#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpf s THR 2 N 0.00 -0.19 -0.08 1.12 2.01 -1.26 -5.13 115.64 112.11 2gpf s THR 2 Ca 0.00 0.28 0.05 0.00 0.31 0.00 0.00 61.69 62.33 2gpf s THR 2 Cb 0.00 -0.30 -0.01 0.00 0.01 0.00 0.00 72.50 72.20 2gpf s THR 2 CO 0.00 0.08 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.33 2gpf s SER 3 N 2.23 3.10 -0.00 3.53 0.01 -1.26 -5.02 113.70 116.29 2gpf s SER 3 Ca 0.04 -0.53 -0.01 0.00 1.31 0.00 0.00 55.95 56.77 2gpf s SER 3 Cb -0.13 -1.08 -0.26 0.00 0.21 0.00 0.00 66.02 64.76 2gpf s SER 3 CO -0.06 0.21 0.84 1.62 0.41 0.00 0.00 173.24 176.26 2gpf h VAL 4 N 5.32 1.13 0.00 3.43 3.04 -2.07 -3.47 116.25 123.62 2gpf h VAL 4 Ca -0.27 -2.80 0.00 0.00 -1.01 0.00 0.00 66.70 62.62 2gpf h VAL 4 Cb 1.20 2.71 0.00 0.00 -2.01 0.00 0.00 31.29 33.19 2gpf h VAL 4 CO 0.47 0.79 0.00 0.49 -1.01 0.00 0.00 177.57 178.32 2gpf n PHE 5 N -3.40 0.00 -1.17 3.17 3.72 -1.26 -4.78 117.46 113.74 2gpf n PHE 5 Ca -0.16 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.15 2gpf n PHE 5 Cb 1.04 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.64 2gpf n PHE 5 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2gpf n ASP 6 N 1.31 -0.18 -4.10 4.37 8.00 -1.26 -5.05 116.55 119.65 2gpf n ASP 6 Ca 0.00 -1.07 -0.33 0.00 0.71 0.00 0.00 54.79 54.09 2gpf n ASP 6 Cb 0.00 -0.30 -0.14 0.00 -0.02 0.00 0.00 41.12 40.66 2gpf n ASP 6 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2gpf s ARG 7 N -3.83 2.07 0.00 -1.24 1.81 -1.26 -5.08 118.95 111.42 2gpf s ARG 7 Ca 0.22 -1.54 0.00 0.00 -1.72 0.00 0.00 55.73 52.69 2gpf s ARG 7 Cb -0.01 -3.19 0.00 0.00 -0.45 0.00 0.00 34.95 31.30 2gpf s ARG 7 CO 0.15 -0.77 0.00 -3.47 -0.68 0.00 0.00 175.30 170.54 2gpf n ASP 8 N 4.48 0.00 -2.94 0.23 -0.08 -1.26 -4.76 116.55 112.22 2gpf n ASP 8 Ca -0.07 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.06 2gpf n ASP 8 Cb 0.42 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.87 2gpf n ASP 8 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2gpf n ASP 9 N 0.00 -2.79 0.19 1.67 5.68 -1.26 -4.79 116.55 115.26 2gpf n ASP 9 Ca 0.00 -0.02 0.06 0.00 -0.50 0.00 0.00 54.79 54.32 2gpf n ASP 9 Cb 0.00 -2.39 0.38 0.00 -1.14 0.00 0.00 41.12 37.97 2gpf n ASP 9 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2gpf h ILE 10 N -0.39 0.94 -2.85 2.12 2.10 -1.97 -3.48 117.51 113.99 2gpf h ILE 10 Ca -0.27 -1.38 0.00 0.00 1.08 0.00 0.00 64.86 64.28 2gpf h ILE 10 Cb 1.19 1.82 0.00 0.00 -1.09 0.00 0.00 36.82 38.74 2gpf h ILE 10 CO 0.35 0.35 -0.41 0.00 -1.08 0.00 0.00 178.15 177.35 2gpf n GLN 11 N -3.65 -2.05 -4.39 2.19 6.02 -1.26 -2.85 117.38 111.39 2gpf n GLN 11 Ca -0.01 1.53 -0.27 0.00 -0.01 0.00 0.00 57.00 58.24 2gpf n GLN 11 Cb 0.46 -2.03 -0.12 0.00 1.02 0.00 0.00 30.24 29.56 2gpf n GLN 11 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2gpf s PHE 12 N -3.37 2.23 0.05 1.08 0.40 0.12 -0.41 117.98 118.07 2gpf s PHE 12 Ca 0.00 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.97 2gpf s PHE 12 Cb 0.00 -1.17 -0.03 0.00 0.51 0.00 0.00 43.02 42.34 2gpf s PHE 12 CO 0.00 0.38 -0.07 1.14 0.70 0.00 0.00 175.22 177.37 2gpf s GLN 13 N -2.31 0.54 -0.20 0.44 -2.07 0.11 -0.57 119.66 115.61 2gpf s GLN 13 Ca 0.16 -0.83 -0.17 0.00 -1.82 0.00 0.00 55.36 52.70 2gpf s GLN 13 Cb -0.09 -0.22 -0.04 0.00 -1.09 0.00 0.00 33.01 31.58 2gpf s GLN 13 CO 0.07 0.02 0.46 0.08 -1.32 0.00 0.00 175.29 174.61 2gpf s VAL 14 N -1.74 5.15 0.07 3.63 1.01 -0.38 -0.42 120.40 127.71 2gpf s VAL 14 Ca -0.08 0.84 0.08 0.00 0.00 0.00 0.00 61.98 62.83 2gpf s VAL 14 Cb -0.08 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 2gpf s VAL 14 CO -0.01 0.21 -0.18 0.68 0.00 0.00 0.00 175.10 175.81 2gpf s VAL 15 N 1.48 2.83 0.02 2.92 -7.23 0.35 0.53 120.40 121.31 2gpf s VAL 15 Ca 0.22 -1.29 0.04 0.00 -1.81 0.00 0.00 61.98 59.13 2gpf s VAL 15 Cb -0.15 -2.23 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 2gpf s VAL 15 CO 0.09 0.25 -0.11 0.54 -0.31 0.00 0.00 175.10 175.56 2gpf s VAL 16 N -1.01 0.87 0.37 1.32 0.11 0.18 -0.40 120.40 121.84 2gpf s VAL 16 Ca 0.16 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.39 2gpf s VAL 16 Cb -0.11 -0.79 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 2gpf s VAL 16 CO 0.07 -0.00 0.60 0.21 -3.33 0.00 0.00 175.10 172.64 2gpf s ASN 17 N -0.91 6.30 0.00 3.54 2.47 -0.78 -0.94 114.94 124.62 2gpf s ASN 17 Ca 0.00 0.57 0.00 0.00 0.42 0.00 0.00 52.86 53.85 2gpf s ASN 17 Cb -0.07 -2.08 0.00 0.00 -1.45 0.00 0.00 41.25 37.65 2gpf s ASN 17 CO 0.01 -0.34 0.48 1.57 -3.72 0.00 0.00 177.10 175.09 2gpf n HIS 18 N -1.81 0.00 -0.13 0.43 -0.00 -1.26 -0.35 115.22 112.09 2gpf n HIS 18 Ca -0.03 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.23 2gpf n HIS 18 Cb 0.56 -0.03 0.20 0.00 -0.12 0.00 0.00 29.99 30.60 2gpf n HIS 18 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 2gpf n GLU 19 N -0.17 2.61 -3.10 1.57 0.28 -1.26 -4.95 120.64 115.61 2gpf n GLU 19 Ca 0.00 -2.20 -0.15 0.00 -0.16 0.00 0.00 57.16 54.65 2gpf n GLU 19 Cb 0.07 -1.38 0.05 0.00 1.43 0.00 0.00 31.44 31.61 2gpf n GLU 19 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2gpf n GLU 20 N 0.98 -4.70 -3.56 3.44 4.07 0.53 -5.00 120.64 116.39 2gpf n GLU 20 Ca 0.16 0.55 -0.39 0.00 -0.06 0.00 0.00 57.16 57.41 2gpf n GLU 20 Cb 0.49 -4.70 -0.11 0.00 -0.06 0.00 0.00 31.44 27.07 2gpf n GLU 20 CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 2gpf s GLN 21 N -5.72 3.69 -0.02 5.31 0.74 -1.20 -4.93 119.66 117.54 2gpf s GLN 21 Ca 0.34 -0.50 -0.18 0.00 0.05 0.00 0.00 55.36 55.06 2gpf s GLN 21 Cb -0.15 -3.74 -0.05 0.00 1.10 0.00 0.00 33.01 30.16 2gpf s GLN 21 CO 0.42 -0.33 0.51 0.71 -0.55 0.00 0.00 175.29 176.05 2gpf s TYR 22 N 1.74 3.67 0.25 1.67 2.02 -1.26 -1.86 117.35 123.58 2gpf s TYR 22 Ca 0.06 1.08 -0.02 0.00 -0.37 0.00 0.00 57.07 57.83 2gpf s TYR 22 Cb -0.17 -2.50 -0.03 0.00 -0.40 0.00 0.00 41.96 38.87 2gpf s TYR 22 CO 0.11 0.42 0.27 0.45 -1.57 0.00 0.00 175.55 175.23 2gpf s SER 23 N -0.37 0.49 0.04 2.29 0.15 0.47 -5.00 113.70 111.77 2gpf s SER 23 Ca 0.28 -1.38 0.06 0.00 0.70 0.00 0.00 55.95 55.60 2gpf s SER 23 Cb -0.17 0.49 -0.03 0.00 -1.71 0.00 0.00 66.02 64.60 2gpf s SER 23 CO 0.15 -1.00 -0.16 0.27 1.20 0.00 0.00 173.24 173.70 2gpf s ILE 24 N -3.85 2.97 -0.01 6.45 -4.36 -1.26 -0.49 121.20 120.65 2gpf s ILE 24 Ca 0.35 -1.12 -0.02 0.00 -0.26 0.00 0.00 60.65 59.60 2gpf s ILE 24 Cb 0.04 -2.27 0.00 0.00 1.25 0.00 0.00 42.46 41.48 2gpf s ILE 24 CO 0.15 0.33 0.05 0.86 0.24 0.00 0.00 174.94 176.58 2gpf s TRP 25 N -0.95 -0.02 0.35 1.37 -0.11 0.44 -4.88 118.94 115.14 2gpf s TRP 25 Ca 0.15 0.05 -0.28 0.00 1.22 0.00 0.00 56.10 57.24 2gpf s TRP 25 Cb -0.11 -0.01 -0.11 0.00 -1.50 0.00 0.00 33.47 31.75 2gpf s TRP 25 CO 0.06 -0.06 1.45 -2.14 -4.62 0.00 0.00 176.95 171.65 2gpf s PRO 26 N -0.21 4.17 0.12 5.86 0.02 -1.26 0.04 135.00 143.75 2gpf s PRO 26 Ca -0.03 2.48 -0.13 0.00 0.02 0.00 0.00 61.00 63.34 2gpf s PRO 26 Cb -0.02 -3.00 -0.06 0.00 0.02 0.00 0.00 34.50 31.44 2gpf s PRO 26 CO 0.00 -0.46 1.46 1.49 -0.33 0.00 0.00 177.00 179.17 2gpf h GLU 27 N 3.35 0.82 0.00 5.54 4.57 -0.58 -3.24 114.58 125.03 2gpf h GLU 27 Ca -0.50 -0.40 -0.03 0.00 -1.18 0.00 0.00 59.36 57.25 2gpf h GLU 27 Cb 1.23 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.82 2gpf h GLU 27 CO 0.66 1.04 -0.13 0.10 -1.18 0.00 0.00 179.01 179.50 2gpf h TYR 28 N 0.60 0.00 -2.63 0.92 -0.00 -1.81 -3.43 116.97 110.62 2gpf h TYR 28 Ca 0.06 0.00 -0.52 0.00 -0.00 0.00 0.00 58.73 58.28 2gpf h TYR 28 Cb 0.86 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.57 2gpf h TYR 28 CO 0.06 0.13 -0.38 -1.59 -0.00 0.00 0.00 178.16 176.39 2gpf s LYS 29 N -3.86 3.48 0.43 0.10 -2.85 -1.23 -5.08 119.74 110.73 2gpf s LYS 29 Ca -0.01 -0.49 -0.23 0.00 -1.00 0.00 0.00 55.97 54.24 2gpf s LYS 29 Cb 0.11 -2.87 -0.08 0.00 -2.06 0.00 0.00 37.83 32.93 2gpf s LYS 29 CO 0.59 0.42 1.10 -1.83 0.10 0.00 0.00 175.35 175.72 2gpf s GLU 30 N -3.51 3.96 0.15 1.78 -1.05 -1.26 -4.88 118.70 113.90 2gpf s GLU 30 Ca 0.37 1.61 -0.19 0.00 -0.15 0.00 0.00 54.97 56.60 2gpf s GLU 30 Cb -0.11 -2.45 -0.07 0.00 -0.44 0.00 0.00 34.13 31.06 2gpf s GLU 30 CO 0.30 -0.34 0.65 0.42 0.95 0.00 0.00 175.26 177.24 2gpf s ILE 31 N -1.64 4.65 0.11 1.83 1.01 -1.26 -5.03 121.20 120.86 2gpf s ILE 31 Ca 0.61 1.24 -0.35 0.00 0.00 0.00 0.00 60.65 62.15 2gpf s ILE 31 Cb -0.24 -3.89 -0.14 0.00 0.01 0.00 0.00 42.46 38.20 2gpf s ILE 31 CO 0.30 0.37 1.58 -2.65 0.00 0.00 0.00 174.94 174.54 2gpf n PRO 32 N 1.18 1.95 0.00 2.79 -0.02 -1.26 -4.86 135.00 134.79 2gpf n PRO 32 Ca -0.06 0.71 0.08 0.00 -2.02 0.00 0.00 63.50 62.21 2gpf n PRO 32 Cb 0.51 -2.46 0.41 0.00 -0.02 0.00 0.00 33.50 31.93 2gpf n PRO 32 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2gpf n GLN 33 N 3.70 0.15 0.19 -0.52 1.13 -1.26 -0.78 117.38 120.00 2gpf n GLN 33 Ca 0.18 0.16 0.08 0.00 -1.94 0.00 0.00 57.00 55.47 2gpf n GLN 33 Cb 0.27 -1.50 0.25 0.00 0.11 0.00 0.00 30.24 29.37 2gpf n GLN 33 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2gpf h GLY 34 N 2.88 0.00 -2.62 1.08 0.00 -1.99 -3.45 103.07 98.97 2gpf h GLY 34 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.88 2gpf h GLY 34 CO 0.00 0.00 -0.36 -0.98 0.00 0.00 0.00 176.54 175.20 2gpf s TRP 35 N -3.31 2.97 0.06 5.60 0.52 0.04 -4.68 118.94 120.14 2gpf s TRP 35 Ca 0.03 -0.29 0.05 0.00 0.02 0.00 0.00 56.10 55.91 2gpf s TRP 35 Cb 0.08 -2.02 -0.03 0.00 -1.15 0.00 0.00 33.47 30.35 2gpf s TRP 35 CO 0.68 -0.04 -0.15 0.50 0.02 0.00 0.00 176.95 177.96 2gpf s ARG 36 N -4.15 0.91 0.24 4.98 6.06 -0.11 -4.84 118.95 122.04 2gpf s ARG 36 Ca 0.46 -0.91 -0.30 0.00 -2.50 0.00 0.00 55.73 52.48 2gpf s ARG 36 Cb -0.08 -0.95 -0.09 0.00 0.06 0.00 0.00 34.95 33.89 2gpf s ARG 36 CO 0.30 0.22 0.97 0.00 -2.50 0.00 0.00 175.30 174.29 2gpf s ALA 37 N -1.10 3.35 0.02 6.12 0.00 -1.26 0.50 121.76 129.38 2gpf s ALA 37 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2gpf s ALA 37 Cb -0.09 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 2gpf s ALA 37 CO 0.02 0.14 -0.03 0.00 0.00 0.00 0.00 175.76 175.89 2gpf s ALA 38 N -1.15 0.13 0.00 0.00 0.00 0.19 -4.87 121.76 116.05 2gpf s ALA 38 Ca 0.42 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2gpf s ALA 38 Cb -0.27 0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2gpf s ALA 38 CO 0.34 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.39 2gpf n GLY 39 N 1.90 1.08 3.71 0.00 0.00 -1.26 -3.97 105.19 106.65 2gpf n GLY 39 Ca -0.21 0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.94 2gpf n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gpf s LYS 40 N 0.00 4.22 -0.23 1.61 1.02 -1.26 -4.98 119.74 120.13 2gpf s LYS 40 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 55.97 56.03 2gpf s LYS 40 Cb 0.00 -3.45 0.06 0.00 -0.52 0.00 0.00 37.83 33.92 2gpf s LYS 40 CO 0.00 0.19 -0.05 0.45 -0.92 0.00 0.00 175.35 175.02 2gpf s SER 41 N 0.61 3.74 0.00 2.83 0.15 -1.26 -1.25 113.70 118.52 2gpf s SER 41 Ca 0.15 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.67 2gpf s SER 41 Cb -0.13 -1.12 0.00 0.00 -1.71 0.00 0.00 66.02 63.06 2gpf s SER 41 CO 0.04 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2gpf n GLY 42 N 4.71 -0.29 3.67 9.45 0.00 0.27 -4.98 105.19 118.01 2gpf n GLY 42 Ca -0.12 0.46 -0.29 0.00 0.00 0.00 0.00 46.02 46.07 2gpf n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gpf s LEU 43 N 0.00 1.97 0.02 0.99 2.01 -1.26 0.10 118.68 122.52 2gpf s LEU 43 Ca 0.00 1.53 -0.26 0.00 0.01 0.00 0.00 54.13 55.41 2gpf s LEU 43 Cb 0.00 -3.82 -0.17 0.00 0.01 0.00 0.00 46.19 42.21 2gpf s LEU 43 CO 0.00 -3.04 1.33 0.50 1.01 0.00 0.00 176.35 176.15 2gpf h LYS 44 N -1.83 -0.36 0.00 1.70 3.64 -1.89 -1.98 116.57 115.85 2gpf h LYS 44 Ca -0.52 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.85 2gpf h LYS 44 Cb 1.30 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 33.19 2gpf h LYS 44 CO 0.53 -0.07 -0.20 1.57 -2.27 0.00 0.00 179.45 179.01 2gpf h LYS 45 N -0.66 0.00 -0.32 1.90 5.09 -1.96 -2.39 116.57 118.23 2gpf h LYS 45 Ca -0.04 0.00 -0.15 0.00 0.09 0.00 0.00 60.65 60.55 2gpf h LYS 45 Cb 0.46 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.79 2gpf h LYS 45 CO 0.06 0.20 -0.42 0.22 -2.09 0.00 0.00 179.45 177.43 2gpf h ASP 46 N 0.00 0.86 -0.15 7.07 3.58 -1.89 -1.85 116.42 124.04 2gpf h ASP 46 Ca -0.00 -0.40 -0.03 0.00 0.42 0.00 0.00 57.03 57.02 2gpf h ASP 46 Cb 0.38 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2gpf h ASP 46 CO 0.03 1.16 -0.01 0.00 -2.88 0.00 0.00 179.24 177.53 2gpf h LEU 48 N 0.01 0.52 -0.86 0.00 3.38 -1.38 -1.80 115.31 115.17 2gpf h LEU 48 Ca 0.04 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.16 2gpf h LEU 48 Cb 0.41 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 2gpf h LEU 48 CO 0.01 0.34 0.48 0.00 0.09 0.00 0.00 178.44 179.36 2gpf h ALA 49 N 1.34 1.27 -0.37 1.53 0.00 -1.24 -2.51 119.26 119.28 2gpf h ALA 49 Ca 0.29 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.33 2gpf h ALA 49 Cb 0.18 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2gpf h ALA 49 CO -0.18 0.03 -0.05 -0.92 0.00 0.00 0.00 179.25 178.13 2gpf h TYR 50 N 0.74 -0.11 -0.33 0.00 3.20 -1.11 -0.36 116.97 119.00 2gpf h TYR 50 Ca 0.44 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.28 2gpf h TYR 50 Cb 0.52 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 2gpf h TYR 50 CO -0.06 -0.12 -0.08 0.82 -1.64 0.00 0.00 178.16 177.07 2gpf h ILE 51 N 0.05 1.23 -0.62 1.81 5.03 -1.48 -2.53 117.51 120.99 2gpf h ILE 51 Ca 0.18 -0.97 -0.03 0.00 -0.12 0.00 0.00 64.86 63.92 2gpf h ILE 51 Cb 0.27 1.07 -0.03 0.00 -3.03 0.00 0.00 36.82 35.10 2gpf h ILE 51 CO -0.35 0.32 0.27 -0.33 -0.68 0.00 0.00 178.15 177.39 2gpf h GLU 52 N 0.51 0.90 -0.52 2.37 5.08 -1.05 -3.32 114.58 118.54 2gpf h GLU 52 Ca 0.10 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2gpf h GLU 52 Cb 0.46 -0.16 -0.08 0.00 0.50 0.00 0.00 28.75 29.47 2gpf h GLU 52 CO 0.02 0.75 -0.45 0.93 -1.00 0.00 0.00 179.01 179.26 2gpf h GLU 53 N 0.85 -0.17 0.08 2.33 4.39 -0.65 -3.47 114.58 117.94 2gpf h GLU 53 Ca 0.21 0.01 -0.35 0.00 0.34 0.00 0.00 59.36 59.57 2gpf h GLU 53 Cb 0.16 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.81 2gpf h GLU 53 CO -0.02 -0.11 -1.99 1.55 -1.16 0.00 0.00 179.01 177.28 2gpf n VAL 54 N -4.77 1.70 -0.64 3.13 3.14 -1.25 -3.91 118.33 115.73 2gpf n VAL 54 Ca -0.01 -0.69 0.06 0.00 -2.96 0.00 0.00 64.34 60.74 2gpf n VAL 54 Cb 0.24 -1.49 0.12 0.00 -1.06 0.00 0.00 33.84 31.65 2gpf n VAL 54 CO 0.00 0.00 0.00 0.79 -6.46 0.00 0.00 176.83 171.16 2gpf n TRP 55 N -3.33 0.20 -3.67 1.45 7.02 -1.26 -4.61 117.44 113.25 2gpf n TRP 55 Ca -0.29 -0.78 -0.08 0.00 -1.02 0.00 0.00 57.50 55.33 2gpf n TRP 55 Cb 1.05 -0.13 0.01 0.00 -2.42 0.00 0.00 31.31 29.81 2gpf n TRP 55 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2gpf n THR 56 N -0.80 0.00 -0.06 -0.99 -2.24 -1.25 -5.07 114.28 103.87 2gpf n THR 56 Ca 0.12 -0.88 -0.04 0.00 -2.27 0.00 0.00 64.05 60.98 2gpf n THR 56 Cb 0.54 0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 2gpf n THR 56 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2gpf h ASP 57 N 1.40 0.00 0.00 3.42 3.58 -1.98 -3.41 116.42 119.43 2gpf h ASP 57 Ca -0.22 -0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.00 2gpf h ASP 57 Cb 0.87 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.92 2gpf h ASP 57 CO 0.29 0.66 0.00 0.80 -2.88 0.00 0.00 179.24 178.11 2gpf n MET 58 N -4.72 0.00 -4.98 0.28 0.00 -1.26 -4.55 117.12 101.89 2gpf n MET 58 Ca -0.04 0.00 -0.29 0.00 -0.00 0.00 0.00 57.70 57.37 2gpf n MET 58 Cb 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 33.22 33.20 2gpf n MET 58 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 175.97 174.99 2gpf s ARG 59 N 0.00 2.37 -0.75 2.12 1.70 -1.26 -5.08 118.95 118.05 2gpf s ARG 59 Ca 0.00 -0.70 -0.26 0.00 -0.47 0.00 0.00 55.73 54.30 2gpf s ARG 59 Cb 0.00 -1.89 0.01 0.00 -0.57 0.00 0.00 34.95 32.50 2gpf s ARG 59 CO 0.00 0.18 1.54 -2.14 -1.08 0.00 0.00 175.30 173.79 2gpf s PRO 60 N 0.31 3.02 -0.01 3.89 0.02 -1.26 -4.79 135.00 136.18 2gpf s PRO 60 Ca -0.13 -0.11 0.11 0.00 0.02 0.00 0.00 61.00 60.89 2gpf s PRO 60 Cb -0.16 -4.48 0.35 0.00 0.02 0.00 0.00 34.50 30.23 2gpf s PRO 60 CO 0.06 -2.44 1.27 1.47 -0.33 0.00 0.00 177.00 177.03 2gpf n LEU 61 N 10.73 2.20 0.12 -5.54 -0.00 -1.26 -4.41 117.00 118.84 2gpf n LEU 61 Ca 0.16 -1.10 -0.14 0.00 -0.00 0.00 0.00 56.01 54.93 2gpf n LEU 61 Cb 0.50 -0.29 -0.08 0.00 -0.00 0.00 0.00 43.42 43.56 2gpf n LEU 61 CO 0.69 0.51 0.80 0.77 -0.00 0.00 0.00 177.39 180.16 2gpf h SER 62 N 2.25 -0.20 0.34 1.45 4.64 -1.92 0.17 113.55 120.28 2gpf h SER 62 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2gpf h SER 62 Cb 0.59 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2gpf h SER 62 CO 0.02 -0.12 0.00 0.00 -0.87 0.00 0.00 176.83 175.86 2gpf n LEU 63 N -5.18 0.00 -0.08 5.97 -0.00 -1.26 -2.96 117.00 113.49 2gpf n LEU 63 Ca -0.09 0.19 -0.16 0.00 -0.00 0.00 0.00 56.01 55.95 2gpf n LEU 63 Cb 0.13 -0.19 -0.14 0.00 -0.00 0.00 0.00 43.42 43.23 2gpf n LEU 63 CO 0.34 -0.02 -1.07 0.54 -0.00 0.00 0.00 177.39 177.18 2gpf n ARG 64 N -1.19 0.68 -0.71 1.47 5.12 -0.76 -5.08 116.66 116.20 2gpf n ARG 64 Ca 0.16 0.16 0.09 0.00 -1.93 0.00 0.00 57.85 56.34 2gpf n ARG 64 Cb 0.18 -1.60 -0.03 0.00 -1.16 0.00 0.00 32.46 29.85 2gpf n ARG 64 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2gpf n GLN 65 N -3.19 -1.50 0.00 5.56 6.02 0.53 -2.86 117.38 121.94 2gpf n GLN 65 Ca -0.36 1.09 0.14 0.00 -0.01 0.00 0.00 57.00 57.86 2gpf n GLN 65 Cb 1.05 -1.80 0.67 0.00 1.02 0.00 0.00 30.24 31.18 2gpf n GLN 65 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 2gpf n HIS 66 N -3.18 0.00 0.79 1.08 -0.00 -1.26 -2.66 115.22 109.98 2gpf n HIS 66 Ca -0.01 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.79 2gpf n HIS 66 Cb 0.33 -0.39 0.24 0.00 -0.00 0.00 0.00 29.99 30.17 2gpf n HIS 66 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2gpf n MET 67 N -1.39 1.95 0.19 1.57 2.81 -1.26 -4.22 117.12 116.77 2gpf n MET 67 Ca 0.10 -1.46 -0.14 0.00 -1.81 0.00 0.00 57.70 54.39 2gpf n MET 67 Cb 0.29 -1.36 -0.07 0.00 -0.71 0.00 0.00 33.22 31.38 2gpf n MET 67 CO 0.00 0.00 0.00 0.22 1.51 0.00 0.00 175.97 177.70 2gpf h ASP 68 N 2.53 -0.60 -3.38 7.83 3.58 -1.36 -3.36 116.42 121.66 2gpf h ASP 68 Ca 0.00 0.05 -0.60 0.00 0.42 0.00 0.00 57.03 56.89 2gpf h ASP 68 Cb 0.57 0.20 -0.40 0.00 1.72 0.00 0.00 39.33 41.42 2gpf h ASP 68 CO 0.00 -0.36 -0.74 -0.75 -2.88 0.00 0.00 179.24 174.51 2gpf s LYS 69 N -6.08 1.07 0.21 0.28 2.36 -1.26 -5.10 119.74 111.21 2gpf s LYS 69 Ca -0.16 -1.61 -0.26 0.00 -2.55 0.00 0.00 55.97 51.39 2gpf s LYS 69 Cb 0.06 -2.28 -0.08 0.00 -1.05 0.00 0.00 37.83 34.47 2gpf s LYS 69 CO 0.64 -1.07 0.83 0.00 1.55 0.00 0.00 175.35 177.30 2gpf s ALA 70 N 0.92 3.39 -1.25 3.13 0.00 -1.26 -4.95 121.76 121.74 2gpf s ALA 70 Ca 0.14 0.41 -0.18 0.00 0.00 0.00 0.00 51.96 52.33 2gpf s ALA 70 Cb -0.21 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2gpf s ALA 70 CO -0.11 0.27 1.93 0.00 0.00 0.00 0.00 175.76 177.84 2gpf n ALA 71 N 1.33 3.72 -0.83 0.00 0.00 -1.26 -5.16 120.51 118.31 2gpf n ALA 71 Ca -0.04 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.77 2gpf n ALA 71 Cb 0.49 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.37 2gpf n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91