#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gcf n ALA 2 N 0.00 1.21 -3.68 -5.12 0.00 -1.26 -4.26 120.51 107.40 2gcf n ALA 2 Ca 0.00 -2.70 -0.30 0.00 0.00 0.00 0.00 53.44 50.44 2gcf n ALA 2 Cb 0.00 -3.47 -0.14 0.00 0.00 0.00 0.00 19.45 15.84 2gcf n ALA 2 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2gcf s GLN 3 N 7.22 0.75 -0.10 0.00 1.11 -1.26 -5.11 119.66 122.27 2gcf s GLN 3 Ca 0.73 -1.23 -0.22 0.00 0.01 0.00 0.00 55.36 54.65 2gcf s GLN 3 Cb 0.00 -1.88 -0.03 0.00 -1.01 0.00 0.00 33.01 30.09 2gcf s GLN 3 CO 0.18 -1.05 0.66 -0.08 0.01 0.00 0.00 175.29 175.00 2gcf s THR 4 N 1.35 5.06 -0.17 -0.19 -1.32 -1.26 -4.12 115.64 114.99 2gcf s THR 4 Ca 0.12 1.33 -0.06 0.00 -1.21 0.00 0.00 61.69 61.87 2gcf s THR 4 Cb -0.19 -3.99 -0.04 0.00 -1.51 0.00 0.00 72.50 66.77 2gcf s THR 4 CO -0.18 0.23 0.05 -0.63 -2.21 0.00 0.00 174.62 171.88 2gcf s ILE 5 N 0.99 4.69 -0.11 5.08 1.09 -0.03 -4.90 121.20 128.00 2gcf s ILE 5 Ca 0.34 -0.08 0.01 0.00 -1.10 0.00 0.00 60.65 59.82 2gcf s ILE 5 Cb -0.17 -3.09 -0.02 0.00 -1.06 0.00 0.00 42.46 38.12 2gcf s ILE 5 CO 0.15 0.49 -0.12 0.54 -0.10 0.00 0.00 174.94 175.90 2gcf s ASN 6 N 0.17 4.11 0.34 3.58 2.20 -1.26 -1.34 114.94 122.74 2gcf s ASN 6 Ca 0.04 -0.26 -0.14 0.00 -0.94 0.00 0.00 52.86 51.56 2gcf s ASN 6 Cb -0.12 -1.39 0.03 0.00 -2.00 0.00 0.00 41.25 37.77 2gcf s ASN 6 CO 0.01 0.23 0.68 -1.48 -2.94 0.00 0.00 177.10 173.59 2gcf s LEU 7 N -0.01 0.20 0.51 3.54 2.34 -0.41 -4.85 118.68 120.00 2gcf s LEU 7 Ca -0.03 -1.10 0.07 0.00 0.06 0.00 0.00 54.13 53.14 2gcf s LEU 7 Cb -0.14 2.42 0.05 0.00 -0.56 0.00 0.00 46.19 47.96 2gcf s LEU 7 CO 0.04 -1.49 0.70 -1.10 -1.06 0.00 0.00 176.35 173.45 2gcf s GLN 8 N -2.95 2.52 -0.23 1.48 -0.21 0.01 -0.49 119.66 119.79 2gcf s GLN 8 Ca 0.19 -1.34 -0.04 0.00 0.02 0.00 0.00 55.36 54.18 2gcf s GLN 8 Cb -0.04 -2.66 0.08 0.00 1.00 0.00 0.00 33.01 31.39 2gcf s GLN 8 CO 0.12 -0.62 0.12 -1.17 -2.12 0.00 0.00 175.29 171.62 2gcf s LEU 9 N -4.57 0.41 -1.24 2.90 0.20 -0.69 -1.28 118.68 114.42 2gcf s LEU 9 Ca 0.59 -0.93 -0.21 0.00 0.69 0.00 0.00 54.13 54.27 2gcf s LEU 9 Cb -0.08 -0.26 -0.02 0.00 -0.43 0.00 0.00 46.19 45.40 2gcf s LEU 9 CO 0.37 -0.39 1.85 -1.61 -0.29 0.00 0.00 176.35 176.27 2gcf s GLU 10 N 2.13 3.16 0.00 1.98 2.02 0.01 -4.45 118.70 123.55 2gcf s GLU 10 Ca 0.06 -1.54 0.00 0.00 0.02 0.00 0.00 54.97 53.51 2gcf s GLU 10 Cb -0.16 -5.38 0.00 0.00 0.10 0.00 0.00 34.13 28.69 2gcf s GLU 10 CO -0.23 -3.22 0.00 0.41 0.02 0.00 0.00 175.26 172.24 2gcf n GLY 11 N 5.63 0.45 4.01 -1.39 0.00 -1.26 -1.13 105.19 111.50 2gcf n GLY 11 Ca 0.47 0.47 -0.32 0.00 0.00 0.00 0.00 46.02 46.64 2gcf n GLY 11 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2gcf n MET 12 N 0.00 -1.43 -0.06 1.61 0.00 -1.26 -4.86 117.12 111.12 2gcf n MET 12 Ca 0.00 0.13 -0.12 0.00 0.00 0.00 0.00 57.70 57.71 2gcf n MET 12 Cb 0.00 -4.70 -0.06 0.00 0.00 0.00 0.00 33.22 28.47 2gcf n MET 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2gcf h ARG 13 N -0.69 0.32 0.00 3.17 2.47 -1.97 -3.44 114.38 114.23 2gcf h ARG 13 Ca -0.45 -0.10 0.00 0.00 -1.26 0.00 0.00 59.98 58.16 2gcf h ARG 13 Cb 1.29 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 2gcf h ARG 13 CO 0.67 0.54 0.00 0.00 0.56 0.00 0.00 179.97 181.74 2gcf s ALA 15 N 0.00 -1.20 -1.34 0.00 0.00 -1.26 -5.07 121.76 112.90 2gcf s ALA 15 Ca 0.00 0.15 0.10 0.00 0.00 0.00 0.00 51.96 52.22 2gcf s ALA 15 Cb 0.00 0.78 0.51 0.00 0.00 0.00 0.00 23.12 24.41 2gcf s ALA 15 CO 0.00 -0.71 1.25 0.00 0.00 0.00 0.00 175.76 176.30 2gcf n ALA 16 N -0.30 1.61 -0.27 0.00 0.00 -1.26 -3.70 120.51 116.60 2gcf n ALA 16 Ca -0.16 -0.05 0.33 0.00 0.00 0.00 0.00 53.44 53.56 2gcf n ALA 16 Cb 0.64 -1.17 0.74 0.00 0.00 0.00 0.00 19.45 19.66 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 1.44 -0.53 0.00 0.00 0.00 -1.90 -1.71 119.26 116.56 2gcf h ALA 18 Ca 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2gcf h ALA 18 Cb 2.08 0.20 0.00 0.00 0.00 0.00 0.00 17.79 20.07 2gcf h ALA 18 CO -0.01 -0.58 0.00 0.43 0.00 0.00 0.00 179.25 179.09 2gcf n SER 19 N -5.16 0.18 0.10 0.00 7.64 -1.22 -1.15 113.62 114.01 2gcf n SER 19 Ca -0.09 0.54 0.11 0.00 1.01 0.00 0.00 58.87 60.43 2gcf n SER 19 Cb 0.28 -0.58 0.45 0.00 -1.01 0.00 0.00 64.21 63.35 2gcf n SER 19 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2gcf n SER 20 N -1.69 0.50 0.27 6.43 2.88 -0.93 -0.95 113.62 120.14 2gcf n SER 20 Ca 0.04 0.63 -0.13 0.00 -1.33 0.00 0.00 58.87 58.08 2gcf n SER 20 Cb 0.23 -0.73 -0.06 0.00 -0.75 0.00 0.00 64.21 62.90 2gcf n SER 20 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 2gcf h ILE 21 N 0.00 0.14 -0.82 2.46 2.04 -0.23 -2.33 117.51 118.77 2gcf h ILE 21 Ca 0.00 -0.45 0.13 0.00 1.00 0.00 0.00 64.86 65.54 2gcf h ILE 21 Cb 0.33 0.21 -0.09 0.00 -0.74 0.00 0.00 36.82 36.53 2gcf h ILE 21 CO 0.00 0.03 0.42 -0.33 0.00 0.00 0.00 178.15 178.26 2gcf h GLU 22 N -1.13 0.61 0.00 2.37 5.08 -1.54 0.12 114.58 120.08 2gcf h GLU 22 Ca -0.08 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.20 2gcf h GLU 22 Cb 0.61 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2gcf h GLU 22 CO 0.12 0.40 -0.21 -0.09 -1.00 0.00 0.00 179.01 178.24 2gcf h ARG 23 N 0.63 0.00 0.21 2.33 9.65 -1.16 -0.11 114.38 125.93 2gcf h ARG 23 Ca 0.43 0.00 -0.31 0.00 -1.10 0.00 0.00 59.98 59.00 2gcf h ARG 23 Cb 0.57 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.18 2gcf h ARG 23 CO -0.34 0.21 -1.33 0.00 2.80 0.00 0.00 179.97 181.31 2gcf h ALA 24 N 1.79 -0.12 0.00 2.80 0.00 -0.34 -3.34 119.26 120.05 2gcf h ALA 24 Ca -0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 54.91 54.01 2gcf h ALA 24 Cb 0.70 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2gcf h ALA 24 CO 0.03 0.64 -0.42 0.82 0.00 0.00 0.00 179.25 180.32 2gcf h ILE 25 N 0.10 1.19 0.00 0.00 1.08 -0.76 -2.83 117.51 116.30 2gcf h ILE 25 Ca -0.22 -1.49 0.00 0.00 -0.39 0.00 0.00 64.86 62.75 2gcf h ILE 25 Cb 2.03 1.83 0.00 0.00 -3.07 0.00 0.00 36.82 37.61 2gcf h ILE 25 CO 0.25 0.41 0.15 0.00 -0.69 0.00 0.00 178.15 178.27 2gcf n ALA 26 N -2.41 0.70 0.42 1.87 0.00 -0.06 -0.25 120.51 120.78 2gcf n ALA 26 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.54 2gcf n ALA 26 Cb 0.47 -0.67 0.08 0.00 0.00 0.00 0.00 19.45 19.33 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 -1.29 0.39 -2.62 0.00 5.02 -1.07 -5.00 118.16 113.58 2gcf n LYS 27 Ca 0.00 0.08 -0.42 0.00 -2.02 0.00 0.00 58.31 55.95 2gcf n LYS 27 Cb 0.15 -1.71 -0.03 0.00 -0.02 0.00 0.00 35.03 33.42 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 -3.24 4.58 0.04 -0.18 1.01 0.66 -4.98 120.40 118.31 2gcf s VAL 28 Ca 0.03 1.88 -0.30 0.00 0.00 0.00 0.00 61.98 63.59 2gcf s VAL 28 Cb 0.12 -4.20 -0.08 0.00 0.00 0.00 0.00 36.38 32.22 2gcf s VAL 28 CO 0.76 0.16 1.68 -2.16 0.00 0.00 0.00 175.10 175.54 2gcf s PRO 29 N 0.92 4.19 0.00 2.72 0.04 -1.26 -1.45 135.00 140.16 2gcf s PRO 29 Ca 0.53 2.33 0.00 0.00 0.04 0.00 0.00 61.00 63.90 2gcf s PRO 29 Cb -0.24 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.59 2gcf s PRO 29 CO 0.29 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.96 2gcf n GLY 30 N 4.06 0.76 3.61 0.56 0.00 -1.26 -1.36 105.19 111.55 2gcf n GLY 30 Ca 0.16 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.24 0.46 -0.10 1.61 3.14 -0.53 -2.67 118.33 118.00 2gcf n VAL 31 Ca 0.00 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.14 2gcf n VAL 31 Cb 0.00 -2.07 0.00 0.00 -1.06 0.00 0.00 33.84 30.71 2gcf n VAL 31 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2gcf n GLN 32 N 7.66 -0.41 0.00 1.45 -0.00 -0.05 -4.96 117.38 121.07 2gcf n GLN 32 Ca 0.28 -0.58 0.00 0.00 -0.00 0.00 0.00 57.00 56.70 2gcf n GLN 32 Cb 0.34 -0.95 0.00 0.00 -0.00 0.00 0.00 30.24 29.63 2gcf n GLN 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2gcf n SER 33 N -0.06 0.00 -4.91 2.61 2.88 -1.22 -4.93 113.62 107.99 2gcf n SER 33 Ca 0.00 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 2gcf n SER 33 Cb 0.06 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 63.57 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 -5.18 0.06 0.29 0.00 -0.21 -0.81 -4.97 119.66 108.84 2gcf s GLN 35 Ca 0.57 0.14 0.09 0.00 0.02 0.00 0.00 55.36 56.18 2gcf s GLN 35 Cb -0.11 0.08 -0.06 0.00 1.00 0.00 0.00 33.01 33.92 2gcf s GLN 35 CO 0.47 -0.02 -0.11 0.14 -2.12 0.00 0.00 175.29 173.65 2gcf s VAL 36 N 1.97 2.00 -0.30 1.09 -7.23 -1.26 -0.14 120.40 116.52 2gcf s VAL 36 Ca -0.01 -2.21 -0.03 0.00 -1.81 0.00 0.00 61.98 57.92 2gcf s VAL 36 Cb -0.01 -2.43 0.11 0.00 0.56 0.00 0.00 36.38 34.61 2gcf s VAL 36 CO -0.16 -0.33 0.15 0.21 -0.31 0.00 0.00 175.10 174.67 2gcf s ASN 37 N -3.49 3.36 0.00 4.85 3.84 0.19 -4.98 114.94 118.71 2gcf s ASN 37 Ca 0.30 -1.48 0.00 0.00 0.21 0.00 0.00 52.86 51.88 2gcf s ASN 37 Cb 0.01 -0.34 0.00 0.00 -0.55 0.00 0.00 41.25 40.37 2gcf s ASN 37 CO 0.13 -0.41 0.73 0.49 -2.79 0.00 0.00 177.10 175.25 2gcf n PHE 38 N 4.97 0.00 0.00 0.43 3.72 -1.26 -1.47 117.46 123.85 2gcf n PHE 38 Ca -0.02 -0.31 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 2gcf n PHE 38 Cb 0.41 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 2gcf n PHE 38 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2gcf n ALA 39 N 0.44 1.41 -1.62 4.37 0.00 -1.26 -4.86 120.51 118.99 2gcf n ALA 39 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2gcf n ALA 39 Cb 0.36 0.09 0.15 0.00 0.00 0.00 0.00 19.45 20.05 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 -1.08 2.21 0.00 0.00 7.94 -1.18 -5.03 117.00 119.87 2gcf n LEU 40 Ca 0.00 -3.26 0.00 0.00 -1.11 0.00 0.00 56.01 51.64 2gcf n LEU 40 Cb 0.15 -0.40 0.00 0.00 0.53 0.00 0.00 43.42 43.70 2gcf n LEU 40 CO 0.00 1.04 0.00 -0.62 -1.11 0.00 0.00 177.39 176.70 2gcf n GLU 41 N -0.91 0.00 -1.46 1.96 1.02 -0.54 -4.95 120.64 115.77 2gcf n GLU 41 Ca 0.15 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.98 2gcf n GLU 41 Cb 0.74 -2.93 0.07 0.00 -0.02 0.00 0.00 31.44 29.31 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 0.00 2.55 0.06 3.49 0.00 -1.24 -1.70 119.66 122.83 2gcf s GLN 42 Ca 0.00 0.97 0.07 0.00 -0.00 0.00 0.00 55.36 56.41 2gcf s GLN 42 Cb 0.00 -1.94 -0.03 0.00 0.00 0.00 0.00 33.01 31.04 2gcf s GLN 42 CO 0.00 -1.38 -0.21 0.00 0.00 0.00 0.00 175.29 173.71 2gcf s ALA 43 N -3.01 1.75 -0.05 2.60 0.00 0.36 -0.64 121.76 122.77 2gcf s ALA 43 Ca 0.60 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 51.47 2gcf s ALA 43 Cb -0.15 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.67 2gcf s ALA 43 CO 0.55 0.38 -0.11 0.54 0.00 0.00 0.00 175.76 177.12 2gcf s VAL 44 N -0.92 1.00 -0.19 0.00 0.11 0.80 -1.29 120.40 119.91 2gcf s VAL 44 Ca 0.07 -0.42 -0.16 0.00 -2.93 0.00 0.00 61.98 58.54 2gcf s VAL 44 Cb -0.09 -0.92 0.05 0.00 -1.53 0.00 0.00 36.38 33.89 2gcf s VAL 44 CO 0.03 0.32 0.50 -0.69 -3.33 0.00 0.00 175.10 171.92 2gcf s VAL 45 N 0.58 -0.00 -0.19 2.04 1.01 -0.45 -1.92 120.40 121.46 2gcf s VAL 45 Ca -0.11 0.01 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 2gcf s VAL 45 Cb -0.14 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2gcf s VAL 45 CO 0.03 0.01 0.06 -0.55 0.00 0.00 0.00 175.10 174.64 2gcf s SER 46 N 0.53 5.52 -0.36 3.32 0.15 -1.25 -0.86 113.70 120.75 2gcf s SER 46 Ca -0.02 0.03 0.13 0.00 0.70 0.00 0.00 55.95 56.79 2gcf s SER 46 Cb -0.04 -1.95 0.41 0.00 -1.71 0.00 0.00 66.02 62.73 2gcf s SER 46 CO -0.03 0.15 1.37 0.00 1.20 0.00 0.00 173.24 175.93 2gcf n TYR 47 N 3.71 -1.64 -3.68 3.44 4.11 -1.23 -0.87 117.16 121.01 2gcf n TYR 47 Ca -0.16 -1.96 -0.14 0.00 -0.00 0.00 0.00 57.90 55.64 2gcf n TYR 47 Cb 0.52 1.23 -0.14 0.00 -0.00 0.00 0.00 39.34 40.96 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 -0.51 -0.33 0.00 -3.48 3.76 -1.09 -4.61 115.29 109.03 2gcf s HIS 48 Ca 0.18 0.83 0.00 0.00 -0.15 0.00 0.00 55.06 55.92 2gcf s HIS 48 Cb 0.42 -0.08 0.00 0.00 1.11 0.00 0.00 32.58 34.03 2gcf s HIS 48 CO -0.09 -0.30 0.00 0.41 -0.85 0.00 0.00 174.74 173.91 2gcf n GLY 49 N 5.10 0.72 0.27 -2.22 0.00 -0.47 -2.07 105.19 106.53 2gcf n GLY 49 Ca -0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.89 2gcf n GLY 49 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2gcf h GLU 50 N 0.00 0.72 0.00 1.61 9.09 -1.96 -0.12 114.58 123.92 2gcf h GLU 50 Ca 0.00 -0.04 -0.41 0.00 0.05 0.00 0.00 59.36 58.96 2gcf h GLU 50 Cb 0.00 -0.16 0.12 0.00 -1.65 0.00 0.00 28.75 27.06 2gcf h GLU 50 CO 0.00 0.48 0.24 0.25 0.05 0.00 0.00 179.01 180.03 2gcf n THR 51 N -4.75 0.00 -3.74 -1.06 -2.24 -1.26 -4.36 114.28 96.87 2gcf n THR 51 Ca 0.09 -1.17 -0.34 0.00 -2.27 0.00 0.00 64.05 60.36 2gcf n THR 51 Cb 0.18 -1.24 -0.09 0.00 -2.10 0.00 0.00 70.33 67.08 2gcf n THR 51 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2gcf s THR 52 N -3.23 3.71 0.10 4.28 2.01 -1.26 -0.90 115.64 120.34 2gcf s THR 52 Ca 0.65 -3.59 -0.30 0.00 0.31 0.00 0.00 61.69 58.76 2gcf s THR 52 Cb -0.03 -3.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.05 2gcf s THR 52 CO 0.44 -0.98 0.96 -2.16 -0.69 0.00 0.00 174.62 172.19 2gcf s PRO 53 N -0.84 4.68 0.00 4.92 0.04 -1.26 -4.94 135.00 137.59 2gcf s PRO 53 Ca 0.22 1.43 0.09 0.00 0.04 0.00 0.00 61.00 62.79 2gcf s PRO 53 Cb -0.13 -3.38 0.54 0.00 0.04 0.00 0.00 34.50 31.56 2gcf s PRO 53 CO -0.09 0.19 0.95 0.00 0.04 0.00 0.00 177.00 178.10 2gcf n GLN 54 N 2.90 0.36 0.20 4.56 10.64 -1.26 -2.27 117.38 132.50 2gcf n GLN 54 Ca 0.02 0.00 0.17 0.00 -1.83 0.00 0.00 57.00 55.36 2gcf n GLN 54 Cb 0.49 -1.39 0.69 0.00 -0.86 0.00 0.00 30.24 29.17 2gcf n GLN 54 CO 0.00 0.00 0.00 0.82 -1.83 0.00 0.00 177.06 176.05 2gcf h ILE 55 N 0.00 0.15 -1.14 -0.39 1.08 -1.96 -0.61 117.51 114.64 2gcf h ILE 55 Ca 0.00 0.00 0.32 0.00 -0.39 0.00 0.00 64.86 64.79 2gcf h ILE 55 Cb 0.00 0.55 -0.06 0.00 -3.07 0.00 0.00 36.82 34.23 2gcf h ILE 55 CO 0.00 0.00 0.80 0.17 -0.69 0.00 0.00 178.15 178.43 2gcf h LEU 56 N 0.00 0.13 0.00 1.44 8.10 -1.77 -2.35 115.31 120.86 2gcf h LEU 56 Ca 0.12 0.03 -0.34 0.00 0.11 0.00 0.00 57.88 57.79 2gcf h LEU 56 Cb 1.13 0.01 -0.05 0.00 -0.44 0.00 0.00 40.66 41.30 2gcf h LEU 56 CO -0.00 0.02 -1.94 0.41 -4.11 0.00 0.00 178.44 172.82 2gcf n THR 57 N -4.32 1.53 -0.32 0.15 -1.04 -0.24 -4.56 114.28 105.47 2gcf n THR 57 Ca 0.26 -0.21 0.13 0.00 -2.04 0.00 0.00 64.05 62.19 2gcf n THR 57 Cb 1.14 -1.98 0.28 0.00 -1.82 0.00 0.00 70.33 67.96 2gcf n THR 57 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 2gcf h ASP 58 N -1.00 -0.30 0.78 8.00 3.58 -1.41 0.23 116.42 126.29 2gcf h ASP 58 Ca -0.52 0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.17 2gcf h ASP 58 Cb 1.44 0.40 0.00 0.00 1.72 0.00 0.00 39.33 42.88 2gcf h ASP 58 CO -0.31 -0.28 0.00 0.00 -2.88 0.00 0.00 179.24 175.77 2gcf n ALA 59 N -2.95 1.70 0.03 -0.78 0.00 -0.90 -1.10 120.51 116.50 2gcf n ALA 59 Ca 0.22 0.08 -0.17 0.00 0.00 0.00 0.00 53.44 53.57 2gcf n ALA 59 Cb 0.71 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.63 2gcf n ALA 59 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2gcf h VAL 60 N 0.00 0.91 -0.69 0.00 2.07 -0.81 -3.37 116.25 114.35 2gcf h VAL 60 Ca 0.00 -2.61 -0.05 0.00 0.82 0.00 0.00 66.70 64.86 2gcf h VAL 60 Cb 0.39 2.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.75 2gcf h VAL 60 CO 0.00 0.79 0.24 -0.33 0.02 0.00 0.00 177.57 178.28 2gcf h GLU 61 N 0.06 1.06 -0.45 1.57 4.39 -0.85 -2.01 114.58 118.35 2gcf h GLU 61 Ca -0.32 -0.22 0.13 0.00 0.34 0.00 0.00 59.36 59.30 2gcf h GLU 61 Cb 2.03 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 30.50 2gcf h GLU 61 CO 0.13 0.90 1.01 -0.09 -1.16 0.00 0.00 179.01 179.80 2gcf h ARG 62 N 1.01 0.00 -0.01 2.33 1.12 -1.27 -0.29 114.38 117.26 2gcf h ARG 62 Ca 0.23 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.10 2gcf h ARG 62 Cb 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.23 2gcf h ARG 62 CO -0.01 0.00 -0.54 0.00 -3.11 0.00 0.00 179.97 176.30 2gcf n ALA 63 N -1.89 3.69 -0.62 2.80 0.00 -0.77 -4.96 120.51 118.77 2gcf n ALA 63 Ca 0.10 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2gcf n ALA 63 Cb 1.15 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 1.37 0.73 3.79 0.00 0.00 -0.12 -4.89 105.19 106.07 2gcf n GLY 64 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 2gcf n GLY 64 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gcf s TYR 65 N -2.38 1.97 0.03 1.61 2.02 -1.12 -4.97 117.35 114.50 2gcf s TYR 65 Ca 0.00 -0.83 0.03 0.00 -0.37 0.00 0.00 57.07 55.90 2gcf s TYR 65 Cb 0.00 -1.78 -0.02 0.00 -0.40 0.00 0.00 41.96 39.76 2gcf s TYR 65 CO 0.00 0.02 -0.10 -1.01 -1.57 0.00 0.00 175.55 172.89 2gcf s HIS 66 N -2.78 0.91 -0.80 2.71 3.76 -0.29 -3.61 115.29 115.19 2gcf s HIS 66 Ca 0.23 -0.32 -0.26 0.00 -0.15 0.00 0.00 55.06 54.56 2gcf s HIS 66 Cb 0.01 -0.55 0.03 0.00 1.11 0.00 0.00 32.58 33.19 2gcf s HIS 66 CO 0.13 -0.01 1.35 0.00 -0.85 0.00 0.00 174.74 175.36 2gcf s ALA 67 N -0.76 2.71 -0.35 -1.40 0.00 -1.26 -0.81 121.76 119.88 2gcf s ALA 67 Ca -0.01 -1.55 -0.27 0.00 0.00 0.00 0.00 51.96 50.13 2gcf s ALA 67 Cb -0.07 -4.33 0.01 0.00 0.00 0.00 0.00 23.12 18.74 2gcf s ALA 67 CO 0.01 -3.41 0.96 0.50 0.00 0.00 0.00 175.76 173.82 2gcf s ARG 68 N 5.62 3.91 -0.00 0.00 6.06 -0.40 -4.94 118.95 129.20 2gcf s ARG 68 Ca 0.39 0.71 -0.30 0.00 -2.50 0.00 0.00 55.73 54.03 2gcf s ARG 68 Cb -0.06 -3.78 -0.05 0.00 0.06 0.00 0.00 34.95 31.12 2gcf s ARG 68 CO 0.09 -0.93 1.29 0.14 -2.50 0.00 0.00 175.30 173.39 2gcf s VAL 69 N 3.51 3.95 0.15 7.11 -7.23 -1.26 -0.81 120.40 125.82 2gcf s VAL 69 Ca 0.40 1.33 0.06 0.00 -1.81 0.00 0.00 61.98 61.96 2gcf s VAL 69 Cb -0.12 -3.86 -0.04 0.00 0.56 0.00 0.00 36.38 32.93 2gcf s VAL 69 CO 0.18 0.03 0.06 -1.48 -0.31 0.00 0.00 175.10 173.58 2gcf s LEU 70 N 1.98 3.57 -0.23 1.32 0.05 -1.26 -4.89 118.68 119.22 2gcf s LEU 70 Ca 0.60 -0.23 -0.04 0.00 0.05 0.00 0.00 54.13 54.50 2gcf s LEU 70 Cb -0.29 -2.21 0.12 0.00 -2.05 0.00 0.00 46.19 41.75 2gcf s LEU 70 CO 0.26 0.10 0.39 -0.54 -0.55 0.00 0.00 176.35 176.00 2gcf s LYS 71 N -2.91 0.34 0.05 1.48 1.02 -1.26 -5.05 119.74 113.41 2gcf s LYS 71 Ca 0.29 0.72 0.04 0.00 0.02 0.00 0.00 55.97 57.04 2gcf s LYS 71 Cb -0.10 -0.18 -0.24 0.00 -0.52 0.00 0.00 37.83 36.79 2gcf s LYS 71 CO 0.21 -0.50 1.02 0.37 -0.92 0.00 0.00 175.35 175.53 2gcf h GLN 72 N 8.18 0.10 0.00 1.68 4.15 -2.04 -3.56 115.11 123.62 2gcf h GLN 72 Ca -0.18 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.07 2gcf h GLN 72 Cb 1.14 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2gcf h GLN 72 CO 0.22 0.96 0.00 0.00 -1.93 0.00 0.00 178.83 178.07