#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dso n ASP 2 N 0.00 5.15 0.26 4.52 2.03 -1.26 -4.83 116.55 122.42 3dso n ASP 2 Ca 0.00 -3.01 0.13 0.00 0.52 0.00 0.00 54.79 52.44 3dso n ASP 2 Cb 0.00 -1.56 0.66 0.00 -0.72 0.00 0.00 41.12 39.50 3dso n ASP 2 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 3dso h MET 3 N 6.76 0.00 0.00 -0.67 2.86 -2.03 -1.05 114.93 120.80 3dso h MET 3 Ca 0.35 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.99 3dso h MET 3 Cb 0.80 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.46 3dso h MET 3 CO 1.37 0.12 -0.01 0.77 1.06 0.00 0.00 176.91 180.22 3dso h SER 4 N 0.00 0.00 -0.45 1.22 0.02 -2.04 -2.37 113.55 109.93 3dso h SER 4 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3dso h SER 4 Cb 0.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.04 3dso h SER 4 CO 0.02 0.01 0.00 0.59 -1.14 0.00 0.00 176.83 176.31 3dso n ASN 5 N -3.52 3.24 -4.69 3.07 3.02 -0.40 -4.93 115.26 111.05 3dso n ASN 5 Ca -0.03 -2.03 -0.40 0.00 -0.03 0.00 0.00 54.58 52.10 3dso n ASN 5 Cb 0.10 -0.31 -0.05 0.00 -0.61 0.00 0.00 39.78 38.90 3dso n ASN 5 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dso s VAL 6 N -1.05 5.02 -0.13 2.41 1.01 -0.89 -0.62 120.40 126.15 3dso s VAL 6 Ca 0.31 1.32 0.18 0.00 0.00 0.00 0.00 61.98 63.78 3dso s VAL 6 Cb 0.16 -3.99 -0.22 0.00 0.00 0.00 0.00 36.38 32.32 3dso s VAL 6 CO 0.20 0.17 0.47 1.33 0.00 0.00 0.00 175.10 177.27 3dso n VAL 7 N 4.29 1.01 -3.71 2.92 0.24 0.47 -4.91 118.33 118.64 3dso n VAL 7 Ca -0.01 -0.71 -0.13 0.00 -2.04 0.00 0.00 64.34 61.45 3dso n VAL 7 Cb 0.50 -0.49 -0.10 0.00 -1.47 0.00 0.00 33.84 32.29 3dso n VAL 7 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3dso s LYS 8 N -2.89 0.53 -0.04 7.34 2.20 -1.16 -5.03 119.74 120.69 3dso s LYS 8 Ca -0.07 0.67 0.07 0.00 -0.36 0.00 0.00 55.97 56.28 3dso s LYS 8 Cb 0.09 0.23 -0.02 0.00 -1.51 0.00 0.00 37.83 36.63 3dso s LYS 8 CO 0.84 -0.08 -0.25 0.99 -0.36 0.00 0.00 175.35 176.50 3dso s THR 9 N 0.38 2.00 -0.24 3.43 2.01 -1.26 -0.99 115.64 120.98 3dso s THR 9 Ca -0.01 -1.06 -0.07 0.00 0.31 0.00 0.00 61.69 60.86 3dso s THR 9 Cb -0.04 -1.68 -0.03 0.00 0.01 0.00 0.00 72.50 70.77 3dso s THR 9 CO -0.01 0.56 0.05 -0.31 -0.69 0.00 0.00 174.62 174.22 3dso s TYR 10 N -0.40 3.07 -0.44 4.92 2.02 0.29 -4.97 117.35 121.84 3dso s TYR 10 Ca 0.04 -0.47 -0.17 0.00 -0.37 0.00 0.00 57.07 56.10 3dso s TYR 10 Cb -0.11 -2.20 0.03 0.00 -0.40 0.00 0.00 41.96 39.28 3dso s TYR 10 CO 0.01 -0.35 0.45 -0.51 -1.57 0.00 0.00 175.55 173.59 3dso s ASP 11 N 1.47 6.19 0.46 2.29 1.01 -1.26 -1.30 116.67 125.53 3dso s ASP 11 Ca 0.06 -0.81 -0.12 0.00 0.71 0.00 0.00 52.55 52.38 3dso s ASP 11 Cb -0.15 -2.23 -0.07 0.00 1.01 0.00 0.00 42.92 41.49 3dso s ASP 11 CO 0.03 -0.63 0.86 -0.76 0.21 0.00 0.00 175.17 174.87 3dso s LEU 12 N 2.12 3.71 0.39 1.23 1.43 -0.34 -0.40 118.68 126.82 3dso s LEU 12 Ca 0.11 1.29 0.13 0.00 -1.03 0.00 0.00 54.13 54.63 3dso s LEU 12 Cb -0.18 -4.21 0.95 0.00 0.03 0.00 0.00 46.19 42.78 3dso s LEU 12 CO 0.12 -0.50 1.88 1.56 0.23 0.00 0.00 176.35 179.64 3dso h GLN 13 N 0.99 0.53 -0.02 1.70 1.08 -1.15 -0.61 115.11 117.63 3dso h GLN 13 Ca -0.47 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 3dso h GLN 13 Cb 1.19 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.50 3dso h GLN 13 CO 0.63 0.35 0.00 -0.40 -0.95 0.00 0.00 178.83 178.46 3dso n ASP 14 N -4.53 0.13 0.00 1.46 5.68 -1.26 -4.88 116.55 113.15 3dso n ASP 14 Ca 0.17 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.50 3dso n ASP 14 Cb 0.55 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 3dso n ASP 14 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dso n GLY 15 N 0.56 1.72 3.80 6.12 0.00 -0.24 -4.67 105.19 112.48 3dso n GLY 15 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3dso n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dso s SER 16 N -3.30 3.95 -0.00 1.61 0.01 -1.26 -3.29 113.70 111.42 3dso s SER 16 Ca 0.00 1.11 0.01 0.00 1.31 0.00 0.00 55.95 58.38 3dso s SER 16 Cb 0.00 -1.76 -0.00 0.00 0.21 0.00 0.00 66.02 64.47 3dso s SER 16 CO 0.00 -2.29 -0.04 -0.54 0.41 0.00 0.00 173.24 170.78 3dso s LYS 17 N -5.23 0.33 -0.18 12.44 1.02 0.18 -1.20 119.74 127.10 3dso s LYS 17 Ca 0.62 -0.13 -0.06 0.00 0.02 0.00 0.00 55.97 56.42 3dso s LYS 17 Cb -0.15 -0.33 -0.03 0.00 -0.52 0.00 0.00 37.83 36.81 3dso s LYS 17 CO 0.54 0.07 0.02 0.08 -0.92 0.00 0.00 175.35 175.15 3dso s VAL 18 N -0.04 4.36 -0.10 3.17 1.01 -0.42 -1.31 120.40 127.08 3dso s VAL 18 Ca 0.01 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 61.84 3dso s VAL 18 Cb -0.02 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 3dso s VAL 18 CO -0.00 0.45 -0.20 -1.00 0.00 0.00 0.00 175.10 174.36 3dso s HIS 19 N 0.57 2.64 -0.12 5.22 0.09 -0.11 -0.54 115.29 123.02 3dso s HIS 19 Ca 0.01 -0.78 -0.00 0.00 -0.00 0.00 0.00 55.06 54.28 3dso s HIS 19 Cb -0.13 -1.73 -0.02 0.00 -0.00 0.00 0.00 32.58 30.70 3dso s HIS 19 CO 0.02 -0.26 -0.11 0.08 -0.00 0.00 0.00 174.74 174.46 3dso s VAL 20 N 0.17 3.21 0.28 -0.90 1.01 -0.16 -1.40 120.40 122.61 3dso s VAL 20 Ca -0.11 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.31 3dso s VAL 20 Cb -0.16 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 3dso s VAL 20 CO 0.06 0.53 0.41 -0.36 0.00 0.00 0.00 175.10 175.74 3dso s PHE 21 N 0.19 3.30 0.46 5.22 0.08 -0.20 -0.40 117.98 126.63 3dso s PHE 21 Ca -0.07 -0.10 0.18 0.00 0.12 0.00 0.00 56.93 57.06 3dso s PHE 21 Cb -0.15 -1.76 1.14 0.00 -0.57 0.00 0.00 43.02 41.68 3dso s PHE 21 CO 0.05 0.24 1.95 0.87 -0.10 0.00 0.00 175.22 178.23 3dso h LYS 22 N 1.04 0.29 -0.34 0.44 1.57 -1.19 -0.85 116.57 117.53 3dso h LYS 22 Ca -0.49 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3dso h LYS 22 Cb 1.24 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3dso h LYS 22 CO 0.57 0.19 0.00 -0.40 -0.57 0.00 0.00 179.45 179.24 3dso n ASP 23 N -4.45 2.00 0.00 0.86 5.75 -1.26 -4.91 116.55 114.54 3dso n ASP 23 Ca 0.12 -1.94 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 3dso n ASP 23 Cb 0.52 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 3dso n ASP 23 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dso n GLY 24 N 1.12 1.14 3.76 6.12 0.00 -0.33 -5.04 105.19 111.96 3dso n GLY 24 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 3dso n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dso s LYS 25 N -0.56 2.30 0.00 1.61 1.02 -1.26 -4.75 119.74 118.09 3dso s LYS 25 Ca 0.00 1.31 -0.00 0.00 0.02 0.00 0.00 55.97 57.29 3dso s LYS 25 Cb 0.00 -1.89 -0.01 0.00 -0.52 0.00 0.00 37.83 35.41 3dso s LYS 25 CO 0.00 -1.63 0.00 1.41 -0.92 0.00 0.00 175.35 174.21 3dso s MET 26 N -4.58 0.13 0.25 1.68 1.75 -1.26 -1.03 119.30 116.24 3dso s MET 26 Ca 0.64 -0.20 -0.04 0.00 -1.25 0.00 0.00 55.69 54.84 3dso s MET 26 Cb -0.19 0.05 -0.02 0.00 2.84 0.00 0.00 34.83 37.50 3dso s MET 26 CO 0.51 -0.02 0.31 0.20 -0.65 0.00 0.00 175.02 175.37 3dso s GLY 27 N -0.52 1.26 0.00 2.11 0.00 -0.50 -5.00 107.32 104.67 3dso s GLY 27 Ca -0.06 -1.46 -0.01 0.00 0.00 0.00 0.00 44.72 43.20 3dso s GLY 27 CO -0.00 -1.11 0.01 -0.29 0.00 0.00 0.00 173.10 171.71 3dso s MET 28 N -3.87 0.18 0.00 2.90 1.75 -1.26 -0.93 119.30 118.07 3dso s MET 28 Ca 0.33 -0.27 0.02 0.00 -1.25 0.00 0.00 55.69 54.52 3dso s MET 28 Cb 0.03 0.07 -0.01 0.00 2.84 0.00 0.00 34.83 37.76 3dso s MET 28 CO 0.14 -0.03 -0.08 -1.83 -0.65 0.00 0.00 175.02 172.57 3dso s GLU 29 N -0.71 0.58 0.97 4.11 -1.05 -0.43 -1.46 118.70 120.72 3dso s GLU 29 Ca -0.08 -0.34 -0.16 0.00 -0.15 0.00 0.00 54.97 54.24 3dso s GLU 29 Cb -0.05 -0.54 0.24 0.00 -0.44 0.00 0.00 34.13 33.34 3dso s GLU 29 CO -0.00 0.14 1.00 0.27 0.95 0.00 0.00 175.26 177.62 3dso n ASN 30 N 2.67 -1.23 0.00 0.83 0.23 0.44 -0.64 115.26 117.56 3dso n ASN 30 Ca -0.15 -1.19 0.09 0.00 -0.53 0.00 0.00 54.58 52.80 3dso n ASN 30 Cb 0.57 -0.86 0.41 0.00 -2.08 0.00 0.00 39.78 37.82 3dso n ASN 30 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 3dso n LYS 31 N -4.01 0.11 -0.12 -3.83 2.85 -1.21 -1.13 118.16 110.83 3dso n LYS 31 Ca 0.13 0.17 0.12 0.00 -1.05 0.00 0.00 58.31 57.68 3dso n LYS 31 Cb 0.50 -1.50 0.21 0.00 -0.65 0.00 0.00 35.03 33.59 3dso n LYS 31 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3dso n PHE 32 N -1.41 0.32 -0.85 5.58 3.72 -1.26 -4.96 117.46 118.59 3dso n PHE 32 Ca 0.06 -0.16 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 3dso n PHE 32 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 3dso n PHE 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dso n GLY 33 N 1.42 0.54 3.73 1.37 0.00 -0.28 -5.04 105.19 106.94 3dso n GLY 33 Ca 0.18 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 3dso n GLY 33 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dso s LYS 34 N -0.64 4.57 0.45 1.61 2.20 -1.26 -4.80 119.74 121.86 3dso s LYS 34 Ca 0.00 1.24 -0.25 0.00 -0.36 0.00 0.00 55.97 56.60 3dso s LYS 34 Cb 0.00 -3.39 -0.08 0.00 -1.51 0.00 0.00 37.83 32.85 3dso s LYS 34 CO 0.00 0.18 1.37 0.45 -0.36 0.00 0.00 175.35 177.00 3dso s SER 35 N 0.23 5.95 0.05 1.43 0.15 -1.26 -0.42 113.70 119.83 3dso s SER 35 Ca 0.43 2.80 0.06 0.00 0.70 0.00 0.00 55.95 59.95 3dso s SER 35 Cb -0.21 -2.65 -0.02 0.00 -1.71 0.00 0.00 66.02 61.43 3dso s SER 35 CO 0.26 -1.11 -0.16 -0.04 1.20 0.00 0.00 173.24 173.38 3dso s MET 36 N -2.44 1.02 0.39 5.44 1.00 -0.53 -4.82 119.30 119.35 3dso s MET 36 Ca 0.61 -0.87 -0.26 0.00 0.00 0.00 0.00 55.69 55.17 3dso s MET 36 Cb -0.41 -1.08 -0.09 0.00 0.00 0.00 0.00 34.83 33.25 3dso s MET 36 CO 0.52 0.26 1.17 -0.80 0.00 0.00 0.00 175.02 176.18 3dso s ASN 37 N -1.32 6.60 -0.13 3.03 0.02 -1.26 -4.13 114.94 117.75 3dso s ASN 37 Ca 0.03 2.37 -0.29 0.00 -1.02 0.00 0.00 52.86 53.95 3dso s ASN 37 Cb -0.09 -2.62 -0.01 0.00 0.02 0.00 0.00 41.25 38.56 3dso s ASN 37 CO 0.02 -0.62 0.98 -0.04 0.02 0.00 0.00 177.10 177.45 3dso s MET 38 N -2.20 4.39 -0.51 -0.60 -1.94 -1.26 -4.97 119.30 112.21 3dso s MET 38 Ca 0.55 1.32 -0.28 0.00 -1.71 0.00 0.00 55.69 55.57 3dso s MET 38 Cb -0.31 -3.55 0.01 0.00 2.01 0.00 0.00 34.83 32.98 3dso s MET 38 CO 0.40 -0.34 1.41 -1.25 -0.01 0.00 0.00 175.02 175.23 3dso s PRO 39 N 2.12 3.39 0.30 2.03 0.04 -1.26 -4.98 135.00 136.64 3dso s PRO 39 Ca 0.46 0.61 -0.29 0.00 0.04 0.00 0.00 61.00 61.82 3dso s PRO 39 Cb -0.18 -4.09 -0.10 0.00 0.04 0.00 0.00 34.50 30.18 3dso s PRO 39 CO 0.16 -1.82 1.13 -2.00 0.04 0.00 0.00 177.00 174.51 3dso s GLU 40 N 5.33 4.55 -0.82 4.56 2.12 -1.26 -3.58 118.70 129.60 3dso s GLU 40 Ca 0.55 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.75 3dso s GLU 40 Cb -0.12 -3.13 0.00 0.00 0.26 0.00 0.00 34.13 31.15 3dso s GLU 40 CO 0.28 0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.52 3dso n GLY 41 N 1.07 0.94 3.51 -1.50 0.00 0.65 -4.98 105.19 104.88 3dso n GLY 41 Ca -0.01 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 3dso n GLY 41 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dso s LYS 42 N -2.39 3.71 0.11 1.61 2.20 -1.23 -5.00 119.74 118.74 3dso s LYS 42 Ca 0.00 -0.49 -0.31 0.00 -0.36 0.00 0.00 55.97 54.81 3dso s LYS 42 Cb 0.00 -3.01 -0.07 0.00 -1.51 0.00 0.00 37.83 33.24 3dso s LYS 42 CO 0.00 0.18 1.27 0.08 -0.36 0.00 0.00 175.35 176.52 3dso s VAL 43 N 0.55 3.66 -0.04 4.02 1.01 -1.26 -4.39 120.40 123.95 3dso s VAL 43 Ca -0.01 1.23 0.03 0.00 0.00 0.00 0.00 61.98 63.23 3dso s VAL 43 Cb -0.14 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.46 3dso s VAL 43 CO 0.02 0.12 -0.13 -0.04 0.00 0.00 0.00 175.10 175.07 3dso s MET 44 N 0.81 1.40 -0.15 2.72 1.00 -0.07 -4.97 119.30 120.04 3dso s MET 44 Ca 0.60 -0.46 -0.08 0.00 0.00 0.00 0.00 55.69 55.75 3dso s MET 44 Cb -0.33 -1.25 -0.04 0.00 0.00 0.00 0.00 34.83 33.21 3dso s MET 44 CO 0.31 0.17 0.12 -2.00 0.00 0.00 0.00 175.02 173.63 3dso s GLU 45 N 0.14 3.71 0.62 2.03 2.12 -1.26 -0.27 118.70 125.79 3dso s GLU 45 Ca -0.04 -0.19 -0.04 0.00 0.36 0.00 0.00 54.97 55.06 3dso s GLU 45 Cb -0.10 -3.25 0.04 0.00 0.26 0.00 0.00 34.13 31.08 3dso s GLU 45 CO 0.01 0.57 0.90 0.95 -0.54 0.00 0.00 175.26 177.16 3dso s THR 46 N -0.43 2.85 0.55 -1.70 -4.23 0.92 -0.75 115.64 112.85 3dso s THR 46 Ca 0.12 -0.31 0.24 0.00 -1.18 0.00 0.00 61.69 60.56 3dso s THR 46 Cb -0.12 -3.15 0.31 0.00 1.34 0.00 0.00 72.50 70.88 3dso s THR 46 CO 0.02 -0.15 2.19 0.03 -0.54 0.00 0.00 174.62 176.17 3dso h ARG 47 N -0.26 0.00 -0.65 3.99 3.08 -0.96 -1.23 114.38 118.35 3dso h ARG 47 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.61 3dso h ARG 47 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3dso h ARG 47 CO 0.58 0.02 0.00 -0.40 -1.07 0.00 0.00 179.97 179.11 3dso n ASP 48 N -4.07 3.95 0.00 7.04 5.75 -1.26 -4.94 116.55 123.02 3dso n ASP 48 Ca -0.03 -2.23 0.00 0.00 -0.01 0.00 0.00 54.79 52.52 3dso n ASP 48 Cb 0.11 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 39.70 3dso n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dso n GLY 49 N 1.26 0.91 3.75 6.12 0.00 -0.47 -5.05 105.19 111.72 3dso n GLY 49 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 3dso n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dso s THR 50 N -2.30 2.26 -0.00 2.61 2.01 -1.26 -4.71 115.64 114.25 3dso s THR 50 Ca 0.00 0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.24 3dso s THR 50 Cb 0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 72.50 69.39 3dso s THR 50 CO 0.00 -0.01 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.22 3dso s LYS 51 N -2.95 2.28 0.15 4.92 1.02 -1.26 -0.05 119.74 123.84 3dso s LYS 51 Ca 0.72 -0.85 0.05 0.00 0.02 0.00 0.00 55.97 55.91 3dso s LYS 51 Cb -0.38 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.61 3dso s LYS 51 CO 0.44 0.58 -0.11 0.96 -0.92 0.00 0.00 175.35 176.30 3dso s ILE 52 N -0.83 1.25 -0.01 2.17 -4.36 0.63 -1.29 121.20 118.76 3dso s ILE 52 Ca 0.13 -2.04 0.02 0.00 -0.26 0.00 0.00 60.65 58.50 3dso s ILE 52 Cb -0.11 -1.83 -0.00 0.00 1.25 0.00 0.00 42.46 41.77 3dso s ILE 52 CO 0.03 -0.70 -0.06 -0.63 0.24 0.00 0.00 174.94 173.82 3dso s ILE 53 N -3.16 0.52 -0.21 8.37 1.01 0.08 -0.90 121.20 126.91 3dso s ILE 53 Ca 0.16 -0.27 -0.09 0.00 0.00 0.00 0.00 60.65 60.46 3dso s ILE 53 Cb 0.01 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 3dso s ILE 53 CO 0.02 0.15 0.11 -0.04 0.00 0.00 0.00 174.94 175.17 3dso s MET 54 N -0.09 3.99 -0.16 2.79 -1.94 -1.26 -0.57 119.30 122.06 3dso s MET 54 Ca 0.02 -0.32 -0.10 0.00 -1.71 0.00 0.00 55.69 53.57 3dso s MET 54 Cb -0.03 -3.37 0.05 0.00 2.01 0.00 0.00 34.83 33.49 3dso s MET 54 CO -0.00 0.13 0.40 0.21 -0.01 0.00 0.00 175.02 175.75 3dso s LYS 55 N 0.80 0.40 -1.45 2.03 2.20 -0.45 -0.26 119.74 123.02 3dso s LYS 55 Ca 0.05 0.71 -0.05 0.00 -0.36 0.00 0.00 55.97 56.32 3dso s LYS 55 Cb -0.13 0.03 0.01 0.00 -1.51 0.00 0.00 37.83 36.23 3dso s LYS 55 CO 0.02 -0.13 0.72 0.41 -0.36 0.00 0.00 175.35 176.01 3dso n GLY 56 N 3.90 -0.47 2.47 5.54 0.00 -1.26 -1.77 105.19 113.61 3dso n GLY 56 Ca -0.21 0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 3dso n GLY 56 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dso n ASN 57 N -2.45 -5.53 -4.28 1.61 5.15 -1.26 -5.00 115.26 103.50 3dso n ASN 57 Ca -0.08 0.25 -0.22 0.00 -0.60 0.00 0.00 54.58 53.93 3dso n ASN 57 Cb 0.60 -4.75 -0.12 0.00 -0.53 0.00 0.00 39.78 34.98 3dso n ASN 57 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dso s GLU 58 N -4.38 1.11 -0.20 1.20 0.41 -0.73 -4.96 118.70 111.16 3dso s GLU 58 Ca 0.00 -1.22 -0.08 0.00 -0.41 0.00 0.00 54.97 53.27 3dso s GLU 58 Cb 0.00 -1.22 -0.04 0.00 -1.78 0.00 0.00 34.13 31.09 3dso s GLU 58 CO 0.00 0.26 0.08 0.42 -0.49 0.00 0.00 175.26 175.53 3dso s ILE 59 N -1.59 4.80 -0.11 -1.63 -1.09 -1.26 -1.34 121.20 118.98 3dso s ILE 59 Ca 0.08 -0.03 -0.02 0.00 -2.23 0.00 0.00 60.65 58.46 3dso s ILE 59 Cb -0.08 -3.18 -0.03 0.00 -1.58 0.00 0.00 42.46 37.59 3dso s ILE 59 CO 0.04 0.43 -0.04 -0.36 -1.23 0.00 0.00 174.94 173.79 3dso s PHE 60 N 0.63 3.04 0.06 3.97 0.08 0.26 -4.98 117.98 121.03 3dso s PHE 60 Ca 0.04 -0.08 0.09 0.00 0.12 0.00 0.00 56.93 57.09 3dso s PHE 60 Cb -0.13 -1.85 -0.03 0.00 -0.57 0.00 0.00 43.02 40.44 3dso s PHE 60 CO 0.01 0.19 -0.24 0.50 -0.10 0.00 0.00 175.22 175.59 3dso s ARG 61 N -0.27 1.57 0.23 0.44 3.52 -1.26 -0.74 118.95 122.44 3dso s ARG 61 Ca 0.05 -1.07 -0.31 0.00 -0.13 0.00 0.00 55.73 54.27 3dso s ARG 61 Cb -0.13 -1.76 -0.14 0.00 -1.56 0.00 0.00 34.95 31.37 3dso s ARG 61 CO 0.02 0.45 1.21 1.28 -0.81 0.00 0.00 175.30 177.45 3dso n LEU 62 N 1.68 2.24 -4.61 -0.88 4.77 -0.41 -4.79 117.00 115.00 3dso n LEU 62 Ca -0.17 1.16 -0.43 0.00 -0.03 0.00 0.00 56.01 56.53 3dso n LEU 62 Cb 0.53 -1.32 -0.02 0.00 -2.33 0.00 0.00 43.42 40.27 3dso n LEU 62 CO 0.23 -1.01 1.41 -0.62 -1.33 0.00 0.00 177.39 176.07 3dso s ASP 63 N -0.06 6.13 0.64 -1.43 -1.08 -1.26 -4.86 116.67 114.74 3dso s ASP 63 Ca 0.67 1.21 0.38 0.00 -0.52 0.00 0.00 52.55 54.29 3dso s ASP 63 Cb -0.73 -2.53 2.18 0.00 -1.46 0.00 0.00 42.92 40.38 3dso s ASP 63 CO 0.54 -1.54 2.33 -0.08 0.52 0.00 0.00 175.17 176.94 3dso h GLU 64 N 11.77 0.00 0.00 4.34 4.81 -2.03 -1.66 114.58 131.82 3dso h GLU 64 Ca -0.32 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 3dso h GLU 64 Cb 1.14 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 3dso h GLU 64 CO 1.04 0.00 -0.02 0.00 -0.73 0.00 0.00 179.01 179.31 3dso h ALA 65 N 2.00 1.54 -0.03 2.92 0.00 -2.01 -3.57 119.26 120.12 3dso h ALA 65 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dso h ALA 65 Cb 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dso h ALA 65 CO -0.00 0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.55