#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 4.37 0.08 9.51 1.01 -1.26 -0.23 120.40 133.89 1kfh s VAL 2 Ca 0.00 1.53 0.04 0.00 0.00 0.00 0.00 61.98 63.56 1kfh s VAL 2 Cb 0.00 -4.44 -0.03 0.00 0.00 0.00 0.00 36.38 31.91 1kfh s VAL 2 CO 0.00 -0.63 -0.11 0.00 0.00 0.00 0.00 175.10 174.36 1kfh s HIS 4 N -1.80 3.27 -0.11 0.00 3.76 -1.26 -0.31 115.29 118.85 1kfh s HIS 4 Ca -0.00 1.20 0.01 0.00 -0.15 0.00 0.00 55.06 56.12 1kfh s HIS 4 Cb -0.07 -3.46 -0.01 0.00 1.11 0.00 0.00 32.58 30.15 1kfh s HIS 4 CO 0.01 -1.48 -0.16 -0.08 -0.85 0.00 0.00 174.74 172.18 1kfh s THR 5 N 1.63 2.84 -1.63 1.30 -1.32 0.47 -3.08 115.64 115.84 1kfh s THR 5 Ca 0.59 -0.75 0.30 0.00 -1.21 0.00 0.00 61.69 60.62 1kfh s THR 5 Cb -0.28 -2.16 0.59 0.00 -1.51 0.00 0.00 72.50 69.14 1kfh s THR 5 CO 0.26 0.54 2.03 0.35 -2.21 0.00 0.00 174.62 175.60 1kfh n THR 6 N 3.29 0.00 0.29 5.08 -2.24 -0.03 -1.86 114.28 118.82 1kfh n THR 6 Ca -0.18 -0.02 0.07 0.00 -2.27 0.00 0.00 64.05 61.65 1kfh n THR 6 Cb 0.53 -0.36 0.32 0.00 -2.10 0.00 0.00 70.33 68.71 1kfh n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kfh n ALA 7 N -1.10 1.39 -2.35 6.98 0.00 -1.26 -4.62 120.51 119.54 1kfh n ALA 7 Ca 0.16 0.04 -0.30 0.00 0.00 0.00 0.00 53.44 53.34 1kfh n ALA 7 Cb 0.23 -1.22 -0.16 0.00 0.00 0.00 0.00 19.45 18.30 1kfh n ALA 7 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1kfh s THR 8 N -3.16 1.97 -0.34 0.00 -4.23 -1.26 -5.10 115.64 103.52 1kfh s THR 8 Ca 0.03 -1.14 -0.06 0.00 -1.18 0.00 0.00 61.69 59.35 1kfh s THR 8 Cb 0.06 -1.65 0.05 0.00 1.34 0.00 0.00 72.50 72.30 1kfh s THR 8 CO 0.21 0.49 0.10 -0.94 -0.54 0.00 0.00 174.62 173.94 1kfh s SER 9 N -0.76 5.27 0.65 3.99 1.04 -1.26 -1.71 113.70 120.92 1kfh s SER 9 Ca 0.10 -1.21 -0.11 0.00 0.48 0.00 0.00 55.95 55.21 1kfh s SER 9 Cb -0.10 -1.85 -0.02 0.00 0.10 0.00 0.00 66.02 64.16 1kfh s SER 9 CO -0.00 -0.34 1.04 -2.16 0.98 0.00 0.00 173.24 172.77 1kfh s PRO 10 N 1.37 3.30 0.09 4.02 0.04 -1.26 -5.11 135.00 137.45 1kfh s PRO 10 Ca -0.02 0.83 -0.36 0.00 0.04 0.00 0.00 61.00 61.49 1kfh s PRO 10 Cb -0.20 -2.04 -0.18 0.00 0.04 0.00 0.00 34.50 32.13 1kfh s PRO 10 CO 0.02 -0.81 1.12 -0.89 0.04 0.00 0.00 177.00 176.48 1kfh n ILE 11 N -2.92 0.43 -4.17 0.56 5.41 -0.69 -4.99 119.36 112.99 1kfh n ILE 11 Ca 0.07 -0.11 -0.15 0.00 1.00 0.00 0.00 62.75 63.56 1kfh n ILE 11 Cb 0.54 -0.47 -0.11 0.00 -0.71 0.00 0.00 39.64 38.89 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 0.05 1.49 -0.55 4.38 1.04 -0.77 -4.95 113.70 114.38 1kfh s SER 12 Ca 0.82 -0.75 -0.22 0.00 0.48 0.00 0.00 55.95 56.28 1kfh s SER 12 Cb -1.03 -0.01 0.06 0.00 0.10 0.00 0.00 66.02 65.14 1kfh s SER 12 CO 0.53 -0.21 0.80 0.00 0.98 0.00 0.00 173.24 175.33 1kfh s ALA 13 N -2.11 3.26 -0.04 5.32 0.00 -1.26 -0.39 121.76 126.54 1kfh s ALA 13 Ca 0.03 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.42 1kfh s ALA 13 Cb -0.05 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.46 1kfh s ALA 13 CO 0.01 -2.27 0.00 0.14 0.00 0.00 0.00 175.76 173.64 1kfh s VAL 14 N 3.34 4.22 -0.85 0.00 -7.23 0.58 -4.83 120.40 115.63 1kfh s VAL 14 Ca 0.22 -0.45 -0.20 0.00 -1.81 0.00 0.00 61.98 59.74 1kfh s VAL 14 Cb -0.16 -2.84 0.11 0.00 0.56 0.00 0.00 36.38 34.05 1kfh s VAL 14 CO 0.14 0.47 1.08 -0.89 -0.31 0.00 0.00 175.10 175.60 1kfh s THR 15 N -1.00 4.59 -0.13 5.32 2.01 -1.26 -0.43 115.64 124.74 1kfh s THR 15 Ca 0.17 -1.19 -0.29 0.00 0.31 0.00 0.00 61.69 60.68 1kfh s THR 15 Cb -0.11 -4.76 -0.03 0.00 0.01 0.00 0.00 72.50 67.61 1kfh s THR 15 CO 0.07 -1.50 1.39 0.00 -0.69 0.00 0.00 174.62 173.89 1kfh s PRO 17 N 3.68 1.90 0.02 0.00 0.04 -1.25 -1.65 135.00 137.75 1kfh s PRO 17 Ca 0.61 0.83 -0.36 0.00 0.04 0.00 0.00 61.00 62.11 1kfh s PRO 17 Cb -0.25 -1.88 -0.16 0.00 0.04 0.00 0.00 34.50 32.25 1kfh s PRO 17 CO 0.19 -1.80 1.51 -2.30 0.04 0.00 0.00 177.00 174.64 1kfh n PRO 18 N -3.58 1.45 0.00 0.56 -0.02 -1.26 -0.45 135.00 131.69 1kfh n PRO 18 Ca 0.07 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1kfh n PRO 18 Cb 0.55 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1kfh n PRO 18 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kfh n GLY 19 N 3.16 2.70 2.47 -1.23 0.00 -1.26 -4.98 105.19 106.04 1kfh n GLY 19 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1kfh n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1kfh s GLU 20 N -0.40 0.66 -0.01 1.61 2.02 0.40 -1.31 118.70 121.67 1kfh s GLU 20 Ca 0.00 -1.52 0.02 0.00 0.02 0.00 0.00 54.97 53.49 1kfh s GLU 20 Cb 0.00 -1.26 -0.03 0.00 0.10 0.00 0.00 34.13 32.93 1kfh s GLU 20 CO 0.00 -1.27 0.04 0.09 0.02 0.00 0.00 175.26 174.15 1kfh n ASN 21 N 3.68 4.45 -4.58 -0.19 4.13 -0.46 -3.78 115.26 118.51 1kfh n ASN 21 Ca 0.17 0.00 -0.34 0.00 1.68 0.00 0.00 54.58 56.09 1kfh n ASN 21 Cb 0.41 0.97 -0.11 0.00 -1.54 0.00 0.00 39.78 39.51 1kfh n ASN 21 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1kfh s LEU 22 N -3.41 3.23 -0.04 3.41 1.43 0.12 -4.63 118.68 118.79 1kfh s LEU 22 Ca -0.01 -0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 52.93 1kfh s LEU 22 Cb 0.01 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 1kfh s LEU 22 CO 0.10 0.34 0.40 0.00 0.23 0.00 0.00 176.35 177.42 1kfh s TYR 24 N -0.56 0.87 -0.45 0.00 -0.85 -0.08 -0.46 117.35 115.82 1kfh s TYR 24 Ca 0.23 -0.53 -0.13 0.00 -0.52 0.00 0.00 57.07 56.12 1kfh s TYR 24 Cb -0.16 -0.50 0.07 0.00 0.38 0.00 0.00 41.96 41.75 1kfh s TYR 24 CO 0.11 -0.04 0.33 0.50 -1.52 0.00 0.00 175.55 174.93 1kfh s ARG 25 N -1.91 2.82 -0.72 -3.49 3.52 -0.08 -2.39 118.95 116.70 1kfh s ARG 25 Ca -0.05 -1.38 -0.16 0.00 -0.13 0.00 0.00 55.73 54.02 1kfh s ARG 25 Cb -0.08 -3.97 0.17 0.00 -1.56 0.00 0.00 34.95 29.51 1kfh s ARG 25 CO 0.01 -0.98 0.71 0.21 -0.81 0.00 0.00 175.30 174.43 1kfh s LYS 26 N 1.55 3.34 -0.04 5.12 2.20 0.12 -0.53 119.74 131.49 1kfh s LYS 26 Ca 0.04 -2.01 0.06 0.00 -0.36 0.00 0.00 55.97 53.70 1kfh s LYS 26 Cb -0.23 -4.41 -0.02 0.00 -1.51 0.00 0.00 37.83 31.66 1kfh s LYS 26 CO 0.05 -1.38 -0.22 0.00 -0.36 0.00 0.00 175.35 173.44 1kfh s MET 27 N 1.17 2.30 0.18 4.03 0.23 -0.22 -0.16 119.30 126.84 1kfh s MET 27 Ca 0.14 -0.86 -0.21 0.00 -1.03 0.00 0.00 55.69 53.73 1kfh s MET 27 Cb -0.18 -2.16 0.05 0.00 -1.53 0.00 0.00 34.83 31.01 1kfh s MET 27 CO -0.03 0.55 0.58 1.67 -2.03 0.00 0.00 175.02 175.76 1kfh s TRP 28 N -0.57 -0.39 -0.02 3.16 -2.14 0.11 -0.22 118.94 118.86 1kfh s TRP 28 Ca 0.08 0.12 -0.24 0.00 2.66 0.00 0.00 56.10 58.72 1kfh s TRP 28 Cb -0.11 0.52 -0.04 0.00 -3.10 0.00 0.00 33.47 30.74 1kfh s TRP 28 CO 0.00 -0.89 0.73 0.00 -2.66 0.00 0.00 176.95 174.13 1kfh s ASP 30 N 0.43 5.96 0.00 0.00 1.47 -0.28 -4.89 116.67 119.36 1kfh s ASP 30 Ca 0.38 0.40 0.00 0.00 1.18 0.00 0.00 52.55 54.51 1kfh s ASP 30 Cb -0.19 -1.71 0.00 0.00 -0.34 0.00 0.00 42.92 40.68 1kfh s ASP 30 CO 0.20 -0.62 0.00 0.00 0.68 0.00 0.00 175.17 175.43 1kfh n ALA 31 N -2.06 0.00 -1.22 2.11 0.00 -1.22 -0.80 120.51 117.33 1kfh n ALA 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1kfh n ALA 31 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.03 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 0.00 -0.33 0.00 3.72 -1.09 -5.08 117.46 114.68 1kfh n PHE 32 Ca 0.00 -0.07 0.03 0.00 -0.05 0.00 0.00 57.45 57.35 1kfh n PHE 32 Cb 0.00 -0.02 -0.01 0.00 -0.94 0.00 0.00 39.48 38.51 1kfh n PHE 32 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1kfh n SER 34 N -4.34 0.00 -0.21 0.00 3.41 -1.26 -1.94 113.62 109.28 1kfh n SER 34 Ca -0.00 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.62 1kfh n SER 34 Cb 0.52 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.59 1kfh n SER 34 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1kfh h SER 35 N 0.00 0.15 -0.79 4.04 4.64 -2.00 -2.81 113.55 116.78 1kfh h SER 35 Ca 0.00 0.10 -0.52 0.00 -0.47 0.00 0.00 61.79 60.90 1kfh h SER 35 Cb 0.00 0.10 -0.30 0.00 -0.31 0.00 0.00 62.40 61.89 1kfh h SER 35 CO 0.00 0.08 0.14 0.54 -0.87 0.00 0.00 176.83 176.72 1kfh n ARG 36 N -5.05 2.74 -0.15 4.77 1.74 -0.82 -5.04 116.66 114.86 1kfh n ARG 36 Ca 0.10 -3.51 0.00 0.00 -0.77 0.00 0.00 57.85 53.67 1kfh n ARG 36 Cb 0.31 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 29.58 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 -0.93 -3.09 2.92 -0.13 0.00 -1.06 -1.98 105.19 100.92 1kfh n GLY 37 Ca 0.51 -1.15 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 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 -5.42 1.53 -0.20 1.61 2.47 -1.26 -1.12 119.74 117.34 1kfh s LYS 38 Ca 0.00 -0.27 -0.09 0.00 -1.56 0.00 0.00 55.97 54.05 1kfh s LYS 38 Cb 0.00 -1.53 -0.04 0.00 -1.46 0.00 0.00 37.83 34.80 1kfh s LYS 38 CO 0.00 -0.21 0.10 0.08 0.16 0.00 0.00 175.35 175.48 1kfh s VAL 39 N 1.51 5.04 -0.10 4.02 1.01 0.31 -4.94 120.40 127.25 1kfh s VAL 39 Ca 0.01 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.07 1kfh s VAL 39 Cb -0.13 -3.30 0.02 0.00 0.00 0.00 0.00 36.38 32.96 1kfh s VAL 39 CO -0.06 0.43 -0.13 -0.69 0.00 0.00 0.00 175.10 174.65 1kfh s VAL 40 N 0.57 1.31 0.09 2.92 1.01 -1.26 -0.72 120.40 124.32 1kfh s VAL 40 Ca 0.05 -0.53 0.07 0.00 0.00 0.00 0.00 61.98 61.58 1kfh s VAL 40 Cb -0.12 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 1kfh s VAL 40 CO 0.01 0.40 -0.19 -1.61 0.00 0.00 0.00 175.10 173.71 1kfh s GLU 41 N 1.01 1.10 -0.05 2.72 0.41 0.78 -4.99 118.70 119.67 1kfh s GLU 41 Ca -0.07 -1.07 0.05 0.00 -0.41 0.00 0.00 54.97 53.46 1kfh s GLU 41 Cb -0.15 -1.28 -0.00 0.00 -1.78 0.00 0.00 34.13 30.91 1kfh s GLU 41 CO -0.01 0.30 -0.20 -0.51 -0.49 0.00 0.00 175.26 174.35 1kfh s LEU 42 N -1.74 1.97 0.00 1.80 2.01 -1.26 0.10 118.68 121.56 1kfh s LEU 42 Ca 0.05 -0.42 0.00 0.00 0.01 0.00 0.00 54.13 53.76 1kfh s LEU 42 Cb -0.10 -1.15 0.00 0.00 0.01 0.00 0.00 46.19 44.96 1kfh s LEU 42 CO 0.03 0.18 0.00 0.61 1.01 0.00 0.00 176.35 178.18 1kfh n GLY 43 N 3.14 2.87 3.26 -3.19 0.00 -1.01 -0.85 105.19 109.42 1kfh n GLY 43 Ca -0.18 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.03 -1.77 -1.10 0.00 0.00 -0.82 -4.95 121.76 112.10 1kfh s ALA 45 Ca 0.06 1.30 0.17 0.00 0.00 0.00 0.00 51.96 53.50 1kfh s ALA 45 Cb -0.09 -0.00 0.78 0.00 0.00 0.00 0.00 23.12 23.80 1kfh s ALA 45 CO 0.03 -0.38 1.55 0.00 0.00 0.00 0.00 175.76 176.96 1kfh n ALA 46 N 0.86 1.83 -3.50 0.00 0.00 -0.43 0.14 120.51 119.40 1kfh n ALA 46 Ca -0.19 -0.07 -0.12 0.00 0.00 0.00 0.00 53.44 53.07 1kfh n ALA 46 Cb 0.57 -1.28 -0.09 0.00 0.00 0.00 0.00 19.45 18.65 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 -2.90 -0.00 -0.14 0.00 2.01 -1.26 -4.68 115.64 108.67 1kfh s THR 47 Ca 0.10 0.01 -0.25 0.00 0.31 0.00 0.00 61.69 61.87 1kfh s THR 47 Cb 0.11 -0.77 -0.02 0.00 0.01 0.00 0.00 72.50 71.83 1kfh s THR 47 CO 0.31 0.01 0.80 0.00 -0.69 0.00 0.00 174.62 175.04 1kfh s PRO 49 N 1.75 3.08 0.00 0.00 0.02 -1.26 -5.09 135.00 133.49 1kfh s PRO 49 Ca 0.38 0.91 0.00 0.00 0.02 0.00 0.00 61.00 62.31 1kfh s PRO 49 Cb -0.17 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.34 1kfh s PRO 49 CO 0.15 -0.98 0.00 -1.13 -0.33 0.00 0.00 177.00 174.70 1kfh n SER 50 N -3.05 0.00 -2.78 2.53 3.41 -1.26 -4.24 113.62 108.23 1kfh n SER 50 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1kfh n SER 50 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1kfh n SER 50 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1kfh n LYS 51 N 0.00 0.00 -3.86 4.33 3.00 -1.24 -2.15 118.16 118.24 1kfh n LYS 51 Ca 0.00 -0.27 -0.12 0.00 -0.00 0.00 0.00 58.31 57.92 1kfh n LYS 51 Cb 0.00 -1.75 -0.14 0.00 0.00 0.00 0.00 35.03 33.14 1kfh n LYS 51 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1kfh s LYS 52 N 4.01 0.03 -0.76 1.64 -0.14 0.63 -2.22 119.74 122.92 1kfh s LYS 52 Ca 0.00 0.04 -0.27 0.00 -1.36 0.00 0.00 55.97 54.39 1kfh s LYS 52 Cb 0.00 -0.00 0.03 0.00 -1.68 0.00 0.00 37.83 36.18 1kfh s LYS 52 CO 0.00 -0.01 1.33 -1.25 -0.76 0.00 0.00 175.35 174.66 1kfh s PRO 53 N 0.07 3.19 0.00 -1.68 0.04 -1.26 -3.75 135.00 131.61 1kfh s PRO 53 Ca -0.01 -0.27 0.00 0.00 0.04 0.00 0.00 61.00 60.76 1kfh s PRO 53 Cb -0.01 -4.31 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1kfh s PRO 53 CO -0.00 -2.20 0.00 0.98 0.04 0.00 0.00 177.00 175.82 1kfh n TYR 54 N 9.56 0.00 -3.10 0.56 9.36 -0.94 -4.95 117.16 127.65 1kfh n TYR 54 Ca 0.07 0.00 -0.40 0.00 3.32 0.00 0.00 57.90 60.89 1kfh n TYR 54 Cb 0.49 -0.72 -0.06 0.00 -0.63 0.00 0.00 39.34 38.42 1kfh n TYR 54 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1kfh s GLU 55 N -0.16 4.19 -0.89 2.98 8.01 -1.24 -4.80 118.70 126.80 1kfh s GLU 55 Ca 0.00 0.63 -0.24 0.00 0.01 0.00 0.00 54.97 55.37 1kfh s GLU 55 Cb 0.00 -3.60 0.05 0.00 -4.31 0.00 0.00 34.13 26.28 1kfh s GLU 55 CO 0.00 -0.29 1.32 -2.00 0.01 0.00 0.00 175.26 174.30 1kfh s GLU 56 N 2.08 3.41 -0.57 1.61 2.56 0.69 -0.27 118.70 128.21 1kfh s GLU 56 Ca 0.29 -0.87 -0.23 0.00 0.00 0.00 0.00 54.97 54.16 1kfh s GLU 56 Cb -0.16 -4.82 0.05 0.00 2.00 0.00 0.00 34.13 31.21 1kfh s GLU 56 CO 0.10 -2.11 0.89 0.08 -0.56 0.00 0.00 175.26 173.66 1kfh s VAL 57 N 4.92 4.45 -0.38 3.70 1.01 -0.91 -1.05 120.40 132.13 1kfh s VAL 57 Ca 0.39 -0.05 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 1kfh s VAL 57 Cb -0.05 -4.54 0.08 0.00 0.00 0.00 0.00 36.38 31.87 1kfh s VAL 57 CO 0.00 -1.16 0.18 0.42 0.00 0.00 0.00 175.10 174.54 1kfh s THR 58 N 3.75 3.71 0.16 3.92 -4.23 0.31 -4.53 115.64 118.72 1kfh s THR 58 Ca 0.25 -1.53 0.09 0.00 -1.18 0.00 0.00 61.69 59.32 1kfh s THR 58 Cb -0.15 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 70.36 1kfh s THR 58 CO 0.15 -0.44 -0.14 0.00 -0.54 0.00 0.00 174.62 173.65 1kfh n SER 61 N 2.10 5.78 -4.40 0.00 3.41 -1.26 0.10 113.62 119.35 1kfh n SER 61 Ca -0.17 -3.75 -0.21 0.00 -0.26 0.00 0.00 58.87 54.48 1kfh n SER 61 Cb 0.57 -0.80 -0.10 0.00 -0.26 0.00 0.00 64.21 63.62 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 -4.29 1.90 -0.17 6.66 -4.23 -1.26 -4.99 115.64 109.27 1kfh s THR 62 Ca 0.58 -2.23 -0.29 0.00 -1.18 0.00 0.00 61.69 58.57 1kfh s THR 62 Cb 0.47 -2.24 -0.04 0.00 1.34 0.00 0.00 72.50 72.04 1kfh s THR 62 CO 0.02 -0.46 1.70 -1.81 -0.54 0.00 0.00 174.62 173.54 1kfh s ASP 63 N -3.41 6.37 -1.84 3.99 1.01 -1.26 -2.32 116.67 119.22 1kfh s ASP 63 Ca 0.26 1.85 0.00 0.00 0.71 0.00 0.00 52.55 55.37 1kfh s ASP 63 Cb -0.00 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 1kfh s ASP 63 CO 0.10 -1.23 0.00 0.29 0.21 0.00 0.00 175.17 174.54 1kfh n LYS 64 N 7.63 -1.55 0.04 8.23 5.02 0.13 -4.91 118.16 132.74 1kfh n LYS 64 Ca 0.19 1.04 0.08 0.00 -2.02 0.00 0.00 58.31 57.61 1kfh n LYS 64 Cb 0.44 -5.59 0.35 0.00 -0.02 0.00 0.00 35.03 30.21 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 -1.72 6.47 -4.71 0.00 6.94 -1.26 -4.91 115.26 116.07 1kfh n ASN 66 Ca 0.03 -3.60 -0.42 0.00 -0.02 0.00 0.00 54.58 50.57 1kfh n ASN 66 Cb 0.17 -1.08 -0.03 0.00 -2.36 0.00 0.00 39.78 36.49 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 -3.67 4.33 -0.10 -0.53 0.02 -1.24 -4.62 135.00 129.20 1kfh s PRO 67 Ca 0.38 1.96 -0.29 0.00 0.02 0.00 0.00 61.00 63.08 1kfh s PRO 67 Cb 0.16 -3.38 -0.07 0.00 0.02 0.00 0.00 34.50 31.23 1kfh s PRO 67 CO -0.06 -0.44 2.06 -1.58 -0.33 0.00 0.00 177.00 176.65 1kfh s HIS 68 N 1.54 1.27 -0.64 6.54 2.46 -1.26 -4.96 115.29 120.25 1kfh s HIS 68 Ca 0.63 0.06 -0.27 0.00 0.47 0.00 0.00 55.06 55.95 1kfh s HIS 68 Cb -0.33 -4.08 0.01 0.00 -0.13 0.00 0.00 32.58 28.05 1kfh s HIS 68 CO 0.29 -4.73 1.46 -1.25 -2.47 0.00 0.00 174.74 168.04 1kfh s PRO 69 N 5.36 3.12 -1.32 2.88 0.04 -1.26 -4.92 135.00 138.91 1kfh s PRO 69 Ca 0.93 0.24 -0.17 0.00 0.04 0.00 0.00 61.00 62.04 1kfh s PRO 69 Cb -0.37 -4.20 0.02 0.00 0.04 0.00 0.00 34.50 29.99 1kfh s PRO 69 CO 0.38 -2.18 2.04 0.36 0.04 0.00 0.00 177.00 177.63 1kfh n LYS 70 N 9.03 2.71 0.00 4.56 2.85 -1.26 -4.94 118.16 131.11 1kfh n LYS 70 Ca 0.11 -2.69 0.00 0.00 -1.05 0.00 0.00 58.31 54.67 1kfh n LYS 70 Cb 0.50 -3.33 0.00 0.00 -0.65 0.00 0.00 35.03 31.55 1kfh n LYS 70 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1kfh n GLN 71 N 6.98 0.00 -1.66 -1.58 1.13 -1.26 -4.57 117.38 116.42 1kfh n GLN 71 Ca 0.50 0.00 -0.46 0.00 -1.94 0.00 0.00 57.00 55.10 1kfh n GLN 71 Cb 0.42 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.72 1kfh n GLN 71 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1kfh n ARG 72 N -0.37 2.33 -0.84 -1.09 0.63 -1.26 -4.91 116.66 111.15 1kfh n ARG 72 Ca 0.00 0.84 -0.10 0.00 -0.92 0.00 0.00 57.85 57.67 1kfh n ARG 72 Cb 0.00 -2.78 -0.14 0.00 0.45 0.00 0.00 32.46 29.99 1kfh n ARG 72 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1kfh n PRO 73 N 7.10 1.68 -0.69 -0.14 -0.04 -1.26 -5.30 135.00 136.34 1kfh n PRO 73 Ca 0.23 -0.82 0.00 0.00 -0.04 0.00 0.00 63.50 62.87 1kfh n PRO 73 Cb 0.33 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 1kfh n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87