#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 2.12 0.00 1.20 7.64 -1.26 -3.43 113.62 119.89 1ssf n SER 8 Ca 0.00 -1.61 -0.02 0.00 1.01 0.00 0.00 58.87 58.24 1ssf n SER 8 Cb 0.00 -0.47 -0.01 0.00 -1.01 0.00 0.00 64.21 62.72 1ssf n SER 8 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1ssf n PHE 9 N 1.96 0.00 0.04 1.43 7.35 -1.26 -4.67 117.46 122.32 1ssf n PHE 9 Ca 0.03 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.72 1ssf n PHE 9 Cb 0.23 -0.14 0.01 0.00 0.35 0.00 0.00 39.48 39.93 1ssf n PHE 9 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1ssf n VAL 10 N -3.57 0.00 -1.13 -2.13 0.24 -1.22 0.31 118.33 110.83 1ssf n VAL 10 Ca -0.04 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.32 1ssf n VAL 10 Cb 0.14 -0.64 0.23 0.00 -1.47 0.00 0.00 33.84 32.10 1ssf n VAL 10 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ssf n GLY 11 N -0.62 4.39 3.15 7.63 0.00 -1.25 -2.92 105.19 115.57 1ssf n GLY 11 Ca 0.00 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.56 1ssf n GLY 11 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ssf n LEU 12 N -0.81 -2.96 -4.23 0.99 7.94 0.15 -4.73 117.00 113.35 1ssf n LEU 12 Ca 0.24 0.05 -0.35 0.00 -1.11 0.00 0.00 56.01 54.84 1ssf n LEU 12 Cb 0.90 -0.81 -0.14 0.00 0.53 0.00 0.00 43.42 43.90 1ssf n LEU 12 CO 0.14 -3.59 -0.37 -0.13 -1.11 0.00 0.00 177.39 172.33 1ssf s ARG 13 N -2.71 2.88 0.29 1.96 0.52 -1.25 -2.21 118.95 118.43 1ssf s ARG 13 Ca 0.46 -0.96 0.10 0.00 -0.52 0.00 0.00 55.73 54.82 1ssf s ARG 13 Cb -0.07 -3.08 -0.05 0.00 0.52 0.00 0.00 34.95 32.26 1ssf s ARG 13 CO 0.70 -0.42 -0.16 0.14 0.02 0.00 0.00 175.30 175.58 1ssf s VAL 14 N 1.36 2.27 0.06 3.52 -7.23 0.30 -0.13 120.40 120.56 1ssf s VAL 14 Ca 0.00 -2.32 0.08 0.00 -1.81 0.00 0.00 61.98 57.93 1ssf s VAL 14 Cb -0.17 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.37 1ssf s VAL 14 CO -0.03 -0.37 -0.18 0.68 -0.31 0.00 0.00 175.10 174.89 1ssf s VAL 15 N -2.63 2.80 -0.26 1.32 -7.23 -0.97 -0.82 120.40 112.62 1ssf s VAL 15 Ca 0.30 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.19 1ssf s VAL 15 Cb -0.02 -2.21 0.07 0.00 0.56 0.00 0.00 36.38 34.78 1ssf s VAL 15 CO 0.14 0.27 0.00 0.00 -0.31 0.00 0.00 175.10 175.20 1ssf s ALA 16 N -0.99 1.86 -0.16 1.32 0.00 0.21 -2.19 121.76 121.81 1ssf s ALA 16 Ca 0.16 -1.46 -0.03 0.00 0.00 0.00 0.00 51.96 50.62 1ssf s ALA 16 Cb -0.11 -1.50 0.05 0.00 0.00 0.00 0.00 23.12 21.57 1ssf s ALA 16 CO 0.07 -1.34 0.06 -1.59 0.00 0.00 0.00 175.76 172.95 1ssf s LYS 17 N 1.44 0.33 0.04 0.00 -2.85 -1.01 -0.63 119.74 117.07 1ssf s LYS 17 Ca -0.00 -0.15 0.10 0.00 -1.00 0.00 0.00 55.97 54.92 1ssf s LYS 17 Cb -0.18 -1.72 -0.21 0.00 -2.06 0.00 0.00 37.83 33.65 1ssf s LYS 17 CO -0.10 -0.59 0.97 -1.49 0.10 0.00 0.00 175.35 174.24 1ssf h TRP 18 N 8.34 0.00 -3.79 1.78 4.06 -1.95 -3.38 115.95 121.01 1ssf h TRP 18 Ca -0.16 0.00 -0.45 0.00 2.06 0.00 0.00 58.89 60.34 1ssf h TRP 18 Cb 1.13 0.00 -0.20 0.00 -1.00 0.00 0.00 29.16 29.09 1ssf h TRP 18 CO 0.27 0.98 -0.78 -1.12 -3.56 0.00 0.00 178.44 174.22 1ssf s SER 19 N -6.38 2.03 -0.44 -3.49 0.01 -1.26 -4.98 113.70 99.20 1ssf s SER 19 Ca -0.02 -0.71 -0.28 0.00 1.31 0.00 0.00 55.95 56.25 1ssf s SER 19 Cb 0.09 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.24 1ssf s SER 19 CO 0.82 -0.06 1.55 -0.94 0.41 0.00 0.00 173.24 175.02 1ssf s SER 20 N -2.05 6.08 -0.16 2.44 1.04 -1.26 -4.83 113.70 114.95 1ssf s SER 20 Ca 0.04 0.80 0.16 0.00 0.48 0.00 0.00 55.95 57.44 1ssf s SER 20 Cb -0.08 -2.54 -0.23 0.00 0.10 0.00 0.00 66.02 63.27 1ssf s SER 20 CO 0.03 -1.65 0.10 -3.20 0.98 0.00 0.00 173.24 169.51 1ssf n ASN 21 N 9.71 0.56 0.00 7.02 5.15 -1.26 -5.02 115.26 131.42 1ssf n ASN 21 Ca 0.18 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.16 1ssf n ASN 21 Cb 0.48 1.04 0.00 0.00 -0.53 0.00 0.00 39.78 40.77 1ssf n ASN 21 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ssf n GLY 22 N 1.84 2.73 3.03 8.20 0.00 -1.26 -5.07 105.19 114.66 1ssf n GLY 22 Ca -0.27 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 1ssf n GLY 22 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ssf s TYR 23 N -2.47 0.56 0.14 1.61 -0.85 -1.26 -0.89 117.35 114.19 1ssf s TYR 23 Ca 0.00 -0.47 0.10 0.00 -0.52 0.00 0.00 57.07 56.18 1ssf s TYR 23 Cb 0.00 -0.35 -0.04 0.00 0.38 0.00 0.00 41.96 41.95 1ssf s TYR 23 CO 0.00 -0.10 -0.21 -0.06 -1.52 0.00 0.00 175.55 173.66 1ssf s PHE 24 N -1.28 2.43 0.29 -3.49 0.08 0.17 -4.88 117.98 111.30 1ssf s PHE 24 Ca -0.10 -0.31 0.00 0.00 0.12 0.00 0.00 56.93 56.64 1ssf s PHE 24 Cb -0.09 -1.27 0.06 0.00 -0.57 0.00 0.00 43.02 41.15 1ssf s PHE 24 CO 0.00 0.41 0.39 0.66 -0.10 0.00 0.00 175.22 176.59 1ssf n TYR 25 N 0.63 -3.14 -4.30 0.36 4.01 0.20 -2.71 117.16 112.20 1ssf n TYR 25 Ca -0.15 -0.73 -0.18 0.00 -0.16 0.00 0.00 57.90 56.67 1ssf n TYR 25 Cb 0.54 -0.29 -0.15 0.00 -0.31 0.00 0.00 39.34 39.13 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 -2.62 0.97 0.18 7.72 0.15 -1.26 -0.62 113.70 118.22 1ssf s SER 26 Ca 0.26 -0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.76 1ssf s SER 26 Cb -0.02 -0.18 -0.04 0.00 -1.71 0.00 0.00 66.02 64.08 1ssf s SER 26 CO 0.17 0.07 0.11 -0.83 1.20 0.00 0.00 173.24 173.97 1ssf s GLY 27 N 0.00 1.29 0.01 9.45 0.00 -0.00 -4.16 107.32 113.91 1ssf s GLY 27 Ca 0.00 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.11 1ssf s GLY 27 CO -0.00 -1.38 -0.05 -1.59 0.00 0.00 0.00 173.10 170.08 1ssf s LYS 28 N -4.12 0.39 0.40 2.90 -2.85 0.24 -0.54 119.74 116.15 1ssf s LYS 28 Ca 0.34 -0.31 -0.06 0.00 -1.00 0.00 0.00 55.97 54.94 1ssf s LYS 28 Cb 0.07 -0.31 -0.05 0.00 -2.06 0.00 0.00 37.83 35.48 1ssf s LYS 28 CO 0.09 0.08 0.70 0.96 0.10 0.00 0.00 175.35 177.28 1ssf s ILE 29 N -0.45 4.91 -0.11 3.79 -4.36 -0.94 -0.90 121.20 123.14 1ssf s ILE 29 Ca -0.02 0.24 0.00 0.00 -0.26 0.00 0.00 60.65 60.62 1ssf s ILE 29 Cb -0.04 -3.79 -0.07 0.00 1.25 0.00 0.00 42.46 39.81 1ssf s ILE 29 CO -0.00 -0.59 -0.10 0.41 0.24 0.00 0.00 174.94 174.90 1ssf n THR 30 N -1.59 0.64 -3.90 8.37 -1.04 0.68 -3.93 114.28 113.52 1ssf n THR 30 Ca 0.00 -0.24 -0.09 0.00 -2.04 0.00 0.00 64.05 61.68 1ssf n THR 30 Cb 0.55 -0.95 -0.05 0.00 -1.82 0.00 0.00 70.33 68.06 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 -2.22 1.33 -0.09 -2.82 0.52 -0.38 -4.68 118.95 110.61 1ssf s ARG 31 Ca -0.15 -1.09 -0.15 0.00 -0.52 0.00 0.00 55.73 53.82 1ssf s ARG 31 Cb 0.04 0.45 -0.05 0.00 0.52 0.00 0.00 34.95 35.91 1ssf s ARG 31 CO 0.25 -0.54 0.38 0.34 0.02 0.00 0.00 175.30 175.76 1ssf s ASP 32 N -2.95 6.64 -0.19 0.23 2.15 -1.26 -0.91 116.67 120.39 1ssf s ASP 32 Ca 0.16 0.76 -0.03 0.00 0.43 0.00 0.00 52.55 53.87 1ssf s ASP 32 Cb 0.01 -2.23 -0.02 0.00 -0.30 0.00 0.00 42.92 40.38 1ssf s ASP 32 CO 0.01 0.17 -0.05 0.68 -0.17 0.00 0.00 175.17 175.82 1ssf s VAL 33 N -0.16 3.53 0.00 1.11 -7.23 -1.09 -4.81 120.40 111.76 1ssf s VAL 33 Ca 0.22 -0.46 0.00 0.00 -1.81 0.00 0.00 61.98 59.93 1ssf s VAL 33 Cb -0.15 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.22 1ssf s VAL 33 CO 0.09 0.45 0.00 0.61 -0.31 0.00 0.00 175.10 175.94 1ssf n GLY 34 N 4.29 2.09 3.45 2.32 0.00 -1.26 -2.71 105.19 113.37 1ssf n GLY 34 Ca -0.18 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.85 3.18 0.00 4.61 0.00 -1.26 -4.59 121.76 122.85 1ssf s ALA 35 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1ssf s ALA 35 Cb 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.01 1ssf s ALA 35 CO 0.00 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.66 1ssf n GLY 36 N 4.93 3.11 3.96 0.00 0.00 -1.26 -4.97 105.19 110.96 1ssf n GLY 36 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 1ssf n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ssf s LYS 37 N -0.35 3.46 0.02 1.61 -2.85 -1.10 0.19 119.74 120.72 1ssf s LYS 37 Ca 0.00 -0.55 0.01 0.00 -1.00 0.00 0.00 55.97 54.43 1ssf s LYS 37 Cb 0.00 -2.79 -0.01 0.00 -2.06 0.00 0.00 37.83 32.97 1ssf s LYS 37 CO 0.00 0.31 -0.04 0.71 0.10 0.00 0.00 175.35 176.42 1ssf s TYR 38 N -2.12 0.37 -0.37 1.78 2.02 -0.69 -2.66 117.35 115.68 1ssf s TYR 38 Ca 0.37 -0.35 -0.04 0.00 -0.37 0.00 0.00 57.07 56.67 1ssf s TYR 38 Cb -0.09 -0.23 0.08 0.00 -0.40 0.00 0.00 41.96 41.31 1ssf s TYR 38 CO 0.32 -0.09 0.14 0.21 -1.57 0.00 0.00 175.55 174.56 1ssf s LYS 39 N -1.01 2.32 0.12 -0.62 2.47 -0.08 -1.68 119.74 121.25 1ssf s LYS 39 Ca -0.08 -1.51 0.02 0.00 -1.56 0.00 0.00 55.97 52.84 1ssf s LYS 39 Cb -0.07 -3.49 -0.04 0.00 -1.46 0.00 0.00 37.83 32.77 1ssf s LYS 39 CO -0.00 -0.87 -0.05 -0.48 0.16 0.00 0.00 175.35 174.11 1ssf s LEU 40 N 1.26 2.41 0.05 5.43 -0.00 -0.80 -0.23 118.68 126.80 1ssf s LEU 40 Ca 0.02 -1.05 0.05 0.00 -0.00 0.00 0.00 54.13 53.16 1ssf s LEU 40 Cb -0.21 -0.08 -0.02 0.00 -0.00 0.00 0.00 46.19 45.87 1ssf s LEU 40 CO -0.01 -0.49 -0.14 -0.22 -0.00 0.00 0.00 176.35 175.49 1ssf s LEU 41 N -3.08 2.20 0.29 1.48 0.20 -0.08 -1.82 118.68 117.87 1ssf s LEU 41 Ca 0.15 -0.50 -0.28 0.00 0.69 0.00 0.00 54.13 54.19 1ssf s LEU 41 Cb 0.05 -0.60 -0.09 0.00 -0.43 0.00 0.00 46.19 45.12 1ssf s LEU 41 CO -0.02 0.01 1.00 -0.36 -0.29 0.00 0.00 176.35 176.68 1ssf s PHE 42 N -0.95 3.71 0.41 5.38 0.40 0.01 -0.59 117.98 126.34 1ssf s PHE 42 Ca 0.01 1.79 0.18 0.00 -0.60 0.00 0.00 56.93 58.31 1ssf s PHE 42 Cb -0.08 -3.06 0.96 0.00 0.51 0.00 0.00 43.02 41.34 1ssf s PHE 42 CO 0.02 -0.01 1.48 0.38 0.70 0.00 0.00 175.22 177.79 1ssf h ASP 43 N 3.58 0.00 0.08 1.36 2.03 -1.84 0.51 116.42 122.14 1ssf h ASP 43 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 1ssf h ASP 43 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1ssf h ASP 43 CO 0.66 0.00 -0.53 -0.90 -1.03 0.00 0.00 179.24 177.44 1ssf n ASP 44 N -2.46 1.50 0.00 4.15 5.68 -1.26 -5.02 116.55 119.15 1ssf n ASP 44 Ca -0.01 -1.19 0.00 0.00 -0.50 0.00 0.00 54.79 53.09 1ssf n ASP 44 Cb 0.48 0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.94 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 1.42 1.42 3.48 6.12 0.00 0.18 -5.10 105.19 112.71 1ssf n GLY 45 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 3.03 0.13 1.61 5.04 -1.24 -4.83 117.35 119.10 1ssf s TYR 46 Ca 0.00 -0.31 0.03 0.00 -2.44 0.00 0.00 57.07 54.35 1ssf s TYR 46 Cb 0.00 -3.49 -0.04 0.00 0.35 0.00 0.00 41.96 38.78 1ssf s TYR 46 CO 0.00 -0.99 0.22 -2.00 -1.34 0.00 0.00 175.55 171.43 1ssf s GLU 47 N 2.81 3.25 0.24 4.97 2.12 -1.26 -0.81 118.70 130.02 1ssf s GLU 47 Ca 0.19 -0.66 -0.20 0.00 0.36 0.00 0.00 54.97 54.66 1ssf s GLU 47 Cb -0.17 -2.87 0.07 0.00 0.26 0.00 0.00 34.13 31.42 1ssf s GLU 47 CO 0.15 0.53 0.95 0.00 -0.54 0.00 0.00 175.26 176.34 1ssf s ASP 49 N -3.24 2.21 0.15 0.00 1.11 -1.26 -1.91 116.67 113.72 1ssf s ASP 49 Ca 0.18 -0.34 -0.09 0.00 0.18 0.00 0.00 52.55 52.48 1ssf s ASP 49 Cb -0.03 -0.25 -0.01 0.00 1.07 0.00 0.00 42.92 43.70 1ssf s ASP 49 CO 0.07 0.23 0.27 0.68 1.18 0.00 0.00 175.17 177.60 1ssf s VAL 50 N -0.43 0.08 -0.01 -1.27 -7.23 -0.68 -5.01 120.40 105.85 1ssf s VAL 50 Ca 0.07 -1.33 -0.24 0.00 -1.81 0.00 0.00 61.98 58.67 1ssf s VAL 50 Cb -0.07 -1.74 -0.05 0.00 0.56 0.00 0.00 36.38 35.08 1ssf s VAL 50 CO -0.01 -0.36 0.74 -0.22 -0.31 0.00 0.00 175.10 174.94 1ssf s LEU 51 N -2.95 4.39 0.16 1.32 1.98 -1.26 -1.70 118.68 120.62 1ssf s LEU 51 Ca 0.15 1.33 -0.11 0.00 -2.89 0.00 0.00 54.13 52.61 1ssf s LEU 51 Cb 0.03 -3.16 0.03 0.00 0.66 0.00 0.00 46.19 43.75 1ssf s LEU 51 CO -0.02 -0.05 1.60 1.23 -1.89 0.00 0.00 176.35 177.22 1ssf h GLY 52 N 6.19 1.04 -0.79 7.98 0.00 -0.53 -3.30 103.07 113.66 1ssf h GLY 52 Ca -0.43 -0.79 0.00 0.00 0.00 0.00 0.00 47.33 46.11 1ssf h GLY 52 CO 0.73 0.73 0.00 0.58 0.00 0.00 0.00 176.54 178.58 1ssf n LYS 53 N -4.24 0.00 0.00 4.80 -0.00 -1.26 -1.33 118.16 116.12 1ssf n LYS 53 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1ssf n LYS 53 Cb 0.35 -0.99 0.00 0.00 -0.00 0.00 0.00 35.03 34.39 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 0.29 0.00 -4.12 -5.58 8.00 -1.24 -4.97 116.55 108.92 1ssf n ASP 54 Ca 0.00 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 1ssf n ASP 54 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 40.99 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 -0.05 3.33 0.09 0.53 -1.09 -0.44 -2.40 121.20 121.17 1ssf s ILE 55 Ca 0.00 -2.16 0.02 0.00 -2.23 0.00 0.00 60.65 56.28 1ssf s ILE 55 Cb 0.00 -3.27 -0.04 0.00 -1.58 0.00 0.00 42.46 37.57 1ssf s ILE 55 CO 0.00 -0.71 -0.08 -0.22 -1.23 0.00 0.00 174.94 172.70 1ssf s LEU 56 N 1.01 2.45 -0.58 2.97 0.20 -0.93 -4.67 118.68 119.12 1ssf s LEU 56 Ca 0.09 -0.89 -0.30 0.00 0.69 0.00 0.00 54.13 53.72 1ssf s LEU 56 Cb -0.23 -0.14 -0.12 0.00 -0.43 0.00 0.00 46.19 45.28 1ssf s LEU 56 CO -0.04 -0.38 2.43 0.00 -0.29 0.00 0.00 176.35 178.07 1ssf n LEU 57 N 0.32 1.77 -4.59 -0.68 -0.00 -1.26 -2.29 117.00 110.27 1ssf n LEU 57 Ca -0.15 -0.08 -0.27 0.00 -0.00 0.00 0.00 56.01 55.51 1ssf n LEU 57 Cb 0.59 -1.33 -0.09 0.00 -0.00 0.00 0.00 43.42 42.59 1ssf n LEU 57 CO 0.28 -1.11 -0.25 0.00 -0.00 0.00 0.00 177.39 176.31 1ssf h ASP 59 N 1.72 0.44 0.00 0.00 3.32 -1.86 -3.32 116.42 116.73 1ssf h ASP 59 Ca -0.41 -0.78 0.00 0.00 0.02 0.00 0.00 57.03 55.87 1ssf h ASP 59 Cb 1.27 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1ssf h ASP 59 CO 0.69 1.68 0.00 -2.65 -1.72 0.00 0.00 179.24 177.23 1ssf n PRO 60 N -3.47 0.00 -4.09 3.56 -0.02 -1.26 -4.90 135.00 124.83 1ssf n PRO 60 Ca -0.25 0.33 -0.22 0.00 -2.02 0.00 0.00 63.50 61.33 1ssf n PRO 60 Cb 1.06 -1.21 -0.04 0.00 -0.02 0.00 0.00 33.50 33.28 1ssf n PRO 60 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1ssf s ILE 61 N -1.93 4.60 -0.45 4.25 -1.09 -1.26 -5.02 121.20 120.30 1ssf s ILE 61 Ca 0.00 -1.29 -0.31 0.00 -2.23 0.00 0.00 60.65 56.81 1ssf s ILE 61 Cb 0.00 -3.48 -0.11 0.00 -1.58 0.00 0.00 42.46 37.29 1ssf s ILE 61 CO 0.00 -0.32 2.32 -2.65 -1.23 0.00 0.00 174.94 173.06 1ssf n PRO 62 N -1.13 1.04 0.00 2.79 -0.02 -1.26 -4.81 135.00 131.61 1ssf n PRO 62 Ca -0.08 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1ssf n PRO 62 Cb 0.57 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 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 11.76 0.00 -2.68 2.45 4.77 -1.26 -1.11 117.00 130.93 1ssf n LEU 63 Ca 0.42 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.38 1ssf n LEU 63 Cb 0.31 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.53 1ssf n LEU 63 CO 0.76 0.00 0.61 -0.67 -1.33 0.00 0.00 177.39 176.75 1ssf n ASP 64 N 0.00 -1.35 -4.51 -1.43 2.03 -0.80 -3.80 116.55 106.69 1ssf n ASP 64 Ca 0.00 -2.22 -0.25 0.00 0.52 0.00 0.00 54.79 52.84 1ssf n ASP 64 Cb 0.00 0.65 -0.10 0.00 -0.72 0.00 0.00 41.12 40.96 1ssf n ASP 64 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1ssf s THR 65 N -0.04 2.71 0.03 5.18 2.01 -0.27 -4.89 115.64 120.38 1ssf s THR 65 Ca 0.10 -2.18 -0.30 0.00 0.31 0.00 0.00 61.69 59.63 1ssf s THR 65 Cb 0.44 -2.40 -0.08 0.00 0.01 0.00 0.00 72.50 70.47 1ssf s THR 65 CO -0.12 -0.32 1.88 -0.70 -0.69 0.00 0.00 174.62 174.66 1ssf s GLU 66 N -3.33 4.15 0.33 4.92 2.12 -1.26 -0.51 118.70 125.12 1ssf s GLU 66 Ca 0.28 2.52 -0.16 0.00 0.36 0.00 0.00 54.97 57.97 1ssf s GLU 66 Cb -0.06 -4.04 0.03 0.00 0.26 0.00 0.00 34.13 30.32 1ssf s GLU 66 CO 0.15 -0.91 0.71 0.08 -0.54 0.00 0.00 175.26 174.75 1ssf s VAL 67 N 4.10 0.00 0.10 3.70 1.01 -0.41 -4.90 120.40 124.01 1ssf s VAL 67 Ca 0.84 -1.09 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1ssf s VAL 67 Cb -0.41 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1ssf s VAL 67 CO 0.38 0.00 -0.08 0.28 0.00 0.00 0.00 175.10 175.68 1ssf s THR 68 N -3.13 0.86 -0.13 3.92 -1.32 -0.98 0.17 115.64 115.01 1ssf s THR 68 Ca 0.16 -1.83 -0.07 0.00 -1.21 0.00 0.00 61.69 58.74 1ssf s THR 68 Cb -0.05 -1.56 -0.04 0.00 -1.51 0.00 0.00 72.50 69.34 1ssf s THR 68 CO 0.10 -0.73 0.12 0.00 -2.21 0.00 0.00 174.62 171.91 1ssf s ALA 69 N -3.09 3.78 -0.31 11.08 0.00 -0.94 -1.03 121.76 131.25 1ssf s ALA 69 Ca 0.10 -0.67 -0.23 0.00 0.00 0.00 0.00 51.96 51.16 1ssf s ALA 69 Cb 0.01 -1.96 0.00 0.00 0.00 0.00 0.00 23.12 21.17 1ssf s ALA 69 CO -0.02 0.51 0.78 -1.17 0.00 0.00 0.00 175.76 175.87 1ssf s LEU 70 N -0.70 4.09 0.17 0.00 1.98 -0.25 -3.90 118.68 120.07 1ssf s LEU 70 Ca 0.13 0.65 -0.01 0.00 -2.89 0.00 0.00 54.13 52.02 1ssf s LEU 70 Cb -0.12 -3.06 -0.04 0.00 0.66 0.00 0.00 46.19 43.63 1ssf s LEU 70 CO 0.03 -0.61 0.08 -0.44 -1.89 0.00 0.00 176.35 173.52 1ssf s SER 71 N 1.62 0.41 0.99 3.68 0.01 -1.26 -4.90 113.70 114.25 1ssf s SER 71 Ca 0.32 -1.29 -0.27 0.00 1.31 0.00 0.00 55.95 56.02 1ssf s SER 71 Cb -0.14 0.30 -0.19 0.00 0.21 0.00 0.00 66.02 66.19 1ssf s SER 71 CO 0.12 -0.76 -1.48 -1.84 0.41 0.00 0.00 173.24 169.70 1ssf n GLU 72 N -0.21 0.00 -0.25 12.44 0.00 -1.26 -3.91 120.64 127.45 1ssf n GLU 72 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.20 1ssf n GLU 72 Cb 0.65 -0.99 0.18 0.00 0.00 0.00 0.00 31.44 31.28 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 -0.99 -0.09 -0.36 -1.84 3.58 -2.03 0.16 116.42 114.86 1ssf h ASP 73 Ca -0.39 0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.22 1ssf h ASP 73 Cb 1.38 0.24 0.00 0.00 1.72 0.00 0.00 39.33 42.67 1ssf h ASP 73 CO 0.21 -0.09 0.00 1.21 -2.88 0.00 0.00 179.24 177.69 1ssf n GLU 74 N -5.21 2.75 0.00 0.28 2.13 -1.26 -4.68 120.64 114.64 1ssf n GLU 74 Ca 0.14 -2.06 0.00 0.00 0.66 0.00 0.00 57.16 55.91 1ssf n GLU 74 Cb 0.48 -1.29 0.00 0.00 0.27 0.00 0.00 31.44 30.90 1ssf n GLU 74 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1ssf n TYR 75 N 0.61 0.00 -1.65 4.31 4.02 -0.81 -5.07 117.16 118.57 1ssf n TYR 75 Ca 0.12 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.59 1ssf n TYR 75 Cb 0.44 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.75 1ssf n TYR 75 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 176.86 177.82 1ssf n PHE 76 N -2.10 1.76 -4.08 -0.72 1.16 0.51 -4.86 117.46 109.12 1ssf n PHE 76 Ca 0.00 0.59 -0.08 0.00 -1.87 0.00 0.00 57.45 56.09 1ssf n PHE 76 Cb 0.48 -2.33 -0.10 0.00 -1.61 0.00 0.00 39.48 35.92 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 -0.49 0.39 0.38 5.98 0.15 -1.25 -5.02 113.70 113.84 1ssf s SER 77 Ca 0.58 -1.02 -0.03 0.00 0.70 0.00 0.00 55.95 56.18 1ssf s SER 77 Cb -0.60 0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 63.92 1ssf s SER 77 CO 0.60 -0.66 0.64 0.00 1.20 0.00 0.00 173.24 175.03 1ssf s ALA 78 N -3.95 3.56 0.00 5.45 0.00 -1.26 -2.22 121.76 123.33 1ssf s ALA 78 Ca 0.12 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1ssf s ALA 78 Cb 0.07 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.84 1ssf s ALA 78 CO -0.06 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.04 1ssf n GLY 79 N -1.70 2.48 3.43 0.00 0.00 0.13 -4.82 105.19 104.70 1ssf n GLY 79 Ca -0.02 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 1ssf n GLY 79 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ssf s VAL 80 N -2.98 2.57 -0.08 1.61 1.01 0.11 -1.29 120.40 121.34 1ssf s VAL 80 Ca 0.00 -1.42 -0.19 0.00 0.00 0.00 0.00 61.98 60.38 1ssf s VAL 80 Cb 0.00 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 1ssf s VAL 80 CO 0.00 0.24 0.52 0.54 0.00 0.00 0.00 175.10 176.39 1ssf s VAL 81 N -0.98 5.11 -0.00 2.92 0.11 0.33 0.32 120.40 128.20 1ssf s VAL 81 Ca 0.15 1.05 -0.00 0.00 -2.93 0.00 0.00 61.98 60.24 1ssf s VAL 81 Cb -0.10 -3.85 -0.00 0.00 -1.53 0.00 0.00 36.38 30.89 1ssf s VAL 81 CO 0.06 0.36 -0.00 0.29 -3.33 0.00 0.00 175.10 172.47 1ssf n LYS 82 N 3.36 0.00 -3.59 1.54 4.76 -1.03 -1.90 118.16 121.29 1ssf n LYS 82 Ca -0.07 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.27 1ssf n LYS 82 Cb 0.52 -0.66 -0.06 0.00 -1.84 0.00 0.00 35.03 32.99 1ssf n LYS 82 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1ssf s GLY 83 N -4.70 -0.22 0.02 0.72 0.00 -1.25 -4.66 107.32 97.22 1ssf s GLY 83 Ca -0.00 2.22 -0.01 0.00 0.00 0.00 0.00 44.72 46.93 1ssf s GLY 83 CO 0.00 1.23 -0.00 -2.38 0.00 0.00 0.00 173.10 171.95 1ssf s HIS 84 N -0.78 0.22 0.19 1.90 -3.43 -1.26 -1.49 115.29 110.65 1ssf s HIS 84 Ca -0.00 -0.46 0.05 0.00 -0.80 0.00 0.00 55.06 53.85 1ssf s HIS 84 Cb -0.02 -0.17 -0.05 0.00 -1.43 0.00 0.00 32.58 30.92 1ssf s HIS 84 CO -0.01 -0.20 -0.07 -0.98 -2.00 0.00 0.00 174.74 171.48 1ssf s ARG 85 N -1.43 1.23 -0.00 -0.38 1.70 -0.58 -5.04 118.95 114.45 1ssf s ARG 85 Ca -0.16 -1.57 0.01 0.00 -0.47 0.00 0.00 55.73 53.54 1ssf s ARG 85 Cb -0.09 -0.75 -0.00 0.00 -0.57 0.00 0.00 34.95 33.54 1ssf s ARG 85 CO -0.01 0.04 -0.03 0.21 -1.08 0.00 0.00 175.30 174.43 1ssf s LYS 86 N -3.76 0.23 0.29 3.89 2.20 -1.26 -2.61 119.74 118.71 1ssf s LYS 86 Ca 0.22 -0.10 0.10 0.00 -0.36 0.00 0.00 55.97 55.84 1ssf s LYS 86 Cb 0.03 -0.22 -0.05 0.00 -1.51 0.00 0.00 37.83 36.08 1ssf s LYS 86 CO 0.05 0.06 -0.07 -2.00 -0.36 0.00 0.00 175.35 173.03 1ssf s GLU 87 N -0.06 2.01 -0.23 4.03 2.12 0.56 -5.02 118.70 122.11 1ssf s GLU 87 Ca 0.01 -1.63 -0.15 0.00 0.36 0.00 0.00 54.97 53.56 1ssf s GLU 87 Cb -0.01 -1.96 -0.17 0.00 0.26 0.00 0.00 34.13 32.26 1ssf s GLU 87 CO -0.00 0.30 1.49 0.45 -0.54 0.00 0.00 175.26 176.95 1ssf n SER 88 N -0.81 1.36 0.00 -1.70 2.88 -1.26 -2.16 113.62 111.93 1ssf n SER 88 Ca -0.05 -2.32 0.00 0.00 -1.33 0.00 0.00 58.87 55.17 1ssf n SER 88 Cb 0.60 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 1ssf n SER 88 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ssf n GLY 89 N 4.40 1.56 2.92 0.46 0.00 -1.26 -5.13 105.19 108.15 1ssf n GLY 89 Ca 0.30 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.20 1ssf n GLY 89 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ssf s GLU 90 N -0.12 0.11 -0.04 1.61 2.12 -0.92 -5.17 118.70 116.30 1ssf s GLU 90 Ca 0.00 -0.15 0.02 0.00 0.36 0.00 0.00 54.97 55.19 1ssf s GLU 90 Cb 0.00 0.04 0.02 0.00 0.26 0.00 0.00 34.13 34.45 1ssf s GLU 90 CO 0.00 -0.02 -0.06 -1.17 -0.54 0.00 0.00 175.26 173.47 1ssf s LEU 91 N -0.42 1.52 -0.06 2.70 1.98 -1.26 -0.33 118.68 122.81 1ssf s LEU 91 Ca -0.05 -0.15 -0.05 0.00 -2.89 0.00 0.00 54.13 50.99 1ssf s LEU 91 Cb -0.03 -0.49 0.02 0.00 0.66 0.00 0.00 46.19 46.35 1ssf s LEU 91 CO -0.00 -0.01 0.16 -0.31 -1.89 0.00 0.00 176.35 174.30 1ssf s TYR 92 N 0.64 -0.18 -0.17 5.38 1.51 -1.07 -3.25 117.35 120.21 1ssf s TYR 92 Ca -0.09 0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 56.40 1ssf s TYR 92 Cb -0.12 0.04 -0.01 0.00 -0.11 0.00 0.00 41.96 41.76 1ssf s TYR 92 CO 0.01 -0.10 -0.10 0.71 -1.11 0.00 0.00 175.55 174.96 1ssf s TYR 93 N 0.26 2.88 -0.70 2.71 1.51 0.40 -1.52 117.35 122.88 1ssf s TYR 93 Ca -0.01 -0.82 -0.22 0.00 -1.01 0.00 0.00 57.07 55.00 1ssf s TYR 93 Cb -0.03 -1.95 0.07 0.00 -0.11 0.00 0.00 41.96 39.94 1ssf s TYR 93 CO -0.01 -0.38 1.01 -1.54 -1.11 0.00 0.00 175.55 173.52 1ssf s SER 94 N 0.86 6.23 -0.30 2.29 1.04 -0.56 -0.99 113.70 122.27 1ssf s SER 94 Ca -0.03 -1.09 -0.11 0.00 0.48 0.00 0.00 55.95 55.20 1ssf s SER 94 Cb -0.15 -2.43 -0.03 0.00 0.10 0.00 0.00 66.02 63.51 1ssf s SER 94 CO 0.00 -1.42 0.19 -0.63 0.98 0.00 0.00 173.24 172.36 1ssf s ILE 95 N 4.02 5.11 -0.51 -1.02 -1.09 0.07 -2.48 121.20 125.29 1ssf s ILE 95 Ca 0.24 -0.06 -0.24 0.00 -2.23 0.00 0.00 60.65 58.37 1ssf s ILE 95 Cb -0.15 -3.51 0.04 0.00 -1.58 0.00 0.00 42.46 37.26 1ssf s ILE 95 CO 0.08 0.16 0.88 -0.70 -1.23 0.00 0.00 174.94 174.13 1ssf s GLU 96 N 1.71 3.36 -0.07 2.79 2.12 0.15 0.34 118.70 129.10 1ssf s GLU 96 Ca 0.06 -0.22 -0.04 0.00 0.36 0.00 0.00 54.97 55.13 1ssf s GLU 96 Cb -0.16 -4.02 0.03 0.00 0.26 0.00 0.00 34.13 30.24 1ssf s GLU 96 CO 0.09 -1.35 0.15 0.21 -0.54 0.00 0.00 175.26 173.83 1ssf s LYS 97 N 3.68 0.13 0.00 4.30 2.47 0.19 -0.71 119.74 129.79 1ssf s LYS 97 Ca 0.30 0.33 0.00 0.00 -1.56 0.00 0.00 55.97 55.04 1ssf s LYS 97 Cb -0.13 -0.09 0.00 0.00 -1.46 0.00 0.00 37.83 36.15 1ssf s LYS 97 CO 0.20 -0.12 0.00 -1.91 0.16 0.00 0.00 175.35 173.68 1ssf n GLU 98 N 3.84 -0.43 0.00 4.03 4.07 -1.26 -1.59 120.64 129.30 1ssf n GLU 98 Ca -0.22 0.11 0.00 0.00 -0.06 0.00 0.00 57.16 56.99 1ssf n GLU 98 Cb 0.54 -3.93 0.00 0.00 -0.06 0.00 0.00 31.44 27.99 1ssf n GLU 98 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ssf n GLY 99 N -1.48 0.99 3.29 8.31 0.00 -1.26 -5.11 105.19 109.93 1ssf n GLY 99 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.25 1.40 -0.23 1.61 1.03 -0.62 -5.14 119.66 117.45 1ssf s GLN 100 Ca 0.00 -1.76 -0.17 0.00 0.04 0.00 0.00 55.36 53.47 1ssf s GLN 100 Cb 0.00 -0.08 -0.03 0.00 0.03 0.00 0.00 33.01 32.93 1ssf s GLN 100 CO 0.00 -0.35 0.48 1.03 -2.54 0.00 0.00 175.29 173.91 1ssf s ARG 101 N -4.02 4.13 0.23 9.60 3.00 -1.26 0.54 118.95 131.17 1ssf s ARG 101 Ca 0.38 0.31 -0.02 0.00 0.00 0.00 0.00 55.73 56.40 1ssf s ARG 101 Cb 0.07 -3.59 -0.04 0.00 0.00 0.00 0.00 34.95 31.38 1ssf s ARG 101 CO 0.14 -0.21 0.43 0.15 0.00 0.00 0.00 175.30 175.82 1ssf s LYS 102 N 1.83 3.54 -0.28 3.54 -0.14 0.15 -4.90 119.74 123.49 1ssf s LYS 102 Ca 0.21 -0.27 0.01 0.00 -1.36 0.00 0.00 55.97 54.57 1ssf s LYS 102 Cb -0.15 -2.79 0.08 0.00 -1.68 0.00 0.00 37.83 33.29 1ssf s LYS 102 CO 0.09 0.35 0.02 -1.58 -0.76 0.00 0.00 175.35 173.47 1ssf s TRP 103 N -1.94 2.48 -0.07 3.18 0.52 -1.26 -0.75 118.94 121.10 1ssf s TRP 103 Ca 0.40 -2.02 0.03 0.00 0.02 0.00 0.00 56.10 54.52 1ssf s TRP 103 Cb -0.11 -1.93 0.01 0.00 -1.15 0.00 0.00 33.47 30.29 1ssf s TRP 103 CO 0.29 -0.84 -0.16 0.71 0.02 0.00 0.00 176.95 176.97 1ssf s TYR 104 N 1.36 1.81 0.57 -1.98 2.02 -0.16 -4.89 117.35 116.08 1ssf s TYR 104 Ca 0.03 -0.69 -0.20 0.00 -0.37 0.00 0.00 57.07 55.84 1ssf s TYR 104 Cb -0.18 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 40.07 1ssf s TYR 104 CO -0.12 -0.32 1.25 -1.59 -1.57 0.00 0.00 175.55 173.20 1ssf s LYS 105 N 0.54 3.05 0.20 -0.62 0.00 -1.20 -0.45 119.74 121.25 1ssf s LYS 105 Ca -0.16 1.95 0.09 0.00 0.00 0.00 0.00 55.97 57.85 1ssf s LYS 105 Cb -0.16 -2.05 0.67 0.00 0.00 0.00 0.00 37.83 36.28 1ssf s LYS 105 CO 0.05 -1.18 0.87 0.54 0.00 0.00 0.00 175.35 175.63 1ssf n ARG 106 N -1.37 -0.04 0.29 1.78 1.74 -1.26 -0.99 116.66 116.82 1ssf n ARG 106 Ca 0.12 0.77 0.20 0.00 -0.77 0.00 0.00 57.85 58.18 1ssf n ARG 106 Cb 0.48 -1.35 1.02 0.00 -1.02 0.00 0.00 32.46 31.59 1ssf n ARG 106 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ssf h MET 107 N 0.00 0.00 -0.61 5.56 -0.00 -1.90 -2.72 114.93 115.26 1ssf h MET 107 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.14 1ssf h MET 107 Cb 1.11 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.71 1ssf h MET 107 CO -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 176.91 176.46 1ssf n ALA 108 N -2.02 2.34 -4.01 -3.00 0.00 -0.16 -4.78 120.51 108.87 1ssf n ALA 108 Ca -0.02 -1.23 -0.31 0.00 0.00 0.00 0.00 53.44 51.88 1ssf n ALA 108 Cb 0.10 -0.81 -0.16 0.00 0.00 0.00 0.00 19.45 18.59 1ssf n ALA 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ssf s VAL 109 N -1.04 1.68 0.44 0.00 0.11 -1.03 -1.09 120.40 119.48 1ssf s VAL 109 Ca 0.42 -0.98 0.03 0.00 -2.93 0.00 0.00 61.98 58.52 1ssf s VAL 109 Cb 0.22 -1.72 -0.03 0.00 -1.53 0.00 0.00 36.38 33.33 1ssf s VAL 109 CO 0.29 0.23 0.06 0.27 -3.33 0.00 0.00 175.10 172.62 1ssf s ILE 110 N 1.39 0.99 0.05 7.04 -4.36 -0.20 -4.67 121.20 121.44 1ssf s ILE 110 Ca -0.00 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.27 1ssf s ILE 110 Cb -0.16 -2.36 0.01 0.00 1.25 0.00 0.00 42.46 41.21 1ssf s ILE 110 CO -0.09 0.00 0.26 -1.48 0.24 0.00 0.00 174.94 173.88 1ssf s LEU 111 N -3.72 1.06 0.52 0.37 0.05 -1.10 -2.32 118.68 113.54 1ssf s LEU 111 Ca 0.18 -0.29 0.09 0.00 0.05 0.00 0.00 54.13 54.16 1ssf s LEU 111 Cb 0.03 1.22 0.06 0.00 -2.05 0.00 0.00 46.19 45.45 1ssf s LEU 111 CO 0.10 -0.62 0.70 -0.94 -0.55 0.00 0.00 176.35 175.04 1ssf s SER 112 N -2.17 5.27 0.05 1.48 1.04 -1.26 0.44 113.70 118.55 1ssf s SER 112 Ca -0.04 -0.72 -0.27 0.00 0.48 0.00 0.00 55.95 55.40 1ssf s SER 112 Cb -0.00 -0.03 -0.17 0.00 0.10 0.00 0.00 66.02 65.91 1ssf s SER 112 CO -0.05 -1.13 1.53 -0.07 0.98 0.00 0.00 173.24 174.50 1ssf h LEU 113 N 0.37 -0.35 0.00 2.42 3.38 -1.39 -1.13 115.31 118.60 1ssf h LEU 113 Ca -0.34 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1ssf h LEU 113 Cb 1.29 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1ssf h LEU 113 CO 0.43 -0.14 0.00 -0.62 0.09 0.00 0.00 178.44 178.20 1ssf n GLU 114 N -5.21 0.00 -0.03 1.13 1.02 -1.26 0.18 120.64 116.47 1ssf n GLU 114 Ca -0.10 0.43 -0.16 0.00 -0.02 0.00 0.00 57.16 57.31 1ssf n GLU 114 Cb 0.22 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.01 1ssf n GLU 114 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1ssf h GLN 115 N 0.00 0.12 0.15 3.49 5.75 -1.87 -3.31 115.11 119.44 1ssf h GLN 115 Ca 0.00 -0.17 -0.23 0.00 -0.15 0.00 0.00 58.65 58.10 1ssf h GLN 115 Cb 0.05 0.06 0.03 0.00 1.07 0.00 0.00 27.48 28.69 1ssf h GLN 115 CO 0.00 1.02 -1.01 0.78 -2.65 0.00 0.00 178.83 176.97 1ssf h GLY 116 N -0.70 0.47 2.00 2.39 0.00 0.29 -3.38 103.07 104.14 1ssf h GLY 116 Ca -0.04 -1.12 -0.10 0.00 0.00 0.00 0.00 47.33 46.07 1ssf h GLY 116 CO 0.05 0.98 -0.46 3.43 0.00 0.00 0.00 176.54 180.54 1ssf h ASN 117 N -0.14 0.00 0.97 0.19 4.21 0.17 -0.81 115.58 120.18 1ssf h ASN 117 Ca -0.17 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.31 1ssf h ASN 117 Cb 1.77 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.97 1ssf h ASN 117 CO 0.19 0.46 -0.12 0.08 -1.29 0.00 0.00 177.43 176.75 1ssf h ARG 118 N 0.00 0.00 0.08 0.81 0.11 -1.73 -3.11 114.38 110.54 1ssf h ARG 118 Ca -0.00 0.00 -0.37 0.00 0.10 0.00 0.00 59.98 59.71 1ssf h ARG 118 Cb 1.19 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.24 1ssf h ARG 118 CO 0.06 0.12 -2.12 -0.11 0.10 0.00 0.00 179.97 178.03 1ssf n LEU 119 N -3.27 2.57 -0.36 0.08 0.00 -1.12 -4.65 117.00 110.25 1ssf n LEU 119 Ca 0.00 0.13 0.29 0.00 0.00 0.00 0.00 56.01 56.43 1ssf n LEU 119 Cb 0.37 -0.96 0.60 0.00 0.00 0.00 0.00 43.42 43.43 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 0.22 0.00 1.96 0.11 -1.07 0.39 114.38 116.04 1ssf h ARG 120 Ca -0.46 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.61 1ssf h ARG 120 Cb 2.00 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 33.03 1ssf h ARG 120 CO 0.04 0.15 -1.16 -0.85 0.10 0.00 0.00 179.97 178.25 1ssf n GLU 121 N -4.54 0.41 -0.10 0.08 0.28 -1.26 -1.63 120.64 113.87 1ssf n GLU 121 Ca 0.29 -0.00 -0.18 0.00 -0.16 0.00 0.00 57.16 57.10 1ssf n GLU 121 Cb 1.12 -1.63 -0.08 0.00 1.43 0.00 0.00 31.44 32.27 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 -2.15 0.47 0.00 3.44 10.64 0.41 -4.93 117.38 125.26 1ssf n GLN 122 Ca 0.01 0.16 0.00 0.00 -1.83 0.00 0.00 57.00 55.33 1ssf n GLN 122 Cb 0.48 -1.33 0.00 0.00 -0.86 0.00 0.00 30.24 28.53 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 -3.50 0.00 0.00 2.61 4.01 0.11 -5.07 117.16 115.31 1ssf n TYR 123 Ca -0.38 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.22 1ssf n TYR 123 Cb 0.84 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.85 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 -0.13 -2.08 0.00 2.72 0.00 -1.25 -4.65 105.19 99.80 1ssf n GLY 124 Ca 0.00 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.70 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 -3.02 0.99 7.99 -1.23 -4.05 117.00 117.68 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 -0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1ssf n LEU 125 CO 0.00 0.00 0.21 -0.83 -1.51 0.00 0.00 177.39 175.26 1ssf s GLY 126 N -0.96 -1.37 -0.41 -0.72 0.00 -0.65 -4.76 107.32 98.46 1ssf s GLY 126 Ca 0.00 0.42 0.02 0.00 0.00 0.00 0.00 44.72 45.16 1ssf s GLY 126 CO 0.00 3.86 1.83 -1.55 0.00 0.00 0.00 173.10 177.24 1ssf n PRO 127 N 3.96 2.10 -4.96 2.90 -0.04 -1.26 -4.87 135.00 132.83 1ssf n PRO 127 Ca 0.11 -2.43 -0.32 0.00 -0.04 0.00 0.00 63.50 60.81 1ssf n PRO 127 Cb 0.59 -1.95 -0.15 0.00 -0.04 0.00 0.00 33.50 31.95 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 -2.73 2.69 0.00 0.54 1.13 -1.26 -4.25 117.35 113.47 1ssf s TYR 128 Ca 0.47 -0.64 0.00 0.00 -1.41 0.00 0.00 57.07 55.49 1ssf s TYR 128 Cb 0.38 -1.74 0.00 0.00 -1.10 0.00 0.00 41.96 39.50 1ssf s TYR 128 CO 0.05 -0.18 0.00 -1.91 -2.51 0.00 0.00 175.55 171.01