#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gcf s ALA 2 N 0.00 -0.55 -1.27 3.04 0.00 -1.26 -4.89 121.76 116.82 2gcf s ALA 2 Ca 0.00 -0.67 -0.09 0.00 0.00 0.00 0.00 51.96 51.19 2gcf s ALA 2 Cb 0.00 -3.01 -0.07 0.00 0.00 0.00 0.00 23.12 20.05 2gcf s ALA 2 CO 0.00 -4.33 2.50 0.00 0.00 0.00 0.00 175.76 173.93 2gcf n GLN 3 N -5.38 2.84 -4.40 0.00 0.00 -1.26 -4.86 117.38 104.32 2gcf n GLN 3 Ca 0.10 -1.90 -0.32 0.00 0.00 0.00 0.00 57.00 54.89 2gcf n GLN 3 Cb 0.59 -2.70 -0.10 0.00 0.00 0.00 0.00 30.24 28.03 2gcf n GLN 3 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 2gcf s THR 4 N 2.93 3.62 -0.07 -0.39 -1.32 -1.26 -3.86 115.64 115.29 2gcf s THR 4 Ca 0.55 -0.88 0.05 0.00 -1.21 0.00 0.00 61.69 60.20 2gcf s THR 4 Cb 0.14 -2.61 -0.01 0.00 -1.51 0.00 0.00 72.50 68.52 2gcf s THR 4 CO -0.04 0.32 -0.24 -0.63 -2.21 0.00 0.00 174.62 171.82 2gcf s ILE 5 N -1.06 2.00 -0.08 5.08 -1.09 -0.24 -4.94 121.20 120.87 2gcf s ILE 5 Ca 0.18 -1.02 0.03 0.00 -2.23 0.00 0.00 60.65 57.62 2gcf s ILE 5 Cb -0.11 -1.70 0.01 0.00 -1.58 0.00 0.00 42.46 39.07 2gcf s ILE 5 CO 0.09 0.55 -0.16 0.54 -1.23 0.00 0.00 174.94 174.73 2gcf s ASN 6 N 0.02 2.24 0.34 3.58 2.20 -1.26 -1.35 114.94 120.72 2gcf s ASN 6 Ca -0.09 -0.39 -0.13 0.00 -0.94 0.00 0.00 52.86 51.31 2gcf s ASN 6 Cb -0.15 -1.01 0.03 0.00 -2.00 0.00 0.00 41.25 38.13 2gcf s ASN 6 CO 0.05 0.08 0.68 -1.48 -2.94 0.00 0.00 177.10 173.49 2gcf s LEU 7 N 0.51 0.21 0.34 3.54 2.34 -0.53 -4.84 118.68 120.25 2gcf s LEU 7 Ca -0.15 -1.11 0.05 0.00 0.06 0.00 0.00 54.13 52.98 2gcf s LEU 7 Cb -0.16 2.41 -0.01 0.00 -0.56 0.00 0.00 46.19 47.87 2gcf s LEU 7 CO 0.05 -1.49 0.49 -1.10 -1.06 0.00 0.00 176.35 173.24 2gcf s GLN 8 N -2.93 3.20 -0.08 1.48 -0.21 0.28 -0.68 119.66 120.73 2gcf s GLN 8 Ca 0.19 -0.83 0.05 0.00 0.02 0.00 0.00 55.36 54.79 2gcf s GLN 8 Cb -0.04 -2.78 -0.01 0.00 1.00 0.00 0.00 33.01 31.19 2gcf s GLN 8 CO 0.12 0.09 -0.24 -1.17 -2.12 0.00 0.00 175.29 171.97 2gcf s LEU 9 N -4.21 2.10 -0.04 2.90 2.96 0.55 -0.51 118.68 122.43 2gcf s LEU 9 Ca 0.43 -0.53 -0.20 0.00 -0.22 0.00 0.00 54.13 53.61 2gcf s LEU 9 Cb -0.09 -1.39 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 2gcf s LEU 9 CO 0.32 0.21 0.57 -0.70 -1.32 0.00 0.00 176.35 175.43 2gcf s GLU 10 N 0.06 4.31 0.00 1.98 2.56 0.21 -4.41 118.70 123.41 2gcf s GLU 10 Ca -0.10 0.66 0.00 0.00 0.00 0.00 0.00 54.97 55.53 2gcf s GLU 10 Cb -0.16 -3.37 0.00 0.00 2.00 0.00 0.00 34.13 32.61 2gcf s GLU 10 CO 0.06 0.31 0.00 0.41 -0.56 0.00 0.00 175.26 175.48 2gcf n GLY 11 N 2.67 0.78 1.65 -1.50 0.00 -1.26 -3.61 105.19 103.92 2gcf n GLY 11 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2gcf n GLY 11 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2gcf n MET 12 N -2.27 0.00 -1.38 1.61 2.81 -1.26 -4.83 117.12 111.80 2gcf n MET 12 Ca 0.00 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.50 2gcf n MET 12 Cb 0.01 -0.62 -0.02 0.00 -0.71 0.00 0.00 33.22 31.88 2gcf n MET 12 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2gcf n ARG 13 N 1.56 3.40 0.00 0.03 1.85 -1.26 -4.71 116.66 117.53 2gcf n ARG 13 Ca 0.00 -2.25 0.00 0.00 -1.00 0.00 0.00 57.85 54.60 2gcf n ARG 13 Cb 0.00 -2.90 0.00 0.00 -1.05 0.00 0.00 32.46 28.51 2gcf n ARG 13 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2gcf n ALA 15 N 0.00 0.90 0.44 0.00 0.00 -1.26 -4.83 120.51 115.76 2gcf n ALA 15 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2gcf n ALA 15 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.22 2gcf n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gcf n ALA 16 N -1.12 1.81 -0.34 0.00 0.00 -1.26 -4.50 120.51 115.10 2gcf n ALA 16 Ca 0.11 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.58 2gcf n ALA 16 Cb 0.44 -1.00 0.09 0.00 0.00 0.00 0.00 19.45 18.98 2gcf n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gcf h ALA 18 N 1.58 -0.55 0.00 0.00 0.00 -1.98 -0.13 119.26 118.19 2gcf h ALA 18 Ca 0.39 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 2gcf h ALA 18 Cb 0.62 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2gcf h ALA 18 CO -0.94 -0.83 -0.31 1.03 0.00 0.00 0.00 179.25 178.20 2gcf h SER 19 N -0.56 0.00 0.34 0.00 0.87 -1.86 -0.41 113.55 111.94 2gcf h SER 19 Ca -0.02 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 2gcf h SER 19 Cb 0.50 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2gcf h SER 19 CO -0.03 0.31 -0.32 -1.28 -0.53 0.00 0.00 176.83 174.99 2gcf h SER 20 N 0.00 0.00 0.02 6.23 0.87 -0.73 -1.31 113.55 118.64 2gcf h SER 20 Ca -0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2gcf h SER 20 Cb 0.86 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2gcf h SER 20 CO 0.04 0.32 -0.01 0.40 -0.53 0.00 0.00 176.83 177.05 2gcf h ILE 21 N 0.00 1.44 -0.75 2.23 2.04 -0.23 -3.26 117.51 118.98 2gcf h ILE 21 Ca -0.00 -1.57 0.15 0.00 1.00 0.00 0.00 64.86 64.44 2gcf h ILE 21 Cb 0.58 2.48 -0.14 0.00 -0.74 0.00 0.00 36.82 38.99 2gcf h ILE 21 CO 0.04 0.39 -0.20 -0.33 0.00 0.00 0.00 178.15 178.05 2gcf h GLU 22 N -0.73 -0.01 0.00 2.37 5.08 -0.96 0.14 114.58 120.47 2gcf h GLU 22 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2gcf h GLU 22 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2gcf h GLU 22 CO 0.01 -0.01 0.00 -0.09 -1.00 0.00 0.00 179.01 177.92 2gcf h ARG 23 N -0.01 0.00 0.07 2.33 9.65 -1.34 0.86 114.38 125.93 2gcf h ARG 23 Ca 0.36 0.00 -0.37 0.00 -1.10 0.00 0.00 59.98 58.87 2gcf h ARG 23 Cb 0.56 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.10 2gcf h ARG 23 CO -0.78 0.00 -2.15 0.00 2.80 0.00 0.00 179.97 179.84 2gcf n ALA 24 N -2.00 1.13 0.11 2.80 0.00 0.23 -4.46 120.51 118.32 2gcf n ALA 24 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.63 2gcf n ALA 24 Cb 0.13 -0.49 0.30 0.00 0.00 0.00 0.00 19.45 19.40 2gcf n ALA 24 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2gcf h ILE 25 N 0.04 1.26 0.00 0.00 1.08 -0.10 -2.98 117.51 116.81 2gcf h ILE 25 Ca -0.47 -1.21 0.00 0.00 -0.39 0.00 0.00 64.86 62.79 2gcf h ILE 25 Cb 2.00 1.50 0.00 0.00 -3.07 0.00 0.00 36.82 37.25 2gcf h ILE 25 CO 0.03 0.37 0.00 0.00 -0.69 0.00 0.00 178.15 177.85 2gcf n ALA 26 N -2.48 1.26 0.29 1.87 0.00 0.23 -0.49 120.51 121.20 2gcf n ALA 26 Ca -0.01 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.46 2gcf n ALA 26 Cb 0.39 -0.84 -0.04 0.00 0.00 0.00 0.00 19.45 18.96 2gcf n ALA 26 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gcf n LYS 27 N -0.73 4.57 -2.59 0.00 5.02 -1.12 -5.07 118.16 118.23 2gcf n LYS 27 Ca 0.00 -0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.87 2gcf n LYS 27 Cb 0.00 -0.83 -0.04 0.00 -0.02 0.00 0.00 35.03 34.14 2gcf n LYS 27 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2gcf s VAL 28 N -1.67 4.26 0.12 -0.18 1.01 0.36 -4.95 120.40 119.35 2gcf s VAL 28 Ca 0.02 1.78 -0.31 0.00 0.00 0.00 0.00 61.98 63.48 2gcf s VAL 28 Cb 0.05 -4.14 -0.10 0.00 0.00 0.00 0.00 36.38 32.19 2gcf s VAL 28 CO 0.27 0.23 1.77 -2.16 0.00 0.00 0.00 175.10 175.21 2gcf s PRO 29 N 0.30 4.15 -0.01 2.72 0.04 -1.26 -1.17 135.00 139.77 2gcf s PRO 29 Ca 0.51 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.08 2gcf s PRO 29 Cb -0.26 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.74 2gcf s PRO 29 CO 0.31 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.96 2gcf n GLY 30 N 4.15 0.46 3.48 0.56 0.00 -1.26 -2.95 105.19 109.62 2gcf n GLY 30 Ca 0.17 -0.42 -0.45 0.00 0.00 0.00 0.00 46.02 45.32 2gcf n GLY 30 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2gcf n VAL 31 N -2.99 0.07 0.01 1.61 3.14 -0.32 -2.67 118.33 117.18 2gcf n VAL 31 Ca -0.00 -0.33 -0.16 0.00 -2.96 0.00 0.00 64.34 60.89 2gcf n VAL 31 Cb 0.01 -1.66 -0.14 0.00 -1.06 0.00 0.00 33.84 30.99 2gcf n VAL 31 CO 0.00 0.00 0.00 1.56 -6.46 0.00 0.00 176.83 171.93 2gcf h GLN 32 N 14.04 0.17 0.00 1.45 1.08 -0.83 -3.47 115.11 127.55 2gcf h GLN 32 Ca -0.21 -0.29 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 2gcf h GLN 32 Cb 1.31 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.85 2gcf h GLN 32 CO 1.14 0.95 0.00 0.45 -0.95 0.00 0.00 178.83 180.41 2gcf n SER 33 N -3.32 0.00 -4.79 1.46 2.88 -1.22 -4.98 113.62 103.65 2gcf n SER 33 Ca -0.24 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 56.94 2gcf n SER 33 Cb 1.05 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.44 2gcf n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2gcf s GLN 35 N -0.27 -0.02 -0.27 0.00 -0.21 -0.75 -5.04 119.66 113.11 2gcf s GLN 35 Ca 0.15 0.19 -0.22 0.00 0.02 0.00 0.00 55.36 55.51 2gcf s GLN 35 Cb -0.13 -0.22 0.07 0.00 1.00 0.00 0.00 33.01 33.74 2gcf s GLN 35 CO 0.04 -0.15 0.70 0.54 -2.12 0.00 0.00 175.29 174.29 2gcf s VAL 36 N 0.98 -0.00 -0.27 1.09 0.11 -1.26 -0.12 120.40 120.94 2gcf s VAL 36 Ca -0.08 0.00 0.01 0.00 -2.93 0.00 0.00 61.98 58.98 2gcf s VAL 36 Cb -0.12 -0.98 0.08 0.00 -1.53 0.00 0.00 36.38 33.83 2gcf s VAL 36 CO -0.03 0.00 -0.00 0.21 -3.33 0.00 0.00 175.10 171.95 2gcf s ASN 37 N 0.78 4.02 -1.27 3.54 3.84 -0.73 -5.01 114.94 120.11 2gcf s ASN 37 Ca -0.03 -1.44 -0.08 0.00 0.21 0.00 0.00 52.86 51.52 2gcf s ASN 37 Cb -0.05 -1.18 -0.08 0.00 -0.55 0.00 0.00 41.25 39.40 2gcf s ASN 37 CO -0.06 -0.30 2.60 0.33 -2.79 0.00 0.00 177.10 176.88 2gcf n PHE 38 N 4.64 1.88 0.00 0.43 -0.00 -1.26 -2.44 117.46 120.72 2gcf n PHE 38 Ca -0.07 -2.55 0.00 0.00 -0.00 0.00 0.00 57.45 54.83 2gcf n PHE 38 Cb 0.43 -2.10 0.00 0.00 -0.00 0.00 0.00 39.48 37.81 2gcf n PHE 38 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2gcf n ALA 39 N 3.82 0.00 -0.79 3.13 0.00 -1.26 -4.94 120.51 120.47 2gcf n ALA 39 Ca 0.63 0.00 0.02 0.00 0.00 0.00 0.00 53.44 54.09 2gcf n ALA 39 Cb 0.20 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.68 2gcf n ALA 39 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2gcf n LEU 40 N -0.43 1.27 0.00 0.00 7.94 -1.02 -5.03 117.00 119.72 2gcf n LEU 40 Ca 0.00 -1.58 0.00 0.00 -1.11 0.00 0.00 56.01 53.32 2gcf n LEU 40 Cb 0.00 -0.09 0.00 0.00 0.53 0.00 0.00 43.42 43.86 2gcf n LEU 40 CO 0.00 0.38 0.00 -0.62 -1.11 0.00 0.00 177.39 176.04 2gcf n GLU 41 N -0.50 0.00 -2.74 1.96 1.02 -1.10 -4.95 120.64 114.32 2gcf n GLU 41 Ca 0.03 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.79 2gcf n GLU 41 Cb 0.47 -3.21 -0.06 0.00 -0.02 0.00 0.00 31.44 28.61 2gcf n GLU 41 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2gcf s GLN 42 N -0.01 4.68 0.06 3.49 0.00 -1.26 -0.33 119.66 126.30 2gcf s GLN 42 Ca 0.00 1.43 0.08 0.00 -0.00 0.00 0.00 55.36 56.87 2gcf s GLN 42 Cb 0.00 -3.01 -0.03 0.00 0.00 0.00 0.00 33.01 29.97 2gcf s GLN 42 CO 0.00 0.35 -0.19 0.00 0.00 0.00 0.00 175.29 175.45 2gcf s ALA 43 N -1.41 2.57 -0.05 2.60 0.00 0.15 -1.78 121.76 123.84 2gcf s ALA 43 Ca 0.46 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 2gcf s ALA 43 Cb -0.23 -0.67 0.03 0.00 0.00 0.00 0.00 23.12 22.25 2gcf s ALA 43 CO 0.28 0.57 0.01 0.54 0.00 0.00 0.00 175.76 177.16 2gcf s VAL 44 N -0.97 0.22 -0.04 0.00 0.11 0.83 -1.45 120.40 119.10 2gcf s VAL 44 Ca 0.15 0.15 -0.02 0.00 -2.93 0.00 0.00 61.98 59.33 2gcf s VAL 44 Cb -0.10 -0.37 0.02 0.00 -1.53 0.00 0.00 36.38 34.40 2gcf s VAL 44 CO 0.06 0.20 0.09 -0.69 -3.33 0.00 0.00 175.10 171.44 2gcf s VAL 45 N 1.61 -0.03 -0.11 2.04 1.01 -0.46 -1.81 120.40 122.65 2gcf s VAL 45 Ca -0.01 0.11 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 2gcf s VAL 45 Cb -0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 2gcf s VAL 45 CO -0.03 0.05 0.00 -0.55 0.00 0.00 0.00 175.10 174.56 2gcf s SER 46 N 0.67 5.19 -0.21 3.32 0.15 -1.20 -1.08 113.70 120.54 2gcf s SER 46 Ca -0.05 0.08 0.07 0.00 0.70 0.00 0.00 55.95 56.75 2gcf s SER 46 Cb -0.07 -1.59 0.24 0.00 -1.71 0.00 0.00 66.02 62.88 2gcf s SER 46 CO -0.03 0.31 1.12 0.00 1.20 0.00 0.00 173.24 175.84 2gcf n TYR 47 N 2.60 -1.23 -3.73 3.44 4.11 -1.17 -0.07 117.16 121.11 2gcf n TYR 47 Ca -0.18 -1.03 -0.13 0.00 -0.00 0.00 0.00 57.90 56.56 2gcf n TYR 47 Cb 0.53 1.17 -0.10 0.00 -0.00 0.00 0.00 39.34 40.94 2gcf n TYR 47 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 2gcf s HIS 48 N 0.08 -0.46 0.00 -3.48 3.76 -1.09 -4.52 115.29 109.58 2gcf s HIS 48 Ca 0.06 1.12 0.00 0.00 -0.15 0.00 0.00 55.06 56.09 2gcf s HIS 48 Cb 0.26 0.16 0.00 0.00 1.11 0.00 0.00 32.58 34.11 2gcf s HIS 48 CO -0.07 -0.23 0.00 0.41 -0.85 0.00 0.00 174.74 173.99 2gcf n GLY 49 N 2.78 0.51 0.05 -2.22 0.00 -1.25 -4.66 105.19 100.41 2gcf n GLY 49 Ca -0.13 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.94 2gcf n GLY 49 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gcf n GLU 50 N 0.00 0.06 -3.60 1.61 4.71 -1.26 -4.68 120.64 117.48 2gcf n GLU 50 Ca 0.00 0.46 -0.14 0.00 -0.01 0.00 0.00 57.16 57.46 2gcf n GLU 50 Cb 0.00 -1.65 -0.07 0.00 -1.01 0.00 0.00 31.44 28.71 2gcf n GLU 50 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2gcf s THR 51 N -3.16 0.00 -0.30 2.62 2.01 -1.26 -5.15 115.64 110.39 2gcf s THR 51 Ca 0.02 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.80 2gcf s THR 51 Cb 0.05 -1.00 -0.00 0.00 0.01 0.00 0.00 72.50 71.56 2gcf s THR 51 CO 0.16 0.00 0.73 -0.89 -0.69 0.00 0.00 174.62 173.93 2gcf s THR 52 N -0.15 4.85 0.27 -0.82 2.01 -1.26 -4.86 115.64 115.69 2gcf s THR 52 Ca -0.03 1.08 -0.20 0.00 0.31 0.00 0.00 61.69 62.85 2gcf s THR 52 Cb -0.03 -4.09 -0.09 0.00 0.01 0.00 0.00 72.50 68.30 2gcf s THR 52 CO 0.03 -0.20 0.78 -2.16 -0.69 0.00 0.00 174.62 172.38 2gcf s PRO 53 N 2.82 4.26 0.49 4.92 0.04 -1.26 -4.97 135.00 141.30 2gcf s PRO 53 Ca 0.30 0.93 0.33 0.00 0.04 0.00 0.00 61.00 62.60 2gcf s PRO 53 Cb -0.14 -2.73 1.75 0.00 0.04 0.00 0.00 34.50 33.42 2gcf s PRO 53 CO 0.12 0.30 2.01 0.37 0.04 0.00 0.00 177.00 179.84 2gcf h GLN 54 N 3.04 0.00 0.00 4.56 4.15 -2.02 -2.10 115.11 122.75 2gcf h GLN 54 Ca -0.48 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.94 2gcf h GLN 54 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.88 2gcf h GLN 54 CO 0.65 0.00 0.27 0.82 -1.93 0.00 0.00 178.83 178.64 2gcf h ILE 55 N 0.00 0.00 -1.08 2.39 2.04 -1.98 -0.67 117.51 118.21 2gcf h ILE 55 Ca 0.00 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.15 2gcf h ILE 55 Cb 0.06 0.57 -0.07 0.00 -0.74 0.00 0.00 36.82 36.64 2gcf h ILE 55 CO 0.00 0.00 0.73 0.17 0.00 0.00 0.00 178.15 179.05 2gcf h LEU 56 N 0.00 0.25 0.00 1.44 8.10 -1.76 -2.83 115.31 120.51 2gcf h LEU 56 Ca 0.00 0.05 -0.08 0.00 0.11 0.00 0.00 57.88 57.96 2gcf h LEU 56 Cb 0.53 0.01 -0.01 0.00 -0.44 0.00 0.00 40.66 40.75 2gcf h LEU 56 CO 0.00 0.05 -0.73 0.71 -4.11 0.00 0.00 178.44 174.36 2gcf h THR 57 N 0.22 0.33 -1.19 0.15 1.35 -1.39 -3.42 112.91 108.95 2gcf h THR 57 Ca 0.57 -1.41 0.35 0.00 -0.55 0.00 0.00 66.41 65.37 2gcf h THR 57 Cb 1.78 0.78 -0.05 0.00 -1.73 0.00 0.00 68.15 68.94 2gcf h THR 57 CO -0.17 0.11 0.92 -0.78 -0.25 0.00 0.00 175.52 175.35 2gcf h ASP 58 N -1.00 0.00 0.00 5.36 3.58 -1.51 -0.19 116.42 122.66 2gcf h ASP 58 Ca -0.12 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.33 2gcf h ASP 58 Cb 0.75 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.80 2gcf h ASP 58 CO -0.07 0.00 0.06 0.00 -2.88 0.00 0.00 179.24 176.35 2gcf h ALA 59 N 1.28 1.06 -0.19 -0.78 0.00 -1.77 -1.76 119.26 117.11 2gcf h ALA 59 Ca 0.57 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.33 2gcf h ALA 59 Cb 2.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 20.19 2gcf h ALA 59 CO -0.01 -0.06 -0.48 -0.39 0.00 0.00 0.00 179.25 178.31 2gcf h VAL 60 N 0.00 1.32 0.00 0.00 -1.51 -1.35 -2.40 116.25 112.31 2gcf h VAL 60 Ca 0.00 -1.70 -0.00 0.00 -1.23 0.00 0.00 66.70 63.77 2gcf h VAL 60 Cb 0.12 1.70 -0.00 0.00 -2.13 0.00 0.00 31.29 30.98 2gcf h VAL 60 CO 0.00 0.53 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.52 2gcf h GLU 61 N 0.39 0.00 -0.78 5.19 3.07 -1.48 -2.61 114.58 118.36 2gcf h GLU 61 Ca 0.02 0.00 0.23 0.00 -0.50 0.00 0.00 59.36 59.11 2gcf h GLU 61 Cb 0.99 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.87 2gcf h GLU 61 CO 0.09 0.01 0.56 0.07 -1.40 0.00 0.00 179.01 178.35 2gcf h ARG 62 N 0.00 0.00 0.00 2.33 -0.00 -1.38 -0.78 114.38 114.55 2gcf h ARG 62 Ca -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2gcf h ARG 62 Cb 0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.04 2gcf h ARG 62 CO 0.00 0.00 -1.21 0.00 -0.00 0.00 0.00 179.97 178.76 2gcf n ALA 63 N -2.69 3.37 -0.37 0.08 0.00 -1.00 -4.98 120.51 114.91 2gcf n ALA 63 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2gcf n ALA 63 Cb 0.85 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2gcf n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gcf n GLY 64 N 1.35 0.79 0.00 0.00 0.00 -0.30 -5.07 105.19 101.96 2gcf n GLY 64 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2gcf n GLY 64 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gcf n TYR 65 N -2.37 0.00 -4.02 1.61 4.02 -1.10 -4.98 117.16 110.31 2gcf n TYR 65 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.75 2gcf n TYR 65 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2gcf n TYR 65 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 2gcf s HIS 66 N 2.46 0.86 0.27 -0.72 2.46 -1.24 -4.19 115.29 115.20 2gcf s HIS 66 Ca 0.00 -1.19 0.10 0.00 0.47 0.00 0.00 55.06 54.43 2gcf s HIS 66 Cb 0.00 0.13 -0.04 0.00 -0.13 0.00 0.00 32.58 32.54 2gcf s HIS 66 CO 0.00 -1.25 -0.01 0.00 -2.47 0.00 0.00 174.74 171.01 2gcf s ALA 67 N -2.83 3.15 -0.01 1.58 0.00 -1.26 -0.62 121.76 121.77 2gcf s ALA 67 Ca 0.27 -1.69 0.01 0.00 0.00 0.00 0.00 51.96 50.55 2gcf s ALA 67 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.39 2gcf s ALA 67 CO 0.19 0.25 -0.03 0.50 0.00 0.00 0.00 175.76 176.66 2gcf s ARG 68 N -3.67 0.38 -0.01 0.00 6.06 0.33 -4.62 118.95 117.42 2gcf s ARG 68 Ca 0.32 -0.10 -0.26 0.00 -2.50 0.00 0.00 55.73 53.19 2gcf s ARG 68 Cb -0.06 -0.41 -0.04 0.00 0.06 0.00 0.00 34.95 34.50 2gcf s ARG 68 CO 0.20 0.03 0.79 0.14 -2.50 0.00 0.00 175.30 173.96 2gcf s VAL 69 N 0.22 4.88 0.23 7.11 -7.23 -1.26 -0.55 120.40 123.80 2gcf s VAL 69 Ca -0.02 1.66 0.04 0.00 -1.81 0.00 0.00 61.98 61.85 2gcf s VAL 69 Cb -0.05 -4.14 -0.03 0.00 0.56 0.00 0.00 36.38 32.72 2gcf s VAL 69 CO -0.00 0.27 0.37 -1.48 -0.31 0.00 0.00 175.10 173.95 2gcf s LEU 70 N 0.52 4.28 -0.30 1.32 0.05 -1.26 -4.80 118.68 118.50 2gcf s LEU 70 Ca 0.41 0.15 -0.13 0.00 0.05 0.00 0.00 54.13 54.62 2gcf s LEU 70 Cb -0.20 -2.94 0.15 0.00 -2.05 0.00 0.00 46.19 41.15 2gcf s LEU 70 CO 0.22 -0.07 0.84 -0.75 -0.55 0.00 0.00 176.35 176.04 2gcf s LYS 71 N -3.84 0.42 0.08 1.48 2.20 -1.26 -5.02 119.74 113.80 2gcf s LYS 71 Ca 0.35 1.05 -0.27 0.00 -0.36 0.00 0.00 55.97 56.75 2gcf s LYS 71 Cb -0.10 0.62 0.09 0.00 -1.51 0.00 0.00 37.83 36.93 2gcf s LYS 71 CO 0.30 -0.14 1.12 -0.65 -0.36 0.00 0.00 175.35 175.61 2gcf s GLN 72 N 2.61 0.85 0.00 4.03 -1.52 -1.26 -5.27 119.66 119.10 2gcf s GLN 72 Ca -0.04 -0.49 0.00 0.00 -1.95 0.00 0.00 55.36 52.88 2gcf s GLN 72 Cb -0.09 0.28 0.00 0.00 -0.22 0.00 0.00 33.01 32.98 2gcf s GLN 72 CO -0.18 -0.39 0.00 0.94 -0.25 0.00 0.00 175.29 175.41