#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 3.75 -0.88 2.03 2.01 -1.26 -4.94 115.64 116.35 2gpf s THR 2 Ca 0.00 1.35 -0.25 0.00 0.31 0.00 0.00 61.69 63.10 2gpf s THR 2 Cb 0.00 -3.70 -0.06 0.00 0.01 0.00 0.00 72.50 68.76 2gpf s THR 2 CO 0.00 0.01 1.99 -0.44 -0.69 0.00 0.00 174.62 175.50 2gpf s SER 3 N -1.56 5.02 0.20 3.53 0.01 -1.26 -4.72 113.70 114.92 2gpf s SER 3 Ca 0.57 -0.56 0.24 0.00 1.31 0.00 0.00 55.95 57.52 2gpf s SER 3 Cb -0.22 -2.56 0.91 0.00 0.21 0.00 0.00 66.02 64.36 2gpf s SER 3 CO 0.27 -2.85 1.73 0.55 0.41 0.00 0.00 173.24 173.36 2gpf n VAL 4 N 7.95 0.69 -1.63 3.43 3.14 -1.26 -4.98 118.33 125.67 2gpf n VAL 4 Ca 0.40 0.02 -0.01 0.00 -2.96 0.00 0.00 64.34 61.80 2gpf n VAL 4 Cb 0.47 -0.89 -0.01 0.00 -1.06 0.00 0.00 33.84 32.35 2gpf n VAL 4 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 2gpf n PHE 5 N -2.14 -1.75 -2.66 1.45 7.35 -1.26 -4.98 117.46 113.47 2gpf n PHE 5 Ca 0.04 1.04 -0.41 0.00 -0.76 0.00 0.00 57.45 57.35 2gpf n PHE 5 Cb 0.31 -2.59 -0.04 0.00 0.35 0.00 0.00 39.48 37.51 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 -0.23 7.40 0.03 -2.13 1.11 -1.26 -4.97 116.67 116.62 2gpf s ASP 6 Ca -0.04 1.84 -0.18 0.00 0.18 0.00 0.00 52.55 54.35 2gpf s ASP 6 Cb 0.00 -2.59 -0.23 0.00 1.07 0.00 0.00 42.92 41.18 2gpf s ASP 6 CO 0.10 -0.16 1.14 0.03 1.18 0.00 0.00 175.17 177.45 2gpf h ARG 7 N 5.81 0.50 0.01 8.23 3.08 -2.01 -3.37 114.38 126.63 2gpf h ARG 7 Ca -0.43 -0.51 -0.36 0.00 0.07 0.00 0.00 59.98 58.75 2gpf h ARG 7 Cb 1.21 0.14 -0.06 0.00 0.08 0.00 0.00 29.97 31.34 2gpf h ARG 7 CO 0.73 1.15 -2.28 -3.47 -1.07 0.00 0.00 179.97 175.03 2gpf n ASP 8 N -4.14 0.87 -4.47 7.04 2.03 -1.26 -4.80 116.55 111.83 2gpf n ASP 8 Ca -0.10 0.04 -0.43 0.00 0.52 0.00 0.00 54.79 54.82 2gpf n ASP 8 Cb 0.71 0.28 -0.04 0.00 -0.72 0.00 0.00 41.12 41.35 2gpf n ASP 8 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2gpf s ASP 9 N -6.01 6.23 0.01 1.67 2.15 -1.26 -5.01 116.67 114.45 2gpf s ASP 9 Ca -0.17 -0.81 0.00 0.00 0.43 0.00 0.00 52.55 52.00 2gpf s ASP 9 Cb 0.07 -2.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 2gpf s ASP 9 CO 0.76 -1.30 0.00 2.30 -0.17 0.00 0.00 175.17 176.76 2gpf n ILE 10 N 5.95 0.00 -3.63 4.11 -5.35 -1.26 -4.35 119.36 114.83 2gpf n ILE 10 Ca -0.03 0.00 -0.37 0.00 -0.27 0.00 0.00 62.75 62.09 2gpf n ILE 10 Cb 0.46 -1.43 -0.09 0.00 -1.74 0.00 0.00 39.64 36.83 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 1.64 4.08 0.38 6.28 1.11 -1.26 -0.86 119.66 131.03 2gpf s GLN 11 Ca 0.00 -0.23 0.04 0.00 0.01 0.00 0.00 55.36 55.18 2gpf s GLN 11 Cb 0.00 -3.54 -0.02 0.00 -1.01 0.00 0.00 33.01 28.44 2gpf s GLN 11 CO 0.00 0.04 0.15 1.19 0.01 0.00 0.00 175.29 176.68 2gpf n PHE 12 N 4.33 0.05 -3.60 0.91 3.01 0.16 -2.22 117.46 120.09 2gpf n PHE 12 Ca -0.14 -2.47 -0.11 0.00 1.01 0.00 0.00 57.45 55.74 2gpf n PHE 12 Cb 0.52 0.02 -0.04 0.00 -0.01 0.00 0.00 39.48 39.97 2gpf n PHE 12 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 2gpf s GLN 13 N -3.44 1.23 -0.15 -1.08 -2.07 0.10 -1.32 119.66 112.93 2gpf s GLN 13 Ca 0.21 -0.69 -0.10 0.00 -1.82 0.00 0.00 55.36 52.96 2gpf s GLN 13 Cb 0.01 0.52 -0.05 0.00 -1.09 0.00 0.00 33.01 32.41 2gpf s GLN 13 CO 0.15 -0.52 0.18 0.08 -1.32 0.00 0.00 175.29 173.87 2gpf s VAL 14 N -3.81 5.39 -0.01 3.63 1.01 -1.23 0.04 120.40 125.43 2gpf s VAL 14 Ca 0.04 0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.39 2gpf s VAL 14 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 2gpf s VAL 14 CO -0.09 0.50 -0.17 0.68 0.00 0.00 0.00 175.10 176.01 2gpf s VAL 15 N -0.16 2.83 -0.08 2.92 -7.23 0.77 0.70 120.40 120.15 2gpf s VAL 15 Ca 0.13 -0.96 0.02 0.00 -1.81 0.00 0.00 61.98 59.36 2gpf s VAL 15 Cb -0.12 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 2gpf s VAL 15 CO 0.02 0.48 -0.13 0.54 -0.31 0.00 0.00 175.10 175.70 2gpf s VAL 16 N -0.80 3.11 0.67 1.32 0.11 0.16 -1.33 120.40 123.64 2gpf s VAL 16 Ca 0.13 -0.68 -0.10 0.00 -2.93 0.00 0.00 61.98 58.40 2gpf s VAL 16 Cb -0.10 -2.25 0.02 0.00 -1.53 0.00 0.00 36.38 32.51 2gpf s VAL 16 CO 0.02 0.57 1.04 0.21 -3.33 0.00 0.00 175.10 173.61 2gpf s ASN 17 N -0.33 5.44 0.00 3.54 3.84 -0.36 -2.60 114.94 124.47 2gpf s ASN 17 Ca 0.03 0.97 0.13 0.00 0.21 0.00 0.00 52.86 54.20 2gpf s ASN 17 Cb -0.13 -1.81 0.71 0.00 -0.55 0.00 0.00 41.25 39.47 2gpf s ASN 17 CO 0.02 -1.28 1.31 1.41 -2.79 0.00 0.00 177.10 175.77 2gpf n HIS 18 N -2.89 0.00 -0.75 0.43 8.25 -1.26 -0.73 115.22 118.27 2gpf n HIS 18 Ca 0.06 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.60 2gpf n HIS 18 Cb 0.58 -0.20 0.18 0.00 1.12 0.00 0.00 29.99 31.67 2gpf n HIS 18 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2gpf n GLU 19 N -1.20 2.49 -3.54 -0.41 1.02 -1.26 -4.98 120.64 112.76 2gpf n GLU 19 Ca 0.07 -2.48 -0.19 0.00 -0.02 0.00 0.00 57.16 54.55 2gpf n GLU 19 Cb 0.09 -1.55 0.07 0.00 -0.02 0.00 0.00 31.44 30.02 2gpf n GLU 19 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2gpf n GLU 20 N -0.58 -6.12 -3.41 3.49 0.28 0.09 -5.02 120.64 109.38 2gpf n GLU 20 Ca 0.16 0.77 -0.38 0.00 -0.16 0.00 0.00 57.16 57.55 2gpf n GLU 20 Cb 0.67 -5.64 -0.06 0.00 1.43 0.00 0.00 31.44 27.84 2gpf n GLU 20 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2gpf s GLN 21 N -5.63 4.01 -0.22 3.44 1.11 -1.26 -4.84 119.66 116.28 2gpf s GLN 21 Ca 0.04 0.52 -0.05 0.00 0.01 0.00 0.00 55.36 55.88 2gpf s GLN 21 Cb -0.02 -3.19 -0.02 0.00 -1.01 0.00 0.00 33.01 28.76 2gpf s GLN 21 CO 0.76 0.65 0.01 0.71 0.01 0.00 0.00 175.29 177.43 2gpf s TYR 22 N -1.13 3.03 0.24 0.91 1.51 -1.26 -1.22 117.35 119.42 2gpf s TYR 22 Ca 0.27 -0.58 0.05 0.00 -1.01 0.00 0.00 57.07 55.80 2gpf s TYR 22 Cb -0.17 -2.14 -0.05 0.00 -0.11 0.00 0.00 41.96 39.49 2gpf s TYR 22 CO 0.16 -0.36 -0.05 -1.12 -1.11 0.00 0.00 175.55 173.06 2gpf s SER 23 N 1.33 2.29 -0.08 2.29 0.01 -0.44 -4.97 113.70 114.12 2gpf s SER 23 Ca 0.04 -1.16 -0.01 0.00 1.31 0.00 0.00 55.95 56.14 2gpf s SER 23 Cb -0.15 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 65.97 2gpf s SER 23 CO 0.01 -0.38 -0.04 0.27 0.41 0.00 0.00 173.24 173.51 2gpf s ILE 24 N -3.19 3.98 -0.04 1.44 -4.36 -1.26 -0.16 121.20 117.61 2gpf s ILE 24 Ca 0.27 -0.37 -0.02 0.00 -0.26 0.00 0.00 60.65 60.27 2gpf s ILE 24 Cb 0.04 -2.65 0.03 0.00 1.25 0.00 0.00 42.46 41.12 2gpf s ILE 24 CO 0.09 0.60 0.10 0.86 0.24 0.00 0.00 174.94 176.82 2gpf s TRP 25 N -0.81 -0.09 0.08 1.37 -0.11 0.11 -4.91 118.94 114.58 2gpf s TRP 25 Ca 0.12 0.31 -0.34 0.00 1.22 0.00 0.00 56.10 57.41 2gpf s TRP 25 Cb -0.11 -0.09 -0.13 0.00 -1.50 0.00 0.00 33.47 31.63 2gpf s TRP 25 CO 0.02 -0.11 1.67 -2.30 -4.62 0.00 0.00 176.95 171.61 2gpf n PRO 26 N 3.86 2.14 0.00 5.86 -0.02 -1.26 0.01 135.00 145.59 2gpf n PRO 26 Ca -0.23 0.78 0.08 0.00 -2.02 0.00 0.00 63.50 62.11 2gpf n PRO 26 Cb 0.53 -2.57 0.44 0.00 -0.02 0.00 0.00 33.50 31.88 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 4.46 0.26 -0.02 -0.52 -0.00 -0.94 -2.44 120.64 121.44 2gpf n GLU 27 Ca 0.19 0.12 -0.14 0.00 -0.00 0.00 0.00 57.16 57.33 2gpf n GLU 27 Cb 0.29 -1.50 -0.02 0.00 -0.00 0.00 0.00 31.44 30.21 2gpf n GLU 27 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.13 179.01 2gpf h TYR 28 N 0.00 0.93 -1.72 -1.84 0.05 -1.89 -3.46 116.97 109.03 2gpf h TYR 28 Ca 0.00 -0.37 -0.44 0.00 0.05 0.00 0.00 58.73 57.97 2gpf h TYR 28 Cb 0.15 -0.16 0.01 0.00 1.01 0.00 0.00 36.73 37.74 2gpf h TYR 28 CO 0.00 1.17 -0.33 0.15 -1.05 0.00 0.00 178.16 178.10 2gpf s LYS 29 N -3.89 3.03 0.36 4.88 1.02 -1.02 -5.08 119.74 119.04 2gpf s LYS 29 Ca -0.09 -1.08 -0.26 0.00 0.02 0.00 0.00 55.97 54.56 2gpf s LYS 29 Cb 0.10 -2.78 -0.09 0.00 -0.52 0.00 0.00 37.83 34.54 2gpf s LYS 29 CO 0.88 -0.01 1.10 -2.00 -0.92 0.00 0.00 175.35 174.40 2gpf s GLU 30 N -4.20 4.28 0.30 1.68 2.56 -1.26 -4.92 118.70 117.14 2gpf s GLU 30 Ca 0.47 1.70 -0.30 0.00 0.00 0.00 0.00 54.97 56.84 2gpf s GLU 30 Cb -0.09 -2.79 -0.11 0.00 2.00 0.00 0.00 34.13 33.14 2gpf s GLU 30 CO 0.31 -0.08 1.56 0.42 -0.56 0.00 0.00 175.26 176.91 2gpf s ILE 31 N -1.43 2.14 0.23 -3.70 1.01 -1.26 -4.93 121.20 113.25 2gpf s ILE 31 Ca 0.53 0.12 -0.31 0.00 0.00 0.00 0.00 60.65 60.99 2gpf s ILE 31 Cb -0.28 -3.08 -0.14 0.00 0.01 0.00 0.00 42.46 38.97 2gpf s ILE 31 CO 0.35 0.02 1.23 -2.65 0.00 0.00 0.00 174.94 173.89 2gpf n PRO 32 N 2.03 1.55 -1.79 2.79 -0.02 -1.26 -4.85 135.00 133.45 2gpf n PRO 32 Ca 0.07 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.68 2gpf n PRO 32 Cb 0.38 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 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 -0.67 4.16 0.00 -0.52 -2.07 -1.26 -1.66 119.66 117.64 2gpf s GLN 33 Ca 0.68 2.47 0.00 0.00 -1.82 0.00 0.00 55.36 56.69 2gpf s GLN 33 Cb -0.74 -3.99 0.00 0.00 -1.09 0.00 0.00 33.01 27.19 2gpf s GLN 33 CO 0.53 -0.89 0.00 0.41 -1.32 0.00 0.00 175.29 174.02 2gpf n GLY 34 N 4.34 1.92 3.85 2.60 0.00 -1.26 -5.10 105.19 111.55 2gpf n GLY 34 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.14 2.95 0.04 1.61 0.52 -0.66 -4.53 118.94 116.72 2gpf s TRP 35 Ca 0.00 -0.26 -0.00 0.00 0.02 0.00 0.00 56.10 55.86 2gpf s TRP 35 Cb 0.00 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.55 2gpf s TRP 35 CO 0.00 0.24 -0.04 1.03 0.02 0.00 0.00 176.95 178.20 2gpf s ARG 36 N -3.98 0.52 0.03 4.98 0.52 -1.07 -4.85 118.95 115.10 2gpf s ARG 36 Ca 0.40 -0.98 -0.30 0.00 -0.52 0.00 0.00 55.73 54.32 2gpf s ARG 36 Cb -0.06 0.10 -0.06 0.00 0.52 0.00 0.00 34.95 35.45 2gpf s ARG 36 CO 0.26 -0.07 1.41 0.00 0.02 0.00 0.00 175.30 176.93 2gpf s ALA 37 N -2.86 3.59 -0.09 2.13 0.00 -1.26 0.37 121.76 123.64 2gpf s ALA 37 Ca -0.02 0.96 0.04 0.00 0.00 0.00 0.00 51.96 52.94 2gpf s ALA 37 Cb 0.00 -3.59 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2gpf s ALA 37 CO -0.06 -0.85 -0.21 0.00 0.00 0.00 0.00 175.76 174.64 2gpf s ALA 38 N 2.09 2.29 0.00 0.00 0.00 0.22 -4.84 121.76 121.52 2gpf s ALA 38 Ca 0.65 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.63 2gpf s ALA 38 Cb -0.33 -0.86 0.00 0.00 0.00 0.00 0.00 23.12 21.93 2gpf s ALA 38 CO 0.28 0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.79 2gpf n GLY 39 N 3.27 1.95 3.52 0.00 0.00 -1.26 -4.20 105.19 108.47 2gpf n GLY 39 Ca -0.18 0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2gpf n GLY 39 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gpf s LYS 40 N 0.00 1.43 0.21 1.61 -2.85 -1.26 -5.10 119.74 113.78 2gpf s LYS 40 Ca 0.00 -1.16 0.08 0.00 -1.00 0.00 0.00 55.97 53.89 2gpf s LYS 40 Cb 0.00 0.46 -0.05 0.00 -2.06 0.00 0.00 37.83 36.18 2gpf s LYS 40 CO 0.00 -0.58 -0.15 0.45 0.10 0.00 0.00 175.35 175.17 2gpf s SER 41 N -2.98 2.65 0.00 0.03 0.15 -1.26 -3.47 113.70 108.83 2gpf s SER 41 Ca 0.19 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.83 2gpf s SER 41 Cb 0.00 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 2gpf s SER 41 CO 0.05 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.95 2gpf n GLY 42 N -0.36 -0.27 3.75 9.45 0.00 -0.44 -5.01 105.19 112.31 2gpf n GLY 42 Ca -0.08 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 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 3.08 0.18 0.99 2.01 -1.26 0.37 118.68 124.04 2gpf s LEU 43 Ca 0.00 1.97 -0.11 0.00 0.01 0.00 0.00 54.13 55.99 2gpf s LEU 43 Cb 0.00 -4.54 0.09 0.00 0.01 0.00 0.00 46.19 41.75 2gpf s LEU 43 CO 0.00 -2.20 1.73 0.50 1.01 0.00 0.00 176.35 177.39 2gpf h LYS 44 N -1.03 0.94 0.00 1.70 3.64 -1.27 -2.11 116.57 118.44 2gpf h LYS 44 Ca -0.44 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 58.74 2gpf h LYS 44 Cb 1.25 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2gpf h LYS 44 CO 0.50 0.80 -0.12 1.57 -2.27 0.00 0.00 179.45 179.93 2gpf h LYS 45 N 0.88 0.00 -0.10 1.90 5.09 -1.92 0.33 116.57 122.74 2gpf h LYS 45 Ca 0.21 0.00 -0.14 0.00 0.09 0.00 0.00 60.65 60.80 2gpf h LYS 45 Cb 0.22 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.53 2gpf h LYS 45 CO -0.02 0.12 -0.57 -0.44 -2.09 0.00 0.00 179.45 176.45 2gpf h ASP 46 N 0.00 0.34 0.09 7.07 3.32 -1.76 -0.19 116.42 125.29 2gpf h ASP 46 Ca -0.00 -0.18 -0.24 0.00 0.02 0.00 0.00 57.03 56.62 2gpf h ASP 46 Cb 0.21 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.68 2gpf h ASP 46 CO 0.01 0.83 -0.95 0.00 -1.72 0.00 0.00 179.24 177.42 2gpf h LEU 48 N 0.37 0.91 -0.88 0.00 3.38 -0.90 -1.84 115.31 116.35 2gpf h LEU 48 Ca -0.10 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 57.90 2gpf h LEU 48 Cb 1.59 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 42.04 2gpf h LEU 48 CO 0.18 0.70 0.53 0.00 0.09 0.00 0.00 178.44 179.94 2gpf h ALA 49 N 1.24 1.25 -0.52 1.53 0.00 -0.89 -2.18 119.26 119.70 2gpf h ALA 49 Ca 0.27 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.25 2gpf h ALA 49 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2gpf h ALA 49 CO -0.05 0.20 0.35 -0.92 0.00 0.00 0.00 179.25 178.82 2gpf h TYR 50 N 0.91 0.50 -0.09 0.00 3.20 -0.53 -0.65 116.97 120.30 2gpf h TYR 50 Ca 0.41 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.16 2gpf h TYR 50 Cb 0.32 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 2gpf h TYR 50 CO -0.04 0.28 -0.54 0.82 -1.64 0.00 0.00 178.16 177.04 2gpf h ILE 51 N 0.51 1.36 -0.65 1.81 5.03 -1.21 -2.96 117.51 121.40 2gpf h ILE 51 Ca 0.22 -1.83 -0.06 0.00 -0.12 0.00 0.00 64.86 63.07 2gpf h ILE 51 Cb 0.23 1.88 -0.03 0.00 -3.03 0.00 0.00 36.82 35.88 2gpf h ILE 51 CO -0.06 0.54 0.16 -0.08 -0.68 0.00 0.00 178.15 178.04 2gpf h GLU 52 N 0.21 1.03 -0.26 2.37 4.57 -0.93 -3.34 114.58 118.23 2gpf h GLU 52 Ca 0.00 -0.25 0.04 0.00 -1.18 0.00 0.00 59.36 57.97 2gpf h GLU 52 Cb 1.02 -0.14 -0.06 0.00 -0.16 0.00 0.00 28.75 29.41 2gpf h GLU 52 CO 0.09 0.93 -0.48 0.93 -1.18 0.00 0.00 179.01 179.29 2gpf h GLU 53 N 0.96 -0.39 0.02 1.92 5.08 -1.20 -3.47 114.58 117.49 2gpf h GLU 53 Ca 0.20 0.03 -0.38 0.00 -1.00 0.00 0.00 59.36 58.21 2gpf h GLU 53 Cb 0.35 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 2gpf h GLU 53 CO 0.00 -0.26 -2.33 1.55 -1.00 0.00 0.00 179.01 176.97 2gpf n VAL 54 N -5.02 1.53 0.05 3.13 3.14 -1.25 -4.45 118.33 115.46 2gpf n VAL 54 Ca -0.04 -0.65 -0.18 0.00 -2.96 0.00 0.00 64.34 60.51 2gpf n VAL 54 Cb 0.31 -1.29 -0.14 0.00 -1.06 0.00 0.00 33.84 31.65 2gpf n VAL 54 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 2gpf h TRP 55 N 0.01 0.47 -3.17 1.45 7.01 -1.89 -3.41 115.95 116.42 2gpf h TRP 55 Ca -0.53 -0.34 -0.56 0.00 2.11 0.00 0.00 58.89 59.57 2gpf h TRP 55 Cb 1.99 -0.02 -0.37 0.00 -2.10 0.00 0.00 29.16 28.67 2gpf h TRP 55 CO 0.03 1.45 -0.81 -0.08 -2.79 0.00 0.00 178.44 176.24 2gpf s THR 56 N -2.60 1.23 -0.32 2.65 -1.32 -1.26 -5.05 115.64 108.96 2gpf s THR 56 Ca -0.11 -0.43 -0.27 0.00 -1.21 0.00 0.00 61.69 59.66 2gpf s THR 56 Cb 0.07 -1.22 -0.06 0.00 -1.51 0.00 0.00 72.50 69.78 2gpf s THR 56 CO 0.84 0.38 2.28 -0.62 -2.21 0.00 0.00 174.62 175.30 2gpf s ASP 57 N 1.62 5.08 -0.02 8.08 -1.08 -1.26 -4.70 116.67 124.38 2gpf s ASP 57 Ca 0.05 1.58 -0.01 0.00 -0.52 0.00 0.00 52.55 53.65 2gpf s ASP 57 Cb -0.13 -2.51 -0.01 0.00 -1.46 0.00 0.00 42.92 38.81 2gpf s ASP 57 CO -0.09 -2.30 -0.03 0.80 0.52 0.00 0.00 175.17 174.07 2gpf n MET 58 N 8.86 0.06 -3.70 4.34 1.56 -1.26 -4.93 117.12 122.04 2gpf n MET 58 Ca 0.32 0.02 -0.30 0.00 -0.27 0.00 0.00 57.70 57.48 2gpf n MET 58 Cb 0.49 -0.76 -0.13 0.00 2.15 0.00 0.00 33.22 34.96 2gpf n MET 58 CO 0.00 0.00 0.00 0.50 -0.73 0.00 0.00 175.97 175.74 2gpf s ARG 59 N -2.05 1.16 1.06 2.12 3.52 -1.26 -5.13 118.95 118.38 2gpf s ARG 59 Ca -0.03 -1.84 -0.12 0.00 -0.13 0.00 0.00 55.73 53.61 2gpf s ARG 59 Cb 0.01 -2.23 0.23 0.00 -1.56 0.00 0.00 34.95 31.40 2gpf s ARG 59 CO 0.05 -1.14 1.08 -1.25 -0.81 0.00 0.00 175.30 173.22 2gpf s PRO 60 N 0.57 -0.11 0.43 5.12 0.04 -1.26 -4.64 135.00 135.15 2gpf s PRO 60 Ca 0.17 1.13 0.23 0.00 0.04 0.00 0.00 61.00 62.56 2gpf s PRO 60 Cb -0.24 -1.63 0.83 0.00 0.04 0.00 0.00 34.50 33.51 2gpf s PRO 60 CO -0.03 -3.26 1.79 1.25 0.04 0.00 0.00 177.00 176.79 2gpf h LEU 61 N -2.31 0.00 0.02 -3.56 5.85 -1.94 -3.19 115.31 110.18 2gpf h LEU 61 Ca -0.54 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.21 2gpf h LEU 61 Cb 1.31 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 2gpf h LEU 61 CO 0.47 0.25 -0.39 0.28 -0.34 0.00 0.00 178.44 178.71 2gpf h SER 62 N 0.00 -1.17 0.25 1.25 0.02 -1.92 -1.24 113.55 110.73 2gpf h SER 62 Ca -0.00 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2gpf h SER 62 Cb 0.81 0.46 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2gpf h SER 62 CO 0.03 -0.44 -0.17 0.00 -1.14 0.00 0.00 176.83 175.12 2gpf n LEU 63 N -5.44 0.86 0.07 5.07 -0.00 -1.25 -3.63 117.00 112.67 2gpf n LEU 63 Ca -0.06 -0.19 -0.04 0.00 -0.00 0.00 0.00 56.01 55.73 2gpf n LEU 63 Cb 0.36 -0.13 -0.08 0.00 -0.00 0.00 0.00 43.42 43.57 2gpf n LEU 63 CO 0.17 0.16 0.09 -0.09 -0.00 0.00 0.00 177.39 177.72 2gpf h ARG 64 N 1.09 0.00 -5.15 1.47 2.43 -1.28 -3.41 114.38 109.52 2gpf h ARG 64 Ca 0.00 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.51 2gpf h ARG 64 Cb 0.44 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 29.83 2gpf h ARG 64 CO 0.00 0.73 -0.09 -1.14 -1.51 0.00 0.00 179.97 177.96 2gpf s GLN 65 N -2.78 3.47 -0.20 0.20 2.00 -0.56 -4.95 119.66 116.83 2gpf s GLN 65 Ca 0.01 -0.34 -0.18 0.00 -2.00 0.00 0.00 55.36 52.85 2gpf s GLN 65 Cb 0.09 -3.86 -0.14 0.00 0.80 0.00 0.00 33.01 29.90 2gpf s GLN 65 CO 0.80 -0.72 0.06 0.72 -0.50 0.00 0.00 175.29 175.66 2gpf n HIS 66 N 5.74 0.90 0.49 1.67 8.25 -1.26 -4.38 115.22 126.63 2gpf n HIS 66 Ca -0.05 0.39 0.12 0.00 -0.26 0.00 0.00 57.72 57.92 2gpf n HIS 66 Cb 0.48 -1.00 0.22 0.00 1.12 0.00 0.00 29.99 30.81 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 -1.00 0.00 -4.87 -0.41 -0.00 -1.98 -3.43 114.93 103.24 2gpf h MET 67 Ca -0.29 0.00 -0.67 0.00 -0.00 0.00 0.00 59.70 58.74 2gpf h MET 67 Cb 1.14 0.00 -0.26 0.00 -0.00 0.00 0.00 31.60 32.48 2gpf h MET 67 CO -0.17 0.00 -0.64 0.34 -0.00 0.00 0.00 176.91 176.44 2gpf s ASP 68 N -4.70 4.99 0.02 -0.10 2.15 -1.26 -4.99 116.67 112.78 2gpf s ASP 68 Ca 0.07 -0.54 -0.29 0.00 0.43 0.00 0.00 52.55 52.22 2gpf s ASP 68 Cb 0.12 -1.87 0.10 0.00 -0.30 0.00 0.00 42.92 40.97 2gpf s ASP 68 CO 0.69 -0.13 1.11 -1.59 -0.17 0.00 0.00 175.17 175.08 2gpf s LYS 69 N 1.52 0.71 -0.08 4.34 -2.85 -1.26 -4.86 119.74 117.27 2gpf s LYS 69 Ca 0.04 -0.36 0.00 0.00 -1.00 0.00 0.00 55.97 54.65 2gpf s LYS 69 Cb -0.16 0.26 0.08 0.00 -2.06 0.00 0.00 37.83 35.95 2gpf s LYS 69 CO 0.02 -0.32 1.55 0.00 0.10 0.00 0.00 175.35 176.70 2gpf n ALA 70 N -0.39 3.61 0.03 0.59 0.00 -1.26 -3.36 120.51 119.72 2gpf n ALA 70 Ca -0.06 -0.45 0.01 0.00 0.00 0.00 0.00 53.44 52.94 2gpf n ALA 70 Cb 0.61 -1.09 0.02 0.00 0.00 0.00 0.00 19.45 18.99 2gpf n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gpf n ALA 71 N 0.70 2.27 -1.16 0.00 0.00 -1.26 -5.34 120.51 115.71 2gpf n ALA 71 Ca 0.09 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2gpf n ALA 71 Cb 0.60 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2gpf n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91