#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hcq s GLU 3 N 0.00 3.69 -0.36 0.00 8.01 -1.26 -4.98 118.70 123.80 1hcq s GLU 3 Ca 0.00 1.55 -0.22 0.00 0.01 0.00 0.00 54.97 56.31 1hcq s GLU 3 Cb 0.00 -2.19 0.01 0.00 -4.31 0.00 0.00 34.13 27.64 1hcq s GLU 3 CO 0.00 -0.56 0.74 0.99 0.01 0.00 0.00 175.26 176.44 1hcq s THR 4 N -1.77 4.79 0.10 3.63 2.01 -1.26 -5.02 115.64 118.11 1hcq s THR 4 Ca 0.67 0.81 0.03 0.00 0.31 0.00 0.00 61.69 63.51 1hcq s THR 4 Cb -0.22 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 1hcq s THR 4 CO 0.26 -0.38 -0.09 -0.13 -0.69 0.00 0.00 174.62 173.59 1hcq s ARG 5 N 2.97 0.85 -0.09 4.92 0.52 -1.26 -5.09 118.95 121.76 1hcq s ARG 5 Ca 0.29 -1.23 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 1hcq s ARG 5 Cb -0.14 -0.42 -0.03 0.00 0.52 0.00 0.00 34.95 34.88 1hcq s ARG 5 CO 0.16 0.05 -0.02 0.71 0.02 0.00 0.00 175.30 176.22 1hcq s TYR 6 N -2.88 3.10 0.19 -0.53 2.02 -1.26 -0.68 117.35 117.30 1hcq s TYR 6 Ca 0.08 0.11 -0.33 0.00 -0.37 0.00 0.00 57.07 56.56 1hcq s TYR 6 Cb 0.00 -1.79 -0.14 0.00 -0.40 0.00 0.00 41.96 39.63 1hcq s TYR 6 CO -0.01 0.39 1.51 0.00 -1.57 0.00 0.00 175.55 175.86 1hcq h ALA 8 N 5.23 1.00 0.00 0.00 0.00 -1.73 -1.41 119.26 122.35 1hcq h ALA 8 Ca -0.45 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.22 1hcq h ALA 8 Cb 1.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 1hcq h ALA 8 CO 0.83 0.00 -1.45 0.28 0.00 0.00 0.00 179.25 178.92 1hcq n VAL 9 N -3.09 1.51 0.56 0.00 0.31 -1.26 -4.71 118.33 111.65 1hcq n VAL 9 Ca 0.02 -0.07 0.06 0.00 -0.01 0.00 0.00 64.34 64.35 1hcq n VAL 9 Cb 0.38 -2.08 0.01 0.00 -0.91 0.00 0.00 33.84 31.24 1hcq n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hcq n ASN 11 N -0.05 -0.72 -4.91 0.00 4.13 -0.53 -2.00 115.26 111.18 1hcq n ASN 11 Ca 0.06 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 56.05 1hcq n ASN 11 Cb 0.28 -0.19 -0.01 0.00 -1.54 0.00 0.00 39.78 38.32 1hcq n ASN 11 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1hcq s ASP 12 N -2.75 6.29 -0.34 6.41 2.15 -1.26 -4.58 116.67 122.59 1hcq s ASP 12 Ca 0.00 0.86 -0.39 0.00 0.43 0.00 0.00 52.55 53.46 1hcq s ASP 12 Cb 0.00 -2.22 -0.14 0.00 -0.30 0.00 0.00 42.92 40.26 1hcq s ASP 12 CO 0.00 -0.52 1.97 -1.22 -0.17 0.00 0.00 175.17 175.23 1hcq n TYR 13 N -2.10 1.76 -1.22 -5.34 4.01 -1.26 0.30 117.16 113.31 1hcq n TYR 13 Ca -0.00 0.47 -0.33 0.00 -0.16 0.00 0.00 57.90 57.87 1hcq n TYR 13 Cb 0.55 -2.46 0.11 0.00 -0.31 0.00 0.00 39.34 37.23 1hcq n TYR 13 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1hcq s ALA 14 N 5.33 1.94 -0.08 -0.72 0.00 0.14 -4.55 121.76 123.82 1hcq s ALA 14 Ca 1.06 0.81 0.17 0.00 0.00 0.00 0.00 51.96 54.00 1hcq s ALA 14 Cb -1.05 -3.47 -0.26 0.00 0.00 0.00 0.00 23.12 18.34 1hcq s ALA 14 CO 0.60 -2.13 0.26 -1.13 0.00 0.00 0.00 175.76 173.36 1hcq n SER 15 N -3.14 0.79 -0.68 0.00 3.41 0.30 -4.82 113.62 109.47 1hcq n SER 15 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1hcq n SER 15 Cb 0.51 1.47 0.00 0.00 -0.26 0.00 0.00 64.21 65.92 1hcq n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hcq n GLY 16 N 1.66 0.69 3.22 5.00 0.00 -1.02 -5.01 105.19 109.73 1hcq n GLY 16 Ca -0.13 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 1hcq n GLY 16 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1hcq s TYR 17 N -2.57 3.35 -0.03 1.61 5.04 -1.26 -1.12 117.35 122.37 1hcq s TYR 17 Ca 0.00 -1.73 0.06 0.00 -2.44 0.00 0.00 57.07 52.96 1hcq s TYR 17 Cb 0.00 -2.68 -0.01 0.00 0.35 0.00 0.00 41.96 39.62 1hcq s TYR 17 CO 0.00 -0.83 -0.23 -1.01 -1.34 0.00 0.00 175.55 172.14 1hcq s HIS 18 N 1.33 2.13 -1.62 4.97 3.76 0.14 -4.72 115.29 121.27 1hcq s HIS 18 Ca 0.01 -0.51 -0.18 0.00 -0.15 0.00 0.00 55.06 54.23 1hcq s HIS 18 Cb -0.21 -1.39 0.16 0.00 1.11 0.00 0.00 32.58 32.24 1hcq s HIS 18 CO 0.01 -0.12 0.69 0.66 -0.85 0.00 0.00 174.74 175.13 1hcq n TYR 19 N 2.75 -1.66 -0.52 1.40 4.01 -1.26 -0.84 117.16 121.05 1hcq n TYR 19 Ca -0.17 0.71 0.00 0.00 -0.16 0.00 0.00 57.90 58.28 1hcq n TYR 19 Cb 0.52 -2.67 0.00 0.00 -0.31 0.00 0.00 39.34 36.88 1hcq n TYR 19 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hcq n GLY 20 N -1.26 0.75 3.60 2.72 0.00 -1.26 -0.82 105.19 108.92 1hcq n GLY 20 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1hcq n GLY 20 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hcq s VAL 21 N -2.51 0.01 0.21 1.61 -7.23 -0.02 -4.84 120.40 107.63 1hcq s VAL 21 Ca 0.00 -1.27 -0.30 0.00 -1.81 0.00 0.00 61.98 58.60 1hcq s VAL 21 Cb 0.00 -2.08 -0.08 0.00 0.56 0.00 0.00 36.38 34.78 1hcq s VAL 21 CO 0.00 -0.03 1.04 0.26 -0.31 0.00 0.00 175.10 176.06 1hcq s TRP 22 N -3.98 3.73 0.08 2.82 0.52 -1.26 0.23 118.94 121.07 1hcq s TRP 22 Ca 0.19 1.74 -0.27 0.00 0.02 0.00 0.00 56.10 57.78 1hcq s TRP 22 Cb -0.01 -3.17 0.08 0.00 -1.15 0.00 0.00 33.47 29.22 1hcq s TRP 22 CO 0.07 -0.19 1.04 -1.54 0.02 0.00 0.00 176.95 176.34 1hcq s SER 23 N -0.57 -0.17 0.65 2.95 1.04 -0.27 -2.12 113.70 115.21 1hcq s SER 23 Ca 0.46 -0.27 -0.09 0.00 0.48 0.00 0.00 55.95 56.52 1hcq s SER 23 Cb -0.28 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.23 1hcq s SER 23 CO 0.35 -0.70 1.02 0.00 0.98 0.00 0.00 173.24 174.89 1hcq h GLU 25 N -0.45 0.56 0.15 0.00 4.39 -1.95 -1.01 114.58 116.27 1hcq h GLU 25 Ca -0.45 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.21 1hcq h GLU 25 Cb 1.25 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.76 1hcq h GLU 25 CO 0.63 0.37 -0.22 0.78 -1.16 0.00 0.00 179.01 179.40 1hcq h GLY 26 N 0.57 -1.05 2.00 -3.84 0.00 -1.99 0.64 103.07 99.41 1hcq h GLY 26 Ca 0.21 0.49 0.00 0.00 0.00 0.00 0.00 47.33 48.03 1hcq h GLY 26 CO -0.11 -0.34 0.00 0.00 0.00 0.00 0.00 176.54 176.09 1hcq h LYS 28 N 0.00 0.28 -0.68 0.00 3.64 0.21 -1.75 116.57 118.26 1hcq h LYS 28 Ca 0.00 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.20 1hcq h LYS 28 Cb 0.06 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1hcq h LYS 28 CO 0.00 0.69 0.31 0.00 -2.27 0.00 0.00 179.45 178.18 1hcq h ALA 29 N 0.58 0.88 -0.09 5.00 0.00 0.20 -1.84 119.26 123.99 1hcq h ALA 29 Ca 0.02 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.80 1hcq h ALA 29 Cb 0.65 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 1hcq h ALA 29 CO 0.03 0.46 -0.54 0.35 0.00 0.00 0.00 179.25 179.55 1hcq h PHE 30 N 0.95 -1.59 -0.79 0.00 3.57 -1.12 -1.70 116.94 116.25 1hcq h PHE 30 Ca 0.23 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 1hcq h PHE 30 Cb 0.15 0.71 -0.04 0.00 2.79 0.00 0.00 35.95 39.56 1hcq h PHE 30 CO 0.01 -0.56 0.35 0.35 -2.23 0.00 0.00 178.31 176.23 1hcq h PHE 31 N -0.61 1.17 -0.34 0.41 3.57 -1.16 -2.61 116.94 117.38 1hcq h PHE 31 Ca 0.03 -0.07 0.07 0.00 3.53 0.00 0.00 57.97 61.53 1hcq h PHE 31 Cb 0.70 -0.36 -0.07 0.00 2.79 0.00 0.00 35.95 39.00 1hcq h PHE 31 CO -0.56 0.87 -0.16 -0.22 -2.23 0.00 0.00 178.31 176.01 1hcq h LYS 32 N 1.14 -0.10 0.20 1.11 3.64 -0.74 -2.05 116.57 119.77 1hcq h LYS 32 Ca 0.27 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.67 1hcq h LYS 32 Cb 0.16 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 1hcq h LYS 32 CO -0.03 -0.07 -0.32 0.00 -2.27 0.00 0.00 179.45 176.76 1hcq h ARG 33 N -0.10 -0.58 -0.93 1.90 3.08 -1.07 -1.94 114.38 114.73 1hcq h ARG 33 Ca 0.17 0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.42 1hcq h ARG 33 Cb 0.36 0.13 -0.10 0.00 0.08 0.00 0.00 29.97 30.45 1hcq h ARG 33 CO -0.40 -0.38 0.53 0.77 -1.07 0.00 0.00 179.97 179.41 1hcq h SER 34 N -0.60 0.67 1.03 7.04 0.02 -1.07 0.34 113.55 120.99 1hcq h SER 34 Ca 0.01 0.09 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 1hcq h SER 34 Cb 0.59 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 1hcq h SER 34 CO -0.14 0.27 -0.59 0.16 -1.14 0.00 0.00 176.83 175.38 1hcq h ILE 35 N 0.71 1.16 0.00 3.27 3.07 -1.31 -2.91 117.51 121.50 1hcq h ILE 35 Ca 0.52 -2.25 0.00 0.00 1.55 0.00 0.00 64.86 64.68 1hcq h ILE 35 Cb 0.74 2.31 0.00 0.00 -0.27 0.00 0.00 36.82 39.61 1hcq h ILE 35 CO -0.36 0.58 0.00 1.67 -1.05 0.00 0.00 178.15 178.99 1hcq n GLN 36 N -3.45 0.68 0.00 0.16 7.27 0.11 -5.13 117.38 117.02 1hcq n GLN 36 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.08 1hcq n GLN 36 Cb 0.69 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.84 1hcq n GLN 36 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1hcq n GLY 37 N 0.98 3.71 0.00 1.69 0.00 -0.26 -5.03 105.19 106.28 1hcq n GLY 37 Ca 0.18 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1hcq n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1hcq n ASP 40 N 0.00 0.00 -4.99 1.61 5.75 -1.26 -4.41 116.55 113.25 1hcq n ASP 40 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 54.79 54.59 1hcq n ASP 40 Cb 0.00 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1hcq n ASP 40 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1hcq s TYR 41 N 0.00 3.11 -0.09 2.11 2.02 -1.26 -5.12 117.35 118.12 1hcq s TYR 41 Ca 0.00 -0.20 -0.02 0.00 -0.37 0.00 0.00 57.07 56.48 1hcq s TYR 41 Cb 0.00 -2.04 0.03 0.00 -0.40 0.00 0.00 41.96 39.56 1hcq s TYR 41 CO 0.00 -0.06 0.02 -1.64 -1.57 0.00 0.00 175.55 172.30 1hcq s MET 42 N -4.21 0.48 0.15 -0.62 -1.94 -1.26 -4.92 119.30 106.97 1hcq s MET 42 Ca 0.46 0.08 -0.31 0.00 -1.71 0.00 0.00 55.69 54.21 1hcq s MET 42 Cb -0.10 -1.07 -0.08 0.00 2.01 0.00 0.00 34.83 35.59 1hcq s MET 42 CO 0.32 -0.36 1.31 0.00 -0.01 0.00 0.00 175.02 176.27 1hcq n PRO 44 N 3.27 0.67 0.00 0.00 -0.04 -1.26 -4.84 135.00 132.80 1hcq n PRO 44 Ca 0.08 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1hcq n PRO 44 Cb 0.43 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1hcq n PRO 44 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hcq n ALA 45 N -1.06 0.00 -0.88 0.55 0.00 -1.26 -5.06 120.51 112.79 1hcq n ALA 45 Ca 0.17 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.69 1hcq n ALA 45 Cb 0.11 0.00 0.33 0.00 0.00 0.00 0.00 19.45 19.89 1hcq n ALA 45 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1hcq n THR 46 N 0.00 2.40 -2.57 0.00 -2.24 -1.26 -4.89 114.28 105.72 1hcq n THR 46 Ca 0.00 -1.57 -0.20 0.00 -2.27 0.00 0.00 64.05 60.02 1hcq n THR 46 Cb 0.00 -0.19 0.01 0.00 -2.10 0.00 0.00 70.33 68.04 1hcq n THR 46 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1hcq n ASN 47 N 0.20 -5.60 -1.70 3.42 3.02 -1.26 -4.83 115.26 108.50 1hcq n ASN 47 Ca 0.24 -0.10 0.01 0.00 -0.03 0.00 0.00 54.58 54.70 1hcq n ASN 47 Cb 1.01 -4.57 0.06 0.00 -0.61 0.00 0.00 39.78 35.67 1hcq n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1hcq n GLN 48 N -3.16 1.05 -1.37 3.52 6.02 -1.26 -5.01 117.38 117.17 1hcq n GLN 48 Ca -0.19 -2.81 -0.30 0.00 -0.01 0.00 0.00 57.00 53.69 1hcq n GLN 48 Cb 0.65 -0.90 0.10 0.00 1.02 0.00 0.00 30.24 31.11 1hcq n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hcq s THR 50 N -3.01 4.69 -0.36 0.00 2.01 -1.26 -4.98 115.64 112.72 1hcq s THR 50 Ca 0.61 1.46 -0.02 0.00 0.31 0.00 0.00 61.69 64.06 1hcq s THR 50 Cb -0.16 -4.03 0.09 0.00 0.01 0.00 0.00 72.50 68.41 1hcq s THR 50 CO 0.56 0.46 0.12 -0.63 -0.69 0.00 0.00 174.62 174.44 1hcq s ILE 51 N -0.59 3.09 -0.26 1.82 -1.09 -1.26 -3.13 121.20 119.79 1hcq s ILE 51 Ca 0.34 -1.85 -0.02 0.00 -2.23 0.00 0.00 60.65 56.89 1hcq s ILE 51 Cb -0.20 -3.02 0.14 0.00 -1.58 0.00 0.00 42.46 37.80 1hcq s ILE 51 CO 0.21 -0.48 0.40 -0.62 -1.23 0.00 0.00 174.94 173.23 1hcq s ASP 52 N 1.53 0.11 0.62 3.58 -1.08 0.31 -4.64 116.67 117.10 1hcq s ASP 52 Ca 0.04 0.18 0.40 0.00 -0.52 0.00 0.00 52.55 52.66 1hcq s ASP 52 Cb -0.21 1.22 2.04 0.00 -1.46 0.00 0.00 42.92 44.51 1hcq s ASP 52 CO -0.03 -0.31 2.24 0.07 0.52 0.00 0.00 175.17 177.66 1hcq h LYS 53 N 8.16 0.00 0.00 4.34 5.09 -1.61 0.32 116.57 132.88 1hcq h LYS 53 Ca -0.18 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.56 1hcq h LYS 53 Cb 1.15 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.48 1hcq h LYS 53 CO 0.27 0.01 -0.31 -0.91 -2.09 0.00 0.00 179.45 176.41 1hcq h ASN 54 N 0.00 0.00 -0.34 7.07 4.21 -1.91 -2.84 115.58 121.77 1hcq h ASN 54 Ca -0.00 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.50 1hcq h ASN 54 Cb 0.18 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.38 1hcq h ASN 54 CO 0.00 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.68 1hcq n ARG 55 N -2.91 2.31 -1.24 0.81 1.74 -0.82 -4.97 116.66 111.58 1hcq n ARG 55 Ca 0.03 -2.12 -0.11 0.00 -0.77 0.00 0.00 57.85 54.88 1hcq n ARG 55 Cb 0.53 -1.44 -0.05 0.00 -1.02 0.00 0.00 32.46 30.48 1hcq n ARG 55 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1hcq n ARG 56 N 1.24 -1.56 -3.04 5.56 3.00 0.04 -4.93 116.66 116.97 1hcq n ARG 56 Ca 0.17 0.77 -0.40 0.00 -0.01 0.00 0.00 57.85 58.38 1hcq n ARG 56 Cb 0.54 -4.98 -0.05 0.00 0.00 0.00 0.00 32.46 27.97 1hcq n ARG 56 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1hcq s LYS 57 N -2.77 4.44 -0.21 5.56 1.02 -0.84 -4.95 119.74 121.99 1hcq s LYS 57 Ca 0.00 0.92 -0.27 0.00 0.02 0.00 0.00 55.97 56.64 1hcq s LYS 57 Cb 0.00 -3.41 0.09 0.00 -0.52 0.00 0.00 37.83 34.00 1hcq s LYS 57 CO 0.00 0.17 0.85 0.45 -0.92 0.00 0.00 175.35 175.90 1hcq s SER 58 N 0.41 -0.58 -0.22 2.83 0.15 -1.18 -0.53 113.70 114.57 1hcq s SER 58 Ca 0.37 0.94 -0.04 0.00 0.70 0.00 0.00 55.95 57.92 1hcq s SER 58 Cb -0.19 0.90 0.08 0.00 -1.71 0.00 0.00 66.02 65.10 1hcq s SER 58 CO 0.20 -0.32 0.12 0.00 1.20 0.00 0.00 173.24 174.44 1hcq n GLN 60 N 5.27 -0.00 0.07 0.00 6.02 -1.26 0.47 117.38 127.95 1hcq n GLN 60 Ca -0.06 0.96 -0.21 0.00 -0.01 0.00 0.00 57.00 57.67 1hcq n GLN 60 Cb 0.47 -2.19 -0.13 0.00 1.02 0.00 0.00 30.24 29.40 1hcq n GLN 60 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hcq h ALA 61 N 0.89 -0.04 -0.58 -1.58 0.00 -1.91 -2.73 119.26 113.31 1hcq h ALA 61 Ca 0.83 -0.72 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1hcq h ALA 61 Cb 3.29 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 21.16 1hcq h ALA 61 CO -0.03 0.54 0.01 0.00 0.00 0.00 0.00 179.25 179.77 1hcq h ARG 63 N 0.92 -0.38 -1.00 0.00 2.43 -1.25 1.18 114.38 116.27 1hcq h ARG 63 Ca 0.17 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.54 1hcq h ARG 63 Cb 0.55 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 30.08 1hcq h ARG 63 CO 0.03 -0.26 0.62 1.25 -1.51 0.00 0.00 179.97 180.10 1hcq h LEU 64 N -0.40 0.78 0.52 3.80 5.85 -1.48 0.59 115.31 124.98 1hcq h LEU 64 Ca -0.02 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1hcq h LEU 64 Cb 0.35 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 1hcq h LEU 64 CO -0.04 0.30 -0.31 -0.09 -0.34 0.00 0.00 178.44 177.97 1hcq h ARG 65 N 0.78 -0.75 -0.45 1.25 2.43 -0.94 -1.62 114.38 115.08 1hcq h ARG 65 Ca 0.56 0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.85 1hcq h ARG 65 Cb 0.86 0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1hcq h ARG 65 CO -0.35 -0.50 0.30 -0.22 -1.51 0.00 0.00 179.97 177.69 1hcq h LYS 66 N -0.78 0.29 -0.44 0.20 3.64 0.28 0.25 116.57 120.01 1hcq h LYS 66 Ca -0.06 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.22 1hcq h LYS 66 Cb 0.63 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1hcq h LYS 66 CO 0.08 0.19 -0.04 0.00 -2.27 0.00 0.00 179.45 177.41 1hcq h TYR 68 N 0.69 0.54 0.09 0.00 0.05 -0.42 0.38 116.97 118.29 1hcq h TYR 68 Ca 0.13 -0.22 0.02 0.00 0.05 0.00 0.00 58.73 58.71 1hcq h TYR 68 Cb 0.48 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 38.08 1hcq h TYR 68 CO 0.02 0.94 -0.47 0.93 -1.05 0.00 0.00 178.16 178.54 1hcq h GLU 69 N -0.02 -0.65 0.00 4.88 5.08 -0.10 0.24 114.58 124.01 1hcq h GLU 69 Ca -0.01 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1hcq h GLU 69 Cb 0.95 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1hcq h GLU 69 CO 0.07 -0.44 0.00 1.33 -1.00 0.00 0.00 179.01 178.97 1hcq n VAL 70 N -5.47 0.00 -0.50 3.13 0.24 -0.11 -4.80 118.33 110.81 1hcq n VAL 70 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1hcq n VAL 70 Cb 0.39 -0.39 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1hcq n VAL 70 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1hcq n GLY 71 N -0.02 0.71 3.55 7.63 0.00 0.84 -4.91 105.19 112.99 1hcq n GLY 71 Ca 0.03 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 1hcq n GLY 71 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1hcq n MET 72 N -2.50 0.44 0.16 1.61 2.81 0.13 -4.84 117.12 114.92 1hcq n MET 72 Ca 0.00 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 56.09 1hcq n MET 72 Cb 0.00 -2.05 0.00 0.00 -0.71 0.00 0.00 33.22 30.46 1hcq n MET 72 CO 0.00 0.00 0.00 -0.12 1.51 0.00 0.00 175.97 177.36 1hcq n MET 73 N -1.33 0.00 -0.36 0.03 1.56 0.00 -4.76 117.12 112.27 1hcq n MET 73 Ca 0.12 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.55 1hcq n MET 73 Cb 0.49 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.86 1hcq n MET 73 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41