#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 0.00 -1.78 -5.12 0.00 -1.26 -5.10 120.51 107.24 2gcf n ALA 2 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2gcf n ALA 2 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2gcf n ALA 2 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2gcf s GLN 3 N -1.37 3.92 0.07 0.00 2.00 -1.26 -5.09 119.66 117.93 2gcf s GLN 3 Ca 0.00 1.52 0.01 0.00 -2.00 0.00 0.00 55.36 54.90 2gcf s GLN 3 Cb 0.00 -2.34 -0.04 0.00 0.80 0.00 0.00 33.01 31.43 2gcf s GLN 3 CO 0.00 -0.36 -0.06 -0.08 -0.50 0.00 0.00 175.29 174.29 2gcf s THR 4 N -1.74 0.56 -0.03 -0.34 -1.32 -1.26 -4.36 115.64 107.14 2gcf s THR 4 Ca 0.63 -1.62 0.07 0.00 -1.21 0.00 0.00 61.69 59.56 2gcf s THR 4 Cb -0.22 -1.27 -0.01 0.00 -1.51 0.00 0.00 72.50 69.48 2gcf s THR 4 CO 0.27 -0.73 -0.23 -0.63 -2.21 0.00 0.00 174.62 171.09 2gcf s ILE 5 N -2.89 1.85 -0.02 5.08 1.09 -0.90 -4.99 121.20 120.42 2gcf s ILE 5 Ca 0.03 -0.99 0.07 0.00 -1.10 0.00 0.00 60.65 58.67 2gcf s ILE 5 Cb 0.00 -1.54 -0.02 0.00 -1.06 0.00 0.00 42.46 39.84 2gcf s ILE 5 CO -0.04 0.52 -0.24 0.54 -0.10 0.00 0.00 174.94 175.63 2gcf s ASN 6 N -0.41 3.25 0.30 3.58 6.03 -1.26 -1.33 114.94 125.10 2gcf s ASN 6 Ca 0.05 -0.42 -0.19 0.00 -1.03 0.00 0.00 52.86 51.28 2gcf s ASN 6 Cb -0.10 -0.44 0.06 0.00 -3.03 0.00 0.00 41.25 37.74 2gcf s ASN 6 CO 0.00 0.32 0.88 -1.48 -2.03 0.00 0.00 177.10 174.79 2gcf s LEU 7 N -0.67 -0.02 0.32 3.54 2.34 -0.54 -4.97 118.68 118.69 2gcf s LEU 7 Ca 0.10 -0.93 0.04 0.00 0.06 0.00 0.00 54.13 53.41 2gcf s LEU 7 Cb -0.10 2.56 -0.02 0.00 -0.56 0.00 0.00 46.19 48.07 2gcf s LEU 7 CO -0.01 -1.40 0.47 -1.10 -1.06 0.00 0.00 176.35 173.25 2gcf s GLN 8 N -2.38 3.27 0.11 1.48 -0.21 -0.48 -0.54 119.66 120.90 2gcf s GLN 8 Ca 0.17 -0.76 0.10 0.00 0.02 0.00 0.00 55.36 54.90 2gcf s GLN 8 Cb -0.04 -2.78 -0.04 0.00 1.00 0.00 0.00 33.01 31.15 2gcf s GLN 8 CO 0.09 0.15 -0.26 -1.17 -2.12 0.00 0.00 175.29 171.97 2gcf s LEU 9 N -4.19 2.28 -0.03 2.90 2.96 0.16 -0.96 118.68 121.81 2gcf s LEU 9 Ca 0.41 -0.70 0.06 0.00 -0.22 0.00 0.00 54.13 53.68 2gcf s LEU 9 Cb -0.09 -1.19 -0.01 0.00 0.50 0.00 0.00 46.19 45.39 2gcf s LEU 9 CO 0.32 0.18 -0.22 -0.70 -1.32 0.00 0.00 176.35 174.62 2gcf s GLU 10 N -1.85 1.88 0.00 1.98 2.12 0.63 -4.48 118.70 118.99 2gcf s GLU 10 Ca 0.13 -0.78 0.00 0.00 0.36 0.00 0.00 54.97 54.68 2gcf s GLU 10 Cb -0.10 -1.76 0.00 0.00 0.26 0.00 0.00 34.13 32.53 2gcf s GLU 10 CO 0.05 0.43 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 2gcf n GLY 11 N 2.68 2.13 3.55 -1.50 0.00 -1.26 -0.76 105.19 110.01 2gcf n GLY 11 Ca -0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.88 0.53 -3.66 1.61 0.00 -1.26 -4.87 117.12 107.58 2gcf n MET 12 Ca 0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 57.70 57.12 2gcf n MET 12 Cb 0.00 -3.11 -0.08 0.00 0.00 0.00 0.00 33.22 30.03 2gcf n MET 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2gcf s ARG 13 N 8.51 0.50 1.41 3.17 1.81 -1.26 -5.04 118.95 128.04 2gcf s ARG 13 Ca 1.02 1.10 0.00 0.00 -1.72 0.00 0.00 55.73 56.14 2gcf s ARG 13 Cb -0.31 0.29 0.00 0.00 -0.45 0.00 0.00 34.95 34.47 2gcf s ARG 13 CO 0.22 -0.19 0.00 0.00 -0.68 0.00 0.00 175.30 174.65 2gcf n ALA 15 N -0.58 -1.11 0.81 0.00 0.00 -1.26 -4.28 120.51 114.08 2gcf n ALA 15 Ca 0.00 0.13 0.13 0.00 0.00 0.00 0.00 53.44 53.70 2gcf n ALA 15 Cb 0.16 -0.38 0.40 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.66 2.67 -0.38 0.00 0.00 -1.26 -4.55 120.51 116.33 2gcf n ALA 16 Ca 0.00 -0.16 0.29 0.00 0.00 0.00 0.00 53.44 53.58 2gcf n ALA 16 Cb 0.19 -1.34 0.57 0.00 0.00 0.00 0.00 19.45 18.87 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 1.65 -0.84 0.00 0.00 0.00 -1.80 -2.87 119.26 115.39 2gcf h ALA 18 Ca 0.72 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2gcf h ALA 18 Cb 2.02 0.29 0.00 0.00 0.00 0.00 0.00 17.79 20.10 2gcf h ALA 18 CO -0.40 -0.79 0.00 0.45 0.00 0.00 0.00 179.25 178.51 2gcf n SER 19 N -4.85 0.78 0.11 0.00 2.88 -1.15 -1.48 113.62 109.91 2gcf n SER 19 Ca -0.09 0.61 0.09 0.00 -1.33 0.00 0.00 58.87 58.15 2gcf n SER 19 Cb 0.29 -0.81 0.44 0.00 -0.75 0.00 0.00 64.21 63.38 2gcf n SER 19 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2gcf n SER 20 N -2.27 0.43 0.07 -3.46 2.88 -0.48 -1.50 113.62 109.29 2gcf n SER 20 Ca 0.04 0.68 -0.03 0.00 -1.33 0.00 0.00 58.87 58.23 2gcf n SER 20 Cb 0.36 -0.74 -0.01 0.00 -0.75 0.00 0.00 64.21 63.06 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 0.00 -0.53 2.46 2.04 -1.03 -3.28 117.51 117.17 2gcf h ILE 21 Ca 0.00 -0.17 0.11 0.00 1.00 0.00 0.00 64.86 65.80 2gcf h ILE 21 Cb 0.08 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.06 2gcf h ILE 21 CO 0.00 0.00 -0.15 -0.33 0.00 0.00 0.00 178.15 177.67 2gcf h GLU 22 N -0.36 -0.03 0.00 2.37 5.08 -1.53 0.22 114.58 120.33 2gcf h GLU 22 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2gcf h GLU 22 Cb 0.15 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2gcf h GLU 22 CO 0.03 -0.02 0.00 -0.09 -1.00 0.00 0.00 179.01 177.94 2gcf h ARG 23 N -0.03 0.00 0.19 2.33 2.43 -1.49 -0.18 114.38 117.64 2gcf h ARG 23 Ca 0.25 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.14 2gcf h ARG 23 Cb 0.41 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 29.99 2gcf h ARG 23 CO -0.56 0.00 -1.32 0.00 -1.51 0.00 0.00 179.97 176.59 2gcf h ALA 24 N 2.39 -0.04 -0.18 2.80 0.00 -1.08 -3.36 119.26 119.78 2gcf h ALA 24 Ca 0.00 -0.89 -0.06 0.00 0.00 0.00 0.00 54.91 53.96 2gcf h ALA 24 Cb 0.58 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2gcf h ALA 24 CO 0.00 0.67 -0.15 0.82 0.00 0.00 0.00 179.25 180.59 2gcf h ILE 25 N -0.08 1.20 0.00 0.00 2.04 -0.87 -2.14 117.51 117.66 2gcf h ILE 25 Ca -0.24 -0.91 0.00 0.00 1.00 0.00 0.00 64.86 64.70 2gcf h ILE 25 Cb 1.94 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 2gcf h ILE 25 CO 0.19 0.29 0.24 0.00 0.00 0.00 0.00 178.15 178.86 2gcf n ALA 26 N -2.49 0.65 0.94 1.87 0.00 -0.10 -0.06 120.51 121.32 2gcf n ALA 26 Ca -0.00 0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.63 2gcf n ALA 26 Cb 0.30 -0.76 0.10 0.00 0.00 0.00 0.00 19.45 19.09 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 -1.77 0.04 -2.92 0.00 5.02 -0.80 -4.97 118.16 112.76 2gcf n LYS 27 Ca -0.01 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.88 2gcf n LYS 27 Cb 0.25 -1.51 -0.04 0.00 -0.02 0.00 0.00 35.03 33.70 2gcf n LYS 27 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2gcf s VAL 28 N -3.03 4.94 -0.02 -0.18 0.11 0.92 -4.96 120.40 118.18 2gcf s VAL 28 Ca 0.09 1.68 0.30 0.00 -2.93 0.00 0.00 61.98 61.12 2gcf s VAL 28 Cb 0.17 -4.15 0.31 0.00 -1.53 0.00 0.00 36.38 31.18 2gcf s VAL 28 CO 0.77 0.24 1.90 1.55 -3.33 0.00 0.00 175.10 176.23 2gcf h PRO 29 N 6.60 0.00 0.00 1.54 0.13 -1.93 -2.07 132.00 136.26 2gcf h PRO 29 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2gcf h PRO 29 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2gcf h PRO 29 CO 0.75 0.00 -0.07 0.41 -0.23 0.00 0.00 178.00 178.86 2gcf n GLY 30 N -0.65 -1.60 3.67 1.56 0.00 -1.26 -4.88 105.19 102.02 2gcf n GLY 30 Ca -0.00 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2gcf n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gcf s VAL 31 N -3.07 3.28 -0.35 1.61 0.11 -0.78 -3.18 120.40 118.02 2gcf s VAL 31 Ca 0.11 0.43 0.04 0.00 -2.93 0.00 0.00 61.98 59.64 2gcf s VAL 31 Cb 0.15 -3.28 -0.01 0.00 -1.53 0.00 0.00 36.38 31.71 2gcf s VAL 31 CO 0.59 -0.03 0.37 0.00 -3.33 0.00 0.00 175.10 172.70 2gcf n GLN 32 N 6.98 3.14 -3.64 1.54 -0.00 0.74 -4.97 117.38 121.17 2gcf n GLN 32 Ca 0.18 -0.32 -0.04 0.00 -0.00 0.00 0.00 57.00 56.82 2gcf n GLN 32 Cb 0.42 -0.86 -0.06 0.00 -0.00 0.00 0.00 30.24 29.74 2gcf n GLN 32 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.06 175.94 2gcf s SER 33 N -0.97 -0.10 0.26 2.61 0.01 -1.19 -4.96 113.70 109.36 2gcf s SER 33 Ca 0.03 0.18 0.11 0.00 1.31 0.00 0.00 55.95 57.58 2gcf s SER 33 Cb 0.03 0.17 -0.05 0.00 0.21 0.00 0.00 66.02 66.39 2gcf s SER 33 CO 0.12 -0.05 -0.17 0.00 0.41 0.00 0.00 173.24 173.55 2gcf s GLN 35 N -3.34 0.12 -0.02 0.00 -0.21 -0.70 -4.98 119.66 110.53 2gcf s GLN 35 Ca 0.28 0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.88 2gcf s GLN 35 Cb -0.06 0.04 0.02 0.00 1.00 0.00 0.00 33.01 34.02 2gcf s GLN 35 CO 0.15 -0.03 0.01 0.54 -2.12 0.00 0.00 175.29 173.84 2gcf s VAL 36 N 1.25 0.08 -0.48 1.09 0.11 -1.26 -0.06 120.40 121.13 2gcf s VAL 36 Ca -0.07 0.12 -0.16 0.00 -2.93 0.00 0.00 61.98 58.94 2gcf s VAL 36 Cb -0.02 -0.18 0.08 0.00 -1.53 0.00 0.00 36.38 34.73 2gcf s VAL 36 CO -0.12 0.11 0.42 0.21 -3.33 0.00 0.00 175.10 172.39 2gcf s ASN 37 N 0.90 6.16 -0.02 3.54 3.84 0.10 -4.97 114.94 124.48 2gcf s ASN 37 Ca -0.08 -1.34 -0.00 0.00 0.21 0.00 0.00 52.86 51.65 2gcf s ASN 37 Cb -0.12 -2.19 0.02 0.00 -0.55 0.00 0.00 41.25 38.41 2gcf s ASN 37 CO -0.02 -0.68 1.90 0.33 -2.79 0.00 0.00 177.10 175.84 2gcf n PHE 38 N 5.27 0.12 0.00 0.43 7.35 -1.26 -2.25 117.46 127.12 2gcf n PHE 38 Ca -0.12 -1.02 0.00 0.00 -0.76 0.00 0.00 57.45 55.55 2gcf n PHE 38 Cb 0.43 -0.51 0.00 0.00 0.35 0.00 0.00 39.48 39.76 2gcf n PHE 38 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2gcf n ALA 39 N 1.31 0.76 -0.95 3.13 0.00 -1.26 -4.93 120.51 118.57 2gcf n ALA 39 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.55 2gcf n ALA 39 Cb 0.51 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.10 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 -0.93 2.51 0.00 0.00 7.94 -1.13 -5.03 117.00 120.37 2gcf n LEU 40 Ca 0.00 -2.97 0.00 0.00 -1.11 0.00 0.00 56.01 51.93 2gcf n LEU 40 Cb 0.00 -0.40 0.00 0.00 0.53 0.00 0.00 43.42 43.55 2gcf n LEU 40 CO 0.00 0.69 0.00 -0.62 -1.11 0.00 0.00 177.39 176.35 2gcf n GLU 41 N -1.22 0.00 -2.15 1.96 1.02 -0.95 -4.97 120.64 114.32 2gcf n GLU 41 Ca 0.15 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.94 2gcf n GLU 41 Cb 0.63 -2.89 0.01 0.00 -0.02 0.00 0.00 31.44 29.17 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 3.22 0.17 3.49 -2.07 -1.26 -0.67 119.66 122.54 2gcf s GLN 42 Ca 0.00 1.62 0.10 0.00 -1.82 0.00 0.00 55.36 55.27 2gcf s GLN 42 Cb 0.00 -1.98 -0.04 0.00 -1.09 0.00 0.00 33.01 29.89 2gcf s GLN 42 CO 0.00 -0.96 -0.22 0.00 -1.32 0.00 0.00 175.29 172.78 2gcf s ALA 43 N -1.81 2.30 -0.03 2.60 0.00 0.29 -0.72 121.76 124.40 2gcf s ALA 43 Ca 0.73 -1.55 0.01 0.00 0.00 0.00 0.00 51.96 51.15 2gcf s ALA 43 Cb -0.25 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.61 2gcf s ALA 43 CO 0.30 0.37 -0.03 0.54 0.00 0.00 0.00 175.76 176.94 2gcf s VAL 44 N -1.69 0.39 -0.07 0.00 0.11 0.92 -1.47 120.40 118.58 2gcf s VAL 44 Ca 0.17 -0.09 -0.05 0.00 -2.93 0.00 0.00 61.98 59.09 2gcf s VAL 44 Cb -0.08 -0.41 0.03 0.00 -1.53 0.00 0.00 36.38 34.39 2gcf s VAL 44 CO 0.08 0.17 0.18 -0.69 -3.33 0.00 0.00 175.10 171.51 2gcf s VAL 45 N 0.66 -0.03 -0.63 2.04 1.01 -0.44 -1.72 120.40 121.29 2gcf s VAL 45 Ca -0.08 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 2gcf s VAL 45 Cb -0.11 -0.27 0.16 0.00 0.00 0.00 0.00 36.38 36.16 2gcf s VAL 45 CO -0.00 0.04 0.47 -0.55 0.00 0.00 0.00 175.10 175.06 2gcf s SER 46 N 0.75 5.50 -0.29 3.32 0.15 -0.82 -2.11 113.70 120.20 2gcf s SER 46 Ca -0.05 -2.72 0.11 0.00 0.70 0.00 0.00 55.95 53.99 2gcf s SER 46 Cb -0.07 -1.92 0.65 0.00 -1.71 0.00 0.00 66.02 62.97 2gcf s SER 46 CO -0.04 -0.43 1.66 0.00 1.20 0.00 0.00 173.24 175.62 2gcf n TYR 47 N 3.72 1.86 -3.38 3.44 0.18 -1.25 -0.19 117.16 121.54 2gcf n TYR 47 Ca 0.07 -1.23 -0.34 0.00 1.88 0.00 0.00 57.90 58.27 2gcf n TYR 47 Cb 0.40 -0.57 -0.05 0.00 -0.38 0.00 0.00 39.34 38.73 2gcf n TYR 47 CO 0.00 0.00 0.00 0.72 -2.08 0.00 0.00 176.86 175.50 2gcf n HIS 48 N -0.48 3.42 0.00 -3.48 8.25 -1.19 -4.52 115.22 117.23 2gcf n HIS 48 Ca 0.36 -3.70 0.00 0.00 -0.26 0.00 0.00 57.72 54.11 2gcf n HIS 48 Cb 1.22 -0.94 0.00 0.00 1.12 0.00 0.00 29.99 31.39 2gcf n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2gcf n GLY 49 N 1.45 1.68 0.00 -1.41 0.00 -1.25 -4.20 105.19 101.47 2gcf n GLY 49 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.52 0.66 -1.78 1.61 1.02 -1.26 -4.93 120.64 115.43 2gcf n GLU 50 Ca 0.00 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.72 2gcf n GLU 50 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.40 2gcf n GLU 50 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2gcf n THR 51 N -0.68 3.11 -1.67 2.62 -2.24 -1.26 -4.95 114.28 109.21 2gcf n THR 51 Ca 0.00 -2.85 -0.45 0.00 -2.27 0.00 0.00 64.05 58.48 2gcf n THR 51 Cb 0.00 -2.48 -0.04 0.00 -2.10 0.00 0.00 70.33 65.72 2gcf n THR 51 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2gcf n THR 52 N 5.68 0.69 -0.49 4.28 -1.04 -1.26 -5.02 114.28 117.13 2gcf n THR 52 Ca 0.51 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 62.39 2gcf n THR 52 Cb 0.41 -2.14 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 2gcf n THR 52 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2gcf n PRO 53 N 7.17 3.56 0.00 -2.82 -0.04 -1.26 -4.90 135.00 136.70 2gcf n PRO 53 Ca 0.21 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.69 2gcf n PRO 53 Cb 0.36 0.00 0.13 0.00 -0.04 0.00 0.00 33.50 33.95 2gcf n PRO 53 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2gcf n GLN 54 N 0.00 0.17 0.02 0.54 7.27 -1.26 -2.37 117.38 121.76 2gcf n GLN 54 Ca 0.00 0.00 0.21 0.00 0.07 0.00 0.00 57.00 57.28 2gcf n GLN 54 Cb 0.00 -1.40 0.73 0.00 2.41 0.00 0.00 30.24 31.98 2gcf n GLN 54 CO 0.00 0.00 0.00 0.82 0.07 0.00 0.00 177.06 177.95 2gcf h ILE 55 N 0.00 0.54 -0.99 1.69 1.08 -1.99 0.82 117.51 118.66 2gcf h ILE 55 Ca 0.00 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.63 2gcf h ILE 55 Cb 0.00 0.68 -0.09 0.00 -3.07 0.00 0.00 36.82 34.34 2gcf h ILE 55 CO 0.00 0.00 0.62 0.17 -0.69 0.00 0.00 178.15 178.25 2gcf h LEU 56 N 0.00 0.81 0.16 1.44 8.10 -1.82 -2.68 115.31 121.32 2gcf h LEU 56 Ca 0.24 0.07 -0.35 0.00 0.11 0.00 0.00 57.88 57.95 2gcf h LEU 56 Cb 1.11 -0.08 -0.00 0.00 -0.44 0.00 0.00 40.66 41.24 2gcf h LEU 56 CO -0.00 0.36 -1.82 0.74 -4.11 0.00 0.00 178.44 173.60 2gcf h THR 57 N 0.83 0.82 -0.90 0.15 2.02 -1.18 -3.38 112.91 111.27 2gcf h THR 57 Ca 0.53 -2.43 0.25 0.00 0.77 0.00 0.00 66.41 65.53 2gcf h THR 57 Cb 0.75 2.66 -0.14 0.00 -1.74 0.00 0.00 68.15 69.67 2gcf h THR 57 CO -0.31 0.86 0.28 -0.78 0.37 0.00 0.00 175.52 175.94 2gcf h ASP 58 N 0.05 0.06 0.20 4.18 3.58 -0.87 0.28 116.42 123.91 2gcf h ASP 58 Ca -0.37 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2gcf h ASP 58 Cb 2.05 0.25 0.00 0.00 1.72 0.00 0.00 39.33 43.35 2gcf h ASP 58 CO 0.13 -0.16 0.00 0.00 -2.88 0.00 0.00 179.24 176.33 2gcf n ALA 59 N -2.66 2.01 -0.11 -0.78 0.00 -1.03 -1.65 120.51 116.29 2gcf n ALA 59 Ca 0.23 -0.09 -0.14 0.00 0.00 0.00 0.00 53.44 53.44 2gcf n ALA 59 Cb 0.73 -1.28 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 2gcf n ALA 59 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2gcf n VAL 60 N -1.18 1.43 -0.24 0.00 0.24 0.91 -4.59 118.33 114.89 2gcf n VAL 60 Ca 0.10 -0.71 -0.02 0.00 -2.04 0.00 0.00 64.34 61.67 2gcf n VAL 60 Cb 0.11 -0.93 0.10 0.00 -1.47 0.00 0.00 33.84 31.64 2gcf n VAL 60 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2gcf h GLU 61 N 0.00 0.70 -0.04 7.34 4.39 -0.63 -1.03 114.58 125.32 2gcf h GLU 61 Ca -0.56 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.11 2gcf h GLU 61 Cb 2.07 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 30.56 2gcf h GLU 61 CO -0.03 0.46 0.67 0.07 -1.16 0.00 0.00 179.01 179.02 2gcf h ARG 62 N 0.72 0.00 -0.00 2.33 -0.00 -1.56 -0.99 114.38 114.88 2gcf h ARG 62 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.28 2gcf h ARG 62 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.13 2gcf h ARG 62 CO -0.17 0.00 -0.86 0.00 -0.00 0.00 0.00 179.97 178.94 2gcf n ALA 63 N -1.73 4.43 -0.71 0.08 0.00 -0.40 -4.95 120.51 117.23 2gcf n ALA 63 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2gcf n ALA 63 Cb 0.70 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.29 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 1.50 0.74 3.55 0.00 0.00 -0.37 -4.86 105.19 105.75 2gcf n GLY 64 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.64 2.73 0.25 1.61 2.02 -1.14 -4.84 117.35 115.33 2gcf s TYR 65 Ca 0.00 -0.15 0.08 0.00 -0.37 0.00 0.00 57.07 56.62 2gcf s TYR 65 Cb 0.00 -1.48 -0.04 0.00 -0.40 0.00 0.00 41.96 40.04 2gcf s TYR 65 CO 0.00 0.37 0.15 -1.01 -1.57 0.00 0.00 175.55 173.49 2gcf s HIS 66 N -1.09 3.02 -0.20 2.71 3.76 0.06 -2.92 115.29 120.63 2gcf s HIS 66 Ca 0.19 -0.13 -0.15 0.00 -0.15 0.00 0.00 55.06 54.82 2gcf s HIS 66 Cb -0.11 -1.36 -0.04 0.00 1.11 0.00 0.00 32.58 32.18 2gcf s HIS 66 CO 0.10 0.54 0.34 0.00 -0.85 0.00 0.00 174.74 174.87 2gcf s ALA 67 N -2.16 3.57 -0.08 -1.40 0.00 -1.26 -0.27 121.76 120.17 2gcf s ALA 67 Ca 0.32 -0.57 0.04 0.00 0.00 0.00 0.00 51.96 51.76 2gcf s ALA 67 Cb -0.08 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.51 2gcf s ALA 67 CO 0.24 -0.20 -0.21 -0.98 0.00 0.00 0.00 175.76 174.60 2gcf s ARG 68 N 1.09 2.55 -0.24 0.00 1.70 -0.14 -4.93 118.95 118.98 2gcf s ARG 68 Ca 0.17 -0.77 -0.20 0.00 -0.47 0.00 0.00 55.73 54.45 2gcf s ARG 68 Cb -0.14 -2.02 -0.02 0.00 -0.57 0.00 0.00 34.95 32.19 2gcf s ARG 68 CO 0.07 0.21 0.61 0.14 -1.08 0.00 0.00 175.30 175.24 2gcf s VAL 69 N 0.23 5.01 -0.19 4.99 -7.23 -1.26 -1.38 120.40 120.56 2gcf s VAL 69 Ca -0.13 1.10 0.02 0.00 -1.81 0.00 0.00 61.98 61.16 2gcf s VAL 69 Cb -0.16 -3.92 0.26 0.00 0.56 0.00 0.00 36.38 33.12 2gcf s VAL 69 CO 0.06 0.06 1.33 0.00 -0.31 0.00 0.00 175.10 176.24 2gcf n LEU 70 N 5.49 4.34 -3.07 1.32 -0.00 -1.26 -4.38 117.00 119.44 2gcf n LEU 70 Ca -0.01 -2.26 -0.16 0.00 -0.00 0.00 0.00 56.01 53.58 2gcf n LEU 70 Cb 0.49 -0.63 -0.00 0.00 -0.00 0.00 0.00 43.42 43.29 2gcf n LEU 70 CO 0.43 0.69 -0.09 1.17 -0.00 0.00 0.00 177.39 179.59 2gcf n LYS 71 N -0.11 0.97 -1.74 1.47 4.81 -1.26 -5.06 118.16 117.25 2gcf n LYS 71 Ca 0.22 -3.01 -0.24 0.00 -0.87 0.00 0.00 58.31 54.41 2gcf n LYS 71 Cb 0.93 -1.53 -0.09 0.00 0.02 0.00 0.00 35.03 34.36 2gcf n LYS 71 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2gcf n GLN 72 N 0.34 0.91 0.00 1.64 3.00 -1.26 -5.30 117.38 116.71 2gcf n GLN 72 Ca 0.20 -2.06 0.00 0.00 -0.01 0.00 0.00 57.00 55.13 2gcf n GLN 72 Cb 0.67 -3.72 0.00 0.00 0.00 0.00 0.00 30.24 27.19 2gcf n GLN 72 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10