#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 3.97 -1.36 1.12 2.01 -1.26 -3.27 115.64 116.85 2gpf s THR 2 Ca 0.00 1.31 0.00 0.00 0.31 0.00 0.00 61.69 63.31 2gpf s THR 2 Cb 0.00 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 68.67 2gpf s THR 2 CO 0.00 -0.02 0.00 -1.20 -0.69 0.00 0.00 174.62 172.71 2gpf n SER 3 N 5.47 -4.91 0.17 3.53 7.64 -1.26 -4.84 113.62 119.43 2gpf n SER 3 Ca 0.12 0.32 0.13 0.00 1.01 0.00 0.00 58.87 60.45 2gpf n SER 3 Cb 0.45 -3.54 0.31 0.00 -1.01 0.00 0.00 64.21 60.42 2gpf n SER 3 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2gpf h VAL 4 N 0.00 0.00 -2.74 0.44 3.04 -2.10 -3.43 116.25 111.46 2gpf h VAL 4 Ca -0.26 -0.71 -0.55 0.00 -1.01 0.00 0.00 66.70 64.16 2gpf h VAL 4 Cb 0.96 1.70 -0.05 0.00 -2.01 0.00 0.00 31.29 31.89 2gpf h VAL 4 CO 0.38 0.00 1.18 -0.36 -1.01 0.00 0.00 177.57 177.76 2gpf s PHE 5 N -3.19 2.09 0.03 3.17 0.08 -1.26 -4.97 117.98 113.93 2gpf s PHE 5 Ca 0.08 0.61 0.09 0.00 0.12 0.00 0.00 56.93 57.83 2gpf s PHE 5 Cb 0.09 -4.26 -0.03 0.00 -0.57 0.00 0.00 43.02 38.25 2gpf s PHE 5 CO 0.62 -2.26 -0.25 0.34 -0.10 0.00 0.00 175.22 173.57 2gpf s ASP 6 N 5.35 3.23 -0.06 1.36 2.15 -1.26 -5.08 116.67 122.37 2gpf s ASP 6 Ca 0.63 -0.55 -0.01 0.00 0.43 0.00 0.00 52.55 53.05 2gpf s ASP 6 Cb -0.14 -0.34 -0.00 0.00 -0.30 0.00 0.00 42.92 42.13 2gpf s ASP 6 CO 0.28 0.27 -0.02 0.03 -0.17 0.00 0.00 175.17 175.56 2gpf h ARG 7 N 4.89 0.00 -3.36 4.34 3.08 -2.01 -3.43 114.38 117.88 2gpf h ARG 7 Ca -0.46 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 58.91 2gpf h ARG 7 Cb 1.14 0.00 -0.37 0.00 0.08 0.00 0.00 29.97 30.82 2gpf h ARG 7 CO 0.45 0.00 -0.36 -0.51 -1.07 0.00 0.00 179.97 178.48 2gpf s ASP 8 N -4.40 5.26 0.00 7.04 1.01 -1.26 -4.95 116.67 119.38 2gpf s ASP 8 Ca -0.02 -3.36 0.00 0.00 0.71 0.00 0.00 52.55 49.88 2gpf s ASP 8 Cb 0.00 -1.80 0.00 0.00 1.01 0.00 0.00 42.92 42.13 2gpf s ASP 8 CO 0.03 -0.23 0.00 -0.90 0.21 0.00 0.00 175.17 174.28 2gpf n ASP 9 N 2.75 0.00 -3.26 0.27 5.75 -1.26 -5.10 116.55 115.70 2gpf n ASP 9 Ca 0.14 0.00 -0.01 0.00 -0.01 0.00 0.00 54.79 54.91 2gpf n ASP 9 Cb 0.36 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.42 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 1.61 -0.87 -0.16 2.12 1.10 -1.26 -5.09 121.20 118.65 2gpf s ILE 10 Ca 0.00 -0.02 -0.07 0.00 -0.51 0.00 0.00 60.65 60.05 2gpf s ILE 10 Cb 0.00 -0.93 -0.04 0.00 0.15 0.00 0.00 42.46 41.64 2gpf s ILE 10 CO 0.00 -0.03 0.09 -1.10 -2.11 0.00 0.00 174.94 171.78 2gpf s GLN 11 N 2.76 3.79 0.48 3.50 -0.21 -1.26 -0.39 119.66 128.32 2gpf s GLN 11 Ca 0.16 -0.27 0.02 0.00 0.02 0.00 0.00 55.36 55.29 2gpf s GLN 11 Cb -0.15 -3.21 -0.02 0.00 1.00 0.00 0.00 33.01 30.63 2gpf s GLN 11 CO -0.19 0.45 0.03 -0.06 -2.12 0.00 0.00 175.29 173.39 2gpf s PHE 12 N -0.10 1.93 0.02 0.91 0.08 0.11 -0.70 117.98 120.22 2gpf s PHE 12 Ca 0.08 -0.98 0.01 0.00 0.12 0.00 0.00 56.93 56.15 2gpf s PHE 12 Cb -0.12 -1.54 -0.01 0.00 -0.57 0.00 0.00 43.02 40.78 2gpf s PHE 12 CO 0.01 0.15 -0.03 1.14 -0.10 0.00 0.00 175.22 176.39 2gpf s GLN 13 N -3.83 0.28 -0.23 0.44 -2.07 0.75 -2.08 119.66 112.92 2gpf s GLN 13 Ca 0.13 -0.43 -0.21 0.00 -1.82 0.00 0.00 55.36 53.03 2gpf s GLN 13 Cb 0.03 -0.04 -0.02 0.00 -1.09 0.00 0.00 33.01 31.89 2gpf s GLN 13 CO 0.07 -0.00 0.63 0.08 -1.32 0.00 0.00 175.29 174.75 2gpf s VAL 14 N -0.93 4.99 0.06 3.63 1.01 -0.47 -0.68 120.40 128.01 2gpf s VAL 14 Ca -0.09 1.16 0.07 0.00 0.00 0.00 0.00 61.98 63.12 2gpf s VAL 14 Cb -0.07 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2gpf s VAL 14 CO -0.00 0.05 -0.15 0.68 0.00 0.00 0.00 175.10 175.68 2gpf s VAL 15 N 2.30 3.04 -0.07 2.92 -7.23 0.53 -0.52 120.40 121.37 2gpf s VAL 15 Ca 0.27 -1.19 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 2gpf s VAL 15 Cb -0.16 -2.33 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 2gpf s VAL 15 CO 0.09 0.26 -0.23 0.54 -0.31 0.00 0.00 175.10 175.46 2gpf s VAL 16 N -1.03 2.26 0.60 1.32 0.11 0.13 -0.80 120.40 123.00 2gpf s VAL 16 Ca 0.17 -0.98 -0.03 0.00 -2.93 0.00 0.00 61.98 58.20 2gpf s VAL 16 Cb -0.11 -1.85 0.03 0.00 -1.53 0.00 0.00 36.38 32.93 2gpf s VAL 16 CO 0.08 0.57 0.87 0.21 -3.33 0.00 0.00 175.10 173.50 2gpf s ASN 17 N -0.11 5.23 0.00 3.54 2.47 -0.64 -1.48 114.94 123.96 2gpf s ASN 17 Ca -0.05 0.32 0.14 0.00 0.42 0.00 0.00 52.86 53.70 2gpf s ASN 17 Cb -0.14 -1.18 0.85 0.00 -1.45 0.00 0.00 41.25 39.33 2gpf s ASN 17 CO 0.04 -1.24 1.29 1.57 -3.72 0.00 0.00 177.10 175.04 2gpf n HIS 18 N -2.57 0.00 -0.20 0.43 -0.00 -1.26 -0.41 115.22 111.22 2gpf n HIS 18 Ca 0.07 0.00 0.09 0.00 -0.00 0.00 0.00 57.72 57.88 2gpf n HIS 18 Cb 0.59 0.00 0.24 0.00 -0.00 0.00 0.00 29.99 30.82 2gpf n HIS 18 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 2gpf n GLU 19 N -0.90 2.68 -3.47 1.57 2.13 -1.26 -4.96 120.64 116.44 2gpf n GLU 19 Ca 0.11 -2.34 -0.18 0.00 0.66 0.00 0.00 57.16 55.41 2gpf n GLU 19 Cb 0.05 -1.43 0.09 0.00 0.27 0.00 0.00 31.44 30.41 2gpf n GLU 19 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2gpf n GLU 20 N 1.16 -6.65 -4.96 5.31 2.13 0.46 -5.02 120.64 113.06 2gpf n GLU 20 Ca 0.18 0.83 -0.33 0.00 0.66 0.00 0.00 57.16 58.51 2gpf n GLU 20 Cb 0.53 -5.83 -0.15 0.00 0.27 0.00 0.00 31.44 26.26 2gpf n GLU 20 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2gpf s GLN 21 N -5.50 3.24 0.16 5.31 -0.21 -1.25 -4.93 119.66 116.49 2gpf s GLN 21 Ca 0.06 -0.77 -0.10 0.00 0.02 0.00 0.00 55.36 54.58 2gpf s GLN 21 Cb -0.03 -2.49 -0.07 0.00 1.00 0.00 0.00 33.01 31.43 2gpf s GLN 21 CO 0.74 0.20 0.49 0.71 -2.12 0.00 0.00 175.29 175.31 2gpf s TYR 22 N 0.34 3.51 0.24 0.91 2.02 -1.26 -1.62 117.35 121.49 2gpf s TYR 22 Ca -0.14 0.84 -0.11 0.00 -0.37 0.00 0.00 57.07 57.29 2gpf s TYR 22 Cb -0.17 -2.22 -0.01 0.00 -0.40 0.00 0.00 41.96 39.16 2gpf s TYR 22 CO 0.07 0.39 0.43 -1.12 -1.57 0.00 0.00 175.55 173.74 2gpf s SER 23 N -2.10 -0.03 -0.11 2.29 0.01 0.02 -4.99 113.70 108.80 2gpf s SER 23 Ca 0.41 -1.02 0.04 0.00 1.31 0.00 0.00 55.95 56.69 2gpf s SER 23 Cb -0.13 0.56 0.00 0.00 0.21 0.00 0.00 66.02 66.66 2gpf s SER 23 CO 0.21 -1.10 -0.23 0.27 0.41 0.00 0.00 173.24 172.80 2gpf s ILE 24 N -4.01 2.01 -0.09 1.44 -4.36 -1.26 -0.35 121.20 114.58 2gpf s ILE 24 Ca 0.25 -0.98 0.04 0.00 -0.26 0.00 0.00 60.65 59.70 2gpf s ILE 24 Cb 0.01 -1.75 -0.01 0.00 1.25 0.00 0.00 42.46 41.96 2gpf s ILE 24 CO 0.10 0.55 -0.21 0.86 0.24 0.00 0.00 174.94 176.47 2gpf s TRP 25 N 0.45 2.60 -0.14 1.37 -0.11 0.14 -4.90 118.94 118.36 2gpf s TRP 25 Ca -0.16 -0.80 -0.32 0.00 1.22 0.00 0.00 56.10 56.03 2gpf s TRP 25 Cb -0.17 -1.71 -0.10 0.00 -1.50 0.00 0.00 33.47 29.99 2gpf s TRP 25 CO 0.07 -0.27 2.03 -2.30 -4.62 0.00 0.00 176.95 171.85 2gpf n PRO 26 N 3.29 2.08 0.01 5.86 -0.02 -1.26 -0.18 135.00 144.77 2gpf n PRO 26 Ca -0.18 0.70 0.23 0.00 -2.02 0.00 0.00 63.50 62.23 2gpf n PRO 26 Cb 0.53 -2.82 0.72 0.00 -0.02 0.00 0.00 33.50 31.90 2gpf n PRO 26 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2gpf h GLU 27 N 11.33 0.00 -0.94 -0.52 4.81 -1.14 0.10 114.58 128.22 2gpf h GLU 27 Ca -0.44 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.78 2gpf h GLU 27 Cb 1.27 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.60 2gpf h GLU 27 CO 0.96 0.00 0.55 1.88 -0.73 0.00 0.00 179.01 181.67 2gpf h TYR 28 N 0.00 1.25 -2.95 0.92 0.05 -1.88 -3.44 116.97 110.92 2gpf h TYR 28 Ca 0.27 -0.01 -0.55 0.00 0.05 0.00 0.00 58.73 58.49 2gpf h TYR 28 Cb 1.36 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 38.67 2gpf h TYR 28 CO 0.00 0.84 -0.32 0.15 -1.05 0.00 0.00 178.16 177.79 2gpf s LYS 29 N -5.92 3.55 0.10 4.88 1.02 0.35 -5.08 119.74 118.63 2gpf s LYS 29 Ca -0.13 -0.25 -0.28 0.00 0.02 0.00 0.00 55.97 55.33 2gpf s LYS 29 Cb 0.17 -2.83 -0.06 0.00 -0.52 0.00 0.00 37.83 34.59 2gpf s LYS 29 CO 0.83 0.41 0.89 -2.00 -0.92 0.00 0.00 175.35 174.55 2gpf s GLU 30 N -3.16 4.63 0.63 1.68 2.12 -1.26 -4.80 118.70 118.54 2gpf s GLU 30 Ca 0.39 1.31 -0.15 0.00 0.36 0.00 0.00 54.97 56.89 2gpf s GLU 30 Cb -0.11 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 2gpf s GLU 30 CO 0.28 0.27 1.07 0.96 -0.54 0.00 0.00 175.26 177.30 2gpf s ILE 31 N -0.14 3.66 0.50 -3.70 -4.36 -1.26 -5.06 121.20 110.85 2gpf s ILE 31 Ca 0.43 0.75 -0.07 0.00 -0.26 0.00 0.00 60.65 61.50 2gpf s ILE 31 Cb -0.22 -3.29 -0.04 0.00 1.25 0.00 0.00 42.46 40.15 2gpf s ILE 31 CO 0.27 -0.50 0.84 -2.16 0.24 0.00 0.00 174.94 173.63 2gpf s PRO 32 N -4.21 3.59 0.16 0.37 0.05 -1.26 -5.03 135.00 128.67 2gpf s PRO 32 Ca 0.64 0.37 -0.31 0.00 0.05 0.00 0.00 61.00 61.74 2gpf s PRO 32 Cb -0.17 -2.31 -0.10 0.00 0.05 0.00 0.00 34.50 31.97 2gpf s PRO 32 CO 0.41 -0.27 1.55 1.14 0.05 0.00 0.00 177.00 179.88 2gpf s GLN 33 N -4.73 4.23 0.00 4.56 -2.07 -1.26 -3.04 119.66 117.34 2gpf s GLN 33 Ca 0.50 2.33 0.00 0.00 -1.82 0.00 0.00 55.36 56.37 2gpf s GLN 33 Cb -0.10 -3.16 0.00 0.00 -1.09 0.00 0.00 33.01 28.65 2gpf s GLN 33 CO 0.45 -0.59 0.00 0.41 -1.32 0.00 0.00 175.29 174.25 2gpf n GLY 34 N 3.69 1.86 3.68 2.60 0.00 -1.26 -5.10 105.19 110.66 2gpf n GLY 34 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.82 3.07 -0.08 1.61 0.52 -1.17 -4.28 118.94 116.78 2gpf s TRP 35 Ca 0.00 0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.23 2gpf s TRP 35 Cb 0.00 -1.66 -0.01 0.00 -1.15 0.00 0.00 33.47 30.65 2gpf s TRP 35 CO 0.00 0.46 -0.21 0.50 0.02 0.00 0.00 176.95 177.72 2gpf s ARG 36 N -1.60 2.81 -0.09 4.98 6.06 -0.55 -4.91 118.95 125.66 2gpf s ARG 36 Ca 0.20 -0.83 -0.30 0.00 -2.50 0.00 0.00 55.73 52.30 2gpf s ARG 36 Cb -0.12 -2.31 -0.02 0.00 0.06 0.00 0.00 34.95 32.56 2gpf s ARG 36 CO 0.11 0.34 1.13 0.00 -2.50 0.00 0.00 175.30 174.37 2gpf s ALA 37 N -0.04 3.48 -0.30 6.12 0.00 -1.26 0.21 121.76 129.98 2gpf s ALA 37 Ca -0.06 0.50 -0.11 0.00 0.00 0.00 0.00 51.96 52.30 2gpf s ALA 37 Cb -0.15 -3.50 0.18 0.00 0.00 0.00 0.00 23.12 19.66 2gpf s ALA 37 CO 0.05 -0.74 1.02 0.00 0.00 0.00 0.00 175.76 176.08 2gpf s ALA 38 N 2.26 -3.78 0.00 0.00 0.00 0.32 -4.94 121.76 115.61 2gpf s ALA 38 Ca 0.53 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.84 2gpf s ALA 38 Cb -0.22 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.17 2gpf s ALA 38 CO 0.19 -1.91 0.00 0.41 0.00 0.00 0.00 175.76 174.45 2gpf n GLY 39 N 5.22 -0.05 2.86 0.00 0.00 -1.26 -4.53 105.19 107.44 2gpf n GLY 39 Ca 0.05 0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 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 0.42 -0.20 1.61 2.47 -1.26 -4.99 119.74 117.79 2gpf s LYS 40 Ca 0.00 -0.01 0.01 0.00 -1.56 0.00 0.00 55.97 54.40 2gpf s LYS 40 Cb 0.00 -0.52 0.02 0.00 -1.46 0.00 0.00 37.83 35.88 2gpf s LYS 40 CO 0.00 -0.07 -0.16 -1.12 0.16 0.00 0.00 175.35 174.16 2gpf s SER 41 N 0.73 3.55 0.00 1.43 0.01 -1.26 -1.37 113.70 116.79 2gpf s SER 41 Ca -0.08 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.41 2gpf s SER 41 Cb -0.11 -1.53 0.00 0.00 0.21 0.00 0.00 66.02 64.59 2gpf s SER 41 CO -0.01 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.21 2gpf n GLY 42 N 4.61 -0.77 3.99 3.44 0.00 -0.88 -5.02 105.19 110.56 2gpf n GLY 42 Ca -0.19 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 2gpf n GLY 42 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2gpf s LEU 43 N 0.00 3.03 0.21 0.99 2.34 -1.26 0.07 118.68 124.06 2gpf s LEU 43 Ca 0.00 -0.36 -0.16 0.00 0.06 0.00 0.00 54.13 53.68 2gpf s LEU 43 Cb 0.00 -2.09 0.21 0.00 -0.56 0.00 0.00 46.19 43.75 2gpf s LEU 43 CO 0.00 -1.70 1.61 0.50 -1.06 0.00 0.00 176.35 175.70 2gpf h LYS 44 N -0.36 -0.06 -0.24 1.48 3.64 -1.07 -0.41 116.57 119.54 2gpf h LYS 44 Ca -0.37 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 2gpf h LYS 44 Cb 1.27 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 2gpf h LYS 44 CO 0.42 -0.04 0.11 -0.22 -2.27 0.00 0.00 179.45 177.45 2gpf h LYS 45 N -0.06 0.36 -0.10 1.90 3.11 -1.94 0.55 116.57 120.38 2gpf h LYS 45 Ca 0.29 -0.06 -0.12 0.00 -2.81 0.00 0.00 60.65 57.95 2gpf h LYS 45 Cb 0.51 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 2gpf h LYS 45 CO -0.67 0.38 -0.48 -0.44 -2.81 0.00 0.00 179.45 175.43 2gpf h ASP 46 N 0.25 0.28 0.24 4.20 3.32 -1.79 -0.34 116.42 122.58 2gpf h ASP 46 Ca 0.08 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 2gpf h ASP 46 Cb 0.15 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2gpf h ASP 46 CO -0.01 0.72 -0.11 0.00 -1.72 0.00 0.00 179.24 178.11 2gpf h LEU 48 N -0.62 -0.15 -0.93 0.00 5.85 -0.69 -1.83 115.31 116.93 2gpf h LEU 48 Ca -0.03 0.06 0.16 0.00 0.84 0.00 0.00 57.88 58.91 2gpf h LEU 48 Cb 0.45 0.12 -0.10 0.00 0.37 0.00 0.00 40.66 41.50 2gpf h LEU 48 CO 0.05 -0.04 0.53 0.00 -0.34 0.00 0.00 178.44 178.64 2gpf h ALA 49 N 1.23 1.46 -0.25 1.25 0.00 -1.12 -2.00 119.26 119.85 2gpf h ALA 49 Ca 0.12 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2gpf h ALA 49 Cb 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2gpf h ALA 49 CO -0.23 -0.03 0.15 -0.92 0.00 0.00 0.00 179.25 178.22 2gpf h TYR 50 N 0.73 0.28 -0.37 0.00 3.20 -1.21 -3.02 116.97 116.59 2gpf h TYR 50 Ca 0.51 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 62.26 2gpf h TYR 50 Cb 0.73 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 2gpf h TYR 50 CO -0.05 0.17 -0.31 0.82 -1.64 0.00 0.00 178.16 177.16 2gpf h ILE 51 N 0.31 1.28 -0.54 1.81 5.03 -1.25 -2.78 117.51 121.36 2gpf h ILE 51 Ca 0.09 -1.46 -0.05 0.00 -0.12 0.00 0.00 64.86 63.32 2gpf h ILE 51 Cb -0.02 1.32 -0.02 0.00 -3.03 0.00 0.00 36.82 35.07 2gpf h ILE 51 CO -0.03 0.48 0.13 1.05 -0.68 0.00 0.00 178.15 179.10 2gpf h GLU 52 N 0.68 0.83 0.01 2.37 4.11 -1.51 -3.32 114.58 117.74 2gpf h GLU 52 Ca 0.08 -0.17 0.01 0.00 0.07 0.00 0.00 59.36 59.35 2gpf h GLU 52 Cb 0.85 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 2gpf h GLU 52 CO 0.07 0.74 -0.38 0.93 0.07 0.00 0.00 179.01 180.45 2gpf h GLU 53 N 0.80 -0.47 0.06 1.06 4.39 -1.36 -3.47 114.58 115.59 2gpf h GLU 53 Ca 0.18 0.03 -0.37 0.00 0.34 0.00 0.00 59.36 59.54 2gpf h GLU 53 Cb 0.29 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.00 2gpf h GLU 53 CO -0.00 -0.31 -2.15 1.55 -1.16 0.00 0.00 179.01 176.94 2gpf n VAL 54 N -4.58 1.63 -2.56 3.13 3.14 -1.25 -4.67 118.33 113.17 2gpf n VAL 54 Ca -0.05 -0.54 -0.36 0.00 -2.96 0.00 0.00 64.34 60.43 2gpf n VAL 54 Cb 0.28 -1.66 0.01 0.00 -1.06 0.00 0.00 33.84 31.40 2gpf n VAL 54 CO 0.00 0.00 0.00 1.87 -6.46 0.00 0.00 176.83 172.24 2gpf n TRP 55 N -3.56 3.22 -0.81 1.45 -0.00 -1.26 -4.55 117.44 111.93 2gpf n TRP 55 Ca -0.39 -2.95 0.00 0.00 -0.00 0.00 0.00 57.50 54.16 2gpf n TRP 55 Cb 0.98 -0.88 0.00 0.00 -0.00 0.00 0.00 31.31 31.41 2gpf n TRP 55 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 177.69 177.94 2gpf n THR 56 N -0.25 0.00 -3.38 5.87 -2.24 -1.26 -5.10 114.28 107.92 2gpf n THR 56 Ca 0.43 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 62.01 2gpf n THR 56 Cb 0.34 -1.56 -0.09 0.00 -2.10 0.00 0.00 70.33 66.92 2gpf n THR 56 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2gpf s ASP 57 N -1.00 1.62 -0.30 3.42 2.15 -1.26 -5.10 116.67 116.20 2gpf s ASP 57 Ca 0.00 -1.84 -0.13 0.00 0.43 0.00 0.00 52.55 51.01 2gpf s ASP 57 Cb 0.00 0.27 0.16 0.00 -0.30 0.00 0.00 42.92 43.06 2gpf s ASP 57 CO 0.00 -0.26 0.92 -0.32 -0.17 0.00 0.00 175.17 175.34 2gpf s MET 58 N 1.23 0.34 -0.17 4.34 1.75 -1.26 -5.08 119.30 120.44 2gpf s MET 58 Ca 0.18 0.80 -0.14 0.00 -1.25 0.00 0.00 55.69 55.29 2gpf s MET 58 Cb -0.16 0.48 -0.08 0.00 2.84 0.00 0.00 34.83 37.90 2gpf s MET 58 CO -0.02 -0.16 -0.12 0.54 -0.65 0.00 0.00 175.02 174.61 2gpf n ARG 59 N 5.13 0.50 -1.03 4.11 3.00 -1.26 -4.53 116.66 122.58 2gpf n ARG 59 Ca -0.09 0.48 -0.20 0.00 -0.01 0.00 0.00 57.85 58.03 2gpf n ARG 59 Cb 0.52 -1.66 -0.11 0.00 0.00 0.00 0.00 32.46 31.21 2gpf n ARG 59 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2gpf n PRO 60 N -4.52 2.42 0.00 5.56 -0.04 -1.26 -4.50 135.00 132.66 2gpf n PRO 60 Ca -0.18 -1.34 0.05 0.00 -0.04 0.00 0.00 63.50 62.00 2gpf n PRO 60 Cb 0.45 -2.24 0.32 0.00 -0.04 0.00 0.00 33.50 31.99 2gpf n PRO 60 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 2gpf n LEU 61 N 2.93 0.00 0.04 1.53 -0.00 -1.26 -3.60 117.00 116.64 2gpf n LEU 61 Ca 0.52 0.00 0.07 0.00 -0.00 0.00 0.00 56.01 56.60 2gpf n LEU 61 Cb 0.63 0.00 0.31 0.00 -0.00 0.00 0.00 43.42 44.36 2gpf n LEU 61 CO 0.38 0.00 0.72 -1.54 -0.00 0.00 0.00 177.39 176.95 2gpf n SER 62 N -0.68 0.18 0.00 1.45 3.41 -1.26 -2.17 113.62 114.55 2gpf n SER 62 Ca 0.08 0.55 0.08 0.00 -0.26 0.00 0.00 58.87 59.32 2gpf n SER 62 Cb 0.04 -0.59 0.37 0.00 -0.26 0.00 0.00 64.21 63.77 2gpf n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gpf n LEU 63 N -1.71 0.00 0.23 1.04 -0.00 -1.24 -2.08 117.00 113.25 2gpf n LEU 63 Ca 0.02 0.39 0.12 0.00 -0.00 0.00 0.00 56.01 56.54 2gpf n LEU 63 Cb 0.14 -0.39 0.40 0.00 -0.00 0.00 0.00 43.42 43.57 2gpf n LEU 63 CO 0.12 -0.18 0.82 -0.09 -0.00 0.00 0.00 177.39 178.06 2gpf h ARG 64 N 0.00 0.00 -7.17 1.47 2.43 -1.77 -3.45 114.38 105.90 2gpf h ARG 64 Ca 0.00 0.00 -0.50 0.00 -0.81 0.00 0.00 59.98 58.67 2gpf h ARG 64 Cb 0.21 0.00 0.05 0.00 -0.42 0.00 0.00 29.97 29.81 2gpf h ARG 64 CO 0.00 0.13 0.28 -0.65 -1.51 0.00 0.00 179.97 178.22 2gpf s GLN 65 N -3.46 3.57 0.00 0.20 -0.21 -0.88 -4.97 119.66 113.91 2gpf s GLN 65 Ca 0.03 0.50 0.26 0.00 0.02 0.00 0.00 55.36 56.17 2gpf s GLN 65 Cb 0.08 -2.21 0.71 0.00 1.00 0.00 0.00 33.01 32.58 2gpf s GLN 65 CO 0.63 -0.40 1.55 0.72 -2.12 0.00 0.00 175.29 175.67 2gpf n HIS 66 N -2.53 0.00 0.18 0.91 8.25 -1.26 -3.51 115.22 117.26 2gpf n HIS 66 Ca 0.04 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.52 2gpf n HIS 66 Cb 0.55 -0.30 0.33 0.00 1.12 0.00 0.00 29.99 31.69 2gpf n HIS 66 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 2gpf h MET 67 N 0.08 0.00 -7.79 -0.41 -1.53 -1.93 -3.45 114.93 99.89 2gpf h MET 67 Ca 0.00 0.00 -0.45 0.00 -3.44 0.00 0.00 59.70 55.81 2gpf h MET 67 Cb 0.49 0.00 0.16 0.00 -0.55 0.00 0.00 31.60 31.71 2gpf h MET 67 CO 0.00 0.42 0.40 0.34 0.14 0.00 0.00 176.91 178.21 2gpf s ASP 68 N -6.78 3.09 -0.24 1.39 2.15 -1.23 -4.94 116.67 110.11 2gpf s ASP 68 Ca -0.02 0.18 -0.29 0.00 0.43 0.00 0.00 52.55 52.85 2gpf s ASP 68 Cb 0.13 -0.21 -0.03 0.00 -0.30 0.00 0.00 42.92 42.52 2gpf s ASP 68 CO 0.72 -2.74 1.73 -1.59 -0.17 0.00 0.00 175.17 173.12 2gpf s LYS 69 N -5.86 3.64 0.02 4.34 -2.85 -1.26 -4.97 119.74 112.80 2gpf s LYS 69 Ca 0.74 1.68 0.03 0.00 -1.00 0.00 0.00 55.97 57.42 2gpf s LYS 69 Cb -0.03 -4.11 -0.01 0.00 -2.06 0.00 0.00 37.83 31.61 2gpf s LYS 69 CO 0.53 -1.49 -0.09 0.00 0.10 0.00 0.00 175.35 174.40 2gpf s ALA 70 N 5.84 0.73 -0.44 0.59 0.00 -1.26 -5.08 121.76 122.14 2gpf s ALA 70 Ca 0.77 -0.57 -0.25 0.00 0.00 0.00 0.00 51.96 51.91 2gpf s ALA 70 Cb -0.26 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.78 2gpf s ALA 70 CO 0.32 0.12 0.90 0.00 0.00 0.00 0.00 175.76 177.10 2gpf s ALA 71 N -0.69 3.28 0.00 0.00 0.00 -1.26 -5.18 121.76 117.91 2gpf s ALA 71 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2gpf s ALA 71 Cb -0.06 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2gpf s ALA 71 CO 0.00 -1.93 0.00 0.41 0.00 0.00 0.00 175.76 174.24