#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 0.69 -1.02 2.03 2.01 -1.26 -5.06 115.64 113.02 2gpf s THR 2 Ca 0.00 -0.39 -0.23 0.00 0.31 0.00 0.00 61.69 61.38 2gpf s THR 2 Cb 0.00 -0.98 0.01 0.00 0.01 0.00 0.00 72.50 71.54 2gpf s THR 2 CO 0.00 0.04 1.67 -0.44 -0.69 0.00 0.00 174.62 175.20 2gpf s SER 3 N 1.81 6.02 0.14 3.53 0.01 -1.26 -4.85 113.70 119.10 2gpf s SER 3 Ca 0.01 -1.33 -0.22 0.00 1.31 0.00 0.00 55.95 55.72 2gpf s SER 3 Cb -0.15 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.52 2gpf s SER 3 CO -0.07 -1.96 1.65 1.62 0.41 0.00 0.00 173.24 174.89 2gpf h VAL 4 N 6.77 0.52 0.00 3.43 3.04 -2.02 -3.42 116.25 124.56 2gpf h VAL 4 Ca 0.20 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.89 2gpf h VAL 4 Cb 0.99 0.52 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 2gpf h VAL 4 CO 1.35 0.00 0.00 0.33 -1.01 0.00 0.00 177.57 178.24 2gpf n PHE 5 N -5.33 0.00 -3.96 3.17 7.35 -1.26 -5.14 117.46 112.28 2gpf n PHE 5 Ca -0.02 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.32 2gpf n PHE 5 Cb 0.25 0.00 -0.12 0.00 0.35 0.00 0.00 39.48 39.96 2gpf n PHE 5 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2gpf s ASP 6 N 0.00 5.09 -0.20 -2.13 1.01 -1.26 -4.99 116.67 114.18 2gpf s ASP 6 Ca 0.00 -0.15 -0.21 0.00 0.71 0.00 0.00 52.55 52.91 2gpf s ASP 6 Cb 0.00 -1.89 -0.18 0.00 1.01 0.00 0.00 42.92 41.87 2gpf s ASP 6 CO 0.00 0.05 0.19 0.03 0.21 0.00 0.00 175.17 175.65 2gpf h ARG 7 N 7.57 0.00 0.15 8.23 3.08 -2.01 -3.42 114.38 127.99 2gpf h ARG 7 Ca -0.37 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.37 2gpf h ARG 7 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2gpf h ARG 7 CO 0.61 0.92 -1.59 0.22 -1.07 0.00 0.00 179.97 179.07 2gpf h ASP 8 N -1.00 0.50 -1.54 7.04 3.58 -2.09 -3.41 116.42 119.50 2gpf h ASP 8 Ca -0.32 -0.90 -0.67 0.00 0.42 0.00 0.00 57.03 55.56 2gpf h ASP 8 Cb 1.24 -0.16 -0.13 0.00 1.72 0.00 0.00 39.33 42.00 2gpf h ASP 8 CO -0.20 1.71 1.52 -0.62 -2.88 0.00 0.00 179.24 178.77 2gpf s ASP 9 N -7.16 6.74 0.11 2.28 -1.08 -1.26 -4.95 116.67 111.34 2gpf s ASP 9 Ca -0.18 -2.17 0.00 0.00 -0.52 0.00 0.00 52.55 49.68 2gpf s ASP 9 Cb 0.05 -2.50 0.00 0.00 -1.46 0.00 0.00 42.92 39.01 2gpf s ASP 9 CO 0.81 -1.16 0.00 2.30 0.52 0.00 0.00 175.17 177.64 2gpf n ILE 10 N 5.98 0.00 -3.41 4.11 -5.35 -1.26 -4.58 119.36 114.85 2gpf n ILE 10 Ca 0.36 0.00 -0.39 0.00 -0.27 0.00 0.00 62.75 62.45 2gpf n ILE 10 Cb 0.48 -1.50 -0.09 0.00 -1.74 0.00 0.00 39.64 36.79 2gpf n ILE 10 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2gpf s GLN 11 N 0.62 4.06 0.45 6.28 1.11 -1.26 -1.60 119.66 129.32 2gpf s GLN 11 Ca 0.00 0.06 0.03 0.00 0.01 0.00 0.00 55.36 55.46 2gpf s GLN 11 Cb 0.00 -3.62 -0.02 0.00 -1.01 0.00 0.00 33.01 28.36 2gpf s GLN 11 CO 0.00 -0.19 0.06 -0.06 0.01 0.00 0.00 175.29 175.11 2gpf s PHE 12 N 1.81 1.88 0.03 0.91 0.40 0.18 -2.26 117.98 120.92 2gpf s PHE 12 Ca 0.16 -1.08 -0.13 0.00 -0.60 0.00 0.00 56.93 55.27 2gpf s PHE 12 Cb -0.15 -1.40 0.02 0.00 0.51 0.00 0.00 43.02 41.99 2gpf s PHE 12 CO 0.09 -0.00 0.28 1.14 0.70 0.00 0.00 175.22 177.43 2gpf s GLN 13 N -3.79 0.74 -0.13 0.44 -2.07 0.14 -0.72 119.66 114.27 2gpf s GLN 13 Ca 0.17 -0.45 -0.18 0.00 -1.82 0.00 0.00 55.36 53.08 2gpf s GLN 13 Cb 0.03 0.32 -0.04 0.00 -1.09 0.00 0.00 33.01 32.23 2gpf s GLN 13 CO 0.10 -0.22 0.47 0.08 -1.32 0.00 0.00 175.29 174.40 2gpf s VAL 14 N -2.21 5.18 -0.06 3.63 1.01 -1.04 -0.29 120.40 126.63 2gpf s VAL 14 Ca -0.07 0.93 0.03 0.00 0.00 0.00 0.00 61.98 62.87 2gpf s VAL 14 Cb -0.02 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 2gpf s VAL 14 CO -0.01 0.31 -0.14 0.68 0.00 0.00 0.00 175.10 175.93 2gpf s VAL 15 N 0.75 3.05 -0.11 2.92 -7.23 0.19 0.12 120.40 120.10 2gpf s VAL 15 Ca 0.25 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.73 2gpf s VAL 15 Cb -0.15 -2.20 -0.01 0.00 0.56 0.00 0.00 36.38 34.58 2gpf s VAL 15 CO 0.10 0.58 -0.19 0.54 -0.31 0.00 0.00 175.10 175.82 2gpf s VAL 16 N -0.59 2.49 0.82 1.32 0.11 0.13 -1.56 120.40 123.12 2gpf s VAL 16 Ca 0.08 -0.87 -0.12 0.00 -2.93 0.00 0.00 61.98 58.14 2gpf s VAL 16 Cb -0.11 -1.99 0.09 0.00 -1.53 0.00 0.00 36.38 32.83 2gpf s VAL 16 CO 0.01 0.55 1.19 0.21 -3.33 0.00 0.00 175.10 173.72 2gpf s ASN 17 N 0.26 4.38 0.00 3.54 3.84 -0.07 0.27 114.94 127.16 2gpf s ASN 17 Ca -0.13 0.76 0.14 0.00 0.21 0.00 0.00 52.86 53.84 2gpf s ASN 17 Cb -0.17 -1.23 0.79 0.00 -0.55 0.00 0.00 41.25 40.09 2gpf s ASN 17 CO 0.07 -1.98 1.28 1.41 -2.79 0.00 0.00 177.10 175.09 2gpf n HIS 18 N -3.36 0.00 -0.69 0.43 8.25 -0.66 -0.02 115.22 119.17 2gpf n HIS 18 Ca 0.08 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.62 2gpf n HIS 18 Cb 0.61 -0.08 0.22 0.00 1.12 0.00 0.00 29.99 31.86 2gpf n HIS 18 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2gpf n GLU 19 N -1.08 2.91 -3.91 -0.41 2.13 -1.26 -4.96 120.64 114.06 2gpf n GLU 19 Ca 0.09 -2.55 -0.25 0.00 0.66 0.00 0.00 57.16 55.11 2gpf n GLU 19 Cb 0.06 -1.63 -0.01 0.00 0.27 0.00 0.00 31.44 30.13 2gpf n GLU 19 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 2gpf n GLU 20 N -0.14 -3.71 -3.35 5.31 0.28 0.98 -4.97 120.64 115.03 2gpf n GLU 20 Ca 0.18 0.46 -0.38 0.00 -0.16 0.00 0.00 57.16 57.25 2gpf n GLU 20 Cb 0.72 -4.73 -0.06 0.00 1.43 0.00 0.00 31.44 28.80 2gpf n GLU 20 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 177.13 175.83 2gpf s GLN 21 N -6.45 4.29 -0.09 3.44 2.00 -1.25 -4.80 119.66 116.79 2gpf s GLN 21 Ca 0.06 0.35 -0.11 0.00 -2.00 0.00 0.00 55.36 53.66 2gpf s GLN 21 Cb -0.03 -3.46 -0.05 0.00 0.80 0.00 0.00 33.01 30.27 2gpf s GLN 21 CO 0.87 0.11 0.27 0.71 -0.50 0.00 0.00 175.29 176.75 2gpf s TYR 22 N 0.82 3.60 0.30 1.67 1.51 -1.26 -0.89 117.35 123.09 2gpf s TYR 22 Ca 0.23 0.69 -0.13 0.00 -1.01 0.00 0.00 57.07 56.85 2gpf s TYR 22 Cb -0.15 -2.17 0.01 0.00 -0.11 0.00 0.00 41.96 39.54 2gpf s TYR 22 CO 0.09 0.56 0.58 -1.12 -1.11 0.00 0.00 175.55 174.55 2gpf s SER 23 N -0.59 0.08 0.02 2.29 0.01 -0.60 -5.00 113.70 109.90 2gpf s SER 23 Ca 0.18 -1.01 0.04 0.00 1.31 0.00 0.00 55.95 56.47 2gpf s SER 23 Cb -0.14 0.68 -0.03 0.00 0.21 0.00 0.00 66.02 66.74 2gpf s SER 23 CO 0.07 -1.32 -0.10 0.27 0.41 0.00 0.00 173.24 172.58 2gpf s ILE 24 N -3.50 3.42 -0.06 1.44 -4.36 -1.26 -0.64 121.20 116.24 2gpf s ILE 24 Ca 0.20 -0.90 -0.04 0.00 -0.26 0.00 0.00 60.65 59.66 2gpf s ILE 24 Cb -0.03 -2.48 0.02 0.00 1.25 0.00 0.00 42.46 41.23 2gpf s ILE 24 CO 0.11 0.37 0.14 0.86 0.24 0.00 0.00 174.94 176.66 2gpf s TRP 25 N -0.99 -0.16 0.16 1.37 -0.11 0.60 -4.89 118.94 114.93 2gpf s TRP 25 Ca 0.17 0.42 -0.32 0.00 1.22 0.00 0.00 56.10 57.59 2gpf s TRP 25 Cb -0.11 0.00 -0.11 0.00 -1.50 0.00 0.00 33.47 31.75 2gpf s TRP 25 CO 0.07 -0.11 1.78 -2.30 -4.62 0.00 0.00 176.95 171.77 2gpf n PRO 26 N 3.49 2.76 0.14 5.86 -0.02 -1.26 0.26 135.00 146.23 2gpf n PRO 26 Ca -0.18 1.00 0.12 0.00 -2.02 0.00 0.00 63.50 62.42 2gpf n PRO 26 Cb 0.56 -2.87 0.49 0.00 -0.02 0.00 0.00 33.50 31.67 2gpf n PRO 26 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2gpf n GLU 27 N 4.86 0.21 0.08 -0.52 0.28 -0.96 -2.20 120.64 122.40 2gpf n GLU 27 Ca 0.17 0.42 0.00 0.00 -0.16 0.00 0.00 57.16 57.59 2gpf n GLU 27 Cb 0.36 -1.89 0.32 0.00 1.43 0.00 0.00 31.44 31.66 2gpf n GLU 27 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 177.13 178.85 2gpf h TYR 28 N 0.00 0.33 -2.43 -1.84 0.05 -1.90 -3.44 116.97 107.75 2gpf h TYR 28 Ca 0.00 -0.05 -0.52 0.00 0.05 0.00 0.00 58.73 58.21 2gpf h TYR 28 Cb 0.40 -0.09 -0.04 0.00 1.01 0.00 0.00 36.73 38.01 2gpf h TYR 28 CO 0.00 0.48 -0.50 0.15 -1.05 0.00 0.00 178.16 177.24 2gpf s LYS 29 N -4.60 3.16 0.50 4.88 1.02 -0.94 -5.10 119.74 118.67 2gpf s LYS 29 Ca -0.06 -0.82 -0.19 0.00 0.02 0.00 0.00 55.97 54.92 2gpf s LYS 29 Cb 0.15 -2.76 -0.08 0.00 -0.52 0.00 0.00 37.83 34.62 2gpf s LYS 29 CO 0.75 0.46 1.03 -2.00 -0.92 0.00 0.00 175.35 174.67 2gpf s GLU 30 N -3.52 3.79 0.16 1.68 2.56 -1.26 -4.89 118.70 117.22 2gpf s GLU 30 Ca 0.33 1.29 -0.30 0.00 0.00 0.00 0.00 54.97 56.29 2gpf s GLU 30 Cb -0.10 -2.10 -0.07 0.00 2.00 0.00 0.00 34.13 33.87 2gpf s GLU 30 CO 0.26 -0.43 1.03 0.42 -0.56 0.00 0.00 175.26 175.98 2gpf s ILE 31 N -2.10 4.14 0.45 -3.70 1.01 -1.26 -5.02 121.20 114.72 2gpf s ILE 31 Ca 0.66 1.84 -0.24 0.00 0.00 0.00 0.00 60.65 62.90 2gpf s ILE 31 Cb -0.15 -4.17 -0.09 0.00 0.01 0.00 0.00 42.46 38.06 2gpf s ILE 31 CO 0.22 0.31 1.27 -2.65 0.00 0.00 0.00 174.94 174.09 2gpf n PRO 32 N 2.46 1.84 -2.07 2.79 -0.02 -1.26 -4.91 135.00 133.82 2gpf n PRO 32 Ca 0.02 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.74 2gpf n PRO 32 Cb 0.47 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.52 2gpf n PRO 32 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2gpf s GLN 33 N -2.35 4.21 0.00 -0.52 -2.07 -1.26 -2.38 119.66 115.29 2gpf s GLN 33 Ca 0.63 2.12 0.00 0.00 -1.82 0.00 0.00 55.36 56.30 2gpf s GLN 33 Cb -0.49 -3.81 0.00 0.00 -1.09 0.00 0.00 33.01 27.63 2gpf s GLN 33 CO 0.56 -0.76 0.00 0.41 -1.32 0.00 0.00 175.29 174.18 2gpf n GLY 34 N 3.96 1.69 3.52 2.60 0.00 -1.26 -5.11 105.19 110.58 2gpf n GLY 34 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.16 2.40 0.05 1.61 0.52 -1.00 -1.66 118.94 119.71 2gpf s TRP 35 Ca 0.00 -0.30 0.02 0.00 0.02 0.00 0.00 56.10 55.84 2gpf s TRP 35 Cb 0.00 -1.05 -0.03 0.00 -1.15 0.00 0.00 33.47 31.24 2gpf s TRP 35 CO 0.00 0.69 -0.07 1.03 0.02 0.00 0.00 176.95 178.61 2gpf s ARG 36 N -3.53 0.58 0.16 4.98 0.52 0.14 -4.84 118.95 116.96 2gpf s ARG 36 Ca 0.30 -0.87 -0.30 0.00 -0.52 0.00 0.00 55.73 54.34 2gpf s ARG 36 Cb -0.05 -0.25 -0.08 0.00 0.52 0.00 0.00 34.95 35.09 2gpf s ARG 36 CO 0.16 0.03 1.19 0.00 0.02 0.00 0.00 175.30 176.71 2gpf s ALA 37 N -1.87 3.43 0.22 2.13 0.00 -1.26 0.19 121.76 124.60 2gpf s ALA 37 Ca -0.06 0.93 -0.15 0.00 0.00 0.00 0.00 51.96 52.68 2gpf s ALA 37 Cb -0.07 -3.42 0.01 0.00 0.00 0.00 0.00 23.12 19.65 2gpf s ALA 37 CO -0.01 -0.38 0.50 0.00 0.00 0.00 0.00 175.76 175.88 2gpf s ALA 38 N 0.16 -0.61 0.00 0.00 0.00 0.12 -4.89 121.76 116.55 2gpf s ALA 38 Ca 0.54 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.95 2gpf s ALA 38 Cb -0.32 0.93 0.00 0.00 0.00 0.00 0.00 23.12 23.73 2gpf s ALA 38 CO 0.35 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2gpf n GLY 39 N -0.36 1.49 3.13 0.00 0.00 -1.26 -3.41 105.19 104.79 2gpf n GLY 39 Ca -0.06 0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 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 1.17 -0.18 1.61 1.02 -1.26 -5.02 119.74 117.08 2gpf s LYS 40 Ca 0.00 -0.59 0.01 0.00 0.02 0.00 0.00 55.97 55.41 2gpf s LYS 40 Cb 0.00 -1.15 0.03 0.00 -0.52 0.00 0.00 37.83 36.20 2gpf s LYS 40 CO 0.00 0.31 -0.13 0.45 -0.92 0.00 0.00 175.35 175.06 2gpf s SER 41 N -0.53 3.16 0.00 2.83 0.15 -1.26 -2.50 113.70 115.56 2gpf s SER 41 Ca 0.05 -0.74 0.00 0.00 0.70 0.00 0.00 55.95 55.96 2gpf s SER 41 Cb -0.06 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 2gpf s SER 41 CO -0.00 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2gpf n GLY 42 N 4.69 -0.55 3.82 9.45 0.00 0.10 -4.99 105.19 117.71 2gpf n GLY 42 Ca -0.16 0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 3.38 0.23 0.99 2.01 -1.26 0.49 118.68 124.52 2gpf s LEU 43 Ca 0.00 1.70 -0.08 0.00 0.01 0.00 0.00 54.13 55.76 2gpf s LEU 43 Cb 0.00 -4.51 0.21 0.00 0.01 0.00 0.00 46.19 41.90 2gpf s LEU 43 CO 0.00 -1.18 1.90 0.50 1.01 0.00 0.00 176.35 178.59 2gpf h LYS 44 N 0.08 1.15 -0.05 1.70 3.64 -1.55 -1.66 116.57 119.89 2gpf h LYS 44 Ca -0.46 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 58.82 2gpf h LYS 44 Cb 1.21 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.76 2gpf h LYS 44 CO 0.58 0.76 -0.13 1.57 -2.27 0.00 0.00 179.45 179.96 2gpf h LYS 45 N 1.19 0.08 -0.12 1.90 5.09 -1.93 -0.26 116.57 122.52 2gpf h LYS 45 Ca 0.32 -0.01 -0.17 0.00 0.09 0.00 0.00 60.65 60.88 2gpf h LYS 45 Cb -0.13 -0.01 -0.00 0.00 0.10 0.00 0.00 32.23 32.18 2gpf h LYS 45 CO -0.07 0.22 -0.65 -0.44 -2.09 0.00 0.00 179.45 176.41 2gpf h ASP 46 N 0.08 0.54 -0.09 7.07 3.32 -1.69 -2.31 116.42 123.33 2gpf h ASP 46 Ca 0.02 -0.32 -0.12 0.00 0.02 0.00 0.00 57.03 56.63 2gpf h ASP 46 Cb 0.29 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.69 2gpf h ASP 46 CO 0.02 1.05 -0.40 0.00 -1.72 0.00 0.00 179.24 178.19 2gpf h LEU 48 N -0.02 0.51 -0.43 0.00 3.38 -1.12 -1.52 115.31 116.11 2gpf h LEU 48 Ca -0.02 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.07 2gpf h LEU 48 Cb 1.04 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 2gpf h LEU 48 CO 0.08 0.32 0.01 0.00 0.09 0.00 0.00 178.44 178.94 2gpf h ALA 49 N 1.38 0.40 -0.54 1.53 0.00 -1.35 -2.63 119.26 118.04 2gpf h ALA 49 Ca 0.32 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.43 2gpf h ALA 49 Cb 0.25 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 2gpf h ALA 49 CO -0.21 -0.38 0.20 -0.92 0.00 0.00 0.00 179.25 177.93 2gpf h TYR 50 N 0.12 0.34 -0.36 0.00 3.20 -0.85 -1.75 116.97 117.67 2gpf h TYR 50 Ca 0.21 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.05 2gpf h TYR 50 Cb 0.30 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 2gpf h TYR 50 CO -0.28 0.10 -0.01 0.82 -1.64 0.00 0.00 178.16 177.15 2gpf h ILE 51 N 0.38 1.21 -0.64 1.81 5.03 -1.17 -2.19 117.51 121.93 2gpf h ILE 51 Ca 0.27 -0.85 -0.03 0.00 -0.12 0.00 0.00 64.86 64.12 2gpf h ILE 51 Cb 0.30 0.95 -0.03 0.00 -3.03 0.00 0.00 36.82 35.02 2gpf h ILE 51 CO -0.27 0.29 0.27 -0.08 -0.68 0.00 0.00 178.15 177.68 2gpf h GLU 52 N 0.54 0.96 -0.31 2.37 4.57 -1.08 -3.35 114.58 118.28 2gpf h GLU 52 Ca 0.11 -0.17 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2gpf h GLU 52 Cb 0.37 -0.16 -0.07 0.00 -0.16 0.00 0.00 28.75 28.73 2gpf h GLU 52 CO 0.01 0.80 -0.50 0.93 -1.18 0.00 0.00 179.01 179.07 2gpf h GLU 53 N 0.90 -0.39 0.01 1.92 4.39 -0.80 -3.47 114.58 117.14 2gpf h GLU 53 Ca 0.22 0.03 -0.40 0.00 0.34 0.00 0.00 59.36 59.54 2gpf h GLU 53 Cb 0.19 0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 28.86 2gpf h GLU 53 CO -0.02 -0.26 -2.46 1.55 -1.16 0.00 0.00 179.01 176.66 2gpf n VAL 54 N -5.13 1.51 -1.49 3.13 3.14 -1.26 -4.57 118.33 113.67 2gpf n VAL 54 Ca -0.04 -0.53 -0.07 0.00 -2.96 0.00 0.00 64.34 60.74 2gpf n VAL 54 Cb 0.32 -1.54 0.19 0.00 -1.06 0.00 0.00 33.84 31.74 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 -3.50 1.30 -4.32 1.45 -0.00 -1.26 -4.57 117.44 106.54 2gpf n TRP 55 Ca -0.47 -1.71 -0.19 0.00 -0.00 0.00 0.00 57.50 55.14 2gpf n TRP 55 Cb 0.97 -0.53 -0.15 0.00 -0.00 0.00 0.00 31.31 31.60 2gpf n TRP 55 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 2gpf s THR 56 N -3.38 0.66 -0.68 5.87 -1.32 -1.26 -5.09 115.64 110.44 2gpf s THR 56 Ca 0.46 -0.33 0.05 0.00 -1.21 0.00 0.00 61.69 60.66 2gpf s THR 56 Cb 0.41 -0.57 0.18 0.00 -1.51 0.00 0.00 72.50 71.01 2gpf s THR 56 CO -0.00 0.20 0.50 -0.67 -2.21 0.00 0.00 174.62 172.44 2gpf n ASP 57 N 3.07 2.75 0.00 8.08 -0.08 -1.26 -4.77 116.55 124.34 2gpf n ASP 57 Ca -0.15 -3.15 0.00 0.00 -1.51 0.00 0.00 54.79 49.97 2gpf n ASP 57 Cb 0.56 -0.73 0.00 0.00 2.34 0.00 0.00 41.12 43.29 2gpf n ASP 57 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 2gpf n MET 58 N 1.95 0.00 -3.50 -0.67 2.81 -1.26 -4.97 117.12 111.48 2gpf n MET 58 Ca 0.22 0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.84 2gpf n MET 58 Cb 0.37 -0.34 -0.10 0.00 -0.71 0.00 0.00 33.22 32.43 2gpf n MET 58 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 2gpf n ARG 59 N -2.61 0.70 -0.72 0.03 0.63 -1.26 -5.13 116.66 108.30 2gpf n ARG 59 Ca 0.00 -3.55 -0.30 0.00 -0.92 0.00 0.00 57.85 53.09 2gpf n ARG 59 Cb 0.25 -1.81 0.20 0.00 0.45 0.00 0.00 32.46 31.55 2gpf n ARG 59 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2gpf s PRO 60 N -0.48 0.22 0.02 -0.14 0.02 -1.26 -4.88 135.00 128.49 2gpf s PRO 60 Ca 0.31 1.13 0.12 0.00 0.02 0.00 0.00 61.00 62.58 2gpf s PRO 60 Cb 0.03 -1.66 0.54 0.00 0.02 0.00 0.00 34.50 33.42 2gpf s PRO 60 CO -0.18 -3.04 1.40 -0.11 -0.33 0.00 0.00 177.00 174.73 2gpf n LEU 61 N -4.48 0.05 0.02 -5.54 7.94 -1.26 -2.96 117.00 110.78 2gpf n LEU 61 Ca 0.07 0.51 -0.10 0.00 -1.11 0.00 0.00 56.01 55.38 2gpf n LEU 61 Cb 0.53 -0.51 -0.04 0.00 0.53 0.00 0.00 43.42 43.94 2gpf n LEU 61 CO 0.54 -0.32 0.74 0.77 -1.11 0.00 0.00 177.39 178.01 2gpf h SER 62 N 0.00 -0.53 0.62 1.96 4.64 -1.93 0.10 113.55 118.41 2gpf h SER 62 Ca 0.00 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2gpf h SER 62 Cb 0.21 0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2gpf h SER 62 CO 0.00 -0.23 -0.85 0.00 -0.87 0.00 0.00 176.83 174.88 2gpf n LEU 63 N -5.31 0.65 0.07 5.97 -0.00 -1.20 -3.98 117.00 113.19 2gpf n LEU 63 Ca -0.04 0.09 -0.12 0.00 -0.00 0.00 0.00 56.01 55.95 2gpf n LEU 63 Cb 0.23 -0.13 -0.02 0.00 -0.00 0.00 0.00 43.42 43.49 2gpf n LEU 63 CO 0.23 -0.00 0.24 -0.09 -0.00 0.00 0.00 177.39 177.76 2gpf h ARG 64 N 0.00 0.38 -6.38 1.47 2.43 -1.37 -3.41 114.38 107.50 2gpf h ARG 64 Ca 0.00 -0.38 -0.54 0.00 -0.81 0.00 0.00 59.98 58.25 2gpf h ARG 64 Cb 0.74 0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 30.32 2gpf h ARG 64 CO 0.00 1.05 1.08 -1.14 -1.51 0.00 0.00 179.97 179.45 2gpf s GLN 65 N -3.34 3.23 -0.22 0.20 2.00 0.33 -4.81 119.66 117.04 2gpf s GLN 65 Ca -0.05 0.12 0.10 0.00 -2.00 0.00 0.00 55.36 53.52 2gpf s GLN 65 Cb 0.09 -4.15 -0.20 0.00 0.80 0.00 0.00 33.01 29.55 2gpf s GLN 65 CO 0.85 -2.06 -0.06 0.72 -0.50 0.00 0.00 175.29 174.24 2gpf n HIS 66 N 9.58 0.00 0.43 1.67 8.25 -1.26 -4.48 115.22 129.40 2gpf n HIS 66 Ca 0.08 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.67 2gpf n HIS 66 Cb 0.49 -0.95 0.46 0.00 1.12 0.00 0.00 29.99 31.11 2gpf n HIS 66 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2gpf h MET 67 N 0.00 0.00 -3.40 -0.41 -0.00 -1.99 -3.42 114.93 105.72 2gpf h MET 67 Ca -0.54 0.00 -0.35 0.00 -0.00 0.00 0.00 59.70 58.81 2gpf h MET 67 Cb 2.04 0.00 -0.37 0.00 -0.00 0.00 0.00 31.60 33.27 2gpf h MET 67 CO -0.02 0.00 -0.74 0.34 -0.00 0.00 0.00 176.91 176.49 2gpf s ASP 68 N -4.84 0.84 0.16 -0.10 2.15 -1.26 -5.14 116.67 108.48 2gpf s ASP 68 Ca 0.06 0.06 -0.25 0.00 0.43 0.00 0.00 52.55 52.85 2gpf s ASP 68 Cb 0.10 -0.14 0.06 0.00 -0.30 0.00 0.00 42.92 42.64 2gpf s ASP 68 CO 0.52 -0.21 0.94 -1.59 -0.17 0.00 0.00 175.17 174.66 2gpf s LYS 69 N 1.82 1.24 0.34 4.34 -2.85 -1.26 -4.89 119.74 118.47 2gpf s LYS 69 Ca 0.01 -0.68 0.01 0.00 -1.00 0.00 0.00 55.97 54.31 2gpf s LYS 69 Cb -0.12 0.42 0.58 0.00 -2.06 0.00 0.00 37.83 36.65 2gpf s LYS 69 CO -0.03 -0.57 1.98 0.00 0.10 0.00 0.00 175.35 176.84 2gpf h ALA 70 N 2.00 1.49 -1.76 0.59 0.00 -2.00 -3.36 119.26 116.21 2gpf h ALA 70 Ca -0.24 -0.07 -0.56 0.00 0.00 0.00 0.00 54.91 54.04 2gpf h ALA 70 Cb 1.23 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 2gpf h ALA 70 CO 0.25 0.45 1.01 0.00 0.00 0.00 0.00 179.25 180.96 2gpf s ALA 71 N -5.69 3.10 0.00 0.00 0.00 -1.26 -5.32 121.76 112.59 2gpf s ALA 71 Ca -0.10 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2gpf s ALA 71 Cb 0.17 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2gpf s ALA 71 CO 0.77 -2.33 0.00 0.41 0.00 0.00 0.00 175.76 174.61