#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 5.43 0.17 9.51 1.01 -1.25 -0.66 120.40 134.62 1kfh s VAL 2 Ca 0.00 -2.19 0.03 0.00 0.00 0.00 0.00 61.98 59.81 1kfh s VAL 2 Cb 0.00 -4.49 -0.05 0.00 0.00 0.00 0.00 36.38 31.84 1kfh s VAL 2 CO 0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 175.10 174.01 1kfh s HIS 4 N -3.55 2.25 -0.10 0.00 3.76 -1.26 -0.37 115.29 116.03 1kfh s HIS 4 Ca 0.22 0.33 -0.00 0.00 -0.15 0.00 0.00 55.06 55.46 1kfh s HIS 4 Cb 0.05 -3.89 -0.03 0.00 1.11 0.00 0.00 32.58 29.83 1kfh s HIS 4 CO 0.03 -3.63 -0.08 -0.08 -0.85 0.00 0.00 174.74 170.13 1kfh s THR 5 N 3.34 3.54 -0.96 1.30 -1.32 0.74 -2.14 115.64 120.13 1kfh s THR 5 Ca 0.72 -0.51 0.24 0.00 -1.21 0.00 0.00 61.69 60.92 1kfh s THR 5 Cb -0.35 -2.48 0.20 0.00 -1.51 0.00 0.00 72.50 68.36 1kfh s THR 5 CO 0.30 0.55 1.75 0.35 -2.21 0.00 0.00 174.62 175.36 1kfh n THR 6 N 2.89 0.41 0.29 5.08 -2.24 0.23 -2.29 114.28 118.65 1kfh n THR 6 Ca -0.18 0.08 0.16 0.00 -2.27 0.00 0.00 64.05 61.84 1kfh n THR 6 Cb 0.53 -0.70 0.77 0.00 -2.10 0.00 0.00 70.33 68.83 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 2.77 1.00 -3.97 6.98 0.00 -1.95 -3.42 119.26 120.67 1kfh h ALA 7 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.22 1kfh h ALA 7 Cb 0.42 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.99 1kfh h ALA 7 CO 0.00 0.00 -0.79 0.95 0.00 0.00 0.00 179.25 179.41 1kfh s THR 8 N -3.70 2.94 -0.26 0.00 -4.23 -1.25 -5.10 115.64 104.04 1kfh s THR 8 Ca -0.01 -1.01 0.03 0.00 -1.18 0.00 0.00 61.69 59.52 1kfh s THR 8 Cb 0.09 -2.21 0.06 0.00 1.34 0.00 0.00 72.50 71.78 1kfh s THR 8 CO 0.38 0.42 -0.10 -0.44 -0.54 0.00 0.00 174.62 174.34 1kfh s SER 9 N -1.22 4.40 0.63 3.99 0.01 -1.26 -2.26 113.70 117.98 1kfh s SER 9 Ca 0.14 -1.38 -0.15 0.00 1.31 0.00 0.00 55.95 55.86 1kfh s SER 9 Cb -0.11 -1.52 -0.02 0.00 0.21 0.00 0.00 66.02 64.59 1kfh s SER 9 CO 0.04 -0.19 1.09 -2.16 0.41 0.00 0.00 173.24 172.42 1kfh s PRO 10 N 1.13 3.04 0.14 12.44 0.04 -1.26 -5.11 135.00 145.42 1kfh s PRO 10 Ca -0.09 1.30 -0.35 0.00 0.04 0.00 0.00 61.00 61.91 1kfh s PRO 10 Cb -0.20 -1.99 -0.15 0.00 0.04 0.00 0.00 34.50 32.21 1kfh s PRO 10 CO -0.05 -1.05 1.51 -0.89 0.04 0.00 0.00 177.00 176.56 1kfh n ILE 11 N -2.25 0.02 -4.13 0.56 2.08 -0.96 -4.99 119.36 109.69 1kfh n ILE 11 Ca 0.10 -0.01 -0.16 0.00 0.56 0.00 0.00 62.75 63.24 1kfh n ILE 11 Cb 0.52 -1.34 -0.12 0.00 -0.75 0.00 0.00 39.64 37.95 1kfh n ILE 11 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1kfh s SER 12 N 0.78 1.36 -0.64 4.38 1.04 -0.97 -4.92 113.70 114.73 1kfh s SER 12 Ca 0.80 -0.60 -0.22 0.00 0.48 0.00 0.00 55.95 56.41 1kfh s SER 12 Cb -0.75 -0.02 0.07 0.00 0.10 0.00 0.00 66.02 65.42 1kfh s SER 12 CO 0.40 -0.13 0.94 0.00 0.98 0.00 0.00 173.24 175.43 1kfh s ALA 13 N -1.34 3.14 0.06 5.32 0.00 -1.26 -0.18 121.76 127.49 1kfh s ALA 13 Ca -0.05 -1.80 0.03 0.00 0.00 0.00 0.00 51.96 50.13 1kfh s ALA 13 Cb -0.10 -3.81 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 1kfh s ALA 13 CO 0.02 -2.69 0.06 0.14 0.00 0.00 0.00 175.76 173.28 1kfh s VAL 14 N 3.93 4.46 -0.68 0.00 -7.23 0.51 -4.62 120.40 116.77 1kfh s VAL 14 Ca 0.22 -0.72 -0.26 0.00 -1.81 0.00 0.00 61.98 59.41 1kfh s VAL 14 Cb -0.17 -3.11 -0.01 0.00 0.56 0.00 0.00 36.38 33.65 1kfh s VAL 14 CO 0.11 0.19 1.74 0.42 -0.31 0.00 0.00 175.10 177.24 1kfh s THR 15 N -1.31 3.46 -0.02 5.32 -4.23 -1.26 -0.89 115.64 116.71 1kfh s THR 15 Ca 0.27 0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.63 1kfh s THR 15 Cb -0.12 -4.19 -0.06 0.00 1.34 0.00 0.00 72.50 69.48 1kfh s THR 15 CO 0.19 -1.14 1.53 0.00 -0.54 0.00 0.00 174.62 174.66 1kfh n PRO 17 N 6.13 1.03 -1.61 0.00 -0.02 -1.26 -4.16 135.00 135.11 1kfh n PRO 17 Ca 0.15 0.38 -0.54 0.00 -2.02 0.00 0.00 63.50 61.47 1kfh n PRO 17 Cb 0.43 -1.93 -0.06 0.00 -0.02 0.00 0.00 33.50 31.91 1kfh n PRO 17 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1kfh n PRO 18 N -0.03 1.04 0.00 0.52 -0.02 -1.26 -4.21 135.00 131.04 1kfh n PRO 18 Ca 0.11 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1kfh n PRO 18 Cb 0.42 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 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 2.81 0.65 3.10 -1.23 0.00 -1.26 -5.08 105.19 104.18 1kfh n GLY 19 Ca 0.20 -0.61 0.01 0.00 0.00 0.00 0.00 46.02 45.63 1kfh n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1kfh s GLU 20 N -0.54 0.53 0.00 1.61 4.04 -1.26 -1.03 118.70 122.05 1kfh s GLU 20 Ca 0.00 0.61 0.00 0.00 0.04 0.00 0.00 54.97 55.62 1kfh s GLU 20 Cb 0.00 0.21 0.00 0.00 0.02 0.00 0.00 34.13 34.36 1kfh s GLU 20 CO 0.00 -0.91 0.00 0.09 -1.84 0.00 0.00 175.26 172.60 1kfh n ASN 21 N 5.41 4.91 -4.12 0.83 4.13 -0.43 -4.76 115.26 121.22 1kfh n ASN 21 Ca 0.02 0.00 -0.23 0.00 1.68 0.00 0.00 54.58 56.05 1kfh n ASN 21 Cb 0.52 0.80 -0.15 0.00 -1.54 0.00 0.00 39.78 39.41 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 -3.31 1.98 -0.15 3.41 1.02 0.53 -4.34 118.68 117.83 1kfh s LEU 22 Ca 0.00 -0.28 -0.11 0.00 0.02 0.00 0.00 54.13 53.76 1kfh s LEU 22 Cb 0.00 -0.80 -0.05 0.00 0.02 0.00 0.00 46.19 45.36 1kfh s LEU 22 CO 0.00 0.17 0.21 0.00 0.02 0.00 0.00 176.35 176.75 1kfh s TYR 24 N -0.06 1.11 -0.34 0.00 -0.85 0.39 -0.73 117.35 116.87 1kfh s TYR 24 Ca 0.14 -0.63 0.04 0.00 -0.52 0.00 0.00 57.07 56.10 1kfh s TYR 24 Cb -0.12 -0.60 0.10 0.00 0.38 0.00 0.00 41.96 41.71 1kfh s TYR 24 CO 0.03 0.02 0.04 0.50 -1.52 0.00 0.00 175.55 174.62 1kfh s ARG 25 N -2.70 1.53 -0.59 -3.49 3.52 -0.10 -2.36 118.95 114.75 1kfh s ARG 25 Ca 0.05 -1.85 -0.19 0.00 -0.13 0.00 0.00 55.73 53.61 1kfh s ARG 25 Cb -0.04 -3.19 0.10 0.00 -1.56 0.00 0.00 34.95 30.26 1kfh s ARG 25 CO 0.01 -0.92 0.70 0.15 -0.81 0.00 0.00 175.30 174.43 1kfh s LYS 26 N 0.91 3.04 -0.15 5.12 1.02 0.64 -1.64 119.74 128.69 1kfh s LYS 26 Ca 0.10 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 54.77 1kfh s LYS 26 Cb -0.19 -4.27 -0.01 0.00 -0.52 0.00 0.00 37.83 32.85 1kfh s LYS 26 CO -0.08 -1.54 -0.14 0.00 -0.92 0.00 0.00 175.35 172.67 1kfh s MET 27 N 2.69 3.27 0.04 1.68 0.23 0.23 0.37 119.30 127.81 1kfh s MET 27 Ca 0.11 -0.73 -0.02 0.00 -1.03 0.00 0.00 55.69 54.02 1kfh s MET 27 Cb -0.24 -2.64 -0.03 0.00 -1.53 0.00 0.00 34.83 30.39 1kfh s MET 27 CO 0.06 0.06 0.02 1.67 -2.03 0.00 0.00 175.02 174.80 1kfh s TRP 28 N 0.71 0.35 -0.29 3.16 -2.14 -0.58 -0.12 118.94 120.02 1kfh s TRP 28 Ca -0.07 -0.76 -0.29 0.00 2.66 0.00 0.00 56.10 57.65 1kfh s TRP 28 Cb -0.15 -0.26 -0.02 0.00 -3.10 0.00 0.00 33.47 29.94 1kfh s TRP 28 CO 0.02 -0.34 1.66 0.00 -2.66 0.00 0.00 176.95 175.63 1kfh s ASP 30 N 4.95 6.81 0.00 0.00 1.47 -0.56 -4.85 116.67 124.50 1kfh s ASP 30 Ca 0.73 1.94 0.00 0.00 1.18 0.00 0.00 52.55 56.41 1kfh s ASP 30 Cb -0.22 -2.57 0.00 0.00 -0.34 0.00 0.00 42.92 39.78 1kfh s ASP 30 CO 0.32 -0.45 0.00 0.00 0.68 0.00 0.00 175.17 175.72 1kfh n ALA 31 N -0.19 0.00 -3.57 2.11 0.00 -1.26 -1.49 120.51 116.12 1kfh n ALA 31 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.22 1kfh n ALA 31 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 1kfh n ALA 31 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1kfh n PHE 32 N 0.00 2.32 -0.31 0.00 7.35 -1.26 -5.00 117.46 120.57 1kfh n PHE 32 Ca 0.00 -4.02 0.28 0.00 -0.76 0.00 0.00 57.45 52.95 1kfh n PHE 32 Cb 0.00 -0.44 0.49 0.00 0.35 0.00 0.00 39.48 39.88 1kfh n PHE 32 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1kfh s SER 34 N -4.49 5.85 0.00 0.00 1.04 -1.26 -3.19 113.70 111.65 1kfh s SER 34 Ca -0.06 -1.74 0.00 0.00 0.48 0.00 0.00 55.95 54.63 1kfh s SER 34 Cb 0.25 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.79 1kfh s SER 34 CO 0.62 -2.18 0.00 -1.54 0.98 0.00 0.00 173.24 171.12 1kfh n SER 35 N 11.59 0.00 -0.96 7.02 3.41 -1.00 -5.03 113.62 128.64 1kfh n SER 35 Ca 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 1kfh n SER 35 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 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 3.57 0.00 4.33 5.12 0.21 -5.09 116.66 124.80 1kfh n ARG 36 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1kfh n ARG 36 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1kfh n ARG 36 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1kfh n GLY 37 N 4.39 3.76 3.48 -0.13 0.00 -1.23 -4.71 105.19 110.76 1kfh n GLY 37 Ca 0.00 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 1kfh n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kfh s LYS 38 N 1.36 3.47 -1.03 1.61 -0.14 -1.26 -1.49 119.74 122.26 1kfh s LYS 38 Ca 0.00 -0.56 -0.20 0.00 -1.36 0.00 0.00 55.97 53.85 1kfh s LYS 38 Cb 0.00 -2.80 0.09 0.00 -1.68 0.00 0.00 37.83 33.44 1kfh s LYS 38 CO 0.00 0.30 1.36 0.08 -0.76 0.00 0.00 175.35 176.33 1kfh s VAL 39 N 0.17 4.30 -0.49 3.17 1.01 0.11 -4.87 120.40 123.79 1kfh s VAL 39 Ca -0.03 -1.28 -0.28 0.00 0.00 0.00 0.00 61.98 60.40 1kfh s VAL 39 Cb -0.14 -4.96 0.03 0.00 0.00 0.00 0.00 36.38 31.31 1kfh s VAL 39 CO 0.03 -1.77 1.08 0.68 0.00 0.00 0.00 175.10 175.12 1kfh s VAL 40 N 3.88 4.26 -0.36 2.92 -7.23 -1.26 -1.53 120.40 121.08 1kfh s VAL 40 Ca 0.42 1.01 0.02 0.00 -1.81 0.00 0.00 61.98 61.62 1kfh s VAL 40 Cb -0.02 -4.58 0.10 0.00 0.56 0.00 0.00 36.38 32.45 1kfh s VAL 40 CO -0.08 -1.02 0.09 -0.70 -0.31 0.00 0.00 175.10 173.09 1kfh s GLU 41 N 4.32 1.66 -0.23 4.82 -6.30 0.16 -4.93 118.70 118.19 1kfh s GLU 41 Ca 0.44 -1.85 -0.12 0.00 -2.50 0.00 0.00 54.97 50.94 1kfh s GLU 41 Cb -0.08 -3.32 -0.05 0.00 0.00 0.00 0.00 34.13 30.68 1kfh s GLU 41 CO 0.29 -0.97 0.24 -0.51 0.02 0.00 0.00 175.26 174.33 1kfh s LEU 42 N 0.98 4.11 0.00 2.70 1.02 -1.26 -0.26 118.68 125.98 1kfh s LEU 42 Ca 0.10 0.23 0.00 0.00 0.02 0.00 0.00 54.13 54.48 1kfh s LEU 42 Cb -0.20 -2.24 0.00 0.00 0.02 0.00 0.00 46.19 43.76 1kfh s LEU 42 CO -0.07 -0.00 0.00 0.61 0.02 0.00 0.00 176.35 176.91 1kfh n GLY 43 N 4.27 2.01 3.13 -3.19 0.00 -0.91 -0.60 105.19 109.90 1kfh n GLY 43 Ca -0.13 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.50 -1.66 -1.22 0.00 0.00 0.11 -4.85 121.76 113.64 1kfh s ALA 45 Ca 0.05 0.73 0.16 0.00 0.00 0.00 0.00 51.96 52.91 1kfh s ALA 45 Cb -0.06 0.63 0.77 0.00 0.00 0.00 0.00 23.12 24.45 1kfh s ALA 45 CO 0.00 -0.67 1.50 0.00 0.00 0.00 0.00 175.76 176.59 1kfh n ALA 46 N -0.08 1.83 -3.58 0.00 0.00 -0.19 -0.35 120.51 118.13 1kfh n ALA 46 Ca -0.16 -0.07 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 1kfh n ALA 46 Cb 0.63 -1.27 -0.09 0.00 0.00 0.00 0.00 19.45 18.72 1kfh n ALA 46 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1kfh s THR 47 N -2.78 -0.64 -0.08 0.00 -1.32 -1.26 -4.72 115.64 104.84 1kfh s THR 47 Ca 0.12 0.12 0.15 0.00 -1.21 0.00 0.00 61.69 60.86 1kfh s THR 47 Cb 0.11 -0.70 -0.16 0.00 -1.51 0.00 0.00 72.50 70.25 1kfh s THR 47 CO 0.27 0.03 0.86 0.00 -2.21 0.00 0.00 174.62 173.57 1kfh s PRO 49 N -2.81 3.65 0.27 0.00 0.04 -1.26 -4.81 135.00 130.09 1kfh s PRO 49 Ca -0.03 0.09 -0.19 0.00 0.04 0.00 0.00 61.00 60.92 1kfh s PRO 49 Cb 0.08 -3.18 -0.09 0.00 0.04 0.00 0.00 34.50 31.36 1kfh s PRO 49 CO 0.81 0.72 0.76 -1.54 0.04 0.00 0.00 177.00 177.78 1kfh s SER 50 N -1.18 6.98 0.00 6.66 1.04 -1.26 -4.81 113.70 121.12 1kfh s SER 50 Ca 0.21 1.42 0.00 0.00 0.48 0.00 0.00 55.95 58.05 1kfh s SER 50 Cb -0.14 -2.42 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1kfh s SER 50 CO 0.10 -0.07 0.00 0.29 0.98 0.00 0.00 173.24 174.54 1kfh n LYS 51 N 0.28 0.00 -2.04 4.02 4.01 -1.26 -4.61 118.16 118.55 1kfh n LYS 51 Ca 0.00 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.39 1kfh n LYS 51 Cb 0.52 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 35.02 1kfh n LYS 51 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1kfh s LYS 52 N 0.00 4.29 -0.91 1.97 1.02 -1.26 -0.94 119.74 123.91 1kfh s LYS 52 Ca 0.00 2.28 -0.14 0.00 0.02 0.00 0.00 55.97 58.13 1kfh s LYS 52 Cb 0.00 -3.09 0.22 0.00 -0.52 0.00 0.00 37.83 34.43 1kfh s LYS 52 CO 0.00 -0.34 0.91 -1.25 -0.92 0.00 0.00 175.35 173.75 1kfh s PRO 53 N -0.93 3.73 0.00 -1.68 0.04 -1.26 -4.96 135.00 129.94 1kfh s PRO 53 Ca 0.55 -2.51 0.00 0.00 0.04 0.00 0.00 61.00 59.09 1kfh s PRO 53 Cb -0.41 -4.55 0.00 0.00 0.04 0.00 0.00 34.50 29.58 1kfh s PRO 53 CO 0.47 -1.37 0.13 2.48 0.04 0.00 0.00 177.00 178.75 1kfh n TYR 54 N 4.18 0.00 -4.40 0.56 0.18 -0.12 -5.14 117.16 112.43 1kfh n TYR 54 Ca 0.18 0.00 -0.25 0.00 1.88 0.00 0.00 57.90 59.71 1kfh n TYR 54 Cb 0.46 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.32 1kfh n TYR 54 CO 0.00 0.00 0.00 -2.00 -2.08 0.00 0.00 176.86 172.78 1kfh s GLU 55 N -0.72 1.78 -0.21 -3.48 2.12 -1.25 -4.12 118.70 112.81 1kfh s GLU 55 Ca 0.00 -1.54 0.02 0.00 0.36 0.00 0.00 54.97 53.81 1kfh s GLU 55 Cb 0.00 -1.92 0.03 0.00 0.26 0.00 0.00 34.13 32.50 1kfh s GLU 55 CO 0.00 0.38 -0.16 -1.21 -0.54 0.00 0.00 175.26 173.73 1kfh s GLU 56 N -3.09 2.72 -0.13 4.30 8.01 0.83 -4.82 118.70 126.51 1kfh s GLU 56 Ca 0.26 -1.02 0.02 0.00 0.01 0.00 0.00 54.97 54.24 1kfh s GLU 56 Cb -0.07 -2.70 0.00 0.00 -4.31 0.00 0.00 34.13 27.06 1kfh s GLU 56 CO 0.14 -0.35 -0.21 0.54 0.01 0.00 0.00 175.26 175.40 1kfh s VAL 57 N 1.22 2.25 -0.34 2.63 0.11 -1.26 -0.60 120.40 124.41 1kfh s VAL 57 Ca -0.00 -0.93 -0.07 0.00 -2.93 0.00 0.00 61.98 58.05 1kfh s VAL 57 Cb -0.16 -1.90 0.04 0.00 -1.53 0.00 0.00 36.38 32.83 1kfh s VAL 57 CO -0.10 0.54 0.11 0.42 -3.33 0.00 0.00 175.10 172.75 1kfh s THR 58 N 0.65 3.87 0.10 5.04 -4.23 -0.65 -4.98 115.64 115.44 1kfh s THR 58 Ca -0.10 -1.07 0.09 0.00 -1.18 0.00 0.00 61.69 59.43 1kfh s THR 58 Cb -0.16 -3.18 -0.03 0.00 1.34 0.00 0.00 72.50 70.47 1kfh s THR 58 CO 0.02 -0.16 -0.23 0.00 -0.54 0.00 0.00 174.62 173.70 1kfh n SER 61 N 1.22 5.14 -4.61 0.00 3.41 -1.26 0.44 113.62 117.97 1kfh n SER 61 Ca -0.16 -2.64 -0.26 0.00 -0.26 0.00 0.00 58.87 55.55 1kfh n SER 61 Cb 0.57 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.80 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 -2.21 2.35 0.19 6.66 -4.23 -1.26 -4.93 115.64 112.21 1kfh s THR 62 Ca 0.53 -2.04 -0.31 0.00 -1.18 0.00 0.00 61.69 58.69 1kfh s THR 62 Cb 0.36 -2.80 -0.09 0.00 1.34 0.00 0.00 72.50 71.32 1kfh s THR 62 CO 0.21 -0.15 1.42 -1.81 -0.54 0.00 0.00 174.62 173.75 1kfh s ASP 63 N -3.69 6.74 -1.15 3.99 1.01 -1.26 -2.72 116.67 119.59 1kfh s ASP 63 Ca 0.35 2.51 0.00 0.00 0.71 0.00 0.00 52.55 56.12 1kfh s ASP 63 Cb 0.03 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.35 1kfh s ASP 63 CO 0.18 -0.67 0.00 0.29 0.21 0.00 0.00 175.17 175.18 1kfh n LYS 64 N 3.09 -1.66 0.24 8.23 5.02 0.14 -4.89 118.16 128.33 1kfh n LYS 64 Ca 0.09 0.83 0.12 0.00 -2.02 0.00 0.00 58.31 57.32 1kfh n LYS 64 Cb 0.41 -5.14 0.54 0.00 -0.02 0.00 0.00 35.03 30.82 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 -3.36 5.62 -4.77 0.00 6.94 -1.26 -4.88 115.26 113.55 1kfh n ASN 66 Ca -0.00 -3.14 -0.40 0.00 -0.02 0.00 0.00 54.58 51.01 1kfh n ASN 66 Cb 0.38 -1.41 -0.03 0.00 -2.36 0.00 0.00 39.78 36.36 1kfh n ASN 66 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1kfh s PRO 67 N -0.73 4.40 0.06 -0.53 0.04 -1.26 -4.55 135.00 132.42 1kfh s PRO 67 Ca 0.35 2.05 -0.31 0.00 0.04 0.00 0.00 61.00 63.14 1kfh s PRO 67 Cb -0.00 -3.05 -0.07 0.00 0.04 0.00 0.00 34.50 31.42 1kfh s PRO 67 CO 0.01 -0.09 1.38 -1.58 0.04 0.00 0.00 177.00 176.76 1kfh s HIS 68 N -1.18 3.06 -1.29 0.56 2.46 -1.26 -4.95 115.29 112.69 1kfh s HIS 68 Ca 0.49 0.91 -0.17 0.00 0.47 0.00 0.00 55.06 56.75 1kfh s HIS 68 Cb -0.36 -3.65 0.01 0.00 -0.13 0.00 0.00 32.58 28.45 1kfh s HIS 68 CO 0.48 -2.34 1.99 -0.35 -2.47 0.00 0.00 174.74 172.05 1kfh n PRO 69 N 4.64 2.69 -2.70 2.88 -0.04 -1.26 -4.89 135.00 136.32 1kfh n PRO 69 Ca 0.12 -2.73 -0.43 0.00 -0.04 0.00 0.00 63.50 60.42 1kfh n PRO 69 Cb 0.43 -3.36 -0.01 0.00 -0.04 0.00 0.00 33.50 30.53 1kfh n PRO 69 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1kfh s LYS 70 N 4.09 3.88 -0.46 0.54 2.47 -1.26 -4.96 119.74 124.04 1kfh s LYS 70 Ca 0.53 -1.90 -0.26 0.00 -1.56 0.00 0.00 55.97 52.77 1kfh s LYS 70 Cb 0.09 -5.32 0.03 0.00 -1.46 0.00 0.00 37.83 31.17 1kfh s LYS 70 CO 0.02 -2.08 0.97 -1.14 0.16 0.00 0.00 175.35 173.28 1kfh s GLN 71 N 3.63 3.60 -0.15 4.03 -0.44 -1.26 -5.02 119.66 124.04 1kfh s GLN 71 Ca 0.47 0.28 -0.29 0.00 -2.50 0.00 0.00 55.36 53.32 1kfh s GLN 71 Cb 0.01 -3.91 -0.04 0.00 -1.64 0.00 0.00 33.01 27.42 1kfh s GLN 71 CO 0.00 -1.24 1.62 1.03 0.50 0.00 0.00 175.29 177.20 1kfh s ARG 72 N 3.88 3.97 0.00 1.67 3.00 -1.26 -4.91 118.95 125.31 1kfh s ARG 72 Ca 0.39 1.89 -0.03 0.00 0.00 0.00 0.00 55.73 57.99 1kfh s ARG 72 Cb -0.10 -4.00 -0.12 0.00 0.00 0.00 0.00 34.95 30.73 1kfh s ARG 72 CO 0.27 -1.08 2.45 -0.35 0.00 0.00 0.00 175.30 176.59 1kfh n PRO 73 N 7.38 1.29 0.00 3.54 -0.04 -1.26 -5.35 135.00 140.56 1kfh n PRO 73 Ca 0.18 -0.45 0.02 0.00 -0.04 0.00 0.00 63.50 63.21 1kfh n PRO 73 Cb 0.44 -1.53 0.13 0.00 -0.04 0.00 0.00 33.50 32.50 1kfh n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87