#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 3.21 -0.19 1.12 2.01 -1.26 -4.94 115.64 115.59 2gpf s THR 2 Ca 0.00 -0.67 0.15 0.00 0.31 0.00 0.00 61.69 61.48 2gpf s THR 2 Cb 0.00 -2.51 0.43 0.00 0.01 0.00 0.00 72.50 70.43 2gpf s THR 2 CO 0.00 0.35 1.32 -1.54 -0.69 0.00 0.00 174.62 174.06 2gpf n SER 3 N 4.76 2.78 0.02 3.53 3.41 -1.26 -4.70 113.62 122.16 2gpf n SER 3 Ca -0.18 -3.33 -0.06 0.00 -0.26 0.00 0.00 58.87 55.04 2gpf n SER 3 Cb 0.50 -0.53 -0.12 0.00 -0.26 0.00 0.00 64.21 63.80 2gpf n SER 3 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2gpf h VAL 4 N 0.93 1.02 -0.11 -3.33 2.07 -2.04 -3.30 116.25 111.49 2gpf h VAL 4 Ca 0.05 -2.76 -0.17 0.00 0.82 0.00 0.00 66.70 64.63 2gpf h VAL 4 Cb 1.29 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 33.53 2gpf h VAL 4 CO 0.16 0.58 -0.66 0.15 0.02 0.00 0.00 177.57 177.82 2gpf h PHE 5 N 0.00 0.59 -2.31 1.57 3.57 -2.03 -3.42 116.94 114.92 2gpf h PHE 5 Ca -0.18 -0.24 -0.55 0.00 3.53 0.00 0.00 57.97 60.53 2gpf h PHE 5 Cb 1.85 -0.10 0.02 0.00 2.79 0.00 0.00 35.95 40.51 2gpf h PHE 5 CO 0.00 0.98 1.19 -3.47 -2.23 0.00 0.00 178.31 174.78 2gpf n ASP 6 N -3.89 4.00 0.00 0.41 2.03 -1.24 -4.84 116.55 113.02 2gpf n ASP 6 Ca -0.04 0.93 0.10 0.00 0.52 0.00 0.00 54.79 56.31 2gpf n ASP 6 Cb 0.67 -1.50 0.49 0.00 -0.72 0.00 0.00 41.12 40.05 2gpf n ASP 6 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2gpf n ARG 7 N 7.06 0.09 0.00 -0.67 1.85 -1.26 -4.87 116.66 118.85 2gpf n ARG 7 Ca 0.20 0.12 0.00 0.00 -1.00 0.00 0.00 57.85 57.17 2gpf n ARG 7 Cb 0.38 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.29 2gpf n ARG 7 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 2gpf n ASP 8 N -1.44 0.00 -2.57 2.89 2.03 -1.26 -3.93 116.55 112.27 2gpf n ASP 8 Ca 0.07 0.00 -0.18 0.00 0.52 0.00 0.00 54.79 55.20 2gpf n ASP 8 Cb 0.23 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.67 2gpf n ASP 8 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2gpf n ASP 9 N 0.90 -5.23 -4.50 1.67 9.92 -1.26 -4.97 116.55 113.08 2gpf n ASP 9 Ca 0.00 -0.29 -0.42 0.00 -0.53 0.00 0.00 54.79 53.55 2gpf n ASP 9 Cb 0.00 -4.00 -0.04 0.00 -0.64 0.00 0.00 41.12 36.44 2gpf n ASP 9 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 2gpf s ILE 10 N -3.11 4.20 0.22 0.53 1.10 -1.25 -5.02 121.20 117.87 2gpf s ILE 10 Ca 0.31 0.07 -0.05 0.00 -0.51 0.00 0.00 60.65 60.47 2gpf s ILE 10 Cb -0.14 -4.69 -0.05 0.00 0.15 0.00 0.00 42.46 37.73 2gpf s ILE 10 CO 0.38 -1.43 0.47 -1.10 -2.11 0.00 0.00 174.94 171.16 2gpf s GLN 11 N 4.42 3.64 0.44 3.50 1.11 -1.26 -4.25 119.66 127.26 2gpf s GLN 11 Ca 0.29 -0.04 0.03 0.00 0.01 0.00 0.00 55.36 55.65 2gpf s GLN 11 Cb -0.13 -2.74 -0.03 0.00 -1.01 0.00 0.00 33.01 29.10 2gpf s GLN 11 CO 0.15 0.34 0.07 -0.06 0.01 0.00 0.00 175.29 175.80 2gpf s PHE 12 N -1.88 1.87 0.01 0.91 0.08 0.20 -1.18 117.98 117.98 2gpf s PHE 12 Ca 0.43 -1.10 0.00 0.00 0.12 0.00 0.00 56.93 56.38 2gpf s PHE 12 Cb -0.11 -1.37 -0.01 0.00 -0.57 0.00 0.00 43.02 40.96 2gpf s PHE 12 CO 0.27 -0.04 -0.01 1.14 -0.10 0.00 0.00 175.22 176.48 2gpf s GLN 13 N -3.79 0.12 -0.18 0.44 -2.07 0.56 -0.17 119.66 114.58 2gpf s GLN 13 Ca 0.19 -0.19 -0.23 0.00 -1.82 0.00 0.00 55.36 53.31 2gpf s GLN 13 Cb 0.03 -0.01 -0.02 0.00 -1.09 0.00 0.00 33.01 31.93 2gpf s GLN 13 CO 0.11 -0.00 0.74 0.08 -1.32 0.00 0.00 175.29 174.89 2gpf s VAL 14 N -0.41 4.95 0.18 3.63 1.01 -1.10 -0.61 120.40 128.04 2gpf s VAL 14 Ca -0.04 1.43 0.10 0.00 0.00 0.00 0.00 61.98 63.47 2gpf s VAL 14 Cb -0.03 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2gpf s VAL 14 CO -0.00 0.07 -0.15 0.68 0.00 0.00 0.00 175.10 175.70 2gpf s VAL 15 N 2.01 2.90 -0.04 2.92 -7.23 0.52 -0.46 120.40 121.01 2gpf s VAL 15 Ca 0.34 -1.77 0.06 0.00 -1.81 0.00 0.00 61.98 58.80 2gpf s VAL 15 Cb -0.16 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 2gpf s VAL 15 CO 0.12 -0.10 -0.22 0.54 -0.31 0.00 0.00 175.10 175.13 2gpf s VAL 16 N -1.66 1.79 0.58 1.32 0.11 0.16 -0.94 120.40 121.75 2gpf s VAL 16 Ca 0.23 -0.94 -0.14 0.00 -2.93 0.00 0.00 61.98 58.20 2gpf s VAL 16 Cb -0.09 -1.50 -0.05 0.00 -1.53 0.00 0.00 36.38 33.21 2gpf s VAL 16 CO 0.13 0.50 1.02 0.21 -3.33 0.00 0.00 175.10 173.64 2gpf s ASN 17 N -0.26 6.17 0.00 3.54 2.47 0.13 -0.68 114.94 126.31 2gpf s ASN 17 Ca 0.01 1.60 0.07 0.00 0.42 0.00 0.00 52.86 54.96 2gpf s ASN 17 Cb -0.11 -2.50 0.31 0.00 -1.45 0.00 0.00 41.25 37.49 2gpf s ASN 17 CO 0.01 -0.90 1.16 1.57 -3.72 0.00 0.00 177.10 175.22 2gpf n HIS 18 N -2.16 0.00 -0.77 0.43 -0.00 -1.10 -0.78 115.22 110.83 2gpf n HIS 18 Ca 0.07 0.00 0.08 0.00 -0.00 0.00 0.00 57.72 57.87 2gpf n HIS 18 Cb 0.54 -0.42 0.29 0.00 -0.00 0.00 0.00 29.99 30.40 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 -1.42 3.48 -2.65 1.57 1.02 -1.26 -4.96 120.64 116.41 2gpf n GLU 19 Ca 0.02 -2.79 -0.09 0.00 -0.02 0.00 0.00 57.16 54.27 2gpf n GLU 19 Cb 0.07 -1.85 0.05 0.00 -0.02 0.00 0.00 31.44 29.69 2gpf n GLU 19 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2gpf n GLU 20 N 0.22 -2.10 -4.89 3.49 2.13 0.04 -5.05 120.64 114.49 2gpf n GLU 20 Ca 0.22 0.53 -0.32 0.00 0.66 0.00 0.00 57.16 58.25 2gpf n GLU 20 Cb 0.88 -4.26 -0.17 0.00 0.27 0.00 0.00 31.44 28.16 2gpf n GLU 20 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 2gpf s GLN 21 N -4.12 2.96 -0.13 5.31 2.00 -1.24 -4.88 119.66 119.57 2gpf s GLN 21 Ca 0.20 -0.84 -0.06 0.00 -2.00 0.00 0.00 55.36 52.67 2gpf s GLN 21 Cb -0.03 -2.33 -0.04 0.00 0.80 0.00 0.00 33.01 31.42 2gpf s GLN 21 CO 0.45 0.06 0.09 0.71 -0.50 0.00 0.00 175.29 176.10 2gpf s TYR 22 N 0.62 3.40 0.27 1.67 2.02 -1.26 0.21 117.35 124.28 2gpf s TYR 22 Ca -0.12 0.34 -0.06 0.00 -0.37 0.00 0.00 57.07 56.86 2gpf s TYR 22 Cb -0.17 -1.94 0.02 0.00 -0.40 0.00 0.00 41.96 39.48 2gpf s TYR 22 CO 0.03 0.52 0.47 0.45 -1.57 0.00 0.00 175.55 175.45 2gpf n SER 23 N 2.42 -1.34 -4.20 2.29 2.88 -0.12 -4.99 113.62 110.57 2gpf n SER 23 Ca -0.19 -2.28 -0.24 0.00 -1.33 0.00 0.00 58.87 54.83 2gpf n SER 23 Cb 0.54 2.33 -0.14 0.00 -0.75 0.00 0.00 64.21 66.18 2gpf n SER 23 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2gpf s ILE 24 N -2.54 1.46 -0.01 2.46 -4.36 -1.26 -0.35 121.20 116.60 2gpf s ILE 24 Ca 0.17 -0.99 0.02 0.00 -0.26 0.00 0.00 60.65 59.58 2gpf s ILE 24 Cb -0.02 -1.26 -0.00 0.00 1.25 0.00 0.00 42.46 42.43 2gpf s ILE 24 CO 0.12 0.24 -0.07 0.86 0.24 0.00 0.00 174.94 176.33 2gpf s TRP 25 N -0.66 0.69 -0.18 1.37 -0.11 0.22 -4.91 118.94 115.36 2gpf s TRP 25 Ca 0.06 -0.14 -0.41 0.00 1.22 0.00 0.00 56.10 56.83 2gpf s TRP 25 Cb -0.08 -0.47 -0.18 0.00 -1.50 0.00 0.00 33.47 31.25 2gpf s TRP 25 CO 0.01 -0.04 1.47 -0.35 -4.62 0.00 0.00 176.95 173.42 2gpf n PRO 26 N 3.06 0.63 -0.36 5.86 -0.04 -1.26 -0.32 135.00 142.57 2gpf n PRO 26 Ca -0.15 0.23 -0.02 0.00 -0.04 0.00 0.00 63.50 63.52 2gpf n PRO 26 Cb 0.56 -1.82 0.12 0.00 -0.04 0.00 0.00 33.50 32.32 2gpf n PRO 26 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2gpf h GLU 27 N 5.14 1.29 -0.01 0.54 4.81 -1.39 -0.78 114.58 124.17 2gpf h GLU 27 Ca -0.47 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 2gpf h GLU 27 Cb 1.36 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 30.45 2gpf h GLU 27 CO 0.85 0.87 0.00 2.48 -0.73 0.00 0.00 179.01 182.48 2gpf n TYR 28 N -4.37 0.01 -3.99 0.92 0.18 -1.26 -4.80 117.16 103.84 2gpf n TYR 28 Ca 0.11 -0.01 -0.32 0.00 1.88 0.00 0.00 57.90 59.56 2gpf n TYR 28 Cb 0.03 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.93 2gpf n TYR 28 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 2gpf s LYS 29 N -1.99 3.24 0.16 -3.48 2.47 -0.30 -5.08 119.74 114.76 2gpf s LYS 29 Ca 0.42 -0.45 -0.30 0.00 -1.56 0.00 0.00 55.97 54.08 2gpf s LYS 29 Cb 0.20 -2.96 -0.07 0.00 -1.46 0.00 0.00 37.83 33.54 2gpf s LYS 29 CO 0.34 0.64 1.14 -2.00 0.16 0.00 0.00 175.35 175.63 2gpf s GLU 30 N -2.02 4.54 0.14 4.03 2.12 -1.26 -4.82 118.70 121.44 2gpf s GLU 30 Ca 0.27 1.77 -0.30 0.00 0.36 0.00 0.00 54.97 57.06 2gpf s GLU 30 Cb -0.12 -3.28 -0.08 0.00 0.26 0.00 0.00 34.13 30.91 2gpf s GLU 30 CO 0.19 -0.01 1.29 0.42 -0.54 0.00 0.00 175.26 176.61 2gpf s ILE 31 N -0.03 3.47 0.70 -3.70 1.01 -1.26 -5.02 121.20 116.37 2gpf s ILE 31 Ca 0.51 1.13 -0.14 0.00 0.00 0.00 0.00 60.65 62.15 2gpf s ILE 31 Cb -0.30 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.47 2gpf s ILE 31 CO 0.35 0.13 1.13 -2.84 0.00 0.00 0.00 174.94 173.71 2gpf s PRO 32 N 0.48 2.53 0.38 2.79 0.02 -1.26 -4.98 135.00 134.96 2gpf s PRO 32 Ca 0.59 1.46 -0.27 0.00 0.02 0.00 0.00 61.00 62.80 2gpf s PRO 32 Cb -0.34 -1.91 -0.09 0.00 0.02 0.00 0.00 34.50 32.17 2gpf s PRO 32 CO 0.34 -1.48 1.31 -0.65 -0.33 0.00 0.00 177.00 176.19 2gpf s GLN 33 N -4.15 4.08 0.00 5.54 -0.21 -1.26 -3.14 119.66 120.52 2gpf s GLN 33 Ca 0.68 2.19 0.00 0.00 0.02 0.00 0.00 55.36 58.25 2gpf s GLN 33 Cb -0.22 -2.85 0.00 0.00 1.00 0.00 0.00 33.01 30.94 2gpf s GLN 33 CO 0.44 -0.41 0.00 0.41 -2.12 0.00 0.00 175.29 173.61 2gpf n GLY 34 N 0.69 2.01 3.67 3.09 0.00 -1.26 -5.06 105.19 108.33 2gpf n GLY 34 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.11 2.74 0.05 1.61 0.52 -1.19 -2.71 118.94 117.85 2gpf s TRP 35 Ca 0.00 -0.23 -0.03 0.00 0.02 0.00 0.00 56.10 55.86 2gpf s TRP 35 Cb 0.00 -1.25 -0.02 0.00 -1.15 0.00 0.00 33.47 31.04 2gpf s TRP 35 CO 0.00 0.59 0.03 -0.98 0.02 0.00 0.00 176.95 176.61 2gpf s ARG 36 N -3.71 0.61 0.18 4.98 1.70 0.15 -4.87 118.95 117.98 2gpf s ARG 36 Ca 0.32 -1.00 -0.30 0.00 -0.47 0.00 0.00 55.73 54.28 2gpf s ARG 36 Cb -0.06 0.22 -0.07 0.00 -0.57 0.00 0.00 34.95 34.47 2gpf s ARG 36 CO 0.21 -0.14 1.03 0.00 -1.08 0.00 0.00 175.30 175.32 2gpf s ALA 37 N -3.34 3.33 0.00 7.88 0.00 -1.26 0.39 121.76 128.76 2gpf s ALA 37 Ca 0.01 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.69 2gpf s ALA 37 Cb 0.03 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2gpf s ALA 37 CO -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 175.76 175.60 2gpf n ALA 38 N 2.26 0.00 -2.31 0.00 0.00 0.39 -4.83 120.51 116.02 2gpf n ALA 38 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.41 2gpf n ALA 38 Cb 0.47 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.99 2gpf n ALA 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gpf n GLY 39 N 5.00 3.54 3.21 0.00 0.00 -1.26 -4.99 105.19 110.69 2gpf n GLY 39 Ca 0.00 -1.52 -0.02 0.00 0.00 0.00 0.00 46.02 44.49 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 -2.85 0.49 0.06 1.61 2.36 -1.26 -5.12 119.74 115.02 2gpf s LYS 40 Ca 0.37 0.99 0.05 0.00 -2.55 0.00 0.00 55.97 54.83 2gpf s LYS 40 Cb 0.37 0.35 -0.04 0.00 -1.05 0.00 0.00 37.83 37.46 2gpf s LYS 40 CO -0.05 -0.50 -0.07 0.45 1.55 0.00 0.00 175.35 176.73 2gpf s SER 41 N 2.76 4.58 0.00 1.43 0.15 -1.26 -2.73 113.70 118.64 2gpf s SER 41 Ca 0.11 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.51 2gpf s SER 41 Cb -0.14 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.17 2gpf s SER 41 CO -0.18 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2gpf n GLY 42 N 1.07 0.35 3.49 9.45 0.00 0.76 -4.99 105.19 115.34 2gpf n GLY 42 Ca -0.14 -1.10 -0.27 0.00 0.00 0.00 0.00 46.02 44.52 2gpf n GLY 42 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2gpf n LEU 43 N 0.00 0.00 -0.26 0.99 -0.00 -1.26 0.60 117.00 117.07 2gpf n LEU 43 Ca 0.00 -1.30 0.16 0.00 -0.00 0.00 0.00 56.01 54.87 2gpf n LEU 43 Cb 0.00 -0.93 0.45 0.00 -0.00 0.00 0.00 43.42 42.94 2gpf n LEU 43 CO 0.00 -1.45 1.22 0.07 -0.00 0.00 0.00 177.39 177.23 2gpf h LYS 44 N 0.00 0.51 -0.27 1.47 2.10 -1.95 0.98 116.57 119.41 2gpf h LYS 44 Ca -0.39 -0.03 0.04 0.00 -2.00 0.00 0.00 60.65 58.27 2gpf h LYS 44 Cb 1.09 -0.12 -0.04 0.00 -0.90 0.00 0.00 32.23 32.26 2gpf h LYS 44 CO 0.27 0.34 0.01 -0.22 -2.00 0.00 0.00 179.45 177.86 2gpf h LYS 45 N 0.53 0.09 -0.29 0.07 1.63 -1.95 0.31 116.57 116.96 2gpf h LYS 45 Ca 0.47 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 60.25 2gpf h LYS 45 Cb 0.99 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.58 2gpf h LYS 45 CO -0.21 0.06 0.13 -0.44 -3.45 0.00 0.00 179.45 175.54 2gpf h ASP 46 N 0.10 0.36 0.17 4.20 3.32 -1.15 -2.14 116.42 121.27 2gpf h ASP 46 Ca 0.13 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2gpf h ASP 46 Cb 0.16 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2gpf h ASP 46 CO -0.20 0.33 -0.08 0.00 -1.72 0.00 0.00 179.24 177.56 2gpf h LEU 48 N -0.78 -0.57 -0.07 0.00 3.38 -0.28 -0.45 115.31 116.55 2gpf h LEU 48 Ca -0.02 0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2gpf h LEU 48 Cb 0.52 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 2gpf h LEU 48 CO 0.04 -0.20 -0.12 0.00 0.09 0.00 0.00 178.44 178.25 2gpf h ALA 49 N 1.16 -0.07 -0.09 1.53 0.00 -1.47 -3.17 119.26 117.15 2gpf h ALA 49 Ca 0.18 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.16 2gpf h ALA 49 Cb 0.38 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 2gpf h ALA 49 CO -0.42 -0.59 -0.21 -0.92 0.00 0.00 0.00 179.25 177.11 2gpf h TYR 50 N -0.17 -0.56 -0.59 0.00 3.20 -0.09 -2.86 116.97 115.91 2gpf h TYR 50 Ca 0.07 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2gpf h TYR 50 Cb 0.26 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 2gpf h TYR 50 CO -0.21 -0.30 0.37 0.82 -1.64 0.00 0.00 178.16 177.21 2gpf h ILE 51 N -0.29 1.16 -0.55 1.81 5.03 -1.12 -2.39 117.51 121.16 2gpf h ILE 51 Ca 0.09 -0.31 -0.07 0.00 -0.12 0.00 0.00 64.86 64.44 2gpf h ILE 51 Cb 0.42 0.31 -0.02 0.00 -3.03 0.00 0.00 36.82 34.50 2gpf h ILE 51 CO -0.26 0.16 0.06 -0.33 -0.68 0.00 0.00 178.15 177.09 2gpf h GLU 52 N 0.80 0.93 -0.31 2.37 5.08 -1.48 -3.34 114.58 118.63 2gpf h GLU 52 Ca 0.21 -0.27 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2gpf h GLU 52 Cb -0.07 -0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.01 2gpf h GLU 52 CO -0.04 0.91 -0.53 0.93 -1.00 0.00 0.00 179.01 179.28 2gpf h GLU 53 N 0.82 -0.44 0.03 2.33 4.39 -1.33 -3.40 114.58 116.97 2gpf h GLU 53 Ca 0.16 0.03 -0.35 0.00 0.34 0.00 0.00 59.36 59.54 2gpf h GLU 53 Cb 0.45 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.16 2gpf h GLU 53 CO 0.02 -0.29 -1.96 1.55 -1.16 0.00 0.00 179.01 177.17 2gpf n VAL 54 N -5.40 1.59 -1.87 3.13 3.14 -1.25 -3.96 118.33 113.69 2gpf n VAL 54 Ca -0.04 -0.35 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 2gpf n VAL 54 Cb 0.36 -1.83 0.00 0.00 -1.06 0.00 0.00 33.84 31.30 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 -3.98 0.00 -0.02 1.45 -0.00 -1.26 -4.55 117.44 109.07 2gpf n TRP 55 Ca -0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 57.50 57.07 2gpf n TRP 55 Cb 0.87 0.10 -0.02 0.00 -0.00 0.00 0.00 31.31 32.26 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 0.00 0.24 -4.71 5.87 -2.24 -1.26 -5.04 114.28 107.14 2gpf n THR 56 Ca 0.00 -0.12 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2gpf n THR 56 Cb 0.57 -0.76 -0.13 0.00 -2.10 0.00 0.00 70.33 67.90 2gpf n THR 56 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2gpf s ASP 57 N -3.99 3.49 0.00 3.42 1.01 -1.25 -4.97 116.67 114.38 2gpf s ASP 57 Ca -0.04 -0.54 0.28 0.00 0.71 0.00 0.00 52.55 52.96 2gpf s ASP 57 Cb 0.01 -0.43 1.10 0.00 1.01 0.00 0.00 42.92 44.62 2gpf s ASP 57 CO 0.12 0.24 1.79 0.80 0.21 0.00 0.00 175.17 178.33 2gpf n MET 58 N 1.53 0.48 -2.70 8.23 0.00 -1.26 -4.64 117.12 118.76 2gpf n MET 58 Ca -0.17 -0.17 -0.42 0.00 -0.00 0.00 0.00 57.70 56.94 2gpf n MET 58 Cb 0.52 -1.50 -0.03 0.00 0.00 0.00 0.00 33.22 32.21 2gpf n MET 58 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2gpf s ARG 59 N -2.64 3.34 0.09 2.12 1.81 -1.26 -5.00 118.95 117.40 2gpf s ARG 59 Ca 0.24 -0.16 -0.31 0.00 -1.72 0.00 0.00 55.73 53.78 2gpf s ARG 59 Cb 0.19 -4.09 -0.07 0.00 -0.45 0.00 0.00 34.95 30.54 2gpf s ARG 59 CO 0.52 -1.72 1.32 -2.14 -0.68 0.00 0.00 175.30 172.60 2gpf s PRO 60 N 4.63 4.36 0.16 3.54 0.02 -1.26 -4.88 135.00 141.57 2gpf s PRO 60 Ca 0.34 1.96 0.24 0.00 0.02 0.00 0.00 61.00 63.56 2gpf s PRO 60 Cb -0.11 -3.31 0.25 0.00 0.02 0.00 0.00 34.50 31.36 2gpf s PRO 60 CO 0.19 -0.38 1.27 -0.07 -0.33 0.00 0.00 177.00 177.68 2gpf h LEU 61 N 6.91 0.00 0.00 -5.54 -0.00 -1.83 -3.32 115.31 111.52 2gpf h LEU 61 Ca -0.42 -0.14 0.00 0.00 -0.00 0.00 0.00 57.88 57.33 2gpf h LEU 61 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.87 2gpf h LEU 61 CO 0.85 0.07 0.00 -1.54 -0.00 0.00 0.00 178.44 177.82 2gpf n SER 62 N -2.34 0.00 0.00 -0.43 3.41 -1.26 -2.94 113.62 110.06 2gpf n SER 62 Ca 0.02 -0.88 0.12 0.00 -0.26 0.00 0.00 58.87 57.88 2gpf n SER 62 Cb 0.48 -0.03 0.29 0.00 -0.26 0.00 0.00 64.21 64.69 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 -1.03 0.45 -0.02 1.04 -0.00 -1.25 -4.12 117.00 112.07 2gpf n LEU 63 Ca 0.22 0.08 -0.12 0.00 -0.00 0.00 0.00 56.01 56.19 2gpf n LEU 63 Cb 0.12 -0.28 -0.06 0.00 -0.00 0.00 0.00 43.42 43.20 2gpf n LEU 63 CO 0.18 0.10 0.80 -0.09 -0.00 0.00 0.00 177.39 178.38 2gpf h ARG 64 N 0.00 0.15 -3.68 1.47 2.43 -1.80 -3.37 114.38 109.58 2gpf h ARG 64 Ca 0.00 -0.03 -0.57 0.00 -0.81 0.00 0.00 59.98 58.57 2gpf h ARG 64 Cb 0.52 -0.02 -0.40 0.00 -0.42 0.00 0.00 29.97 29.65 2gpf h ARG 64 CO 0.00 0.31 -0.76 1.14 -1.51 0.00 0.00 179.97 179.15 2gpf s GLN 65 N -5.38 0.83 0.02 0.20 -2.07 -1.26 -4.88 119.66 107.13 2gpf s GLN 65 Ca -0.14 -0.86 -0.06 0.00 -1.82 0.00 0.00 55.36 52.48 2gpf s GLN 65 Cb 0.06 -2.13 -0.02 0.00 -1.09 0.00 0.00 33.01 29.82 2gpf s GLN 65 CO 0.69 -0.82 1.09 1.25 -1.32 0.00 0.00 175.29 176.18 2gpf h HIS 66 N 8.11 -0.25 0.00 9.60 -0.00 -1.74 -3.40 115.15 127.47 2gpf h HIS 66 Ca -0.15 0.01 -0.16 0.00 -0.00 0.00 0.00 60.37 60.06 2gpf h HIS 66 Cb 1.06 0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 28.55 2gpf h HIS 66 CO 0.36 -0.10 -1.38 -0.12 -0.00 0.00 0.00 177.93 176.69 2gpf n MET 67 N -2.91 0.37 -3.84 5.26 0.00 -1.26 -5.02 117.12 109.73 2gpf n MET 67 Ca -0.01 0.16 -0.10 0.00 -0.00 0.00 0.00 57.70 57.74 2gpf n MET 67 Cb 0.07 -1.14 -0.08 0.00 0.00 0.00 0.00 33.22 32.07 2gpf n MET 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2gpf s ASP 68 N -6.32 0.03 -0.67 6.12 1.01 -1.26 -5.11 116.67 110.47 2gpf s ASP 68 Ca -0.23 -0.37 -0.06 0.00 0.71 0.00 0.00 52.55 52.61 2gpf s ASP 68 Cb 0.06 0.29 0.18 0.00 1.01 0.00 0.00 42.92 44.46 2gpf s ASP 68 CO 0.31 -0.57 0.52 -0.75 0.21 0.00 0.00 175.17 174.89 2gpf s LYS 69 N -2.62 2.83 0.00 8.23 2.36 -1.26 -4.86 119.74 124.42 2gpf s LYS 69 Ca -0.05 -2.51 0.00 0.00 -2.55 0.00 0.00 55.97 50.86 2gpf s LYS 69 Cb -0.01 -3.91 0.00 0.00 -1.05 0.00 0.00 37.83 32.86 2gpf s LYS 69 CO -0.04 -1.20 0.00 0.00 1.55 0.00 0.00 175.35 175.65 2gpf n ALA 70 N 3.61 0.00 0.07 3.13 0.00 -1.26 -2.98 120.51 123.09 2gpf n ALA 70 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2gpf n ALA 70 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 0.27 3.00 0.00 0.00 0.00 -1.26 -5.23 120.51 117.29 2gpf n ALA 71 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gpf n ALA 71 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.50 2gpf n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91