#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kfh s VAL 2 N 0.00 4.78 0.04 9.51 1.01 -1.26 -0.46 120.40 134.02 1kfh s VAL 2 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 1kfh s VAL 2 Cb 0.00 -3.15 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1kfh s VAL 2 CO 0.00 0.47 -0.03 0.00 0.00 0.00 0.00 175.10 175.54 1kfh s HIS 4 N -2.67 2.10 -0.12 0.00 3.76 -1.26 -0.77 115.29 116.33 1kfh s HIS 4 Ca -0.04 0.42 -0.00 0.00 -0.15 0.00 0.00 55.06 55.29 1kfh s HIS 4 Cb -0.01 -3.90 -0.02 0.00 1.11 0.00 0.00 32.58 29.76 1kfh s HIS 4 CO -0.05 -3.27 -0.10 0.95 -0.85 0.00 0.00 174.74 171.42 1kfh s THR 5 N 4.52 3.35 -0.60 1.30 -4.23 0.52 -2.25 115.64 118.24 1kfh s THR 5 Ca 0.71 -0.57 0.25 0.00 -1.18 0.00 0.00 61.69 60.90 1kfh s THR 5 Cb -0.29 -2.41 0.28 0.00 1.34 0.00 0.00 72.50 71.42 1kfh s THR 5 CO 0.28 0.53 1.75 0.35 -0.54 0.00 0.00 174.62 176.99 1kfh n THR 6 N 3.21 0.71 0.33 3.99 -2.24 0.99 -2.45 114.28 118.82 1kfh n THR 6 Ca -0.18 -0.07 0.22 0.00 -2.27 0.00 0.00 64.05 61.76 1kfh n THR 6 Cb 0.53 -0.85 1.13 0.00 -2.10 0.00 0.00 70.33 69.04 1kfh n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kfh h ALA 7 N 2.39 1.00 -3.27 6.98 0.00 -1.94 -3.41 119.26 121.01 1kfh h ALA 7 Ca 0.00 -0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 1kfh h ALA 7 Cb 0.58 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.21 1kfh h ALA 7 CO 0.00 0.00 -0.61 0.95 0.00 0.00 0.00 179.25 179.59 1kfh s THR 8 N -4.07 4.41 -0.32 0.00 -4.23 -1.20 -5.09 115.64 105.15 1kfh s THR 8 Ca -0.04 -0.19 -0.05 0.00 -1.18 0.00 0.00 61.69 60.24 1kfh s THR 8 Cb 0.12 -2.91 0.04 0.00 1.34 0.00 0.00 72.50 71.09 1kfh s THR 8 CO 0.44 0.54 0.06 -0.94 -0.54 0.00 0.00 174.62 174.18 1kfh s SER 9 N -0.27 5.14 0.65 3.99 1.04 -1.26 -1.76 113.70 121.23 1kfh s SER 9 Ca 0.07 -1.16 -0.12 0.00 0.48 0.00 0.00 55.95 55.21 1kfh s SER 9 Cb -0.12 -1.81 -0.01 0.00 0.10 0.00 0.00 66.02 64.17 1kfh s SER 9 CO 0.02 -0.29 1.05 -2.16 0.98 0.00 0.00 173.24 172.84 1kfh s PRO 10 N 1.35 3.16 -0.17 4.02 0.04 -1.26 -5.09 135.00 137.05 1kfh s PRO 10 Ca -0.03 1.01 -0.35 0.00 0.04 0.00 0.00 61.00 61.67 1kfh s PRO 10 Cb -0.19 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.21 1kfh s PRO 10 CO 0.01 -0.92 1.94 -0.89 0.04 0.00 0.00 177.00 177.18 1kfh n ILE 11 N -2.70 0.46 -3.97 0.56 5.41 -0.72 -4.95 119.36 113.45 1kfh n ILE 11 Ca 0.08 -0.15 -0.09 0.00 1.00 0.00 0.00 62.75 63.59 1kfh n ILE 11 Cb 0.53 -1.80 -0.09 0.00 -0.71 0.00 0.00 39.64 37.57 1kfh n ILE 11 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1kfh s SER 12 N 4.89 0.26 -0.62 4.38 1.04 -1.02 -4.90 113.70 117.73 1kfh s SER 12 Ca 0.97 -0.68 -0.26 0.00 0.48 0.00 0.00 55.95 56.46 1kfh s SER 12 Cb -0.75 0.22 0.04 0.00 0.10 0.00 0.00 66.02 65.63 1kfh s SER 12 CO 0.52 -0.55 1.13 0.00 0.98 0.00 0.00 173.24 175.32 1kfh s ALA 13 N -3.07 2.99 0.13 5.32 0.00 -1.26 -0.35 121.76 125.52 1kfh s ALA 13 Ca -0.01 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.88 1kfh s ALA 13 Cb 0.02 -3.99 -0.04 0.00 0.00 0.00 0.00 23.12 19.10 1kfh s ALA 13 CO -0.07 -2.74 -0.17 0.14 0.00 0.00 0.00 175.76 172.92 1kfh s VAL 14 N 4.79 1.55 -0.37 0.00 -7.23 0.05 -4.82 120.40 114.37 1kfh s VAL 14 Ca 0.36 -1.71 -0.28 0.00 -1.81 0.00 0.00 61.98 58.54 1kfh s VAL 14 Cb -0.10 -1.60 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 1kfh s VAL 14 CO 0.20 -0.29 2.05 -0.89 -0.31 0.00 0.00 175.10 175.85 1kfh s THR 15 N -1.84 3.23 0.00 5.32 2.01 -1.26 -0.91 115.64 122.19 1kfh s THR 15 Ca 0.10 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.31 1kfh s THR 15 Cb -0.07 -3.39 0.00 0.00 0.01 0.00 0.00 72.50 69.05 1kfh s THR 15 CO 0.04 -0.30 0.00 0.00 -0.69 0.00 0.00 174.62 173.67 1kfh h PRO 17 N 0.00 0.82 -0.01 0.00 0.11 -1.91 -3.06 132.00 127.95 1kfh h PRO 17 Ca 0.00 -0.18 -0.22 0.00 0.11 0.00 0.00 66.00 65.72 1kfh h PRO 17 Cb 0.00 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 30.99 1kfh h PRO 17 CO 0.00 0.75 -0.90 -1.35 -0.21 0.00 0.00 178.00 176.30 1kfh h PRO 18 N 0.79 0.39 0.00 1.05 0.11 -1.91 -3.50 132.00 128.92 1kfh h PRO 18 Ca 0.17 -0.40 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1kfh h PRO 18 Cb 0.32 0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.54 1kfh h PRO 18 CO 0.00 1.07 0.00 0.41 -0.21 0.00 0.00 178.00 179.27 1kfh n GLY 19 N 0.87 -1.89 0.00 -0.55 0.00 -1.16 -4.82 105.19 97.65 1kfh n GLY 19 Ca -0.06 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1kfh n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1kfh n GLU 20 N 0.00 2.51 0.08 1.61 1.02 -1.25 -4.74 120.64 119.87 1kfh n GLU 20 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.15 1kfh n GLU 20 Cb 0.00 0.00 0.35 0.00 -0.02 0.00 0.00 31.44 31.77 1kfh n GLU 20 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1kfh h ASN 21 N 0.00 0.32 -1.34 1.62 4.21 -1.73 -2.99 115.58 115.67 1kfh h ASN 21 Ca 0.00 -0.07 -0.47 0.00 1.21 0.00 0.00 56.30 56.97 1kfh h ASN 21 Cb 0.00 -0.08 -0.07 0.00 -1.12 0.00 0.00 38.32 37.05 1kfh h ASN 21 CO 0.00 0.46 1.15 -0.76 -1.29 0.00 0.00 177.43 176.99 1kfh s LEU 22 N -8.83 3.30 -0.07 1.61 1.02 0.99 -3.84 118.68 112.85 1kfh s LEU 22 Ca -0.06 -0.74 -0.30 0.00 0.02 0.00 0.00 54.13 53.06 1kfh s LEU 22 Cb 0.15 -2.56 -0.02 0.00 0.02 0.00 0.00 46.19 43.79 1kfh s LEU 22 CO 0.75 -2.11 1.01 0.00 0.02 0.00 0.00 176.35 176.02 1kfh s TYR 24 N 1.74 1.54 -0.61 0.00 -0.85 0.30 -0.85 117.35 118.63 1kfh s TYR 24 Ca 0.50 -0.36 -0.04 0.00 -0.52 0.00 0.00 57.07 56.65 1kfh s TYR 24 Cb -0.19 -0.92 0.16 0.00 0.38 0.00 0.00 41.96 41.38 1kfh s TYR 24 CO 0.21 0.06 0.44 0.50 -1.52 0.00 0.00 175.55 175.24 1kfh s ARG 25 N -1.10 2.60 -0.75 -3.49 3.52 0.26 -2.15 118.95 117.85 1kfh s ARG 25 Ca 0.05 -2.42 -0.13 0.00 -0.13 0.00 0.00 55.73 53.10 1kfh s ARG 25 Cb -0.08 -3.79 0.20 0.00 -1.56 0.00 0.00 34.95 29.71 1kfh s ARG 25 CO 0.01 -1.18 0.68 0.21 -0.81 0.00 0.00 175.30 174.22 1kfh s LYS 26 N 0.15 3.38 -0.16 5.12 2.20 0.62 -1.25 119.74 129.79 1kfh s LYS 26 Ca 0.16 -2.31 -0.02 0.00 -0.36 0.00 0.00 55.97 53.43 1kfh s LYS 26 Cb -0.20 -4.34 -0.02 0.00 -1.51 0.00 0.00 37.83 31.77 1kfh s LYS 26 CO -0.04 -1.29 -0.08 0.00 -0.36 0.00 0.00 175.35 173.59 1kfh s MET 27 N 0.45 3.46 0.06 4.03 0.23 -0.51 -0.02 119.30 127.00 1kfh s MET 27 Ca 0.15 -0.62 -0.10 0.00 -1.03 0.00 0.00 55.69 54.09 1kfh s MET 27 Cb -0.15 -2.82 0.01 0.00 -1.53 0.00 0.00 34.83 30.33 1kfh s MET 27 CO -0.06 0.10 0.22 1.67 -2.03 0.00 0.00 175.02 174.92 1kfh s TRP 28 N 0.69 0.06 0.02 3.16 -2.14 0.46 0.17 118.94 121.36 1kfh s TRP 28 Ca -0.04 -0.37 -0.30 0.00 2.66 0.00 0.00 56.10 58.05 1kfh s TRP 28 Cb -0.15 -0.01 -0.05 0.00 -3.10 0.00 0.00 33.47 30.16 1kfh s TRP 28 CO 0.02 -0.50 1.19 0.00 -2.66 0.00 0.00 176.95 175.00 1kfh n ASP 30 N 4.37 0.00 -1.62 0.00 5.68 -0.50 -4.87 116.55 119.60 1kfh n ASP 30 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.38 1kfh n ASP 30 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 1kfh n ASP 30 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1kfh n ALA 31 N -0.84 0.00 -1.27 2.12 0.00 -1.03 -4.92 120.51 114.58 1kfh n ALA 31 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1kfh n ALA 31 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1kfh n ALA 31 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1kfh n PHE 32 N 0.00 2.28 0.00 0.00 3.01 -1.17 -4.75 117.46 116.83 1kfh n PHE 32 Ca 0.00 -2.19 0.00 0.00 1.01 0.00 0.00 57.45 56.27 1kfh n PHE 32 Cb 0.00 -1.96 0.00 0.00 -0.01 0.00 0.00 39.48 37.51 1kfh n PHE 32 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1kfh n SER 34 N -2.93 2.37 0.00 0.00 3.41 -1.26 -3.64 113.62 111.57 1kfh n SER 34 Ca 0.00 -2.64 0.00 0.00 -0.26 0.00 0.00 58.87 55.97 1kfh n SER 34 Cb 0.00 -1.27 0.00 0.00 -0.26 0.00 0.00 64.21 62.68 1kfh n SER 34 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1kfh n SER 35 N 10.87 0.00 -2.74 4.04 3.41 -1.14 -4.97 113.62 123.08 1kfh n SER 35 Ca 0.47 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.80 1kfh n SER 35 Cb 0.43 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 1kfh n SER 35 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1kfh n ARG 36 N 0.00 3.06 -0.59 4.33 1.74 0.16 -4.89 116.66 120.46 1kfh n ARG 36 Ca 0.00 -2.27 0.00 0.00 -0.77 0.00 0.00 57.85 54.81 1kfh n ARG 36 Cb 0.00 -2.33 0.00 0.00 -1.02 0.00 0.00 32.46 29.11 1kfh n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1kfh n GLY 37 N 1.90 -3.43 3.13 -0.13 0.00 -1.24 -2.31 105.19 103.11 1kfh n GLY 37 Ca 0.56 -1.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 1kfh n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1kfh s LYS 38 N -4.81 1.85 -0.21 1.61 2.47 -1.26 -1.42 119.74 117.97 1kfh s LYS 38 Ca 0.00 -0.61 -0.08 0.00 -1.56 0.00 0.00 55.97 53.72 1kfh s LYS 38 Cb 0.00 -1.58 -0.04 0.00 -1.46 0.00 0.00 37.83 34.75 1kfh s LYS 38 CO 0.00 0.22 0.08 0.08 0.16 0.00 0.00 175.35 175.89 1kfh s VAL 39 N 0.12 4.80 -0.26 4.02 1.01 0.77 -4.90 120.40 125.96 1kfh s VAL 39 Ca -0.06 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1kfh s VAL 39 Cb -0.12 -3.20 0.05 0.00 0.00 0.00 0.00 36.38 33.11 1kfh s VAL 39 CO 0.03 0.41 -0.09 -0.69 0.00 0.00 0.00 175.10 174.76 1kfh s VAL 40 N 0.80 2.43 -0.36 2.92 1.01 -1.26 -0.40 120.40 125.54 1kfh s VAL 40 Ca 0.04 -1.45 -0.06 0.00 0.00 0.00 0.00 61.98 60.51 1kfh s VAL 40 Cb -0.13 -2.37 0.05 0.00 0.00 0.00 0.00 36.38 33.93 1kfh s VAL 40 CO 0.02 0.03 0.13 -0.70 0.00 0.00 0.00 175.10 174.58 1kfh s GLU 41 N 1.18 2.54 -0.35 2.72 2.56 0.97 -4.93 118.70 123.37 1kfh s GLU 41 Ca -0.06 -1.31 -0.12 0.00 0.00 0.00 0.00 54.97 53.49 1kfh s GLU 41 Cb -0.19 -3.50 0.01 0.00 2.00 0.00 0.00 34.13 32.44 1kfh s GLU 41 CO -0.05 -0.76 0.22 -0.51 -0.56 0.00 0.00 175.26 173.60 1kfh s LEU 42 N 1.36 4.57 0.00 2.70 1.43 -1.25 -0.28 118.68 127.22 1kfh s LEU 42 Ca -0.00 -0.71 0.00 0.00 -1.03 0.00 0.00 54.13 52.39 1kfh s LEU 42 Cb -0.21 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.95 1kfh s LEU 42 CO 0.02 -0.31 0.00 0.61 0.23 0.00 0.00 176.35 176.90 1kfh n GLY 43 N 5.05 2.52 3.48 -3.19 0.00 -0.91 -0.01 105.19 112.13 1kfh n GLY 43 Ca -0.12 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 1kfh n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kfh s ALA 45 N -1.64 -1.74 -1.39 0.00 0.00 -0.48 -4.22 121.76 112.29 1kfh s ALA 45 Ca 0.22 0.91 0.29 0.00 0.00 0.00 0.00 51.96 53.38 1kfh s ALA 45 Cb -0.08 0.44 1.30 0.00 0.00 0.00 0.00 23.12 24.77 1kfh s ALA 45 CO 0.12 -0.65 1.92 0.00 0.00 0.00 0.00 175.76 177.15 1kfh n ALA 46 N -0.07 2.63 -3.64 0.00 0.00 -1.26 -0.01 120.51 118.15 1kfh n ALA 46 Ca -0.13 -0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.08 1kfh n ALA 46 Cb 0.62 -1.41 -0.07 0.00 0.00 0.00 0.00 19.45 18.60 1kfh n ALA 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1kfh s THR 47 N -2.65 0.00 0.06 0.00 2.01 -1.26 -4.72 115.64 109.07 1kfh s THR 47 Ca 0.25 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.23 1kfh s THR 47 Cb 0.20 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 1kfh s THR 47 CO 0.50 0.00 0.23 0.00 -0.69 0.00 0.00 174.62 174.66 1kfh s PRO 49 N -2.40 4.22 -0.38 0.00 0.02 -1.26 -4.96 135.00 130.23 1kfh s PRO 49 Ca 0.34 1.82 -0.27 0.00 0.02 0.00 0.00 61.00 62.91 1kfh s PRO 49 Cb -0.13 -2.80 -0.05 0.00 0.02 0.00 0.00 34.50 31.55 1kfh s PRO 49 CO 0.26 -0.17 2.16 -1.54 -0.33 0.00 0.00 177.00 177.37 1kfh s SER 50 N -1.08 5.16 0.00 2.53 1.04 -1.26 -4.61 113.70 115.49 1kfh s SER 50 Ca 0.54 1.30 0.00 0.00 0.48 0.00 0.00 55.95 58.27 1kfh s SER 50 Cb -0.31 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.30 1kfh s SER 50 CO 0.39 -2.28 0.00 0.29 0.98 0.00 0.00 173.24 172.62 1kfh n LYS 51 N 8.84 0.00 -1.92 4.02 5.02 -1.26 -4.80 118.16 128.06 1kfh n LYS 51 Ca 0.30 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.17 1kfh n LYS 51 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.48 1kfh n LYS 51 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1kfh s LYS 52 N 0.00 3.14 -0.73 1.97 1.02 -1.26 -4.79 119.74 119.10 1kfh s LYS 52 Ca 0.00 1.40 -0.25 0.00 0.02 0.00 0.00 55.97 57.14 1kfh s LYS 52 Cb 0.00 -4.27 -0.15 0.00 -0.52 0.00 0.00 37.83 32.89 1kfh s LYS 52 CO 0.00 -2.09 2.45 -2.30 -0.92 0.00 0.00 175.35 172.49 1kfh n PRO 53 N 8.60 0.59 0.00 -1.68 -0.02 -1.26 -0.10 135.00 141.14 1kfh n PRO 53 Ca 0.24 -0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1kfh n PRO 53 Cb 0.48 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 1kfh n PRO 53 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1kfh n TYR 54 N 14.35 0.00 -3.74 6.00 4.11 -1.26 -5.14 117.16 131.48 1kfh n TYR 54 Ca 0.49 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 58.04 1kfh n TYR 54 Cb 0.37 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.65 1kfh n TYR 54 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.86 175.65 1kfh s GLU 55 N 0.00 3.61 -0.75 -3.48 2.02 0.86 -3.63 118.70 117.33 1kfh s GLU 55 Ca 0.00 -0.02 -0.05 0.00 0.02 0.00 0.00 54.97 54.92 1kfh s GLU 55 Cb 0.00 -3.10 0.19 0.00 0.10 0.00 0.00 34.13 31.32 1kfh s GLU 55 CO 0.00 0.67 0.61 -1.21 0.02 0.00 0.00 175.26 175.34 1kfh s GLU 56 N -1.59 2.99 -0.96 1.61 8.01 0.13 -4.15 118.70 124.73 1kfh s GLU 56 Ca 0.26 -2.73 -0.19 0.00 0.01 0.00 0.00 54.97 52.32 1kfh s GLU 56 Cb -0.13 -3.94 0.13 0.00 -4.31 0.00 0.00 34.13 25.87 1kfh s GLU 56 CO 0.14 -1.22 1.18 0.08 0.01 0.00 0.00 175.26 175.45 1kfh s VAL 57 N -0.39 4.70 -0.52 2.63 1.01 -1.26 -1.42 120.40 125.15 1kfh s VAL 57 Ca 0.20 -1.62 -0.15 0.00 0.00 0.00 0.00 61.98 60.41 1kfh s VAL 57 Cb -0.15 -4.81 0.12 0.00 0.00 0.00 0.00 36.38 31.53 1kfh s VAL 57 CO -0.07 -1.55 0.46 0.42 0.00 0.00 0.00 175.10 174.37 1kfh s THR 58 N 2.75 5.15 0.18 3.92 -4.23 -0.38 -4.76 115.64 118.26 1kfh s THR 58 Ca 0.35 -1.41 0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1kfh s THR 58 Cb -0.04 -4.25 -0.04 0.00 1.34 0.00 0.00 72.50 69.50 1kfh s THR 58 CO -0.09 -0.79 -0.24 0.00 -0.54 0.00 0.00 174.62 172.96 1kfh n SER 61 N 1.71 2.34 -4.62 0.00 3.41 -1.26 0.07 113.62 115.27 1kfh n SER 61 Ca -0.17 -1.96 -0.25 0.00 -0.26 0.00 0.00 58.87 56.23 1kfh n SER 61 Cb 0.56 -0.27 -0.09 0.00 -0.26 0.00 0.00 64.21 64.15 1kfh n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1kfh s THR 62 N -1.46 2.46 -0.14 6.66 -4.23 -1.25 -4.67 115.64 113.01 1kfh s THR 62 Ca 0.31 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.52 1kfh s THR 62 Cb 0.16 -2.80 -0.05 0.00 1.34 0.00 0.00 72.50 71.15 1kfh s THR 62 CO 0.22 -0.17 1.85 -1.81 -0.54 0.00 0.00 174.62 174.17 1kfh s ASP 63 N -3.71 6.21 -1.73 3.99 1.01 -1.26 -2.28 116.67 118.90 1kfh s ASP 63 Ca 0.35 2.01 0.00 0.00 0.71 0.00 0.00 52.55 55.62 1kfh s ASP 63 Cb 0.02 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.42 1kfh s ASP 63 CO 0.19 -1.33 0.00 0.29 0.21 0.00 0.00 175.17 174.52 1kfh n LYS 64 N 7.83 -1.35 0.16 8.23 5.02 0.55 -4.91 118.16 133.70 1kfh n LYS 64 Ca 0.21 1.01 0.13 0.00 -2.02 0.00 0.00 58.31 57.64 1kfh n LYS 64 Cb 0.44 -5.39 0.54 0.00 -0.02 0.00 0.00 35.03 30.60 1kfh n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1kfh n ASN 66 N -2.42 5.86 -4.75 0.00 6.94 -1.26 -4.90 115.26 114.72 1kfh n ASN 66 Ca 0.02 -3.18 -0.39 0.00 -0.02 0.00 0.00 54.58 51.01 1kfh n ASN 66 Cb 0.24 -1.35 0.04 0.00 -2.36 0.00 0.00 39.78 36.35 1kfh n ASN 66 CO 0.00 0.00 0.00 -2.84 -1.03 0.00 0.00 177.26 173.39 1kfh s PRO 67 N -1.73 3.22 -0.11 -0.53 0.02 -1.26 -4.54 135.00 130.08 1kfh s PRO 67 Ca 0.32 2.26 -0.15 0.00 0.02 0.00 0.00 61.00 63.45 1kfh s PRO 67 Cb -0.03 -2.32 -0.05 0.00 0.02 0.00 0.00 34.50 32.12 1kfh s PRO 67 CO -0.00 -1.13 0.38 -1.58 -0.33 0.00 0.00 177.00 174.33 1kfh s HIS 68 N -1.29 3.54 0.00 6.54 2.46 -1.26 -4.92 115.29 120.36 1kfh s HIS 68 Ca 0.70 0.78 0.00 0.00 0.47 0.00 0.00 55.06 57.01 1kfh s HIS 68 Cb -0.41 -2.39 0.00 0.00 -0.13 0.00 0.00 32.58 29.65 1kfh s HIS 68 CO 0.49 0.32 0.68 -2.30 -2.47 0.00 0.00 174.74 171.46 1kfh n PRO 69 N 3.17 0.00 -1.75 2.88 -0.02 -1.26 -0.95 135.00 137.06 1kfh n PRO 69 Ca -0.11 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1kfh n PRO 69 Cb 0.52 -1.10 -0.00 0.00 -0.02 0.00 0.00 33.50 32.90 1kfh n PRO 69 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1kfh n LYS 70 N -2.11 2.92 0.03 -0.52 5.02 -1.26 -2.88 118.16 119.37 1kfh n LYS 70 Ca 0.00 -2.64 0.00 0.00 -2.02 0.00 0.00 58.31 53.65 1kfh n LYS 70 Cb 0.00 -3.25 0.00 0.00 -0.02 0.00 0.00 35.03 31.76 1kfh n LYS 70 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1kfh n GLN 71 N 5.89 0.00 -1.77 1.97 0.00 -1.11 -4.99 117.38 117.38 1kfh n GLN 71 Ca 0.52 0.00 -0.39 0.00 -0.00 0.00 0.00 57.00 57.13 1kfh n GLN 71 Cb 0.38 0.00 0.03 0.00 0.00 0.00 0.00 30.24 30.65 1kfh n GLN 71 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 1kfh s ARG 72 N -2.00 3.43 -1.07 3.69 1.70 -0.13 -4.91 118.95 119.67 1kfh s ARG 72 Ca 0.00 2.37 -0.18 0.00 -0.47 0.00 0.00 55.73 57.45 1kfh s ARG 72 Cb 0.00 -2.48 -0.07 0.00 -0.57 0.00 0.00 34.95 31.82 1kfh s ARG 72 CO 0.00 -1.00 2.07 -0.35 -1.08 0.00 0.00 175.30 174.94 1kfh n PRO 73 N -0.56 2.09 0.00 3.89 -0.04 -1.26 -4.99 135.00 134.13 1kfh n PRO 73 Ca 0.07 -2.15 0.00 0.00 -0.04 0.00 0.00 63.50 61.38 1kfh n PRO 73 Cb 0.43 -3.06 0.01 0.00 -0.04 0.00 0.00 33.50 30.84 1kfh n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87