#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hc9 s VAL 2 N 0.00 3.72 0.12 9.51 1.01 -1.26 -0.95 120.40 132.55 1hc9 s VAL 2 Ca 0.00 -0.42 0.05 0.00 0.00 0.00 0.00 61.98 61.61 1hc9 s VAL 2 Cb 0.00 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1hc9 s VAL 2 CO 0.00 0.50 -0.12 0.00 0.00 0.00 0.00 175.10 175.47 1hc9 s HIS 4 N -2.41 3.14 -0.01 0.00 3.76 -1.26 -0.47 115.29 118.04 1hc9 s HIS 4 Ca 0.10 1.61 0.01 0.00 -0.15 0.00 0.00 55.06 56.63 1hc9 s HIS 4 Cb -0.03 -3.15 -0.00 0.00 1.11 0.00 0.00 32.58 30.51 1hc9 s HIS 4 CO 0.02 -0.81 -0.05 -0.08 -0.85 0.00 0.00 174.74 172.97 1hc9 s THR 5 N -1.73 0.41 -2.14 1.30 -1.32 0.13 -3.01 115.64 109.28 1hc9 s THR 5 Ca 0.61 -0.20 0.18 0.00 -1.21 0.00 0.00 61.69 61.07 1hc9 s THR 5 Cb -0.21 -0.36 0.44 0.00 -1.51 0.00 0.00 72.50 70.85 1hc9 s THR 5 CO 0.27 0.13 1.41 0.35 -2.21 0.00 0.00 174.62 174.56 1hc9 n THR 6 N 3.10 0.52 0.36 5.08 -2.24 -0.88 -3.35 114.28 116.87 1hc9 n THR 6 Ca -0.15 -0.59 0.14 0.00 -2.27 0.00 0.00 64.05 61.19 1hc9 n THR 6 Cb 0.57 0.44 0.48 0.00 -2.10 0.00 0.00 70.33 69.72 1hc9 n THR 6 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hc9 h ALA 7 N 4.03 1.00 -1.90 6.98 0.00 -1.95 -3.45 119.26 123.96 1hc9 h ALA 7 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1hc9 h ALA 7 Cb 0.66 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.36 1hc9 h ALA 7 CO 0.00 0.00 -0.57 0.95 0.00 0.00 0.00 179.25 179.63 1hc9 s THR 8 N -3.38 2.85 -0.15 0.00 -4.23 -1.25 -5.11 115.64 104.36 1hc9 s THR 8 Ca 0.05 -1.82 -0.03 0.00 -1.18 0.00 0.00 61.69 58.70 1hc9 s THR 8 Cb 0.09 -2.90 0.05 0.00 1.34 0.00 0.00 72.50 71.09 1hc9 s THR 8 CO 0.53 -0.19 0.06 -0.55 -0.54 0.00 0.00 174.62 173.93 1hc9 s SER 9 N -3.78 2.30 0.99 3.99 0.15 -1.26 -3.34 113.70 112.74 1hc9 s SER 9 Ca 0.36 -0.54 -0.13 0.00 0.70 0.00 0.00 55.95 56.34 1hc9 s SER 9 Cb -0.01 -0.37 0.18 0.00 -1.71 0.00 0.00 66.02 64.11 1hc9 s SER 9 CO 0.21 -0.31 1.12 -2.16 1.20 0.00 0.00 173.24 173.31 1hc9 s PRO 10 N 2.03 0.51 0.28 5.44 0.04 -1.26 -5.08 135.00 136.96 1hc9 s PRO 10 Ca 0.02 0.30 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 1hc9 s PRO 10 Cb -0.15 -1.76 -0.12 0.00 0.04 0.00 0.00 34.50 32.50 1hc9 s PRO 10 CO -0.07 -2.63 1.55 -0.89 0.04 0.00 0.00 177.00 174.99 1hc9 n ILE 11 N -4.07 0.99 -4.18 0.56 5.41 -1.21 -4.98 119.36 111.88 1hc9 n ILE 11 Ca 0.07 -0.25 -0.12 0.00 1.00 0.00 0.00 62.75 63.45 1hc9 n ILE 11 Cb 0.59 -1.84 -0.05 0.00 -0.71 0.00 0.00 39.64 37.63 1hc9 n ILE 11 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1hc9 n SER 12 N 2.19 -0.28 -4.66 4.38 2.88 -1.21 -4.96 113.62 111.95 1hc9 n SER 12 Ca 0.09 -2.33 -0.35 0.00 -1.33 0.00 0.00 58.87 54.96 1hc9 n SER 12 Cb 0.35 0.98 -0.10 0.00 -0.75 0.00 0.00 64.21 64.69 1hc9 n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1hc9 s ALA 13 N -2.81 3.22 0.11 -1.46 0.00 -1.26 -0.69 121.76 118.87 1hc9 s ALA 13 Ca 0.23 -0.83 0.07 0.00 0.00 0.00 0.00 51.96 51.43 1hc9 s ALA 13 Cb 0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.67 1hc9 s ALA 13 CO 0.16 0.59 -0.17 0.54 0.00 0.00 0.00 175.76 176.88 1hc9 s VAL 14 N -0.88 1.46 -0.22 0.00 0.11 0.38 -4.93 120.40 116.33 1hc9 s VAL 14 Ca 0.13 -1.61 -0.20 0.00 -2.93 0.00 0.00 61.98 57.37 1hc9 s VAL 14 Cb -0.11 -1.49 -0.02 0.00 -1.53 0.00 0.00 36.38 33.23 1hc9 s VAL 14 CO 0.02 -0.26 0.60 -0.89 -3.33 0.00 0.00 175.10 171.24 1hc9 s THR 15 N -1.67 5.03 0.61 5.04 2.01 -1.26 -0.78 115.64 124.61 1hc9 s THR 15 Ca 0.07 1.10 -0.16 0.00 0.31 0.00 0.00 61.69 63.00 1hc9 s THR 15 Cb -0.08 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 1hc9 s THR 15 CO 0.04 0.09 1.09 0.00 -0.69 0.00 0.00 174.62 175.15 1hc9 s PRO 17 N -3.89 1.70 0.35 0.00 0.02 -1.26 -4.60 135.00 127.33 1hc9 s PRO 17 Ca 0.67 1.75 -0.29 0.00 0.02 0.00 0.00 61.00 63.15 1hc9 s PRO 17 Cb -0.19 -1.78 -0.11 0.00 0.02 0.00 0.00 34.50 32.43 1hc9 s PRO 17 CO 0.36 -2.16 1.50 -1.25 -0.33 0.00 0.00 177.00 175.12 1hc9 s PRO 18 N -4.12 4.13 0.00 5.54 0.04 -1.26 -1.48 135.00 137.84 1hc9 s PRO 18 Ca 0.73 2.55 0.00 0.00 0.04 0.00 0.00 61.00 64.32 1hc9 s PRO 18 Cb -0.29 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1hc9 s PRO 18 CO 0.50 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 177.41 1hc9 n GLY 19 N 0.96 2.92 3.26 0.56 0.00 -1.26 -4.97 105.19 106.66 1hc9 n GLY 19 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1hc9 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hc9 s GLU 20 N -0.83 3.09 -0.19 1.61 2.02 -0.55 -4.49 118.70 119.36 1hc9 s GLU 20 Ca 0.00 -2.18 0.16 0.00 0.02 0.00 0.00 54.97 52.97 1hc9 s GLU 20 Cb 0.00 -4.19 0.63 0.00 0.10 0.00 0.00 34.13 30.67 1hc9 s GLU 20 CO 0.00 -1.26 1.54 0.09 0.02 0.00 0.00 175.26 175.64 1hc9 n ASN 21 N 4.35 4.51 -4.23 -0.19 3.02 -1.12 -4.41 115.26 117.18 1hc9 n ASN 21 Ca 0.03 -2.94 -0.18 0.00 -0.03 0.00 0.00 54.58 51.46 1hc9 n ASN 21 Cb 0.43 -0.58 -0.11 0.00 -0.61 0.00 0.00 39.78 38.90 1hc9 n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1hc9 s LEU 22 N -2.72 2.39 0.19 3.41 1.43 -0.84 -4.65 118.68 117.89 1hc9 s LEU 22 Ca 0.46 -0.79 0.07 0.00 -1.03 0.00 0.00 54.13 52.84 1hc9 s LEU 22 Cb 0.36 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 46.00 1hc9 s LEU 22 CO 0.12 -0.14 0.02 0.00 0.23 0.00 0.00 176.35 176.58 1hc9 s TYR 24 N -1.83 0.27 -0.07 0.00 -0.85 -0.48 -1.51 117.35 112.89 1hc9 s TYR 24 Ca 0.28 -0.62 0.00 0.00 -0.52 0.00 0.00 57.07 56.22 1hc9 s TYR 24 Cb -0.09 -0.20 0.02 0.00 0.38 0.00 0.00 41.96 42.08 1hc9 s TYR 24 CO 0.19 -0.33 -0.04 0.50 -1.52 0.00 0.00 175.55 174.35 1hc9 s ARG 25 N -2.62 0.97 -0.08 -3.49 3.52 0.74 -1.87 118.95 116.12 1hc9 s ARG 25 Ca -0.05 -0.10 0.05 0.00 -0.13 0.00 0.00 55.73 55.50 1hc9 s ARG 25 Cb -0.01 -1.06 -0.00 0.00 -1.56 0.00 0.00 34.95 32.32 1hc9 s ARG 25 CO -0.05 -0.16 -0.24 0.21 -0.81 0.00 0.00 175.30 174.25 1hc9 s LYS 26 N 1.31 2.83 0.01 5.12 2.20 0.61 -0.58 119.74 131.24 1hc9 s LYS 26 Ca -0.04 -0.87 0.02 0.00 -0.36 0.00 0.00 55.97 54.72 1hc9 s LYS 26 Cb -0.14 -2.22 -0.01 0.00 -1.51 0.00 0.00 37.83 33.95 1hc9 s LYS 26 CO -0.02 0.25 -0.07 -1.64 -0.36 0.00 0.00 175.35 173.50 1hc9 s MET 27 N 0.17 0.55 0.16 4.03 -1.94 0.11 -0.67 119.30 121.71 1hc9 s MET 27 Ca -0.13 -0.36 -0.22 0.00 -1.71 0.00 0.00 55.69 53.26 1hc9 s MET 27 Cb -0.16 -0.49 0.06 0.00 2.01 0.00 0.00 34.83 36.25 1hc9 s MET 27 CO 0.07 0.13 0.58 1.67 -0.01 0.00 0.00 175.02 177.45 1hc9 s TRP 28 N -0.42 -0.47 0.05 -0.03 -2.14 -1.06 -0.19 118.94 114.68 1hc9 s TRP 28 Ca 0.00 0.23 -0.21 0.00 2.66 0.00 0.00 56.10 58.78 1hc9 s TRP 28 Cb -0.04 0.52 -0.06 0.00 -3.10 0.00 0.00 33.47 30.79 1hc9 s TRP 28 CO -0.00 -0.85 0.64 0.00 -2.66 0.00 0.00 176.95 174.08 1hc9 n ASP 30 N 2.23 1.99 0.15 0.00 5.75 -1.26 -4.96 116.55 120.45 1hc9 n ASP 30 Ca -0.07 -0.46 0.13 0.00 -0.01 0.00 0.00 54.79 54.38 1hc9 n ASP 30 Cb 0.50 0.00 0.66 0.00 -1.03 0.00 0.00 41.12 41.25 1hc9 n ASP 30 CO 0.00 0.00 0.00 -0.37 -0.11 0.00 0.00 177.20 176.72 1hc9 h VAL 31 N 0.46 0.89 -0.34 2.12 -1.51 -1.98 -2.45 116.25 113.44 1hc9 h VAL 31 Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1hc9 h VAL 31 Cb 0.00 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 30.04 1hc9 h VAL 31 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.83 1hc9 n PHE 32 N -4.47 0.57 -0.30 5.19 3.01 -1.26 -4.53 117.46 115.67 1hc9 n PHE 32 Ca 0.02 -0.26 0.06 0.00 1.01 0.00 0.00 57.45 58.28 1hc9 n PHE 32 Cb 0.31 -0.05 0.21 0.00 -0.01 0.00 0.00 39.48 39.93 1hc9 n PHE 32 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1hc9 h SER 34 N 0.73 0.39 0.00 0.00 4.64 -1.86 -0.51 113.55 116.95 1hc9 h SER 34 Ca 0.44 -0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.44 1hc9 h SER 34 Cb 0.53 -0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 62.47 1hc9 h SER 34 CO -0.31 0.27 -2.20 -1.54 -0.87 0.00 0.00 176.83 172.19 1hc9 n SER 35 N -4.48 2.22 -0.00 4.97 3.41 -0.85 -4.68 113.62 114.20 1hc9 n SER 35 Ca 0.05 -0.10 0.10 0.00 -0.26 0.00 0.00 58.87 58.65 1hc9 n SER 35 Cb 0.16 -0.21 -0.12 0.00 -0.26 0.00 0.00 64.21 63.78 1hc9 n SER 35 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1hc9 n ARG 36 N -3.07 0.11 0.00 4.33 1.74 0.03 -5.10 116.66 114.71 1hc9 n ARG 36 Ca -0.36 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.71 1hc9 n ARG 36 Cb 0.91 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.86 1hc9 n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hc9 n GLY 37 N 1.49 -2.22 3.80 -0.13 0.00 -0.20 -4.94 105.19 102.99 1hc9 n GLY 37 Ca 0.04 -1.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.10 1hc9 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hc9 s LYS 38 N -0.26 3.58 0.48 1.61 1.02 -1.26 -4.10 119.74 120.80 1hc9 s LYS 38 Ca 0.00 1.26 -0.23 0.00 0.02 0.00 0.00 55.97 57.02 1hc9 s LYS 38 Cb 0.00 -2.07 -0.07 0.00 -0.52 0.00 0.00 37.83 35.18 1hc9 s LYS 38 CO 0.00 -0.60 1.23 0.08 -0.92 0.00 0.00 175.35 175.14 1hc9 s VAL 39 N -2.24 2.76 -0.11 3.17 1.01 0.15 -4.81 120.40 120.33 1hc9 s VAL 39 Ca 0.65 0.59 0.02 0.00 0.00 0.00 0.00 61.98 63.24 1hc9 s VAL 39 Cb -0.16 -3.30 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1hc9 s VAL 39 CO 0.29 0.00 -0.18 -0.69 0.00 0.00 0.00 175.10 174.52 1hc9 s VAL 40 N -1.44 1.67 -0.06 2.92 1.01 -1.26 -2.57 120.40 120.67 1hc9 s VAL 40 Ca 0.65 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.90 1hc9 s VAL 40 Cb -0.33 -1.50 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1hc9 s VAL 40 CO 0.40 0.48 -0.16 -0.70 0.00 0.00 0.00 175.10 175.11 1hc9 s GLU 41 N 0.82 1.90 -0.03 2.72 2.12 0.15 -4.95 118.70 121.43 1hc9 s GLU 41 Ca -0.09 -0.57 0.03 0.00 0.36 0.00 0.00 54.97 54.70 1hc9 s GLU 41 Cb -0.16 -1.58 0.00 0.00 0.26 0.00 0.00 34.13 32.65 1hc9 s GLU 41 CO 0.00 0.16 -0.11 -0.51 -0.54 0.00 0.00 175.26 174.26 1hc9 s LEU 42 N 0.30 1.85 0.00 2.70 1.43 -1.26 -0.28 118.68 123.41 1hc9 s LEU 42 Ca -0.10 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 1hc9 s LEU 42 Cb -0.14 -0.65 0.00 0.00 0.03 0.00 0.00 46.19 45.44 1hc9 s LEU 42 CO 0.04 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.32 1hc9 n GLY 43 N 3.19 1.95 3.87 -3.19 0.00 -0.78 -2.07 105.19 108.15 1hc9 n GLY 43 Ca -0.18 -0.70 -0.24 0.00 0.00 0.00 0.00 46.02 44.90 1hc9 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hc9 s ALA 45 N -1.92 -1.79 -0.21 0.00 0.00 -0.71 -4.83 121.76 112.31 1hc9 s ALA 45 Ca 0.33 1.39 -0.08 0.00 0.00 0.00 0.00 51.96 53.60 1hc9 s ALA 45 Cb -0.09 -0.16 -0.19 0.00 0.00 0.00 0.00 23.12 22.68 1hc9 s ALA 45 CO 0.26 -0.36 0.01 0.00 0.00 0.00 0.00 175.76 175.67 1hc9 n ALA 46 N 0.98 1.11 -2.86 0.00 0.00 -1.26 -1.99 120.51 116.48 1hc9 n ALA 46 Ca -0.18 -0.84 -0.30 0.00 0.00 0.00 0.00 53.44 52.13 1hc9 n ALA 46 Cb 0.57 -0.32 -0.16 0.00 0.00 0.00 0.00 19.45 19.53 1hc9 n ALA 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1hc9 s THR 47 N -2.51 1.84 0.31 0.00 2.01 -1.26 -4.65 115.64 111.38 1hc9 s THR 47 Ca -0.31 -0.94 -0.30 0.00 0.31 0.00 0.00 61.69 60.46 1hc9 s THR 47 Cb 0.09 -1.57 -0.12 0.00 0.01 0.00 0.00 72.50 70.91 1hc9 s THR 47 CO 0.63 0.52 1.54 0.00 -0.69 0.00 0.00 174.62 176.62 1hc9 n PRO 49 N 1.64 2.50 -1.62 0.00 -0.02 -1.26 -4.89 135.00 131.34 1hc9 n PRO 49 Ca 0.07 0.90 -0.42 0.00 -2.02 0.00 0.00 63.50 62.03 1hc9 n PRO 49 Cb 0.37 -2.72 0.01 0.00 -0.02 0.00 0.00 33.50 31.13 1hc9 n PRO 49 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1hc9 n SER 50 N 4.00 1.49 -4.63 2.55 3.41 -1.26 -4.89 113.62 114.29 1hc9 n SER 50 Ca 0.17 1.07 -0.43 0.00 -0.26 0.00 0.00 58.87 59.42 1hc9 n SER 50 Cb 0.32 -1.37 -0.02 0.00 -0.26 0.00 0.00 64.21 62.88 1hc9 n SER 50 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1hc9 s LYS 51 N -1.99 3.84 -0.10 4.33 2.47 -1.26 -5.02 119.74 122.02 1hc9 s LYS 51 Ca 0.62 1.37 -0.06 0.00 -1.56 0.00 0.00 55.97 56.34 1hc9 s LYS 51 Cb -0.57 -3.95 -0.04 0.00 -1.46 0.00 0.00 37.83 31.82 1hc9 s LYS 51 CO 0.57 -1.22 0.14 0.15 0.16 0.00 0.00 175.35 175.15 1hc9 s LYS 52 N 4.42 3.40 0.15 4.03 1.02 -1.26 -5.04 119.74 126.46 1hc9 s LYS 52 Ca 0.62 -0.19 -0.19 0.00 0.02 0.00 0.00 55.97 56.24 1hc9 s LYS 52 Cb -0.19 -3.14 0.07 0.00 -0.52 0.00 0.00 37.83 34.05 1hc9 s LYS 52 CO 0.26 0.76 1.22 -2.30 -0.92 0.00 0.00 175.35 174.36 1hc9 n PRO 53 N 1.81 -0.26 -1.68 -1.68 -0.02 -1.26 -1.74 135.00 130.17 1hc9 n PRO 53 Ca -0.18 1.20 -0.33 0.00 -2.02 0.00 0.00 63.50 62.16 1hc9 n PRO 53 Cb 0.54 -1.77 0.05 0.00 -0.02 0.00 0.00 33.50 32.31 1hc9 n PRO 53 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1hc9 n TYR 54 N -5.07 3.10 -3.86 6.00 4.01 -1.26 -4.93 117.16 115.14 1hc9 n TYR 54 Ca 0.05 -2.73 -0.12 0.00 -0.16 0.00 0.00 57.90 54.94 1hc9 n TYR 54 Cb 0.26 -1.06 -0.12 0.00 -0.31 0.00 0.00 39.34 38.11 1hc9 n TYR 54 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1hc9 s GLU 55 N -3.81 0.24 -0.11 -0.72 2.12 -0.71 -4.56 118.70 111.14 1hc9 s GLU 55 Ca 0.58 -0.09 -0.02 0.00 0.36 0.00 0.00 54.97 55.80 1hc9 s GLU 55 Cb 0.47 0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.93 1hc9 s GLU 55 CO -0.10 -0.04 -0.02 -1.21 -0.54 0.00 0.00 175.26 173.35 1hc9 s GLU 56 N -0.50 3.26 -0.03 4.30 0.41 0.73 -4.47 118.70 122.41 1hc9 s GLU 56 Ca -0.06 -0.47 0.01 0.00 -0.41 0.00 0.00 54.97 54.04 1hc9 s GLU 56 Cb -0.04 -2.83 0.01 0.00 -1.78 0.00 0.00 34.13 29.50 1hc9 s GLU 56 CO 0.00 0.50 -0.04 0.08 -0.49 0.00 0.00 175.26 175.31 1hc9 s VAL 57 N -0.33 0.43 -0.05 2.63 1.01 -1.26 -0.72 120.40 122.11 1hc9 s VAL 57 Ca 0.06 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 61.95 1hc9 s VAL 57 Cb -0.12 -0.43 0.00 0.00 0.00 0.00 0.00 36.38 35.83 1hc9 s VAL 57 CO 0.02 0.17 -0.16 -0.89 0.00 0.00 0.00 175.10 174.25 1hc9 s THR 58 N 0.54 1.35 0.03 3.92 2.01 0.25 -4.99 115.64 118.75 1hc9 s THR 58 Ca -0.06 -0.65 0.05 0.00 0.31 0.00 0.00 61.69 61.33 1hc9 s THR 58 Cb -0.10 -1.18 -0.02 0.00 0.01 0.00 0.00 72.50 71.22 1hc9 s THR 58 CO -0.00 0.39 -0.15 0.00 -0.69 0.00 0.00 174.62 174.18 1hc9 n SER 61 N -0.32 1.75 -4.42 0.00 3.41 -1.26 -0.53 113.62 112.24 1hc9 n SER 61 Ca -0.03 -3.08 -0.28 0.00 -0.26 0.00 0.00 58.87 55.21 1hc9 n SER 61 Cb 0.63 -0.42 -0.12 0.00 -0.26 0.00 0.00 64.21 64.04 1hc9 n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1hc9 s THR 62 N -2.37 2.41 0.11 6.66 -4.23 -1.26 -4.96 115.64 112.00 1hc9 s THR 62 Ca 0.29 -1.80 -0.36 0.00 -1.18 0.00 0.00 61.69 58.65 1hc9 s THR 62 Cb 0.27 -2.11 -0.16 0.00 1.34 0.00 0.00 72.50 71.85 1hc9 s THR 62 CO -0.02 0.02 1.33 0.47 -0.54 0.00 0.00 174.62 175.89 1hc9 n ASP 63 N 0.67 1.71 -3.39 3.99 8.00 -1.26 -1.99 116.55 124.28 1hc9 n ASP 63 Ca -0.16 1.12 -0.24 0.00 0.71 0.00 0.00 54.79 56.22 1hc9 n ASP 63 Cb 0.54 -1.21 0.01 0.00 -0.02 0.00 0.00 41.12 40.44 1hc9 n ASP 63 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hc9 n LYS 64 N 2.45 -4.21 0.00 -1.24 5.02 0.13 -4.19 118.16 116.13 1hc9 n LYS 64 Ca 0.18 0.61 0.15 0.00 -2.02 0.00 0.00 58.31 57.22 1hc9 n LYS 64 Cb 0.21 -5.39 0.71 0.00 -0.02 0.00 0.00 35.03 30.54 1hc9 n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hc9 n ASN 66 N -1.01 5.34 -4.75 0.00 6.94 -1.26 -4.93 115.26 115.59 1hc9 n ASN 66 Ca 0.16 -3.71 -0.30 0.00 -0.02 0.00 0.00 54.58 50.71 1hc9 n ASN 66 Cb 0.24 -0.69 0.12 0.00 -2.36 0.00 0.00 39.78 37.09 1hc9 n ASN 66 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 1hc9 s PRO 67 N -3.70 1.56 0.47 -0.53 0.04 -1.26 -4.53 135.00 127.05 1hc9 s PRO 67 Ca 0.47 0.74 -0.23 0.00 0.04 0.00 0.00 61.00 62.03 1hc9 s PRO 67 Cb 0.31 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.93 1hc9 s PRO 67 CO -0.18 -2.01 1.20 -1.58 0.04 0.00 0.00 177.00 174.47 1hc9 s HIS 68 N -3.02 2.77 0.55 0.56 5.65 -1.26 -4.87 115.29 115.67 1hc9 s HIS 68 Ca 0.62 1.50 0.39 0.00 0.25 0.00 0.00 55.06 57.82 1hc9 s HIS 68 Cb -0.17 -3.46 1.57 0.00 -1.18 0.00 0.00 32.58 29.34 1hc9 s HIS 68 CO 0.56 -1.77 1.76 -1.35 -0.65 0.00 0.00 174.74 173.29 1hc9 h PRO 69 N 1.98 0.00 -0.09 2.88 0.11 -2.02 0.35 132.00 135.21 1hc9 h PRO 69 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1hc9 h PRO 69 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1hc9 h PRO 69 CO 0.60 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.02 1hc9 n LYS 70 N -4.10 1.31 -4.22 1.05 4.76 -1.26 -4.85 118.16 110.84 1hc9 n LYS 70 Ca 0.28 -0.46 -0.18 0.00 -2.87 0.00 0.00 58.31 55.08 1hc9 n LYS 70 Cb 1.36 -1.27 -0.11 0.00 -1.84 0.00 0.00 35.03 33.17 1hc9 n LYS 70 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1hc9 s GLN 71 N -1.88 0.96 0.35 1.97 -0.21 0.12 -5.15 119.66 115.82 1hc9 s GLN 71 Ca 0.24 -1.17 -0.11 0.00 0.02 0.00 0.00 55.36 54.34 1hc9 s GLN 71 Cb 0.12 -0.84 -0.07 0.00 1.00 0.00 0.00 33.01 33.21 1hc9 s GLN 71 CO 0.18 0.16 0.72 -0.98 -2.12 0.00 0.00 175.29 173.26 1hc9 s ARG 72 N -2.48 3.84 0.75 2.91 3.03 -1.26 -4.60 118.95 121.14 1hc9 s ARG 72 Ca 0.06 0.48 -0.11 0.00 2.03 0.00 0.00 55.73 58.20 1hc9 s ARG 72 Cb -0.06 -2.44 0.04 0.00 -1.03 0.00 0.00 34.95 31.46 1hc9 s ARG 72 CO 0.02 0.07 1.08 -2.14 -1.13 0.00 0.00 175.30 173.21 1hc9 s PRO 73 N -3.46 2.47 0.00 3.89 0.02 -1.26 -4.85 135.00 131.81 1hc9 s PRO 73 Ca 0.51 1.05 0.00 0.00 0.02 0.00 0.00 61.00 62.59 1hc9 s PRO 73 Cb -0.10 -1.93 0.00 0.00 0.02 0.00 0.00 34.50 32.49 1hc9 s PRO 73 CO 0.26 -1.46 0.00 0.41 -0.33 0.00 0.00 177.00 175.88