#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 3.38 -1.37 1.12 -4.23 -1.26 -4.93 115.64 108.35 2gpf s THR 2 Ca 0.00 1.05 -0.11 0.00 -1.18 0.00 0.00 61.69 61.45 2gpf s THR 2 Cb 0.00 -3.54 0.10 0.00 1.34 0.00 0.00 72.50 70.40 2gpf s THR 2 CO 0.00 -0.00 2.14 -0.24 -0.54 0.00 0.00 174.62 175.98 2gpf n SER 3 N -0.29 5.30 0.08 3.99 2.88 -1.26 -4.48 113.62 119.85 2gpf n SER 3 Ca 0.06 -2.98 0.11 0.00 -1.33 0.00 0.00 58.87 54.74 2gpf n SER 3 Cb 0.49 -1.53 -0.01 0.00 -0.75 0.00 0.00 64.21 62.41 2gpf n SER 3 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2gpf n VAL 4 N 3.76 0.49 -1.05 2.46 0.24 -1.26 -5.08 118.33 117.89 2gpf n VAL 4 Ca 0.49 -0.50 0.14 0.00 -2.04 0.00 0.00 64.34 62.43 2gpf n VAL 4 Cb 0.35 -0.24 -0.05 0.00 -1.47 0.00 0.00 33.84 32.44 2gpf n VAL 4 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2gpf n PHE 5 N -2.53 -2.70 0.00 6.34 7.35 -1.26 -4.79 117.46 119.87 2gpf n PHE 5 Ca -0.00 1.39 0.00 0.00 -0.76 0.00 0.00 57.45 58.08 2gpf n PHE 5 Cb 0.54 -2.45 0.00 0.00 0.35 0.00 0.00 39.48 37.91 2gpf n PHE 5 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2gpf n ASP 6 N -3.66 0.00 -4.32 -2.13 2.03 -1.26 -4.81 116.55 102.40 2gpf n ASP 6 Ca -0.02 0.00 -0.31 0.00 0.52 0.00 0.00 54.79 54.98 2gpf n ASP 6 Cb 0.49 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.73 2gpf n ASP 6 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2gpf s ARG 7 N 0.00 2.25 0.00 -0.67 6.06 -1.26 -5.11 118.95 120.22 2gpf s ARG 7 Ca 0.00 -0.90 0.00 0.00 -2.50 0.00 0.00 55.73 52.33 2gpf s ARG 7 Cb 0.00 -2.11 0.00 0.00 0.06 0.00 0.00 34.95 32.90 2gpf s ARG 7 CO 0.00 0.53 0.00 -3.47 -2.50 0.00 0.00 175.30 169.86 2gpf n ASP 8 N 2.53 0.00 0.00 -2.12 -0.08 -1.26 -4.91 116.55 110.72 2gpf n ASP 8 Ca -0.16 -0.87 0.00 0.00 -1.51 0.00 0.00 54.79 52.25 2gpf n ASP 8 Cb 0.51 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.97 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 -1.51 0.00 -4.84 1.67 5.75 -1.26 -5.13 116.55 111.23 2gpf n ASP 9 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 54.79 54.41 2gpf n ASP 9 Cb 0.00 0.21 -0.06 0.00 -1.03 0.00 0.00 41.12 40.24 2gpf n ASP 9 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 2gpf s ILE 10 N -1.43 4.98 -0.12 2.12 2.07 -1.26 -5.08 121.20 122.47 2gpf s ILE 10 Ca 0.00 0.79 -0.06 0.00 -1.41 0.00 0.00 60.65 59.98 2gpf s ILE 10 Cb 0.00 -3.72 -0.04 0.00 0.13 0.00 0.00 42.46 38.83 2gpf s ILE 10 CO 0.00 0.45 0.09 -1.10 -1.91 0.00 0.00 174.94 172.47 2gpf s GLN 11 N -1.43 3.40 0.45 3.50 1.11 -1.26 -4.41 119.66 121.01 2gpf s GLN 11 Ca 0.29 -0.23 0.03 0.00 0.01 0.00 0.00 55.36 55.46 2gpf s GLN 11 Cb -0.16 -3.09 -0.02 0.00 -1.01 0.00 0.00 33.01 28.72 2gpf s GLN 11 CO 0.16 0.69 0.06 -0.06 0.01 0.00 0.00 175.29 176.16 2gpf s PHE 12 N -0.80 1.87 0.06 0.91 0.08 0.20 -2.16 117.98 118.14 2gpf s PHE 12 Ca 0.13 -1.09 -0.10 0.00 0.12 0.00 0.00 56.93 55.99 2gpf s PHE 12 Cb -0.12 -1.40 0.00 0.00 -0.57 0.00 0.00 43.02 40.94 2gpf s PHE 12 CO 0.03 -0.01 0.21 1.14 -0.10 0.00 0.00 175.22 176.49 2gpf s GLN 13 N -3.79 0.79 -0.22 0.44 -2.07 0.12 -0.72 119.66 114.21 2gpf s GLN 13 Ca 0.17 -0.76 -0.13 0.00 -1.82 0.00 0.00 55.36 52.82 2gpf s GLN 13 Cb 0.03 0.33 -0.05 0.00 -1.09 0.00 0.00 33.01 32.23 2gpf s GLN 13 CO 0.10 -0.24 0.26 0.08 -1.32 0.00 0.00 175.29 174.16 2gpf s VAL 14 N -3.18 5.30 0.21 3.63 1.01 -0.83 -1.00 120.40 125.54 2gpf s VAL 14 Ca -0.00 0.41 0.10 0.00 0.00 0.00 0.00 61.98 62.49 2gpf s VAL 14 Cb 0.02 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2gpf s VAL 14 CO -0.07 0.32 -0.15 0.68 0.00 0.00 0.00 175.10 175.88 2gpf s VAL 15 N 1.04 2.83 -0.05 2.92 -7.23 0.78 -1.41 120.40 119.29 2gpf s VAL 15 Ca 0.13 -1.95 0.06 0.00 -1.81 0.00 0.00 61.98 58.41 2gpf s VAL 15 Cb -0.14 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 2gpf s VAL 15 CO 0.05 -0.20 -0.22 0.54 -0.31 0.00 0.00 175.10 174.97 2gpf s VAL 16 N -1.92 1.79 0.77 1.32 0.11 0.15 -0.30 120.40 122.33 2gpf s VAL 16 Ca 0.25 -0.92 -0.08 0.00 -2.93 0.00 0.00 61.98 58.30 2gpf s VAL 16 Cb -0.08 -1.52 0.11 0.00 -1.53 0.00 0.00 36.38 33.36 2gpf s VAL 16 CO 0.14 0.50 1.09 0.21 -3.33 0.00 0.00 175.10 173.71 2gpf s ASN 17 N -0.13 4.33 0.00 3.54 3.84 0.06 -0.12 114.94 126.46 2gpf s ASN 17 Ca -0.02 0.27 0.12 0.00 0.21 0.00 0.00 52.86 53.44 2gpf s ASN 17 Cb -0.12 -0.73 0.52 0.00 -0.55 0.00 0.00 41.25 40.37 2gpf s ASN 17 CO 0.03 -1.92 1.39 1.57 -2.79 0.00 0.00 177.10 175.38 2gpf n HIS 18 N -3.11 0.00 1.22 0.43 -0.00 -1.25 -0.16 115.22 112.34 2gpf n HIS 18 Ca 0.11 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.94 2gpf n HIS 18 Cb 0.60 -0.50 0.38 0.00 -0.00 0.00 0.00 29.99 30.47 2gpf n HIS 18 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2gpf n GLU 19 N -1.50 1.75 -3.19 1.57 1.02 -1.26 -4.90 120.64 114.13 2gpf n GLU 19 Ca 0.03 -1.13 -0.22 0.00 -0.02 0.00 0.00 57.16 55.82 2gpf n GLU 19 Cb 0.14 -1.41 0.05 0.00 -0.02 0.00 0.00 31.44 30.21 2gpf n GLU 19 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2gpf n GLU 20 N 0.36 -5.75 -4.36 3.49 -0.58 0.77 -5.00 120.64 109.56 2gpf n GLU 20 Ca 0.17 0.84 -0.35 0.00 -0.42 0.00 0.00 57.16 57.39 2gpf n GLU 20 Cb 0.34 -5.65 -0.10 0.00 -0.57 0.00 0.00 31.44 25.46 2gpf n GLU 20 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 2gpf s GLN 21 N -5.86 3.12 0.01 3.49 0.74 -1.25 -4.84 119.66 115.07 2gpf s GLN 21 Ca 0.39 -0.42 -0.16 0.00 0.05 0.00 0.00 55.36 55.22 2gpf s GLN 21 Cb -0.17 -2.83 -0.06 0.00 1.10 0.00 0.00 33.01 31.05 2gpf s GLN 21 CO 0.48 0.62 0.44 0.71 -0.55 0.00 0.00 175.29 176.99 2gpf s TYR 22 N -0.65 3.74 0.23 1.67 2.02 -1.26 -0.76 117.35 122.34 2gpf s TYR 22 Ca 0.10 1.05 0.01 0.00 -0.37 0.00 0.00 57.07 57.86 2gpf s TYR 22 Cb -0.12 -2.34 -0.04 0.00 -0.40 0.00 0.00 41.96 39.07 2gpf s TYR 22 CO 0.02 0.62 0.15 0.45 -1.57 0.00 0.00 175.55 175.22 2gpf s SER 23 N -1.04 0.52 0.03 2.29 0.15 0.59 -4.98 113.70 111.27 2gpf s SER 23 Ca 0.25 -1.45 0.08 0.00 0.70 0.00 0.00 55.95 55.52 2gpf s SER 23 Cb -0.17 0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 64.50 2gpf s SER 23 CO 0.14 -0.86 -0.22 0.27 1.20 0.00 0.00 173.24 173.77 2gpf s ILE 24 N -4.00 2.50 -0.04 6.45 -4.36 -1.26 -0.15 121.20 120.34 2gpf s ILE 24 Ca 0.39 -1.22 -0.04 0.00 -0.26 0.00 0.00 60.65 59.52 2gpf s ILE 24 Cb 0.06 -2.00 0.01 0.00 1.25 0.00 0.00 42.46 41.78 2gpf s ILE 24 CO 0.15 0.39 0.10 0.86 0.24 0.00 0.00 174.94 176.68 2gpf s TRP 25 N -0.84 -0.11 0.07 1.37 -0.11 -0.17 -4.93 118.94 114.21 2gpf s TRP 25 Ca 0.13 0.28 -0.34 0.00 1.22 0.00 0.00 56.10 57.39 2gpf s TRP 25 Cb -0.10 0.04 -0.13 0.00 -1.50 0.00 0.00 33.47 31.78 2gpf s TRP 25 CO 0.03 -0.06 1.72 -0.35 -4.62 0.00 0.00 176.95 173.68 2gpf n PRO 26 N 3.04 2.25 0.21 5.86 -0.04 -1.26 0.13 135.00 145.19 2gpf n PRO 26 Ca -0.13 0.82 0.07 0.00 -0.04 0.00 0.00 63.50 64.22 2gpf n PRO 26 Cb 0.59 -2.63 0.47 0.00 -0.04 0.00 0.00 33.50 31.88 2gpf n PRO 26 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2gpf h GLU 27 N 7.45 0.00 0.00 0.54 4.11 -1.64 -1.72 114.58 123.32 2gpf h GLU 27 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2gpf h GLU 27 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2gpf h GLU 27 CO 0.92 0.29 -0.08 2.48 0.07 0.00 0.00 179.01 182.68 2gpf n TYR 28 N -3.76 0.51 -3.72 2.06 4.11 -1.26 -4.80 117.16 110.30 2gpf n TYR 28 Ca -0.01 0.15 -0.23 0.00 -0.00 0.00 0.00 57.90 57.80 2gpf n TYR 28 Cb 0.39 -0.72 -0.02 0.00 -0.00 0.00 0.00 39.34 38.99 2gpf n TYR 28 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 2gpf s LYS 29 N -3.06 3.47 0.03 -3.48 1.02 -0.65 -5.07 119.74 112.00 2gpf s LYS 29 Ca 0.12 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.27 2gpf s LYS 29 Cb 0.15 -2.80 -0.04 0.00 -0.52 0.00 0.00 37.83 34.62 2gpf s LYS 29 CO 0.59 0.33 1.08 -2.00 -0.92 0.00 0.00 175.35 174.43 2gpf s GLU 30 N -3.97 4.50 0.05 1.68 2.12 -1.26 -4.87 118.70 116.94 2gpf s GLU 30 Ca 0.37 1.58 -0.31 0.00 0.36 0.00 0.00 54.97 56.98 2gpf s GLU 30 Cb -0.10 -3.41 -0.06 0.00 0.26 0.00 0.00 34.13 30.82 2gpf s GLU 30 CO 0.31 -0.15 1.33 0.42 -0.54 0.00 0.00 175.26 176.63 2gpf s ILE 31 N 1.05 3.71 0.84 -3.70 1.01 -1.26 -5.01 121.20 117.85 2gpf s ILE 31 Ca 0.55 1.18 -0.12 0.00 0.00 0.00 0.00 60.65 62.26 2gpf s ILE 31 Cb -0.25 -3.76 0.11 0.00 0.01 0.00 0.00 42.46 38.57 2gpf s ILE 31 CO 0.28 0.05 1.19 -2.84 0.00 0.00 0.00 174.94 173.63 2gpf s PRO 32 N 1.62 1.40 -0.38 2.79 0.02 -1.26 -4.90 135.00 134.29 2gpf s PRO 32 Ca 0.62 1.71 -0.29 0.00 0.02 0.00 0.00 61.00 63.06 2gpf s PRO 32 Cb -0.32 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.44 2gpf s PRO 32 CO 0.28 -2.38 1.54 -1.14 -0.33 0.00 0.00 177.00 174.97 2gpf s GLN 33 N -4.29 3.50 0.00 5.54 2.00 -1.26 -2.78 119.66 122.36 2gpf s GLN 33 Ca 0.71 1.11 0.00 0.00 -2.00 0.00 0.00 55.36 55.19 2gpf s GLN 33 Cb -0.27 -4.08 0.00 0.00 0.80 0.00 0.00 33.01 29.46 2gpf s GLN 33 CO 0.53 -1.66 0.00 0.41 -0.50 0.00 0.00 175.29 174.07 2gpf n GLY 34 N 5.19 0.93 3.68 2.59 0.00 -1.26 -5.13 105.19 111.19 2gpf n GLY 34 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2gpf n GLY 34 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2gpf s TRP 35 N -0.15 3.14 -0.09 1.61 0.52 -1.12 -3.92 118.94 118.93 2gpf s TRP 35 Ca 0.00 0.17 -0.00 0.00 0.02 0.00 0.00 56.10 56.29 2gpf s TRP 35 Cb 0.00 -1.77 -0.03 0.00 -1.15 0.00 0.00 33.47 30.52 2gpf s TRP 35 CO 0.00 0.46 -0.07 0.50 0.02 0.00 0.00 176.95 177.86 2gpf s ARG 36 N -0.97 3.01 -0.13 4.98 6.06 0.83 -4.88 118.95 127.86 2gpf s ARG 36 Ca 0.14 -0.55 -0.29 0.00 -2.50 0.00 0.00 55.73 52.52 2gpf s ARG 36 Cb -0.11 -2.67 -0.04 0.00 0.06 0.00 0.00 34.95 32.19 2gpf s ARG 36 CO 0.03 0.53 1.53 0.00 -2.50 0.00 0.00 175.30 174.89 2gpf s ALA 37 N -0.44 3.54 -0.36 6.12 0.00 -1.26 0.34 121.76 129.70 2gpf s ALA 37 Ca 0.06 0.68 -0.00 0.00 0.00 0.00 0.00 51.96 52.70 2gpf s ALA 37 Cb -0.12 -3.74 0.19 0.00 0.00 0.00 0.00 23.12 19.45 2gpf s ALA 37 CO 0.02 -1.48 0.82 0.00 0.00 0.00 0.00 175.76 175.12 2gpf s ALA 38 N 4.18 -3.31 0.00 0.00 0.00 -0.50 -4.91 121.76 117.23 2gpf s ALA 38 Ca 0.67 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.43 2gpf s ALA 38 Cb -0.28 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.01 2gpf s ALA 38 CO 0.25 -2.28 0.00 0.41 0.00 0.00 0.00 175.76 174.14 2gpf n GLY 39 N 4.29 -0.46 3.08 0.00 0.00 -1.23 -4.42 105.19 106.45 2gpf n GLY 39 Ca 0.08 0.23 -0.23 0.00 0.00 0.00 0.00 46.02 46.11 2gpf n GLY 39 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2gpf s LYS 40 N 0.00 1.23 -0.07 1.61 2.47 -1.26 -4.89 119.74 118.83 2gpf s LYS 40 Ca 0.00 -0.47 0.00 0.00 -1.56 0.00 0.00 55.97 53.94 2gpf s LYS 40 Cb 0.00 -1.14 -0.03 0.00 -1.46 0.00 0.00 37.83 35.20 2gpf s LYS 40 CO 0.00 0.24 -0.05 -1.54 0.16 0.00 0.00 175.35 174.16 2gpf s SER 41 N -0.11 4.84 0.00 1.43 1.04 -1.26 -1.97 113.70 117.67 2gpf s SER 41 Ca 0.01 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2gpf s SER 41 Cb -0.08 -1.26 0.00 0.00 0.10 0.00 0.00 66.02 64.78 2gpf s SER 41 CO 0.00 0.36 0.00 0.61 0.98 0.00 0.00 173.24 175.19 2gpf n GLY 42 N 2.13 -0.16 3.90 7.32 0.00 0.10 -4.98 105.19 113.52 2gpf n GLY 42 Ca -0.18 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 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 2.55 0.16 0.99 2.01 -1.26 0.61 118.68 123.74 2gpf s LEU 43 Ca 0.00 0.46 -0.15 0.00 0.01 0.00 0.00 54.13 54.45 2gpf s LEU 43 Cb 0.00 -2.64 0.09 0.00 0.01 0.00 0.00 46.19 43.66 2gpf s LEU 43 CO 0.00 -2.53 1.74 0.50 1.01 0.00 0.00 176.35 177.07 2gpf h LYS 44 N -1.50 0.27 -0.28 1.70 1.63 -1.96 -1.81 116.57 114.62 2gpf h LYS 44 Ca -0.45 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 2gpf h LYS 44 Cb 1.27 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.82 2gpf h LYS 44 CO 0.47 0.18 0.19 1.57 -3.45 0.00 0.00 179.45 178.40 2gpf h LYS 45 N 0.28 0.37 -0.32 1.90 5.09 -1.94 -0.34 116.57 121.61 2gpf h LYS 45 Ca 0.19 -0.02 -0.15 0.00 0.09 0.00 0.00 60.65 60.76 2gpf h LYS 45 Cb 0.18 -0.08 -0.01 0.00 0.10 0.00 0.00 32.23 32.42 2gpf h LYS 45 CO -0.20 0.25 -0.39 -0.44 -2.09 0.00 0.00 179.45 176.57 2gpf h ASP 46 N 0.38 0.82 -0.14 7.07 3.32 -1.69 -1.47 116.42 124.72 2gpf h ASP 46 Ca 0.10 -0.37 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 2gpf h ASP 46 Cb -0.04 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.28 2gpf h ASP 46 CO -0.02 1.11 -0.32 0.00 -1.72 0.00 0.00 179.24 178.29 2gpf h LEU 48 N 0.06 -0.22 -0.47 0.00 3.38 -0.99 -2.47 115.31 114.62 2gpf h LEU 48 Ca -0.00 0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.11 2gpf h LEU 48 Cb 0.92 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 2gpf h LEU 48 CO 0.07 -0.07 0.11 0.00 0.09 0.00 0.00 178.44 178.64 2gpf h ALA 49 N 1.25 0.53 -0.30 1.53 0.00 -1.29 -2.81 119.26 118.17 2gpf h ALA 49 Ca 0.12 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2gpf h ALA 49 Cb 0.18 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 2gpf h ALA 49 CO -0.25 -0.29 -0.08 -0.92 0.00 0.00 0.00 179.25 177.71 2gpf h TYR 50 N 0.26 -0.18 -0.30 0.00 3.20 -1.19 -0.40 116.97 118.35 2gpf h TYR 50 Ca 0.23 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.07 2gpf h TYR 50 Cb 0.28 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 2gpf h TYR 50 CO -0.20 -0.14 -0.04 0.82 -1.64 0.00 0.00 178.16 176.95 2gpf h ILE 51 N -0.01 1.20 -0.04 1.81 5.03 -1.35 -2.03 117.51 122.11 2gpf h ILE 51 Ca 0.15 -0.83 -0.13 0.00 -0.12 0.00 0.00 64.86 63.93 2gpf h ILE 51 Cb 0.24 1.02 -0.01 0.00 -3.03 0.00 0.00 36.82 35.03 2gpf h ILE 51 CO -0.32 0.28 -0.56 -0.33 -0.68 0.00 0.00 178.15 176.54 2gpf h GLU 52 N 0.46 0.13 -0.43 2.37 5.08 -1.10 -3.35 114.58 117.73 2gpf h GLU 52 Ca 0.10 -0.08 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 2gpf h GLU 52 Cb 0.37 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 2gpf h GLU 52 CO 0.02 0.66 -0.45 0.93 -1.00 0.00 0.00 179.01 179.17 2gpf h GLU 53 N 0.10 -0.23 0.04 2.33 4.39 -0.33 -3.47 114.58 117.40 2gpf h GLU 53 Ca -0.00 0.02 -0.38 0.00 0.34 0.00 0.00 59.36 59.33 2gpf h GLU 53 Cb 1.03 0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 29.67 2gpf h GLU 53 CO 0.08 -0.16 -2.34 1.55 -1.16 0.00 0.00 179.01 176.98 2gpf n VAL 54 N -4.81 1.57 -2.37 3.13 3.14 -1.26 -4.88 118.33 112.86 2gpf n VAL 54 Ca -0.02 -0.60 -0.39 0.00 -2.96 0.00 0.00 64.34 60.37 2gpf n VAL 54 Cb 0.25 -1.49 -0.02 0.00 -1.06 0.00 0.00 33.84 31.52 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 -3.31 4.03 0.00 1.45 7.02 -1.26 -4.56 117.44 120.80 2gpf n TRP 55 Ca -0.42 -2.44 0.00 0.00 -1.02 0.00 0.00 57.50 53.62 2gpf n TRP 55 Cb 1.01 -2.61 0.00 0.00 -2.42 0.00 0.00 31.31 27.28 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 6.72 0.00 -3.07 -0.99 -2.24 -1.26 -4.92 114.28 108.52 2gpf n THR 56 Ca 0.48 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.37 2gpf n THR 56 Cb 0.46 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 2gpf n THR 56 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2gpf n ASP 57 N 1.16 -7.34 -3.14 3.42 9.92 -1.26 -4.72 116.55 114.59 2gpf n ASP 57 Ca 0.00 0.83 -0.20 0.00 -0.53 0.00 0.00 54.79 54.89 2gpf n ASP 57 Cb 0.00 -2.34 -0.04 0.00 -0.64 0.00 0.00 41.12 38.10 2gpf n ASP 57 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2gpf n MET 58 N -3.18 0.83 -3.35 -1.24 1.56 -1.26 -5.02 117.12 105.46 2gpf n MET 58 Ca 0.01 -3.11 -0.18 0.00 -0.27 0.00 0.00 57.70 54.14 2gpf n MET 58 Cb 0.35 -1.41 -0.08 0.00 2.15 0.00 0.00 33.22 34.23 2gpf n MET 58 CO 0.00 0.00 0.00 -0.98 -0.73 0.00 0.00 175.97 174.26 2gpf s ARG 59 N -1.46 0.67 0.69 2.12 1.70 -1.26 -5.15 118.95 116.27 2gpf s ARG 59 Ca 0.36 -1.03 -0.17 0.00 -0.47 0.00 0.00 55.73 54.42 2gpf s ARG 59 Cb 0.25 -0.81 0.02 0.00 -0.57 0.00 0.00 34.95 33.83 2gpf s ARG 59 CO -0.10 -1.22 1.27 -1.25 -1.08 0.00 0.00 175.30 172.91 2gpf s PRO 60 N 1.25 2.29 0.35 3.89 0.04 -1.26 -4.90 135.00 136.65 2gpf s PRO 60 Ca 0.19 1.97 0.02 0.00 0.04 0.00 0.00 61.00 63.22 2gpf s PRO 60 Cb -0.14 -1.83 0.63 0.00 0.04 0.00 0.00 34.50 33.20 2gpf s PRO 60 CO -0.03 -1.77 2.01 -0.07 0.04 0.00 0.00 177.00 177.17 2gpf h LEU 61 N 0.13 0.73 0.00 -3.56 3.38 -1.96 -0.86 115.31 113.17 2gpf h LEU 61 Ca -0.50 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.46 2gpf h LEU 61 Cb 1.32 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2gpf h LEU 61 CO 0.51 0.53 0.00 -1.20 0.09 0.00 0.00 178.44 178.37 2gpf n SER 62 N -4.44 0.00 0.05 -0.43 7.64 -1.26 -0.38 113.62 114.80 2gpf n SER 62 Ca 0.07 -0.64 -0.14 0.00 1.01 0.00 0.00 58.87 59.16 2gpf n SER 62 Cb 0.04 -0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.01 2gpf n SER 62 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2gpf h LEU 63 N 0.00 0.28 0.09 -3.43 5.85 -1.47 -3.34 115.31 113.29 2gpf h LEU 63 Ca 0.00 -0.38 -0.29 0.00 0.84 0.00 0.00 57.88 58.05 2gpf h LEU 63 Cb 0.09 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2gpf h LEU 63 CO 0.00 1.32 -1.55 0.03 -0.34 0.00 0.00 178.44 177.89 2gpf h ARG 64 N 0.05 0.20 -6.04 1.25 3.08 -1.51 -3.43 114.38 107.98 2gpf h ARG 64 Ca -0.20 -0.34 -0.58 0.00 0.07 0.00 0.00 59.98 58.93 2gpf h ARG 64 Cb 1.97 0.13 -0.10 0.00 0.08 0.00 0.00 29.97 32.04 2gpf h ARG 64 CO 0.15 1.16 0.96 -0.65 -1.07 0.00 0.00 179.97 180.52 2gpf s GLN 65 N -2.48 3.23 0.36 0.04 -0.21 0.49 -4.84 119.66 116.25 2gpf s GLN 65 Ca -0.22 -0.56 0.24 0.00 0.02 0.00 0.00 55.36 54.84 2gpf s GLN 65 Cb 0.05 -4.36 0.50 0.00 1.00 0.00 0.00 33.01 30.21 2gpf s GLN 65 CO 0.73 -2.05 1.66 0.45 -2.12 0.00 0.00 175.29 173.96 2gpf h HIS 66 N 9.83 0.00 0.00 0.91 3.86 -1.83 -2.91 115.15 125.01 2gpf h HIS 66 Ca -0.21 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.00 2gpf h HIS 66 Cb 1.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.52 2gpf h HIS 66 CO 1.11 0.00 -0.33 0.52 0.86 0.00 0.00 177.93 180.08 2gpf h MET 67 N 0.00 0.00 -5.43 2.45 2.86 -1.90 -3.39 114.93 109.52 2gpf h MET 67 Ca 0.00 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.00 2gpf h MET 67 Cb 0.91 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.42 2gpf h MET 67 CO 0.00 0.00 0.85 0.34 1.06 0.00 0.00 176.91 179.16 2gpf s ASP 68 N -5.49 6.41 -0.59 1.22 -1.08 -1.10 -4.97 116.67 111.06 2gpf s ASP 68 Ca 0.06 -1.47 -0.26 0.00 -0.52 0.00 0.00 52.55 50.36 2gpf s ASP 68 Cb 0.08 -2.44 -0.03 0.00 -1.46 0.00 0.00 42.92 39.07 2gpf s ASP 68 CO 0.70 -1.32 2.00 -0.54 0.52 0.00 0.00 175.17 176.52 2gpf s LYS 69 N 3.74 2.48 0.00 4.34 1.02 -1.26 -4.33 119.74 125.73 2gpf s LYS 69 Ca 0.31 0.78 0.00 0.00 0.02 0.00 0.00 55.97 57.08 2gpf s LYS 69 Cb -0.09 -4.46 0.00 0.00 -0.52 0.00 0.00 37.83 32.77 2gpf s LYS 69 CO -0.01 -2.90 0.24 0.00 -0.92 0.00 0.00 175.35 171.76 2gpf n ALA 70 N 13.61 0.88 -1.78 5.17 0.00 -1.26 -5.12 120.51 132.01 2gpf n ALA 70 Ca 0.25 -0.03 -0.40 0.00 0.00 0.00 0.00 53.44 53.26 2gpf n ALA 70 Cb 0.53 -0.03 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 2gpf n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gpf s ALA 71 N 0.00 3.42 0.00 0.00 0.00 -1.25 -4.82 121.76 119.10 2gpf s ALA 71 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 51.96 52.89 2gpf s ALA 71 Cb 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.78 2gpf s ALA 71 CO 0.00 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 175.96