63 N -3.98 0.00 -0.25 -1.35 3.72 0.74 -4.65 117.46 111.69 1mie n PHE 63 Ca 0.04 0.00 0.22 0.00 -0.05 0.00 0.00 57.45 57.66 1mie n PHE 63 Cb 0.42 -0.14 0.41 0.00 -0.94 0.00 0.00 39.48 39.24 1mie n PHE 63 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1mie n LYS 64 N -1.61 -0.05 0.00 -1.08 2.85 0.21 0.29 118.16 118.77 1mie n LYS 64 Ca -0.00 1.10 0.12 0.00 -1.05 0.00 0.00 58.31 58.48 1mie n LYS 64 Cb 0.21 -1.92 0.30 0.00 -0.65 0.00 0.00 35.03 32.96 1mie n LYS 64 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1mie n ASN 65 N -4.84 0.69 -0.12 -5.58 5.15 -1.26 -4.37 115.26 104.93 1mie n ASN 65 Ca 0.27 -0.49 -0.26 0.00 -0.60 0.00 0.00 54.58 53.50 1mie n ASN 65 Cb 0.92 0.21 -0.10 0.00 -0.53 0.00 0.00 39.78 40.28 1mie n ASN 65 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1mie n LYS 66 N -1.19 0.58 -4.31 1.20 3.00 0.82 -5.04 118.16 113.22 1mie n LYS 66 Ca 0.08 0.37 -0.25 0.00 -0.00 0.00 0.00 58.31 58.51 1mie n LYS 66 Cb 0.34 -1.58 -0.09 0.00 0.00 0.00 0.00 35.03 33.71 1mie n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mie s ALA 67 N -2.48 3.00 -0.25 3.14 0.00 -0.09 -4.24 121.76 120.84 1mie s ALA 67 Ca -0.35 -1.57 -0.02 0.00 0.00 0.00 0.00 51.96 50.02 1mie s ALA 67 Cb 0.11 -0.71 0.08 0.00 0.00 0.00 0.00 23.12 22.61 1mie s ALA 67 CO 0.51 0.38 0.07 0.99 0.00 0.00 0.00 175.76 177.72 1mie s THR 68 N -1.98 0.51 -1.20 0.00 2.01 -0.99 -4.72 115.64 109.26 1mie s THR 68 Ca 0.27 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.33 1mie s THR 68 Cb -0.08 -1.22 -0.07 0.00 0.01 0.00 0.00 72.50 71.15 1mie s THR 68 CO 0.17 -0.46 2.41 0.18 -0.69 0.00 0.00 174.62 176.23 1mie n LEU 69 N 5.03 6.40 -4.59 4.42 4.77 -1.26 -2.55 117.00 129.22 1mie n LEU 69 Ca -0.06 -3.52 -0.43 0.00 -0.03 0.00 0.00 56.01 51.97 1mie n LEU 69 Cb 0.45 -1.31 -0.04 0.00 -2.33 0.00 0.00 43.42 40.19 1mie n LEU 69 CO 0.11 1.10 0.77 0.42 -1.33 0.00 0.00 177.39 178.46 1mie s THR 70 N 3.07 4.53 0.00 -5.08 -4.23 -1.18 -4.78 115.64 107.97 1mie s THR 70 Ca 0.52 1.05 0.00 0.00 -1.18 0.00 0.00 61.69 62.09 1mie s THR 70 Cb 0.14 -4.38 0.00 0.00 1.34 0.00 0.00 72.50 69.59 1mie s THR 70 CO -0.03 -0.66 0.00 1.33 -0.54 0.00 0.00 174.62 174.72 1mie n VAL 71 N 6.17 0.00 -3.37 2.29 0.24 -1.26 -3.37 118.33 119.03 1mie n VAL 71 Ca 0.07 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.38 1mie n VAL 71 Cb 0.48 -1.93 -0.03 0.00 -1.47 0.00 0.00 33.84 30.89 1mie n VAL 71 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1mie s ASP 72 N -1.03 -1.21 0.15 -1.34 -1.08 -0.76 -4.86 116.67 106.53 1mie s ASP 72 Ca 0.00 1.14 -0.07 0.00 -0.52 0.00 0.00 52.55 53.09 1mie s ASP 72 Cb 0.00 2.17 -0.00 0.00 -1.46 0.00 0.00 42.92 43.63 1mie s ASP 72 CO 0.00 -0.24 1.44 0.71 0.52 0.00 0.00 175.17 177.59 1mie h THR 73 N 6.01 1.30 -0.03 1.71 1.35 -1.94 0.88 112.91 122.20 1mie h THR 73 Ca -0.21 -1.81 -0.00 0.00 -0.55 0.00 0.00 66.41 63.84 1mie h THR 73 Cb 1.14 1.75 -0.00 0.00 -1.73 0.00 0.00 68.15 69.30 1mie h THR 73 CO 0.19 0.57 0.02 0.77 -0.25 0.00 0.00 175.52 176.82 1mie h SER 74 N 0.53 0.04 1.55 5.36 4.64 -1.96 -2.66 113.55 121.05 1mie h SER 74 Ca 0.00 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 1mie h SER 74 Cb 1.17 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1mie h SER 74 CO 0.12 0.13 -0.19 0.28 -0.87 0.00 0.00 176.83 176.30 1mie h SER 75 N -0.05 0.00 -5.13 4.97 0.02 -2.00 -3.47 113.55 107.90 1mie h SER 75 Ca 0.01 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.62 1mie h SER 75 Cb 0.10 0.00 0.12 0.00 0.14 0.00 0.00 62.40 62.76 1mie h SER 75 CO -0.00 0.19 -0.58 -0.24 -1.14 0.00 0.00 176.83 175.05 1mie n SER 76 N -3.19 -5.53 -4.03 3.07 2.88 0.25 -5.00 113.62 102.06 1mie n SER 76 Ca 0.02 -0.46 -0.14 0.00 -1.33 0.00 0.00 58.87 56.96 1mie n SER 76 Cb 0.55 -4.37 -0.12 0.00 -0.75 0.00 0.00 64.21 59.52 1mie n SER 76 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1mie s THR 77 N -3.27 0.50 0.38 2.46 -4.23 -0.86 -5.03 115.64 105.59 1mie s THR 77 Ca 0.47 -0.85 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 1mie s THR 77 Cb -0.21 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.05 1mie s THR 77 CO 0.62 -0.25 0.64 0.00 -0.54 0.00 0.00 174.62 175.10 1mie s ALA 78 N -1.04 3.56 0.10 3.99 0.00 -1.26 -1.83 121.76 125.28 1mie s ALA 78 Ca -0.07 -0.64 -0.04 0.00 0.00 0.00 0.00 51.96 51.21 1mie s ALA 78 Cb -0.08 -2.35 -0.03 0.00 0.00 0.00 0.00 23.12 20.66 1mie s ALA 78 CO 0.00 -0.06 0.09 0.71 0.00 0.00 0.00 175.76 176.51 1mie s TYR 79 N -2.40 0.53 -0.19 0.00 2.02 -1.22 -0.40 117.35 115.70 1mie s TYR 79 Ca 0.44 -0.97 -0.08 0.00 -0.37 0.00 0.00 57.07 56.08 1mie s TYR 79 Cb -0.10 -0.30 0.07 0.00 -0.40 0.00 0.00 41.96 41.24 1mie s TYR 79 CO 0.37 -0.51 0.43 1.41 -1.57 0.00 0.00 175.55 175.67 1mie s MET 80 N -3.96 0.37 -0.07 -0.62 -2.45 -0.80 -3.10 119.30 108.67 1mie s MET 80 Ca 0.14 0.93 0.00 0.00 -1.25 0.00 0.00 55.69 55.50 1mie s MET 80 Cb 0.06 0.15 -0.03 0.00 1.25 0.00 0.00 34.83 36.27 1mie s MET 80 CO -0.05 -0.20 -0.05 -1.14 1.05 0.00 0.00 175.02 174.63 1mie s GLN 81 N 1.99 2.83 0.52 4.11 0.74 -1.06 -1.64 119.66 127.16 1mie s GLN 81 Ca -0.06 -0.51 0.04 0.00 0.05 0.00 0.00 55.36 54.88 1mie s GLN 81 Cb -0.10 -2.65 0.01 0.00 1.10 0.00 0.00 33.01 31.37 1mie s GLN 81 CO -0.13 0.66 0.23 -0.51 -0.55 0.00 0.00 175.29 175.00 1mie s LEU 82 N -0.80 2.56 0.00 3.68 1.43 0.12 -2.35 118.68 123.32 1mie s LEU 82 Ca 0.12 -1.40 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 1mie s LEU 82 Cb -0.11 -1.02 0.00 0.00 0.03 0.00 0.00 46.19 45.09 1mie s LEU 82 CO 0.02 -0.98 0.00 -1.20 0.23 0.00 0.00 176.35 174.42 1mie n SER 82 N -1.54 0.00 -4.86 2.29 7.64 -0.76 -0.02 113.62 116.37 1mie n SER 82 Ca -0.09 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.47 1mie n SER 82 Cb 0.65 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.80 1mie n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1mie s LEU 82 N 0.00 4.15 0.25 -3.43 1.02 -0.25 -4.73 118.68 115.68 1mie s LEU 82 Ca 0.00 1.09 0.07 0.00 0.02 0.00 0.00 54.13 55.30 1mie s LEU 82 Cb 0.00 -3.80 -0.05 0.00 0.02 0.00 0.00 46.19 42.36 1mie s LEU 82 CO 0.00 -0.11 -0.09 0.28 0.02 0.00 0.00 176.35 176.46 1mie s THR 83 N -1.84 1.66 -0.48 5.49 -1.32 -1.26 -0.52 115.64 117.37 1mie s THR 83 Ca 0.49 -2.16 0.10 0.00 -1.21 0.00 0.00 61.69 58.92 1mie s THR 83 Cb -0.11 -2.30 0.10 0.00 -1.51 0.00 0.00 72.50 68.68 1mie s THR 83 CO 0.20 -0.40 1.27 -0.24 -2.21 0.00 0.00 174.62 173.23 1mie n SER 84 N -0.51 0.27 0.09 8.08 2.88 -1.26 0.26 113.62 123.43 1mie n SER 84 Ca -0.06 0.58 0.13 0.00 -1.33 0.00 0.00 58.87 58.19 1mie n SER 84 Cb 0.62 -0.60 0.45 0.00 -0.75 0.00 0.00 64.21 63.93 1mie n SER 84 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1mie n ASP 85 N -1.85 0.62 0.01 -3.46 2.03 -1.26 -2.79 116.55 109.85 1mie n ASP 85 Ca -0.01 0.58 0.11 0.00 0.52 0.00 0.00 54.79 56.00 1mie n ASP 85 Cb 0.09 -0.74 0.12 0.00 -0.72 0.00 0.00 41.12 39.87 1mie n ASP 85 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1mie n ASP 86 N -2.10 0.63 -4.67 1.67 8.00 0.73 -4.88 116.55 115.93 1mie n ASP 86 Ca 0.05 -0.33 -0.43 0.00 0.71 0.00 0.00 54.79 54.78 1mie n ASP 86 Cb 0.36 0.52 -0.03 0.00 -0.02 0.00 0.00 41.12 41.95 1mie n ASP 86 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1mie n SER 87 N -1.68 3.99 0.00 -2.24 7.64 -1.12 -4.86 113.62 115.35 1mie n SER 87 Ca 0.04 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1mie n SER 87 Cb 0.37 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.07 1mie n SER 87 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1mie n ALA 88 N 6.90 0.00 -2.69 -0.43 0.00 0.37 -4.73 120.51 119.94 1mie n ALA 88 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.26 1mie n ALA 88 Cb 0.38 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 1mie n ALA 88 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1mie s PHE 89 N -2.00 3.40 -0.25 0.00 0.40 0.12 0.37 117.98 120.02 1mie s PHE 89 Ca 0.00 0.63 -0.01 0.00 -0.60 0.00 0.00 56.93 56.95 1mie s PHE 89 Cb 0.00 -2.48 0.03 0.00 0.51 0.00 0.00 43.02 41.08 1mie s PHE 89 CO 0.00 0.06 -0.07 0.71 0.70 0.00 0.00 175.22 176.62 1mie s TYR 90 N 1.06 3.09 -0.12 0.36 1.51 -0.08 -1.49 117.35 121.68 1mie s TYR 90 Ca 0.19 -1.69 -0.04 0.00 -1.01 0.00 0.00 57.07 54.51 1mie s TYR 90 Cb -0.14 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.63 1mie s TYR 90 CO 0.07 -0.76 0.05 0.71 -1.11 0.00 0.00 175.55 174.51 1mie s TYR 91 N 1.29 3.28 -0.36 2.71 2.02 -0.84 -1.33 117.35 124.13 1mie s TYR 91 Ca -0.01 0.23 0.00 0.00 -0.37 0.00 0.00 57.07 56.91 1mie s TYR 91 Cb -0.17 -1.90 0.10 0.00 -0.40 0.00 0.00 41.96 39.59 1mie s TYR 91 CO -0.05 0.44 0.11 0.00 -1.57 0.00 0.00 175.55 174.48 1mie s VAL 93 N 1.07 5.34 -0.03 0.00 0.11 -0.54 -3.08 120.40 123.26 1mie s VAL 93 Ca 0.07 0.09 -0.01 0.00 -2.93 0.00 0.00 61.98 59.20 1mie s VAL 93 Cb -0.21 -3.56 -0.00 0.00 -1.53 0.00 0.00 36.38 31.08 1mie s VAL 93 CO -0.05 0.36 -0.02 -0.09 -3.33 0.00 0.00 175.10 171.97 1mie h ARG 94 N 3.96 0.00 -2.71 1.54 2.43 -1.84 0.25 114.38 118.01 1mie h ARG 94 Ca -0.50 0.00 -0.73 0.00 -0.81 0.00 0.00 59.98 57.94 1mie h ARG 94 Cb 1.20 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 30.64 1mie h ARG 94 CO 0.67 0.00 2.57 -0.35 -1.51 0.00 0.00 179.97 181.35 1mie n PRO 101 N -2.74 4.44 -3.28 0.20 -0.04 -1.26 -4.56 135.00 127.76 1mie n PRO 101 Ca -0.01 -3.32 -0.45 0.00 -0.04 0.00 0.00 63.50 59.69 1mie n PRO 101 Cb 0.02 -2.67 -0.06 0.00 -0.04 0.00 0.00 33.50 30.76 1mie n PRO 101 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1mie s TYR 102 N -0.68 3.18 0.12 0.54 2.02 -1.26 -5.06 117.35 116.21 1mie s TYR 102 Ca 0.55 -1.01 -0.30 0.00 -0.37 0.00 0.00 57.07 55.94 1mie s TYR 102 Cb 0.18 -3.59 -0.06 0.00 -0.40 0.00 0.00 41.96 38.08 1mie s TYR 102 CO -0.09 -1.00 1.08 -1.58 -1.57 0.00 0.00 175.55 172.40 1mie s TRP 103 N 1.94 3.61 0.39 2.71 0.52 -1.26 -4.09 118.94 122.75 1mie s TRP 103 Ca 0.06 1.59 -0.07 0.00 0.02 0.00 0.00 56.10 57.70 1mie s TRP 103 Cb -0.26 -3.24 0.09 0.00 -1.15 0.00 0.00 33.47 28.91 1mie s TRP 103 CO 0.06 -0.52 0.48 0.41 0.02 0.00 0.00 176.95 177.40 1mie n GLY 104 N 2.45 -1.55 0.14 0.98 0.00 -1.18 -4.96 105.19 101.07 1mie n GLY 104 Ca 0.04 -1.64 0.12 0.00 0.00 0.00 0.00 46.02 44.54 1mie n GLY 104 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1mie h GLN 105 N 0.00 0.00 0.00 1.61 3.07 -1.89 -3.46 115.11 114.44 1mie h GLN 105 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.58 1mie h GLN 105 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.01 1mie h GLN 105 CO 0.11 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.44 1mie n GLY 106 N 1.17 -2.24 3.24 0.06 0.00 -1.26 -4.99 105.19 101.17 1mie n GLY 106 Ca 0.01 -1.38 -0.30 0.00 0.00 0.00 0.00 46.02 44.35 1mie n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mie s THR 107 N -3.61 1.93 -0.46 2.61 2.01 -0.44 -4.42 115.64 113.26 1mie s THR 107 Ca 0.00 -0.99 -0.19 0.00 0.31 0.00 0.00 61.69 60.82 1mie s THR 107 Cb 0.00 -1.64 0.04 0.00 0.01 0.00 0.00 72.50 70.91 1mie s THR 107 CO 0.00 0.54 0.54 -0.22 -0.69 0.00 0.00 174.62 174.79 1mie s LEU 108 N -0.07 4.86 -0.14 4.42 2.96 -0.56 -0.91 118.68 129.24 1mie s LEU 108 Ca -0.05 -0.72 -0.21 0.00 -0.22 0.00 0.00 54.13 52.93 1mie s LEU 108 Cb -0.14 -2.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.05 1mie s LEU 108 CO 0.04 -0.73 0.61 -0.69 -1.32 0.00 0.00 176.35 174.26 1mie s VAL 109 N 2.43 5.07 -0.31 1.68 1.01 0.16 -2.30 120.40 128.13 1mie s VAL 109 Ca 0.15 1.20 0.03 0.00 0.00 0.00 0.00 61.98 63.37 1mie s VAL 109 Cb -0.17 -3.94 0.09 0.00 0.00 0.00 0.00 36.38 32.35 1mie s VAL 109 CO 0.14 0.20 0.00 -0.89 0.00 0.00 0.00 175.10 174.55 1mie s THR 110 N 1.30 2.18 -0.79 3.92 2.01 -0.69 -0.48 115.64 123.08 1mie s THR 110 Ca 0.30 -2.07 -0.24 0.00 0.31 0.00 0.00 61.69 59.99 1mie s THR 110 Cb -0.16 -2.51 0.06 0.00 0.01 0.00 0.00 72.50 69.90 1mie s THR 110 CO 0.12 -0.42 1.20 -0.69 -0.69 0.00 0.00 174.62 174.15 1mie s VAL 111 N 1.00 4.05 0.08 3.82 1.01 -1.26 -2.53 120.40 126.58 1mie s VAL 111 Ca 0.04 -0.27 -0.17 0.00 0.00 0.00 0.00 61.98 61.58 1mie s VAL 111 Cb -0.19 -4.86 0.04 0.00 0.00 0.00 0.00 36.38 31.36 1mie s VAL 111 CO -0.08 -1.72 0.41 -0.55 0.00 0.00 0.00 175.10 173.17 1mie s SER 112 N 3.95 -0.26 0.17 3.32 0.15 -0.93 -4.31 113.70 115.79 1mie s SER 112 Ca 0.33 -0.15 0.24 0.00 0.70 0.00 0.00 55.95 57.06 1mie s SER 112 Cb -0.09 0.45 0.24 0.00 -1.71 0.00 0.00 66.02 64.91 1mie s SER 112 CO 0.06 -0.76 1.26 0.00 1.20 0.00 0.00 173.24 175.00 1mie h ALA 113 N 2.68 0.59 -2.21 5.45 0.00 -1.92 -3.35 119.26 120.50 1mie h ALA 113 Ca -0.33 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.07 1mie h ALA 113 Cb 1.23 0.00 0.21 0.00 0.00 0.00 0.00 17.79 19.23 1mie h ALA 113 CO 0.45 0.00 -0.11 0.00 0.00 0.00 0.00 179.25 179.60 1mie n ALA 114 N -1.96 -1.65 -2.71 0.00 0.00 -1.26 -5.02 120.51 107.90 1mie n ALA 114 Ca 0.02 -0.63 -0.20 0.00 0.00 0.00 0.00 53.44 52.63 1mie n ALA 114 Cb 0.48 -2.03 -0.02 0.00 0.00 0.00 0.00 19.45 17.88 1mie n ALA 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1mie s LYS 115 N -4.24 3.15 0.31 0.00 -2.85 -1.26 -5.03 119.74 109.81 1mie s LYS 115 Ca 0.63 -0.97 -0.29 0.00 -1.00 0.00 0.00 55.97 54.34 1mie s LYS 115 Cb -0.22 -2.75 -0.10 0.00 -2.06 0.00 0.00 37.83 32.70 1mie s LYS 115 CO 0.62 0.26 1.26 0.99 0.10 0.00 0.00 175.35 178.58 1mie s THR 116 N -2.12 2.92 -0.08 3.79 2.01 -1.26 -4.68 115.64 116.21 1mie s THR 116 Ca 0.38 0.91 -0.03 0.00 0.31 0.00 0.00 61.69 63.26 1mie s THR 116 Cb -0.09 -3.58 0.05 0.00 0.01 0.00 0.00 72.50 68.89 1mie s THR 116 CO 0.29 0.21 0.17 -0.89 -0.69 0.00 0.00 174.62 173.71 1mie s THR 117 N -1.05 -0.19 0.40 -0.82 2.01 0.10 -4.95 115.64 111.13 1mie s THR 117 Ca 0.48 0.28 -0.25 0.00 0.31 0.00 0.00 61.69 62.52 1mie s THR 117 Cb -0.38 -0.29 -0.09 0.00 0.01 0.00 0.00 72.50 71.75 1mie s THR 117 CO 0.49 0.12 1.09 0.00 -0.69 0.00 0.00 174.62 175.63 1mie s ALA 118 N 1.88 3.11 0.62 7.40 0.00 -1.26 -1.67 121.76 131.84 1mie s ALA 118 Ca -0.02 0.80 -0.14 0.00 0.00 0.00 0.00 51.96 52.60 1mie s ALA 118 Cb -0.12 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1mie s ALA 118 CO -0.06 -0.33 1.05 -1.25 0.00 0.00 0.00 175.76 175.18 1mie s PRO 119 N -2.39 3.25 0.05 0.00 0.04 -1.26 -4.55 135.00 130.14 1mie s PRO 119 Ca 0.57 1.11 -0.10 0.00 0.04 0.00 0.00 61.00 62.63 1mie s PRO 119 Cb -0.25 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 1mie s PRO 119 CO 0.32 -0.86 0.37 -1.12 0.04 0.00 0.00 177.00 175.75 1mie s SER 120 N -3.11 6.63 -0.21 6.66 0.01 0.21 -4.91 113.70 118.98 1mie s SER 120 Ca 0.62 0.76 -0.01 0.00 1.31 0.00 0.00 55.95 58.63 1mie s SER 120 Cb -0.15 -2.17 0.06 0.00 0.21 0.00 0.00 66.02 63.97 1mie s SER 120 CO 0.42 0.21 -0.03 -0.69 0.41 0.00 0.00 173.24 173.56 1mie s VAL 121 N -1.33 1.12 -0.11 3.43 1.01 -1.26 -0.98 120.40 122.28 1mie s VAL 121 Ca 0.30 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 1mie s VAL 121 Cb -0.14 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1mie s VAL 121 CO 0.17 -0.08 -0.04 -0.31 0.00 0.00 0.00 175.10 174.84 1mie s TYR 122 N 1.59 3.02 0.13 5.22 2.02 -0.30 -4.97 117.35 124.07 1mie s TYR 122 Ca -0.03 -0.07 -0.30 0.00 -0.37 0.00 0.00 57.07 56.30 1mie s TYR 122 Cb -0.17 -1.83 -0.07 0.00 -0.40 0.00 0.00 41.96 39.49 1mie s TYR 122 CO -0.07 0.22 1.10 -1.25 -1.57 0.00 0.00 175.55 173.98 1mie s PRO 123 N -0.35 4.56 -0.47 -1.71 0.04 -1.26 -1.53 135.00 134.27 1mie s PRO 123 Ca 0.06 1.69 -0.02 0.00 0.04 0.00 0.00 61.00 62.77 1mie s PRO 123 Cb -0.12 -3.32 0.12 0.00 0.04 0.00 0.00 34.50 31.23 1mie s PRO 123 CO 0.02 -0.01 0.26 -0.51 0.04 0.00 0.00 177.00 176.81 1mie s LEU 124 N 0.12 5.17 0.14 -3.56 1.43 0.49 -4.92 118.68 117.54 1mie s LEU 124 Ca 0.52 -2.33 0.04 0.00 -1.03 0.00 0.00 54.13 51.33 1mie s LEU 124 Cb -0.28 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1mie s LEU 124 CO 0.33 -0.47 0.17 0.00 0.23 0.00 0.00 176.35 176.61 1mie s ALA 125 N 0.71 3.71 0.80 4.21 0.00 -1.26 -0.47 121.76 129.45 1mie s ALA 125 Ca 0.11 -1.11 -0.14 0.00 0.00 0.00 0.00 51.96 50.82 1mie s ALA 125 Cb -0.22 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.40 1mie s ALA 125 CO -0.04 0.57 0.76 -2.30 0.00 0.00 0.00 175.76 174.74 1mie n PRO 126 N -0.25 0.15 -0.70 0.00 -0.02 -1.26 -4.97 135.00 127.95 1mie n PRO 126 Ca -0.08 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1mie n PRO 126 Cb 0.54 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1mie n PRO 126 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1mie n VAL 127 N -2.96 -0.46 0.00 -1.45 0.31 -1.26 -4.69 118.33 107.81 1mie n VAL 127 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1mie n VAL 127 Cb 0.51 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1mie n VAL 127 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1mie n SER 136 N -0.49 0.00 -4.39 4.52 3.41 -1.26 -5.15 113.62 110.26 1mie n SER 136 Ca 0.00 0.07 -0.20 0.00 -0.26 0.00 0.00 58.87 58.48 1mie n SER 136 Cb 0.23 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.01 1mie n SER 136 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1mie s SER 137 N -1.74 2.48 0.01 4.04 1.04 -1.26 -0.50 113.70 117.78 1mie s SER 137 Ca 0.00 -1.16 0.04 0.00 0.48 0.00 0.00 55.95 55.30 1mie s SER 137 Cb 0.00 -0.12 -0.01 0.00 0.10 0.00 0.00 66.02 65.99 1mie s SER 137 CO 0.00 -0.35 -0.12 0.54 0.98 0.00 0.00 173.24 174.29 1mie s VAL 138 N -3.11 0.90 -0.15 5.02 0.11 0.96 -4.55 120.40 119.59 1mie s VAL 138 Ca 0.28 -0.70 -0.01 0.00 -2.93 0.00 0.00 61.98 58.62 1mie s VAL 138 Cb 0.03 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 34.08 1mie s VAL 138 CO 0.10 0.09 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.95 1mie s THR 139 N -0.56 3.01 0.32 5.04 2.01 -1.26 -1.27 115.64 122.92 1mie s THR 139 Ca 0.02 -0.66 0.10 0.00 0.31 0.00 0.00 61.69 61.46 1mie s THR 139 Cb -0.06 -2.28 -0.06 0.00 0.01 0.00 0.00 72.50 70.11 1mie s THR 139 CO 0.00 0.51 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.55 1mie s LEU 140 N 0.61 2.69 0.33 4.42 1.43 -0.57 -4.48 118.68 123.10 1mie s LEU 140 Ca -0.07 -1.13 -0.01 0.00 -1.03 0.00 0.00 54.13 51.88 1mie s LEU 140 Cb -0.15 -1.04 -0.01 0.00 0.03 0.00 0.00 46.19 45.01 1mie s LEU 140 CO 0.03 -0.12 0.42 -0.83 0.23 0.00 0.00 176.35 176.08 1mie s GLY 141 N -3.58 1.59 -0.04 -3.19 0.00 0.38 -1.45 107.32 101.03 1mie s GLY 141 Ca 0.32 -1.60 -0.01 0.00 0.00 0.00 0.00 44.72 43.42 1mie s GLY 141 CO 0.16 -1.09 0.09 0.00 0.00 0.00 0.00 173.10 172.26 1mie s LEU 143 N 1.14 2.60 -0.38 0.00 2.96 -0.58 -1.29 118.68 123.13 1mie s LEU 143 Ca -0.09 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.31 1mie s LEU 143 Cb -0.12 -1.62 0.08 0.00 0.50 0.00 0.00 46.19 45.02 1mie s LEU 143 CO -0.05 0.03 0.16 -0.69 -1.32 0.00 0.00 176.35 174.49 1mie s VAL 144 N 1.12 3.53 0.13 1.68 1.01 0.47 -1.15 120.40 127.19 1mie s VAL 144 Ca 0.01 -1.59 0.10 0.00 0.00 0.00 0.00 61.98 60.49 1mie s VAL 144 Cb -0.14 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1mie s VAL 144 CO -0.04 -0.43 -0.25 -0.75 0.00 0.00 0.00 175.10 173.64 1mie s LYS 145 N 1.28 1.32 -0.68 2.72 2.20 -0.15 -0.80 119.74 125.62 1mie s LYS 145 Ca 0.02 -1.31 -0.03 0.00 -0.36 0.00 0.00 55.97 54.29 1mie s LYS 145 Cb -0.22 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.38 1mie s LYS 145 CO -0.01 0.40 0.42 0.41 -0.36 0.00 0.00 175.35 176.21 1mie n GLY 146 N 0.89 0.18 3.72 5.54 0.00 -0.66 -0.62 105.19 114.24 1mie n GLY 146 Ca -0.18 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.31 1mie n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mie s TYR 147 N -2.99 2.72 -0.28 1.61 1.13 -1.02 -4.56 117.35 113.96 1mie s TYR 147 Ca 0.21 -0.34 -0.23 0.00 -1.41 0.00 0.00 57.07 55.30 1mie s TYR 147 Cb -0.09 -1.54 0.11 0.00 -1.10 0.00 0.00 41.96 39.34 1mie s TYR 147 CO 0.26 0.41 0.90 0.12 -2.51 0.00 0.00 175.55 174.73 1mie s PHE 148 N -2.40 -0.64 0.00 -3.49 2.19 -0.67 0.16 117.98 113.14 1mie s PHE 148 Ca 0.36 1.47 0.00 0.00 0.33 0.00 0.00 56.93 59.09 1mie s PHE 148 Cb -0.03 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.04 1mie s PHE 148 CO 0.22 -0.31 0.00 -0.35 1.83 0.00 0.00 175.22 176.61 1mie n PRO 149 N 2.76 1.14 -2.24 10.12 -0.04 -1.26 0.00 135.00 145.48 1mie n PRO 149 Ca -0.14 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.06 1mie n PRO 149 Cb 0.56 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.08 1mie n PRO 149 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1mie s GLU 150 N -0.74 2.39 0.41 0.54 0.41 -1.26 -4.86 118.70 115.60 1mie s GLU 150 Ca 0.00 -0.18 0.06 0.00 -0.41 0.00 0.00 54.97 54.43 1mie s GLU 150 Cb 0.00 -2.19 0.06 0.00 -1.78 0.00 0.00 34.13 30.21 1mie s GLU 150 CO 0.00 -1.10 0.46 -0.35 -0.49 0.00 0.00 175.26 173.78 1mie n PRO 151 N -2.84 0.80 -4.18 0.39 -0.04 -1.26 -4.85 135.00 123.03 1mie n PRO 151 Ca 0.07 -2.34 -0.16 0.00 -0.04 0.00 0.00 63.50 61.04 1mie n PRO 151 Cb 0.60 0.01 -0.13 0.00 -0.04 0.00 0.00 33.50 33.94 1mie n PRO 151 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1mie s VAL 152 N -1.74 0.71 -0.15 0.52 -7.23 -1.26 -4.27 120.40 106.97 1mie s VAL 152 Ca 0.35 -0.86 -0.02 0.00 -1.81 0.00 0.00 61.98 59.64 1mie s VAL 152 Cb -0.03 -0.69 -0.02 0.00 0.56 0.00 0.00 36.38 36.21 1mie s VAL 152 CO 0.22 -0.14 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.89 1mie s THR 153 N -0.92 3.37 -0.05 5.32 2.01 -0.12 -4.96 115.64 120.30 1mie s THR 153 Ca -0.03 -0.54 0.03 0.00 0.31 0.00 0.00 61.69 61.46 1mie s THR 153 Cb -0.07 -2.46 0.00 0.00 0.01 0.00 0.00 72.50 69.98 1mie s THR 153 CO 0.01 0.50 -0.15 -0.22 -0.69 0.00 0.00 174.62 174.06 1mie s LEU 154 N 0.52 1.83 0.22 4.42 0.20 -1.26 -0.97 118.68 123.64 1mie s LEU 154 Ca -0.06 -0.34 0.00 0.00 0.69 0.00 0.00 54.13 54.42 1mie s LEU 154 Cb -0.15 -0.92 -0.05 0.00 -0.43 0.00 0.00 46.19 44.65 1mie s LEU 154 CO 0.03 0.11 0.11 0.42 -0.29 0.00 0.00 176.35 176.73 1mie s THR 157 N 0.27 0.27 -0.04 3.68 -4.23 -0.51 -4.99 115.64 110.09 1mie s THR 157 Ca -0.08 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.49 1mie s THR 157 Cb -0.13 -2.53 -0.01 0.00 1.34 0.00 0.00 72.50 71.17 1mie s THR 157 CO 0.03 -0.03 -0.21 0.26 -0.54 0.00 0.00 174.62 174.13 1mie s TRP 158 N -3.96 2.00 -1.46 3.99 0.52 -1.26 -0.61 118.94 118.16 1mie s TRP 158 Ca 0.37 -0.52 -0.01 0.00 0.02 0.00 0.00 56.10 55.97 1mie s TRP 158 Cb 0.07 -1.32 0.00 0.00 -1.15 0.00 0.00 33.47 31.08 1mie s TRP 158 CO 0.12 -0.14 0.23 0.09 0.02 0.00 0.00 176.95 177.28 1mie n ASN 162 N 2.88 0.13 -2.09 2.95 3.02 0.62 -0.37 115.26 122.40 1mie n ASN 162 Ca -0.17 -1.14 -0.13 0.00 -0.03 0.00 0.00 54.58 53.11 1mie n ASN 162 Cb 0.52 -2.35 -0.02 0.00 -0.61 0.00 0.00 39.78 37.32 1mie n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1mie n SER 163 N -2.92 -3.90 0.00 6.41 7.64 -1.26 -1.06 113.62 118.53 1mie n SER 163 Ca -0.31 0.22 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1mie n SER 163 Cb 0.69 -3.40 0.00 0.00 -1.01 0.00 0.00 64.21 60.49 1mie n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mie n GLY 164 N -0.63 1.18 0.21 0.23 0.00 0.50 -4.95 105.19 101.72 1mie n GLY 164 Ca -0.15 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.91 1mie n GLY 164 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1mie h SER 165 N 0.00 0.01 -3.59 1.61 0.02 -0.93 -3.38 113.55 107.29 1mie h SER 165 Ca 0.00 -0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 1mie h SER 165 Cb 0.00 -0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.29 1mie h SER 165 CO 0.00 0.25 -0.51 -0.76 -1.14 0.00 0.00 176.83 174.67 1mie s LEU 166 N -8.50 4.70 0.00 5.07 1.43 -1.10 -4.90 118.68 115.38 1mie s LEU 166 Ca -0.04 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.09 1mie s LEU 166 Cb 0.15 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.35 1mie s LEU 166 CO 0.71 -0.38 0.00 -1.54 0.23 0.00 0.00 176.35 175.37 1mie n SER 167 N 5.00 2.31 -0.08 2.29 3.41 -1.26 -4.29 113.62 120.99 1mie n SER 167 Ca -0.12 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.48 1mie n SER 167 Cb 0.46 0.40 0.26 0.00 -0.26 0.00 0.00 64.21 65.07 1mie n SER 167 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1mie h SER 168 N 0.00 0.66 -0.74 4.04 0.02 -1.96 -3.25 113.55 112.32 1mie h SER 168 Ca 0.00 -0.10 -0.54 0.00 -0.84 0.00 0.00 61.79 60.31 1mie h SER 168 Cb 0.13 -0.17 -0.42 0.00 0.14 0.00 0.00 62.40 62.08 1mie h SER 168 CO 0.00 0.63 -0.81 0.61 -1.14 0.00 0.00 176.83 176.12 1mie n GLY 169 N -1.00 6.39 3.65 -3.77 0.00 -1.26 -5.01 105.19 104.18 1mie n GLY 169 Ca 0.04 -2.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.06 1mie n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mie s VAL 171 N -4.58 4.40 -0.08 1.61 1.01 -1.23 -0.10 120.40 121.44 1mie s VAL 171 Ca 0.51 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 62.31 1mie s VAL 171 Cb 0.41 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.90 1mie s VAL 171 CO 0.04 0.55 -0.13 -1.00 0.00 0.00 0.00 175.10 174.56 1mie s HIS 172 N -0.38 1.58 -0.16 5.22 3.76 -0.30 -4.99 115.29 120.02 1mie s HIS 172 Ca 0.08 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 1mie s HIS 172 Cb -0.12 -1.16 0.03 0.00 1.11 0.00 0.00 32.58 32.43 1mie s HIS 172 CO 0.02 -0.33 -0.14 0.99 -0.85 0.00 0.00 174.74 174.43 1mie s THR 173 N 0.78 1.63 -0.05 1.30 2.01 -1.26 -0.52 115.64 119.52 1mie s THR 173 Ca -0.12 -0.72 -0.23 0.00 0.31 0.00 0.00 61.69 60.92 1mie s THR 173 Cb -0.16 -1.55 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 1mie s THR 173 CO 0.02 0.42 0.70 -0.36 -0.69 0.00 0.00 174.62 174.72 1mie s PHE 174 N 1.45 3.60 0.47 4.92 0.08 -0.70 -5.03 117.98 122.77 1mie s PHE 174 Ca 0.04 1.27 -0.22 0.00 0.12 0.00 0.00 56.93 58.14 1mie s PHE 174 Cb -0.13 -2.80 -0.10 0.00 -0.57 0.00 0.00 43.02 39.42 1mie s PHE 174 CO -0.11 0.12 0.82 -2.30 -0.10 0.00 0.00 175.22 173.65 1mie n PRO 175 N 3.63 0.97 -2.12 0.24 -0.02 -1.26 -4.10 135.00 132.33 1mie n PRO 175 Ca -0.02 0.35 -0.33 0.00 -2.02 0.00 0.00 63.50 61.49 1mie n PRO 175 Cb 0.51 -1.87 0.01 0.00 -0.02 0.00 0.00 33.50 32.12 1mie n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mie s ALA 176 N -1.42 2.71 -0.11 3.55 0.00 -1.26 -4.80 121.76 120.44 1mie s ALA 176 Ca 0.66 0.52 0.03 0.00 0.00 0.00 0.00 51.96 53.17 1mie s ALA 176 Cb -0.53 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.32 1mie s ALA 176 CO 0.55 -0.78 -0.20 0.08 0.00 0.00 0.00 175.76 175.41 1mie s VAL 177 N -2.25 1.80 -0.20 0.00 1.01 -0.69 -4.94 120.40 115.12 1mie s VAL 177 Ca 0.66 -0.85 -0.27 0.00 0.00 0.00 0.00 61.98 61.52 1mie s VAL 177 Cb -0.18 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 1mie s VAL 177 CO 0.33 0.50 0.93 -0.22 0.00 0.00 0.00 175.10 176.64 1mie s LEU 178 N 0.63 4.13 -0.09 3.92 2.96 -1.26 -2.53 118.68 126.44 1mie s LEU 178 Ca -0.13 1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 55.02 1mie s LEU 178 Cb -0.16 -3.38 0.03 0.00 0.50 0.00 0.00 46.19 43.18 1mie s LEU 178 CO 0.04 -0.54 0.03 -1.58 -1.32 0.00 0.00 176.35 172.97 1mie s GLN 179 N 2.72 0.42 -1.34 1.98 2.00 0.14 -4.87 119.66 120.72 1mie s GLN 179 Ca 0.41 0.09 -0.05 0.00 -2.00 0.00 0.00 55.36 53.81 1mie s GLN 179 Cb -0.16 -1.09 0.02 0.00 0.80 0.00 0.00 33.01 32.59 1mie s GLN 179 CO 0.09 -0.38 0.92 0.43 -0.50 0.00 0.00 175.29 175.85 1mie n SER 180 N 5.18 -3.09 -1.33 6.67 7.64 -1.26 -1.69 113.62 125.74 1mie n SER 180 Ca -0.06 -0.71 -0.16 0.00 1.01 0.00 0.00 58.87 58.95 1mie n SER 180 Cb 0.50 -4.46 -0.06 0.00 -1.01 0.00 0.00 64.21 59.18 1mie n SER 180 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mie n ASP 183 N -3.02 -4.89 -3.93 6.43 8.00 -1.26 -4.99 116.55 112.89 1mie n ASP 183 Ca -0.17 0.32 -0.10 0.00 0.71 0.00 0.00 54.79 55.55 1mie n ASP 183 Cb 0.62 -3.83 -0.12 0.00 -0.02 0.00 0.00 41.12 37.78 1mie n ASP 183 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1mie s LEU 184 N -3.79 2.07 0.09 0.64 1.43 -0.68 -4.82 118.68 113.62 1mie s LEU 184 Ca 0.00 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1mie s LEU 184 Cb 0.00 0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.33 1mie s LEU 184 CO 0.00 -0.22 0.26 -0.31 0.23 0.00 0.00 176.35 176.31 1mie s TYR 185 N -1.00 3.51 -0.01 0.29 2.02 0.12 0.28 117.35 122.56 1mie s TYR 185 Ca -0.11 0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.90 1mie s TYR 185 Cb -0.07 -1.80 0.01 0.00 -0.40 0.00 0.00 41.96 39.70 1mie s TYR 185 CO -0.00 0.54 -0.03 0.99 -1.57 0.00 0.00 175.55 175.47 1mie s THR 186 N -1.58 0.32 0.09 -0.71 2.01 -1.05 -1.65 115.64 113.07 1mie s THR 186 Ca 0.36 -0.11 0.02 0.00 0.31 0.00 0.00 61.69 62.27 1mie s THR 186 Cb -0.13 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 1mie s THR 186 CO 0.27 0.12 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.04 1mie s LEU 187 N 0.29 2.50 0.06 4.42 0.20 0.02 -1.71 118.68 124.45 1mie s LEU 187 Ca -0.03 -0.98 -0.08 0.00 0.69 0.00 0.00 54.13 53.73 1mie s LEU 187 Cb -0.06 -0.06 -0.00 0.00 -0.43 0.00 0.00 46.19 45.63 1mie s LEU 187 CO -0.00 -0.46 0.16 -0.94 -0.29 0.00 0.00 176.35 174.81 1mie s SER 188 N -2.97 0.13 -0.03 3.68 1.04 -1.26 -0.39 113.70 113.91 1mie s SER 188 Ca 0.10 -0.58 -0.05 0.00 0.48 0.00 0.00 55.95 55.90 1mie s SER 188 Cb 0.05 0.30 0.01 0.00 0.10 0.00 0.00 66.02 66.47 1mie s SER 188 CO -0.05 -0.64 0.13 -0.55 0.98 0.00 0.00 173.24 173.11 1mie s SER 189 N -2.54 -0.06 0.19 7.02 0.15 -0.41 -1.72 113.70 116.33 1mie s SER 189 Ca 0.01 0.05 0.09 0.00 0.70 0.00 0.00 55.95 56.80 1mie s SER 189 Cb 0.03 0.24 -0.04 0.00 -1.71 0.00 0.00 66.02 64.54 1mie s SER 189 CO -0.08 -0.18 -0.19 -0.94 1.20 0.00 0.00 173.24 173.05 1mie s SER 190 N -0.56 2.90 -0.05 5.45 1.04 0.32 -0.62 113.70 122.20 1mie s SER 190 Ca -0.06 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.43 1mie s SER 190 Cb -0.04 -0.19 0.02 0.00 0.10 0.00 0.00 66.02 65.91 1mie s SER 190 CO 0.01 -0.02 0.12 0.54 0.98 0.00 0.00 173.24 174.87 1mie s VAL 191 N -2.15 -0.02 -0.09 5.02 0.11 -0.53 -1.15 120.40 121.58 1mie s VAL 191 Ca 0.19 0.08 0.04 0.00 -2.93 0.00 0.00 61.98 59.36 1mie s VAL 191 Cb -0.05 -0.18 -0.00 0.00 -1.53 0.00 0.00 36.38 34.61 1mie s VAL 191 CO 0.08 0.03 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.75 1mie s THR 192 N 0.51 2.08 0.22 5.04 2.01 0.86 -1.52 115.64 124.84 1mie s THR 192 Ca -0.04 -1.02 -0.00 0.00 0.31 0.00 0.00 61.69 60.94 1mie s THR 192 Cb -0.05 -1.78 -0.04 0.00 0.01 0.00 0.00 72.50 70.63 1mie s THR 192 CO -0.02 0.56 0.12 0.68 -0.69 0.00 0.00 174.62 175.27 1mie s VAL 193 N 0.27 0.15 0.04 3.82 -7.23 -0.40 -4.42 120.40 112.63 1mie s VAL 193 Ca -0.17 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 57.66 1mie s VAL 193 Cb -0.17 -2.54 -0.14 0.00 0.56 0.00 0.00 36.38 34.09 1mie s VAL 193 CO 0.08 0.00 1.66 0.41 -0.31 0.00 0.00 175.10 176.94 1mie n THR 194 N -0.32 0.21 -0.28 5.32 -1.04 -1.26 -0.02 114.28 116.89 1mie n THR 194 Ca 0.01 -0.04 0.13 0.00 -2.04 0.00 0.00 64.05 62.11 1mie n THR 194 Cb 0.66 -1.53 0.38 0.00 -1.82 0.00 0.00 70.33 68.02 1mie n THR 194 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1mie h SER 195 N 6.91 0.65 0.50 8.00 4.64 -1.03 -2.32 113.55 130.90 1mie h SER 195 Ca -0.47 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1mie h SER 195 Cb 1.28 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1mie h SER 195 CO 0.90 0.32 0.00 0.77 -0.87 0.00 0.00 176.83 177.95 1mie h SER 196 N 0.68 0.00 -0.35 4.97 4.64 -1.89 -3.13 113.55 118.46 1mie h SER 196 Ca 0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 1mie h SER 196 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1mie h SER 196 CO -0.22 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.09 1mie n THR 198 N -2.37 0.46 -3.84 2.95 -2.24 -0.87 -4.71 114.28 103.66 1mie n THR 198 Ca 0.01 -0.62 -0.14 0.00 -2.27 0.00 0.00 64.05 61.02 1mie n THR 198 Cb 0.17 0.67 -0.15 0.00 -2.10 0.00 0.00 70.33 68.92 1mie n THR 198 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1mie s TRP 199 N -1.54 0.07 -2.00 4.78 -0.00 -1.19 -0.33 118.94 118.73 1mie s TRP 199 Ca 0.36 0.06 0.26 0.00 -0.00 0.00 0.00 56.10 56.79 1mie s TRP 199 Cb 0.20 -0.18 1.58 0.00 -0.00 0.00 0.00 33.47 35.08 1mie s TRP 199 CO 0.29 -0.06 1.94 -0.35 -0.00 0.00 0.00 176.95 178.76 1mie n PRO 200 N 3.74 0.84 -0.30 5.86 -0.04 -1.26 -4.93 135.00 138.92 1mie n PRO 200 Ca -0.22 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.33 1mie n PRO 200 Cb 0.54 -1.49 0.25 0.00 -0.04 0.00 0.00 33.50 32.75 1mie n PRO 200 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1mie h SER 202 N 0.00 0.51 -3.58 3.54 4.64 -1.84 -3.30 113.55 113.51 1mie h SER 202 Ca 0.00 0.10 -0.69 0.00 -0.47 0.00 0.00 61.79 60.73 1mie h SER 202 Cb 0.00 0.03 -0.34 0.00 -0.31 0.00 0.00 62.40 61.77 1mie h SER 202 CO 0.00 0.19 -0.61 -1.10 -0.87 0.00 0.00 176.83 174.44 1mie s GLN 203 N -5.95 2.08 0.17 4.77 -0.21 0.55 -5.06 119.66 116.01 1mie s GLN 203 Ca -0.12 -1.66 -0.30 0.00 0.02 0.00 0.00 55.36 53.30 1mie s GLN 203 Cb 0.23 -3.44 -0.17 0.00 1.00 0.00 0.00 33.01 30.62 1mie s GLN 203 CO 0.78 -0.93 0.60 0.45 -2.12 0.00 0.00 175.29 174.07 1mie n SER 204 N 4.58 -1.05 -3.88 5.90 2.88 -1.25 -4.59 113.62 116.22 1mie n SER 204 Ca -0.05 1.12 -0.24 0.00 -1.33 0.00 0.00 58.87 58.38 1mie n SER 204 Cb 0.42 -0.94 -0.17 0.00 -0.75 0.00 0.00 64.21 62.78 1mie n SER 204 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1mie s ILE 205 N -0.84 0.73 -0.04 2.46 1.01 -1.26 -4.98 121.20 118.28 1mie s ILE 205 Ca 0.67 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 61.21 1mie s ILE 205 Cb -0.97 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 40.73 1mie s ILE 205 CO 0.56 0.30 -0.13 -0.89 0.00 0.00 0.00 174.94 174.77 1mie s THR 206 N 1.45 1.16 -0.21 2.92 2.01 -1.26 -0.44 115.64 121.27 1mie s THR 206 Ca -0.02 -0.55 -0.14 0.00 0.31 0.00 0.00 61.69 61.29 1mie s THR 206 Cb -0.13 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 1mie s THR 206 CO -0.04 0.35 0.33 0.00 -0.69 0.00 0.00 174.62 174.57 1mie s ASN 209 N 1.01 4.73 -0.07 0.00 -0.87 0.22 -1.06 114.94 118.90 1mie s ASN 209 Ca 0.16 -0.23 0.03 0.00 -1.57 0.00 0.00 52.86 51.25 1mie s ASN 209 Cb -0.14 -1.80 0.01 0.00 -0.02 0.00 0.00 41.25 39.29 1mie s ASN 209 CO 0.07 0.06 -0.15 -0.69 -2.57 0.00 0.00 177.10 173.82 1mie s VAL 210 N 1.00 1.34 -0.07 1.60 1.01 0.28 -1.43 120.40 124.13 1mie s VAL 210 Ca 0.01 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 61.45 1mie s VAL 210 Cb -0.14 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1mie s VAL 210 CO 0.01 0.40 -0.24 0.00 0.00 0.00 0.00 175.10 175.28 1mie s ALA 211 N 0.59 2.07 -0.43 5.51 0.00 -0.14 -0.18 121.76 129.17 1mie s ALA 211 Ca -0.15 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 50.87 1mie s ALA 211 Cb -0.16 -0.69 0.12 0.00 0.00 0.00 0.00 23.12 22.39 1mie s ALA 211 CO 0.05 0.36 0.18 -1.58 0.00 0.00 0.00 175.76 174.77 1mie s HIS 212 N 0.02 2.95 0.22 0.00 2.46 0.35 -0.94 115.29 120.35 1mie s HIS 212 Ca -0.08 -2.84 -0.10 0.00 0.47 0.00 0.00 55.06 52.51 1mie s HIS 212 Cb -0.15 -2.55 0.32 0.00 -0.13 0.00 0.00 32.58 30.07 1mie s HIS 212 CO 0.05 -0.82 1.65 -1.35 -2.47 0.00 0.00 174.74 171.80 1mie h PRO 213 N 7.00 0.09 -0.96 2.88 0.11 -1.80 -1.09 132.00 138.22 1mie h PRO 213 Ca -0.06 -0.01 0.17 0.00 0.11 0.00 0.00 66.00 66.22 1mie h PRO 213 Cb 0.95 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 31.93 1mie h PRO 213 CO 0.58 0.06 0.56 0.00 -0.21 0.00 0.00 178.00 178.99 1mie h ALA 214 N 1.61 1.55 -0.48 -0.75 0.00 -1.87 -0.79 119.26 118.53 1mie h ALA 214 Ca 0.34 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1mie h ALA 214 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1mie h ALA 214 CO -0.59 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 177.49 1mie n SER 215 N -4.79 3.55 -2.64 0.00 3.41 -0.63 -4.95 113.62 107.58 1mie n SER 215 Ca 0.21 -1.98 -0.16 0.00 -0.26 0.00 0.00 58.87 56.68 1mie n SER 215 Cb 0.52 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1mie n SER 215 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1mie n SER 216 N 1.46 -4.34 -4.52 4.04 7.64 -0.30 -4.95 113.62 112.65 1mie n SER 216 Ca 0.20 0.03 -0.28 0.00 1.01 0.00 0.00 58.87 59.83 1mie n SER 216 Cb 0.59 -3.64 -0.10 0.00 -1.01 0.00 0.00 64.21 60.05 1mie n SER 216 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1mie s THR 217 N -2.77 2.97 0.02 0.44 -4.23 -1.04 -4.99 115.64 106.04 1mie s THR 217 Ca 0.09 -1.60 0.01 0.00 -1.18 0.00 0.00 61.69 59.01 1mie s THR 217 Cb -0.05 -2.42 -0.02 0.00 1.34 0.00 0.00 72.50 71.36 1mie s THR 217 CO 0.11 -0.00 -0.04 -0.54 -0.54 0.00 0.00 174.62 173.61 1mie s LYS 218 N -2.47 0.36 -0.03 3.99 1.02 -1.26 -0.50 119.74 120.85 1mie s LYS 218 Ca 0.21 -0.58 0.01 0.00 0.02 0.00 0.00 55.97 55.63 1mie s LYS 218 Cb -0.10 -0.05 0.02 0.00 -0.52 0.00 0.00 37.83 37.18 1mie s LYS 218 CO 0.12 -0.01 -0.02 0.08 -0.92 0.00 0.00 175.35 174.60 1mie s VAL 219 N -1.25 0.34 -0.48 3.17 1.01 0.74 -4.98 120.40 118.95 1mie s VAL 219 Ca -0.12 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1mie s VAL 219 Cb -0.09 -0.39 0.13 0.00 0.00 0.00 0.00 36.38 36.03 1mie s VAL 219 CO -0.00 0.17 0.24 -1.81 0.00 0.00 0.00 175.10 173.70 1mie s ASP 220 N 0.86 4.78 -0.45 3.32 1.01 -1.26 -0.56 116.67 124.37 1mie s ASP 220 Ca -0.10 -2.62 -0.18 0.00 0.71 0.00 0.00 52.55 50.36 1mie s ASP 220 Cb -0.13 -1.71 0.04 0.00 1.01 0.00 0.00 42.92 42.12 1mie s ASP 220 CO -0.01 -0.35 0.49 -0.54 0.21 0.00 0.00 175.17 174.98 1mie s LYS 221 N 0.27 3.10 0.21 8.23 -0.14 -0.22 -4.90 119.74 126.28 1mie s LYS 221 Ca 0.14 -0.83 -0.31 0.00 -1.36 0.00 0.00 55.97 53.62 1mie s LYS 221 Cb -0.22 -4.02 -0.10 0.00 -1.68 0.00 0.00 37.83 31.81 1mie s LYS 221 CO -0.03 -0.97 1.46 0.21 -0.76 0.00 0.00 175.35 175.25 1mie s LYS 222 N 2.25 4.27 -0.16 1.68 2.20 -1.26 -1.47 119.74 127.25 1mie s LYS 222 Ca 0.13 2.27 -0.23 0.00 -0.36 0.00 0.00 55.97 57.78 1mie s LYS 222 Cb -0.18 -3.14 -0.02 0.00 -1.51 0.00 0.00 37.83 32.97 1mie s LYS 222 CO 0.13 -0.46 0.72 0.42 -0.36 0.00 0.00 175.35 175.80 1mie s ILE 223 N 0.44 4.97 0.17 5.43 -1.09 0.42 -4.87 121.20 126.66 1mie s ILE 223 Ca 0.63 1.40 0.11 0.00 -2.23 0.00 0.00 60.65 60.56 1mie s ILE 223 Cb -0.41 -4.03 -0.04 0.00 -1.58 0.00 0.00 42.46 36.39 1mie s ILE 223 CO 0.38 0.10 -0.25 -1.61 -1.23 0.00 0.00 174.94 172.33 1mie s GLU 226 N 1.81 1.47 0.38 2.79 2.02 -1.26 -4.66 118.70 121.25 1mie s GLU 226 Ca 0.34 -1.45 -0.28 0.00 0.02 0.00 0.00 54.97 53.60 1mie s GLU 226 Cb -0.16 -1.87 -0.10 0.00 0.10 0.00 0.00 34.13 32.09 1mie s GLU 226 CO 0.12 0.42 1.40 -2.14 0.02 0.00 0.00 175.26 175.08 1mie s PRO 227 N -2.41 4.10 0.00 0.39 0.02 -1.26 -4.74 135.00 131.10 1mie s PRO 227 Ca 0.18 2.38 0.18 0.00 0.02 0.00 0.00 61.00 63.76 1mie s PRO 227 Cb -0.09 -2.92 1.08 0.00 0.02 0.00 0.00 34.50 32.59 1mie s PRO 227 CO 0.08 -0.46 1.47 0.54 -0.33 0.00 0.00 177.00 178.30