#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c0r s GLN 2 N 0.00 0.69 0.30 2.12 0.74 -1.26 -2.27 119.66 119.97 3c0r s GLN 2 Ca 0.00 0.02 0.08 0.00 0.05 0.00 0.00 55.36 55.51 3c0r s GLN 2 Cb 0.00 -0.89 -0.06 0.00 1.10 0.00 0.00 33.01 33.16 3c0r s GLN 2 CO 0.00 -0.20 -0.09 0.96 -0.55 0.00 0.00 175.29 175.40 3c0r s ILE 3 N 1.48 1.95 0.07 -2.34 -4.36 -0.92 -1.25 121.20 115.82 3c0r s ILE 3 Ca -0.02 -2.19 0.08 0.00 -0.26 0.00 0.00 60.65 58.26 3c0r s ILE 3 Cb -0.13 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.07 3c0r s ILE 3 CO -0.03 -0.30 -0.20 -0.36 0.24 0.00 0.00 174.94 174.29 3c0r s PHE 4 N -2.82 2.50 -0.09 1.37 0.08 -0.19 -0.31 117.98 118.52 3c0r s PHE 4 Ca 0.30 -0.29 0.01 0.00 0.12 0.00 0.00 56.93 57.08 3c0r s PHE 4 Cb 0.02 -1.40 0.02 0.00 -0.57 0.00 0.00 43.02 41.09 3c0r s PHE 4 CO 0.13 0.28 -0.12 0.08 -0.10 0.00 0.00 175.22 175.50 3c0r s VAL 5 N -0.98 1.23 -0.07 -0.44 1.01 0.91 0.12 120.40 122.18 3c0r s VAL 5 Ca 0.15 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3c0r s VAL 5 Cb -0.10 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 3c0r s VAL 5 CO 0.06 0.39 -0.14 -0.75 0.00 0.00 0.00 175.10 174.66 3c0r s LYS 6 N 1.05 2.69 0.36 2.72 2.20 0.91 0.07 119.74 129.75 3c0r s LYS 6 Ca -0.07 -0.70 0.07 0.00 -0.36 0.00 0.00 55.97 54.92 3c0r s LYS 6 Cb -0.15 -2.43 -0.01 0.00 -1.51 0.00 0.00 37.83 33.73 3c0r s LYS 6 CO -0.01 0.53 0.42 0.95 -0.36 0.00 0.00 175.35 176.88 3c0r s THR 7 N -0.50 3.47 -1.31 3.43 -4.23 0.44 -1.33 115.64 115.62 3c0r s THR 7 Ca 0.06 -1.16 0.21 0.00 -1.18 0.00 0.00 61.69 59.62 3c0r s THR 7 Cb -0.12 -3.20 0.32 0.00 1.34 0.00 0.00 72.50 70.84 3c0r s THR 7 CO 0.02 -0.11 1.67 0.18 -0.54 0.00 0.00 174.62 175.84 3c0r n LEU 8 N -1.59 0.00 -1.74 4.79 4.77 -1.26 -2.43 117.00 119.55 3c0r n LEU 8 Ca 0.02 0.34 -0.04 0.00 -0.03 0.00 0.00 56.01 56.30 3c0r n LEU 8 Cb 0.59 -0.34 0.28 0.00 -2.33 0.00 0.00 43.42 41.62 3c0r n LEU 8 CO 0.42 -0.10 0.96 0.35 -1.33 0.00 0.00 177.39 177.68 3c0r n THR 9 N -1.34 2.81 -0.86 -5.08 -2.24 -1.26 -4.93 114.28 101.37 3c0r n THR 9 Ca 0.09 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.04 3c0r n THR 9 Cb 0.19 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 3c0r n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c0r n GLY 10 N -0.36 0.66 3.72 3.38 0.00 -1.02 -4.99 105.19 106.57 3c0r n GLY 10 Ca 0.38 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.98 3c0r n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c0r s LYS 11 N -0.34 4.58 -0.09 1.61 3.01 -1.26 -4.84 119.74 122.42 3c0r s LYS 11 Ca 0.00 1.58 0.01 0.00 -1.01 0.00 0.00 55.97 56.55 3c0r s LYS 11 Cb 0.00 -3.37 -0.02 0.00 -1.01 0.00 0.00 37.83 33.43 3c0r s LYS 11 CO 0.00 0.01 -0.11 0.99 0.51 0.00 0.00 175.35 176.74 3c0r s THR 12 N 0.44 3.27 -0.00 2.17 2.01 -1.26 -0.42 115.64 121.84 3c0r s THR 12 Ca 0.51 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 61.91 3c0r s THR 12 Cb -0.26 -2.34 -0.00 0.00 0.01 0.00 0.00 72.50 69.91 3c0r s THR 12 CO 0.30 0.56 -0.05 -0.51 -0.69 0.00 0.00 174.62 174.23 3c0r s ILE 13 N -0.29 0.41 -0.30 1.82 2.07 0.11 -4.95 121.20 120.07 3c0r s ILE 13 Ca 0.03 -0.22 -0.11 0.00 -1.41 0.00 0.00 60.65 58.94 3c0r s ILE 13 Cb -0.13 -0.35 -0.03 0.00 0.13 0.00 0.00 42.46 42.07 3c0r s ILE 13 CO 0.03 0.12 0.19 -0.89 -1.91 0.00 0.00 174.94 172.48 3c0r s THR 14 N -0.10 5.16 0.25 4.00 2.01 -1.26 -0.06 115.64 125.63 3c0r s THR 14 Ca 0.02 -0.03 0.05 0.00 0.31 0.00 0.00 61.69 62.04 3c0r s THR 14 Cb -0.02 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.93 3c0r s THR 14 CO -0.00 0.16 0.34 -0.76 -0.69 0.00 0.00 174.62 173.67 3c0r s LEU 15 N 1.72 4.23 -0.26 4.42 1.43 0.58 -4.98 118.68 125.82 3c0r s LEU 15 Ca 0.06 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.20 3c0r s LEU 15 Cb -0.16 -2.78 0.06 0.00 0.03 0.00 0.00 46.19 43.33 3c0r s LEU 15 CO 0.10 -0.09 -0.11 -1.61 0.23 0.00 0.00 176.35 174.87 3c0r s GLU 16 N -3.97 2.31 0.17 1.70 2.02 -1.26 -2.18 118.70 117.49 3c0r s GLU 16 Ca 0.34 -1.30 0.01 0.00 0.02 0.00 0.00 54.97 54.05 3c0r s GLU 16 Cb -0.09 -2.89 -0.01 0.00 0.10 0.00 0.00 34.13 31.25 3c0r s GLU 16 CO 0.29 -0.54 0.05 1.33 0.02 0.00 0.00 175.26 176.40 3c0r n VAL 17 N 4.46 0.00 -3.98 2.63 0.24 -0.96 -4.98 118.33 115.74 3c0r n VAL 17 Ca -0.14 -0.96 -0.10 0.00 -2.04 0.00 0.00 64.34 61.10 3c0r n VAL 17 Cb 0.43 0.32 -0.12 0.00 -1.47 0.00 0.00 33.84 33.00 3c0r n VAL 17 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3c0r s GLU 18 N -2.64 0.30 0.54 7.34 0.41 -1.26 -3.50 118.70 119.90 3c0r s GLU 18 Ca 0.07 -0.54 0.29 0.00 -0.41 0.00 0.00 54.97 54.38 3c0r s GLU 18 Cb 0.00 0.02 1.45 0.00 -1.78 0.00 0.00 34.13 33.82 3c0r s GLU 18 CO 0.05 -0.02 1.93 -1.35 -0.49 0.00 0.00 175.26 175.38 3c0r h PRO 19 N 4.87 0.00 -0.01 0.39 0.11 -1.94 0.31 132.00 135.74 3c0r h PRO 19 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3c0r h PRO 19 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3c0r h PRO 19 CO 0.43 0.00 -0.19 -1.13 -0.21 0.00 0.00 178.00 176.90 3c0r n SER 20 N -4.27 0.79 -4.76 -2.05 3.41 -1.26 -0.76 113.62 104.72 3c0r n SER 20 Ca 0.14 -0.76 -0.41 0.00 -0.26 0.00 0.00 58.87 57.58 3c0r n SER 20 Cb 0.80 0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.77 3c0r n SER 20 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3c0r s ASP 21 N -2.48 6.58 0.63 4.04 1.01 0.11 -4.79 116.67 121.77 3c0r s ASP 21 Ca 0.26 2.78 -0.09 0.00 0.71 0.00 0.00 52.55 56.21 3c0r s ASP 21 Cb 0.20 -2.64 -0.00 0.00 1.01 0.00 0.00 42.92 41.48 3c0r s ASP 21 CO 0.50 -0.73 1.00 0.42 0.21 0.00 0.00 175.17 176.57 3c0r s THR 22 N -0.42 3.93 0.34 -1.27 -4.23 -1.26 -1.44 115.64 111.28 3c0r s THR 22 Ca 0.57 0.40 0.04 0.00 -1.18 0.00 0.00 61.69 61.52 3c0r s THR 22 Cb -0.43 -3.59 0.29 0.00 1.34 0.00 0.00 72.50 70.11 3c0r s THR 22 CO 0.49 -0.71 1.94 0.40 -0.54 0.00 0.00 174.62 176.19 3c0r h ILE 23 N -0.37 1.03 -0.21 2.99 1.08 -1.39 -1.47 117.51 119.17 3c0r h ILE 23 Ca -0.45 -0.29 0.05 0.00 -0.39 0.00 0.00 64.86 63.78 3c0r h ILE 23 Cb 1.24 0.10 -0.05 0.00 -3.07 0.00 0.00 36.82 35.04 3c0r h ILE 23 CO 0.62 0.16 -0.10 -0.33 -0.69 0.00 0.00 178.15 177.80 3c0r h GLU 24 N 0.85 -0.08 -0.47 2.37 5.08 -1.77 0.63 114.58 121.20 3c0r h GLU 24 Ca 0.35 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.80 3c0r h GLU 24 Cb 0.27 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 3c0r h GLU 24 CO -0.13 -0.05 0.04 -0.91 -1.00 0.00 0.00 179.01 176.96 3c0r h ASN 25 N -0.08 -0.12 -0.43 1.42 2.35 -1.61 0.32 115.58 117.43 3c0r h ASN 25 Ca 0.11 0.10 0.02 0.00 -0.55 0.00 0.00 56.30 55.99 3c0r h ASN 25 Cb 0.25 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.76 3c0r h ASN 25 CO -0.26 -0.03 0.25 0.58 -1.65 0.00 0.00 177.43 176.31 3c0r h VAL 26 N 0.15 1.03 -0.79 2.81 2.07 -0.61 0.26 116.25 121.17 3c0r h VAL 26 Ca 0.23 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.60 3c0r h VAL 26 Cb 0.33 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3c0r h VAL 26 CO -0.36 0.09 0.52 0.11 0.02 0.00 0.00 177.57 177.95 3c0r h LYS 27 N 0.50 1.01 -0.73 1.57 1.57 0.12 0.44 116.57 121.05 3c0r h LYS 27 Ca 0.17 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3c0r h LYS 27 Cb 0.02 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 3c0r h LYS 27 CO -0.09 0.67 0.30 0.00 -0.57 0.00 0.00 179.45 179.77 3c0r h ALA 28 N 1.31 1.16 -0.09 3.86 0.00 0.18 -0.31 119.26 125.37 3c0r h ALA 28 Ca 0.30 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3c0r h ALA 28 Cb -0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3c0r h ALA 28 CO -0.08 0.61 -0.32 0.87 0.00 0.00 0.00 179.25 180.33 3c0r h LYS 29 N 1.05 0.18 -0.16 0.00 1.57 0.48 0.27 116.57 119.97 3c0r h LYS 29 Ca 0.25 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.84 3c0r h LYS 29 Cb 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3c0r h LYS 29 CO -0.02 0.49 -0.35 0.82 -0.57 0.00 0.00 179.45 179.81 3c0r h ILE 30 N 0.16 1.35 -0.43 1.86 2.04 -0.35 -2.52 117.51 119.62 3c0r h ILE 30 Ca 0.02 -1.61 0.09 0.00 1.00 0.00 0.00 64.86 64.35 3c0r h ILE 30 Cb 0.66 1.98 -0.08 0.00 -0.74 0.00 0.00 36.82 38.64 3c0r h ILE 30 CO 0.05 0.49 -0.08 -0.61 0.00 0.00 0.00 178.15 177.99 3c0r h GLN 31 N 0.15 0.02 0.00 2.37 4.15 -0.64 0.32 115.11 121.48 3c0r h GLN 31 Ca 0.00 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 3c0r h GLN 31 Cb 0.96 -0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.64 3c0r h GLN 31 CO 0.08 0.01 -0.08 -0.44 -1.93 0.00 0.00 178.83 176.48 3c0r h ASP 32 N 0.02 0.00 0.00 -0.69 3.32 -0.88 0.12 116.42 118.31 3c0r h ASP 32 Ca 0.21 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.04 3c0r h ASP 32 Cb 0.32 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.83 3c0r h ASP 32 CO -0.43 0.08 -2.05 1.17 -1.72 0.00 0.00 179.24 176.29 3c0r n LYS 33 N -4.00 1.11 0.00 3.56 4.81 -0.91 -4.68 118.16 118.05 3c0r n LYS 33 Ca -0.03 -0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 3c0r n LYS 33 Cb 0.16 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 33.79 3c0r n LYS 33 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3c0r n GLU 34 N -2.49 3.65 -2.67 1.64 -0.58 0.11 -5.04 120.64 115.27 3c0r n GLU 34 Ca -0.21 -0.17 -0.16 0.00 -0.42 0.00 0.00 57.16 56.20 3c0r n GLU 34 Cb 0.89 -0.64 0.02 0.00 -0.57 0.00 0.00 31.44 31.14 3c0r n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3c0r n GLY 35 N 0.57 -0.22 3.49 0.62 0.00 0.42 -4.97 105.19 105.09 3c0r n GLY 35 Ca 0.00 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 3c0r n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3c0r s ILE 36 N -2.94 4.04 0.21 -0.61 1.01 -1.25 -5.01 121.20 116.65 3c0r s ILE 36 Ca 0.16 -0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.21 3c0r s ILE 36 Cb -0.07 -2.81 -0.10 0.00 0.01 0.00 0.00 42.46 39.49 3c0r s ILE 36 CO 0.20 0.46 1.55 -2.84 0.00 0.00 0.00 174.94 174.31 3c0r s PRO 37 N 0.68 4.21 0.43 2.79 0.02 -1.26 -3.73 135.00 138.14 3c0r s PRO 37 Ca -0.00 2.40 0.18 0.00 0.02 0.00 0.00 61.00 63.59 3c0r s PRO 37 Cb -0.14 -3.12 1.10 0.00 0.02 0.00 0.00 34.50 32.36 3c0r s PRO 37 CO 0.02 -0.58 1.89 -1.35 -0.33 0.00 0.00 177.00 176.66 3c0r h PRO 38 N 6.11 0.37 0.00 5.54 0.11 -1.95 0.42 132.00 142.59 3c0r h PRO 38 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3c0r h PRO 38 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3c0r h PRO 38 CO 0.87 0.24 0.00 -0.40 -0.21 0.00 0.00 178.00 178.50 3c0r n ASP 39 N -4.48 0.62 -1.07 -2.05 5.68 -1.26 -1.57 116.55 112.42 3c0r n ASP 39 Ca 0.16 0.66 0.11 0.00 -0.50 0.00 0.00 54.79 55.23 3c0r n ASP 39 Cb 0.62 -0.79 0.25 0.00 -1.14 0.00 0.00 41.12 40.06 3c0r n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3c0r n GLN 40 N -2.20 2.39 -4.31 0.11 1.13 0.13 -4.90 117.38 109.73 3c0r n GLN 40 Ca 0.02 -2.11 -0.34 0.00 -1.94 0.00 0.00 57.00 52.63 3c0r n GLN 40 Cb 0.21 -1.49 -0.12 0.00 0.11 0.00 0.00 30.24 28.95 3c0r n GLN 40 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3c0r s GLN 41 N -1.48 3.66 -0.16 -1.09 -0.21 -0.61 -1.38 119.66 118.39 3c0r s GLN 41 Ca 0.39 -0.52 -0.02 0.00 0.02 0.00 0.00 55.36 55.23 3c0r s GLN 41 Cb 0.22 -2.96 -0.01 0.00 1.00 0.00 0.00 33.01 31.26 3c0r s GLN 41 CO 0.30 0.18 -0.09 1.03 -2.12 0.00 0.00 175.29 174.59 3c0r s ARG 42 N 0.53 3.42 -0.10 2.91 0.52 0.34 -4.99 118.95 121.59 3c0r s ARG 42 Ca -0.03 -0.64 -0.03 0.00 -0.52 0.00 0.00 55.73 54.51 3c0r s ARG 42 Cb -0.14 -2.78 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 3c0r s ARG 42 CO 0.03 0.10 0.02 -0.51 0.02 0.00 0.00 175.30 174.96 3c0r s LEU 43 N 0.67 3.70 -0.05 2.53 1.43 -1.26 -1.07 118.68 124.62 3c0r s LEU 43 Ca -0.05 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 3c0r s LEU 43 Cb -0.15 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.23 3c0r s LEU 43 CO 0.02 0.37 -0.08 -0.63 0.23 0.00 0.00 176.35 176.26 3c0r s ILE 44 N -0.80 0.78 -0.05 -0.59 1.01 0.82 -1.84 121.20 120.53 3c0r s ILE 44 Ca 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.49 3c0r s ILE 44 Cb -0.12 -0.75 0.03 0.00 0.01 0.00 0.00 42.46 41.63 3c0r s ILE 44 CO 0.02 0.28 0.03 0.12 0.00 0.00 0.00 174.94 175.39 3c0r s PHE 45 N 0.78 0.31 -1.05 3.97 5.36 -1.10 0.75 117.98 127.01 3c0r s PHE 45 Ca -0.13 0.08 -0.04 0.00 -0.96 0.00 0.00 56.93 55.88 3c0r s PHE 45 Cb -0.15 -0.60 0.00 0.00 -0.34 0.00 0.00 43.02 41.94 3c0r s PHE 45 CO 0.02 -0.24 0.90 0.00 -1.46 0.00 0.00 175.22 174.44 3c0r n ALA 46 N 5.15 -1.35 -0.86 11.12 0.00 -1.26 -2.59 120.51 130.73 3c0r n ALA 46 Ca -0.06 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3c0r n ALA 46 Cb 0.50 -3.40 0.00 0.00 0.00 0.00 0.00 19.45 16.55 3c0r n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c0r n GLY 47 N -1.44 0.39 3.86 0.00 0.00 -1.26 -4.99 105.19 101.75 3c0r n GLY 47 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 3c0r n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c0r s LYS 48 N -0.73 3.62 -0.72 1.61 1.02 -1.07 -5.06 119.74 118.42 3c0r s LYS 48 Ca 0.00 0.06 -0.24 0.00 0.02 0.00 0.00 55.97 55.81 3c0r s LYS 48 Cb 0.00 -3.21 0.06 0.00 -0.52 0.00 0.00 37.83 34.16 3c0r s LYS 48 CO 0.00 0.74 1.11 -1.14 -0.92 0.00 0.00 175.35 175.14 3c0r s GLN 49 N -1.01 3.19 0.29 1.68 2.00 -1.26 -2.69 119.66 121.86 3c0r s GLN 49 Ca 0.18 -0.69 -0.29 0.00 -2.00 0.00 0.00 55.36 52.56 3c0r s GLN 49 Cb -0.14 -4.31 -0.10 0.00 0.80 0.00 0.00 33.01 29.26 3c0r s GLN 49 CO 0.07 -1.96 1.41 -0.51 -0.50 0.00 0.00 175.29 173.81 3c0r s LEU 50 N 4.64 4.39 -0.06 3.68 1.43 -0.76 -4.99 118.68 127.00 3c0r s LEU 50 Ca 0.29 2.73 -0.14 0.00 -1.03 0.00 0.00 54.13 55.98 3c0r s LEU 50 Cb -0.12 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 3c0r s LEU 50 CO 0.10 -0.68 0.35 -1.61 0.23 0.00 0.00 176.35 174.74 3c0r s GLU 51 N -0.99 3.95 0.36 1.70 2.02 -1.26 -4.72 118.70 119.76 3c0r s GLU 51 Ca 0.56 0.28 0.17 0.00 0.02 0.00 0.00 54.97 56.00 3c0r s GLU 51 Cb -0.42 -3.28 1.22 0.00 0.10 0.00 0.00 34.13 31.75 3c0r s GLU 51 CO 0.49 0.56 1.60 -0.44 0.02 0.00 0.00 175.26 177.49 3c0r h ASP 52 N 5.32 0.28 0.94 -0.19 5.19 -1.94 -2.64 116.42 123.39 3c0r h ASP 52 Ca -0.49 0.25 -0.21 0.00 -0.62 0.00 0.00 57.03 55.96 3c0r h ASP 52 Cb 1.21 0.26 -0.03 0.00 0.18 0.00 0.00 39.33 40.95 3c0r h ASP 52 CO 0.65 -0.36 -0.99 1.23 -3.12 0.00 0.00 179.24 176.66 3c0r h GLY 53 N 0.08 0.02 -1.00 2.75 0.00 -1.97 -2.72 103.07 100.23 3c0r h GLY 53 Ca 0.79 -0.06 -0.48 0.00 0.00 0.00 0.00 47.33 47.58 3c0r h GLY 53 CO -0.75 0.05 0.33 0.50 0.00 0.00 0.00 176.54 176.67 3c0r s ARG 54 N -2.78 1.87 0.44 4.80 1.81 -0.99 -4.80 118.95 119.30 3c0r s ARG 54 Ca 0.00 0.58 0.08 0.00 -1.72 0.00 0.00 55.73 54.68 3c0r s ARG 54 Cb 0.10 -1.90 0.02 0.00 -0.45 0.00 0.00 34.95 32.72 3c0r s ARG 54 CO 0.82 -1.76 0.59 0.95 -0.68 0.00 0.00 175.30 175.22 3c0r s THR 55 N -3.17 2.86 0.28 0.02 -4.23 -1.26 -2.06 115.64 108.08 3c0r s THR 55 Ca 0.61 -1.02 0.03 0.00 -1.18 0.00 0.00 61.69 60.13 3c0r s THR 55 Cb -0.15 -2.88 0.06 0.00 1.34 0.00 0.00 72.50 70.88 3c0r s THR 55 CO 0.54 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 176.27 3c0r h LEU 56 N 0.60 0.45 -1.09 4.79 3.38 -1.02 -2.62 115.31 119.80 3c0r h LEU 56 Ca -0.39 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.33 3c0r h LEU 56 Cb 1.28 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3c0r h LEU 56 CO 0.45 0.72 -0.45 -1.28 0.09 0.00 0.00 178.44 177.98 3c0r h SER 57 N 0.39 0.00 -0.17 -0.43 0.87 -1.17 -1.89 113.55 111.16 3c0r h SER 57 Ca 0.05 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.60 3c0r h SER 57 Cb 0.70 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 3c0r h SER 57 CO 0.05 0.45 0.07 0.44 -0.53 0.00 0.00 176.83 177.31 3c0r h ASP 58 N 0.00 0.27 -0.58 6.23 3.32 -1.72 -1.41 116.42 122.53 3c0r h ASP 58 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3c0r h ASP 58 Cb 0.81 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3c0r h ASP 58 CO 0.06 0.26 0.00 -1.22 -1.72 0.00 0.00 179.24 176.62 3c0r n TYR 59 N -4.43 1.59 -1.32 4.55 4.01 -1.13 -4.92 117.16 115.50 3c0r n TYR 59 Ca 0.00 -0.60 -0.13 0.00 -0.16 0.00 0.00 57.90 57.02 3c0r n TYR 59 Cb 0.13 -0.32 -0.05 0.00 -0.31 0.00 0.00 39.34 38.79 3c0r n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3c0r n ASN 60 N 0.89 -3.80 -4.68 7.72 5.15 -0.53 -4.91 115.26 115.10 3c0r n ASN 60 Ca 0.25 0.31 -0.42 0.00 -0.60 0.00 0.00 54.58 54.12 3c0r n ASN 60 Cb 0.94 -3.36 -0.03 0.00 -0.53 0.00 0.00 39.78 36.80 3c0r n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3c0r s ILE 61 N -2.02 3.06 0.00 -1.44 1.01 -0.72 -4.95 121.20 116.13 3c0r s ILE 61 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.10 3c0r s ILE 61 Cb 0.00 -3.29 0.00 0.00 0.01 0.00 0.00 42.46 39.18 3c0r s ILE 61 CO 0.00 -0.01 0.00 1.67 0.00 0.00 0.00 174.94 176.60 3c0r n GLN 62 N 5.88 0.00 -1.60 2.79 -0.06 -1.26 -4.48 117.38 118.65 3c0r n GLN 62 Ca 0.16 0.00 -0.54 0.00 -2.00 0.00 0.00 57.00 54.62 3c0r n GLN 62 Cb 0.41 0.00 -0.06 0.00 -4.06 0.00 0.00 30.24 26.52 3c0r n GLN 62 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 3c0r n LYS 63 N 0.00 0.99 -1.79 3.69 5.02 -1.26 -0.69 118.16 124.12 3c0r n LYS 63 Ca 0.00 0.36 -0.21 0.00 -2.02 0.00 0.00 58.31 56.44 3c0r n LYS 63 Cb 0.00 -1.99 -0.07 0.00 -0.02 0.00 0.00 35.03 32.95 3c0r n LYS 63 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3c0r n GLU 64 N 2.89 -1.51 -2.38 1.97 1.02 -0.38 -4.97 120.64 117.28 3c0r n GLU 64 Ca 0.20 1.17 -0.41 0.00 -0.02 0.00 0.00 57.16 58.10 3c0r n GLU 64 Cb 0.16 -5.62 -0.04 0.00 -0.02 0.00 0.00 31.44 25.93 3c0r n GLU 64 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3c0r s SER 65 N -2.58 7.11 -0.24 1.62 0.01 0.14 -4.82 113.70 114.94 3c0r s SER 65 Ca 0.00 2.28 -0.08 0.00 1.31 0.00 0.00 55.95 59.46 3c0r s SER 65 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 3c0r s SER 65 CO 0.00 -0.32 0.09 -0.89 0.41 0.00 0.00 173.24 172.54 3c0r s THR 66 N -0.47 4.60 0.10 1.44 2.01 -1.26 -1.02 115.64 121.04 3c0r s THR 66 Ca 0.50 -0.08 -0.02 0.00 0.31 0.00 0.00 61.69 62.40 3c0r s THR 66 Cb -0.33 -3.15 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 3c0r s THR 66 CO 0.39 0.34 0.28 -0.76 -0.69 0.00 0.00 174.62 174.19 3c0r s LEU 67 N 1.43 4.32 -0.18 4.42 1.02 0.33 -4.82 118.68 125.20 3c0r s LEU 67 Ca 0.06 0.40 -0.05 0.00 0.02 0.00 0.00 54.13 54.56 3c0r s LEU 67 Cb -0.15 -3.11 -0.03 0.00 0.02 0.00 0.00 46.19 42.92 3c0r s LEU 67 CO 0.05 0.11 0.00 -1.00 0.02 0.00 0.00 176.35 175.53 3c0r s HIS 68 N -1.59 3.08 -0.21 0.29 3.76 0.23 -0.06 115.29 120.80 3c0r s HIS 68 Ca 0.38 -0.27 -0.04 0.00 -0.15 0.00 0.00 55.06 54.97 3c0r s HIS 68 Cb -0.13 -2.04 -0.02 0.00 1.11 0.00 0.00 32.58 31.51 3c0r s HIS 68 CO 0.27 -0.08 -0.02 -1.17 -0.85 0.00 0.00 174.74 172.89 3c0r s LEU 69 N 0.63 3.12 -0.07 0.89 2.96 -0.44 -0.13 118.68 125.65 3c0r s LEU 69 Ca -0.00 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 3c0r s LEU 69 Cb -0.14 -1.79 0.00 0.00 0.50 0.00 0.00 46.19 44.76 3c0r s LEU 69 CO 0.02 0.04 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.21 3c0r s VAL 70 N 1.15 1.65 0.50 1.68 1.01 -0.24 -4.03 120.40 122.12 3c0r s VAL 70 Ca 0.02 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 3c0r s VAL 70 Cb -0.14 -1.43 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 3c0r s VAL 70 CO 0.01 0.47 0.76 -0.76 0.00 0.00 0.00 175.10 175.57 3c0r s LEU 71 N 0.27 3.50 0.00 3.92 1.43 -1.26 -0.50 118.68 126.04 3c0r s LEU 71 Ca -0.11 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 3c0r s LEU 71 Cb -0.15 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.70 3c0r s LEU 71 CO 0.05 -0.81 0.00 0.54 0.23 0.00 0.00 176.35 176.36 3c0r n ARG 72 N -2.27 0.00 -3.30 1.70 1.74 -0.48 -4.89 116.66 109.17 3c0r n ARG 72 Ca 0.02 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.87 3c0r n ARG 72 Cb 0.57 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 32.07 3c0r n ARG 72 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3c0r n LEU 73 N 0.00 -3.04 -4.69 0.55 4.77 -1.26 -4.95 117.00 108.38 3c0r n LEU 73 Ca 0.00 -0.41 -0.42 0.00 -0.03 0.00 0.00 56.01 55.16 3c0r n LEU 73 Cb 0.00 -3.02 -0.04 0.00 -2.33 0.00 0.00 43.42 38.04 3c0r n LEU 73 CO 0.00 0.44 0.65 -0.13 -1.33 0.00 0.00 177.39 177.01 3c0r s ARG 74 N -6.00 4.38 0.00 3.23 0.52 -1.26 -5.26 118.95 114.56 3c0r s ARG 74 Ca 0.44 1.16 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 3c0r s ARG 74 Cb -0.19 -3.54 0.00 0.00 0.52 0.00 0.00 34.95 31.74 3c0r s ARG 74 CO 0.54 -0.25 0.00 0.41 0.02 0.00 0.00 175.30 176.03