#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ssf n SER 8 N 0.00 1.83 -1.91 0.53 3.41 -1.26 -4.74 113.62 111.48 1ssf n SER 8 Ca 0.00 0.31 -0.18 0.00 -0.26 0.00 0.00 58.87 58.74 1ssf n SER 8 Cb 0.00 -0.72 0.13 0.00 -0.26 0.00 0.00 64.21 63.36 1ssf n SER 8 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1ssf n PHE 9 N -4.28 2.27 -0.15 7.33 3.72 -1.26 -4.72 117.46 120.36 1ssf n PHE 9 Ca -0.28 -1.54 0.25 0.00 -0.05 0.00 0.00 57.45 55.83 1ssf n PHE 9 Cb 0.63 -0.79 0.68 0.00 -0.94 0.00 0.00 39.48 39.06 1ssf n PHE 9 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1ssf h VAL 10 N 0.75 0.61 -0.70 -4.37 2.07 -1.85 -1.85 116.25 110.91 1ssf h VAL 10 Ca 0.47 -0.03 -0.45 0.00 0.82 0.00 0.00 66.70 67.51 1ssf h VAL 10 Cb 2.30 0.53 -0.42 0.00 -1.52 0.00 0.00 31.29 32.18 1ssf h VAL 10 CO 0.83 0.01 -0.92 0.61 0.02 0.00 0.00 177.57 178.13 1ssf n GLY 11 N -1.66 4.84 3.85 2.17 0.00 -1.26 -4.15 105.19 108.98 1ssf n GLY 11 Ca 0.17 -2.15 -0.30 0.00 0.00 0.00 0.00 46.02 43.74 1ssf n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ssf s LEU 12 N -3.65 2.80 -0.10 0.99 0.20 -0.70 -4.82 118.68 113.41 1ssf s LEU 12 Ca 0.43 1.24 0.04 0.00 0.69 0.00 0.00 54.13 56.52 1ssf s LEU 12 Cb 0.38 -3.97 -0.00 0.00 -0.43 0.00 0.00 46.19 42.17 1ssf s LEU 12 CO 0.00 -1.58 -0.23 -0.13 -0.29 0.00 0.00 176.35 174.12 1ssf s ARG 13 N -5.26 3.03 0.24 1.98 0.52 -1.26 -1.42 118.95 116.80 1ssf s ARG 13 Ca 0.59 -0.87 0.04 0.00 -0.52 0.00 0.00 55.73 54.97 1ssf s ARG 13 Cb -0.12 -2.31 -0.05 0.00 0.52 0.00 0.00 34.95 32.98 1ssf s ARG 13 CO 0.53 0.20 0.01 0.14 0.02 0.00 0.00 175.30 176.20 1ssf s VAL 14 N 0.30 1.05 0.08 3.52 -7.23 -0.30 -0.58 120.40 117.24 1ssf s VAL 14 Ca -0.17 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.04 1ssf s VAL 14 Cb -0.17 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.33 1ssf s VAL 14 CO 0.08 -0.27 -0.19 0.68 -0.31 0.00 0.00 175.10 175.09 1ssf s VAL 15 N -3.41 1.56 -0.30 1.32 -7.23 -1.10 -1.99 120.40 109.24 1ssf s VAL 15 Ca 0.30 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 59.08 1ssf s VAL 15 Cb 0.06 -1.41 0.07 0.00 0.56 0.00 0.00 36.38 35.65 1ssf s VAL 15 CO 0.10 -0.03 -0.01 0.00 -0.31 0.00 0.00 175.10 174.85 1ssf s ALA 16 N -1.08 2.78 -0.38 1.32 0.00 0.22 -2.24 121.76 122.38 1ssf s ALA 16 Ca 0.05 -1.96 0.01 0.00 0.00 0.00 0.00 51.96 50.06 1ssf s ALA 16 Cb -0.10 -1.88 0.12 0.00 0.00 0.00 0.00 23.12 21.26 1ssf s ALA 16 CO 0.03 -1.37 0.16 -1.59 0.00 0.00 0.00 175.76 173.00 1ssf s LYS 17 N 1.14 1.11 0.12 0.00 -2.85 -0.18 -0.60 119.74 118.48 1ssf s LYS 17 Ca -0.03 -1.64 -0.14 0.00 -1.00 0.00 0.00 55.97 53.16 1ssf s LYS 17 Cb -0.20 -2.34 -0.03 0.00 -2.06 0.00 0.00 37.83 33.19 1ssf s LYS 17 CO -0.04 -1.06 1.53 -1.49 0.10 0.00 0.00 175.35 174.39 1ssf h TRP 18 N 7.38 0.83 -4.02 1.78 4.06 -1.94 -3.38 115.95 120.66 1ssf h TRP 18 Ca -0.07 -0.18 -0.46 0.00 2.06 0.00 0.00 58.89 60.25 1ssf h TRP 18 Cb 0.97 -0.20 -0.24 0.00 -1.00 0.00 0.00 29.16 28.69 1ssf h TRP 18 CO 0.43 0.87 -0.80 -1.12 -3.56 0.00 0.00 178.44 174.27 1ssf s SER 19 N -6.34 1.82 0.03 -3.49 0.01 -1.26 -4.96 113.70 99.51 1ssf s SER 19 Ca -0.13 -0.52 -0.30 0.00 1.31 0.00 0.00 55.95 56.31 1ssf s SER 19 Cb 0.10 -0.11 -0.06 0.00 0.21 0.00 0.00 66.02 66.16 1ssf s SER 19 CO 0.81 0.02 1.43 -0.44 0.41 0.00 0.00 173.24 175.48 1ssf s SER 20 N -1.34 6.81 -0.01 2.44 0.01 -1.26 -4.96 113.70 115.40 1ssf s SER 20 Ca 0.02 2.21 0.17 0.00 1.31 0.00 0.00 55.95 59.66 1ssf s SER 20 Cb -0.09 -2.57 -0.21 0.00 0.21 0.00 0.00 66.02 63.37 1ssf s SER 20 CO 0.02 -0.73 0.66 -3.20 0.41 0.00 0.00 173.24 170.40 1ssf n ASN 21 N 5.11 0.84 0.00 2.44 4.05 -1.26 -4.90 115.26 121.54 1ssf n ASN 21 Ca 0.13 -0.71 0.00 0.00 0.45 0.00 0.00 54.58 54.45 1ssf n ASN 21 Cb 0.43 1.17 0.00 0.00 1.23 0.00 0.00 39.78 42.61 1ssf n ASN 21 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1ssf n GLY 22 N 1.42 2.83 3.24 8.20 0.00 -1.26 -5.05 105.19 114.57 1ssf n GLY 22 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 1ssf n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ssf s TYR 23 N -2.51 1.22 0.13 1.61 1.51 -1.26 -0.79 117.35 117.26 1ssf s TYR 23 Ca 0.00 -1.16 0.10 0.00 -1.01 0.00 0.00 57.07 55.00 1ssf s TYR 23 Cb 0.00 -0.69 -0.04 0.00 -0.11 0.00 0.00 41.96 41.12 1ssf s TYR 23 CO 0.00 -0.37 -0.23 -0.06 -1.11 0.00 0.00 175.55 173.78 1ssf s PHE 24 N -3.83 2.40 0.22 2.71 0.08 0.16 -4.86 117.98 114.85 1ssf s PHE 24 Ca 0.30 -0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.02 1ssf s PHE 24 Cb 0.07 -1.29 0.04 0.00 -0.57 0.00 0.00 43.02 41.28 1ssf s PHE 24 CO 0.07 0.36 0.31 0.66 -0.10 0.00 0.00 175.22 176.52 1ssf n TYR 25 N 0.85 -3.22 -4.04 0.36 4.01 0.23 -2.73 117.16 112.62 1ssf n TYR 25 Ca -0.17 -0.55 -0.35 0.00 -0.16 0.00 0.00 57.90 56.67 1ssf n TYR 25 Cb 0.53 -0.22 -0.13 0.00 -0.31 0.00 0.00 39.34 39.20 1ssf n TYR 25 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1ssf s SER 26 N -2.25 4.51 0.14 7.72 0.15 -1.26 -0.61 113.70 122.09 1ssf s SER 26 Ca 0.20 -0.31 -0.01 0.00 0.70 0.00 0.00 55.95 56.54 1ssf s SER 26 Cb -0.01 -1.77 -0.04 0.00 -1.71 0.00 0.00 66.02 62.49 1ssf s SER 26 CO 0.14 0.03 0.05 -0.83 1.20 0.00 0.00 173.24 173.82 1ssf s GLY 27 N 1.20 1.02 0.04 9.45 0.00 -0.84 -4.14 107.32 114.04 1ssf s GLY 27 Ca 0.03 -1.49 0.08 0.00 0.00 0.00 0.00 44.72 43.35 1ssf s GLY 27 CO -0.00 -1.39 -0.24 0.54 0.00 0.00 0.00 173.10 172.01 1ssf s LYS 28 N -4.03 1.65 0.33 2.90 1.02 0.08 -1.14 119.74 120.55 1ssf s LYS 28 Ca 0.24 -1.03 -0.11 0.00 0.02 0.00 0.00 55.97 55.09 1ssf s LYS 28 Cb 0.07 -1.79 -0.07 0.00 -0.52 0.00 0.00 37.83 35.52 1ssf s LYS 28 CO 0.02 0.46 0.69 0.42 -0.92 0.00 0.00 175.35 176.02 1ssf s ILE 29 N -0.79 4.81 -0.07 2.17 -1.09 -0.50 -0.85 121.20 124.88 1ssf s ILE 29 Ca 0.10 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 1ssf s ILE 29 Cb -0.09 -3.68 -0.05 0.00 -1.58 0.00 0.00 42.46 37.06 1ssf s ILE 29 CO 0.02 -0.32 -0.06 0.41 -1.23 0.00 0.00 174.94 173.75 1ssf n THR 30 N -0.79 0.41 -3.91 2.92 -1.04 -0.06 -4.36 114.28 107.45 1ssf n THR 30 Ca 0.02 -0.15 -0.08 0.00 -2.04 0.00 0.00 64.05 61.79 1ssf n THR 30 Cb 0.53 -0.77 -0.02 0.00 -1.82 0.00 0.00 70.33 68.25 1ssf n THR 30 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ssf s ARG 31 N -2.14 1.80 0.27 -2.82 0.52 -0.65 -4.25 118.95 111.68 1ssf s ARG 31 Ca -0.10 -1.19 -0.00 0.00 -0.52 0.00 0.00 55.73 53.92 1ssf s ARG 31 Cb 0.02 0.56 -0.04 0.00 0.52 0.00 0.00 34.95 36.02 1ssf s ARG 31 CO 0.16 -0.81 0.47 0.16 0.02 0.00 0.00 175.30 175.31 1ssf s ASP 32 N -2.99 6.35 -0.16 0.23 -4.77 -1.26 -0.77 116.67 113.30 1ssf s ASP 32 Ca 0.16 0.43 0.01 0.00 -3.30 0.00 0.00 52.55 49.86 1ssf s ASP 32 Cb -0.04 -2.02 0.02 0.00 -1.09 0.00 0.00 42.92 39.79 1ssf s ASP 32 CO 0.09 -0.16 -0.19 0.68 0.70 0.00 0.00 175.17 176.29 1ssf s VAL 33 N -2.07 1.94 0.00 2.11 -7.23 -0.79 -4.60 120.40 109.75 1ssf s VAL 33 Ca 0.39 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1ssf s VAL 33 Cb -0.10 -1.75 0.00 0.00 0.56 0.00 0.00 36.38 35.08 1ssf s VAL 33 CO 0.32 0.52 0.00 0.61 -0.31 0.00 0.00 175.10 176.24 1ssf n GLY 34 N 4.55 2.22 3.48 2.32 0.00 -1.26 -2.18 105.19 114.32 1ssf n GLY 34 Ca -0.20 -0.15 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 1ssf n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ssf s ALA 35 N -1.22 3.16 0.00 4.61 0.00 -1.26 -4.61 121.76 122.44 1ssf s ALA 35 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1ssf s ALA 35 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 23.12 21.17 1ssf s ALA 35 CO 0.00 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1ssf n GLY 36 N 4.46 1.41 3.61 0.00 0.00 -1.26 -5.05 105.19 108.35 1ssf n GLY 36 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1ssf n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ssf s LYS 37 N -0.77 1.99 0.04 1.61 1.02 -0.93 0.51 119.74 123.21 1ssf s LYS 37 Ca 0.00 -1.87 0.02 0.00 0.02 0.00 0.00 55.97 54.14 1ssf s LYS 37 Cb 0.00 -1.82 -0.02 0.00 -0.52 0.00 0.00 37.83 35.47 1ssf s LYS 37 CO 0.00 0.09 -0.08 0.71 -0.92 0.00 0.00 175.35 175.15 1ssf s TYR 38 N -2.58 0.67 -0.29 3.18 2.02 -0.28 -1.89 117.35 118.17 1ssf s TYR 38 Ca 0.35 -0.43 -0.01 0.00 -0.37 0.00 0.00 57.07 56.60 1ssf s TYR 38 Cb 0.03 -0.40 0.05 0.00 -0.40 0.00 0.00 41.96 41.24 1ssf s TYR 38 CO 0.19 -0.07 -0.02 0.21 -1.57 0.00 0.00 175.55 174.29 1ssf s LYS 39 N -1.36 2.39 0.10 -0.62 2.47 0.05 -1.20 119.74 121.58 1ssf s LYS 39 Ca -0.08 -1.28 0.03 0.00 -1.56 0.00 0.00 55.97 53.08 1ssf s LYS 39 Cb -0.09 -3.13 -0.04 0.00 -1.46 0.00 0.00 37.83 33.11 1ssf s LYS 39 CO 0.00 -0.61 -0.09 -0.48 0.16 0.00 0.00 175.35 174.33 1ssf s LEU 40 N 1.23 2.45 -0.02 5.43 -0.00 -0.84 -0.88 118.68 126.04 1ssf s LEU 40 Ca -0.06 -0.89 0.04 0.00 -0.00 0.00 0.00 54.13 53.22 1ssf s LEU 40 Cb -0.20 -0.21 -0.01 0.00 -0.00 0.00 0.00 46.19 45.77 1ssf s LEU 40 CO -0.02 -0.34 -0.12 -0.22 -0.00 0.00 0.00 176.35 175.65 1ssf s LEU 41 N -2.68 1.96 0.49 1.48 0.20 -0.03 -1.80 118.68 118.31 1ssf s LEU 41 Ca 0.08 -0.23 -0.21 0.00 0.69 0.00 0.00 54.13 54.46 1ssf s LEU 41 Cb 0.00 -0.66 -0.07 0.00 -0.43 0.00 0.00 46.19 45.03 1ssf s LEU 41 CO -0.02 0.14 1.09 -0.36 -0.29 0.00 0.00 176.35 176.91 1ssf s PHE 42 N -0.16 2.89 0.56 5.38 0.40 -0.07 -0.75 117.98 126.22 1ssf s PHE 42 Ca 0.02 1.57 0.26 0.00 -0.60 0.00 0.00 56.93 58.18 1ssf s PHE 42 Cb -0.06 -3.21 1.43 0.00 0.51 0.00 0.00 43.02 41.69 1ssf s PHE 42 CO -0.00 -1.19 1.79 -0.44 0.70 0.00 0.00 175.22 176.08 1ssf h ASP 43 N 1.62 0.00 0.02 1.36 5.19 -1.88 0.48 116.42 123.21 1ssf h ASP 43 Ca -0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 1ssf h ASP 43 Cb 1.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1ssf h ASP 43 CO 0.59 0.00 -0.38 -0.90 -3.12 0.00 0.00 179.24 175.43 1ssf n ASP 44 N -2.74 1.97 0.00 6.45 5.68 -1.26 -5.02 116.55 121.63 1ssf n ASP 44 Ca -0.02 -1.48 0.00 0.00 -0.50 0.00 0.00 54.79 52.80 1ssf n ASP 44 Cb 0.39 0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.73 1ssf n ASP 44 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ssf n GLY 45 N 1.39 1.11 3.45 6.12 0.00 0.17 -5.09 105.19 112.34 1ssf n GLY 45 Ca 0.10 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.69 1ssf n GLY 45 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ssf s TYR 46 N -2.00 3.08 0.10 1.61 6.14 -1.25 -4.84 117.35 120.19 1ssf s TYR 46 Ca 0.00 -0.49 0.03 0.00 0.64 0.00 0.00 57.07 57.24 1ssf s TYR 46 Cb 0.00 -3.39 -0.04 0.00 0.42 0.00 0.00 41.96 38.95 1ssf s TYR 46 CO 0.00 -0.95 0.14 -2.00 0.64 0.00 0.00 175.55 173.38 1ssf s GLU 47 N 2.50 3.06 0.24 4.97 -6.30 -1.26 -0.89 118.70 121.01 1ssf s GLU 47 Ca 0.15 -0.67 -0.21 0.00 -2.50 0.00 0.00 54.97 51.74 1ssf s GLU 47 Cb -0.19 -2.80 0.07 0.00 0.00 0.00 0.00 34.13 31.21 1ssf s GLU 47 CO 0.12 0.55 0.96 0.00 0.02 0.00 0.00 175.26 176.92 1ssf s ASP 49 N -3.27 2.38 0.19 0.00 1.11 -1.26 -1.99 116.67 113.83 1ssf s ASP 49 Ca 0.19 -0.37 -0.09 0.00 0.18 0.00 0.00 52.55 52.46 1ssf s ASP 49 Cb -0.03 -0.26 -0.01 0.00 1.07 0.00 0.00 42.92 43.68 1ssf s ASP 49 CO 0.07 0.25 0.31 0.68 1.18 0.00 0.00 175.17 177.66 1ssf s VAL 50 N -0.49 0.04 0.43 -1.27 -7.23 -0.34 -5.00 120.40 106.54 1ssf s VAL 50 Ca 0.08 -1.47 -0.19 0.00 -1.81 0.00 0.00 61.98 58.59 1ssf s VAL 50 Cb -0.08 -2.02 -0.10 0.00 0.56 0.00 0.00 36.38 34.74 1ssf s VAL 50 CO -0.01 -0.18 0.92 -0.22 -0.31 0.00 0.00 175.10 175.30 1ssf s LEU 51 N -3.01 3.89 0.00 1.32 1.98 -1.26 -1.12 118.68 120.48 1ssf s LEU 51 Ca 0.21 1.58 0.17 0.00 -2.89 0.00 0.00 54.13 53.20 1ssf s LEU 51 Cb 0.03 -4.44 0.86 0.00 0.66 0.00 0.00 46.19 43.30 1ssf s LEU 51 CO 0.04 -0.38 1.57 0.61 -1.89 0.00 0.00 176.35 176.30 1ssf n GLY 52 N -0.81 -0.60 0.90 7.98 0.00 0.18 -1.24 105.19 111.60 1ssf n GLY 52 Ca 0.06 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1ssf n GLY 52 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ssf n LYS 53 N -0.42 2.83 0.00 1.61 0.00 -1.26 -4.31 118.16 116.60 1ssf n LYS 53 Ca 0.13 -2.28 0.00 0.00 -0.00 0.00 0.00 58.31 56.16 1ssf n LYS 53 Cb 0.13 -1.38 0.00 0.00 -0.00 0.00 0.00 35.03 33.79 1ssf n LYS 53 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ssf n ASP 54 N 0.92 0.00 -4.10 -5.58 8.00 -0.37 -4.86 116.55 110.57 1ssf n ASP 54 Ca 0.16 0.00 -0.35 0.00 0.71 0.00 0.00 54.79 55.31 1ssf n ASP 54 Cb 0.50 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.48 1ssf n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ssf s ILE 55 N 0.00 3.13 0.11 0.53 -1.09 -1.14 -1.01 121.20 121.73 1ssf s ILE 55 Ca 0.00 -2.19 0.03 0.00 -2.23 0.00 0.00 60.65 56.26 1ssf s ILE 55 Cb 0.00 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 1ssf s ILE 55 CO 0.00 -0.69 -0.09 -1.48 -1.23 0.00 0.00 174.94 171.45 1ssf s LEU 56 N 0.99 2.47 -0.64 2.97 -0.00 -0.95 -4.61 118.68 118.91 1ssf s LEU 56 Ca 0.09 -0.92 -0.29 0.00 -0.00 0.00 0.00 54.13 53.01 1ssf s LEU 56 Cb -0.22 -0.21 -0.13 0.00 -0.00 0.00 0.00 46.19 45.63 1ssf s LEU 56 CO -0.05 -0.36 2.48 0.00 -0.00 0.00 0.00 176.35 178.43 1ssf n LEU 57 N 0.20 1.58 -4.59 1.48 -0.00 -1.26 -2.70 117.00 111.71 1ssf n LEU 57 Ca -0.14 -0.11 -0.27 0.00 -0.00 0.00 0.00 56.01 55.49 1ssf n LEU 57 Cb 0.59 -1.30 -0.09 0.00 -0.00 0.00 0.00 43.42 42.62 1ssf n LEU 57 CO 0.29 -1.13 -0.25 0.00 -0.00 0.00 0.00 177.39 176.30 1ssf h ASP 59 N 1.74 0.38 0.00 0.00 1.82 -1.84 -3.34 116.42 115.18 1ssf h ASP 59 Ca -0.41 -0.54 0.00 0.00 -0.39 0.00 0.00 57.03 55.69 1ssf h ASP 59 Cb 1.27 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.17 1ssf h ASP 59 CO 0.70 0.85 0.00 -0.81 -1.61 0.00 0.00 179.24 178.36 1ssf n PRO 60 N -4.52 0.00 -4.35 0.28 -0.04 -1.26 -4.80 135.00 120.31 1ssf n PRO 60 Ca -0.07 0.38 -0.20 0.00 -0.04 0.00 0.00 63.50 63.57 1ssf n PRO 60 Cb 0.41 -1.24 -0.10 0.00 -0.04 0.00 0.00 33.50 32.53 1ssf n PRO 60 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ssf s ILE 61 N -1.96 1.82 -0.11 0.52 1.01 -1.26 -5.02 121.20 116.19 1ssf s ILE 61 Ca 0.00 -2.17 -0.35 0.00 0.00 0.00 0.00 60.65 58.13 1ssf s ILE 61 Cb 0.00 -2.02 -0.13 0.00 0.01 0.00 0.00 42.46 40.32 1ssf s ILE 61 CO 0.00 -0.52 1.83 -2.65 0.00 0.00 0.00 174.94 173.60 1ssf n PRO 62 N -0.26 1.96 0.00 2.79 -0.02 -1.26 -4.82 135.00 133.39 1ssf n PRO 62 Ca -0.09 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ssf n PRO 62 Cb 0.60 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1ssf n PRO 62 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ssf n LEU 63 N 6.17 0.00 -0.37 2.45 4.32 -1.26 -0.20 117.00 128.12 1ssf n LEU 63 Ca 0.23 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 56.23 1ssf n LEU 63 Cb 0.26 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.07 1ssf n LEU 63 CO 0.74 0.00 0.27 0.47 -1.22 0.00 0.00 177.39 177.65 1ssf n ASP 64 N -0.00 0.17 -4.21 -1.43 8.00 -0.88 -4.18 116.55 114.03 1ssf n ASP 64 Ca 0.00 -1.88 -0.35 0.00 0.71 0.00 0.00 54.79 53.27 1ssf n ASP 64 Cb 0.00 -0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 40.78 1ssf n ASP 64 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ssf s THR 65 N -0.19 2.95 -0.78 -3.53 2.01 0.72 -4.91 115.64 111.90 1ssf s THR 65 Ca 0.02 -1.04 -0.25 0.00 0.31 0.00 0.00 61.69 60.73 1ssf s THR 65 Cb 0.02 -2.52 -0.07 0.00 0.01 0.00 0.00 72.50 69.94 1ssf s THR 65 CO 0.00 0.16 2.11 -1.61 -0.69 0.00 0.00 174.62 174.60 1ssf s GLU 66 N 1.33 2.24 0.48 4.92 2.02 -1.26 -0.55 118.70 127.89 1ssf s GLU 66 Ca -0.00 0.26 0.07 0.00 0.02 0.00 0.00 54.97 55.32 1ssf s GLU 66 Cb -0.17 -4.82 0.04 0.00 0.10 0.00 0.00 34.13 29.28 1ssf s GLU 66 CO -0.04 -3.57 0.66 0.08 0.02 0.00 0.00 175.26 172.41 1ssf s VAL 67 N 11.51 2.72 -0.11 2.63 1.01 0.43 -4.72 120.40 133.87 1ssf s VAL 67 Ca 0.79 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 61.74 1ssf s VAL 67 Cb -0.11 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 1ssf s VAL 67 CO 0.08 0.00 0.18 0.28 0.00 0.00 0.00 175.10 175.64 1ssf s THR 68 N -2.50 5.43 -0.07 3.92 -1.32 -1.01 -0.85 115.64 119.24 1ssf s THR 68 Ca 0.57 0.30 -0.01 0.00 -1.21 0.00 0.00 61.69 61.35 1ssf s THR 68 Cb -0.09 -3.45 -0.03 0.00 -1.51 0.00 0.00 72.50 67.41 1ssf s THR 68 CO 0.35 0.60 -0.01 0.00 -2.21 0.00 0.00 174.62 173.36 1ssf s ALA 69 N -0.90 3.26 -0.38 11.08 0.00 0.28 -1.22 121.76 133.88 1ssf s ALA 69 Ca 0.16 -0.83 -0.28 0.00 0.00 0.00 0.00 51.96 51.01 1ssf s ALA 69 Cb -0.13 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 1ssf s ALA 69 CO 0.05 0.60 1.97 -1.17 0.00 0.00 0.00 175.76 177.20 1ssf s LEU 70 N -0.97 3.44 0.19 0.00 1.98 0.10 -3.67 118.68 119.75 1ssf s LEU 70 Ca 0.14 1.22 -0.01 0.00 -2.89 0.00 0.00 54.13 52.59 1ssf s LEU 70 Cb -0.11 -3.21 -0.04 0.00 0.66 0.00 0.00 46.19 43.49 1ssf s LEU 70 CO 0.03 -2.03 0.11 -0.44 -1.89 0.00 0.00 176.35 172.13 1ssf s SER 71 N 7.67 0.27 0.89 3.68 0.01 -1.26 -5.05 113.70 119.90 1ssf s SER 71 Ca 0.84 -1.35 -0.16 0.00 1.31 0.00 0.00 55.95 56.60 1ssf s SER 71 Cb -0.22 0.34 -0.14 0.00 0.21 0.00 0.00 66.02 66.21 1ssf s SER 71 CO 0.31 -0.80 -0.70 -1.84 0.41 0.00 0.00 173.24 170.61 1ssf n GLU 72 N -0.24 0.00 -0.26 12.44 0.00 -1.26 -4.17 120.64 127.15 1ssf n GLU 72 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 57.16 57.17 1ssf n GLU 72 Cb 0.65 -0.93 0.09 0.00 0.00 0.00 0.00 31.44 31.25 1ssf n GLU 72 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 1ssf h ASP 73 N -0.85 -0.74 -0.14 -1.84 3.58 -2.01 0.11 116.42 114.53 1ssf h ASP 73 Ca -0.41 0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.27 1ssf h ASP 73 Cb 1.21 0.48 0.00 0.00 1.72 0.00 0.00 39.33 42.74 1ssf h ASP 73 CO 0.23 -0.25 0.00 1.21 -2.88 0.00 0.00 179.24 177.54 1ssf n GLU 74 N -5.50 1.42 -0.00 0.28 4.07 -1.26 -4.72 120.64 114.94 1ssf n GLU 74 Ca 0.10 -1.50 0.02 0.00 -0.06 0.00 0.00 57.16 55.72 1ssf n GLU 74 Cb 0.39 -1.24 -0.03 0.00 -0.06 0.00 0.00 31.44 30.50 1ssf n GLU 74 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1ssf n TYR 75 N 0.59 0.00 -1.16 4.31 4.01 -0.62 -5.05 117.16 119.23 1ssf n TYR 75 Ca 0.08 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.48 1ssf n TYR 75 Cb 0.34 -0.05 0.09 0.00 -0.31 0.00 0.00 39.34 39.41 1ssf n TYR 75 CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 1ssf n PHE 76 N -1.36 -0.16 -4.12 -0.72 1.16 0.29 -4.83 117.46 107.71 1ssf n PHE 76 Ca 0.00 0.35 -0.09 0.00 -1.87 0.00 0.00 57.45 55.84 1ssf n PHE 76 Cb 0.08 -1.97 -0.10 0.00 -1.61 0.00 0.00 39.48 35.88 1ssf n PHE 76 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1ssf s SER 77 N -1.74 0.77 0.37 5.98 0.15 -1.24 -4.94 113.70 113.04 1ssf s SER 77 Ca 0.67 -0.98 -0.16 0.00 0.70 0.00 0.00 55.95 56.19 1ssf s SER 77 Cb -0.31 0.15 -0.09 0.00 -1.71 0.00 0.00 66.02 64.06 1ssf s SER 77 CO 0.57 -0.53 0.80 0.00 1.20 0.00 0.00 173.24 175.28 1ssf s ALA 78 N -3.68 3.25 0.19 5.45 0.00 -1.26 -0.56 121.76 125.16 1ssf s ALA 78 Ca 0.08 0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.91 1ssf s ALA 78 Cb 0.06 -2.86 0.05 0.00 0.00 0.00 0.00 23.12 20.37 1ssf s ALA 78 CO -0.07 0.21 0.60 0.20 0.00 0.00 0.00 175.76 176.70 1ssf s GLY 79 N -2.44 -0.40 -0.30 0.00 0.00 -0.03 -4.90 107.32 99.26 1ssf s GLY 79 Ca 0.56 0.18 -0.11 0.00 0.00 0.00 0.00 44.72 45.35 1ssf s GLY 79 CO 0.19 0.01 0.18 0.14 0.00 0.00 0.00 173.10 173.63 1ssf s VAL 80 N -3.81 5.05 0.18 1.40 1.01 0.04 -0.43 120.40 123.84 1ssf s VAL 80 Ca 0.05 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1ssf s VAL 80 Cb -0.02 -3.48 -0.09 0.00 0.00 0.00 0.00 36.38 32.80 1ssf s VAL 80 CO -0.07 0.17 1.34 0.54 0.00 0.00 0.00 175.10 177.07 1ssf s VAL 81 N 1.71 3.20 0.00 2.92 0.11 0.29 0.11 120.40 128.73 1ssf s VAL 81 Ca 0.06 0.96 0.00 0.00 -2.93 0.00 0.00 61.98 60.07 1ssf s VAL 81 Cb -0.16 -3.61 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 1ssf s VAL 81 CO 0.09 0.13 0.00 0.29 -3.33 0.00 0.00 175.10 172.28 1ssf n LYS 82 N 2.94 0.00 -3.92 1.54 5.02 -1.06 -2.06 118.16 120.62 1ssf n LYS 82 Ca 0.07 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.23 1ssf n LYS 82 Cb 0.42 -0.55 -0.15 0.00 -0.02 0.00 0.00 35.03 34.74 1ssf n LYS 82 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1ssf s GLY 83 N -3.48 0.08 0.20 0.72 0.00 -1.25 -4.71 107.32 98.88 1ssf s GLY 83 Ca 0.00 0.01 -0.14 0.00 0.00 0.00 0.00 44.72 44.60 1ssf s GLY 83 CO 0.00 0.10 0.44 -2.38 0.00 0.00 0.00 173.10 171.26 1ssf s HIS 84 N 0.20 0.18 0.19 1.90 -3.43 -1.26 -1.66 115.29 111.41 1ssf s HIS 84 Ca -0.02 -0.54 -0.18 0.00 -0.80 0.00 0.00 55.06 53.52 1ssf s HIS 84 Cb -0.03 0.20 0.03 0.00 -1.43 0.00 0.00 32.58 31.35 1ssf s HIS 84 CO -0.01 -0.89 0.53 -0.98 -2.00 0.00 0.00 174.74 171.40 1ssf s ARG 85 N -3.95 1.36 -0.01 -0.38 1.04 -0.40 -5.03 118.95 111.59 1ssf s ARG 85 Ca 0.16 -0.81 0.01 0.00 -1.04 0.00 0.00 55.73 54.04 1ssf s ARG 85 Cb 0.00 0.53 0.00 0.00 -2.04 0.00 0.00 34.95 33.44 1ssf s ARG 85 CO 0.02 -0.58 -0.03 0.21 -0.04 0.00 0.00 175.30 174.88 1ssf s LYS 86 N -3.86 0.28 0.29 3.89 2.36 -1.26 -2.66 119.74 118.78 1ssf s LYS 86 Ca 0.08 -0.09 0.12 0.00 -2.55 0.00 0.00 55.97 53.52 1ssf s LYS 86 Cb -0.01 -0.29 -0.05 0.00 -1.05 0.00 0.00 37.83 36.42 1ssf s LYS 86 CO -0.04 0.04 -0.18 -2.00 1.55 0.00 0.00 175.35 174.72 1ssf s GLU 87 N 0.07 1.73 0.00 4.03 -6.30 -0.30 -5.03 118.70 112.90 1ssf s GLU 87 Ca -0.00 -1.77 -0.18 0.00 -2.50 0.00 0.00 54.97 50.52 1ssf s GLU 87 Cb -0.03 -1.78 -0.22 0.00 0.00 0.00 0.00 34.13 32.10 1ssf s GLU 87 CO -0.00 0.31 1.30 0.43 0.02 0.00 0.00 175.26 177.31 1ssf n SER 88 N -0.65 0.54 0.00 -1.70 7.64 -1.26 -1.94 113.62 116.24 1ssf n SER 88 Ca -0.05 -2.20 0.00 0.00 1.01 0.00 0.00 58.87 57.63 1ssf n SER 88 Cb 0.60 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1ssf n SER 88 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ssf n GLY 89 N 4.52 1.11 3.13 0.23 0.00 -1.26 -5.12 105.19 107.80 1ssf n GLY 89 Ca 0.27 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 1ssf n GLY 89 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ssf s GLU 90 N -0.20 1.41 -0.04 1.61 0.41 -0.82 -5.13 118.70 115.95 1ssf s GLU 90 Ca 0.00 -0.57 0.05 0.00 -0.41 0.00 0.00 54.97 54.04 1ssf s GLU 90 Cb 0.00 -1.32 -0.01 0.00 -1.78 0.00 0.00 34.13 31.02 1ssf s GLU 90 CO 0.00 0.31 -0.20 -1.17 -0.49 0.00 0.00 175.26 173.71 1ssf s LEU 91 N -0.24 1.99 -0.09 1.80 1.98 -1.26 -1.15 118.68 121.70 1ssf s LEU 91 Ca 0.03 -0.40 -0.00 0.00 -2.89 0.00 0.00 54.13 50.86 1ssf s LEU 91 Cb -0.08 -1.11 0.02 0.00 0.66 0.00 0.00 46.19 45.69 1ssf s LEU 91 CO 0.00 0.20 -0.05 -0.31 -1.89 0.00 0.00 176.35 174.31 1ssf s TYR 92 N -0.15 1.14 -0.20 5.38 2.02 -1.09 -3.78 117.35 120.68 1ssf s TYR 92 Ca -0.01 -0.48 0.01 0.00 -0.37 0.00 0.00 57.07 56.22 1ssf s TYR 92 Cb -0.11 -1.02 0.03 0.00 -0.40 0.00 0.00 41.96 40.45 1ssf s TYR 92 CO 0.02 -0.41 -0.18 -0.47 -1.57 0.00 0.00 175.55 172.94 1ssf s TYR 93 N 1.66 2.88 -0.23 2.71 5.04 0.07 -1.27 117.35 128.20 1ssf s TYR 93 Ca 0.02 -1.78 -0.11 0.00 -2.44 0.00 0.00 57.07 52.76 1ssf s TYR 93 Cb -0.13 -1.92 -0.05 0.00 0.35 0.00 0.00 41.96 40.21 1ssf s TYR 93 CO -0.06 -0.82 0.19 0.45 -1.34 0.00 0.00 175.55 173.97 1ssf s SER 94 N 1.25 6.18 -0.06 4.32 0.15 -0.66 -2.60 113.70 122.27 1ssf s SER 94 Ca 0.02 0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.89 1ssf s SER 94 Cb -0.14 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.05 1ssf s SER 94 CO -0.11 0.07 -0.16 0.27 1.20 0.00 0.00 173.24 174.50 1ssf s ILE 95 N 0.97 1.43 -0.30 6.45 -0.00 -0.54 -2.57 121.20 126.65 1ssf s ILE 95 Ca 0.09 -0.68 -0.12 0.00 -0.00 0.00 0.00 60.65 59.94 1ssf s ILE 95 Cb -0.13 -1.26 -0.04 0.00 -0.00 0.00 0.00 42.46 41.03 1ssf s ILE 95 CO 0.04 0.42 0.22 -0.70 -0.00 0.00 0.00 174.94 174.92 1ssf s GLU 96 N 0.35 3.81 -0.07 0.37 2.12 0.12 -0.60 118.70 124.80 1ssf s GLU 96 Ca -0.11 -0.39 -0.05 0.00 0.36 0.00 0.00 54.97 54.78 1ssf s GLU 96 Cb -0.15 -3.71 0.03 0.00 0.26 0.00 0.00 34.13 30.57 1ssf s GLU 96 CO 0.04 -0.27 0.17 0.21 -0.54 0.00 0.00 175.26 174.87 1ssf s LYS 97 N 1.78 0.16 0.00 4.30 2.47 0.23 -0.78 119.74 127.90 1ssf s LYS 97 Ca 0.07 0.34 0.00 0.00 -1.56 0.00 0.00 55.97 54.82 1ssf s LYS 97 Cb -0.16 -0.05 0.00 0.00 -1.46 0.00 0.00 37.83 36.16 1ssf s LYS 97 CO 0.11 -0.10 0.00 0.39 0.16 0.00 0.00 175.35 175.91 1ssf n GLU 98 N 3.68 -0.49 0.00 4.03 -0.58 -1.26 -1.24 120.64 124.79 1ssf n GLU 98 Ca -0.20 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1ssf n GLU 98 Cb 0.55 -4.04 0.00 0.00 -0.57 0.00 0.00 31.44 27.38 1ssf n GLU 98 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ssf n GLY 99 N -1.38 1.19 3.68 0.62 0.00 -1.26 -5.10 105.19 102.94 1ssf n GLY 99 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1ssf n GLY 99 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ssf s GLN 100 N -0.33 2.09 -0.03 1.61 1.03 -0.37 -5.14 119.66 118.52 1ssf s GLN 100 Ca 0.00 -2.00 -0.10 0.00 0.04 0.00 0.00 55.36 53.31 1ssf s GLN 100 Cb 0.00 -1.80 -0.05 0.00 0.03 0.00 0.00 33.01 31.19 1ssf s GLN 100 CO 0.00 -0.09 0.28 0.50 -2.54 0.00 0.00 175.29 173.44 1ssf s ARG 101 N -3.81 3.66 -0.17 9.60 6.06 -1.26 0.74 118.95 133.77 1ssf s ARG 101 Ca 0.37 0.08 0.01 0.00 -2.50 0.00 0.00 55.73 53.69 1ssf s ARG 101 Cb 0.07 -3.16 0.02 0.00 0.06 0.00 0.00 34.95 31.94 1ssf s ARG 101 CO 0.20 0.70 -0.18 0.15 -2.50 0.00 0.00 175.30 173.66 1ssf s LYS 102 N -1.31 2.80 -0.21 5.12 1.02 0.23 -4.91 119.74 122.48 1ssf s LYS 102 Ca 0.23 -0.75 -0.04 0.00 0.02 0.00 0.00 55.97 55.42 1ssf s LYS 102 Cb -0.14 -2.43 -0.01 0.00 -0.52 0.00 0.00 37.83 34.73 1ssf s LYS 102 CO 0.11 -0.21 -0.05 -1.58 -0.92 0.00 0.00 175.35 172.71 1ssf s TRP 103 N 1.32 2.95 0.39 3.18 0.23 -1.26 -1.46 118.94 124.29 1ssf s TRP 103 Ca 0.04 -0.87 0.04 0.00 -2.03 0.00 0.00 56.10 53.28 1ssf s TRP 103 Cb -0.13 -2.08 -0.03 0.00 0.03 0.00 0.00 33.47 31.26 1ssf s TRP 103 CO -0.12 -0.49 0.11 0.71 0.96 0.00 0.00 176.95 178.12 1ssf s TYR 104 N 1.34 1.82 0.17 -1.98 2.02 -1.07 -5.03 117.35 114.62 1ssf s TYR 104 Ca 0.04 -1.20 0.04 0.00 -0.37 0.00 0.00 57.07 55.58 1ssf s TYR 104 Cb -0.14 -1.21 -0.04 0.00 -0.40 0.00 0.00 41.96 40.18 1ssf s TYR 104 CO -0.02 -0.20 0.25 -1.59 -1.57 0.00 0.00 175.55 172.41 1ssf s LYS 105 N -3.76 3.26 0.28 -0.62 -2.85 -1.25 -0.75 119.74 114.05 1ssf s LYS 105 Ca 0.26 -0.72 0.22 0.00 -1.00 0.00 0.00 55.97 54.72 1ssf s LYS 105 Cb 0.04 -2.84 0.92 0.00 -2.06 0.00 0.00 37.83 33.88 1ssf s LYS 105 CO 0.14 0.49 0.92 0.54 0.10 0.00 0.00 175.35 177.54 1ssf n ARG 106 N -0.66 -0.02 0.30 1.78 5.12 -1.26 -2.67 116.66 119.24 1ssf n ARG 106 Ca -0.08 0.72 0.19 0.00 -1.93 0.00 0.00 57.85 56.75 1ssf n ARG 106 Cb 0.55 -1.46 0.92 0.00 -1.16 0.00 0.00 32.46 31.30 1ssf n ARG 106 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ssf h MET 107 N 0.00 0.00 -0.45 5.56 -0.00 -1.95 -2.74 114.93 115.36 1ssf h MET 107 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.23 1ssf h MET 107 Cb 1.82 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.42 1ssf h MET 107 CO -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.70 1ssf n ALA 108 N -2.06 2.37 -3.85 -3.00 0.00 -1.09 -4.85 120.51 108.03 1ssf n ALA 108 Ca -0.01 -1.08 -0.29 0.00 0.00 0.00 0.00 53.44 52.07 1ssf n ALA 108 Cb 0.19 -0.76 -0.17 0.00 0.00 0.00 0.00 19.45 18.71 1ssf n ALA 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ssf s VAL 109 N -1.21 1.41 0.33 0.00 -7.23 -1.03 -0.72 120.40 111.94 1ssf s VAL 109 Ca 0.37 -0.55 0.02 0.00 -1.81 0.00 0.00 61.98 60.00 1ssf s VAL 109 Cb 0.20 -1.33 -0.01 0.00 0.56 0.00 0.00 36.38 35.81 1ssf s VAL 109 CO 0.28 0.43 0.08 2.30 -0.31 0.00 0.00 175.10 177.88 1ssf n ILE 110 N 4.57 0.00 -3.79 -0.62 -0.00 -0.36 -4.79 119.36 114.38 1ssf n ILE 110 Ca -0.17 -1.80 -0.13 0.00 -0.00 0.00 0.00 62.75 60.65 1ssf n ILE 110 Cb 0.50 0.58 -0.09 0.00 -0.00 0.00 0.00 39.64 40.63 1ssf n ILE 110 CO 0.00 0.00 0.00 -1.48 -0.00 0.00 0.00 176.55 175.07 1ssf s LEU 111 N 0.00 1.05 0.53 7.28 0.05 -1.11 -2.40 118.68 124.09 1ssf s LEU 111 Ca 0.12 -0.02 -0.04 0.00 0.05 0.00 0.00 54.13 54.24 1ssf s LEU 111 Cb 0.01 1.11 -0.00 0.00 -2.05 0.00 0.00 46.19 45.25 1ssf s LEU 111 CO 0.08 -0.44 0.81 -0.94 -0.55 0.00 0.00 176.35 175.31 1ssf s SER 112 N -1.41 5.76 0.19 1.48 1.04 -1.26 0.37 113.70 119.87 1ssf s SER 112 Ca -0.13 0.60 -0.08 0.00 0.48 0.00 0.00 55.95 56.82 1ssf s SER 112 Cb -0.05 -1.72 0.10 0.00 0.10 0.00 0.00 66.02 64.44 1ssf s SER 112 CO 0.03 -0.88 1.64 -0.07 0.98 0.00 0.00 173.24 174.95 1ssf h LEU 113 N 0.07 1.01 -0.02 2.42 -0.00 -1.30 -0.79 115.31 116.69 1ssf h LEU 113 Ca -0.46 -0.30 0.00 0.00 -0.00 0.00 0.00 57.88 57.12 1ssf h LEU 113 Cb 1.25 -0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 1ssf h LEU 113 CO 0.60 1.08 0.00 -0.62 -0.00 0.00 0.00 178.44 179.50 1ssf n GLU 114 N -4.17 0.07 0.03 1.13 1.02 -1.26 0.14 120.64 117.61 1ssf n GLU 114 Ca 0.02 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.36 1ssf n GLU 114 Cb 0.36 -1.59 0.10 0.00 -0.02 0.00 0.00 31.44 30.30 1ssf n GLU 114 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1ssf n GLN 115 N -1.71 0.24 -0.10 3.49 6.02 -1.19 -3.88 117.38 120.25 1ssf n GLN 115 Ca 0.06 0.03 -0.24 0.00 -0.01 0.00 0.00 57.00 56.84 1ssf n GLN 115 Cb 0.35 -1.61 -0.12 0.00 1.02 0.00 0.00 30.24 29.88 1ssf n GLN 115 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ssf n GLY 116 N 1.38 -0.56 0.10 1.08 0.00 -0.31 -4.57 105.19 102.31 1ssf n GLY 116 Ca 0.03 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.07 1ssf n GLY 116 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ssf n ASN 117 N -3.94 0.64 0.24 1.61 3.02 0.37 -1.98 115.26 115.22 1ssf n ASN 117 Ca -0.42 0.60 0.13 0.00 -0.03 0.00 0.00 54.58 54.86 1ssf n ASN 117 Cb 0.88 -0.76 0.41 0.00 -0.61 0.00 0.00 39.78 39.71 1ssf n ASN 117 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 1ssf h ARG 118 N 0.00 0.00 0.09 3.52 -0.00 -1.74 -3.20 114.38 113.05 1ssf h ARG 118 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 59.98 59.61 1ssf h ARG 118 Cb 0.55 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 30.49 1ssf h ARG 118 CO 0.00 0.06 -2.09 -0.11 -0.00 0.00 0.00 179.97 177.83 1ssf n LEU 119 N -3.14 2.54 -0.35 0.08 0.00 -0.84 -4.64 117.00 110.66 1ssf n LEU 119 Ca 0.02 0.14 0.28 0.00 0.00 0.00 0.00 56.01 56.46 1ssf n LEU 119 Cb 0.44 -0.95 0.60 0.00 0.00 0.00 0.00 43.42 43.50 1ssf n LEU 119 CO 0.31 0.84 1.25 0.08 0.00 0.00 0.00 177.39 179.87 1ssf h ARG 120 N 0.05 0.23 0.00 1.96 0.11 -1.43 0.55 114.38 115.85 1ssf h ARG 120 Ca -0.45 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1ssf h ARG 120 Cb 2.01 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 33.04 1ssf h ARG 120 CO 0.05 0.15 -1.22 -0.85 0.10 0.00 0.00 179.97 178.20 1ssf n GLU 121 N -4.52 0.45 -0.10 0.08 0.28 -1.26 -1.94 120.64 113.64 1ssf n GLU 121 Ca 0.27 -0.01 -0.17 0.00 -0.16 0.00 0.00 57.16 57.09 1ssf n GLU 121 Cb 1.07 -1.64 -0.08 0.00 1.43 0.00 0.00 31.44 32.21 1ssf n GLU 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ssf n GLN 122 N -2.23 0.46 0.00 3.44 10.64 -0.03 -4.93 117.38 124.74 1ssf n GLN 122 Ca 0.00 0.15 0.00 0.00 -1.83 0.00 0.00 57.00 55.32 1ssf n GLN 122 Cb 0.50 -1.32 0.00 0.00 -0.86 0.00 0.00 30.24 28.55 1ssf n GLN 122 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1ssf n TYR 123 N -3.44 0.00 0.00 2.61 4.01 0.17 -5.07 117.16 115.44 1ssf n TYR 123 Ca -0.37 -0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.35 1ssf n TYR 123 Cb 0.83 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.86 1ssf n TYR 123 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ssf n GLY 124 N -0.02 -0.28 0.00 2.72 0.00 -1.24 -4.68 105.19 101.68 1ssf n GLY 124 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1ssf n GLY 124 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ssf n LEU 125 N 0.00 0.00 -3.21 0.99 7.99 -1.24 -4.12 117.00 117.41 1ssf n LEU 125 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 56.00 1ssf n LEU 125 Cb 0.00 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.29 1ssf n LEU 125 CO 0.00 0.00 0.07 -0.83 -1.51 0.00 0.00 177.39 175.12 1ssf s GLY 126 N -1.36 -1.14 -0.20 -0.72 0.00 -0.82 -4.57 107.32 98.51 1ssf s GLY 126 Ca 0.00 0.33 0.11 0.00 0.00 0.00 0.00 44.72 45.16 1ssf s GLY 126 CO 0.00 3.57 1.53 -1.55 0.00 0.00 0.00 173.10 176.65 1ssf n PRO 127 N 4.70 4.03 -3.69 2.90 -0.04 -1.26 -4.87 135.00 136.77 1ssf n PRO 127 Ca 0.09 -2.55 -0.37 0.00 -0.04 0.00 0.00 63.50 60.63 1ssf n PRO 127 Cb 0.55 -2.12 -0.12 0.00 -0.04 0.00 0.00 33.50 31.77 1ssf n PRO 127 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1ssf s TYR 128 N -2.44 3.14 -1.94 0.54 1.13 -1.26 -4.33 117.35 112.19 1ssf s TYR 128 Ca 0.44 -0.29 0.16 0.00 -1.41 0.00 0.00 57.07 55.97 1ssf s TYR 128 Cb 0.34 -2.30 0.12 0.00 -1.10 0.00 0.00 41.96 39.02 1ssf s TYR 128 CO 0.13 -0.32 0.99 -0.85 -2.51 0.00 0.00 175.55 172.99