#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 0.21 -0.29 0.54 0.00 -1.26 -2.23 119.74 116.70 1iml s LYS 2 Ca 0.00 -0.16 -0.26 0.00 0.00 0.00 0.00 55.97 55.54 1iml s LYS 2 Cb 0.00 0.09 0.01 0.00 0.00 0.00 0.00 37.83 37.92 1iml s LYS 2 CO 0.00 -0.04 0.93 0.00 0.00 0.00 0.00 175.35 176.24 1iml h PRO 4 N 7.96 0.00 0.00 0.00 0.14 -1.89 -1.53 132.00 136.68 1iml h PRO 4 Ca -0.22 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.92 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 0.95 0.00 0.00 1.17 0.14 0.00 0.00 178.00 180.26 1iml n LYS 5 N -3.39 0.00 0.04 0.86 0.00 -1.26 -4.50 118.16 109.92 1iml n LYS 5 Ca -0.03 0.34 0.09 0.00 0.00 0.00 0.00 58.31 58.71 1iml n LYS 5 Cb 0.09 -0.90 -0.08 0.00 0.00 0.00 0.00 35.03 34.13 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 -2.53 -3.23 -1.71 0.00 -0.08 -0.58 -5.07 116.55 103.35 1iml n ASP 7 Ca -0.04 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 52.99 1iml n ASP 7 Cb 0.61 -2.24 0.00 0.00 2.34 0.00 0.00 41.12 41.82 1iml n ASP 7 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1iml n LYS 8 N -2.15 2.13 -4.04 -0.67 4.81 -1.26 -4.93 118.16 112.05 1iml n LYS 8 Ca -0.05 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.11 1iml n LYS 8 Cb 0.55 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.55 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 -1.53 2.99 -0.30 1.64 2.02 -1.26 -0.57 118.70 121.70 1iml s GLU 9 Ca 0.00 -0.75 -0.04 0.00 0.02 0.00 0.00 54.97 54.20 1iml s GLU 9 Cb 0.00 -2.73 0.03 0.00 0.10 0.00 0.00 34.13 31.53 1iml s GLU 9 CO 0.00 0.52 0.03 0.08 0.02 0.00 0.00 175.26 175.91 1iml s VAL 10 N -1.61 3.37 0.67 2.63 1.01 -0.95 -4.87 120.40 120.65 1iml s VAL 10 Ca 0.31 -1.10 -0.11 0.00 0.00 0.00 0.00 61.98 61.08 1iml s VAL 10 Cb -0.11 -2.84 -0.00 0.00 0.00 0.00 0.00 36.38 33.42 1iml s VAL 10 CO 0.24 -0.02 1.05 -0.47 0.00 0.00 0.00 175.10 175.90 1iml s TYR 11 N 1.36 3.19 0.04 5.22 6.14 -1.26 -4.87 117.35 127.16 1iml s TYR 11 Ca -0.02 1.41 -0.28 0.00 0.64 0.00 0.00 57.07 58.83 1iml s TYR 11 Cb -0.18 -2.86 -0.15 0.00 0.42 0.00 0.00 41.96 39.18 1iml s TYR 11 CO -0.00 -1.13 1.40 0.35 0.64 0.00 0.00 175.55 176.81 1iml h PHE 12 N -0.55 -0.93 0.00 4.97 3.04 -1.98 -0.90 116.94 120.59 1iml h PHE 12 Ca -0.44 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.49 1iml h PHE 12 Cb 1.21 0.31 0.00 0.00 2.56 0.00 0.00 35.95 40.02 1iml h PHE 12 CO 0.62 -0.58 0.00 0.00 -2.02 0.00 0.00 178.31 176.33 1iml n ALA 13 N -2.51 2.04 -0.58 2.41 0.00 -1.26 0.59 120.51 121.20 1iml n ALA 13 Ca -0.12 -0.09 0.09 0.00 0.00 0.00 0.00 53.44 53.31 1iml n ALA 13 Cb 0.40 -1.27 0.33 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.09 3.51 -3.84 0.00 1.02 -0.36 -4.96 120.64 114.93 1iml n GLU 14 Ca 0.11 -2.80 -0.33 0.00 -0.02 0.00 0.00 57.16 54.11 1iml n GLU 14 Cb 0.08 -1.80 -0.05 0.00 -0.02 0.00 0.00 31.44 29.65 1iml n GLU 14 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1iml s ARG 15 N -1.73 3.50 -0.05 3.49 1.70 0.20 -1.06 118.95 125.00 1iml s ARG 15 Ca 0.48 -0.23 -0.02 0.00 -0.47 0.00 0.00 55.73 55.50 1iml s ARG 15 Cb 0.31 -3.06 0.04 0.00 -0.57 0.00 0.00 34.95 31.66 1iml s ARG 15 CO 0.24 0.64 0.10 0.14 -1.08 0.00 0.00 175.30 175.34 1iml s VAL 16 N -1.36 -0.10 -0.13 4.99 -7.23 -0.51 -4.74 120.40 111.32 1iml s VAL 16 Ca 0.29 0.26 -0.14 0.00 -1.81 0.00 0.00 61.98 60.59 1iml s VAL 16 Cb -0.13 -0.19 -0.05 0.00 0.56 0.00 0.00 36.38 36.58 1iml s VAL 16 CO 0.19 0.11 0.32 -0.89 -0.31 0.00 0.00 175.10 174.52 1iml s THR 17 N 1.49 5.27 -0.30 5.32 2.01 -1.26 0.60 115.64 128.78 1iml s THR 17 Ca -0.05 0.61 -0.13 0.00 0.31 0.00 0.00 61.69 62.44 1iml s THR 17 Cb -0.12 -3.65 0.13 0.00 0.01 0.00 0.00 72.50 68.87 1iml s THR 17 CO -0.05 0.43 0.75 -0.44 -0.69 0.00 0.00 174.62 174.62 1iml s SER 18 N 0.13 -0.95 -2.06 3.53 0.01 -0.88 -4.88 113.70 108.59 1iml s SER 18 Ca 0.18 1.36 0.00 0.00 1.31 0.00 0.00 55.95 58.80 1iml s SER 18 Cb -0.14 1.93 0.00 0.00 0.21 0.00 0.00 66.02 68.02 1iml s SER 18 CO 0.06 -0.20 0.00 0.18 0.41 0.00 0.00 173.24 173.69 1iml n LEU 19 N 5.02 -1.69 0.00 2.44 7.99 -1.26 -2.18 117.00 127.32 1iml n LEU 19 Ca -0.13 0.32 0.00 0.00 -0.01 0.00 0.00 56.01 56.18 1iml n LEU 19 Cb 0.52 -2.90 0.00 0.00 -0.11 0.00 0.00 43.42 40.93 1iml n LEU 19 CO -0.03 -0.77 0.00 0.61 -1.51 0.00 0.00 177.39 175.69 1iml n GLY 20 N -0.63 0.52 3.28 -0.72 0.00 -1.26 -5.03 105.19 101.35 1iml n GLY 20 Ca -0.22 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.02 1iml n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iml s LYS 21 N -1.20 0.74 0.99 1.61 1.02 -0.93 -5.09 119.74 116.88 1iml s LYS 21 Ca 0.00 -0.15 -0.16 0.00 0.02 0.00 0.00 55.97 55.68 1iml s LYS 21 Cb 0.00 0.33 0.21 0.00 -0.52 0.00 0.00 37.83 37.85 1iml s LYS 21 CO 0.00 -0.21 1.31 -0.51 -0.92 0.00 0.00 175.35 175.02 1iml s ASP 22 N -1.37 2.89 0.28 2.83 1.11 -1.26 -2.08 116.67 119.07 1iml s ASP 22 Ca -0.13 0.28 -0.04 0.00 0.18 0.00 0.00 52.55 52.84 1iml s ASP 22 Cb -0.04 -0.32 0.02 0.00 1.07 0.00 0.00 42.92 43.65 1iml s ASP 22 CO 0.05 -2.87 0.44 0.79 1.18 0.00 0.00 175.17 174.75 1iml n TRP 23 N -3.86 -1.46 -3.95 4.23 7.02 0.20 -4.14 117.44 115.47 1iml n TRP 23 Ca 0.15 -1.66 -0.35 0.00 -1.02 0.00 0.00 57.50 54.63 1iml n TRP 23 Cb 0.59 0.51 -0.06 0.00 -2.42 0.00 0.00 31.31 29.93 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 -3.58 3.50 0.13 -5.99 3.76 -1.26 -1.42 115.29 110.44 1iml s HIS 24 Ca 0.19 0.38 -0.17 0.00 -0.15 0.00 0.00 55.06 55.31 1iml s HIS 24 Cb -0.02 -1.85 -0.02 0.00 1.11 0.00 0.00 32.58 31.80 1iml s HIS 24 CO 0.14 0.65 1.75 -0.09 -0.85 0.00 0.00 174.74 176.34 1iml h ARG 25 N 4.32 0.45 -0.09 1.40 2.43 -1.39 -1.91 114.38 119.60 1iml h ARG 25 Ca -0.51 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.64 1iml h ARG 25 Cb 1.20 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1iml h ARG 25 CO 0.63 0.36 0.07 -1.35 -1.51 0.00 0.00 179.97 178.18 1iml h PRO 26 N 0.42 0.00 0.07 0.20 0.11 -1.95 -3.18 132.00 127.67 1iml h PRO 26 Ca 0.12 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.11 1iml h PRO 26 Cb 0.03 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.15 1iml h PRO 26 CO -0.02 0.00 -0.56 0.00 -0.21 0.00 0.00 178.00 177.21 1iml s LEU 28 N -7.99 2.78 -0.04 0.00 2.96 -0.96 -4.86 118.68 110.57 1iml s LEU 28 Ca -0.17 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1iml s LEU 28 Cb -0.00 -2.56 0.02 0.00 0.50 0.00 0.00 46.19 44.15 1iml s LEU 28 CO 0.76 -4.00 -0.02 -0.54 -1.32 0.00 0.00 176.35 171.23 1iml s LYS 29 N 8.72 0.58 0.12 1.98 1.02 -1.26 -0.82 119.74 130.08 1iml s LYS 29 Ca 0.89 0.01 -0.31 0.00 0.02 0.00 0.00 55.97 56.58 1iml s LYS 29 Cb -0.11 -0.74 -0.10 0.00 -0.52 0.00 0.00 37.83 36.36 1iml s LYS 29 CO 0.09 -0.15 1.78 0.00 -0.92 0.00 0.00 175.35 176.15 1iml n GLU 31 N 5.42 1.99 0.00 0.00 4.07 -1.25 -0.96 120.64 129.92 1iml n GLU 31 Ca 0.17 -2.36 0.00 0.00 -0.06 0.00 0.00 57.16 54.91 1iml n GLU 31 Cb 0.38 -1.93 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 1iml n GLU 31 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1iml n LYS 32 N -0.78 0.00 0.00 5.31 0.00 -1.26 -4.82 118.16 116.62 1iml n LYS 32 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.78 1iml n LYS 32 Cb 1.39 -0.62 0.00 0.00 0.00 0.00 0.00 35.03 35.80 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 0.93 -0.28 3.62 0.00 0.00 -0.13 -5.01 105.19 104.33 1iml n GLY 34 Ca 0.00 0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 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 -5.81 4.06 0.30 1.61 2.20 -1.25 -4.89 119.74 115.97 1iml s LYS 35 Ca 0.38 0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.80 1iml s LYS 35 Cb -0.17 -3.62 -0.11 0.00 -1.51 0.00 0.00 37.83 32.42 1iml s LYS 35 CO 0.47 -0.22 1.55 0.99 -0.36 0.00 0.00 175.35 177.78 1iml s THR 36 N 1.89 2.16 -0.24 3.43 2.01 -1.26 -2.25 115.64 121.37 1iml s THR 36 Ca 0.17 0.14 -0.09 0.00 0.31 0.00 0.00 61.69 62.21 1iml s THR 36 Cb -0.15 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 1iml s THR 36 CO 0.09 0.02 0.13 -0.76 -0.69 0.00 0.00 174.62 173.41 1iml s LEU 37 N -0.76 3.88 0.00 4.42 1.43 -0.01 -4.95 118.68 122.70 1iml s LEU 37 Ca 0.61 -0.00 -0.06 0.00 -1.03 0.00 0.00 54.13 53.65 1iml s LEU 37 Cb -0.47 -2.04 0.11 0.00 0.03 0.00 0.00 46.19 43.83 1iml s LEU 37 CO 0.50 0.03 0.70 1.07 0.23 0.00 0.00 176.35 178.88 1iml n THR 38 N 4.50 0.00 0.05 5.49 5.66 -1.26 -4.87 114.28 123.85 1iml n THR 38 Ca -0.15 -0.69 0.01 0.00 -3.05 0.00 0.00 64.05 60.17 1iml n THR 38 Cb 0.52 -1.50 0.03 0.00 -1.55 0.00 0.00 70.33 67.83 1iml n THR 38 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1iml n SER 39 N -3.30 0.00 -2.83 1.09 3.41 -1.26 -4.70 113.62 106.03 1iml n SER 39 Ca 0.10 0.49 -0.00 0.00 -0.26 0.00 0.00 58.87 59.20 1iml n SER 39 Cb 0.34 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1iml n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iml n GLY 40 N -1.33 -3.28 3.26 5.00 0.00 -1.26 -4.78 105.19 102.80 1iml n GLY 40 Ca 0.00 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 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 0.85 3.64 0.00 -0.02 0.00 -1.26 -4.91 105.19 103.49 1iml n GLY 41 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.17 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 5.93 -2.15 -2.75 1.61 -0.00 -1.26 -1.73 115.22 114.86 1iml n HIS 42 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.14 1iml n HIS 42 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.41 1iml n HIS 42 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1iml n ALA 43 N -3.00 0.00 -3.58 1.59 0.00 0.20 -4.08 120.51 111.64 1iml n ALA 43 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1iml n ALA 43 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1iml n ALA 43 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1iml s GLU 44 N -1.00 0.49 0.00 0.00 4.04 -1.26 -1.65 118.70 119.32 1iml s GLU 44 Ca 0.00 -0.02 0.00 0.00 0.04 0.00 0.00 54.97 54.99 1iml s GLU 44 Cb 0.00 0.23 0.00 0.00 0.02 0.00 0.00 34.13 34.38 1iml s GLU 44 CO 0.00 -0.18 0.00 -2.39 -1.84 0.00 0.00 175.26 170.85 1iml n HIS 45 N 0.32 -2.60 -1.66 4.83 -0.00 -0.11 -4.89 115.22 111.12 1iml n HIS 45 Ca -0.06 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.47 1iml n HIS 45 Cb 0.59 0.00 -0.06 0.00 -0.00 0.00 0.00 29.99 30.52 1iml n HIS 45 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1iml s GLU 46 N -1.40 1.84 -0.48 -1.40 8.01 -1.26 -1.83 118.70 122.18 1iml s GLU 46 Ca 0.00 0.49 -0.01 0.00 0.01 0.00 0.00 54.97 55.46 1iml s GLU 46 Cb 0.00 -4.79 -0.01 0.00 -4.31 0.00 0.00 34.13 25.02 1iml s GLU 46 CO 0.00 -4.09 0.40 0.41 0.01 0.00 0.00 175.26 172.00 1iml n GLY 47 N 6.68 0.08 3.15 -1.39 0.00 -1.26 -5.03 105.19 107.42 1iml n GLY 47 Ca 0.44 -0.11 0.06 0.00 0.00 0.00 0.00 46.02 46.40 1iml n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1iml s LYS 48 N -4.18 0.01 0.50 1.61 2.20 -0.76 -4.92 119.74 114.20 1iml s LYS 48 Ca 0.07 0.01 -0.21 0.00 -0.36 0.00 0.00 55.97 55.49 1iml s LYS 48 Cb -0.01 0.01 -0.07 0.00 -1.51 0.00 0.00 37.83 36.25 1iml s LYS 48 CO 0.31 -0.01 1.11 -1.25 -0.36 0.00 0.00 175.35 175.15 1iml s PRO 49 N 3.00 3.61 0.07 4.03 0.04 -1.26 -0.93 135.00 143.55 1iml s PRO 49 Ca 0.02 1.59 0.01 0.00 0.04 0.00 0.00 61.00 62.66 1iml s PRO 49 Cb -0.05 -2.16 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 1iml s PRO 49 CO -0.11 -0.64 0.08 0.66 0.04 0.00 0.00 177.00 177.03 1iml n TYR 50 N -0.94 -0.38 -1.74 0.56 4.02 -0.66 -3.72 117.16 114.31 1iml n TYR 50 Ca 0.10 -0.51 -0.42 0.00 -0.01 0.00 0.00 57.90 57.05 1iml n TYR 50 Cb 0.50 0.08 -0.01 0.00 -0.02 0.00 0.00 39.34 39.90 1iml n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1iml h ASN 52 N 3.64 0.46 -5.25 0.00 -1.24 -1.48 -1.72 115.58 109.99 1iml h ASN 52 Ca -0.48 -0.17 -0.08 0.00 0.71 0.00 0.00 56.30 56.29 1iml h ASN 52 Cb 1.25 -0.13 -0.11 0.00 0.73 0.00 0.00 38.32 40.07 1iml h ASN 52 CO 0.70 0.74 -0.19 -1.00 -1.29 0.00 0.00 177.43 176.39 1iml s HIS 53 N -4.40 0.35 0.38 0.67 3.76 -1.26 -3.22 115.29 111.56 1iml s HIS 53 Ca -0.06 -0.70 0.38 0.00 -0.15 0.00 0.00 55.06 54.53 1iml s HIS 53 Cb 0.13 0.10 1.85 0.00 1.11 0.00 0.00 32.58 35.78 1iml s HIS 53 CO 0.79 -0.87 2.17 -1.00 -0.85 0.00 0.00 174.74 174.97 1iml h PRO 54 N 2.36 0.00 -0.30 8.40 0.13 -1.97 -3.46 132.00 137.16 1iml h PRO 54 Ca -0.29 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.88 1iml h PRO 54 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 1iml h PRO 54 CO 0.41 0.01 0.09 0.00 -0.23 0.00 0.00 178.00 178.28 1iml h TYR 56 N 0.22 -0.66 0.00 0.00 3.20 -1.47 -2.16 116.97 116.11 1iml h TYR 56 Ca 0.13 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1iml h TYR 56 Cb 0.11 0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1iml h TYR 56 CO -0.14 -0.38 0.00 1.03 -1.64 0.00 0.00 178.16 177.03 1iml h SER 57 N -0.76 0.00 0.00 -2.11 0.87 -1.28 0.44 113.55 110.70 1iml h SER 57 Ca -0.07 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.33 1iml h SER 57 Cb 0.57 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1iml h SER 57 CO 0.12 0.00 -1.04 0.00 -0.53 0.00 0.00 176.83 175.38 1iml n ALA 58 N -1.95 0.68 -0.07 6.23 0.00 0.20 -4.58 120.51 121.02 1iml n ALA 58 Ca -0.02 -0.48 -0.18 0.00 0.00 0.00 0.00 53.44 52.76 1iml n ALA 58 Cb 0.07 -0.34 -0.13 0.00 0.00 0.00 0.00 19.45 19.05 1iml n ALA 58 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1iml n MET 59 N -4.49 0.69 -0.60 0.00 0.00 -0.85 -4.96 117.12 106.92 1iml n MET 59 Ca -0.24 0.19 -0.01 0.00 0.00 0.00 0.00 57.70 57.64 1iml n MET 59 Cb 0.54 -1.61 0.00 0.00 0.00 0.00 0.00 33.22 32.16 1iml n MET 59 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1iml n PHE 60 N -3.28 -3.44 0.00 1.12 3.01 0.15 -4.99 117.46 110.03 1iml n PHE 60 Ca -0.37 -0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.04 1iml n PHE 60 Cb 1.03 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.48 1iml n PHE 60 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1iml n GLY 61 N 4.81 -0.33 3.50 1.37 0.00 -1.21 -4.37 105.19 108.96 1iml n GLY 61 Ca 0.00 0.24 -0.51 0.00 0.00 0.00 0.00 46.02 45.75 1iml n GLY 61 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iml n PRO 62 N 0.00 1.19 -3.65 1.61 -0.02 -1.26 -4.92 135.00 127.95 1iml n PRO 62 Ca 0.00 0.36 -0.04 0.00 -2.02 0.00 0.00 63.50 61.80 1iml n PRO 62 Cb 0.00 -2.43 -0.06 0.00 -0.02 0.00 0.00 33.50 31.00 1iml n PRO 62 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1iml s LYS 63 N 5.64 0.57 0.37 -0.52 2.47 -1.26 -5.00 119.74 122.02 1iml s LYS 63 Ca 1.06 1.34 0.06 0.00 -1.56 0.00 0.00 55.97 56.87 1iml s LYS 63 Cb -0.87 0.62 0.73 0.00 -1.46 0.00 0.00 37.83 36.85 1iml s LYS 63 CO 0.52 -0.19 1.95 0.78 0.16 0.00 0.00 175.35 178.56 1iml h GLY 64 N 7.76 0.51 0.00 5.54 0.00 -2.08 -3.45 103.07 111.36 1iml h GLY 64 Ca -0.21 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1iml h GLY 64 CO 0.12 0.25 0.00 0.69 0.00 0.00 0.00 176.54 177.60 1iml n PHE 65 N -4.35 0.00 -4.26 5.60 3.72 -1.26 -4.74 117.46 112.16 1iml n PHE 65 Ca 0.02 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.13 1iml n PHE 65 Cb 0.18 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.67 1iml n PHE 65 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1iml s GLY 66 N 0.00 2.60 -0.48 1.37 0.00 -1.26 -5.11 107.32 104.44 1iml s GLY 66 Ca 0.00 -1.15 0.03 0.00 0.00 0.00 0.00 44.72 43.61 1iml s GLY 66 CO 0.00 -2.03 0.34 -1.60 0.00 0.00 0.00 173.10 169.81 1iml s ARG 67 N -4.05 1.34 0.00 2.90 3.52 -1.26 -5.04 118.95 116.37 1iml s ARG 67 Ca 0.25 -2.31 0.00 0.00 -0.13 0.00 0.00 55.73 53.55 1iml s ARG 67 Cb 0.01 -2.12 0.00 0.00 -1.56 0.00 0.00 34.95 31.27 1iml s ARG 67 CO 0.15 -1.29 0.00 0.41 -0.81 0.00 0.00 175.30 173.76 1iml n GLY 68 N 2.93 3.79 3.58 8.12 0.00 -1.26 -5.19 105.19 117.16 1iml n GLY 68 Ca 0.20 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1iml n GLY 68 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1iml s GLY 69 N 0.00 -0.42 0.00 -0.02 0.00 -1.26 -5.15 107.32 100.47 1iml s GLY 69 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 44.72 44.93 1iml s GLY 69 CO 0.00 0.07 0.00 0.00 0.00 0.00 0.00 173.10 173.17 1iml n ALA 70 N -0.41 0.00 -3.63 3.20 0.00 -1.26 -4.47 120.51 113.94 1iml n ALA 70 Ca -0.12 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.97 1iml n ALA 70 Cb 0.63 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.94 1iml n ALA 70 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iml s GLU 71 N 0.00 2.55 -0.13 0.00 2.56 -1.26 -5.07 118.70 117.35 1iml s GLU 71 Ca 0.00 -1.18 -0.34 0.00 0.00 0.00 0.00 54.97 53.45 1iml s GLU 71 Cb 0.00 -3.15 0.14 0.00 2.00 0.00 0.00 34.13 33.12 1iml s GLU 71 CO 0.00 -0.56 1.34 -1.54 -0.56 0.00 0.00 175.26 173.93 1iml s SER 72 N 1.28 -0.05 0.00 -1.70 1.04 -1.26 -5.04 113.70 107.97 1iml s SER 72 Ca -0.04 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1iml s SER 72 Cb -0.19 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.01 1iml s SER 72 CO -0.02 -0.15 0.00 1.57 0.98 0.00 0.00 173.24 175.63 1iml n HIS 73 N -0.31 0.00 0.00 5.02 -0.00 -1.26 -4.51 115.22 114.16 1iml n HIS 73 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.68 1iml n HIS 73 Cb 0.61 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.60 1iml n HIS 73 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 1iml n THR 74 N 0.00 0.00 -3.93 3.57 -2.24 -1.26 -4.79 114.28 105.63 1iml n THR 74 Ca 0.00 0.63 -0.35 0.00 -2.27 0.00 0.00 64.05 62.05 1iml n THR 74 Cb 0.00 -1.58 -0.13 0.00 -2.10 0.00 0.00 70.33 66.53 1iml n THR 74 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1iml s PHE 75 N -0.30 3.04 0.00 4.78 0.08 -1.26 -5.27 117.98 119.04 1iml s PHE 75 Ca 0.00 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 56.52 1iml s PHE 75 Cb 0.00 -2.14 0.00 0.00 -0.57 0.00 0.00 43.02 40.31 1iml s PHE 75 CO 0.00 -0.33 0.00 1.17 -0.10 0.00 0.00 175.22 175.96