#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ism n ARG 3 N 0.00 3.62 -3.32 -0.99 1.74 -1.24 -4.90 116.66 111.57 1ism n ARG 3 Ca 0.00 -0.21 -0.20 0.00 -0.77 0.00 0.00 57.85 56.67 1ism n ARG 3 Cb 0.00 -0.71 0.01 0.00 -1.02 0.00 0.00 32.46 30.74 1ism n ARG 3 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ism s ALA 4 N -0.58 4.41 0.46 7.54 0.00 0.22 -4.86 121.76 128.96 1ism s ALA 4 Ca 0.00 -1.80 -0.24 0.00 0.00 0.00 0.00 51.96 49.92 1ism s ALA 4 Cb 0.00 -1.26 -0.07 0.00 0.00 0.00 0.00 23.12 21.79 1ism s ALA 4 CO 0.00 -0.43 1.33 -2.00 0.00 0.00 0.00 175.76 174.66 1ism s GLU 5 N -4.35 3.64 0.96 0.00 2.12 -1.26 -2.38 118.70 117.43 1ism s GLU 5 Ca 0.51 2.20 -0.12 0.00 0.36 0.00 0.00 54.97 57.92 1ism s GLU 5 Cb -0.06 -2.55 0.16 0.00 0.26 0.00 0.00 34.13 31.95 1ism s GLU 5 CO 0.31 -0.78 1.09 0.20 -0.54 0.00 0.00 175.26 175.54 1ism s GLY 6 N -0.82 1.59 0.30 -1.50 0.00 -1.26 -2.39 107.32 103.25 1ism s GLY 6 Ca 0.63 -0.18 -0.30 0.00 0.00 0.00 0.00 44.72 44.87 1ism s GLY 6 CO 0.49 0.38 1.55 -0.37 0.00 0.00 0.00 173.10 175.15 1ism n THR 7 N -4.09 1.20 -1.72 0.90 5.66 -0.62 -4.59 114.28 111.03 1ism n THR 7 Ca 0.06 -0.30 -0.42 0.00 -3.05 0.00 0.00 64.05 60.34 1ism n THR 7 Cb 0.56 -1.91 -0.01 0.00 -1.55 0.00 0.00 70.33 67.42 1ism n THR 7 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1ism n SER 8 N 1.85 3.10 -4.77 1.09 7.64 0.32 -4.69 113.62 118.17 1ism n SER 8 Ca 0.08 1.20 -0.37 0.00 1.01 0.00 0.00 58.87 60.78 1ism n SER 8 Cb 0.36 -1.52 -0.00 0.00 -1.01 0.00 0.00 64.21 62.05 1ism n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ism s ALA 9 N -0.82 2.90 -1.36 -0.43 0.00 -1.26 -2.92 121.76 117.86 1ism s ALA 9 Ca 0.58 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 53.39 1ism s ALA 9 Cb -0.55 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.25 1ism s ALA 9 CO 0.59 -0.76 0.57 0.72 0.00 0.00 0.00 175.76 176.88 1ism n HIS 10 N -0.70 -1.82 -0.08 0.00 8.25 -1.26 -4.85 115.22 114.76 1ism n HIS 10 Ca 0.08 0.55 -0.09 0.00 -0.26 0.00 0.00 57.72 58.01 1ism n HIS 10 Cb 0.48 -3.04 -0.02 0.00 1.12 0.00 0.00 29.99 28.53 1ism n HIS 10 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1ism h LEU 11 N -1.13 -1.03 -0.41 2.41 5.85 -1.93 -0.43 115.31 118.64 1ism h LEU 11 Ca -0.46 0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.46 1ism h LEU 11 Cb 1.31 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 42.78 1ism h LEU 11 CO 0.58 -0.33 0.22 -0.09 -0.34 0.00 0.00 178.44 178.48 1ism h ARG 12 N -0.29 0.43 -0.32 1.25 2.43 -1.89 0.12 114.38 116.11 1ism h ARG 12 Ca 0.15 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1ism h ARG 12 Cb 0.53 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.94 1ism h ARG 12 CO -0.47 0.28 0.01 -0.44 -1.51 0.00 0.00 179.97 177.84 1ism h ASP 13 N 0.44 -0.11 0.71 -3.80 3.32 -1.80 -0.36 116.42 114.82 1ism h ASP 13 Ca 0.17 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.25 1ism h ASP 13 Cb 0.05 0.12 0.01 0.00 0.22 0.00 0.00 39.33 39.73 1ism h ASP 13 CO -0.10 -0.02 -0.34 0.40 -1.72 0.00 0.00 179.24 177.46 1ism h ILE 14 N 0.10 0.23 -0.54 0.35 2.04 -0.71 -1.83 117.51 117.16 1ism h ILE 14 Ca 0.15 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1ism h ILE 14 Cb 0.20 0.27 -0.09 0.00 -0.74 0.00 0.00 36.82 36.47 1ism h ILE 14 CO -0.25 0.02 -0.56 0.15 0.00 0.00 0.00 178.15 177.51 1ism h PHE 15 N -1.07 -1.73 -0.85 1.37 3.57 -0.59 0.32 116.94 117.96 1ism h PHE 15 Ca -0.10 0.09 0.04 0.00 3.53 0.00 0.00 57.97 61.54 1ism h PHE 15 Cb 0.75 0.83 -0.05 0.00 2.79 0.00 0.00 35.95 40.27 1ism h PHE 15 CO -0.01 -0.46 0.56 -0.07 -2.23 0.00 0.00 178.31 176.10 1ism h LEU 16 N -0.30 0.89 0.10 0.59 3.38 -1.11 -1.00 115.31 117.86 1ism h LEU 16 Ca 0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ism h LEU 16 Cb 0.54 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1ism h LEU 16 CO -0.67 0.60 -0.05 1.23 0.09 0.00 0.00 178.44 179.64 1ism h GLY 17 N 1.03 -0.14 0.40 0.83 0.00 -0.09 0.21 103.07 105.31 1ism h GLY 17 Ca 0.34 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.77 1ism h GLY 17 CO -0.11 -0.05 -0.18 3.21 0.00 0.00 0.00 176.54 179.41 1ism h ARG 18 N -0.32 -0.21 -0.76 4.80 3.08 -0.12 -0.43 114.38 120.42 1ism h ARG 18 Ca -0.01 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.13 1ism h ARG 18 Cb 0.26 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.29 1ism h ARG 18 CO 0.02 -0.14 0.42 0.00 -1.07 0.00 0.00 179.97 179.20 1ism h ALA 20 N 1.42 -0.31 -0.46 0.00 0.00 0.67 -2.91 119.26 117.68 1ism h ALA 20 Ca 0.36 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.13 1ism h ALA 20 Cb 0.31 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1ism h ALA 20 CO -0.23 -0.71 -0.15 0.93 0.00 0.00 0.00 179.25 179.09 1ism h GLU 21 N -0.35 0.87 -0.49 0.00 5.08 -0.70 -3.13 114.58 115.86 1ism h GLU 21 Ca 0.02 -0.32 0.09 0.00 -1.00 0.00 0.00 59.36 58.15 1ism h GLU 21 Cb 0.37 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 1ism h GLU 21 CO -0.09 0.96 0.33 -0.92 -1.00 0.00 0.00 179.01 178.29 1ism h TYR 22 N 0.77 0.27 -0.55 4.33 3.20 -0.86 -2.78 116.97 121.35 1ism h TYR 22 Ca 0.12 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.10 1ism h TYR 22 Cb 0.68 -0.09 -0.09 0.00 1.54 0.00 0.00 36.73 38.77 1ism h TYR 22 CO 0.04 0.13 0.04 0.00 -1.64 0.00 0.00 178.16 176.73 1ism h ARG 23 N 0.26 0.15 -0.61 1.82 3.08 -1.46 0.11 114.38 117.73 1ism h ARG 23 Ca 0.22 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.44 1ism h ARG 23 Cb 0.54 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 1ism h ARG 23 CO -0.05 0.10 0.53 0.00 -1.07 0.00 0.00 179.97 179.49 1ism h ALA 24 N 1.47 2.44 0.01 0.04 0.00 -1.68 0.11 119.26 121.65 1ism h ALA 24 Ca 0.28 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.97 1ism h ALA 24 Cb 0.43 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1ism h ALA 24 CO -0.43 -0.85 -0.91 -0.07 0.00 0.00 0.00 179.25 176.99 1ism h LEU 25 N 0.00 0.18-10.20 0.00 3.38 -0.93 -3.46 115.31 104.28 1ism h LEU 25 Ca 0.29 -0.16 -0.52 0.00 0.09 0.00 0.00 57.88 57.58 1ism h LEU 25 Cb 1.35 -0.06 0.14 0.00 0.09 0.00 0.00 40.66 42.19 1ism h LEU 25 CO -0.00 1.00 0.37 -0.76 0.09 0.00 0.00 178.44 179.13 1ism s LEU 26 N -7.25 3.28 0.53 1.67 1.43 0.37 -4.99 118.68 113.72 1ism s LEU 26 Ca -0.02 2.21 -0.19 0.00 -1.03 0.00 0.00 54.13 55.09 1ism s LEU 26 Cb 0.10 -4.57 -0.07 0.00 0.03 0.00 0.00 46.19 41.68 1ism s LEU 26 CO 0.82 -2.13 1.08 -0.94 0.23 0.00 0.00 176.35 175.41 1ism s SER 27 N -2.32 6.00 0.18 2.29 1.04 -1.26 -4.69 113.70 114.93 1ism s SER 27 Ca 0.71 2.02 -0.25 0.00 0.48 0.00 0.00 55.95 58.91 1ism s SER 27 Cb -0.25 -2.57 0.07 0.00 0.10 0.00 0.00 66.02 63.37 1ism s SER 27 CO 0.46 -1.02 1.56 -0.65 0.98 0.00 0.00 173.24 174.56 1ism h PRO 28 N 1.25 -0.11 -0.85 4.02 0.11 -1.94 0.38 132.00 134.86 1ism h PRO 28 Ca -0.49 0.01 0.25 0.00 0.11 0.00 0.00 66.00 65.87 1ism h PRO 28 Cb 1.24 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1ism h PRO 28 CO 0.58 -0.07 0.66 0.93 -0.21 0.00 0.00 178.00 179.89 1ism h GLU 29 N -0.11 0.00 -0.36 1.05 3.07 -2.03 0.47 114.58 116.67 1ism h GLU 29 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1ism h GLU 29 Cb 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1ism h GLU 29 CO -0.83 0.00 0.00 1.04 -1.40 0.00 0.00 179.01 177.82 1ism n GLN 30 N -4.09 2.69 0.25 2.33 6.02 0.11 -4.54 117.38 120.15 1ism n GLN 30 Ca 0.17 -2.05 0.14 0.00 -0.01 0.00 0.00 57.00 55.26 1ism n GLN 30 Cb 0.96 -1.30 0.47 0.00 1.02 0.00 0.00 30.24 31.40 1ism n GLN 30 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1ism h ARG 31 N 2.28 0.00 0.00 -1.09 9.65 0.15 -3.34 114.38 122.02 1ism h ARG 31 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1ism h ARG 31 Cb 0.74 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1ism h ARG 31 CO 0.00 0.06 0.02 0.27 2.80 0.00 0.00 179.97 183.13 1ism n ASN 32 N -3.15 0.00 -4.56 -3.80 6.94 -1.26 -4.84 115.26 104.58 1ism n ASN 32 Ca 0.02 0.03 -0.44 0.00 -0.02 0.00 0.00 54.58 54.16 1ism n ASN 32 Cb 0.41 -0.03 -0.01 0.00 -2.36 0.00 0.00 39.78 37.79 1ism n ASN 32 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1ism n LYS 33 N -0.83 1.17 -3.74 -3.83 4.76 -1.26 -4.96 118.16 109.49 1ism n LYS 33 Ca 0.00 0.41 -0.36 0.00 -2.87 0.00 0.00 58.31 55.49 1ism n LYS 33 Cb 0.02 -1.76 -0.10 0.00 -1.84 0.00 0.00 35.03 31.35 1ism n LYS 33 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1ism s ASP 34 N -0.64 5.20 0.24 4.39 -1.08 -1.26 -4.99 116.67 118.52 1ism s ASP 34 Ca 0.60 -2.74 -0.06 0.00 -0.52 0.00 0.00 52.55 49.82 1ism s ASP 34 Cb -0.70 -1.84 0.42 0.00 -1.46 0.00 0.00 42.92 39.34 1ism s ASP 34 CO 0.59 -0.39 1.70 0.00 0.52 0.00 0.00 175.17 177.60 1ism h THR 36 N 0.32 1.20 -0.30 0.00 2.02 -1.96 0.52 112.91 114.71 1ism h THR 36 Ca 0.39 -0.60 -0.07 0.00 0.77 0.00 0.00 66.41 66.90 1ism h THR 36 Cb 0.62 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1ism h THR 36 CO -0.45 0.25 -0.10 0.00 0.37 0.00 0.00 175.52 175.58 1ism h ALA 37 N 1.44 0.42 -0.76 6.16 0.00 -1.66 0.19 119.26 125.06 1ism h ALA 37 Ca 0.21 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1ism h ALA 37 Cb 0.12 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1ism h ALA 37 CO -0.02 0.27 0.48 0.82 0.00 0.00 0.00 179.25 180.80 1ism h ILE 38 N 0.36 1.11 -0.34 0.00 2.04 0.24 -0.85 117.51 120.08 1ism h ILE 38 Ca 0.07 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.51 1ism h ILE 38 Cb 0.60 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1ism h ILE 38 CO 0.04 0.17 -0.16 -0.25 0.00 0.00 0.00 178.15 177.95 1ism h TRP 39 N 0.94 0.81 -0.97 1.37 2.91 0.21 -0.55 115.95 120.67 1ism h TRP 39 Ca 0.30 -0.20 0.04 0.00 1.13 0.00 0.00 58.89 60.16 1ism h TRP 39 Cb 0.01 -0.19 -0.06 0.00 -0.51 0.00 0.00 29.16 28.42 1ism h TRP 39 CO -0.03 0.91 0.63 1.49 -1.03 0.00 0.00 178.44 180.40 1ism h GLU 40 N 0.48 1.18 -0.20 2.65 4.57 -0.21 0.31 114.58 123.35 1ism h GLU 40 Ca 0.08 -0.07 -0.16 0.00 -1.18 0.00 0.00 59.36 58.03 1ism h GLU 40 Cb 0.69 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 1ism h GLU 40 CO 0.05 0.78 -0.53 0.00 -1.18 0.00 0.00 179.01 178.13 1ism h ALA 41 N 1.40 0.70 -0.45 2.92 0.00 -1.03 -3.03 119.26 119.77 1ism h ALA 41 Ca 0.39 -0.50 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1ism h ALA 41 Cb 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1ism h ALA 41 CO -0.13 0.68 -0.06 0.35 0.00 0.00 0.00 179.25 180.09 1ism h PHE 42 N 0.45 0.84 0.00 0.00 3.57 -0.40 -2.87 116.94 118.54 1ism h PHE 42 Ca 0.01 -0.14 -0.02 0.00 3.53 0.00 0.00 57.97 61.36 1ism h PHE 42 Cb 1.07 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.59 1ism h PHE 42 CO 0.05 0.81 -0.10 -0.22 -2.23 0.00 0.00 178.31 176.62 1ism h LYS 43 N 0.71 0.00 -1.04 1.11 3.64 -0.83 -3.10 116.57 117.06 1ism h LYS 43 Ca 0.13 0.00 0.28 0.00 -1.27 0.00 0.00 60.65 59.79 1ism h LYS 43 Cb 0.53 0.00 -0.12 0.00 -0.41 0.00 0.00 32.23 32.23 1ism h LYS 43 CO 0.03 0.10 0.64 0.28 -2.27 0.00 0.00 179.45 178.23 1ism h VAL 44 N 0.00 0.45 0.00 2.00 2.07 -1.51 1.00 116.25 120.26 1ism h VAL 44 Ca -0.00 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 1ism h VAL 44 Cb 0.34 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 1ism h VAL 44 CO 0.01 0.08 -0.29 0.00 0.02 0.00 0.00 177.57 177.39 1ism h ALA 45 N 1.71 0.82 0.00 1.67 0.00 -1.75 -3.21 119.26 118.50 1ism h ALA 45 Ca 0.66 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 1ism h ALA 45 Cb 1.52 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1ism h ALA 45 CO -0.44 0.36 -0.19 -0.07 0.00 0.00 0.00 179.25 178.91 1ism h LEU 46 N 0.00 0.00 0.00 0.00 3.38 0.88 -3.08 115.31 116.49 1ism h LEU 46 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1ism h LEU 46 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1ism h LEU 46 CO 0.04 0.19 -0.66 0.44 0.09 0.00 0.00 178.44 178.54 1ism h ASP 47 N 0.00 0.00 -4.33 -0.43 3.32 -1.38 -3.37 116.42 110.22 1ism h ASP 47 Ca -0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 1ism h ASP 47 Cb 0.74 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.36 1ism h ASP 47 CO 0.02 0.37 0.39 -0.54 -1.72 0.00 0.00 179.24 177.77 1ism s LYS 48 N -3.04 3.27 -0.10 3.56 1.02 -1.17 -4.97 119.74 118.31 1ism s LYS 48 Ca 0.03 0.89 -0.37 0.00 0.02 0.00 0.00 55.97 56.53 1ism s LYS 48 Cb 0.08 -2.03 -0.14 0.00 -0.52 0.00 0.00 37.83 35.21 1ism s LYS 48 CO 0.75 -0.84 1.71 -3.47 -0.92 0.00 0.00 175.35 172.58 1ism n ASP 49 N -2.86 2.74 0.00 2.83 2.03 -1.26 -4.60 116.55 115.43 1ism n ASP 49 Ca 0.07 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.43 1ism n ASP 49 Cb 0.54 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.67 1ism n ASP 49 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1ism n PRO 50 N 5.14 0.00 -0.03 -0.67 -0.04 -1.26 0.22 135.00 138.36 1ism n PRO 50 Ca 0.23 0.18 0.02 0.00 -0.04 0.00 0.00 63.50 63.89 1ism n PRO 50 Cb 0.22 -1.78 0.03 0.00 -0.04 0.00 0.00 33.50 31.92 1ism n PRO 50 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ism n SER 52 N -0.60 1.93 -4.73 0.00 7.64 0.13 -4.25 113.62 113.74 1ism n SER 52 Ca 0.03 -3.31 -0.35 0.00 1.01 0.00 0.00 58.87 56.25 1ism n SER 52 Cb 0.37 -0.45 -0.08 0.00 -1.01 0.00 0.00 64.21 63.05 1ism n SER 52 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ism s VAL 53 N -2.64 5.39 0.18 0.44 1.01 0.61 -4.82 120.40 120.57 1ism s VAL 53 Ca 0.38 0.28 0.07 0.00 0.00 0.00 0.00 61.98 62.71 1ism s VAL 53 Cb 0.38 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1ism s VAL 53 CO -0.08 0.43 0.06 -0.76 0.00 0.00 0.00 175.10 174.75 1ism s LEU 54 N 0.36 3.52 0.20 3.92 1.43 -1.26 -4.22 118.68 122.62 1ism s LEU 54 Ca 0.10 -0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 1ism s LEU 54 Cb -0.11 -2.13 0.22 0.00 0.03 0.00 0.00 46.19 44.19 1ism s LEU 54 CO -0.00 0.06 1.77 -0.65 0.23 0.00 0.00 176.35 177.76 1ism h PRO 55 N 2.43 0.48 -0.00 1.29 0.11 -1.96 -0.07 132.00 134.28 1ism h PRO 55 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ism h PRO 55 Cb 1.21 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1ism h PRO 55 CO 0.60 0.32 0.34 0.66 -0.21 0.00 0.00 178.00 179.71 1ism h SER 56 N 0.49 0.00 0.01 -2.05 4.64 -1.95 0.18 113.55 114.87 1ism h SER 56 Ca 0.27 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.51 1ism h SER 56 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1ism h SER 56 CO -0.23 0.00 -0.22 0.44 -0.87 0.00 0.00 176.83 175.95 1ism h ASP 57 N 0.00 0.36 -0.04 4.97 3.32 -1.40 -2.14 116.42 121.50 1ism h ASP 57 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1ism h ASP 57 Cb 0.69 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1ism h ASP 57 CO -0.00 0.59 0.00 -1.22 -1.72 0.00 0.00 179.24 176.89 1ism n TYR 58 N -4.16 0.05 -0.12 4.55 4.02 0.63 -4.11 117.16 118.02 1ism n TYR 58 Ca -0.00 -0.02 -0.05 0.00 -0.01 0.00 0.00 57.90 57.81 1ism n TYR 58 Cb 0.36 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.71 1ism n TYR 58 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1ism h ASP 59 N 0.34 0.09 -0.45 7.72 3.32 -1.47 -0.31 116.42 125.66 1ism h ASP 59 Ca 0.00 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1ism h ASP 59 Cb 0.08 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 1ism h ASP 59 CO 0.00 0.08 0.22 0.25 -1.72 0.00 0.00 179.24 178.07 1ism h LEU 60 N 0.25 0.58 -0.59 1.55 6.46 -1.81 -0.54 115.31 121.22 1ism h LEU 60 Ca 0.18 -0.12 0.06 0.00 -0.12 0.00 0.00 57.88 57.88 1ism h LEU 60 Cb 0.19 -0.15 -0.05 0.00 -0.73 0.00 0.00 40.66 39.92 1ism h LEU 60 CO -0.21 0.54 0.30 0.15 -0.62 0.00 0.00 178.44 178.60 1ism h PHE 61 N 0.58 0.54 -0.09 1.25 3.57 -1.68 -1.10 116.94 120.02 1ism h PHE 61 Ca 0.15 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 1ism h PHE 61 Cb 0.11 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1ism h PHE 61 CO -0.01 0.25 -0.35 0.82 -2.23 0.00 0.00 178.31 176.79 1ism h ILE 62 N 0.56 1.28 0.01 1.41 1.08 -0.72 -2.79 117.51 118.34 1ism h ILE 62 Ca 0.27 -1.32 -0.00 0.00 -0.39 0.00 0.00 64.86 63.42 1ism h ILE 62 Cb 0.19 1.60 0.00 0.00 -3.07 0.00 0.00 36.82 35.54 1ism h ILE 62 CO -0.19 0.39 -0.01 0.74 -0.69 0.00 0.00 178.15 178.40 1ism h THR 63 N 0.15 1.05 0.00 -0.27 2.02 0.18 0.18 112.91 116.21 1ism h THR 63 Ca 0.02 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1ism h THR 63 Cb 0.69 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 1ism h THR 63 CO 0.05 0.05 0.00 0.18 0.37 0.00 0.00 175.52 176.17 1ism n LEU 64 N -5.06 0.19 -0.00 2.58 4.77 -0.92 -3.78 117.00 114.78 1ism n LEU 64 Ca -0.07 0.53 0.01 0.00 -0.03 0.00 0.00 56.01 56.45 1ism n LEU 64 Cb 0.07 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.66 1ism n LEU 64 CO 0.33 -0.16 -0.20 -1.54 -1.33 0.00 0.00 177.39 174.49 1ism n SER 65 N -1.69 1.70 -4.57 -1.43 3.41 -1.06 -4.65 113.62 105.32 1ism n SER 65 Ca 0.05 -0.36 -0.38 0.00 -0.26 0.00 0.00 58.87 57.92 1ism n SER 65 Cb 0.29 1.05 0.04 0.00 -0.26 0.00 0.00 64.21 65.33 1ism n SER 65 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1ism n ARG 66 N -1.26 0.86 -3.55 4.33 0.63 0.62 -4.44 116.66 113.84 1ism n ARG 66 Ca 0.00 0.33 -0.08 0.00 -0.92 0.00 0.00 57.85 57.17 1ism n ARG 66 Cb 0.06 -2.01 -0.03 0.00 0.45 0.00 0.00 32.46 30.93 1ism n ARG 66 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 1ism s HIS 67 N -1.53 -0.31 0.95 -0.14 -3.43 -1.26 -5.05 115.29 104.52 1ism s HIS 67 Ca 0.71 0.34 -0.10 0.00 -0.80 0.00 0.00 55.06 55.22 1ism s HIS 67 Cb -0.45 0.50 0.17 0.00 -1.43 0.00 0.00 32.58 31.37 1ism s HIS 67 CO 0.51 -0.40 1.13 -1.54 -2.00 0.00 0.00 174.74 172.44 1ism s SER 68 N -1.89 2.59 -0.09 7.38 1.04 -1.26 -5.02 113.70 116.46 1ism s SER 68 Ca 0.03 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.59 1ism s SER 68 Cb -0.01 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.59 1ism s SER 68 CO -0.04 -3.30 -0.07 -0.63 0.98 0.00 0.00 173.24 170.18 1ism s ILE 69 N -2.61 0.87 0.19 -1.02 1.01 -1.26 -5.07 121.20 113.30 1ism s ILE 69 Ca 0.67 -0.24 -0.32 0.00 0.00 0.00 0.00 60.65 60.76 1ism s ILE 69 Cb -0.23 -0.89 -0.16 0.00 0.01 0.00 0.00 42.46 41.19 1ism s ILE 69 CO 0.59 0.33 1.13 -2.65 0.00 0.00 0.00 174.94 174.33 1ism n PRO 70 N 4.59 1.15 -1.78 2.79 -0.02 -1.26 -4.80 135.00 135.67 1ism n PRO 70 Ca -0.16 0.41 -0.40 0.00 -2.02 0.00 0.00 63.50 61.33 1ism n PRO 70 Cb 0.50 -1.88 0.02 0.00 -0.02 0.00 0.00 33.50 32.13 1ism n PRO 70 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1ism s ARG 71 N -0.53 3.57 0.00 -0.52 3.52 -1.26 -2.05 118.95 121.68 1ism s ARG 71 Ca 0.71 2.40 0.00 0.00 -0.13 0.00 0.00 55.73 58.72 1ism s ARG 71 Cb -0.84 -2.58 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 1ism s ARG 71 CO 0.53 -0.90 0.00 -0.25 -0.81 0.00 0.00 175.30 173.87 1ism n ASP 72 N -0.36 -3.50 -0.48 -2.12 8.00 -0.66 -4.84 116.55 112.59 1ism n ASP 72 Ca 0.06 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.61 1ism n ASP 72 Cb 0.42 -1.87 0.09 0.00 -0.02 0.00 0.00 41.12 39.74 1ism n ASP 72 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ism n LYS 73 N -1.18 1.53 -2.46 -1.24 4.76 -0.87 -4.81 118.16 113.88 1ism n LYS 73 Ca 0.00 -1.51 -0.34 0.00 -2.87 0.00 0.00 58.31 53.60 1ism n LYS 73 Cb 0.20 -1.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.15 1ism n LYS 73 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1ism s SER 74 N -0.91 6.29 -0.29 4.39 0.01 -1.26 -0.48 113.70 121.44 1ism s SER 74 Ca 0.16 1.88 -0.01 0.00 1.31 0.00 0.00 55.95 59.28 1ism s SER 74 Cb 0.09 -2.55 0.13 0.00 0.21 0.00 0.00 66.02 63.90 1ism s SER 74 CO 0.13 -0.82 0.27 -0.22 0.41 0.00 0.00 173.24 173.01 1ism s LEU 75 N -3.69 -0.09 0.45 2.44 2.96 -1.26 -3.49 118.68 116.00 1ism s LEU 75 Ca 0.66 -0.87 -0.06 0.00 -0.22 0.00 0.00 54.13 53.63 1ism s LEU 75 Cb -0.15 0.35 -0.04 0.00 0.50 0.00 0.00 46.19 46.84 1ism s LEU 75 CO 0.23 -0.40 0.76 -0.36 -1.32 0.00 0.00 176.35 175.27 1ism s PHE 76 N 2.29 3.54 0.19 5.38 0.40 0.11 -4.35 117.98 125.54 1ism s PHE 76 Ca 0.09 0.83 -0.24 0.00 -0.60 0.00 0.00 56.93 57.02 1ism s PHE 76 Cb -0.14 -2.30 0.05 0.00 0.51 0.00 0.00 43.02 41.13 1ism s PHE 76 CO -0.33 -0.21 0.86 1.67 0.70 0.00 0.00 175.22 177.91 1ism s TRP 77 N -2.62 -0.18 -0.05 0.36 1.48 -1.26 -1.18 118.94 115.50 1ism s TRP 77 Ca 0.48 -0.17 -0.14 0.00 -1.06 0.00 0.00 56.10 55.21 1ism s TRP 77 Cb -0.10 0.66 0.03 0.00 -1.16 0.00 0.00 33.47 32.89 1ism s TRP 77 CO 0.41 -0.96 0.32 -1.21 -4.06 0.00 0.00 176.95 171.45 1ism s GLU 78 N -3.51 0.58 -1.70 3.25 0.41 -1.03 -4.75 118.70 111.93 1ism s GLU 78 Ca 0.11 0.02 -0.17 0.00 -0.41 0.00 0.00 54.97 54.52 1ism s GLU 78 Cb -0.03 0.26 0.15 0.00 -1.78 0.00 0.00 34.13 32.73 1ism s GLU 78 CO 0.03 -0.14 0.70 0.09 -0.49 0.00 0.00 175.26 175.45 1ism n ASN 79 N 1.80 -2.66 -0.85 -0.19 3.02 -1.26 -3.71 115.26 111.40 1ism n ASN 79 Ca -0.19 -1.06 -0.05 0.00 -0.03 0.00 0.00 54.58 53.25 1ism n ASN 79 Cb 0.56 -2.57 -0.05 0.00 -0.61 0.00 0.00 39.78 37.12 1ism n ASN 79 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1ism n SER 80 N -2.67 -0.73 -0.39 6.41 3.41 -1.26 -4.54 113.62 113.86 1ism n SER 80 Ca 0.03 -1.54 -0.09 0.00 -0.26 0.00 0.00 58.87 57.01 1ism n SER 80 Cb 0.51 0.22 -0.07 0.00 -0.26 0.00 0.00 64.21 64.61 1ism n SER 80 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1ism n HIS 81 N 0.00 -0.35 0.05 7.33 -0.00 -1.26 -0.59 115.22 120.40 1ism n HIS 81 Ca -0.20 1.19 -0.12 0.00 0.46 0.00 0.00 57.72 59.04 1ism n HIS 81 Cb 0.59 -0.62 -0.07 0.00 -0.12 0.00 0.00 29.99 29.77 1ism n HIS 81 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1ism h LEU 82 N 0.00 -0.02 -1.05 0.27 3.38 -1.99 -0.98 115.31 114.91 1ism h LEU 82 Ca 0.18 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.22 1ism h LEU 82 Cb 0.42 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 1ism h LEU 82 CO -0.90 -0.00 0.63 0.25 0.09 0.00 0.00 178.44 178.50 1ism h LEU 83 N -0.04 0.96 -0.15 1.67 5.85 -1.77 0.14 115.31 121.97 1ism h LEU 83 Ca -0.00 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1ism h LEU 83 Cb 0.04 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1ism h LEU 83 CO 0.00 0.58 0.05 0.58 -0.34 0.00 0.00 178.44 179.31 1ism h VAL 84 N 1.07 1.17 -0.39 1.05 2.07 -0.40 -0.02 116.25 120.80 1ism h VAL 84 Ca 0.45 -0.53 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 1ism h VAL 84 Cb 0.30 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1ism h VAL 84 CO -0.20 0.16 0.24 0.78 0.02 0.00 0.00 177.57 178.58 1ism h ASN 85 N 0.07 0.46 0.35 0.57 -0.26 -0.45 -1.55 115.58 114.78 1ism h ASN 85 Ca 0.05 -0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.73 1ism h ASN 85 Cb 0.20 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.35 1ism h ASN 85 CO -0.00 0.37 -0.17 -1.28 -1.06 0.00 0.00 177.43 175.28 1ism h SER 86 N 0.52 -0.40 0.03 5.81 0.87 -0.62 -2.78 113.55 116.98 1ism h SER 86 Ca 0.14 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1ism h SER 86 Cb -0.02 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1ism h SER 86 CO -0.03 -0.29 -0.02 0.15 -0.53 0.00 0.00 176.83 176.12 1ism h PHE 87 N -0.48 -0.04 -0.96 2.24 3.04 -0.94 -2.85 116.94 116.95 1ism h PHE 87 Ca -0.05 -0.00 0.19 0.00 3.98 0.00 0.00 57.97 62.09 1ism h PHE 87 Cb 0.37 0.01 -0.09 0.00 2.56 0.00 0.00 35.95 38.80 1ism h PHE 87 CO -0.05 0.08 0.61 0.00 -2.02 0.00 0.00 178.31 176.93 1ism h ALA 88 N 0.81 1.89 -5.43 2.41 0.00 -1.33 -3.41 119.26 114.20 1ism h ALA 88 Ca -0.00 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 54.71 1ism h ALA 88 Cb 0.14 -0.07 0.20 0.00 0.00 0.00 0.00 17.79 18.06 1ism h ALA 88 CO 0.01 -0.22 -0.84 -3.47 0.00 0.00 0.00 179.25 174.73 1ism n ASP 89 N -4.64 -6.64 -3.77 0.00 2.03 -1.05 0.22 116.55 102.70 1ism n ASP 89 Ca 0.21 -0.69 -0.30 0.00 0.52 0.00 0.00 54.79 54.53 1ism n ASP 89 Cb 0.61 -5.19 0.03 0.00 -0.72 0.00 0.00 41.12 35.85 1ism n ASP 89 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1ism n ASN 90 N -3.19 -3.76 0.00 1.67 5.15 -1.26 -1.34 115.26 112.52 1ism n ASN 90 Ca -0.07 -1.02 0.00 0.00 -0.60 0.00 0.00 54.58 52.90 1ism n ASN 90 Cb 0.62 -3.26 0.00 0.00 -0.53 0.00 0.00 39.78 36.60 1ism n ASN 90 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1ism n THR 91 N -4.28 0.00 0.41 -0.44 -2.24 -1.19 -4.90 114.28 101.65 1ism n THR 91 Ca -0.16 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.44 1ism n THR 91 Cb 0.62 -0.11 -0.09 0.00 -2.10 0.00 0.00 70.33 68.65 1ism n THR 91 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1ism h ARG 92 N 1.23 -1.01 0.08 -0.78 2.43 -0.99 -3.35 114.38 111.98 1ism h ARG 92 Ca 0.00 0.07 -0.16 0.00 -0.81 0.00 0.00 59.98 59.08 1ism h ARG 92 Cb 0.00 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1ism h ARG 92 CO 0.00 -0.66 -0.76 0.00 -1.51 0.00 0.00 179.97 177.04 1ism h ARG 93 N -1.18 0.16 -4.41 0.20 3.08 -0.43 -3.49 114.38 108.30 1ism h ARG 93 Ca -0.11 -0.28 -0.31 0.00 0.07 0.00 0.00 59.98 59.35 1ism h ARG 93 Cb 0.82 0.10 -0.11 0.00 0.08 0.00 0.00 29.97 30.86 1ism h ARG 93 CO 0.18 1.13 -0.36 -0.06 -1.07 0.00 0.00 179.97 179.79 1ism s PHE 94 N -2.37 1.24 -0.52 3.04 0.40 -1.00 -5.00 117.98 113.77 1ism s PHE 94 Ca -0.18 -1.38 0.06 0.00 -0.60 0.00 0.00 56.93 54.83 1ism s PHE 94 Cb 0.01 -0.35 0.21 0.00 0.51 0.00 0.00 43.02 43.40 1ism s PHE 94 CO 0.75 -0.95 0.51 -0.12 0.70 0.00 0.00 175.22 176.11 1ism n MET 95 N -0.51 1.20 -1.15 0.44 1.56 0.37 -3.14 117.12 115.89 1ism n MET 95 Ca 0.03 -3.81 -0.29 0.00 -0.27 0.00 0.00 57.70 53.37 1ism n MET 95 Cb 0.63 -1.81 0.19 0.00 2.15 0.00 0.00 33.22 34.37 1ism n MET 95 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1ism s PRO 96 N -1.17 0.17 0.36 2.12 0.04 -1.26 -4.12 135.00 131.14 1ism s PRO 96 Ca 0.33 0.44 0.12 0.00 0.04 0.00 0.00 61.00 61.93 1ism s PRO 96 Cb 0.08 -1.71 0.92 0.00 0.04 0.00 0.00 34.50 33.83 1ism s PRO 96 CO -0.13 -2.89 1.79 1.25 0.04 0.00 0.00 177.00 177.06 1ism h LEU 97 N -2.00 0.61 -0.17 -3.56 5.85 -1.96 0.78 115.31 114.85 1ism h LEU 97 Ca -0.54 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1ism h LEU 97 Cb 1.33 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1ism h LEU 97 CO 0.56 0.19 0.00 -1.54 -0.34 0.00 0.00 178.44 177.31 1ism n SER 98 N -4.68 0.11 -0.94 1.25 3.41 -1.26 -1.93 113.62 109.58 1ism n SER 98 Ca 0.23 0.54 0.03 0.00 -0.26 0.00 0.00 58.87 59.41 1ism n SER 98 Cb 0.69 -0.56 0.23 0.00 -0.26 0.00 0.00 64.21 64.31 1ism n SER 98 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ism n ASP 99 N -1.63 3.23 -4.46 4.04 8.00 0.27 -3.02 116.55 122.98 1ism n ASP 99 Ca 0.02 -3.32 -0.30 0.00 0.71 0.00 0.00 54.79 51.90 1ism n ASP 99 Cb 0.12 -0.57 -0.12 0.00 -0.02 0.00 0.00 41.12 40.52 1ism n ASP 99 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ism s VAL 100 N -3.00 2.77 0.17 2.53 1.01 -0.81 -4.78 120.40 118.29 1ism s VAL 100 Ca 0.42 -1.31 -0.24 0.00 0.00 0.00 0.00 61.98 60.85 1ism s VAL 100 Cb 0.36 -2.20 0.06 0.00 0.00 0.00 0.00 36.38 34.61 1ism s VAL 100 CO 0.05 0.25 1.58 0.25 0.00 0.00 0.00 175.10 177.23 1ism h LEU 101 N 4.27 -1.31 -0.36 3.92 5.85 -1.86 0.55 115.31 126.37 1ism h LEU 101 Ca -0.48 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1ism h LEU 101 Cb 1.16 0.61 0.00 0.00 0.37 0.00 0.00 40.66 42.80 1ism h LEU 101 CO 0.47 -0.33 0.00 0.00 -0.34 0.00 0.00 178.44 178.24 1ism n TYR 102 N -5.42 0.24 -0.13 1.25 0.18 -1.26 -2.59 117.16 109.43 1ism n TYR 102 Ca 0.02 0.11 -0.26 0.00 1.88 0.00 0.00 57.90 59.65 1ism n TYR 102 Cb 0.35 -0.68 -0.11 0.00 -0.38 0.00 0.00 39.34 38.53 1ism n TYR 102 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1ism n GLY 103 N -0.87 -0.45 0.26 -7.48 0.00 0.12 -4.38 105.19 92.39 1ism n GLY 103 Ca 0.01 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 45.93 1ism n GLY 103 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ism h ARG 104 N -0.72 0.32 0.00 1.61 9.65 0.06 -0.14 114.38 125.15 1ism h ARG 104 Ca -0.65 -0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 58.20 1ism h ARG 104 Cb 1.69 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 30.19 1ism h ARG 104 CO -0.32 0.21 -0.02 -0.39 2.80 0.00 0.00 179.97 182.25 1ism h VAL 105 N 0.33 0.50 -0.01 0.20 -1.51 -1.73 -3.03 116.25 111.01 1ism h VAL 105 Ca 0.38 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.78 1ism h VAL 105 Cb 0.60 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 30.81 1ism h VAL 105 CO -0.44 0.02 -0.00 0.00 -1.23 0.00 0.00 177.57 175.92 1ism n ALA 106 N -2.30 2.49 -1.63 5.19 0.00 -0.45 -4.56 120.51 119.25 1ism n ALA 106 Ca -0.03 -0.54 -0.49 0.00 0.00 0.00 0.00 53.44 52.39 1ism n ALA 106 Cb 0.10 -0.18 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 1ism n ALA 106 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ism n ASP 107 N 0.29 2.32 0.00 0.00 4.64 -0.19 -2.07 116.55 121.54 1ism n ASP 107 Ca 0.03 1.11 0.00 0.00 -1.38 0.00 0.00 54.79 54.55 1ism n ASP 107 Cb 0.13 -1.31 0.00 0.00 -1.04 0.00 0.00 41.12 38.90 1ism n ASP 107 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1ism n PHE 108 N 2.76 0.00 -1.85 -0.67 3.01 -1.26 -4.95 117.46 114.51 1ism n PHE 108 Ca 0.17 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.33 1ism n PHE 108 Cb 0.25 -1.22 0.15 0.00 -0.01 0.00 0.00 39.48 38.64 1ism n PHE 108 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1ism s LEU 109 N 0.00 2.48 0.05 4.37 1.43 -0.88 -5.08 118.68 121.06 1ism s LEU 109 Ca 0.00 0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 53.55 1ism s LEU 109 Cb 0.00 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.47 1ism s LEU 109 CO 0.00 -2.48 0.18 -0.55 0.23 0.00 0.00 176.35 173.73 1ism s SER 110 N -4.66 0.08 -0.17 2.29 0.15 -1.26 -4.97 113.70 105.16 1ism s SER 110 Ca 0.69 -0.45 -0.31 0.00 0.70 0.00 0.00 55.95 56.58 1ism s SER 110 Cb -0.08 0.29 0.14 0.00 -1.71 0.00 0.00 66.02 64.66 1ism s SER 110 CO 0.52 -0.58 1.12 -1.66 1.20 0.00 0.00 173.24 173.84 1ism s TRP 111 N -2.79 -0.23 0.00 3.44 -2.14 -1.26 -0.52 118.94 115.43 1ism s TRP 111 Ca -0.03 0.29 0.00 0.00 2.66 0.00 0.00 56.10 59.01 1ism s TRP 111 Cb -0.00 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.86 1ism s TRP 111 CO -0.05 -0.27 0.00 0.00 -2.66 0.00 0.00 176.95 173.97 1ism s ARG 113 N -2.00 2.88 0.45 0.00 3.52 -1.26 -1.73 118.95 120.81 1ism s ARG 113 Ca 0.00 -0.47 -0.25 0.00 -0.13 0.00 0.00 55.73 54.88 1ism s ARG 113 Cb 0.00 -2.48 -0.08 0.00 -1.56 0.00 0.00 34.95 30.83 1ism s ARG 113 CO 0.00 -0.49 1.38 -0.65 -0.81 0.00 0.00 175.30 174.73 1ism s GLN 114 N -4.71 3.70 0.37 5.12 -1.52 0.45 -4.31 119.66 118.76 1ism s GLN 114 Ca 0.52 2.32 0.07 0.00 -1.95 0.00 0.00 55.36 56.32 1ism s GLN 114 Cb -0.10 -2.63 0.79 0.00 -0.22 0.00 0.00 33.01 30.84 1ism s GLN 114 CO 0.39 -0.77 1.94 -0.22 -0.25 0.00 0.00 175.29 176.39 1ism h LYS 115 N 2.31 0.69 0.00 2.91 3.11 -1.96 -3.34 116.57 120.29 1ism h LYS 115 Ca -0.51 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.29 1ism h LYS 115 Cb 1.26 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.34 1ism h LYS 115 CO 0.61 0.45 -0.89 0.00 -2.81 0.00 0.00 179.45 176.81 1ism n ALA 116 N -2.45 1.96 -1.81 5.00 0.00 -1.26 -4.86 120.51 117.09 1ism n ALA 116 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 1ism n ALA 116 Cb 0.29 0.37 0.13 0.00 0.00 0.00 0.00 19.45 20.24 1ism n ALA 116 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ism s ASP 117 N -3.52 3.86 0.00 0.00 2.15 -1.25 -5.01 116.67 112.90 1ism s ASP 117 Ca 0.00 0.69 0.25 0.00 0.43 0.00 0.00 52.55 53.91 1ism s ASP 117 Cb 0.00 -1.08 0.60 0.00 -0.30 0.00 0.00 42.92 42.14 1ism s ASP 117 CO 0.00 -2.30 1.49 -1.54 -0.17 0.00 0.00 175.17 172.65 1ism n SER 118 N -3.56 2.37 -1.80 -0.34 3.41 -1.26 -3.79 113.62 108.65 1ism n SER 118 Ca 0.10 -1.79 0.00 0.00 -0.26 0.00 0.00 58.87 56.92 1ism n SER 118 Cb 0.60 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 1ism n SER 118 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ism n GLY 119 N 1.28 1.13 3.74 5.00 0.00 -1.26 -4.82 105.19 110.26 1ism n GLY 119 Ca 0.17 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.83 1ism n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ism s LEU 120 N 0.00 4.27 -0.59 0.99 1.43 -1.26 -0.41 118.68 123.11 1ism s LEU 120 Ca 0.00 0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 53.41 1ism s LEU 120 Cb 0.00 -2.43 0.03 0.00 0.03 0.00 0.00 46.19 43.82 1ism s LEU 120 CO 0.00 0.11 1.18 -0.62 0.23 0.00 0.00 176.35 177.26 1ism s ASP 121 N 0.31 6.42 0.00 2.29 -1.08 -0.71 -4.74 116.67 119.16 1ism s ASP 121 Ca 0.19 0.04 0.27 0.00 -0.52 0.00 0.00 52.55 52.53 1ism s ASP 121 Cb -0.14 -2.55 0.94 0.00 -1.46 0.00 0.00 42.92 39.72 1ism s ASP 121 CO 0.06 -1.49 1.68 -1.22 0.52 0.00 0.00 175.17 174.72 1ism n TYR 122 N 8.44 0.00 -0.06 -5.34 4.02 -1.26 -1.60 117.16 121.36 1ism n TYR 122 Ca 0.08 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.82 1ism n TYR 122 Cb 0.49 -0.02 -0.13 0.00 -0.02 0.00 0.00 39.34 39.66 1ism n TYR 122 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1ism h GLN 123 N 2.30 0.03 -1.11 -0.72 5.75 -1.90 -3.39 115.11 116.05 1ism h GLN 123 Ca 0.00 -0.04 0.22 0.00 -0.15 0.00 0.00 58.65 58.68 1ism h GLN 123 Cb 0.53 0.01 -0.27 0.00 1.07 0.00 0.00 27.48 28.82 1ism h GLN 123 CO 0.00 0.96 0.90 -1.54 -2.65 0.00 0.00 178.83 176.51 1ism s SER 124 N -6.22 -0.08 0.14 -0.69 1.04 -1.26 -4.06 113.70 102.57 1ism s SER 124 Ca -0.18 0.09 0.08 0.00 0.48 0.00 0.00 55.95 56.42 1ism s SER 124 Cb -0.02 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 1ism s SER 124 CO 0.70 -0.07 -0.13 0.00 0.98 0.00 0.00 173.24 174.72 1ism s PRO 126 N -2.40 4.19 0.00 0.00 0.04 -1.26 -0.61 135.00 134.96 1ism s PRO 126 Ca 0.21 2.45 0.00 0.00 0.04 0.00 0.00 61.00 63.70 1ism s PRO 126 Cb -0.10 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1ism s PRO 126 CO 0.13 -0.51 0.00 0.25 0.04 0.00 0.00 177.00 176.91 1ism n THR 127 N 1.82 0.00 0.01 1.26 -2.24 -1.26 -4.74 114.28 109.13 1ism n THR 127 Ca 0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.71 1ism n THR 127 Cb 0.39 -1.59 -0.08 0.00 -2.10 0.00 0.00 70.33 66.95 1ism n THR 127 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1ism h SER 128 N 0.00 0.03 -0.44 3.42 0.87 -1.91 -3.14 113.55 112.38 1ism h SER 128 Ca 0.00 -0.22 0.01 0.00 -1.23 0.00 0.00 61.79 60.35 1ism h SER 128 Cb 0.00 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1ism h SER 128 CO 0.00 0.24 0.27 -0.33 -0.53 0.00 0.00 176.83 176.49 1ism h GLU 129 N -0.19 0.54 -1.02 2.24 5.08 -1.96 -2.38 114.58 116.88 1ism h GLU 129 Ca 0.01 -0.03 0.28 0.00 -1.00 0.00 0.00 59.36 58.62 1ism h GLU 129 Cb 0.23 -0.12 -0.13 0.00 0.50 0.00 0.00 28.75 29.23 1ism h GLU 129 CO 0.00 0.36 0.61 -0.44 -1.00 0.00 0.00 179.01 178.53 1ism h ASP 130 N 0.56 0.58 0.00 1.42 3.32 -1.91 -3.43 116.42 116.96 1ism h ASP 130 Ca 0.17 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.37 1ism h ASP 130 Cb -0.03 0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1ism h ASP 130 CO -0.06 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.47 1ism h GLU 132 N 0.00 -1.02 -2.73 0.00 4.81 -1.79 -3.35 114.58 110.50 1ism h GLU 132 Ca 0.00 0.07 -0.20 0.00 -0.13 0.00 0.00 59.36 59.10 1ism h GLU 132 Cb 0.00 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1ism h GLU 132 CO 0.00 -0.67 0.82 0.09 -0.73 0.00 0.00 179.01 178.52 1ism n ASN 133 N -5.54 3.72 -4.92 1.04 3.02 -1.26 -4.74 115.26 106.58 1ism n ASN 133 Ca -0.15 -2.15 -0.26 0.00 -0.03 0.00 0.00 54.58 51.99 1ism n ASN 133 Cb 0.42 -0.92 0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1ism n ASN 133 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ism s ASN 134 N 2.70 6.18 0.19 6.41 2.20 -1.26 -0.29 114.94 131.09 1ism s ASN 134 Ca 0.40 0.75 -0.12 0.00 -0.94 0.00 0.00 52.86 52.95 1ism s ASN 134 Cb 0.16 -2.10 0.17 0.00 -2.00 0.00 0.00 41.25 37.48 1ism s ASN 134 CO -0.01 -0.56 1.79 -0.65 -2.94 0.00 0.00 177.10 174.73 1ism h PRO 135 N 0.33 0.53 -0.35 3.55 0.11 -1.84 -2.42 132.00 131.91 1ism h PRO 135 Ca -0.47 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 1ism h PRO 135 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1ism h PRO 135 CO 0.61 0.35 -0.03 0.28 -0.21 0.00 0.00 178.00 179.01 1ism h VAL 136 N 0.55 1.27 -0.17 3.15 2.07 -1.92 -1.28 116.25 119.91 1ism h VAL 136 Ca 0.25 -1.04 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 1ism h VAL 136 Cb 0.15 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1ism h VAL 136 CO -0.17 0.34 0.00 0.44 0.02 0.00 0.00 177.57 178.21 1ism h ASP 137 N 0.44 0.30 -0.76 0.57 3.32 -1.88 -2.23 116.42 116.18 1ism h ASP 137 Ca 0.10 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 56.86 1ism h ASP 137 Cb 0.50 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.93 1ism h ASP 137 CO 0.02 0.53 0.49 0.28 -1.72 0.00 0.00 179.24 178.84 1ism h SER 138 N 0.06 0.83 0.23 6.45 0.02 -1.46 -0.48 113.55 119.20 1ism h SER 138 Ca 0.05 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1ism h SER 138 Cb 0.37 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1ism h SER 138 CO 0.01 0.58 -0.44 0.15 -1.14 0.00 0.00 176.83 175.99 1ism h PHE 139 N 0.98 -1.25 0.00 3.45 3.57 -1.08 0.08 116.94 122.68 1ism h PHE 139 Ca 0.29 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.81 1ism h PHE 139 Cb -0.04 0.52 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 1ism h PHE 139 CO -0.03 -0.53 -0.01 -1.49 -2.23 0.00 0.00 178.31 174.03 1ism h TRP 140 N -0.72 0.00 -0.24 0.41 4.06 -1.19 0.19 115.95 118.46 1ism h TRP 140 Ca -0.02 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.86 1ism h TRP 140 Cb 0.68 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.83 1ism h TRP 140 CO -0.35 0.01 -0.12 0.87 -3.56 0.00 0.00 178.44 175.29 1ism h LYS 141 N 0.00 0.51 0.24 0.49 1.57 -0.57 -0.63 116.57 118.19 1ism h LYS 141 Ca -0.00 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 1ism h LYS 141 Cb 0.01 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ism h LYS 141 CO 0.00 0.77 -0.12 0.00 -0.57 0.00 0.00 179.45 179.54 1ism h ARG 142 N 0.23 -0.32 -0.55 3.15 2.47 0.56 -2.29 114.38 117.64 1ism h ARG 142 Ca 0.05 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1ism h ARG 142 Cb 0.62 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.98 1ism h ARG 142 CO 0.04 -0.08 0.35 0.00 0.56 0.00 0.00 179.97 180.84 1ism h ALA 143 N 0.19 0.70 -0.56 0.04 0.00 -0.75 -1.86 119.26 117.02 1ism h ALA 143 Ca -0.03 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1ism h ALA 143 Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1ism h ALA 143 CO 0.05 0.16 -0.00 0.66 0.00 0.00 0.00 179.25 180.12 1ism h SER 144 N 0.75 0.95 -0.46 0.00 4.64 -1.14 0.12 113.55 118.42 1ism h SER 144 Ca 0.20 -0.26 -0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1ism h SER 144 Cb -0.06 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.76 1ism h SER 144 CO -0.04 1.01 0.27 0.40 -0.87 0.00 0.00 176.83 177.60 1ism h ILE 145 N 0.90 1.15 0.32 0.95 2.04 -1.20 -0.70 117.51 120.97 1ism h ILE 145 Ca 0.16 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1ism h ILE 145 Cb 0.53 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1ism h ILE 145 CO 0.03 0.15 -0.15 -0.61 0.00 0.00 0.00 178.15 177.57 1ism h GLN 146 N 0.61 -0.41 -0.99 2.37 5.75 -0.97 -2.17 115.11 119.31 1ism h GLN 146 Ca 0.17 0.03 0.19 0.00 -0.15 0.00 0.00 58.65 58.89 1ism h GLN 146 Cb 0.01 0.09 -0.11 0.00 1.07 0.00 0.00 27.48 28.54 1ism h GLN 146 CO -0.03 -0.24 0.58 -0.92 -2.65 0.00 0.00 178.83 175.58 1ism h TYR 147 N -0.48 1.02 -0.25 3.99 3.20 -0.52 -0.69 116.97 123.24 1ism h TYR 147 Ca -0.04 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.75 1ism h TYR 147 Cb 0.36 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1ism h TYR 147 CO -0.04 0.20 -0.27 0.77 -1.64 0.00 0.00 178.16 177.18 1ism h SER 148 N 0.71 0.67 0.36 -2.11 0.02 -0.92 -2.66 113.55 109.62 1ism h SER 148 Ca 0.58 -0.48 -0.07 0.00 -0.84 0.00 0.00 61.79 60.97 1ism h SER 148 Cb 0.93 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 1ism h SER 148 CO -0.40 1.01 -0.35 0.11 -1.14 0.00 0.00 176.83 176.06 1ism h LYS 149 N 0.34 0.00 -0.01 3.45 1.57 -0.68 -2.80 116.57 118.44 1ism h LYS 149 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1ism h LYS 149 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1ism h LYS 149 CO 0.07 0.35 -0.13 -0.25 -0.57 0.00 0.00 179.45 178.92 1ism n ASP 150 N -4.11 1.03 -4.87 0.86 8.00 -0.35 -4.76 116.55 112.35 1ism n ASP 150 Ca -0.02 -1.03 -0.30 0.00 0.71 0.00 0.00 54.79 54.15 1ism n ASP 150 Cb 0.39 0.05 -0.01 0.00 -0.02 0.00 0.00 41.12 41.53 1ism n ASP 150 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1ism s SER 151 N -2.31 6.36 0.26 -2.24 0.01 -1.01 -4.52 113.70 110.24 1ism s SER 151 Ca 0.31 1.28 -0.21 0.00 1.31 0.00 0.00 55.95 58.64 1ism s SER 151 Cb 0.20 -2.40 0.03 0.00 0.21 0.00 0.00 66.02 64.06 1ism s SER 151 CO 0.45 -0.68 0.78 -0.94 0.41 0.00 0.00 173.24 173.26 1ism s SER 152 N -3.80 -0.22 0.70 2.44 1.04 -1.26 -4.78 113.70 107.83 1ism s SER 152 Ca 0.53 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1ism s SER 152 Cb -0.11 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1ism s SER 152 CO 0.44 -1.27 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1ism n GLY 153 N -0.47 0.88 3.70 7.32 0.00 0.55 -1.65 105.19 115.52 1ism n GLY 153 Ca -0.05 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1ism n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ism s VAL 154 N 0.00 5.04 -0.21 1.61 1.01 -1.26 -0.65 120.40 125.93 1ism s VAL 154 Ca 0.00 1.34 -0.12 0.00 0.00 0.00 0.00 61.98 63.19 1ism s VAL 154 Cb 0.00 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 1ism s VAL 154 CO 0.00 0.20 0.23 -0.63 0.00 0.00 0.00 175.10 174.89 1ism s ILE 155 N 1.23 5.33 0.03 2.22 -1.09 -0.40 -4.23 121.20 124.30 1ism s ILE 155 Ca 0.34 0.35 0.03 0.00 -2.23 0.00 0.00 60.65 59.14 1ism s ILE 155 Cb -0.17 -3.56 -0.04 0.00 -1.58 0.00 0.00 42.46 37.11 1ism s ILE 155 CO 0.14 0.35 -0.02 -1.00 -1.23 0.00 0.00 174.94 173.18 1ism s HIS 156 N 0.90 2.99 -0.05 3.97 3.76 -1.23 -0.20 115.29 125.43 1ism s HIS 156 Ca 0.11 0.01 -0.01 0.00 -0.15 0.00 0.00 55.06 55.02 1ism s HIS 156 Cb -0.13 -1.60 0.03 0.00 1.11 0.00 0.00 32.58 31.98 1ism s HIS 156 CO 0.04 0.44 0.02 0.08 -0.85 0.00 0.00 174.74 174.48 1ism s VAL 157 N -1.14 0.15 -0.29 -0.90 1.01 -0.22 -0.71 120.40 118.29 1ism s VAL 157 Ca 0.21 0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 1ism s VAL 157 Cb -0.11 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 1ism s VAL 157 CO 0.12 0.21 0.16 -0.32 0.00 0.00 0.00 175.10 175.28 1ism s MET 158 N 1.91 3.62 0.23 2.72 1.75 -0.32 0.44 119.30 129.65 1ism s MET 158 Ca 0.03 -0.53 0.09 0.00 -1.25 0.00 0.00 55.69 54.03 1ism s MET 158 Cb -0.12 -3.59 -0.04 0.00 2.84 0.00 0.00 34.83 33.92 1ism s MET 158 CO -0.04 -0.30 -0.06 -0.51 -0.65 0.00 0.00 175.02 173.46 1ism s LEU 159 N 1.68 3.05 -0.43 4.11 1.43 0.71 -2.48 118.68 126.75 1ism s LEU 159 Ca 0.06 -0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 52.34 1ism s LEU 159 Cb -0.16 -1.64 0.03 0.00 0.03 0.00 0.00 46.19 44.44 1ism s LEU 159 CO 0.08 0.05 0.45 0.21 0.23 0.00 0.00 176.35 177.36 1ism s ASN 160 N -3.29 6.19 0.00 2.29 3.84 -1.24 -0.40 114.94 122.32 1ism s ASN 160 Ca 0.28 -0.73 0.17 0.00 0.21 0.00 0.00 52.86 52.80 1ism s ASN 160 Cb -0.07 -2.23 0.74 0.00 -0.55 0.00 0.00 41.25 39.14 1ism s ASN 160 CO 0.17 -0.60 1.52 0.61 -2.79 0.00 0.00 177.10 176.01 1ism n GLY 161 N 5.12 -0.14 0.63 1.21 0.00 0.37 -2.99 105.19 109.39 1ism n GLY 161 Ca -0.07 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.71 1ism n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ism n SER 162 N -0.04 3.08 -4.63 1.61 7.64 -1.26 -1.17 113.62 118.86 1ism n SER 162 Ca 0.14 -2.31 -0.43 0.00 1.01 0.00 0.00 58.87 57.28 1ism n SER 162 Cb 0.22 -0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 63.10 1ism n SER 162 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ism s GLU 163 N -1.55 3.94 0.19 1.43 2.56 -1.16 -4.79 118.70 119.32 1ism s GLU 163 Ca 0.26 1.17 -0.21 0.00 0.00 0.00 0.00 54.97 56.19 1ism s GLU 163 Cb 0.17 -3.85 0.12 0.00 2.00 0.00 0.00 34.13 32.58 1ism s GLU 163 CO 0.12 -1.08 1.46 -2.30 -0.56 0.00 0.00 175.26 172.90 1ism n PRO 164 N 7.24 -0.29 0.00 4.30 -0.02 -1.26 -0.96 135.00 144.01 1ism n PRO 164 Ca 0.14 1.44 0.12 0.00 -2.02 0.00 0.00 63.50 63.18 1ism n PRO 164 Cb 0.47 -2.14 0.62 0.00 -0.02 0.00 0.00 33.50 32.43 1ism n PRO 164 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ism n THR 165 N -5.32 0.20 0.00 3.45 -2.24 -1.26 -4.99 114.28 104.13 1ism n THR 165 Ca 0.07 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 1ism n THR 165 Cb 0.33 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 1ism n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ism n GLY 166 N 0.65 3.60 0.10 3.38 0.00 -0.14 -4.95 105.19 107.84 1ism n GLY 166 Ca 0.13 -1.72 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 1ism n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ism h ALA 167 N 0.00 0.14 -2.37 4.61 0.00 -1.80 -3.42 119.26 116.42 1ism h ALA 167 Ca 0.00 -0.25 -0.73 0.00 0.00 0.00 0.00 54.91 53.92 1ism h ALA 167 Cb 0.00 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 17.53 1ism h ALA 167 CO 0.00 -0.08 -0.35 -0.47 0.00 0.00 0.00 179.25 178.34 1ism s TYR 168 N -4.55 3.25 -0.31 0.00 5.04 -1.26 -4.31 117.35 115.21 1ism s TYR 168 Ca -0.15 -0.96 -0.29 0.00 -2.44 0.00 0.00 57.07 53.24 1ism s TYR 168 Cb 0.04 -3.09 -0.01 0.00 0.35 0.00 0.00 41.96 39.25 1ism s TYR 168 CO 0.72 -0.78 1.57 -2.14 -1.34 0.00 0.00 175.55 173.58 1ism s PRO 169 N 1.62 3.62 0.00 4.97 0.02 -1.26 -4.81 135.00 139.16 1ism s PRO 169 Ca 0.04 1.34 0.05 0.00 0.02 0.00 0.00 61.00 62.46 1ism s PRO 169 Cb -0.24 -4.06 0.28 0.00 0.02 0.00 0.00 34.50 30.50 1ism s PRO 169 CO 0.06 -1.51 0.97 0.44 -0.33 0.00 0.00 177.00 176.64 1ism n ILE 170 N 6.86 0.77 -3.13 2.83 -5.35 -1.26 -3.22 119.36 116.87 1ism n ILE 170 Ca 0.19 0.19 -0.20 0.00 -0.27 0.00 0.00 62.75 62.66 1ism n ILE 170 Cb 0.47 -1.10 -0.04 0.00 -1.74 0.00 0.00 39.64 37.22 1ism n ILE 170 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1ism n LYS 171 N -1.23 0.79 -1.44 6.28 4.76 -1.26 -4.75 118.16 121.32 1ism n LYS 171 Ca 0.03 -3.06 0.00 0.00 -2.87 0.00 0.00 58.31 52.41 1ism n LYS 171 Cb 0.04 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 1ism n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ism n GLY 172 N 1.11 4.68 0.14 0.72 0.00 -1.20 -4.96 105.19 105.69 1ism n GLY 172 Ca 0.20 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.30 1ism n GLY 172 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ism h PHE 173 N 0.72 0.40 -0.68 1.61 -1.00 -1.94 -0.07 116.94 115.99 1ism h PHE 173 Ca 0.00 -0.07 0.07 0.00 2.81 0.00 0.00 57.97 60.78 1ism h PHE 173 Cb 0.00 -0.11 -0.06 0.00 3.61 0.00 0.00 35.95 39.39 1ism h PHE 173 CO 0.00 0.56 0.36 0.35 -1.61 0.00 0.00 178.31 177.96 1ism h PHE 174 N 0.14 0.65 0.02 -0.55 3.57 -1.92 0.20 116.94 119.05 1ism h PHE 174 Ca 0.06 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.47 1ism h PHE 174 Cb 0.40 -0.19 0.01 0.00 2.79 0.00 0.00 35.95 38.96 1ism h PHE 174 CO 0.03 0.28 -0.48 0.00 -2.23 0.00 0.00 178.31 175.91 1ism h ALA 175 N 1.38 0.03 0.02 2.41 0.00 -1.77 -0.73 119.26 120.60 1ism h ALA 175 Ca 0.32 -0.55 -0.26 0.00 0.00 0.00 0.00 54.91 54.42 1ism h ALA 175 Cb 0.27 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ism h ALA 175 CO -0.22 0.24 -1.37 -0.44 0.00 0.00 0.00 179.25 177.46 1ism h ASP 176 N -0.34 0.07 0.00 0.00 3.32 -0.91 -3.41 116.42 115.15 1ism h ASP 176 Ca -0.07 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1ism h ASP 176 Cb 1.25 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1ism h ASP 176 CO 0.09 1.08 -0.89 -1.22 -1.72 0.00 0.00 179.24 176.59 1ism n TYR 177 N -3.25 0.00 -0.12 4.55 4.02 0.61 -4.76 117.16 118.21 1ism n TYR 177 Ca -0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.59 1ism n TYR 177 Cb 1.00 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 40.25 1ism n TYR 177 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1ism n GLU 178 N -1.44 0.56 -0.33 -0.72 1.02 -0.73 -4.19 120.64 114.81 1ism n GLU 178 Ca 0.00 0.25 0.08 0.00 -0.02 0.00 0.00 57.16 57.48 1ism n GLU 178 Cb 0.00 -1.48 0.28 0.00 -0.02 0.00 0.00 31.44 30.22 1ism n GLU 178 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1ism h ILE 179 N -1.00 0.90 0.00 -3.67 2.04 -1.36 0.19 117.51 114.62 1ism h ILE 179 Ca -0.39 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1ism h ILE 179 Cb 1.33 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1ism h ILE 179 CO -0.24 0.17 0.00 -0.65 0.00 0.00 0.00 178.15 177.43 1ism h PRO 180 N 0.91 0.00 -0.24 2.37 0.11 -1.80 -2.92 132.00 130.43 1ism h PRO 180 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 1ism h PRO 180 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1ism h PRO 180 CO -0.25 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.63 1ism n ASN 181 N -2.32 2.64 -4.76 -2.05 3.02 0.62 -4.99 115.26 107.43 1ism n ASN 181 Ca 0.01 -1.81 -0.41 0.00 -0.03 0.00 0.00 54.58 52.35 1ism n ASN 181 Cb 0.21 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 1ism n ASN 181 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ism s LEU 182 N -1.02 4.48 -0.52 3.41 1.43 -0.83 -3.47 118.68 122.16 1ism s LEU 182 Ca 0.22 2.42 -0.21 0.00 -1.03 0.00 0.00 54.13 55.53 1ism s LEU 182 Cb 0.12 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.77 1ism s LEU 182 CO 0.17 -0.36 0.72 -1.10 0.23 0.00 0.00 176.35 176.01 1ism s GLN 183 N -1.19 3.19 0.34 1.70 -1.52 -1.26 -4.94 119.66 115.97 1ism s GLN 183 Ca 0.49 -0.68 0.04 0.00 -1.95 0.00 0.00 55.36 53.25 1ism s GLN 183 Cb -0.35 -4.08 0.65 0.00 -0.22 0.00 0.00 33.01 29.01 1ism s GLN 183 CO 0.44 -1.30 1.94 -0.22 -0.25 0.00 0.00 175.29 175.90 1ism h LYS 184 N 9.09 0.84 -0.06 2.91 3.64 -1.93 -1.84 116.57 129.22 1ism h LYS 184 Ca -0.27 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.04 1ism h LYS 184 Cb 1.09 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1ism h LYS 184 CO 1.00 0.56 -0.05 0.93 -2.27 0.00 0.00 179.45 179.61 1ism h GLU 185 N 0.87 0.09 -0.02 1.90 3.07 -2.01 -2.44 114.58 116.03 1ism h GLU 185 Ca 0.35 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 1ism h GLU 185 Cb 0.25 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1ism h GLU 185 CO -0.12 0.15 -0.29 1.63 -1.40 0.00 0.00 179.01 178.98 1ism n LYS 186 N -4.42 1.39 -4.06 2.33 5.02 -0.73 -4.90 118.16 112.79 1ism n LYS 186 Ca -0.02 -1.06 -0.35 0.00 -2.02 0.00 0.00 58.31 54.86 1ism n LYS 186 Cb 0.16 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.59 1ism n LYS 186 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ism s ILE 187 N -2.34 4.52 -0.07 -0.18 1.01 -0.92 -0.33 121.20 122.89 1ism s ILE 187 Ca 0.24 -0.12 -0.14 0.00 0.00 0.00 0.00 60.65 60.62 1ism s ILE 187 Cb 0.19 -3.04 -0.29 0.00 0.01 0.00 0.00 42.46 39.33 1ism s ILE 187 CO 0.48 0.45 0.64 0.71 0.00 0.00 0.00 174.94 177.22 1ism h THR 188 N 5.03 1.02 -2.18 2.92 1.35 -1.16 -3.47 112.91 116.42 1ism h THR 188 Ca -0.36 -2.46 0.19 0.00 -0.55 0.00 0.00 66.41 63.23 1ism h THR 188 Cb 1.17 2.77 -0.10 0.00 -1.73 0.00 0.00 68.15 70.26 1ism h THR 188 CO 0.67 0.78 0.54 0.00 -0.25 0.00 0.00 175.52 177.26 1ism s ARG 189 N -2.52 0.98 -0.07 4.72 1.70 -1.24 -4.53 118.95 117.98 1ism s ARG 189 Ca -0.18 -0.51 0.05 0.00 -0.47 0.00 0.00 55.73 54.62 1ism s ARG 189 Cb 0.05 0.36 -0.00 0.00 -0.57 0.00 0.00 34.95 34.78 1ism s ARG 189 CO 0.81 -0.45 -0.23 0.42 -1.08 0.00 0.00 175.30 174.77 1ism s ILE 190 N -3.11 1.96 -0.09 4.99 1.01 0.13 -1.27 121.20 124.83 1ism s ILE 190 Ca 0.11 -0.99 0.05 0.00 0.00 0.00 0.00 60.65 59.81 1ism s ILE 190 Cb -0.00 -1.68 -0.00 0.00 0.01 0.00 0.00 42.46 40.78 1ism s ILE 190 CO -0.01 0.54 -0.24 -0.70 0.00 0.00 0.00 174.94 174.53 1ism s GLU 191 N 0.09 2.91 -0.07 2.79 2.12 0.73 -2.16 118.70 125.11 1ism s GLU 191 Ca -0.10 -0.89 0.02 0.00 0.36 0.00 0.00 54.97 54.36 1ism s GLU 191 Cb -0.15 -2.26 -0.03 0.00 0.26 0.00 0.00 34.13 31.95 1ism s GLU 191 CO 0.06 0.24 -0.12 0.42 -0.54 0.00 0.00 175.26 175.32 1ism s ILE 192 N 0.20 3.28 -0.31 -3.70 -1.09 0.21 -1.06 121.20 118.72 1ism s ILE 192 Ca -0.15 -0.63 -0.01 0.00 -2.23 0.00 0.00 60.65 57.63 1ism s ILE 192 Cb -0.17 -2.32 0.06 0.00 -1.58 0.00 0.00 42.46 38.45 1ism s ILE 192 CO 0.08 0.58 0.01 0.26 -1.23 0.00 0.00 174.94 174.64 1ism s TRP 193 N -0.53 3.34 -0.50 3.97 0.51 0.17 -0.12 118.94 125.78 1ism s TRP 193 Ca 0.07 -2.07 -0.20 0.00 -2.12 0.00 0.00 56.10 51.78 1ism s TRP 193 Cb -0.12 -2.28 0.05 0.00 -0.81 0.00 0.00 33.47 30.31 1ism s TRP 193 CO 0.02 -0.84 0.67 0.08 -0.51 0.00 0.00 176.95 176.36 1ism s VAL 194 N 1.20 4.80 -0.18 4.03 1.01 0.08 -0.21 120.40 131.14 1ism s VAL 194 Ca -0.03 -0.29 -0.14 0.00 0.00 0.00 0.00 61.98 61.52 1ism s VAL 194 Cb -0.20 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 1ism s VAL 194 CO -0.02 -0.81 0.31 -0.04 0.00 0.00 0.00 175.10 174.54 1ism s MET 195 N 2.84 4.23 0.14 2.72 -1.94 0.46 -0.68 119.30 127.06 1ism s MET 195 Ca 0.18 0.10 0.04 0.00 -1.71 0.00 0.00 55.69 54.30 1ism s MET 195 Cb -0.17 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.16 1ism s MET 195 CO 0.14 0.15 0.14 -1.01 -0.01 0.00 0.00 175.02 174.43 1ism s HIS 196 N 0.73 3.20 0.51 -0.03 3.76 -1.26 -0.48 115.29 121.72 1ism s HIS 196 Ca 0.17 0.02 -0.20 0.00 -0.15 0.00 0.00 55.06 54.90 1ism s HIS 196 Cb -0.13 -1.56 -0.07 0.00 1.11 0.00 0.00 32.58 31.93 1ism s HIS 196 CO 0.05 0.52 1.12 -1.21 -0.85 0.00 0.00 174.74 174.37 1ism s GLU 197 N -2.92 3.53 0.03 1.40 0.41 -1.26 -4.91 118.70 114.97 1ism s GLU 197 Ca 0.31 1.60 -0.30 0.00 -0.41 0.00 0.00 54.97 56.17 1ism s GLU 197 Cb -0.11 -2.11 -0.08 0.00 -1.78 0.00 0.00 34.13 30.05 1ism s GLU 197 CO 0.24 -0.70 1.74 0.42 -0.49 0.00 0.00 175.26 176.47 1ism s ILE 198 N -1.76 3.16 0.00 -1.63 -1.09 -1.26 -1.89 121.20 116.74 1ism s ILE 198 Ca 0.70 0.41 0.00 0.00 -2.23 0.00 0.00 60.65 59.52 1ism s ILE 198 Cb -0.24 -3.26 0.00 0.00 -1.58 0.00 0.00 42.46 37.38 1ism s ILE 198 CO 0.27 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.57 1ism n GLY 199 N 4.19 0.74 2.91 6.18 0.00 -1.26 -4.92 105.19 113.03 1ism n GLY 199 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 1ism n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ism n GLY 200 N 0.00 -3.91 3.71 -0.02 0.00 -0.79 -4.80 105.19 99.38 1ism n GLY 200 Ca 0.00 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 1ism n GLY 200 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ism s PRO 201 N -1.94 4.16 -1.28 1.61 0.04 -1.26 -4.59 135.00 131.75 1ism s PRO 201 Ca 0.37 2.50 -0.12 0.00 0.04 0.00 0.00 61.00 63.80 1ism s PRO 201 Cb -0.07 -3.30 0.15 0.00 0.04 0.00 0.00 34.50 31.32 1ism s PRO 201 CO 0.74 -0.74 1.76 -1.71 0.04 0.00 0.00 177.00 177.10 1ism n ASN 202 N 4.64 5.02 -0.15 6.66 2.85 -1.26 -3.98 115.26 129.03 1ism n ASN 202 Ca 0.16 -3.03 -0.03 0.00 -0.11 0.00 0.00 54.58 51.57 1ism n ASN 202 Cb 0.38 -1.54 0.19 0.00 1.24 0.00 0.00 39.78 40.04 1ism n ASN 202 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1ism h VAL 203 N 4.15 1.22 -2.27 3.44 2.07 -1.45 -3.45 116.25 119.97 1ism h VAL 203 Ca 0.39 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 67.09 1ism h VAL 203 Cb 0.72 0.57 -0.22 0.00 -1.52 0.00 0.00 31.29 30.83 1ism h VAL 203 CO 1.52 0.29 -0.02 -1.61 0.02 0.00 0.00 177.57 177.78 1ism s GLU 204 N -5.32 0.69 0.51 1.57 2.02 -0.41 -5.01 118.70 112.75 1ism s GLU 204 Ca -0.10 0.87 0.01 0.00 0.02 0.00 0.00 54.97 55.77 1ism s GLU 204 Cb 0.16 0.31 -0.00 0.00 0.10 0.00 0.00 34.13 34.69 1ism s GLU 204 CO 0.80 -0.09 0.02 -1.12 0.02 0.00 0.00 175.26 174.89 1ism s SER 205 N 0.49 3.99 0.47 -0.19 0.01 -1.26 -4.50 113.70 112.71 1ism s SER 205 Ca -0.01 -1.71 -0.22 0.00 1.31 0.00 0.00 55.95 55.32 1ism s SER 205 Cb -0.04 0.66 -0.10 0.00 0.21 0.00 0.00 66.02 66.74 1ism s SER 205 CO -0.02 -0.93 0.72 0.00 0.41 0.00 0.00 173.24 173.42 1ism n GLY 207 N 1.56 0.06 3.80 0.00 0.00 -1.26 -4.96 105.19 104.40 1ism n GLY 207 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.90 1ism n GLY 207 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ism s GLU 208 N -1.44 2.87 0.00 1.61 2.02 -0.80 -4.51 118.70 118.45 1ism s GLU 208 Ca 0.00 -1.03 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1ism s GLU 208 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 34.13 31.68 1ism s GLU 208 CO 0.00 0.42 0.00 0.41 0.02 0.00 0.00 175.26 176.11 1ism n GLY 209 N -0.93 1.63 0.36 -1.39 0.00 -1.26 -0.44 105.19 103.16 1ism n GLY 209 Ca -0.08 0.17 0.10 0.00 0.00 0.00 0.00 46.02 46.21 1ism n GLY 209 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ism h SER 210 N 0.00 0.60 0.00 1.61 4.64 -1.95 0.73 113.55 119.18 1ism h SER 210 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1ism h SER 210 Cb 0.00 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1ism h SER 210 CO 0.00 0.35 0.06 0.24 -0.87 0.00 0.00 176.83 176.61 1ism h MET 211 N 0.66 0.00 0.20 4.77 2.07 -1.07 0.19 114.93 121.75 1ism h MET 211 Ca 0.36 0.00 -0.26 0.00 -2.07 0.00 0.00 59.70 57.72 1ism h MET 211 Cb 0.51 0.00 0.03 0.00 -1.87 0.00 0.00 31.60 30.27 1ism h MET 211 CO -0.13 0.00 -1.17 0.87 1.07 0.00 0.00 176.91 177.54 1ism h LYS 212 N 0.00 0.42 0.58 1.72 1.57 -0.70 -2.66 116.57 117.50 1ism h LYS 212 Ca 0.00 -0.71 -0.03 0.00 -1.87 0.00 0.00 60.65 58.04 1ism h LYS 212 Cb 0.13 0.26 0.01 0.00 0.08 0.00 0.00 32.23 32.71 1ism h LYS 212 CO 0.00 1.34 -0.28 0.28 -0.57 0.00 0.00 179.45 180.22 1ism h VAL 213 N -0.12 0.42 -0.51 0.50 2.07 -0.70 0.92 116.25 118.84 1ism h VAL 213 Ca -0.21 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.41 1ism h VAL 213 Cb 1.91 0.42 -0.08 0.00 -1.52 0.00 0.00 31.29 32.02 1ism h VAL 213 CO 0.21 0.00 0.06 0.25 0.02 0.00 0.00 177.57 178.11 1ism h LEU 214 N -0.79 -0.10 -0.29 2.57 5.85 -1.36 0.75 115.31 121.94 1ism h LEU 214 Ca -0.08 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1ism h LEU 214 Cb 0.60 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 1ism h LEU 214 CO 0.13 -0.02 0.18 -0.08 -0.34 0.00 0.00 178.44 178.31 1ism h GLU 215 N 0.18 0.39 -0.49 1.25 4.81 -1.25 -0.91 114.58 118.57 1ism h GLU 215 Ca 0.26 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1ism h GLU 215 Cb 0.38 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1ism h GLU 215 CO -0.38 0.30 0.29 -0.22 -0.73 0.00 0.00 179.01 178.27 1ism h LYS 216 N 0.37 0.66 -0.32 1.92 3.64 0.01 -1.48 116.57 121.37 1ism h LYS 216 Ca 0.10 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1ism h LYS 216 Cb 0.01 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1ism h LYS 216 CO -0.02 0.48 0.20 -0.09 -2.27 0.00 0.00 179.45 177.75 1ism h ARG 217 N 0.65 0.43 -0.57 1.90 2.43 -0.63 0.25 114.38 118.84 1ism h ARG 217 Ca 0.17 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1ism h ARG 217 Cb -0.01 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1ism h ARG 217 CO -0.03 0.31 0.29 -0.07 -1.51 0.00 0.00 179.97 178.96 1ism h LEU 218 N 0.42 0.73 -0.42 3.80 3.38 -0.97 -1.27 115.31 120.98 1ism h LEU 218 Ca 0.11 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1ism h LEU 218 Cb -0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1ism h LEU 218 CO -0.02 0.63 -0.10 0.11 0.09 0.00 0.00 178.44 179.15 1ism h LYS 219 N 0.76 0.81 -0.75 1.13 1.57 -1.03 -1.99 116.57 117.07 1ism h LYS 219 Ca 0.20 -0.31 0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1ism h LYS 219 Cb 0.09 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1ism h LYS 219 CO -0.03 0.93 0.49 -0.44 -0.57 0.00 0.00 179.45 179.83 1ism h ASP 220 N 0.63 0.65 0.90 0.86 3.32 -0.24 0.21 116.42 122.75 1ism h ASP 220 Ca 0.11 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ism h ASP 220 Cb 0.63 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1ism h ASP 220 CO 0.04 0.41 0.00 0.24 -1.72 0.00 0.00 179.24 178.21 1ism h MET 221 N 0.73 0.00 0.00 3.56 2.86 -0.83 -3.46 114.93 117.79 1ism h MET 221 Ca 0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 1ism h MET 221 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1ism h MET 221 CO -0.12 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.26 1ism n GLY 222 N 0.04 0.99 3.89 8.32 0.00 0.72 -5.10 105.19 114.06 1ism n GLY 222 Ca 0.01 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1ism n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ism s PHE 223 N -2.00 3.58 -0.22 1.61 2.99 -0.79 -5.01 117.98 118.15 1ism s PHE 223 Ca 0.00 0.98 -0.17 0.00 0.00 0.00 0.00 56.93 57.74 1ism s PHE 223 Cb 0.00 -2.45 -0.03 0.00 0.00 0.00 0.00 43.02 40.53 1ism s PHE 223 CO 0.00 -0.43 0.47 -1.14 -0.00 0.00 0.00 175.22 174.12 1ism s GLN 224 N -4.90 4.14 0.21 0.44 0.74 -1.26 -4.46 119.66 114.57 1ism s GLN 224 Ca 0.50 0.30 0.08 0.00 0.05 0.00 0.00 55.36 56.29 1ism s GLN 224 Cb -0.11 -3.58 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 1ism s GLN 224 CO 0.48 -0.17 0.02 -0.47 -0.55 0.00 0.00 175.29 174.60 1ism s TYR 225 N 1.72 2.84 -0.26 1.67 5.04 -1.26 0.21 117.35 127.31 1ism s TYR 225 Ca 0.21 -0.15 -0.26 0.00 -2.44 0.00 0.00 57.07 54.43 1ism s TYR 225 Cb -0.15 -1.33 0.13 0.00 0.35 0.00 0.00 41.96 40.95 1ism s TYR 225 CO 0.09 0.55 1.06 -1.54 -1.34 0.00 0.00 175.55 174.37 1ism s SER 226 N -3.25 -0.39 0.00 4.32 1.04 -0.92 -4.93 113.70 109.58 1ism s SER 226 Ca 0.29 0.69 0.03 0.00 0.48 0.00 0.00 55.95 57.44 1ism s SER 226 Cb -0.08 0.67 -0.01 0.00 0.10 0.00 0.00 66.02 66.70 1ism s SER 226 CO 0.20 -0.18 -0.09 0.00 0.98 0.00 0.00 173.24 174.14 1ism s ILE 228 N -0.34 1.39 -0.14 0.00 1.01 0.83 -4.92 121.20 119.02 1ism s ILE 228 Ca 0.03 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.81 1ism s ILE 228 Cb -0.04 -1.16 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1ism s ILE 228 CO -0.00 0.39 0.26 0.20 0.00 0.00 0.00 174.94 175.80 1ism s ASN 229 N -0.36 6.44 -1.25 3.58 0.01 -1.26 -0.74 114.94 121.36 1ism s ASN 229 Ca 0.06 0.51 -0.24 0.00 -0.71 0.00 0.00 52.86 52.48 1ism s ASN 229 Cb -0.07 -2.16 0.02 0.00 0.41 0.00 0.00 41.25 39.45 1ism s ASN 229 CO -0.00 0.17 0.62 0.47 -1.51 0.00 0.00 177.10 176.85 1ism n ASP 230 N 3.17 -3.58 -4.52 -1.22 8.00 0.14 -4.69 116.55 113.84 1ism n ASP 230 Ca -0.14 -1.19 -0.62 0.00 0.71 0.00 0.00 54.79 53.55 1ism n ASP 230 Cb 0.52 -2.27 -0.10 0.00 -0.02 0.00 0.00 41.12 39.26 1ism n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ism n TYR 231 N -4.71 1.56 -0.36 1.24 9.36 -1.26 -4.55 117.16 118.45 1ism n TYR 231 Ca -0.15 0.82 -0.04 0.00 3.32 0.00 0.00 57.90 61.86 1ism n TYR 231 Cb 0.60 -2.32 -0.01 0.00 -0.63 0.00 0.00 39.34 36.98 1ism n TYR 231 CO 0.00 0.00 0.00 -2.13 0.22 0.00 0.00 176.86 174.95 1ism n ARG 232 N 5.97 -0.28 -0.25 2.98 3.00 -1.26 -1.19 116.66 125.64 1ism n ARG 232 Ca 0.40 1.38 0.05 0.00 -0.00 0.00 0.00 57.85 59.68 1ism n ARG 232 Cb 0.01 -2.04 0.18 0.00 0.00 0.00 0.00 32.46 30.60 1ism n ARG 232 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1ism h PRO 233 N 0.00 0.36 -0.03 -0.14 0.11 -2.00 0.10 132.00 130.39 1ism h PRO 233 Ca 0.25 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.19 1ism h PRO 233 Cb 0.48 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1ism h PRO 233 CO -0.88 0.24 -0.66 0.28 -0.21 0.00 0.00 178.00 176.77 1ism h VAL 234 N 0.37 1.43 -0.44 3.15 2.07 -1.56 -2.76 116.25 118.51 1ism h VAL 234 Ca 0.40 -2.15 -0.02 0.00 0.82 0.00 0.00 66.70 65.75 1ism h VAL 234 Cb 0.63 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.52 1ism h VAL 234 CO -0.43 0.63 0.22 0.50 0.02 0.00 0.00 177.57 178.50 1ism h LYS 235 N 0.10 0.64 -0.66 1.57 1.63 0.48 -1.87 116.57 118.46 1ism h LYS 235 Ca -0.01 -0.09 0.04 0.00 -0.85 0.00 0.00 60.65 59.74 1ism h LYS 235 Cb 1.17 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 32.64 1ism h LYS 235 CO 0.09 0.54 0.39 -0.07 -3.45 0.00 0.00 179.45 176.96 1ism h LEU 236 N 0.57 0.61 -0.75 5.20 3.38 -0.81 -0.57 115.31 122.95 1ism h LEU 236 Ca 0.15 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1ism h LEU 236 Cb 0.11 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1ism h LEU 236 CO -0.02 0.41 0.48 0.25 0.09 0.00 0.00 178.44 179.65 1ism h LEU 237 N 0.74 0.80 -1.03 1.67 5.85 -1.13 -0.69 115.31 121.52 1ism h LEU 237 Ca 0.28 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.91 1ism h LEU 237 Cb 0.09 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1ism h LEU 237 CO -0.14 0.56 -0.13 1.56 -0.34 0.00 0.00 178.44 179.96 1ism h GLN 238 N 0.95 0.55 0.00 1.25 4.20 -0.84 -2.29 115.11 118.93 1ism h GLN 238 Ca 0.29 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 1ism h GLN 238 Cb -0.03 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.70 1ism h GLN 238 CO -0.09 0.67 -0.06 0.00 -0.67 0.00 0.00 178.83 178.68 1ism h VAL 240 N 0.00 0.48 -0.55 0.00 2.07 -0.77 0.66 116.25 118.15 1ism h VAL 240 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1ism h VAL 240 Cb 0.18 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1ism h VAL 240 CO 0.01 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.07 1ism n ASP 241 N -3.95 3.51 -2.73 0.57 8.00 -0.98 -4.44 116.55 116.53 1ism n ASP 241 Ca 0.09 -2.03 -0.04 0.00 0.71 0.00 0.00 54.79 53.53 1ism n ASP 241 Cb 0.66 -0.37 0.08 0.00 -0.02 0.00 0.00 41.12 41.47 1ism n ASP 241 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ism n HIS 242 N 1.07 -0.23 -0.22 1.24 8.25 0.17 -4.97 115.22 120.53 1ism n HIS 242 Ca 0.19 -2.15 0.15 0.00 -0.26 0.00 0.00 57.72 55.64 1ism n HIS 242 Cb 0.54 0.50 0.45 0.00 1.12 0.00 0.00 29.99 32.60 1ism n HIS 242 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1ism h SER 243 N 2.20 0.51 0.99 0.41 4.64 -1.63 -1.91 113.55 118.76 1ism h SER 243 Ca -0.23 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1ism h SER 243 Cb 1.26 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1ism h SER 243 CO 0.12 0.25 -0.13 0.35 -0.87 0.00 0.00 176.83 176.55 1ism n THR 244 N -4.52 0.13 -2.44 2.95 -2.24 -1.26 -4.56 114.28 102.34 1ism n THR 244 Ca 0.17 -0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.50 1ism n THR 244 Cb 0.53 -0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 1ism n THR 244 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1ism s HIS 245 N -3.03 3.17 0.55 4.78 5.04 -0.72 -4.94 115.29 120.14 1ism s HIS 245 Ca 0.12 1.61 0.32 0.00 -1.54 0.00 0.00 55.06 55.57 1ism s HIS 245 Cb 0.17 -3.23 1.83 0.00 0.04 0.00 0.00 32.58 31.39 1ism s HIS 245 CO 0.59 -0.93 2.23 -1.00 -2.34 0.00 0.00 174.74 173.29 1ism h PRO 246 N 2.50 0.00 0.00 2.88 0.13 -1.89 -1.57 132.00 134.05 1ism h PRO 246 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1ism h PRO 246 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ism h PRO 246 CO 0.62 0.03 0.00 -0.25 -0.23 0.00 0.00 178.00 178.17 1ism n ASP 247 N -3.65 0.00 -0.72 1.44 8.00 -1.26 -2.95 116.55 117.41 1ism n ASP 247 Ca -0.03 0.49 0.04 0.00 0.71 0.00 0.00 54.79 56.01 1ism n ASP 247 Cb 0.12 -0.50 0.20 0.00 -0.02 0.00 0.00 41.12 40.93 1ism n ASP 247 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ism s ALA 249 N -3.07 3.49 0.30 0.00 0.00 -1.15 -4.84 121.76 116.49 1ism s ALA 249 Ca 0.40 -0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.07 1ism s ALA 249 Cb 0.35 -2.61 -0.06 0.00 0.00 0.00 0.00 23.12 20.81 1ism s ALA 249 CO 0.01 0.02 0.59 -0.51 0.00 0.00 0.00 175.76 175.87 1ism s LEU 250 N 0.58 4.03 0.00 0.00 1.43 -1.26 -5.11 118.68 118.34 1ism s LEU 250 Ca 0.25 0.81 0.18 0.00 -1.03 0.00 0.00 54.13 54.34 1ism s LEU 250 Cb -0.15 -3.63 1.09 0.00 0.03 0.00 0.00 46.19 43.53 1ism s LEU 250 CO 0.09 -0.22 1.49 0.29 0.23 0.00 0.00 176.35 178.23