#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iml s LYS 2 N 0.00 0.25 -0.35 0.54 2.47 -1.26 -1.75 119.74 119.63 1iml s LYS 2 Ca 0.00 0.44 -0.26 0.00 -1.56 0.00 0.00 55.97 54.59 1iml s LYS 2 Cb 0.00 0.01 0.01 0.00 -1.46 0.00 0.00 37.83 36.39 1iml s LYS 2 CO 0.00 -0.10 0.91 0.00 0.16 0.00 0.00 175.35 176.32 1iml h PRO 4 N 8.39 0.00 0.00 0.00 0.14 -1.89 -1.65 132.00 136.99 1iml h PRO 4 Ca -0.23 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.91 1iml h PRO 4 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.22 1iml h PRO 4 CO 0.97 0.00 0.00 1.17 0.14 0.00 0.00 178.00 180.28 1iml n LYS 5 N -3.15 0.00 0.05 0.86 0.00 -1.26 -4.42 118.16 110.23 1iml n LYS 5 Ca -0.03 0.35 0.08 0.00 0.00 0.00 0.00 58.31 58.71 1iml n LYS 5 Cb 0.08 -0.90 -0.07 0.00 0.00 0.00 0.00 35.03 34.14 1iml n LYS 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iml n ASP 7 N -2.59 -3.25 -1.76 0.00 9.92 -0.62 -5.08 116.55 113.17 1iml n ASP 7 Ca -0.04 -0.25 0.00 0.00 -0.53 0.00 0.00 54.79 53.96 1iml n ASP 7 Cb 0.63 -2.23 0.00 0.00 -0.64 0.00 0.00 41.12 38.88 1iml n ASP 7 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1iml n LYS 8 N -2.14 2.11 -4.04 -1.24 4.81 -1.26 -4.95 118.16 111.44 1iml n LYS 8 Ca -0.05 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.11 1iml n LYS 8 Cb 0.55 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.54 1iml n LYS 8 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1iml s GLU 9 N -1.60 3.00 -0.30 1.64 2.02 -1.26 -1.13 118.70 121.07 1iml s GLU 9 Ca 0.00 -0.72 -0.04 0.00 0.02 0.00 0.00 54.97 54.23 1iml s GLU 9 Cb 0.00 -2.75 0.03 0.00 0.10 0.00 0.00 34.13 31.51 1iml s GLU 9 CO 0.00 0.54 0.03 0.08 0.02 0.00 0.00 175.26 175.93 1iml s VAL 10 N -1.56 3.38 0.63 2.63 1.01 -0.72 -4.88 120.40 120.89 1iml s VAL 10 Ca 0.31 -1.08 -0.16 0.00 0.00 0.00 0.00 61.98 61.05 1iml s VAL 10 Cb -0.11 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1iml s VAL 10 CO 0.24 -0.01 1.13 -0.47 0.00 0.00 0.00 175.10 175.99 1iml s TYR 11 N 1.36 2.58 0.04 5.22 6.14 -1.26 -4.80 117.35 126.64 1iml s TYR 11 Ca -0.01 1.55 -0.30 0.00 0.64 0.00 0.00 57.07 58.95 1iml s TYR 11 Cb -0.18 -3.24 -0.16 0.00 0.42 0.00 0.00 41.96 38.80 1iml s TYR 11 CO -0.00 -1.74 1.42 0.74 0.64 0.00 0.00 175.55 176.61 1iml h PHE 12 N 0.37 -0.99 0.00 4.97 -1.00 -1.98 -0.91 116.94 117.40 1iml h PHE 12 Ca -0.48 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.28 1iml h PHE 12 Cb 1.26 0.33 0.00 0.00 3.61 0.00 0.00 35.95 41.14 1iml h PHE 12 CO 0.53 -0.61 0.00 0.00 -1.61 0.00 0.00 178.31 176.61 1iml n ALA 13 N -2.54 2.06 -0.57 2.45 0.00 -1.26 0.58 120.51 121.23 1iml n ALA 13 Ca -0.13 -0.10 0.09 0.00 0.00 0.00 0.00 53.44 53.30 1iml n ALA 13 Cb 0.42 -1.27 0.32 0.00 0.00 0.00 0.00 19.45 18.93 1iml n ALA 13 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1iml n GLU 14 N -1.07 3.44 -3.63 0.00 4.71 -0.36 -4.99 120.64 118.74 1iml n GLU 14 Ca 0.11 -2.76 -0.27 0.00 -0.01 0.00 0.00 57.16 54.23 1iml n GLU 14 Cb 0.07 -1.77 -0.03 0.00 -1.01 0.00 0.00 31.44 28.70 1iml n GLU 14 CO 0.00 0.00 0.00 -0.98 0.09 0.00 0.00 177.13 176.24 1iml s ARG 15 N -1.71 3.54 0.02 3.49 1.04 0.20 -1.17 118.95 124.35 1iml s ARG 15 Ca 0.47 -0.28 -0.08 0.00 -1.04 0.00 0.00 55.73 54.80 1iml s ARG 15 Cb 0.30 -2.80 0.00 0.00 -2.04 0.00 0.00 34.95 30.40 1iml s ARG 15 CO 0.24 0.36 0.15 0.14 -0.04 0.00 0.00 175.30 176.15 1iml s VAL 16 N -1.92 0.10 -0.09 4.99 -7.23 -0.31 -4.71 120.40 111.23 1iml s VAL 16 Ca 0.39 -0.80 0.01 0.00 -1.81 0.00 0.00 61.98 59.77 1iml s VAL 16 Cb -0.11 -0.64 -0.02 0.00 0.56 0.00 0.00 36.38 36.17 1iml s VAL 16 CO 0.29 -0.44 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.64 1iml s THR 17 N -1.88 3.32 -0.29 5.32 2.01 -1.26 0.60 115.64 123.45 1iml s THR 17 Ca -0.11 -0.60 -0.18 0.00 0.31 0.00 0.00 61.69 61.11 1iml s THR 17 Cb -0.05 -2.36 0.18 0.00 0.01 0.00 0.00 72.50 70.29 1iml s THR 17 CO -0.01 0.57 1.17 -0.55 -0.69 0.00 0.00 174.62 175.11 1iml s SER 18 N -0.37 -0.24 -1.60 3.53 0.15 -0.73 -4.93 113.70 109.51 1iml s SER 18 Ca 0.05 0.39 -0.04 0.00 0.70 0.00 0.00 55.95 57.04 1iml s SER 18 Cb -0.12 0.97 0.00 0.00 -1.71 0.00 0.00 66.02 65.16 1iml s SER 18 CO 0.02 -0.06 0.54 0.18 1.20 0.00 0.00 173.24 175.12 1iml n LEU 19 N 3.06 -2.61 -1.18 3.45 7.99 -1.26 -2.15 117.00 124.29 1iml n LEU 19 Ca -0.17 -0.25 -0.15 0.00 -0.01 0.00 0.00 56.01 55.43 1iml n LEU 19 Cb 0.57 -2.99 -0.07 0.00 -0.11 0.00 0.00 43.42 40.82 1iml n LEU 19 CO 0.04 0.18 -0.15 0.61 -1.51 0.00 0.00 177.39 176.56 1iml n GLY 20 N -1.47 1.51 3.07 -0.72 0.00 -1.26 -4.96 105.19 101.36 1iml n GLY 20 Ca -0.13 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 1iml n GLY 20 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iml s LYS 21 N -3.27 0.55 0.78 1.61 2.47 -0.92 -5.09 119.74 115.88 1iml s LYS 21 Ca 0.00 -0.93 -0.05 0.00 -1.56 0.00 0.00 55.97 53.43 1iml s LYS 21 Cb 0.00 -0.07 0.14 0.00 -1.46 0.00 0.00 37.83 36.43 1iml s LYS 21 CO 0.00 -0.02 1.08 -0.51 0.16 0.00 0.00 175.35 176.06 1iml s ASP 22 N -2.11 4.08 0.27 1.43 1.01 -1.26 -1.77 116.67 118.32 1iml s ASP 22 Ca -0.04 -0.11 -0.02 0.00 0.71 0.00 0.00 52.55 53.10 1iml s ASP 22 Cb -0.03 -0.22 0.01 0.00 1.01 0.00 0.00 42.92 43.69 1iml s ASP 22 CO -0.03 -2.05 0.38 0.79 0.21 0.00 0.00 175.17 174.46 1iml n TRP 23 N -3.08 -1.23 -3.87 4.23 7.02 0.20 -4.03 117.44 116.68 1iml n TRP 23 Ca 0.14 -1.76 -0.35 0.00 -1.02 0.00 0.00 57.50 54.51 1iml n TRP 23 Cb 0.60 0.43 -0.05 0.00 -2.42 0.00 0.00 31.31 29.86 1iml n TRP 23 CO 0.00 0.00 0.00 -1.01 -2.02 0.00 0.00 177.69 174.66 1iml s HIS 24 N -3.45 3.58 0.16 -5.99 3.76 -1.26 -1.16 115.29 110.93 1iml s HIS 24 Ca 0.22 0.47 -0.15 0.00 -0.15 0.00 0.00 55.06 55.45 1iml s HIS 24 Cb -0.01 -1.91 0.04 0.00 1.11 0.00 0.00 32.58 31.81 1iml s HIS 24 CO 0.16 0.68 1.80 -0.09 -0.85 0.00 0.00 174.74 176.44 1iml h ARG 25 N 4.35 0.63 -0.49 1.40 2.43 -1.43 -1.82 114.38 119.45 1iml h ARG 25 Ca -0.52 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 58.55 1iml h ARG 25 Cb 1.21 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1iml h ARG 25 CO 0.64 0.45 0.08 -1.00 -1.51 0.00 0.00 179.97 178.63 1iml h PRO 26 N 0.62 0.76 -0.26 0.20 0.13 -1.95 -3.30 132.00 128.20 1iml h PRO 26 Ca 0.17 -0.16 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 1iml h PRO 26 Cb -0.02 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 30.99 1iml h PRO 26 CO -0.03 0.72 0.10 0.00 -0.23 0.00 0.00 178.00 178.55 1iml s LEU 28 N -9.79 2.64 0.01 0.00 2.96 -1.16 -4.82 118.68 108.52 1iml s LEU 28 Ca -0.13 -0.85 -0.03 0.00 -0.22 0.00 0.00 54.13 52.89 1iml s LEU 28 Cb 0.08 -2.58 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1iml s LEU 28 CO 0.72 -4.15 0.05 -1.59 -1.32 0.00 0.00 176.35 170.06 1iml s LYS 29 N 8.11 0.38 0.11 1.98 -2.85 -1.26 -1.18 119.74 125.03 1iml s LYS 29 Ca 0.81 -0.50 -0.31 0.00 -1.00 0.00 0.00 55.97 54.97 1iml s LYS 29 Cb -0.06 0.15 -0.09 0.00 -2.06 0.00 0.00 37.83 35.77 1iml s LYS 29 CO 0.14 -0.08 1.57 0.00 0.10 0.00 0.00 175.35 177.08 1iml n GLU 31 N 4.75 3.61 0.00 0.00 2.13 -1.24 -1.19 120.64 128.70 1iml n GLU 31 Ca 0.14 -2.51 -0.04 0.00 0.66 0.00 0.00 57.16 55.42 1iml n GLU 31 Cb 0.40 -2.08 -0.01 0.00 0.27 0.00 0.00 31.44 30.02 1iml n GLU 31 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1iml n LYS 32 N 0.17 0.17 -0.01 5.31 0.00 -1.26 -4.87 118.16 117.67 1iml n LYS 32 Ca 0.29 0.07 0.08 0.00 0.00 0.00 0.00 58.31 58.75 1iml n LYS 32 Cb 1.12 -0.79 -0.13 0.00 0.00 0.00 0.00 35.03 35.23 1iml n LYS 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1iml n GLY 34 N 1.56 0.59 3.70 0.00 0.00 -0.33 -5.03 105.19 105.67 1iml n GLY 34 Ca -0.03 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 1iml n GLY 34 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iml s LYS 35 N -4.91 4.21 0.31 1.61 2.47 -1.26 -4.86 119.74 117.31 1iml s LYS 35 Ca 0.07 0.08 -0.30 0.00 -1.56 0.00 0.00 55.97 54.26 1iml s LYS 35 Cb -0.03 -3.47 -0.11 0.00 -1.46 0.00 0.00 37.83 32.76 1iml s LYS 35 CO 0.08 0.14 1.55 0.99 0.16 0.00 0.00 175.35 178.27 1iml s THR 36 N 0.78 2.13 0.41 3.43 2.01 -1.26 -1.85 115.64 121.29 1iml s THR 36 Ca 0.16 0.12 0.05 0.00 0.31 0.00 0.00 61.69 62.33 1iml s THR 36 Cb -0.13 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1iml s THR 36 CO 0.05 0.02 0.57 -0.76 -0.69 0.00 0.00 174.62 173.81 1iml s LEU 37 N -0.86 3.73 0.40 4.42 1.43 -0.33 -4.91 118.68 122.57 1iml s LEU 37 Ca 0.60 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.58 1iml s LEU 37 Cb -0.47 -2.80 -0.05 0.00 0.03 0.00 0.00 46.19 42.91 1iml s LEU 37 CO 0.51 -0.67 0.05 -0.89 0.23 0.00 0.00 176.35 175.58 1iml s THR 38 N -2.36 1.19 -0.74 5.49 2.01 -1.26 -4.98 115.64 114.99 1iml s THR 38 Ca 0.50 -2.00 -0.26 0.00 0.31 0.00 0.00 61.69 60.24 1iml s THR 38 Cb -0.10 -2.59 -0.12 0.00 0.01 0.00 0.00 72.50 69.71 1iml s THR 38 CO 0.34 0.00 2.36 -0.44 -0.69 0.00 0.00 174.62 176.19 1iml s SER 39 N -3.64 4.10 -0.63 3.53 0.01 -1.26 -2.13 113.70 113.68 1iml s SER 39 Ca 0.27 0.18 -0.02 0.00 1.31 0.00 0.00 55.95 57.68 1iml s SER 39 Cb 0.06 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 1iml s SER 39 CO 0.13 -3.60 0.54 0.61 0.41 0.00 0.00 173.24 171.33 1iml n GLY 40 N 6.66 -0.20 0.13 3.44 0.00 -1.26 -4.96 105.19 108.99 1iml n GLY 40 Ca 0.44 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1iml n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iml n GLY 41 N -1.27 -1.53 0.00 -0.02 0.00 -0.91 -5.09 105.19 96.37 1iml n GLY 41 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1iml n GLY 41 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1iml n HIS 42 N -0.07 -1.23 -3.55 1.61 -0.00 -1.26 -2.02 115.22 108.70 1iml n HIS 42 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.66 1iml n HIS 42 Cb 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.50 1iml n HIS 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1iml s ALA 43 N -2.00 -1.94 -0.19 1.59 0.00 0.20 -4.14 121.76 115.27 1iml s ALA 43 Ca 0.00 1.34 -0.04 0.00 0.00 0.00 0.00 51.96 53.26 1iml s ALA 43 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1iml s ALA 43 CO 0.00 -0.59 -0.03 -1.83 0.00 0.00 0.00 175.76 173.31 1iml s GLU 44 N -2.54 3.54 0.30 0.00 4.04 -1.26 0.58 118.70 123.36 1iml s GLU 44 Ca 0.06 -0.57 0.06 0.00 0.04 0.00 0.00 54.97 54.56 1iml s GLU 44 Cb -0.01 -2.98 -0.02 0.00 0.02 0.00 0.00 34.13 31.14 1iml s GLU 44 CO -0.06 0.02 0.44 -1.58 -1.84 0.00 0.00 175.26 172.24 1iml s HIS 45 N 0.94 3.26 -0.71 4.83 2.46 0.93 -4.93 115.29 122.07 1iml s HIS 45 Ca 0.00 -0.11 -0.26 0.00 0.47 0.00 0.00 55.06 55.17 1iml s HIS 45 Cb -0.15 -1.85 -0.12 0.00 -0.13 0.00 0.00 32.58 30.34 1iml s HIS 45 CO 0.01 0.15 2.40 -1.21 -2.47 0.00 0.00 174.74 173.62 1iml s GLU 46 N -4.12 1.74 -0.26 2.88 8.01 -1.26 0.46 118.70 126.15 1iml s GLU 46 Ca 0.41 0.74 -0.01 0.00 0.01 0.00 0.00 54.97 56.12 1iml s GLU 46 Cb -0.09 -4.73 0.00 0.00 -4.31 0.00 0.00 34.13 25.00 1iml s GLU 46 CO 0.31 -4.12 0.22 0.41 0.01 0.00 0.00 175.26 172.09 1iml n GLY 47 N 6.59 0.43 3.15 -1.39 0.00 -1.26 -5.03 105.19 107.68 1iml n GLY 47 Ca 0.44 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 46.11 1iml n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iml s LYS 48 N -4.68 0.06 1.25 1.61 -2.85 0.17 -4.83 119.74 110.47 1iml s LYS 48 Ca 0.05 0.08 -0.16 0.00 -1.00 0.00 0.00 55.97 54.94 1iml s LYS 48 Cb -0.02 0.04 0.31 0.00 -2.06 0.00 0.00 37.83 36.10 1iml s LYS 48 CO 0.15 -0.09 1.00 -1.25 0.10 0.00 0.00 175.35 175.26 1iml s PRO 49 N 2.98 -1.57 0.16 1.78 0.04 -1.26 -0.05 135.00 137.08 1iml s PRO 49 Ca 0.12 0.58 -0.23 0.00 0.04 0.00 0.00 61.00 61.51 1iml s PRO 49 Cb -0.04 -1.50 0.08 0.00 0.04 0.00 0.00 34.50 33.08 1iml s PRO 49 CO -0.15 -4.09 1.06 0.71 0.04 0.00 0.00 177.00 174.57 1iml s TYR 50 N -2.43 0.04 0.38 0.56 2.02 0.20 -3.61 117.35 114.51 1iml s TYR 50 Ca 0.68 -0.39 -0.27 0.00 -0.37 0.00 0.00 57.07 56.72 1iml s TYR 50 Cb -0.21 0.68 -0.11 0.00 -0.40 0.00 0.00 41.96 41.92 1iml s TYR 50 CO 0.63 -0.83 1.40 0.00 -1.57 0.00 0.00 175.55 175.17 1iml h ASN 52 N 2.63 1.03 -5.24 0.00 2.35 -1.56 -1.55 115.58 113.24 1iml h ASN 52 Ca -0.49 -0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 55.12 1iml h ASN 52 Cb 1.26 -0.26 -0.07 0.00 0.05 0.00 0.00 38.32 39.31 1iml h ASN 52 CO 0.63 0.78 -0.03 -1.00 -1.65 0.00 0.00 177.43 176.16 1iml s HIS 53 N -5.88 0.42 0.33 1.19 3.76 -1.26 -3.95 115.29 109.89 1iml s HIS 53 Ca -0.12 -0.82 0.37 0.00 -0.15 0.00 0.00 55.06 54.34 1iml s HIS 53 Cb 0.17 0.29 1.92 0.00 1.11 0.00 0.00 32.58 36.07 1iml s HIS 53 CO 0.81 -1.15 2.13 -1.00 -0.85 0.00 0.00 174.74 174.68 1iml h PRO 54 N 2.15 0.00 -0.86 8.40 0.13 -2.00 -3.45 132.00 136.36 1iml h PRO 54 Ca -0.27 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.92 1iml h PRO 54 Cb 1.25 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.32 1iml h PRO 54 CO 0.36 0.00 0.54 0.00 -0.23 0.00 0.00 178.00 178.66 1iml h TYR 56 N 1.00 0.25 0.00 0.00 5.03 -1.44 -2.47 116.97 119.33 1iml h TYR 56 Ca 0.37 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.68 1iml h TYR 56 Cb 0.13 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.33 1iml h TYR 56 CO -0.03 0.20 0.00 1.03 -1.32 0.00 0.00 178.16 178.04 1iml h SER 57 N 0.22 0.00 0.03 -2.11 0.87 -0.74 -2.01 113.55 109.80 1iml h SER 57 Ca 0.07 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.31 1iml h SER 57 Cb 0.03 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 1iml h SER 57 CO -0.01 0.00 -1.76 0.00 -0.53 0.00 0.00 176.83 174.53 1iml n ALA 58 N -1.98 0.93 -0.04 6.23 0.00 0.70 -4.32 120.51 122.03 1iml n ALA 58 Ca 0.02 -0.67 -0.17 0.00 0.00 0.00 0.00 53.44 52.61 1iml n ALA 58 Cb 0.32 -0.42 -0.14 0.00 0.00 0.00 0.00 19.45 19.22 1iml n ALA 58 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1iml n MET 59 N -4.12 0.70 -3.89 0.00 2.81 -0.94 -4.60 117.12 107.08 1iml n MET 59 Ca -0.38 0.22 -0.29 0.00 -1.81 0.00 0.00 57.70 55.44 1iml n MET 59 Cb 0.82 -1.66 -0.12 0.00 -0.71 0.00 0.00 33.22 31.55 1iml n MET 59 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1iml s PHE 60 N -2.55 3.56 0.00 2.03 0.08 -0.76 -5.04 117.98 115.30 1iml s PHE 60 Ca -0.21 -3.31 0.00 0.00 0.12 0.00 0.00 56.93 53.53 1iml s PHE 60 Cb 0.07 -2.76 0.00 0.00 -0.57 0.00 0.00 43.02 39.77 1iml s PHE 60 CO 0.75 -0.58 0.00 0.41 -0.10 0.00 0.00 175.22 175.70 1iml n GLY 61 N 2.12 2.71 3.71 4.36 0.00 -1.26 -4.39 105.19 112.44 1iml n GLY 61 Ca 0.18 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1iml n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1iml n PRO 62 N -0.58 1.64 -3.33 1.61 -0.04 -1.26 -4.82 135.00 128.22 1iml n PRO 62 Ca 0.00 0.60 -0.13 0.00 -0.04 0.00 0.00 63.50 63.93 1iml n PRO 62 Cb 0.00 -2.45 -0.04 0.00 -0.04 0.00 0.00 33.50 30.96 1iml n PRO 62 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1iml n LYS 63 N -0.70 0.56 0.00 0.54 2.85 -1.26 -5.01 118.16 115.13 1iml n LYS 63 Ca 0.10 -1.93 0.00 0.00 -1.05 0.00 0.00 58.31 55.43 1iml n LYS 63 Cb 0.44 1.23 0.00 0.00 -0.65 0.00 0.00 35.03 36.05 1iml n LYS 63 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1iml n GLY 64 N 0.23 0.71 0.00 2.58 0.00 -1.26 -5.02 105.19 102.43 1iml n GLY 64 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1iml n GLY 64 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1iml n PHE 65 N 0.00 0.00 0.00 1.61 7.35 -1.26 -4.96 117.46 120.20 1iml n PHE 65 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1iml n PHE 65 Cb 0.00 -0.14 0.00 0.00 0.35 0.00 0.00 39.48 39.69 1iml n PHE 65 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1iml n GLY 66 N 0.38 0.00 2.00 7.13 0.00 -1.26 -5.05 105.19 108.39 1iml n GLY 66 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1iml n GLY 66 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1iml n ARG 67 N 0.00 2.33 -1.32 1.61 1.85 -1.26 -5.01 116.66 114.85 1iml n ARG 67 Ca 0.00 -3.18 -0.34 0.00 -1.00 0.00 0.00 57.85 53.33 1iml n ARG 67 Cb 0.00 -2.13 0.11 0.00 -1.05 0.00 0.00 32.46 29.39 1iml n ARG 67 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1iml s GLY 68 N -1.84 2.30 1.36 2.89 0.00 -1.26 -4.95 107.32 105.83 1iml s GLY 68 Ca 0.56 0.88 -0.22 0.00 0.00 0.00 0.00 44.72 45.94 1iml s GLY 68 CO 0.05 1.30 0.99 -0.32 0.00 0.00 0.00 173.10 175.12 1iml s GLY 69 N -2.05 1.47 -0.19 0.20 0.00 -1.26 -4.99 107.32 100.50 1iml s GLY 69 Ca 0.74 -0.90 0.08 0.00 0.00 0.00 0.00 44.72 44.64 1iml s GLY 69 CO 0.47 0.09 0.09 0.00 0.00 0.00 0.00 173.10 173.75 1iml n ALA 70 N -5.39 1.38 0.00 3.20 0.00 -1.26 -4.95 120.51 113.50 1iml n ALA 70 Ca 0.13 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1iml n ALA 70 Cb 0.60 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1iml n ALA 70 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1iml n GLU 71 N -3.09 0.00 -3.68 0.00 0.28 -1.26 -5.08 120.64 107.81 1iml n GLU 71 Ca -0.35 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.28 1iml n GLU 71 Cb 1.07 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 33.83 1iml n GLU 71 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 1iml s SER 72 N -1.99 5.96 0.95 -1.84 0.01 -1.26 -5.07 113.70 110.46 1iml s SER 72 Ca 0.00 0.05 -0.12 0.00 1.31 0.00 0.00 55.95 57.19 1iml s SER 72 Cb 0.00 -2.08 0.16 0.00 0.21 0.00 0.00 66.02 64.31 1iml s SER 72 CO 0.00 0.04 1.09 -1.38 0.41 0.00 0.00 173.24 173.40 1iml s HIS 73 N 1.22 2.21 0.00 2.43 -3.43 -1.26 -4.79 115.29 111.67 1iml s HIS 73 Ca 0.07 1.10 0.00 0.00 -0.80 0.00 0.00 55.06 55.42 1iml s HIS 73 Cb -0.14 -3.22 0.00 0.00 -1.43 0.00 0.00 32.58 27.78 1iml s HIS 73 CO 0.06 -2.66 0.00 -2.37 -2.00 0.00 0.00 174.74 167.77 1iml n THR 74 N -4.04 0.00 -1.96 -5.38 5.66 -1.26 -5.05 114.28 102.25 1iml n THR 74 Ca 0.06 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.81 1iml n THR 74 Cb 0.56 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.28 1iml n THR 74 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 1iml s PHE 75 N -5.86 1.74 -1.71 1.09 2.19 -1.26 -4.95 117.98 109.21 1iml s PHE 75 Ca 0.00 0.89 0.14 0.00 0.33 0.00 0.00 56.93 58.28 1iml s PHE 75 Cb 0.00 -3.88 0.11 0.00 -1.31 0.00 0.00 43.02 37.93 1iml s PHE 75 CO 0.00 -1.38 0.93 0.36 1.83 0.00 0.00 175.22 176.97