#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hcp h LYS 2 N 0.00 -0.66 -3.70 3.17 1.57 -2.15 -3.47 116.57 111.33 1hcp h LYS 2 Ca 0.00 0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1hcp h LYS 2 Cb 0.00 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1hcp h LYS 2 CO 0.00 -0.36 -0.50 -0.85 -0.57 0.00 0.00 179.45 177.17 1hcp n GLU 3 N -5.29 -0.32 -3.66 3.15 0.28 -1.26 -4.97 120.64 108.57 1hcp n GLU 3 Ca -0.11 0.44 -0.07 0.00 -0.16 0.00 0.00 57.16 57.25 1hcp n GLU 3 Cb 0.32 -0.58 -0.08 0.00 1.43 0.00 0.00 31.44 32.52 1hcp n GLU 3 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1hcp s THR 4 N -0.53 -0.27 0.61 3.84 2.01 -1.26 -5.16 115.64 114.89 1hcp s THR 4 Ca 0.05 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.15 1hcp s THR 4 Cb -0.00 -0.81 0.09 0.00 0.01 0.00 0.00 72.50 71.78 1hcp s THR 4 CO 0.11 0.02 0.85 -0.13 -0.69 0.00 0.00 174.62 174.78 1hcp s ARG 5 N 1.91 2.14 0.33 4.92 1.81 -1.26 -5.10 118.95 123.69 1hcp s ARG 5 Ca -0.08 -1.31 -0.08 0.00 -1.72 0.00 0.00 55.73 52.55 1hcp s ARG 5 Cb -0.08 -2.52 0.01 0.00 -0.45 0.00 0.00 34.95 31.91 1hcp s ARG 5 CO -0.16 -1.01 0.55 0.71 -0.68 0.00 0.00 175.30 174.70 1hcp s TYR 6 N -2.83 0.67 0.29 -0.53 2.02 -1.26 -4.28 117.35 111.43 1hcp s TYR 6 Ca 0.62 -1.03 -0.30 0.00 -0.37 0.00 0.00 57.07 55.99 1hcp s TYR 6 Cb -0.06 0.19 -0.13 0.00 -0.40 0.00 0.00 41.96 41.56 1hcp s TYR 6 CO 0.40 -1.20 1.38 0.00 -1.57 0.00 0.00 175.55 174.56 1hcp h ALA 8 N 3.59 2.35 0.00 0.00 0.00 -1.89 -3.41 119.26 119.90 1hcp h ALA 8 Ca -0.46 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1hcp h ALA 8 Cb 1.27 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1hcp h ALA 8 CO 0.71 -0.97 0.00 0.28 0.00 0.00 0.00 179.25 179.26 1hcp n VAL 9 N -4.89 0.00 0.00 0.00 0.31 -1.26 -5.05 118.33 107.44 1hcp n VAL 9 Ca 0.34 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.67 1hcp n VAL 9 Cb 1.21 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.14 1hcp n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hcp n ASN 11 N -1.38 0.00 0.00 0.00 2.85 -1.26 -4.44 115.26 111.03 1hcp n ASN 11 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1hcp n ASN 11 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1hcp n ASN 11 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1hcp n ASP 12 N 0.00 0.06 -2.54 1.20 2.03 -1.26 -4.65 116.55 111.40 1hcp n ASP 12 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 1hcp n ASP 12 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 1hcp n ASP 12 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1hcp n TYR 13 N 0.00 0.22 -2.74 -0.67 4.01 -1.26 0.22 117.16 116.94 1hcp n TYR 13 Ca 0.00 0.15 -0.40 0.00 -0.16 0.00 0.00 57.90 57.49 1hcp n TYR 13 Cb 0.00 -1.01 -0.06 0.00 -0.31 0.00 0.00 39.34 37.96 1hcp n TYR 13 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1hcp s ALA 14 N 3.48 3.34 0.55 -0.72 0.00 -1.26 -4.78 121.76 122.37 1hcp s ALA 14 Ca 0.76 0.63 0.34 0.00 0.00 0.00 0.00 51.96 53.70 1hcp s ALA 14 Cb -0.64 -3.22 1.51 0.00 0.00 0.00 0.00 23.12 20.78 1hcp s ALA 14 CO 0.29 0.19 1.83 1.03 0.00 0.00 0.00 175.76 179.10 1hcp h SER 15 N 4.16 0.00 -0.98 0.00 0.87 -1.88 -3.46 113.55 112.26 1hcp h SER 15 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1hcp h SER 15 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1hcp h SER 15 CO 0.68 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 177.59 1hcp n GLY 16 N -1.73 2.56 3.61 5.77 0.00 -1.26 -5.08 105.19 109.06 1hcp n GLY 16 Ca 0.22 -1.21 -0.52 0.00 0.00 0.00 0.00 46.02 44.51 1hcp n GLY 16 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1hcp n TYR 17 N -1.25 2.00 -0.05 1.61 9.36 -1.26 -4.23 117.16 123.35 1hcp n TYR 17 Ca 0.00 0.24 -0.09 0.00 3.32 0.00 0.00 57.90 61.36 1hcp n TYR 17 Cb 0.00 -2.57 -0.03 0.00 -0.63 0.00 0.00 39.34 36.11 1hcp n TYR 17 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1hcp n HIS 18 N 7.53 0.00 0.00 2.98 8.25 -1.24 -5.00 115.22 127.74 1hcp n HIS 18 Ca 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 1hcp n HIS 18 Cb 0.23 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.01 1hcp n HIS 18 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1hcp n TYR 19 N -3.33 0.00 -1.88 4.41 4.02 -1.26 -4.96 117.16 114.15 1hcp n TYR 19 Ca -0.18 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.73 1hcp n TYR 19 Cb 0.63 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.97 1hcp n TYR 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1hcp n GLY 20 N 3.78 1.12 3.44 2.72 0.00 -1.26 -5.03 105.19 109.96 1hcp n GLY 20 Ca 0.00 -0.18 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 1hcp n GLY 20 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hcp s VAL 21 N -0.40 0.00 -1.08 1.61 -7.23 -1.26 -4.84 120.40 107.20 1hcp s VAL 21 Ca 0.05 0.00 -0.21 0.00 -1.81 0.00 0.00 61.98 60.01 1hcp s VAL 21 Cb 0.05 -1.00 -0.08 0.00 0.56 0.00 0.00 36.38 35.91 1hcp s VAL 21 CO -0.00 0.00 1.93 0.79 -0.31 0.00 0.00 175.10 177.51 1hcp n TRP 22 N -0.18 2.80 -3.97 2.82 7.02 -1.26 -3.62 117.44 121.05 1hcp n TRP 22 Ca -0.17 -1.95 -0.31 0.00 -1.02 0.00 0.00 57.50 54.05 1hcp n TRP 22 Cb 0.64 -2.29 -0.05 0.00 -2.42 0.00 0.00 31.31 27.19 1hcp n TRP 22 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1hcp s SER 23 N 5.27 6.08 0.73 -0.99 0.01 -1.26 -2.78 113.70 120.76 1hcp s SER 23 Ca 0.60 0.18 -0.13 0.00 1.31 0.00 0.00 55.95 57.92 1hcp s SER 23 Cb 0.07 -1.80 0.04 0.00 0.21 0.00 0.00 66.02 64.54 1hcp s SER 23 CO 0.10 0.18 1.11 0.00 0.41 0.00 0.00 173.24 175.04 1hcp h GLU 25 N -0.65 -0.04 -1.02 0.00 5.08 -1.94 -1.72 114.58 114.30 1hcp h GLU 25 Ca -0.45 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.20 1hcp h GLU 25 Cb 1.24 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 30.37 1hcp h GLU 25 CO 0.52 -0.03 0.60 0.78 -1.00 0.00 0.00 179.01 179.88 1hcp h GLY 26 N -0.04 1.92 0.63 -3.84 0.00 -1.97 0.65 103.07 100.42 1hcp h GLY 26 Ca 0.08 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1hcp h GLY 26 CO -0.17 -0.36 -0.03 0.00 0.00 0.00 0.00 176.54 175.98 1hcp h LYS 28 N -0.44 0.84 0.21 0.00 3.64 -0.60 0.98 116.57 121.21 1hcp h LYS 28 Ca -0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1hcp h LYS 28 Cb 0.39 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1hcp h LYS 28 CO 0.01 0.56 -0.10 0.00 -2.27 0.00 0.00 179.45 177.65 1hcp h ALA 29 N 1.45 -0.28 -0.06 5.00 0.00 -0.85 0.63 119.26 125.16 1hcp h ALA 29 Ca 0.40 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1hcp h ALA 29 Cb 0.31 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1hcp h ALA 29 CO -0.23 -0.48 0.03 0.35 0.00 0.00 0.00 179.25 178.92 1hcp h PHE 30 N -0.63 0.05 -0.63 0.00 3.57 -0.35 -1.62 116.94 117.33 1hcp h PHE 30 Ca -0.03 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.53 1hcp h PHE 30 Cb 0.45 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.13 1hcp h PHE 30 CO 0.03 0.03 0.35 0.35 -2.23 0.00 0.00 178.31 176.84 1hcp h PHE 31 N 0.06 0.64 0.00 0.41 3.57 1.00 0.21 116.94 122.83 1hcp h PHE 31 Ca 0.02 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1hcp h PHE 31 Cb 0.00 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.55 1hcp h PHE 31 CO -0.08 0.31 0.00 1.17 -2.23 0.00 0.00 178.31 177.48 1hcp n LYS 32 N -4.80 0.06 0.27 1.11 4.81 0.21 -1.20 118.16 118.62 1hcp n LYS 32 Ca 0.07 0.19 0.18 0.00 -0.87 0.00 0.00 58.31 57.88 1hcp n LYS 32 Cb 0.16 -1.50 0.74 0.00 0.02 0.00 0.00 35.03 34.45 1hcp n LYS 32 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1hcp h ARG 33 N 0.00 0.00 0.00 1.64 2.43 0.39 -3.41 114.38 115.44 1hcp h ARG 33 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1hcp h ARG 33 Cb 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1hcp h ARG 33 CO 0.00 0.00 0.00 0.43 -1.51 0.00 0.00 179.97 178.89 1hcp n SER 34 N -3.02 0.00 -0.08 -3.80 7.64 -0.79 -5.11 113.62 108.47 1hcp n SER 34 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.89 1hcp n SER 34 Cb 0.27 0.02 -0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1hcp n SER 34 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1hcp n ILE 35 N -1.60 0.00 -1.69 0.44 2.08 -0.34 -4.94 119.36 113.32 1hcp n ILE 35 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1hcp n ILE 35 Cb 0.00 -0.01 0.00 0.00 -0.75 0.00 0.00 39.64 38.88 1hcp n ILE 35 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1hcp n GLN 36 N -0.72 -4.62 0.00 0.38 1.13 -1.26 -4.81 117.38 107.48 1hcp n GLN 36 Ca 0.00 3.49 0.00 0.00 -1.94 0.00 0.00 57.00 58.55 1hcp n GLN 36 Cb 0.50 -4.07 0.00 0.00 0.11 0.00 0.00 30.24 26.79 1hcp n GLN 36 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1hcp n GLY 37 N -1.43 -2.06 3.50 1.08 0.00 -1.26 -4.44 105.19 100.58 1hcp n GLY 37 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1hcp n GLY 37 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1hcp n HIS 38 N -1.97 0.09 -3.55 1.61 -0.00 -1.26 -4.77 115.22 105.37 1hcp n HIS 38 Ca 0.00 0.02 -0.11 0.00 -0.00 0.00 0.00 57.72 57.63 1hcp n HIS 38 Cb 0.00 -0.71 -0.03 0.00 -0.00 0.00 0.00 29.99 29.25 1hcp n HIS 38 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1hcp s ASN 39 N 1.04 -0.42 -0.09 0.26 2.47 -1.26 -5.08 114.94 111.86 1hcp s ASN 39 Ca 1.31 -0.19 -0.29 0.00 0.42 0.00 0.00 52.86 54.11 1hcp s ASN 39 Cb -0.84 0.57 -0.02 0.00 -1.45 0.00 0.00 41.25 39.51 1hcp s ASN 39 CO 0.54 -0.97 0.98 -1.81 -3.72 0.00 0.00 177.10 172.13 1hcp s ASP 40 N -2.79 7.24 -0.28 -4.21 1.11 -1.26 -5.01 116.67 111.47 1hcp s ASP 40 Ca 0.03 1.52 -0.24 0.00 0.18 0.00 0.00 52.55 54.04 1hcp s ASP 40 Cb -0.00 -2.55 0.12 0.00 1.07 0.00 0.00 42.92 41.56 1hcp s ASP 40 CO -0.10 -0.40 0.99 -0.31 1.18 0.00 0.00 175.17 176.53 1hcp s TYR 41 N 1.79 -0.53 -0.13 4.23 2.02 -1.26 -5.00 117.35 118.48 1hcp s TYR 41 Ca 0.48 1.26 -0.09 0.00 -0.37 0.00 0.00 57.07 58.35 1hcp s TYR 41 Cb -0.19 0.36 0.04 0.00 -0.40 0.00 0.00 41.96 41.77 1hcp s TYR 41 CO 0.19 -0.26 0.32 -1.64 -1.57 0.00 0.00 175.55 172.60 1hcp s MET 42 N 0.38 0.33 -0.05 -0.62 -1.94 -1.26 -4.95 119.30 111.19 1hcp s MET 42 Ca 0.01 0.53 -0.27 0.00 -1.71 0.00 0.00 55.69 54.25 1hcp s MET 42 Cb -0.05 0.07 -0.03 0.00 2.01 0.00 0.00 34.83 36.83 1hcp s MET 42 CO -0.07 -0.09 0.88 0.00 -0.01 0.00 0.00 175.02 175.73 1hcp n PRO 44 N 4.09 0.40 0.00 0.00 -0.04 -1.26 -1.93 135.00 136.25 1hcp n PRO 44 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1hcp n PRO 44 Cb 0.51 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1hcp n PRO 44 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hcp n ALA 45 N 0.86 0.06 -3.53 0.55 0.00 -1.26 -5.00 120.51 112.18 1hcp n ALA 45 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1hcp n ALA 45 Cb 0.20 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.67 1hcp n ALA 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1hcp n THR 46 N -0.19 -1.73 -2.94 0.00 -1.04 -0.81 -4.86 114.28 102.71 1hcp n THR 46 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1hcp n THR 46 Cb 0.00 -2.71 0.03 0.00 -1.82 0.00 0.00 70.33 65.83 1hcp n THR 46 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1hcp n ASN 47 N -2.60 -0.40 0.00 8.00 3.02 -1.26 -5.04 115.26 116.98 1hcp n ASN 47 Ca -0.01 -3.17 0.00 0.00 -0.03 0.00 0.00 54.58 51.37 1hcp n ASN 47 Cb 0.55 0.39 0.00 0.00 -0.61 0.00 0.00 39.78 40.11 1hcp n ASN 47 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1hcp n GLN 48 N 0.20 0.00 -1.42 3.52 -0.06 -1.26 -4.85 117.38 113.52 1hcp n GLN 48 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.15 1hcp n GLN 48 Cb 0.71 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.89 1hcp n GLN 48 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1hcp s THR 50 N -3.59 4.85 0.10 0.00 2.01 -1.26 -5.03 115.64 112.72 1hcp s THR 50 Ca 0.00 1.78 -0.23 0.00 0.31 0.00 0.00 61.69 63.56 1hcp s THR 50 Cb 0.00 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 68.25 1hcp s THR 50 CO 0.00 0.25 0.69 -0.63 -0.69 0.00 0.00 174.62 174.24 1hcp s ILE 51 N 0.60 4.59 0.00 1.82 -1.09 -1.26 -4.71 121.20 121.15 1hcp s ILE 51 Ca 0.44 1.50 0.00 0.00 -2.23 0.00 0.00 60.65 60.36 1hcp s ILE 51 Cb -0.20 -4.04 0.00 0.00 -1.58 0.00 0.00 42.46 36.64 1hcp s ILE 51 CO 0.24 0.50 0.00 0.47 -1.23 0.00 0.00 174.94 174.92 1hcp n ASP 52 N 1.95 0.00 0.00 3.58 8.00 -1.26 -4.72 116.55 124.10 1hcp n ASP 52 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1hcp n ASP 52 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.60 1hcp n ASP 52 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hcp n LYS 53 N 0.00 0.00 0.00 -1.24 4.76 -1.26 -3.98 118.16 116.44 1hcp n LYS 53 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1hcp n LYS 53 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1hcp n LYS 53 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1hcp n ASN 54 N 1.26 0.00 0.00 4.39 3.02 -1.26 -5.12 115.26 117.55 1hcp n ASN 54 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1hcp n ASN 54 Cb 0.00 0.37 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 1hcp n ASN 54 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1hcp n ARG 55 N -2.33 0.00 -0.71 3.52 0.63 -1.26 -5.01 116.66 111.51 1hcp n ARG 55 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1hcp n ARG 55 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1hcp n ARG 55 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1hcp n ARG 56 N 0.00 0.00 -1.78 -0.14 -4.01 -1.26 -4.89 116.66 104.58 1hcp n ARG 56 Ca 0.00 -1.03 -0.33 0.00 -1.04 0.00 0.00 57.85 55.45 1hcp n ARG 56 Cb 0.00 -0.28 0.05 0.00 -3.04 0.00 0.00 32.46 29.18 1hcp n ARG 56 CO 0.00 0.00 0.00 1.63 -3.04 0.00 0.00 177.63 176.22 1hcp n LYS 57 N 0.09 3.01 0.00 2.89 5.02 -1.26 -4.83 118.16 123.08 1hcp n LYS 57 Ca -0.00 -3.71 0.00 0.00 -2.02 0.00 0.00 58.31 52.58 1hcp n LYS 57 Cb 0.75 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.48 1hcp n LYS 57 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1hcp n SER 58 N -0.72 0.00 -4.47 4.39 7.64 -1.26 -5.05 113.62 114.14 1hcp n SER 58 Ca 0.53 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.99 1hcp n SER 58 Cb 0.63 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.79 1hcp n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hcp n GLN 60 N 7.96 1.50 -0.09 0.00 6.02 -1.26 -3.33 117.38 128.19 1hcp n GLN 60 Ca -0.02 -0.78 -0.20 0.00 -0.01 0.00 0.00 57.00 55.99 1hcp n GLN 60 Cb 0.46 -1.20 -0.07 0.00 1.02 0.00 0.00 30.24 30.46 1hcp n GLN 60 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hcp n ALA 61 N 0.11 1.80 0.25 -1.58 0.00 -1.26 -4.17 120.51 115.67 1hcp n ALA 61 Ca 0.09 -0.74 0.12 0.00 0.00 0.00 0.00 53.44 52.91 1hcp n ALA 61 Cb 0.19 0.26 0.67 0.00 0.00 0.00 0.00 19.45 20.58 1hcp n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hcp h ARG 63 N 0.00 -0.88 0.08 0.00 2.43 -1.76 0.86 114.38 115.12 1hcp h ARG 63 Ca -0.00 0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1hcp h ARG 63 Cb 0.40 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1hcp h ARG 63 CO 0.02 -0.58 -0.24 1.25 -1.51 0.00 0.00 179.97 178.91 1hcp h LEU 64 N -0.92 -0.68 -1.56 3.80 5.85 -1.64 1.50 115.31 121.65 1hcp h LEU 64 Ca -0.09 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.80 1hcp h LEU 64 Cb 0.70 0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1hcp h LEU 64 CO 0.15 -0.32 0.42 0.03 -0.34 0.00 0.00 178.44 178.38 1hcp h ARG 65 N -0.42 0.49 0.00 1.25 2.47 -1.29 1.21 114.38 118.08 1hcp h ARG 65 Ca 0.04 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1hcp h ARG 65 Cb 0.46 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 1hcp h ARG 65 CO -0.16 0.32 0.00 1.63 0.56 0.00 0.00 179.97 182.33 1hcp n LYS 66 N -4.48 0.01 0.01 0.04 4.76 0.30 -0.70 118.16 118.10 1hcp n LYS 66 Ca 0.10 0.01 -0.11 0.00 -2.87 0.00 0.00 58.31 55.43 1hcp n LYS 66 Cb 0.33 -1.51 -0.14 0.00 -1.84 0.00 0.00 35.03 31.88 1hcp n LYS 66 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hcp h TYR 68 N 0.02 0.30 0.00 0.00 0.05 -0.58 -3.24 116.97 113.52 1hcp h TYR 68 Ca -0.23 -0.22 0.00 0.00 0.05 0.00 0.00 58.73 58.33 1hcp h TYR 68 Cb 1.97 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.70 1hcp h TYR 68 CO 0.02 1.27 0.30 1.49 -1.05 0.00 0.00 178.16 180.19 1hcp h GLU 69 N 0.04 0.00 0.37 4.88 4.81 -1.04 0.28 114.58 123.93 1hcp h GLU 69 Ca -0.22 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1hcp h GLU 69 Cb 1.98 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.36 1hcp h GLU 69 CO 0.14 0.00 -0.18 0.28 -0.73 0.00 0.00 179.01 178.52 1hcp h VAL 70 N 0.00 0.50 0.00 0.32 2.07 -1.67 -3.48 116.25 113.99 1hcp h VAL 70 Ca 0.00 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1hcp h VAL 70 Cb 0.60 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1hcp h VAL 70 CO 0.00 0.09 0.00 0.61 0.02 0.00 0.00 177.57 178.29 1hcp n GLY 71 N -0.15 1.41 0.01 2.17 0.00 0.97 -5.05 105.19 104.54 1hcp n GLY 71 Ca -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.93 1hcp n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hcp h MET 72 N 0.00 0.00 -3.24 1.61 -0.00 -1.76 -3.47 114.93 108.08 1hcp h MET 72 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1hcp h MET 72 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 1hcp h MET 72 CO 0.00 0.00 -0.68 -1.33 -0.00 0.00 0.00 176.91 174.90 1hcp n MET 73 N -2.41 -3.92 -0.21 -0.10 2.81 -1.26 -4.39 117.12 107.64 1hcp n MET 73 Ca -0.00 2.89 0.27 0.00 -1.81 0.00 0.00 57.70 59.05 1hcp n MET 73 Cb 0.00 -3.02 0.42 0.00 -0.71 0.00 0.00 33.22 29.91 1hcp n MET 73 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1hcp n LYS 74 N 0.99 0.01 0.00 0.03 4.81 -1.26 -4.74 118.16 118.01 1hcp n LYS 74 Ca 0.00 0.98 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 1hcp n LYS 74 Cb 0.00 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 32.61 1hcp n LYS 74 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98