#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lkf n GLY 2 N 0.00 1.91 3.31 8.31 0.00 -1.21 -2.48 105.19 115.03 1lkf n GLY 2 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1lkf n GLY 2 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lkf s LYS 3 N 4.92 1.20 -0.11 1.61 -2.85 -0.95 -4.97 119.74 118.60 1lkf s LYS 3 Ca 0.00 -1.37 0.00 0.00 -1.00 0.00 0.00 55.97 53.60 1lkf s LYS 3 Cb 0.00 0.34 0.02 0.00 -2.06 0.00 0.00 37.83 36.13 1lkf s LYS 3 CO 0.00 -0.43 -0.09 0.42 0.10 0.00 0.00 175.35 175.36 1lkf s ILE 4 N -4.05 1.06 0.74 3.79 1.01 -1.26 -0.78 121.20 121.71 1lkf s ILE 4 Ca 0.26 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.47 1lkf s ILE 4 Cb 0.04 -1.06 0.03 0.00 0.01 0.00 0.00 42.46 41.49 1lkf s ILE 4 CO 0.06 0.37 1.08 0.42 0.00 0.00 0.00 174.94 176.86 1lkf s THR 5 N 1.53 3.66 0.86 2.92 -4.23 -0.30 -4.98 115.64 115.10 1lkf s THR 5 Ca 0.02 0.54 -0.12 0.00 -1.18 0.00 0.00 61.69 60.95 1lkf s THR 5 Cb -0.13 -3.16 0.11 0.00 1.34 0.00 0.00 72.50 70.65 1lkf s THR 5 CO -0.06 -0.70 1.12 -2.84 -0.54 0.00 0.00 174.62 171.59 1lkf s PRO 6 N -4.99 1.58 0.11 3.99 0.02 -1.26 -4.53 135.00 129.92 1lkf s PRO 6 Ca 0.60 0.47 -0.30 0.00 0.02 0.00 0.00 61.00 61.78 1lkf s PRO 6 Cb -0.15 -1.87 -0.06 0.00 0.02 0.00 0.00 34.50 32.43 1lkf s PRO 6 CO 0.55 -1.93 1.05 0.08 -0.33 0.00 0.00 177.00 176.42 1lkf s VAL 7 N -3.21 4.26 -0.04 3.83 1.01 -1.26 -4.68 120.40 120.32 1lkf s VAL 7 Ca 0.62 1.81 -0.02 0.00 0.00 0.00 0.00 61.98 64.39 1lkf s VAL 7 Cb -0.15 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 1lkf s VAL 7 CO 0.54 0.24 0.10 -0.94 0.00 0.00 0.00 175.10 175.04 1lkf s SER 8 N 0.31 5.90 0.02 3.32 1.04 -0.02 -4.92 113.70 119.36 1lkf s SER 8 Ca 0.51 0.25 0.09 0.00 0.48 0.00 0.00 55.95 57.27 1lkf s SER 8 Cb -0.26 -1.77 -0.03 0.00 0.10 0.00 0.00 66.02 64.06 1lkf s SER 8 CO 0.31 0.31 -0.26 0.68 0.98 0.00 0.00 173.24 175.26 1lkf s VAL 9 N -1.16 2.14 -0.22 5.02 -7.23 -1.26 -1.09 120.40 116.60 1lkf s VAL 9 Ca 0.21 -1.30 -0.04 0.00 -1.81 0.00 0.00 61.98 59.04 1lkf s VAL 9 Cb -0.12 -1.80 0.07 0.00 0.56 0.00 0.00 36.38 35.09 1lkf s VAL 9 CO 0.12 0.43 0.10 -0.75 -0.31 0.00 0.00 175.10 174.69 1lkf s LYS 10 N -1.05 0.16 -0.21 4.82 2.47 0.11 -4.99 119.74 121.04 1lkf s LYS 10 Ca 0.11 -0.28 -0.29 0.00 -1.56 0.00 0.00 55.97 53.95 1lkf s LYS 10 Cb -0.10 -1.62 0.01 0.00 -1.46 0.00 0.00 37.83 34.65 1lkf s LYS 10 CO 0.01 -0.80 1.06 0.21 0.16 0.00 0.00 175.35 176.00 1lkf s LYS 11 N 2.10 4.27 0.00 4.03 2.20 -1.26 0.21 119.74 131.28 1lkf s LYS 11 Ca 0.04 1.40 0.00 0.00 -0.36 0.00 0.00 55.97 57.05 1lkf s LYS 11 Cb -0.16 -3.64 0.00 0.00 -1.51 0.00 0.00 37.83 32.51 1lkf s LYS 11 CO -0.19 -0.61 0.00 0.28 -0.36 0.00 0.00 175.35 174.47 1lkf n VAL 12 N 5.26 0.00 0.00 4.02 0.31 -0.54 -4.96 118.33 122.42 1lkf n VAL 12 Ca 0.12 0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.85 1lkf n VAL 12 Cb 0.46 -1.22 0.00 0.00 -0.91 0.00 0.00 33.84 32.17 1lkf n VAL 12 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1lkf n ASP 13 N -1.79 0.00 0.00 4.52 9.92 -1.18 -5.01 116.55 123.02 1lkf n ASP 13 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1lkf n ASP 13 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1lkf n ASP 13 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1lkf n ASP 14 N 0.00 0.50 -0.13 -2.24 5.68 -1.26 -4.66 116.55 114.44 1lkf n ASP 14 Ca 0.00 -0.75 -0.18 0.00 -0.50 0.00 0.00 54.79 53.36 1lkf n ASP 14 Cb 0.00 0.41 -0.12 0.00 -1.14 0.00 0.00 41.12 40.27 1lkf n ASP 14 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1lkf n LYS 15 N -0.41 0.63 -4.74 0.11 0.00 -1.26 -4.94 118.16 107.55 1lkf n LYS 15 Ca 0.00 0.15 -0.33 0.00 -0.00 0.00 0.00 58.31 58.13 1lkf n LYS 15 Cb 0.01 -1.50 -0.13 0.00 -0.00 0.00 0.00 35.03 33.41 1lkf n LYS 15 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1lkf s VAL 16 N -2.51 3.32 -0.06 0.58 1.01 -1.26 -0.87 120.40 120.63 1lkf s VAL 16 Ca -0.34 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.04 1lkf s VAL 16 Cb 0.09 -2.36 0.02 0.00 0.00 0.00 0.00 36.38 34.13 1lkf s VAL 16 CO 0.58 0.57 -0.06 -0.89 0.00 0.00 0.00 175.10 175.30 1lkf s THR 17 N -0.40 0.66 -0.12 3.92 2.01 -0.47 -1.46 115.64 119.78 1lkf s THR 17 Ca 0.05 -0.17 -0.10 0.00 0.31 0.00 0.00 61.69 61.78 1lkf s THR 17 Cb -0.12 -0.68 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 1lkf s THR 17 CO 0.02 0.26 0.22 -0.76 -0.69 0.00 0.00 174.62 173.68 1lkf s LEU 18 N 1.07 4.35 -0.06 4.42 1.43 0.13 -2.05 118.68 127.97 1lkf s LEU 18 Ca -0.08 0.53 0.04 0.00 -1.03 0.00 0.00 54.13 53.59 1lkf s LEU 18 Cb -0.14 -2.24 -0.00 0.00 0.03 0.00 0.00 46.19 43.84 1lkf s LEU 18 CO -0.01 0.29 -0.19 -0.31 0.23 0.00 0.00 176.35 176.36 1lkf s TYR 19 N -0.49 1.97 -0.00 0.29 2.02 -0.13 0.04 117.35 121.04 1lkf s TYR 19 Ca 0.16 -0.66 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1lkf s TYR 19 Cb -0.13 -1.34 -0.01 0.00 -0.40 0.00 0.00 41.96 40.09 1lkf s TYR 19 CO 0.05 -0.25 -0.09 0.21 -1.57 0.00 0.00 175.55 173.89 1lkf s LYS 20 N 0.19 0.75 -0.15 -0.62 2.20 -0.25 0.24 119.74 122.11 1lkf s LYS 20 Ca -0.09 -0.36 -0.12 0.00 -0.36 0.00 0.00 55.97 55.04 1lkf s LYS 20 Cb -0.14 -0.72 0.04 0.00 -1.51 0.00 0.00 37.83 35.50 1lkf s LYS 20 CO 0.04 0.20 0.39 -0.08 -0.36 0.00 0.00 175.35 175.54 1lkf s THR 21 N -0.27 -0.01 -0.13 3.43 -1.32 -0.89 -0.84 115.64 115.63 1lkf s THR 21 Ca 0.03 0.03 0.01 0.00 -1.21 0.00 0.00 61.69 60.55 1lkf s THR 21 Cb -0.04 -0.56 -0.01 0.00 -1.51 0.00 0.00 72.50 70.38 1lkf s THR 21 CO -0.00 0.01 -0.15 -0.89 -2.21 0.00 0.00 174.62 171.38 1lkf s THR 22 N 0.59 2.87 -0.02 5.08 2.01 -1.26 -0.83 115.64 124.08 1lkf s THR 22 Ca -0.03 -0.73 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1lkf s THR 22 Cb -0.05 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.24 1lkf s THR 22 CO -0.04 0.53 -0.12 0.00 -0.69 0.00 0.00 174.62 174.30 1lkf s ALA 23 N 0.36 2.77 -0.11 7.40 0.00 0.28 -1.14 121.76 131.32 1lkf s ALA 23 Ca -0.12 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.82 1lkf s ALA 23 Cb -0.16 -0.99 0.02 0.00 0.00 0.00 0.00 23.12 21.99 1lkf s ALA 23 CO 0.06 0.57 -0.10 0.99 0.00 0.00 0.00 175.76 177.29 1lkf s THR 24 N -0.84 1.14 -0.08 0.00 2.01 0.04 -0.44 115.64 117.46 1lkf s THR 24 Ca 0.13 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.76 1lkf s THR 24 Cb -0.11 -1.11 0.02 0.00 0.01 0.00 0.00 72.50 71.31 1lkf s THR 24 CO 0.03 0.38 -0.10 0.00 -0.69 0.00 0.00 174.62 174.24 1lkf s ALA 25 N 1.40 1.28 0.21 7.40 0.00 -0.80 -2.23 121.76 129.00 1lkf s ALA 25 Ca -0.00 -0.46 0.10 0.00 0.00 0.00 0.00 51.96 51.59 1lkf s ALA 25 Cb -0.13 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 1lkf s ALA 25 CO -0.05 -0.10 -0.19 -0.51 0.00 0.00 0.00 175.76 174.90 1lkf s ASP 26 N 1.09 3.07 -0.33 0.00 1.01 -1.04 -1.08 116.67 119.39 1lkf s ASP 26 Ca -0.07 -0.93 0.02 0.00 0.71 0.00 0.00 52.55 52.28 1lkf s ASP 26 Cb -0.14 -0.21 0.10 0.00 1.01 0.00 0.00 42.92 43.67 1lkf s ASP 26 CO -0.01 -0.00 0.07 -0.55 0.21 0.00 0.00 175.17 174.88 1lkf s SER 27 N -3.00 4.44 0.22 0.27 0.15 -0.13 -2.47 113.70 113.18 1lkf s SER 27 Ca 0.22 -1.92 -0.06 0.00 0.70 0.00 0.00 55.95 54.88 1lkf s SER 27 Cb -0.05 -1.29 0.19 0.00 -1.71 0.00 0.00 66.02 63.15 1lkf s SER 27 CO 0.10 -0.39 1.74 0.44 1.20 0.00 0.00 173.24 176.32 1lkf h ASP 28 N 7.82 1.00 0.02 5.45 3.32 -1.97 -1.53 116.42 130.53 1lkf h ASP 28 Ca -0.08 -0.21 0.01 0.00 0.02 0.00 0.00 57.03 56.76 1lkf h ASP 28 Cb 1.02 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 1lkf h ASP 28 CO 0.50 0.97 -0.06 0.50 -1.72 0.00 0.00 179.24 179.43 1lkf h LYS 29 N 1.00 -0.11 -0.01 3.56 3.64 -1.95 -2.86 116.57 119.84 1lkf h LYS 29 Ca 0.21 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1lkf h LYS 29 Cb 0.38 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1lkf h LYS 29 CO 0.00 -0.07 -0.10 1.19 -2.27 0.00 0.00 179.45 178.21 1lkf n PHE 30 N -5.17 0.00 -3.64 1.91 3.72 -1.23 -4.94 117.46 108.11 1lkf n PHE 30 Ca -0.06 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.11 1lkf n PHE 30 Cb 0.10 -0.06 0.06 0.00 -0.94 0.00 0.00 39.48 38.64 1lkf n PHE 30 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1lkf n LYS 31 N -0.30 -6.53 -5.08 -1.08 5.02 -0.62 -4.51 118.16 105.05 1lkf n LYS 31 Ca 0.17 0.75 -0.32 0.00 -2.02 0.00 0.00 58.31 56.88 1lkf n LYS 31 Cb 0.33 -5.66 -0.16 0.00 -0.02 0.00 0.00 35.03 29.51 1lkf n LYS 31 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1lkf s ILE 32 N -3.39 2.41 -0.11 -0.18 1.01 -0.91 -1.69 121.20 118.34 1lkf s ILE 32 Ca 0.34 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 60.10 1lkf s ILE 32 Cb -0.16 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.38 1lkf s ILE 32 CO 0.77 0.55 -0.14 -0.55 0.00 0.00 0.00 174.94 175.57 1lkf s SER 33 N 0.19 2.35 -0.20 3.58 0.15 0.12 -0.95 113.70 118.93 1lkf s SER 33 Ca -0.12 -0.40 -0.05 0.00 0.70 0.00 0.00 55.95 56.08 1lkf s SER 33 Cb -0.16 -1.04 -0.03 0.00 -1.71 0.00 0.00 66.02 63.09 1lkf s SER 33 CO 0.07 -0.00 0.01 -1.10 1.20 0.00 0.00 173.24 173.41 1lkf s GLN 34 N 1.06 3.65 -0.24 5.44 -0.21 -0.24 -0.78 119.66 128.34 1lkf s GLN 34 Ca -0.05 -0.50 0.02 0.00 0.02 0.00 0.00 55.36 54.85 1lkf s GLN 34 Cb -0.15 -3.10 0.05 0.00 1.00 0.00 0.00 33.01 30.82 1lkf s GLN 34 CO -0.02 0.03 -0.12 0.42 -2.12 0.00 0.00 175.29 173.48 1lkf s ILE 35 N 0.96 2.06 -0.27 1.08 1.01 -0.33 -1.91 121.20 123.79 1lkf s ILE 35 Ca 0.02 -1.47 -0.02 0.00 0.00 0.00 0.00 60.65 59.18 1lkf s ILE 35 Cb -0.14 -2.14 0.03 0.00 0.01 0.00 0.00 42.46 40.22 1lkf s ILE 35 CO 0.02 0.05 -0.03 -0.76 0.00 0.00 0.00 174.94 174.22 1lkf s LEU 36 N 1.17 3.52 -0.35 2.97 1.43 0.41 -0.15 118.68 127.68 1lkf s LEU 36 Ca -0.06 -1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 51.92 1lkf s LEU 36 Cb -0.19 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1lkf s LEU 36 CO -0.06 -0.18 0.20 -0.89 0.23 0.00 0.00 176.35 175.64 1lkf s THR 37 N 1.31 4.68 -0.38 5.49 2.01 0.04 -0.56 115.64 128.23 1lkf s THR 37 Ca -0.02 -0.65 -0.17 0.00 0.31 0.00 0.00 61.69 61.16 1lkf s THR 37 Cb -0.18 -3.52 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1lkf s THR 37 CO -0.03 -0.12 0.44 -0.36 -0.69 0.00 0.00 174.62 173.86 1lkf s PHE 38 N 1.59 3.18 -0.45 4.92 0.40 -0.01 -0.87 117.98 126.74 1lkf s PHE 38 Ca 0.03 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.12 1lkf s PHE 38 Cb -0.18 -2.85 0.09 0.00 0.51 0.00 0.00 43.02 40.59 1lkf s PHE 38 CO 0.07 -0.59 0.32 -0.80 0.70 0.00 0.00 175.22 174.92 1lkf s ASN 39 N 1.79 5.77 -0.08 1.36 0.01 0.17 -2.08 114.94 121.87 1lkf s ASN 39 Ca 0.14 -1.60 -0.23 0.00 -0.71 0.00 0.00 52.86 50.46 1lkf s ASN 39 Cb -0.16 -2.04 -0.04 0.00 0.41 0.00 0.00 41.25 39.42 1lkf s ASN 39 CO 0.13 -0.62 0.66 -0.36 -1.51 0.00 0.00 177.10 175.41 1lkf s PHE 40 N 1.45 3.57 -0.32 2.20 0.08 0.14 -0.38 117.98 124.71 1lkf s PHE 40 Ca 0.04 1.19 -0.01 0.00 0.12 0.00 0.00 56.93 58.26 1lkf s PHE 40 Cb -0.24 -2.76 0.07 0.00 -0.57 0.00 0.00 43.02 39.51 1lkf s PHE 40 CO 0.02 0.10 0.04 0.42 -0.10 0.00 0.00 175.22 175.70 1lkf s ILE 41 N 0.78 2.97 -0.38 0.64 1.01 0.91 -0.96 121.20 126.17 1lkf s ILE 41 Ca 0.36 -1.60 -0.15 0.00 0.00 0.00 0.00 60.65 59.26 1lkf s ILE 41 Cb -0.17 -2.81 0.01 0.00 0.01 0.00 0.00 42.46 39.49 1lkf s ILE 41 CO 0.17 -0.26 0.31 -0.54 0.00 0.00 0.00 174.94 174.62 1lkf s LYS 42 N 1.20 3.22 -0.26 2.79 -0.14 -0.87 -2.69 119.74 122.98 1lkf s LYS 42 Ca -0.01 -0.80 0.02 0.00 -1.36 0.00 0.00 55.97 53.81 1lkf s LYS 42 Cb -0.20 -3.91 0.06 0.00 -1.68 0.00 0.00 37.83 32.11 1lkf s LYS 42 CO -0.02 -0.65 -0.06 0.34 -0.76 0.00 0.00 175.35 174.20 1lkf s ASP 43 N 1.72 4.17 0.51 2.83 2.15 -1.26 -1.37 116.67 125.43 1lkf s ASP 43 Ca 0.07 -1.36 0.34 0.00 0.43 0.00 0.00 52.55 52.03 1lkf s ASP 43 Cb -0.18 -1.36 1.74 0.00 -0.30 0.00 0.00 42.92 42.82 1lkf s ASP 43 CO 0.11 -0.23 2.04 0.11 -0.17 0.00 0.00 175.17 177.02 1lkf h LYS 44 N 7.86 0.00 -0.21 4.34 1.57 -1.36 -1.63 116.57 127.13 1lkf h LYS 44 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1lkf h LYS 44 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.36 1lkf h LYS 44 CO 0.44 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 178.19 1lkf n SER 45 N -2.78 1.67 -4.04 0.86 3.41 -1.26 -4.85 113.62 106.63 1lkf n SER 45 Ca -0.01 -1.77 -0.18 0.00 -0.26 0.00 0.00 58.87 56.65 1lkf n SER 45 Cb 0.13 -0.13 -0.14 0.00 -0.26 0.00 0.00 64.21 63.80 1lkf n SER 45 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1lkf s TYR 46 N -1.73 0.80 -0.43 7.33 1.51 -0.61 -4.68 117.35 119.53 1lkf s TYR 46 Ca 0.30 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 56.16 1lkf s TYR 46 Cb 0.16 -0.50 0.25 0.00 -0.11 0.00 0.00 41.96 41.76 1lkf s TYR 46 CO 0.23 -0.01 1.13 -0.40 -1.11 0.00 0.00 175.55 175.39 1lkf n ASP 47 N 2.52 2.96 -3.88 2.29 5.75 -1.26 -4.82 116.55 120.10 1lkf n ASP 47 Ca -0.15 -2.44 -0.11 0.00 -0.01 0.00 0.00 54.79 52.08 1lkf n ASP 47 Cb 0.56 -0.59 -0.11 0.00 -1.03 0.00 0.00 41.12 39.95 1lkf n ASP 47 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1lkf s LYS 48 N -1.35 0.34 -0.05 0.11 1.02 -1.26 -4.40 119.74 114.15 1lkf s LYS 48 Ca 0.19 -0.28 -0.15 0.00 0.02 0.00 0.00 55.97 55.76 1lkf s LYS 48 Cb 0.15 0.14 -0.05 0.00 -0.52 0.00 0.00 37.83 37.55 1lkf s LYS 48 CO 0.05 -0.07 0.38 -0.51 -0.92 0.00 0.00 175.35 174.28 1lkf s ASP 49 N -0.96 6.71 -0.07 2.83 1.01 -0.40 -4.70 116.67 121.09 1lkf s ASP 49 Ca -0.11 0.84 0.03 0.00 0.71 0.00 0.00 52.55 54.03 1lkf s ASP 49 Cb -0.06 -2.23 -0.02 0.00 1.01 0.00 0.00 42.92 41.61 1lkf s ASP 49 CO 0.01 0.25 -0.16 -0.89 0.21 0.00 0.00 175.17 174.58 1lkf s THR 50 N -0.59 2.84 -0.15 -1.27 2.01 -1.10 -1.25 115.64 116.14 1lkf s THR 50 Ca 0.22 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1lkf s THR 50 Cb -0.16 -2.11 0.02 0.00 0.01 0.00 0.00 72.50 70.26 1lkf s THR 50 CO 0.11 0.57 -0.14 -0.22 -0.69 0.00 0.00 174.62 174.25 1lkf s LEU 51 N -0.41 1.69 -0.40 4.42 2.96 -0.02 -0.06 118.68 126.86 1lkf s LEU 51 Ca 0.04 -0.48 -0.08 0.00 -0.22 0.00 0.00 54.13 53.38 1lkf s LEU 51 Cb -0.12 -1.18 0.07 0.00 0.50 0.00 0.00 46.19 45.46 1lkf s LEU 51 CO 0.02 -0.05 0.22 -0.69 -1.32 0.00 0.00 176.35 174.53 1lkf s VAL 52 N 1.46 4.12 -0.26 1.68 1.01 0.48 -0.67 120.40 128.22 1lkf s VAL 52 Ca 0.04 -1.35 -0.14 0.00 0.00 0.00 0.00 61.98 60.53 1lkf s VAL 52 Cb -0.13 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 1lkf s VAL 52 CO -0.10 -0.44 0.35 -0.22 0.00 0.00 0.00 175.10 174.69 1lkf s LEU 53 N 1.41 4.05 -0.26 3.92 2.96 -0.25 -0.66 118.68 129.85 1lkf s LEU 53 Ca 0.02 0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 54.12 1lkf s LEU 53 Cb -0.22 -2.39 -0.03 0.00 0.50 0.00 0.00 46.19 44.05 1lkf s LEU 53 CO 0.02 -0.15 0.10 -0.75 -1.32 0.00 0.00 176.35 174.25 1lkf s LYS 54 N 1.93 3.64 -0.26 1.98 2.20 -0.05 -1.25 119.74 127.92 1lkf s LYS 54 Ca 0.14 -0.50 -0.08 0.00 -0.36 0.00 0.00 55.97 55.17 1lkf s LYS 54 Cb -0.16 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 1lkf s LYS 54 CO 0.10 -0.22 0.10 0.00 -0.36 0.00 0.00 175.35 174.96 1lkf s ALA 55 N 1.63 3.21 0.00 3.13 0.00 0.84 -0.78 121.76 129.79 1lkf s ALA 55 Ca 0.06 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1lkf s ALA 55 Cb -0.16 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 20.79 1lkf s ALA 55 CO 0.05 -0.57 0.00 0.25 0.00 0.00 0.00 175.76 175.48 1lkf n THR 56 N 4.95 0.00 0.00 0.00 -2.24 0.79 -1.35 114.28 116.42 1lkf n THR 56 Ca -0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1lkf n THR 56 Cb 0.51 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1lkf n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lkf n GLY 57 N 1.74 0.10 3.25 3.38 0.00 -1.25 -1.18 105.19 111.24 1lkf n GLY 57 Ca 0.00 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 1lkf n GLY 57 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1lkf s ASN 58 N -4.00 -0.30 -0.22 1.61 2.47 0.04 -4.04 114.94 110.51 1lkf s ASN 58 Ca 0.00 0.45 -0.02 0.00 0.42 0.00 0.00 52.86 53.70 1lkf s ASN 58 Cb 0.00 0.55 0.07 0.00 -1.45 0.00 0.00 41.25 40.42 1lkf s ASN 58 CO 0.00 -0.27 0.05 -0.63 -3.72 0.00 0.00 177.10 172.53 1lkf s ILE 59 N -0.48 0.59 0.69 -5.21 1.01 0.27 0.15 121.20 118.21 1lkf s ILE 59 Ca -0.06 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 59.69 1lkf s ILE 59 Cb -0.04 -1.17 0.02 0.00 0.01 0.00 0.00 42.46 41.28 1lkf s ILE 59 CO 0.02 -0.31 1.22 0.21 0.00 0.00 0.00 174.94 176.08 1lkf s ASN 60 N 1.81 4.47 0.32 3.58 3.84 -0.68 -0.75 114.94 127.53 1lkf s ASN 60 Ca 0.01 2.40 0.16 0.00 0.21 0.00 0.00 52.86 55.65 1lkf s ASN 60 Cb -0.17 -2.60 0.39 0.00 -0.55 0.00 0.00 41.25 38.32 1lkf s ASN 60 CO -0.12 -2.08 1.59 0.77 -2.79 0.00 0.00 177.10 174.47 1lkf h SER 61 N 0.08 0.00 -0.15 -4.21 4.64 -1.63 -3.45 113.55 108.83 1lkf h SER 61 Ca -0.49 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.77 1lkf h SER 61 Cb 1.30 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.37 1lkf h SER 61 CO 0.51 0.48 -0.06 0.61 -0.87 0.00 0.00 176.83 177.51 1lkf n GLY 62 N 0.66 0.63 3.74 -0.77 0.00 -1.26 -3.07 105.19 105.12 1lkf n GLY 62 Ca 0.00 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 1lkf n GLY 62 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1lkf n PHE 63 N -2.85 2.83 -3.99 1.61 7.35 -1.26 -4.65 117.46 116.49 1lkf n PHE 63 Ca -0.03 0.26 -0.29 0.00 -0.76 0.00 0.00 57.45 56.64 1lkf n PHE 63 Cb 0.13 -2.59 -0.17 0.00 0.35 0.00 0.00 39.48 37.20 1lkf n PHE 63 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1lkf s VAL 64 N -0.02 1.35 0.83 -2.13 1.01 -0.50 -4.96 120.40 115.97 1lkf s VAL 64 Ca 0.64 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 1lkf s VAL 64 Cb -0.50 -1.30 0.09 0.00 0.00 0.00 0.00 36.38 34.68 1lkf s VAL 64 CO 0.49 0.42 1.18 -0.54 0.00 0.00 0.00 175.10 176.65 1lkf s LYS 65 N 1.56 1.55 0.64 2.72 1.02 -1.26 -2.57 119.74 123.39 1lkf s LYS 65 Ca 0.04 1.67 -0.10 0.00 0.02 0.00 0.00 55.97 57.60 1lkf s LYS 65 Cb -0.13 -1.77 -0.02 0.00 -0.52 0.00 0.00 37.83 35.39 1lkf s LYS 65 CO -0.09 -2.26 1.03 -1.25 -0.92 0.00 0.00 175.35 171.85 1lkf s PRO 66 N -4.29 3.29 -0.31 -1.68 0.04 -1.26 -4.86 135.00 125.94 1lkf s PRO 66 Ca 0.71 0.56 -0.27 0.00 0.04 0.00 0.00 61.00 62.04 1lkf s PRO 66 Cb -0.26 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.19 1lkf s PRO 66 CO 0.52 -0.72 0.96 1.21 0.04 0.00 0.00 177.00 179.02 1lkf s ASN 67 N -4.25 6.85 0.12 6.66 3.84 -1.26 -4.92 114.94 121.98 1lkf s ASN 67 Ca 0.56 0.94 0.09 0.00 0.21 0.00 0.00 52.86 54.66 1lkf s ASN 67 Cb -0.11 -2.49 0.49 0.00 -0.55 0.00 0.00 41.25 38.59 1lkf s ASN 67 CO 0.52 -0.76 1.29 -0.81 -2.79 0.00 0.00 177.10 174.55 1lkf n PRO 68 N 6.56 0.06 0.00 0.43 -0.04 -1.26 -1.99 135.00 138.76 1lkf n PRO 68 Ca 0.09 0.53 0.13 0.00 -0.04 0.00 0.00 63.50 64.20 1lkf n PRO 68 Cb 0.47 -1.67 0.36 0.00 -0.04 0.00 0.00 33.50 32.62 1lkf n PRO 68 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1lkf n ASN 69 N -1.79 1.17 -4.67 3.54 3.02 -1.26 -4.38 115.26 110.89 1lkf n ASN 69 Ca -0.00 -1.01 -0.42 0.00 -0.03 0.00 0.00 54.58 53.12 1lkf n ASN 69 Cb 0.03 0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 1lkf n ASN 69 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1lkf s ASP 70 N -2.45 6.70 -0.14 6.41 1.01 -0.84 -4.92 116.67 122.44 1lkf s ASP 70 Ca 0.25 2.24 -0.10 0.00 0.71 0.00 0.00 52.55 55.65 1lkf s ASP 70 Cb 0.19 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.55 1lkf s ASP 70 CO 0.51 -0.88 -0.17 0.00 0.21 0.00 0.00 175.17 174.83 1lkf n TYR 71 N 6.55 0.92 0.83 4.23 9.36 -1.26 -0.62 117.16 137.18 1lkf n TYR 71 Ca 0.16 0.40 0.09 0.00 3.32 0.00 0.00 57.90 61.88 1lkf n TYR 71 Cb 0.43 -0.78 -0.12 0.00 -0.63 0.00 0.00 39.34 38.24 1lkf n TYR 71 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1lkf n ASP 72 N -4.61 0.87 -3.77 2.98 8.00 -1.26 -0.18 116.55 118.58 1lkf n ASP 72 Ca -0.08 -0.86 -0.13 0.00 0.71 0.00 0.00 54.79 54.43 1lkf n ASP 72 Cb 0.28 1.10 -0.13 0.00 -0.02 0.00 0.00 41.12 42.35 1lkf n ASP 72 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1lkf s PHE 73 N -2.94 -0.22 0.11 1.24 5.36 -1.26 -0.58 117.98 119.69 1lkf s PHE 73 Ca 0.06 0.56 -0.16 0.00 -0.96 0.00 0.00 56.93 56.43 1lkf s PHE 73 Cb 0.15 0.01 0.03 0.00 -0.34 0.00 0.00 43.02 42.87 1lkf s PHE 73 CO 0.82 -0.15 0.39 0.45 -1.46 0.00 0.00 175.22 175.26 1lkf s SER 74 N 0.75 -0.21 0.11 6.13 0.15 -0.60 -4.72 113.70 115.31 1lkf s SER 74 Ca -0.05 -0.31 -0.10 0.00 0.70 0.00 0.00 55.95 56.19 1lkf s SER 74 Cb -0.07 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 1lkf s SER 74 CO -0.04 -0.82 0.24 -1.59 1.20 0.00 0.00 173.24 172.23 1lkf s LYS 75 N -3.66 0.93 0.07 5.44 -2.85 -1.26 -0.86 119.74 117.54 1lkf s LYS 75 Ca 0.02 -0.94 -0.06 0.00 -1.00 0.00 0.00 55.97 53.99 1lkf s LYS 75 Cb 0.02 0.37 -0.01 0.00 -2.06 0.00 0.00 37.83 36.14 1lkf s LYS 75 CO -0.11 -0.32 0.11 -0.48 0.10 0.00 0.00 175.35 174.65 1lkf s LEU 76 N -2.86 1.81 -0.03 2.77 2.34 0.18 -4.19 118.68 118.70 1lkf s LEU 76 Ca 0.06 -0.72 0.04 0.00 0.06 0.00 0.00 54.13 53.57 1lkf s LEU 76 Cb 0.04 0.70 -0.03 0.00 -0.56 0.00 0.00 46.19 46.34 1lkf s LEU 76 CO -0.10 -0.64 -0.14 -0.31 -1.06 0.00 0.00 176.35 174.10 1lkf s TYR 77 N -3.60 2.69 0.03 3.48 2.02 -1.06 -0.87 117.35 120.04 1lkf s TYR 77 Ca 0.03 -0.16 -0.01 0.00 -0.37 0.00 0.00 57.07 56.56 1lkf s TYR 77 Cb 0.04 -1.59 -0.02 0.00 -0.40 0.00 0.00 41.96 39.99 1lkf s TYR 77 CO -0.09 0.22 -0.01 1.67 -1.57 0.00 0.00 175.55 175.77 1lkf s TRP 78 N -0.80 0.29 -0.74 2.71 1.48 -0.75 -1.42 118.94 119.72 1lkf s TRP 78 Ca 0.13 -0.61 -0.27 0.00 -1.06 0.00 0.00 56.10 54.29 1lkf s TRP 78 Cb -0.11 -0.22 0.03 0.00 -1.16 0.00 0.00 33.47 32.01 1lkf s TRP 78 CO 0.02 -0.25 1.34 0.20 -4.06 0.00 0.00 176.95 174.20 1lkf s GLY 79 N -1.81 0.84 0.05 3.67 0.00 -0.11 -1.18 107.32 108.78 1lkf s GLY 79 Ca -0.10 -1.35 0.15 0.00 0.00 0.00 0.00 44.72 43.41 1lkf s GLY 79 CO -0.03 2.72 0.84 0.00 0.00 0.00 0.00 173.10 176.63 1lkf h ALA 80 N 10.44 0.68 -2.40 3.20 0.00 -1.52 -3.33 119.26 126.32 1lkf h ALA 80 Ca -0.25 -0.99 -0.08 0.00 0.00 0.00 0.00 54.91 53.59 1lkf h ALA 80 Cb 1.06 0.30 -0.23 0.00 0.00 0.00 0.00 17.79 18.91 1lkf h ALA 80 CO 1.28 1.10 -0.11 0.21 0.00 0.00 0.00 179.25 181.73 1lkf s LYS 81 N -2.83 0.60 -0.14 0.00 2.20 -1.10 -0.53 119.74 117.94 1lkf s LYS 81 Ca -0.03 0.84 -0.00 0.00 -0.36 0.00 0.00 55.97 56.41 1lkf s LYS 81 Cb 0.08 0.22 -0.01 0.00 -1.51 0.00 0.00 37.83 36.61 1lkf s LYS 81 CO 0.81 -0.10 -0.13 0.71 -0.36 0.00 0.00 175.35 176.28 1lkf s TYR 82 N 0.72 2.82 -0.10 4.03 2.02 0.43 -0.40 117.35 126.88 1lkf s TYR 82 Ca -0.03 -0.74 0.04 0.00 -0.37 0.00 0.00 57.07 55.97 1lkf s TYR 82 Cb -0.05 -1.87 0.00 0.00 -0.40 0.00 0.00 41.96 39.64 1lkf s TYR 82 CO -0.05 -0.28 -0.23 -0.80 -1.57 0.00 0.00 175.55 172.62 1lkf s ASN 83 N 0.52 2.96 -0.11 2.29 0.01 -0.19 -0.31 114.94 120.10 1lkf s ASN 83 Ca -0.09 -0.53 0.02 0.00 -0.71 0.00 0.00 52.86 51.55 1lkf s ASN 83 Cb -0.16 -1.35 0.01 0.00 0.41 0.00 0.00 41.25 40.16 1lkf s ASN 83 CO 0.04 0.15 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.91 1lkf s VAL 84 N 0.38 1.65 0.01 1.60 1.01 -0.76 0.05 120.40 124.34 1lkf s VAL 84 Ca -0.18 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.10 1lkf s VAL 84 Cb -0.18 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 1lkf s VAL 84 CO 0.08 0.47 -0.14 -0.44 0.00 0.00 0.00 175.10 175.07 1lkf s SER 85 N 0.90 1.69 -0.08 3.32 0.01 0.24 -1.34 113.70 118.45 1lkf s SER 85 Ca -0.08 -0.32 0.03 0.00 1.31 0.00 0.00 55.95 56.89 1lkf s SER 85 Cb -0.15 -0.16 0.01 0.00 0.21 0.00 0.00 66.02 65.92 1lkf s SER 85 CO -0.01 0.14 -0.16 -0.63 0.41 0.00 0.00 173.24 172.98 1lkf s ILE 86 N -0.49 1.46 -0.04 1.44 -1.09 0.45 -0.46 121.20 122.47 1lkf s ILE 86 Ca 0.04 -0.67 0.00 0.00 -2.23 0.00 0.00 60.65 57.80 1lkf s ILE 86 Cb -0.06 -1.30 0.03 0.00 -1.58 0.00 0.00 42.46 39.54 1lkf s ILE 86 CO 0.00 0.43 -0.01 -0.55 -1.23 0.00 0.00 174.94 173.57 1lkf s SER 87 N 0.57 0.78 -0.53 3.58 0.15 -0.31 -1.20 113.70 116.74 1lkf s SER 87 Ca -0.16 -0.07 -0.27 0.00 0.70 0.00 0.00 55.95 56.16 1lkf s SER 87 Cb -0.16 -0.33 0.03 0.00 -1.71 0.00 0.00 66.02 63.85 1lkf s SER 87 CO 0.05 -0.10 1.08 -0.55 1.20 0.00 0.00 173.24 174.92 1lkf s SER 88 N 1.13 6.48 0.00 5.45 0.15 0.93 -1.40 113.70 126.44 1lkf s SER 88 Ca -0.08 0.10 0.26 0.00 0.70 0.00 0.00 55.95 56.94 1lkf s SER 88 Cb -0.14 -2.51 0.76 0.00 -1.71 0.00 0.00 66.02 62.43 1lkf s SER 88 CO -0.02 -1.29 1.58 0.00 1.20 0.00 0.00 173.24 174.71 1lkf n GLN 89 N 7.86 0.27 -3.81 5.44 1.13 0.41 -4.89 117.38 123.79 1lkf n GLN 89 Ca 0.08 -0.14 -0.04 0.00 -1.94 0.00 0.00 57.00 54.96 1lkf n GLN 89 Cb 0.49 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.34 1lkf n GLN 89 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1lkf s SER 90 N -2.82 -0.11 -0.08 1.08 1.04 -1.24 -4.88 113.70 106.69 1lkf s SER 90 Ca 0.17 -0.60 -0.05 0.00 0.48 0.00 0.00 55.95 55.94 1lkf s SER 90 Cb 0.18 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.89 1lkf s SER 90 CO 0.61 -1.08 0.11 -3.20 0.98 0.00 0.00 173.24 170.65 1lkf n ASN 91 N -0.79 -1.88 0.00 7.02 2.85 -1.26 -4.19 115.26 117.00 1lkf n ASN 91 Ca -0.05 0.72 0.06 0.00 -0.11 0.00 0.00 54.58 55.19 1lkf n ASN 91 Cb 0.60 -3.13 0.33 0.00 1.24 0.00 0.00 39.78 38.82 1lkf n ASN 91 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1lkf n ASP 92 N 0.86 0.00 0.05 1.20 2.03 -1.26 -1.98 116.55 117.45 1lkf n ASP 92 Ca -0.18 -0.06 0.12 0.00 0.52 0.00 0.00 54.79 55.19 1lkf n ASP 92 Cb 0.28 -0.19 0.19 0.00 -0.72 0.00 0.00 41.12 40.68 1lkf n ASP 92 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1lkf n SER 93 N -1.19 0.65 -4.70 1.67 7.64 -1.26 -4.84 113.62 111.58 1lkf n SER 93 Ca 0.07 0.08 -0.35 0.00 1.01 0.00 0.00 58.87 59.68 1lkf n SER 93 Cb 0.08 0.16 -0.09 0.00 -1.01 0.00 0.00 64.21 63.35 1lkf n SER 93 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1lkf s VAL 94 N -3.14 4.90 0.04 0.44 1.01 -0.84 -0.85 120.40 121.96 1lkf s VAL 94 Ca 0.07 -0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1lkf s VAL 94 Cb 0.14 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.33 1lkf s VAL 94 CO 0.71 0.52 -0.06 0.20 0.00 0.00 0.00 175.10 176.47 1lkf s ASN 95 N -0.19 0.70 -0.47 3.32 0.02 -0.13 -4.93 114.94 113.26 1lkf s ASN 95 Ca 0.08 -0.56 -0.24 0.00 -1.02 0.00 0.00 52.86 51.12 1lkf s ASN 95 Cb -0.12 0.06 0.03 0.00 0.02 0.00 0.00 41.25 41.24 1lkf s ASN 95 CO 0.01 -0.24 0.83 -0.69 0.02 0.00 0.00 177.10 177.03 1lkf s VAL 96 N -1.52 4.58 -0.20 1.60 1.01 0.89 -0.38 120.40 126.39 1lkf s VAL 96 Ca -0.10 0.43 0.18 0.00 0.00 0.00 0.00 61.98 62.48 1lkf s VAL 96 Cb -0.09 -4.38 -0.25 0.00 0.00 0.00 0.00 36.38 31.66 1lkf s VAL 96 CO -0.00 -0.81 0.07 1.33 0.00 0.00 0.00 175.10 175.69 1lkf n VAL 97 N 6.19 1.35 -3.99 2.92 0.24 -0.16 -4.53 118.33 120.36 1lkf n VAL 97 Ca 0.03 -0.84 -0.09 0.00 -2.04 0.00 0.00 64.34 61.39 1lkf n VAL 97 Cb 0.48 -0.47 -0.06 0.00 -1.47 0.00 0.00 33.84 32.32 1lkf n VAL 97 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1lkf s ASP 98 N -5.44 -0.06 0.00 -1.34 1.01 -1.18 -5.01 116.67 104.66 1lkf s ASP 98 Ca -0.10 -0.92 -0.29 0.00 0.71 0.00 0.00 52.55 51.95 1lkf s ASP 98 Cb 0.06 0.54 0.10 0.00 1.01 0.00 0.00 42.92 44.63 1lkf s ASP 98 CO 0.81 -1.06 1.10 -0.72 0.21 0.00 0.00 175.17 175.51 1lkf s TYR 99 N -4.01 -0.14 -0.10 4.23 -0.85 -1.26 0.15 117.35 115.37 1lkf s TYR 99 Ca 0.22 -0.02 -0.05 0.00 -0.52 0.00 0.00 57.07 56.71 1lkf s TYR 99 Cb 0.01 0.57 0.04 0.00 0.38 0.00 0.00 41.96 42.96 1lkf s TYR 99 CO 0.07 -0.48 0.22 0.00 -1.52 0.00 0.00 175.55 173.84 1lkf s ALA 100 N -2.82 -0.48 0.63 9.51 0.00 -0.36 -3.88 121.76 124.36 1lkf s ALA 100 Ca 0.11 0.92 -0.16 0.00 0.00 0.00 0.00 51.96 52.82 1lkf s ALA 100 Cb 0.01 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 1lkf s ALA 100 CO -0.03 -0.20 1.13 -1.25 0.00 0.00 0.00 175.76 175.41 1lkf s PRO 101 N 1.26 2.90 0.00 0.00 0.04 -1.26 -1.14 135.00 136.80 1lkf s PRO 101 Ca -0.09 1.51 0.14 0.00 0.04 0.00 0.00 61.00 62.60 1lkf s PRO 101 Cb -0.11 -1.95 -0.12 0.00 0.04 0.00 0.00 34.50 32.36 1lkf s PRO 101 CO -0.08 -1.19 0.64 0.36 0.04 0.00 0.00 177.00 176.77 1lkf n LYS 102 N -2.09 2.26 -4.03 4.56 2.85 -1.25 -5.01 118.16 115.45 1lkf n LYS 102 Ca 0.11 -0.16 -0.08 0.00 -1.05 0.00 0.00 58.31 57.13 1lkf n LYS 102 Cb 0.51 -1.17 -0.10 0.00 -0.65 0.00 0.00 35.03 33.62 1lkf n LYS 102 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1lkf s ASN 103 N -2.20 0.37 0.37 -5.58 3.04 -1.26 -4.99 114.94 104.69 1lkf s ASN 103 Ca 0.07 -0.84 -0.26 0.00 0.04 0.00 0.00 52.86 51.86 1lkf s ASN 103 Cb 0.11 0.21 -0.12 0.00 -1.54 0.00 0.00 41.25 39.91 1lkf s ASN 103 CO 0.53 -0.58 1.15 1.67 -3.04 0.00 0.00 177.10 176.84 1lkf n GLN 104 N 0.32 1.72 -3.65 0.43 7.27 -1.26 -4.87 117.38 117.35 1lkf n GLN 104 Ca -0.16 0.61 -0.10 0.00 0.07 0.00 0.00 57.00 57.42 1lkf n GLN 104 Cb 0.60 -2.16 -0.11 0.00 2.41 0.00 0.00 30.24 30.98 1lkf n GLN 104 CO 0.00 0.00 0.00 1.21 0.07 0.00 0.00 177.06 178.34 1lkf s ASN 105 N -0.52 -0.02 -0.13 1.69 3.84 -0.13 -4.99 114.94 114.68 1lkf s ASN 105 Ca 0.59 0.82 0.15 0.00 0.21 0.00 0.00 52.86 54.63 1lkf s ASN 105 Cb -0.58 1.12 0.47 0.00 -0.55 0.00 0.00 41.25 41.71 1lkf s ASN 105 CO 0.59 -0.24 1.38 -1.84 -2.79 0.00 0.00 177.10 174.21 1lkf n GLU 106 N 5.38 2.97 -2.36 0.43 0.28 -1.26 -0.76 120.64 125.31 1lkf n GLU 106 Ca -0.07 -2.61 -0.36 0.00 -0.16 0.00 0.00 57.16 53.95 1lkf n GLU 106 Cb 0.50 -1.68 -0.02 0.00 1.43 0.00 0.00 31.44 31.67 1lkf n GLU 106 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1lkf s GLU 107 N -2.26 3.70 0.46 3.44 0.41 -1.26 -4.88 118.70 118.31 1lkf s GLU 107 Ca 0.37 1.61 0.11 0.00 -0.41 0.00 0.00 54.97 56.65 1lkf s GLU 107 Cb 0.28 -2.25 1.05 0.00 -1.78 0.00 0.00 34.13 31.43 1lkf s GLU 107 CO 0.11 -0.56 2.10 0.74 -0.49 0.00 0.00 175.26 177.16 1lkf h PHE 108 N 1.76 0.27 -3.37 1.61 0.04 -1.91 -3.39 116.94 111.95 1lkf h PHE 108 Ca -0.49 0.01 -0.55 0.00 2.80 0.00 0.00 57.97 59.73 1lkf h PHE 108 Cb 1.24 -0.09 -0.38 0.00 2.20 0.00 0.00 35.95 38.92 1lkf h PHE 108 CO 0.54 0.18 -0.78 -1.14 -0.60 0.00 0.00 178.31 176.50 1lkf s GLN 109 N -5.28 1.23 -0.22 1.51 2.00 -1.26 -0.73 119.66 116.91 1lkf s GLN 109 Ca -0.07 -0.56 -0.21 0.00 -2.00 0.00 0.00 55.36 52.53 1lkf s GLN 109 Cb 0.17 -2.10 -0.02 0.00 0.80 0.00 0.00 33.01 31.86 1lkf s GLN 109 CO 0.70 -0.51 0.65 0.08 -0.50 0.00 0.00 175.29 175.71 1lkf s VAL 110 N 1.66 4.99 -0.05 1.34 1.01 -0.19 -4.95 120.40 124.20 1lkf s VAL 110 Ca -0.01 1.21 -0.01 0.00 0.00 0.00 0.00 61.98 63.17 1lkf s VAL 110 Cb -0.16 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.28 1lkf s VAL 110 CO -0.07 0.06 0.00 -1.10 0.00 0.00 0.00 175.10 173.99 1lkf s GLN 111 N 2.23 0.46 0.07 2.72 -0.21 -1.26 -1.83 119.66 121.85 1lkf s GLN 111 Ca 0.28 0.11 -0.01 0.00 0.02 0.00 0.00 55.36 55.77 1lkf s GLN 111 Cb -0.16 -0.76 -0.04 0.00 1.00 0.00 0.00 33.01 33.05 1lkf s GLN 111 CO 0.09 -0.23 -0.01 -0.80 -2.12 0.00 0.00 175.29 172.22 1lkf s ASN 112 N 1.61 0.45 -0.04 5.90 0.02 -0.97 -0.13 114.94 121.78 1lkf s ASN 112 Ca -0.01 -1.06 0.02 0.00 -1.02 0.00 0.00 52.86 50.80 1lkf s ASN 112 Cb -0.13 0.23 0.01 0.00 0.02 0.00 0.00 41.25 41.37 1lkf s ASN 112 CO -0.03 -0.63 -0.10 -0.89 0.02 0.00 0.00 177.10 175.46 1lkf s THR 113 N -3.95 0.91 -0.20 1.60 2.01 -0.07 -1.82 115.64 114.11 1lkf s THR 113 Ca 0.12 -0.40 -0.02 0.00 0.31 0.00 0.00 61.69 61.70 1lkf s THR 113 Cb 0.08 -0.82 -0.00 0.00 0.01 0.00 0.00 72.50 71.77 1lkf s THR 113 CO -0.07 0.29 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.83 1lkf s LEU 114 N 0.38 2.65 -0.03 4.42 0.20 0.61 -0.99 118.68 125.92 1lkf s LEU 114 Ca -0.07 -0.46 0.07 0.00 0.69 0.00 0.00 54.13 54.36 1lkf s LEU 114 Cb -0.11 -1.65 -0.02 0.00 -0.43 0.00 0.00 46.19 43.97 1lkf s LEU 114 CO 0.01 0.01 -0.22 -0.83 -0.29 0.00 0.00 176.35 175.03 1lkf s GLY 115 N 1.29 1.36 -0.15 7.98 0.00 0.90 -1.58 107.32 117.11 1lkf s GLY 115 Ca 0.03 -1.08 -0.02 0.00 0.00 0.00 0.00 44.72 43.66 1lkf s GLY 115 CO -0.05 -0.88 -0.09 -0.47 0.00 0.00 0.00 173.10 171.61 1lkf s TYR 116 N -0.65 2.90 -0.06 1.90 6.14 0.08 -0.69 117.35 126.96 1lkf s TYR 116 Ca 0.11 -0.60 -0.02 0.00 0.64 0.00 0.00 57.07 57.19 1lkf s TYR 116 Cb -0.10 -1.92 -0.04 0.00 0.42 0.00 0.00 41.96 40.32 1lkf s TYR 116 CO -0.00 -0.22 0.06 0.99 0.64 0.00 0.00 175.55 177.02 1lkf s THR 117 N 0.55 4.72 -0.14 4.34 2.01 -0.00 -0.94 115.64 126.18 1lkf s THR 117 Ca -0.06 -0.22 -0.37 0.00 0.31 0.00 0.00 61.69 61.35 1lkf s THR 117 Cb -0.15 -3.07 -0.14 0.00 0.01 0.00 0.00 72.50 69.15 1lkf s THR 117 CO 0.03 0.51 1.77 0.49 -0.69 0.00 0.00 174.62 176.73 1lkf n PHE 118 N 1.73 2.16 0.00 4.92 3.01 -1.26 -1.00 117.46 127.01 1lkf n PHE 118 Ca -0.17 0.28 0.00 0.00 1.01 0.00 0.00 57.45 58.57 1lkf n PHE 118 Cb 0.54 -2.55 0.00 0.00 -0.01 0.00 0.00 39.48 37.46 1lkf n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1lkf n GLY 119 N 4.12 1.91 0.00 1.37 0.00 -1.26 -4.76 105.19 106.56 1lkf n GLY 119 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1lkf n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lkf n GLY 120 N 0.00 0.73 3.69 -0.02 0.00 -0.17 -4.69 105.19 104.73 1lkf n GLY 120 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1lkf n GLY 120 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1lkf s ASP 121 N -1.82 6.82 -0.20 1.61 2.15 -1.20 -4.82 116.67 119.21 1lkf s ASP 121 Ca 0.00 2.19 -0.05 0.00 0.43 0.00 0.00 52.55 55.11 1lkf s ASP 121 Cb 0.00 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 40.03 1lkf s ASP 121 CO 0.00 -0.73 0.01 -0.63 -0.17 0.00 0.00 175.17 173.65 1lkf s ILE 122 N 2.22 4.04 -0.08 4.11 -1.09 -1.26 -0.82 121.20 128.31 1lkf s ILE 122 Ca 0.65 -0.28 0.04 0.00 -2.23 0.00 0.00 60.65 58.83 1lkf s ILE 122 Cb -0.33 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 1lkf s ILE 122 CO 0.28 0.42 -0.21 -0.44 -1.23 0.00 0.00 174.94 173.76 1lkf s SER 123 N 1.01 2.70 -0.13 3.58 0.01 0.13 -4.98 113.70 116.02 1lkf s SER 123 Ca 0.02 -0.47 0.02 0.00 1.31 0.00 0.00 55.95 56.83 1lkf s SER 123 Cb -0.14 -1.12 -0.00 0.00 0.21 0.00 0.00 66.02 64.97 1lkf s SER 123 CO 0.02 0.14 -0.20 -0.63 0.41 0.00 0.00 173.24 172.98 1lkf s ILE 124 N 0.31 2.36 0.15 1.44 1.01 -1.26 -0.07 121.20 125.13 1lkf s ILE 124 Ca -0.14 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 59.67 1lkf s ILE 124 Cb -0.16 -1.95 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1lkf s ILE 124 CO 0.06 0.54 -0.13 -0.94 0.00 0.00 0.00 174.94 174.48 1lkf s SER 125 N 0.56 2.04 0.39 3.58 1.04 -0.17 -4.97 113.70 116.17 1lkf s SER 125 Ca -0.12 -0.92 -0.25 0.00 0.48 0.00 0.00 55.95 55.15 1lkf s SER 125 Cb -0.16 -0.06 -0.09 0.00 0.10 0.00 0.00 66.02 65.80 1lkf s SER 125 CO 0.04 -0.21 1.08 0.21 0.98 0.00 0.00 173.24 175.34 1lkf s ASN 126 N -2.85 6.74 0.00 7.02 2.47 -1.26 -0.89 114.94 126.16 1lkf s ASN 126 Ca 0.14 2.12 0.00 0.00 0.42 0.00 0.00 52.86 55.54 1lkf s ASN 126 Cb -0.02 -2.59 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 1lkf s ASN 126 CO 0.03 -0.51 0.00 0.61 -3.72 0.00 0.00 177.10 173.51 1lkf n GLY 127 N 0.47 -2.86 3.44 1.21 0.00 0.82 -4.75 105.19 103.52 1lkf n GLY 127 Ca 0.04 -1.72 -0.44 0.00 0.00 0.00 0.00 46.02 43.91 1lkf n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lkf s LEU 128 N 0.00 5.14 0.00 0.99 1.43 -1.26 -2.63 118.68 122.35 1lkf s LEU 128 Ca 0.00 -0.99 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1lkf s LEU 128 Cb 0.00 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.86 1lkf s LEU 128 CO 0.00 -0.76 0.00 0.35 0.23 0.00 0.00 176.35 176.17 1lkf n THR 136 N 5.47 0.00 0.08 5.49 -2.24 -1.26 -4.95 114.28 116.87 1lkf n THR 136 Ca -0.08 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.68 1lkf n THR 136 Cb 0.45 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.63 1lkf n THR 136 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lkf h ALA 137 N 0.00 0.58 -2.71 6.98 0.00 -1.37 -3.47 119.26 119.26 1lkf h ALA 137 Ca 0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 54.91 54.03 1lkf h ALA 137 Cb 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.57 1lkf h ALA 137 CO 0.00 0.96 -0.28 0.12 0.00 0.00 0.00 179.25 180.05 1lkf s PHE 138 N -2.84 -0.31 -0.04 0.00 5.36 -1.12 -5.00 117.98 114.02 1lkf s PHE 138 Ca 0.01 0.69 -0.08 0.00 -0.96 0.00 0.00 56.93 56.59 1lkf s PHE 138 Cb 0.09 0.12 0.01 0.00 -0.34 0.00 0.00 43.02 42.90 1lkf s PHE 138 CO 0.79 -0.28 0.19 0.45 -1.46 0.00 0.00 175.22 174.91 1lkf s SER 139 N -0.43 -0.12 0.08 6.13 0.15 -1.26 -0.75 113.70 117.50 1lkf s SER 139 Ca -0.06 0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.64 1lkf s SER 139 Cb -0.04 0.33 0.01 0.00 -1.71 0.00 0.00 66.02 64.61 1lkf s SER 139 CO 0.02 -0.21 0.25 -1.61 1.20 0.00 0.00 173.24 172.89 1lkf s GLU 140 N -0.56 0.85 0.13 5.44 0.41 -0.61 -5.01 118.70 119.35 1lkf s GLU 140 Ca -0.07 -0.77 0.06 0.00 -0.41 0.00 0.00 54.97 53.78 1lkf s GLU 140 Cb -0.04 0.36 -0.04 0.00 -1.78 0.00 0.00 34.13 32.63 1lkf s GLU 140 CO 0.01 -0.28 -0.13 0.95 -0.49 0.00 0.00 175.26 175.32 1lkf s THR 141 N -3.37 1.30 -0.02 3.63 -4.23 -1.26 -0.28 115.64 111.41 1lkf s THR 141 Ca 0.01 -1.79 0.07 0.00 -1.18 0.00 0.00 61.69 58.80 1lkf s THR 141 Cb 0.02 -1.59 -0.02 0.00 1.34 0.00 0.00 72.50 72.26 1lkf s THR 141 CO -0.08 -0.48 -0.22 0.27 -0.54 0.00 0.00 174.62 173.57 1lkf s ILE 142 N -2.37 1.71 -0.22 2.99 -5.25 -0.76 -4.97 121.20 112.33 1lkf s ILE 142 Ca 0.10 -0.93 -0.05 0.00 -0.99 0.00 0.00 60.65 58.79 1lkf s ILE 142 Cb -0.03 -1.42 0.11 0.00 2.95 0.00 0.00 42.46 44.07 1lkf s ILE 142 CO 0.03 0.48 0.43 0.21 -1.79 0.00 0.00 174.94 174.30 1lkf s ASN 143 N -0.50 -0.20 -0.02 4.36 3.84 -1.25 -2.30 114.94 118.87 1lkf s ASN 143 Ca 0.08 0.76 -0.17 0.00 0.21 0.00 0.00 52.86 53.74 1lkf s ASN 143 Cb -0.08 1.36 0.03 0.00 -0.55 0.00 0.00 41.25 42.01 1lkf s ASN 143 CO -0.01 -0.26 0.36 -0.72 -2.79 0.00 0.00 177.10 173.68 1lkf s TYR 144 N 2.62 -0.25 -0.09 0.43 -0.85 -0.76 -4.67 117.35 113.78 1lkf s TYR 144 Ca 0.04 0.40 -0.13 0.00 -0.52 0.00 0.00 57.07 56.86 1lkf s TYR 144 Cb -0.13 0.14 -0.05 0.00 0.38 0.00 0.00 41.96 42.29 1lkf s TYR 144 CO -0.14 -0.41 0.31 0.21 -1.52 0.00 0.00 175.55 173.99 1lkf s LYS 145 N -1.26 3.94 -0.32 -3.49 2.20 -1.26 -1.02 119.74 118.53 1lkf s LYS 145 Ca -0.13 0.18 0.17 0.00 -0.36 0.00 0.00 55.97 55.83 1lkf s LYS 145 Cb -0.04 -3.29 0.45 0.00 -1.51 0.00 0.00 37.83 33.44 1lkf s LYS 145 CO 0.05 0.54 1.22 0.00 -0.36 0.00 0.00 175.35 176.79 1lkf n GLN 146 N 2.52 1.40 -1.64 4.03 10.64 0.09 -4.84 117.38 129.58 1lkf n GLN 146 Ca -0.14 -2.60 -0.49 0.00 -1.83 0.00 0.00 57.00 51.94 1lkf n GLN 146 Cb 0.53 -0.75 -0.05 0.00 -0.86 0.00 0.00 30.24 29.10 1lkf n GLN 146 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 1lkf n GLU 147 N -0.68 1.74 -0.40 2.61 2.13 -1.24 -1.16 120.64 123.65 1lkf n GLU 147 Ca -0.00 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.45 1lkf n GLU 147 Cb 0.83 -2.35 0.00 0.00 0.27 0.00 0.00 31.44 30.19 1lkf n GLU 147 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1lkf n SER 148 N 3.20 0.00 -4.82 4.31 7.64 -1.26 -4.73 113.62 117.96 1lkf n SER 148 Ca 0.18 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.82 1lkf n SER 148 Cb 0.25 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.40 1lkf n SER 148 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1lkf s TYR 149 N -3.37 2.46 -0.01 1.43 1.51 -0.30 -0.18 117.35 118.89 1lkf s TYR 149 Ca 0.00 -0.60 0.01 0.00 -1.01 0.00 0.00 57.07 55.47 1lkf s TYR 149 Cb 0.00 -2.03 0.00 0.00 -0.11 0.00 0.00 41.96 39.83 1lkf s TYR 149 CO 0.00 -0.04 -0.03 0.50 -1.11 0.00 0.00 175.55 174.87 1lkf s ARG 150 N -4.05 0.32 -0.19 -0.62 3.52 0.31 -4.71 118.95 113.53 1lkf s ARG 150 Ca 0.42 -0.10 -0.11 0.00 -0.13 0.00 0.00 55.73 55.81 1lkf s ARG 150 Cb 0.00 -0.34 -0.05 0.00 -1.56 0.00 0.00 34.95 33.00 1lkf s ARG 150 CO 0.24 0.04 0.17 0.99 -0.81 0.00 0.00 175.30 175.93 1lkf s THR 151 N 0.11 5.38 0.11 4.11 2.01 0.06 -0.75 115.64 126.68 1lkf s THR 151 Ca -0.01 0.29 0.04 0.00 0.31 0.00 0.00 61.69 62.32 1lkf s THR 151 Cb -0.04 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 1lkf s THR 151 CO -0.00 0.43 -0.10 0.42 -0.69 0.00 0.00 174.62 174.67 1lkf s THR 152 N 0.35 1.02 -0.04 -0.82 -4.23 0.12 -0.95 115.64 111.10 1lkf s THR 152 Ca 0.10 -1.77 -0.21 0.00 -1.18 0.00 0.00 61.69 58.64 1lkf s THR 152 Cb -0.12 -1.51 -0.05 0.00 1.34 0.00 0.00 72.50 72.16 1lkf s THR 152 CO -0.00 -0.61 0.61 -0.76 -0.54 0.00 0.00 174.62 173.32 1lkf s LEU 153 N -2.66 4.36 0.56 4.79 2.01 -1.26 -0.99 118.68 125.50 1lkf s LEU 153 Ca 0.09 1.12 -0.20 0.00 0.01 0.00 0.00 54.13 55.15 1lkf s LEU 153 Cb -0.01 -2.94 -0.05 0.00 0.01 0.00 0.00 46.19 43.19 1lkf s LEU 153 CO 0.00 0.02 1.10 -1.54 1.01 0.00 0.00 176.35 176.94 1lkf n SER 154 N 3.20 1.47 -0.05 2.29 3.41 -0.14 -4.90 113.62 118.90 1lkf n SER 154 Ca -0.05 0.89 -0.01 0.00 -0.26 0.00 0.00 58.87 59.44 1lkf n SER 154 Cb 0.51 -1.45 0.25 0.00 -0.26 0.00 0.00 64.21 63.26 1lkf n SER 154 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1lkf h ARG 155 N 0.92 0.65 -0.46 4.33 3.08 -1.95 -2.88 114.38 118.06 1lkf h ARG 155 Ca -0.49 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.42 1lkf h ARG 155 Cb 1.34 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1lkf h ARG 155 CO 0.54 0.64 0.00 0.27 -1.07 0.00 0.00 179.97 180.35 1lkf n ASN 156 N -4.27 0.46 -4.69 7.04 0.23 -1.26 -4.85 115.26 107.92 1lkf n ASN 156 Ca 0.02 -1.84 -0.42 0.00 -0.53 0.00 0.00 54.58 51.81 1lkf n ASN 156 Cb 0.24 -0.23 -0.03 0.00 -2.08 0.00 0.00 39.78 37.68 1lkf n ASN 156 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1lkf s THR 157 N -1.50 3.38 0.00 5.53 2.01 -1.09 -4.80 115.64 119.17 1lkf s THR 157 Ca 0.00 0.83 0.00 0.00 0.31 0.00 0.00 61.69 62.83 1lkf s THR 157 Cb 0.00 -3.54 0.00 0.00 0.01 0.00 0.00 72.50 68.97 1lkf s THR 157 CO 0.00 0.01 0.00 -0.46 -0.69 0.00 0.00 174.62 173.48 1lkf n ASN 158 N 5.20 0.00 0.00 3.53 0.23 -0.49 -4.98 115.26 118.75 1lkf n ASN 158 Ca 0.14 -0.34 0.06 0.00 -0.53 0.00 0.00 54.58 53.91 1lkf n ASN 158 Cb 0.42 0.00 0.30 0.00 -2.08 0.00 0.00 39.78 38.43 1lkf n ASN 158 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1lkf n TYR 159 N 0.00 0.00 -0.82 -2.53 4.11 -1.26 -2.50 117.16 114.16 1lkf n TYR 159 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1lkf n TYR 159 Cb 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 39.34 39.10 1lkf n TYR 159 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1lkf n LYS 160 N -1.24 0.51 -3.79 -3.48 5.02 -1.26 -0.08 118.16 113.85 1lkf n LYS 160 Ca 0.06 -0.66 -0.13 0.00 -2.02 0.00 0.00 58.31 55.56 1lkf n LYS 160 Cb 0.09 -0.59 -0.12 0.00 -0.02 0.00 0.00 35.03 34.39 1lkf n LYS 160 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1lkf s ASN 161 N -0.17 -0.23 -0.02 4.39 -0.87 -1.04 -0.05 114.94 116.94 1lkf s ASN 161 Ca 0.00 0.45 -0.02 0.00 -1.57 0.00 0.00 52.86 51.72 1lkf s ASN 161 Cb 0.00 0.44 0.00 0.00 -0.02 0.00 0.00 41.25 41.68 1lkf s ASN 161 CO 0.00 -0.09 0.06 0.54 -2.57 0.00 0.00 177.10 175.05 1lkf s VAL 162 N 0.26 0.01 0.08 1.60 0.11 -0.34 -1.40 120.40 120.72 1lkf s VAL 162 Ca -0.01 -0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 58.84 1lkf s VAL 162 Cb -0.03 -0.12 0.02 0.00 -1.53 0.00 0.00 36.38 34.72 1lkf s VAL 162 CO -0.01 -0.04 0.28 -0.83 -3.33 0.00 0.00 175.10 171.17 1lkf s GLY 163 N -0.11 -0.08 0.04 6.54 0.00 -1.26 -0.41 107.32 112.05 1lkf s GLY 163 Ca -0.01 -0.24 0.03 0.00 0.00 0.00 0.00 44.72 44.49 1lkf s GLY 163 CO 0.00 -0.46 -0.09 -0.98 0.00 0.00 0.00 173.10 171.57 1lkf s TRP 164 N -3.35 0.81 -0.06 1.90 0.51 -0.45 -0.96 118.94 117.34 1lkf s TRP 164 Ca 0.01 -0.45 0.04 0.00 -2.12 0.00 0.00 56.10 53.57 1lkf s TRP 164 Cb 0.02 -0.48 0.00 0.00 -0.81 0.00 0.00 33.47 32.21 1lkf s TRP 164 CO -0.08 -0.04 -0.16 0.20 -0.51 0.00 0.00 176.95 176.36 1lkf s GLY 165 N -1.48 0.92 -0.36 0.98 0.00 -0.16 -1.82 107.32 105.39 1lkf s GLY 165 Ca -0.07 -0.62 0.02 0.00 0.00 0.00 0.00 44.72 44.05 1lkf s GLY 165 CO 0.01 -0.18 0.10 0.14 0.00 0.00 0.00 173.10 173.16 1lkf s VAL 166 N 0.29 2.61 0.05 1.40 1.01 0.57 -0.70 120.40 125.63 1lkf s VAL 166 Ca -0.09 -2.25 0.08 0.00 0.00 0.00 0.00 61.98 59.72 1lkf s VAL 166 Cb -0.14 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 1lkf s VAL 166 CO 0.03 -0.62 -0.23 -0.70 0.00 0.00 0.00 175.10 173.59 1lkf s GLU 167 N 0.98 1.88 0.07 2.72 2.12 0.07 -0.43 118.70 126.11 1lkf s GLU 167 Ca 0.10 -1.08 -0.36 0.00 0.36 0.00 0.00 54.97 53.99 1lkf s GLU 167 Cb -0.20 -2.07 -0.16 0.00 0.26 0.00 0.00 34.13 31.96 1lkf s GLU 167 CO -0.07 0.52 1.42 0.00 -0.54 0.00 0.00 175.26 176.59 1lkf n ALA 168 N 1.57 -0.48 -0.08 6.30 0.00 0.31 -0.53 120.51 127.60 1lkf n ALA 168 Ca -0.17 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1lkf n ALA 168 Cb 0.52 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1lkf n ALA 168 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1lkf n HIS 169 N 2.99 0.00 -3.85 0.00 -0.00 0.75 -4.59 115.22 110.52 1lkf n HIS 169 Ca 0.19 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 58.07 1lkf n HIS 169 Cb 0.20 0.08 -0.14 0.00 -0.12 0.00 0.00 29.99 30.02 1lkf n HIS 169 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 1lkf s LYS 170 N -0.92 1.42 -0.26 1.57 1.02 -0.69 -4.26 119.74 117.62 1lkf s LYS 170 Ca 0.00 -2.00 -0.06 0.00 0.02 0.00 0.00 55.97 53.94 1lkf s LYS 170 Cb 0.00 -2.74 -0.01 0.00 -0.52 0.00 0.00 37.83 34.56 1lkf s LYS 170 CO 0.00 -1.07 0.04 0.42 -0.92 0.00 0.00 175.35 173.82 1lkf s ILE 171 N 0.50 3.87 0.04 2.17 1.01 -0.28 -4.53 121.20 123.99 1lkf s ILE 171 Ca 0.15 -0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.17 1lkf s ILE 171 Cb -0.23 -2.86 -0.06 0.00 0.01 0.00 0.00 42.46 39.32 1lkf s ILE 171 CO -0.06 0.28 0.49 -0.04 0.00 0.00 0.00 174.94 175.60 1lkf s MET 172 N 1.53 4.04 -0.02 2.79 -1.94 -1.26 -0.13 119.30 124.30 1lkf s MET 172 Ca 0.05 0.55 -0.00 0.00 -1.71 0.00 0.00 55.69 54.57 1lkf s MET 172 Cb -0.16 -3.20 -0.00 0.00 2.01 0.00 0.00 34.83 33.48 1lkf s MET 172 CO 0.01 0.65 -0.01 -0.97 -0.01 0.00 0.00 175.02 174.69 1lkf h ASN 173 N 4.53 0.00 0.00 3.03 -0.73 -1.55 -3.48 115.58 117.38 1lkf h ASN 173 Ca -0.51 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.66 1lkf h ASN 173 Cb 1.21 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.80 1lkf h ASN 173 CO 0.63 0.11 0.00 0.59 -0.37 0.00 0.00 177.43 178.38 1lkf n ASN 174 N -2.58 0.00 -0.09 1.15 3.02 -1.26 -4.90 115.26 110.60 1lkf n ASN 174 Ca -0.00 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.59 1lkf n ASN 174 Cb 0.01 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 1lkf n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lkf n GLY 175 N 2.47 0.04 3.76 7.41 0.00 -1.26 -5.00 105.19 112.62 1lkf n GLY 175 Ca 0.00 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 1lkf n GLY 175 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1lkf s TRP 176 N -1.58 3.78 0.00 1.61 -2.14 -1.26 -4.91 118.94 114.44 1lkf s TRP 176 Ca 0.05 1.83 0.00 0.00 2.66 0.00 0.00 56.10 60.64 1lkf s TRP 176 Cb 0.07 -3.01 0.00 0.00 -3.10 0.00 0.00 33.47 27.43 1lkf s TRP 176 CO 0.30 0.17 0.00 0.41 -2.66 0.00 0.00 176.95 175.17 1lkf n GLY 177 N 1.04 0.49 3.79 3.67 0.00 -1.26 -1.53 105.19 111.40 1lkf n GLY 177 Ca -0.00 -2.27 -0.32 0.00 0.00 0.00 0.00 46.02 43.43 1lkf n GLY 177 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lkf s PRO 178 N 0.00 2.84 0.24 1.61 0.04 -1.26 -5.04 135.00 133.43 1lkf s PRO 178 Ca 0.00 1.17 0.11 0.00 0.04 0.00 0.00 61.00 62.32 1lkf s PRO 178 Cb 0.00 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 1lkf s PRO 178 CO 0.00 -1.19 -0.20 0.71 0.04 0.00 0.00 177.00 176.36 1lkf s TYR 179 N -2.69 2.20 0.09 0.56 2.02 0.81 -4.80 117.35 115.54 1lkf s TYR 179 Ca 0.62 -0.37 0.01 0.00 -0.37 0.00 0.00 57.07 56.96 1lkf s TYR 179 Cb -0.17 -1.00 -0.00 0.00 -0.40 0.00 0.00 41.96 40.38 1lkf s TYR 179 CO 0.47 0.60 0.04 0.41 -1.57 0.00 0.00 175.55 175.50 1lkf n GLY 180 N -0.30 3.87 0.28 0.71 0.00 -1.26 -1.12 105.19 107.37 1lkf n GLY 180 Ca -0.08 -1.89 0.16 0.00 0.00 0.00 0.00 46.02 44.22 1lkf n GLY 180 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1lkf h ARG 181 N 0.00 0.00 0.00 1.61 3.08 -1.89 -3.06 114.38 114.13 1lkf h ARG 181 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1lkf h ARG 181 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1lkf h ARG 181 CO 0.10 0.06 -1.43 -0.40 -1.07 0.00 0.00 179.97 177.24 1lkf n ASP 182 N -3.25 0.62 -4.71 7.04 5.75 -1.26 -4.79 116.55 115.95 1lkf n ASP 182 Ca -0.01 -0.51 -0.39 0.00 -0.01 0.00 0.00 54.79 53.87 1lkf n ASP 182 Cb 0.27 1.45 0.03 0.00 -1.03 0.00 0.00 41.12 41.84 1lkf n ASP 182 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1lkf n SER 183 N -1.83 2.45 -3.66 -1.12 3.41 -1.16 -5.02 113.62 106.70 1lkf n SER 183 Ca 0.00 1.02 -0.05 0.00 -0.26 0.00 0.00 58.87 59.58 1lkf n SER 183 Cb 0.42 -1.53 -0.07 0.00 -0.26 0.00 0.00 64.21 62.78 1lkf n SER 183 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1lkf s PHE 184 N -1.27 -1.05 -0.04 7.33 2.19 -1.26 -3.83 117.98 120.05 1lkf s PHE 184 Ca 0.67 1.93 -0.18 0.00 0.33 0.00 0.00 56.93 59.68 1lkf s PHE 184 Cb -0.45 0.56 -0.05 0.00 -1.31 0.00 0.00 43.02 41.76 1lkf s PHE 184 CO 0.53 -0.55 0.50 -1.58 1.83 0.00 0.00 175.22 175.95 1lkf s HIS 185 N 2.46 3.64 0.52 10.12 5.65 -0.12 -4.91 115.29 132.64 1lkf s HIS 185 Ca -0.06 1.03 0.32 0.00 0.25 0.00 0.00 55.06 56.61 1lkf s HIS 185 Cb -0.11 -2.50 1.47 0.00 -1.18 0.00 0.00 32.58 30.26 1lkf s HIS 185 CO -0.16 0.37 1.84 -1.35 -0.65 0.00 0.00 174.74 174.79 1lkf h PRO 186 N 5.74 0.05 0.00 2.88 0.11 -2.01 -0.81 132.00 137.97 1lkf h PRO 186 Ca -0.45 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.37 1lkf h PRO 186 Cb 1.20 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1lkf h PRO 186 CO 0.69 0.03 -1.89 2.41 -0.21 0.00 0.00 178.00 179.04 1lkf n THR 187 N -4.27 1.37 0.87 -1.15 -1.04 -1.26 -4.69 114.28 104.12 1lkf n THR 187 Ca 0.22 -0.18 0.06 0.00 -2.04 0.00 0.00 64.05 62.12 1lkf n THR 187 Cb 1.08 -1.96 0.18 0.00 -1.82 0.00 0.00 70.33 67.80 1lkf n THR 187 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1lkf n TYR 188 N -4.17 0.46 -4.16 -1.42 4.01 -1.20 -4.82 117.16 105.86 1lkf n TYR 188 Ca -0.37 -0.23 0.00 0.00 -0.16 0.00 0.00 57.90 57.14 1lkf n TYR 188 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.75 1lkf n TYR 188 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1lkf n GLY 189 N 1.08 1.17 3.63 2.72 0.00 -0.31 -1.15 105.19 112.34 1lkf n GLY 189 Ca 0.13 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 1lkf n GLY 189 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1lkf s ASN 190 N -4.00 6.89 -0.05 1.61 3.84 0.00 -0.95 114.94 122.28 1lkf s ASN 190 Ca 0.00 0.96 0.17 0.00 0.21 0.00 0.00 52.86 54.20 1lkf s ASN 190 Cb 0.00 -2.54 0.59 0.00 -0.55 0.00 0.00 41.25 38.74 1lkf s ASN 190 CO 0.00 -0.93 1.48 -0.62 -2.79 0.00 0.00 177.10 174.24 1lkf n GLU 191 N 6.99 2.90 -0.34 0.43 1.02 -1.26 -3.47 120.64 126.92 1lkf n GLU 191 Ca 0.12 -2.34 -0.06 0.00 -0.02 0.00 0.00 57.16 54.86 1lkf n GLU 191 Cb 0.47 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.21 1lkf n GLU 191 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1lkf n LEU 192 N 1.13 -0.74 -0.24 -4.62 7.94 -1.26 -2.37 117.00 116.83 1lkf n LEU 192 Ca 0.21 1.47 0.09 0.00 -1.11 0.00 0.00 56.01 56.67 1lkf n LEU 192 Cb 0.66 -0.25 0.16 0.00 0.53 0.00 0.00 43.42 44.51 1lkf n LEU 192 CO 0.17 -1.25 0.52 0.49 -1.11 0.00 0.00 177.39 176.21 1lkf n PHE 193 N -5.12 0.04 -2.62 1.96 3.72 -1.26 -4.67 117.46 109.50 1lkf n PHE 193 Ca 0.05 -1.13 -0.43 0.00 -0.05 0.00 0.00 57.45 55.89 1lkf n PHE 193 Cb 0.27 -0.19 -0.02 0.00 -0.94 0.00 0.00 39.48 38.60 1lkf n PHE 193 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1lkf s LEU 194 N -2.98 4.24 0.16 4.37 2.96 -1.00 -1.02 118.68 125.41 1lkf s LEU 194 Ca 0.34 1.59 0.07 0.00 -0.22 0.00 0.00 54.13 55.90 1lkf s LEU 194 Cb 0.31 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 43.38 1lkf s LEU 194 CO 0.01 -0.51 1.36 0.00 -1.32 0.00 0.00 176.35 175.88 1lkf h ALA 195 N 7.26 0.50 -1.89 5.97 0.00 -1.25 -3.43 119.26 126.42 1lkf h ALA 195 Ca -0.30 -0.81 -0.01 0.00 0.00 0.00 0.00 54.91 53.79 1lkf h ALA 195 Cb 1.14 -0.13 -0.22 0.00 0.00 0.00 0.00 17.79 18.58 1lkf h ALA 195 CO 0.88 1.09 0.21 0.20 0.00 0.00 0.00 179.25 181.62 1lkf s GLY 196 N -4.63 -0.44 0.35 0.00 0.00 -1.26 -4.97 107.32 96.37 1lkf s GLY 196 Ca -0.00 2.24 0.15 0.00 0.00 0.00 0.00 44.72 47.11 1lkf s GLY 196 CO 0.81 1.84 1.74 3.21 0.00 0.00 0.00 173.10 180.70 1lkf h ARG 197 N 4.97 0.00 0.00 2.90 3.08 -1.90 -3.32 114.38 120.11 1lkf h ARG 197 Ca -0.29 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 1lkf h ARG 197 Cb 1.17 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 1lkf h ARG 197 CO 0.07 0.43 -0.29 1.04 -1.07 0.00 0.00 179.97 180.16 1lkf n GLN 198 N -3.77 0.99 -1.70 0.04 1.13 -1.26 -0.50 117.38 112.31 1lkf n GLN 198 Ca -0.01 -2.37 -0.43 0.00 -1.94 0.00 0.00 57.00 52.24 1lkf n GLN 198 Cb 0.50 -1.20 -0.03 0.00 0.11 0.00 0.00 30.24 29.61 1lkf n GLN 198 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1lkf n SER 199 N -0.93 3.74 -4.40 1.08 7.64 -1.25 -4.88 113.62 114.62 1lkf n SER 199 Ca 0.13 1.05 -0.44 0.00 1.01 0.00 0.00 58.87 60.62 1lkf n SER 199 Cb 0.70 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 1lkf n SER 199 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1lkf n SER 200 N 4.19 5.12 -4.06 6.43 2.88 -1.26 -4.88 113.62 122.04 1lkf n SER 200 Ca 0.17 -2.98 -0.10 0.00 -1.33 0.00 0.00 58.87 54.63 1lkf n SER 200 Cb 0.33 -1.60 -0.07 0.00 -0.75 0.00 0.00 64.21 62.13 1lkf n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lkf s ALA 201 N 1.95 0.22 0.41 -1.46 0.00 -1.26 -5.14 121.76 116.48 1lkf s ALA 201 Ca 0.45 -1.14 -0.24 0.00 0.00 0.00 0.00 51.96 51.02 1lkf s ALA 201 Cb 0.00 1.16 -0.09 0.00 0.00 0.00 0.00 23.12 24.20 1lkf s ALA 201 CO 0.01 -0.76 1.08 0.71 0.00 0.00 0.00 175.76 176.80 1lkf s TYR 202 N -4.06 3.20 0.25 0.00 1.51 -1.26 -4.92 117.35 112.06 1lkf s TYR 202 Ca 0.27 1.62 -0.04 0.00 -1.01 0.00 0.00 57.07 57.91 1lkf s TYR 202 Cb 0.02 -3.19 0.38 0.00 -0.11 0.00 0.00 41.96 39.06 1lkf s TYR 202 CO 0.09 -0.80 1.83 0.00 -1.11 0.00 0.00 175.55 175.56 1lkf h ALA 203 N 2.47 1.20 0.00 3.71 0.00 0.50 -0.51 119.26 126.62 1lkf h ALA 203 Ca -0.48 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1lkf h ALA 203 Cb 1.22 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1lkf h ALA 203 CO 0.62 0.18 0.00 0.78 0.00 0.00 0.00 179.25 180.83 1lkf h GLY 204 N 0.87 0.00 -0.96 0.00 0.00 -1.03 -1.42 103.07 100.53 1lkf h GLY 204 Ca 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.69 1lkf h GLY 204 CO -0.22 0.00 -0.12 -1.06 0.00 0.00 0.00 176.54 175.14 1lkf n GLN 205 N -2.48 1.82 -0.55 4.80 6.02 -0.25 -4.29 117.38 122.46 1lkf n GLN 205 Ca -0.00 -2.91 0.06 0.00 -0.01 0.00 0.00 57.00 54.13 1lkf n GLN 205 Cb 0.13 -1.66 0.20 0.00 1.02 0.00 0.00 30.24 29.93 1lkf n GLN 205 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1lkf n ASN 206 N -1.11 1.89 -4.83 1.08 5.15 -0.53 -4.72 115.26 112.18 1lkf n ASN 206 Ca 0.21 -3.78 -0.22 0.00 -0.60 0.00 0.00 54.58 50.19 1lkf n ASN 206 Cb 0.78 -0.53 -0.04 0.00 -0.53 0.00 0.00 39.78 39.47 1lkf n ASN 206 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1lkf s PHE 207 N -3.19 3.02 0.77 1.20 0.40 -1.26 -0.91 117.98 118.01 1lkf s PHE 207 Ca 0.38 -0.19 -0.11 0.00 -0.60 0.00 0.00 56.93 56.41 1lkf s PHE 207 Cb 0.36 -1.56 0.06 0.00 0.51 0.00 0.00 43.02 42.39 1lkf s PHE 207 CO -0.05 0.39 1.08 0.96 0.70 0.00 0.00 175.22 178.30 1lkf s ILE 208 N -2.21 3.40 0.72 0.64 -4.36 -0.19 -4.48 121.20 114.72 1lkf s ILE 208 Ca 0.36 0.45 -0.14 0.00 -0.26 0.00 0.00 60.65 61.07 1lkf s ILE 208 Cb -0.07 -3.06 0.04 0.00 1.25 0.00 0.00 42.46 40.62 1lkf s ILE 208 CO 0.25 -0.59 1.14 0.00 0.24 0.00 0.00 174.94 175.98 1lkf s ALA 209 N -2.99 2.23 0.35 2.27 0.00 -1.26 -4.92 121.76 117.44 1lkf s ALA 209 Ca 0.60 0.62 0.03 0.00 0.00 0.00 0.00 51.96 53.21 1lkf s ALA 209 Cb -0.16 -3.37 0.64 0.00 0.00 0.00 0.00 23.12 20.23 1lkf s ALA 209 CO 0.56 -1.69 2.00 1.96 0.00 0.00 0.00 175.76 178.59 1lkf h GLN 210 N -0.43 0.83 0.00 0.00 4.20 -1.95 -1.42 115.11 116.34 1lkf h GLN 210 Ca -0.46 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.20 1lkf h GLN 210 Cb 1.26 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1lkf h GLN 210 CO 0.51 0.55 0.00 -2.39 -0.67 0.00 0.00 178.83 176.83 1lkf n HIS 211 N -4.44 0.59 1.10 2.96 1.44 -1.26 -1.73 115.22 113.87 1lkf n HIS 211 Ca 0.07 0.23 0.12 0.00 -2.01 0.00 0.00 57.72 56.13 1lkf n HIS 211 Cb 0.06 -0.87 0.18 0.00 0.12 0.00 0.00 29.99 29.48 1lkf n HIS 211 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1lkf n GLN 212 N -2.04 0.66 -3.35 -1.40 6.02 -0.54 -4.89 117.38 111.84 1lkf n GLN 212 Ca 0.02 -0.46 -0.27 0.00 -0.01 0.00 0.00 57.00 56.28 1lkf n GLN 212 Cb 0.21 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 1lkf n GLN 212 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1lkf s MET 213 N -2.66 3.56 0.56 -1.09 -1.94 -0.71 -4.91 119.30 112.12 1lkf s MET 213 Ca 0.18 -0.14 -0.21 0.00 -1.71 0.00 0.00 55.69 53.81 1lkf s MET 213 Cb 0.18 -2.66 -0.04 0.00 2.01 0.00 0.00 34.83 34.32 1lkf s MET 213 CO 0.62 0.19 1.33 -2.14 -0.01 0.00 0.00 175.02 175.01 1lkf s PRO 214 N -3.85 3.04 0.34 2.03 0.02 -1.26 -4.90 135.00 130.42 1lkf s PRO 214 Ca 0.42 2.16 0.06 0.00 0.02 0.00 0.00 61.00 63.67 1lkf s PRO 214 Cb -0.10 -2.17 0.73 0.00 0.02 0.00 0.00 34.50 32.98 1lkf s PRO 214 CO 0.33 -1.24 1.91 -0.07 -0.33 0.00 0.00 177.00 177.59 1lkf h LEU 215 N 1.28 0.72 -1.11 -5.54 -0.00 -1.92 -2.07 115.31 106.66 1lkf h LEU 215 Ca -0.51 0.02 -0.08 0.00 -0.00 0.00 0.00 57.88 57.31 1lkf h LEU 215 Cb 1.31 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.83 1lkf h LEU 215 CO 0.56 0.42 -0.39 -0.07 -0.00 0.00 0.00 178.44 178.96 1lkf h LEU 216 N 0.79 0.00 -0.28 1.67 3.38 -1.86 0.74 115.31 119.75 1lkf h LEU 216 Ca 0.39 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 58.16 1lkf h LEU 216 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1lkf h LEU 216 CO -0.16 0.39 -0.88 0.77 0.09 0.00 0.00 178.44 178.66 1lkf h SER 217 N 0.00 0.21 0.00 -0.43 4.64 -1.50 -3.39 113.55 113.09 1lkf h SER 217 Ca -0.00 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1lkf h SER 217 Cb 0.80 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1lkf h SER 217 CO 0.05 0.99 0.00 -2.11 -0.87 0.00 0.00 176.83 174.89 1lkf n ARG 218 N -3.63 -0.47 0.00 4.77 -4.01 -1.15 -0.94 116.66 111.23 1lkf n ARG 218 Ca -0.03 -0.56 0.00 0.00 -1.04 0.00 0.00 57.85 56.22 1lkf n ARG 218 Cb 0.81 -0.94 0.00 0.00 -3.04 0.00 0.00 32.46 29.29 1lkf n ARG 218 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1lkf n SER 219 N -0.05 0.00 -3.49 2.89 2.88 0.25 -4.73 113.62 111.37 1lkf n SER 219 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1lkf n SER 219 Cb 0.06 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.53 1lkf n SER 219 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1lkf s ASN 220 N 0.90 -0.03 -0.07 -3.46 4.22 -1.19 -1.76 114.94 113.56 1lkf s ASN 220 Ca 0.00 -0.55 0.02 0.00 -2.14 0.00 0.00 52.86 50.19 1lkf s ASN 220 Cb 0.00 0.45 0.01 0.00 1.28 0.00 0.00 41.25 42.99 1lkf s ASN 220 CO 0.00 -0.88 -0.12 0.12 -2.04 0.00 0.00 177.10 174.18 1lkf s PHE 221 N -2.39 1.48 -0.62 1.54 5.36 0.07 -4.22 117.98 119.19 1lkf s PHE 221 Ca 0.20 -0.55 -0.07 0.00 -0.96 0.00 0.00 56.93 55.55 1lkf s PHE 221 Cb -0.02 -1.08 0.16 0.00 -0.34 0.00 0.00 43.02 41.74 1lkf s PHE 221 CO 0.04 -0.28 0.49 -0.80 -1.46 0.00 0.00 175.22 173.20 1lkf s ASN 222 N 0.68 5.74 0.53 6.13 0.02 -1.26 -0.57 114.94 126.21 1lkf s ASN 222 Ca -0.14 -2.52 -0.21 0.00 -1.02 0.00 0.00 52.86 48.97 1lkf s ASN 222 Cb -0.16 -1.98 -0.06 0.00 0.02 0.00 0.00 41.25 39.07 1lkf s ASN 222 CO 0.04 -0.52 1.19 -2.16 0.02 0.00 0.00 177.10 175.67 1lkf s PRO 223 N 0.43 3.38 -0.27 -0.60 0.04 -1.26 -4.75 135.00 131.98 1lkf s PRO 223 Ca 0.14 1.79 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 1lkf s PRO 223 Cb -0.19 -2.16 0.12 0.00 0.04 0.00 0.00 34.50 32.30 1lkf s PRO 223 CO -0.04 -0.87 0.22 -1.21 0.04 0.00 0.00 177.00 175.15 1lkf s GLU 224 N -3.04 0.25 0.04 4.56 2.02 -1.24 -3.74 118.70 117.55 1lkf s GLU 224 Ca 0.70 -0.20 0.04 0.00 0.02 0.00 0.00 54.97 55.53 1lkf s GLU 224 Cb -0.29 -0.94 -0.02 0.00 0.10 0.00 0.00 34.13 32.98 1lkf s GLU 224 CO 0.34 -0.95 -0.12 -0.06 0.02 0.00 0.00 175.26 174.48 1lkf s PHE 225 N 2.27 1.08 -0.03 1.61 0.08 -0.46 -4.54 117.98 117.98 1lkf s PHE 225 Ca 0.09 -0.36 0.07 0.00 0.12 0.00 0.00 56.93 56.85 1lkf s PHE 225 Cb -0.15 -0.64 -0.01 0.00 -0.57 0.00 0.00 43.02 41.65 1lkf s PHE 225 CO -0.30 0.02 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.09 1lkf s LEU 226 N -1.14 2.04 -0.01 -0.37 1.43 -0.29 -0.12 118.68 120.22 1lkf s LEU 226 Ca -0.00 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 1lkf s LEU 226 Cb -0.08 -1.24 -0.00 0.00 0.03 0.00 0.00 46.19 44.90 1lkf s LEU 226 CO 0.01 0.26 -0.06 -0.94 0.23 0.00 0.00 176.35 175.85 1lkf s SER 227 N -0.36 0.70 -0.26 2.29 1.04 -0.38 -1.22 113.70 115.50 1lkf s SER 227 Ca 0.04 -0.11 -0.05 0.00 0.48 0.00 0.00 55.95 56.31 1lkf s SER 227 Cb -0.11 -0.11 0.00 0.00 0.10 0.00 0.00 66.02 65.91 1lkf s SER 227 CO 0.01 0.06 0.03 -0.69 0.98 0.00 0.00 173.24 173.63 1lkf s VAL 228 N -0.03 3.71 -0.06 5.02 1.01 0.12 -1.09 120.40 129.08 1lkf s VAL 228 Ca 0.01 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.34 1lkf s VAL 228 Cb -0.03 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 1lkf s VAL 228 CO -0.00 0.22 0.09 -0.76 0.00 0.00 0.00 175.10 174.64 1lkf s LEU 229 N 1.48 4.01 -0.05 3.92 1.02 0.15 -0.99 118.68 128.24 1lkf s LEU 229 Ca 0.04 0.26 0.06 0.00 0.02 0.00 0.00 54.13 54.50 1lkf s LEU 229 Cb -0.16 -2.14 -0.01 0.00 0.02 0.00 0.00 46.19 43.90 1lkf s LEU 229 CO 0.00 0.34 -0.23 -0.55 0.02 0.00 0.00 176.35 175.93 1lkf s SER 230 N -1.35 2.80 -0.16 2.29 0.15 0.49 -0.84 113.70 117.07 1lkf s SER 230 Ca 0.19 -0.46 -0.00 0.00 0.70 0.00 0.00 55.95 56.37 1lkf s SER 230 Cb -0.12 -0.71 -0.00 0.00 -1.71 0.00 0.00 66.02 63.48 1lkf s SER 230 CO 0.09 0.23 -0.13 -2.28 1.20 0.00 0.00 173.24 172.34 1lkf s HIS 231 N -0.16 2.82 -1.55 3.44 2.46 -0.38 -0.96 115.29 120.96 1lkf s HIS 231 Ca -0.02 -0.97 0.08 0.00 0.47 0.00 0.00 55.06 54.63 1lkf s HIS 231 Cb -0.13 -1.92 0.43 0.00 -0.13 0.00 0.00 32.58 30.84 1lkf s HIS 231 CO 0.03 -0.44 1.09 0.54 -2.47 0.00 0.00 174.74 173.48 1lkf n ARG 232 N 4.09 0.15 -1.91 2.88 1.74 -0.03 -1.27 116.66 122.31 1lkf n ARG 232 Ca -0.19 0.16 -0.15 0.00 -0.77 0.00 0.00 57.85 56.90 1lkf n ARG 232 Cb 0.52 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 1lkf n ARG 232 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1lkf n GLN 233 N -1.22 -1.15 -3.90 5.56 6.02 -1.26 -4.80 117.38 116.62 1lkf n GLN 233 Ca 0.04 0.88 -0.11 0.00 -0.01 0.00 0.00 57.00 57.80 1lkf n GLN 233 Cb 0.06 -5.14 -0.11 0.00 1.02 0.00 0.00 30.24 26.07 1lkf n GLN 233 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1lkf s ASP 234 N -2.55 0.08 0.09 1.08 1.01 -1.26 -5.11 116.67 110.00 1lkf s ASP 234 Ca 0.00 -0.24 0.00 0.00 0.71 0.00 0.00 52.55 53.02 1lkf s ASP 234 Cb 0.00 0.17 0.00 0.00 1.01 0.00 0.00 42.92 44.10 1lkf s ASP 234 CO 0.00 -0.29 0.00 0.61 0.21 0.00 0.00 175.17 175.70 1lkf n GLY 235 N 1.77 -1.63 1.99 0.21 0.00 -1.26 -4.77 105.19 101.50 1lkf n GLY 235 Ca -0.21 -1.44 -0.28 0.00 0.00 0.00 0.00 46.02 44.09 1lkf n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lkf n ALA 236 N -1.74 -2.12 0.79 4.61 0.00 -1.26 -4.91 120.51 115.89 1lkf n ALA 236 Ca -0.00 0.25 0.13 0.00 0.00 0.00 0.00 53.44 53.81 1lkf n ALA 236 Cb 0.15 -0.94 0.38 0.00 0.00 0.00 0.00 19.45 19.04 1lkf n ALA 236 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1lkf n LYS 237 N 0.60 0.14 -4.37 0.00 4.76 -1.26 -4.85 118.16 113.18 1lkf n LYS 237 Ca 0.10 0.08 -0.28 0.00 -2.87 0.00 0.00 58.31 55.35 1lkf n LYS 237 Cb 0.15 -1.63 -0.11 0.00 -1.84 0.00 0.00 35.03 31.60 1lkf n LYS 237 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1lkf s LYS 238 N -3.07 1.66 0.06 1.97 1.02 -1.26 -0.76 119.74 119.37 1lkf s LYS 238 Ca 0.11 -1.38 -0.10 0.00 0.02 0.00 0.00 55.97 54.62 1lkf s LYS 238 Cb 0.15 -1.97 0.01 0.00 -0.52 0.00 0.00 37.83 35.50 1lkf s LYS 238 CO 0.63 0.43 0.23 -1.54 -0.92 0.00 0.00 175.35 174.18 1lkf s SER 239 N -2.50 0.01 -0.01 2.83 1.04 -0.31 -4.82 113.70 109.94 1lkf s SER 239 Ca 0.20 -0.43 -0.08 0.00 0.48 0.00 0.00 55.95 56.13 1lkf s SER 239 Cb -0.09 0.33 -0.05 0.00 0.10 0.00 0.00 66.02 66.32 1lkf s SER 239 CO 0.10 -0.65 0.27 -0.54 0.98 0.00 0.00 173.24 173.41 1lkf s LYS 240 N -3.11 3.61 -0.01 4.02 1.02 -1.26 0.36 119.74 124.38 1lkf s LYS 240 Ca -0.01 -0.02 -0.02 0.00 0.02 0.00 0.00 55.97 55.95 1lkf s LYS 240 Cb 0.01 -3.10 -0.00 0.00 -0.52 0.00 0.00 37.83 34.22 1lkf s LYS 240 CO -0.07 0.66 0.03 -1.50 -0.92 0.00 0.00 175.35 173.56 1lkf s ILE 241 N -1.25 0.03 -0.03 2.17 2.07 -0.42 -0.44 121.20 123.33 1lkf s ILE 241 Ca 0.26 -0.28 0.05 0.00 -1.41 0.00 0.00 60.65 59.27 1lkf s ILE 241 Cb -0.13 -0.14 -0.01 0.00 0.13 0.00 0.00 42.46 42.30 1lkf s ILE 241 CO 0.14 -0.15 -0.19 0.42 -1.91 0.00 0.00 174.94 173.25 1lkf s THR 242 N -0.46 1.51 -0.12 4.00 -4.23 -0.49 -0.48 115.64 115.37 1lkf s THR 242 Ca -0.05 -0.79 0.02 0.00 -1.18 0.00 0.00 61.69 59.70 1lkf s THR 242 Cb -0.03 -1.27 0.01 0.00 1.34 0.00 0.00 72.50 72.54 1lkf s THR 242 CO -0.00 0.43 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.63 1lkf s VAL 243 N -0.20 1.78 -0.14 2.29 1.01 -0.46 -1.17 120.40 123.51 1lkf s VAL 243 Ca 0.01 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1lkf s VAL 243 Cb -0.10 -1.59 0.01 0.00 0.00 0.00 0.00 36.38 34.70 1lkf s VAL 243 CO 0.01 0.50 -0.22 -0.89 0.00 0.00 0.00 175.10 174.50 1lkf s THR 244 N 0.85 2.04 -0.10 3.92 2.01 0.39 -0.67 115.64 124.07 1lkf s THR 244 Ca -0.08 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.96 1lkf s THR 244 Cb -0.15 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.53 1lkf s THR 244 CO -0.01 0.55 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.05 1lkf s TYR 245 N 0.83 2.82 0.03 4.92 1.51 -0.29 -0.59 117.35 126.59 1lkf s TYR 245 Ca -0.07 -0.36 -0.12 0.00 -1.01 0.00 0.00 57.07 55.52 1lkf s TYR 245 Cb -0.15 -1.77 0.01 0.00 -0.11 0.00 0.00 41.96 39.94 1lkf s TYR 245 CO -0.02 0.01 0.25 -1.14 -1.11 0.00 0.00 175.55 173.53 1lkf s GLN 246 N -0.15 0.72 -0.02 -0.62 0.74 0.11 -1.22 119.66 119.21 1lkf s GLN 246 Ca 0.00 -0.51 0.04 0.00 0.05 0.00 0.00 55.36 54.94 1lkf s GLN 246 Cb -0.13 0.31 -0.01 0.00 1.10 0.00 0.00 33.01 34.27 1lkf s GLN 246 CO 0.03 -0.21 -0.13 -0.98 -0.55 0.00 0.00 175.29 173.45 1lkf s ARG 247 N -2.31 1.16 -0.23 1.67 1.70 -0.91 -1.02 118.95 119.01 1lkf s ARG 247 Ca -0.07 -0.47 -0.07 0.00 -0.47 0.00 0.00 55.73 54.65 1lkf s ARG 247 Cb -0.02 -1.10 -0.03 0.00 -0.57 0.00 0.00 34.95 33.23 1lkf s ARG 247 CO -0.02 0.25 0.07 -1.21 -1.08 0.00 0.00 175.30 173.31 1lkf s GLU 248 N -0.18 3.74 -0.17 3.89 2.02 0.47 -2.65 118.70 125.81 1lkf s GLU 248 Ca 0.03 -0.44 -0.05 0.00 0.02 0.00 0.00 54.97 54.52 1lkf s GLU 248 Cb -0.07 -3.30 -0.03 0.00 0.10 0.00 0.00 34.13 30.83 1lkf s GLU 248 CO -0.00 -0.07 0.00 -1.64 0.02 0.00 0.00 175.26 173.57 1lkf s MET 249 N 1.31 3.77 -0.00 1.61 -1.94 -0.12 -1.35 119.30 122.57 1lkf s MET 249 Ca 0.05 -0.46 -0.05 0.00 -1.71 0.00 0.00 55.69 53.52 1lkf s MET 249 Cb -0.15 -3.04 -0.04 0.00 2.01 0.00 0.00 34.83 33.61 1lkf s MET 249 CO 0.04 0.22 0.23 -0.51 -0.01 0.00 0.00 175.02 175.00 1lkf s ASP 250 N 0.44 6.45 -0.42 3.03 1.11 -0.32 -0.84 116.67 126.12 1lkf s ASP 250 Ca -0.01 0.48 -0.17 0.00 0.18 0.00 0.00 52.55 53.03 1lkf s ASP 250 Cb -0.14 -2.06 0.02 0.00 1.07 0.00 0.00 42.92 41.81 1lkf s ASP 250 CO 0.02 0.26 0.42 -0.22 1.18 0.00 0.00 175.17 176.83 1lkf s LEU 251 N -1.79 4.88 -0.24 1.23 2.96 -0.58 -1.80 118.68 123.34 1lkf s LEU 251 Ca 0.27 -0.69 -0.09 0.00 -0.22 0.00 0.00 54.13 53.41 1lkf s LEU 251 Cb -0.13 -2.35 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 1lkf s LEU 251 CO 0.16 -0.55 0.11 -0.47 -1.32 0.00 0.00 176.35 174.28 1lkf s TYR 252 N 2.07 3.17 0.05 5.38 5.04 -0.05 -0.13 117.35 132.88 1lkf s TYR 252 Ca 0.11 -0.12 0.03 0.00 -2.44 0.00 0.00 57.07 54.66 1lkf s TYR 252 Cb -0.17 -2.24 -0.02 0.00 0.35 0.00 0.00 41.96 39.87 1lkf s TYR 252 CO 0.13 -0.15 -0.11 1.14 -1.34 0.00 0.00 175.55 175.22 1lkf s GLN 253 N 1.32 0.67 0.15 4.97 -2.07 0.04 -0.65 119.66 124.09 1lkf s GLN 253 Ca 0.06 -0.76 0.09 0.00 -1.82 0.00 0.00 55.36 52.92 1lkf s GLN 253 Cb -0.15 -0.57 -0.04 0.00 -1.09 0.00 0.00 33.01 31.16 1lkf s GLN 253 CO 0.05 0.13 -0.21 0.96 -1.32 0.00 0.00 175.29 174.90 1lkf s ILE 254 N -1.14 1.92 -0.14 3.63 -4.36 -0.04 -0.12 121.20 120.95 1lkf s ILE 254 Ca -0.05 -1.82 -0.13 0.00 -0.26 0.00 0.00 60.65 58.39 1lkf s ILE 254 Cb -0.09 -1.83 0.04 0.00 1.25 0.00 0.00 42.46 41.83 1lkf s ILE 254 CO 0.01 -0.18 0.38 -0.60 0.24 0.00 0.00 174.94 174.79 1lkf s ARG 255 N -2.48 0.44 -0.18 0.37 3.52 -0.66 -1.55 118.95 118.40 1lkf s ARG 255 Ca 0.14 0.52 -0.14 0.00 -0.13 0.00 0.00 55.73 56.12 1lkf s ARG 255 Cb -0.08 0.21 -0.04 0.00 -1.56 0.00 0.00 34.95 33.48 1lkf s ARG 255 CO 0.06 -0.05 0.31 -0.46 -0.81 0.00 0.00 175.30 174.36 1lkf s TRP 256 N 0.20 3.42 -1.20 5.12 -0.11 0.25 -1.97 118.94 124.65 1lkf s TRP 256 Ca -0.00 0.57 0.16 0.00 1.22 0.00 0.00 56.10 58.05 1lkf s TRP 256 Cb -0.03 -2.39 0.51 0.00 -1.50 0.00 0.00 33.47 30.06 1lkf s TRP 256 CO 0.00 0.14 1.43 0.27 -4.62 0.00 0.00 176.95 174.18 1lkf n ASN 257 N 3.92 3.70 0.00 5.86 6.94 -0.99 -4.90 115.26 129.79 1lkf n ASN 257 Ca -0.11 -2.19 0.00 0.00 -0.02 0.00 0.00 54.58 52.26 1lkf n ASN 257 Cb 0.52 -0.41 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 1lkf n ASN 257 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1lkf n GLY 258 N 0.87 2.19 0.54 4.83 0.00 -1.26 -4.85 105.19 107.52 1lkf n GLY 258 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1lkf n GLY 258 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1lkf n PHE 259 N -1.83 0.00 -4.02 1.61 3.01 -1.26 -5.13 117.46 109.85 1lkf n PHE 259 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 1lkf n PHE 259 Cb 0.00 0.03 -0.04 0.00 -0.01 0.00 0.00 39.48 39.46 1lkf n PHE 259 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 1lkf s TYR 260 N -1.94 0.59 -0.05 1.38 -0.85 -1.26 -4.92 117.35 110.30 1lkf s TYR 260 Ca 0.00 -0.93 -0.04 0.00 -0.52 0.00 0.00 57.07 55.58 1lkf s TYR 260 Cb 0.00 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 1lkf s TYR 260 CO 0.00 -1.08 0.16 -1.58 -1.52 0.00 0.00 175.55 171.53 1lkf s TRP 261 N -3.57 3.54 0.00 -3.49 0.52 0.35 -2.35 118.94 113.93 1lkf s TRP 261 Ca 0.25 0.40 0.00 0.00 0.02 0.00 0.00 56.10 56.78 1lkf s TRP 261 Cb -0.01 -1.86 -0.00 0.00 -1.15 0.00 0.00 33.47 30.45 1lkf s TRP 261 CO 0.13 0.67 -0.02 0.00 0.02 0.00 0.00 176.95 177.75 1lkf s ALA 262 N -1.21 0.12 0.24 0.98 0.00 -0.83 -4.69 121.76 116.36 1lkf s ALA 262 Ca 0.23 -0.12 0.07 0.00 0.00 0.00 0.00 51.96 52.14 1lkf s ALA 262 Cb -0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 1lkf s ALA 262 CO 0.13 0.01 0.12 0.20 0.00 0.00 0.00 175.76 176.23 1lkf s GLY 263 N -0.18 1.53 -0.11 0.00 0.00 -0.30 -1.66 107.32 106.61 1lkf s GLY 263 Ca -0.01 -1.45 -0.05 0.00 0.00 0.00 0.00 44.72 43.21 1lkf s GLY 263 CO -0.00 -1.49 0.25 0.00 0.00 0.00 0.00 173.10 171.86 1lkf s ALA 264 N -2.10 -0.57 -0.26 3.20 0.00 0.83 -0.82 121.76 122.05 1lkf s ALA 264 Ca 0.32 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.27 1lkf s ALA 264 Cb -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 23.12 22.41 1lkf s ALA 264 CO 0.23 -0.21 -0.04 1.21 0.00 0.00 0.00 175.76 176.95 1lkf s ASN 265 N 1.31 4.48 -0.52 0.00 2.47 -1.26 -0.78 114.94 120.63 1lkf s ASN 265 Ca -0.09 -0.90 -0.24 0.00 0.42 0.00 0.00 52.86 52.05 1lkf s ASN 265 Cb -0.10 -1.70 0.04 0.00 -1.45 0.00 0.00 41.25 38.04 1lkf s ASN 265 CO -0.09 -0.15 0.90 -0.31 -3.72 0.00 0.00 177.10 173.73 1lkf s TYR 266 N 1.34 2.85 0.12 0.43 1.51 0.82 -4.93 117.35 119.49 1lkf s TYR 266 Ca -0.00 0.02 -0.31 0.00 -1.01 0.00 0.00 57.07 55.77 1lkf s TYR 266 Cb -0.17 -3.98 -0.09 0.00 -0.11 0.00 0.00 41.96 37.61 1lkf s TYR 266 CO -0.03 -1.26 1.50 0.21 -1.11 0.00 0.00 175.55 174.86 1lkf s LYS 267 N 3.76 4.26 -1.24 -0.62 2.20 -1.26 -1.52 119.74 125.32 1lkf s LYS 267 Ca 0.30 2.22 -0.17 0.00 -0.36 0.00 0.00 55.97 57.96 1lkf s LYS 267 Cb -0.13 -3.27 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 1lkf s LYS 267 CO 0.20 -0.55 0.64 -1.71 -0.36 0.00 0.00 175.35 173.57 1lkf n ASN 268 N 4.25 -3.51 0.21 1.43 4.05 -1.24 -4.87 115.26 115.57 1lkf n ASN 268 Ca 0.13 -1.07 0.11 0.00 0.45 0.00 0.00 54.58 54.20 1lkf n ASN 268 Cb 0.41 -2.93 0.15 0.00 1.23 0.00 0.00 39.78 38.64 1lkf n ASN 268 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 1lkf h PHE 269 N -2.01 0.00 -3.55 1.20 3.57 -1.04 -3.44 116.94 111.66 1lkf h PHE 269 Ca -0.66 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 60.61 1lkf h PHE 269 Cb 1.37 0.00 -0.28 0.00 2.79 0.00 0.00 35.95 39.83 1lkf h PHE 269 CO 0.39 0.02 -0.65 0.15 -2.23 0.00 0.00 178.31 175.99 1lkf s LYS 270 N -3.21 0.06 -0.03 1.11 1.02 -1.05 -1.43 119.74 116.21 1lkf s LYS 270 Ca 0.06 0.12 0.04 0.00 0.02 0.00 0.00 55.97 56.21 1lkf s LYS 270 Cb 0.05 -0.01 -0.00 0.00 -0.52 0.00 0.00 37.83 37.35 1lkf s LYS 270 CO 0.68 -0.04 -0.13 0.99 -0.92 0.00 0.00 175.35 175.94 1lkf s THR 271 N 0.22 1.05 -0.12 2.17 2.01 0.63 -0.95 115.64 120.65 1lkf s THR 271 Ca -0.02 -0.53 -0.00 0.00 0.31 0.00 0.00 61.69 61.46 1lkf s THR 271 Cb -0.02 -0.91 0.02 0.00 0.01 0.00 0.00 72.50 71.60 1lkf s THR 271 CO -0.01 0.31 -0.10 -0.13 -0.69 0.00 0.00 174.62 174.01 1lkf s ARG 272 N -0.00 1.76 -0.02 4.92 1.81 -1.08 -0.66 118.95 125.68 1lkf s ARG 272 Ca -0.01 -0.35 0.06 0.00 -1.72 0.00 0.00 55.73 53.71 1lkf s ARG 272 Cb -0.08 -1.72 -0.01 0.00 -0.45 0.00 0.00 34.95 32.68 1lkf s ARG 272 CO 0.01 -0.24 -0.20 0.99 -0.68 0.00 0.00 175.30 175.18 1lkf s THR 273 N 1.57 1.54 -0.12 0.02 2.01 0.19 -2.14 115.64 118.71 1lkf s THR 273 Ca 0.04 -0.83 -0.01 0.00 0.31 0.00 0.00 61.69 61.19 1lkf s THR 273 Cb -0.13 -1.29 0.03 0.00 0.01 0.00 0.00 72.50 71.13 1lkf s THR 273 CO -0.08 0.44 -0.05 0.12 -0.69 0.00 0.00 174.62 174.36 1lkf s PHE 274 N -0.43 1.35 -0.07 4.92 5.36 -0.36 -1.27 117.98 127.48 1lkf s PHE 274 Ca 0.07 -0.72 0.04 0.00 -0.96 0.00 0.00 56.93 55.36 1lkf s PHE 274 Cb -0.08 -1.15 -0.02 0.00 -0.34 0.00 0.00 43.02 41.43 1lkf s PHE 274 CO -0.01 -0.51 -0.19 0.21 -1.46 0.00 0.00 175.22 173.26 1lkf s LYS 275 N 1.75 2.71 0.08 10.12 2.20 -0.74 -1.14 119.74 134.73 1lkf s LYS 275 Ca 0.03 -0.80 0.10 0.00 -0.36 0.00 0.00 55.97 54.94 1lkf s LYS 275 Cb -0.13 -2.32 -0.03 0.00 -1.51 0.00 0.00 37.83 33.83 1lkf s LYS 275 CO -0.07 0.42 -0.26 -1.54 -0.36 0.00 0.00 175.35 173.53 1lkf s SER 276 N -0.22 3.19 -0.11 1.43 1.04 0.16 -1.18 113.70 118.01 1lkf s SER 276 Ca -0.01 -0.66 0.02 0.00 0.48 0.00 0.00 55.95 55.78 1lkf s SER 276 Cb -0.13 -0.25 0.01 0.00 0.10 0.00 0.00 66.02 65.75 1lkf s SER 276 CO 0.03 0.21 -0.17 -0.89 0.98 0.00 0.00 173.24 173.41 1lkf s THR 277 N -0.93 1.61 0.13 2.02 2.01 0.24 -1.36 115.64 119.36 1lkf s THR 277 Ca 0.12 -0.71 0.10 0.00 0.31 0.00 0.00 61.69 61.51 1lkf s THR 277 Cb -0.10 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.92 1lkf s THR 277 CO 0.04 0.46 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.88 1lkf s TYR 278 N 0.89 2.09 -0.26 4.92 1.51 0.37 -0.31 117.35 126.55 1lkf s TYR 278 Ca -0.08 -0.40 -0.08 0.00 -1.01 0.00 0.00 57.07 55.50 1lkf s TYR 278 Cb -0.15 -1.12 -0.03 0.00 -0.11 0.00 0.00 41.96 40.55 1lkf s TYR 278 CO -0.00 0.31 0.10 -2.00 -1.11 0.00 0.00 175.55 172.85 1lkf s GLU 279 N -2.12 3.67 -0.19 -0.62 2.12 0.33 -1.30 118.70 120.59 1lkf s GLU 279 Ca 0.12 -0.48 -0.19 0.00 0.36 0.00 0.00 54.97 54.78 1lkf s GLU 279 Cb -0.09 -3.41 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 1lkf s GLU 279 CO 0.06 -0.21 0.55 0.42 -0.54 0.00 0.00 175.26 175.54 1lkf s ILE 280 N 1.64 5.08 -0.62 -3.70 1.01 0.16 -1.44 121.20 123.34 1lkf s ILE 280 Ca 0.06 1.03 -0.12 0.00 0.00 0.00 0.00 60.65 61.62 1lkf s ILE 280 Cb -0.15 -3.87 0.16 0.00 0.01 0.00 0.00 42.46 38.60 1lkf s ILE 280 CO 0.05 0.17 0.53 -0.62 0.00 0.00 0.00 174.94 175.07 1lkf s ASP 281 N 1.13 6.13 0.43 3.58 -1.08 0.47 -1.17 116.67 126.16 1lkf s ASP 281 Ca 0.26 -2.22 0.17 0.00 -0.52 0.00 0.00 52.55 50.24 1lkf s ASP 281 Cb -0.16 -2.12 0.96 0.00 -1.46 0.00 0.00 42.92 40.15 1lkf s ASP 281 CO 0.10 -0.67 1.93 -0.50 0.52 0.00 0.00 175.17 176.54 1lkf h TRP 282 N 8.23 0.00 -0.11 -5.34 4.06 -1.21 0.15 115.95 121.73 1lkf h TRP 282 Ca -0.12 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.72 1lkf h TRP 282 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1lkf h TRP 282 CO 0.80 0.26 -0.35 1.49 -3.56 0.00 0.00 178.44 177.07 1lkf h GLU 283 N 0.00 0.43 -0.53 0.49 4.81 -1.92 -3.33 114.58 114.53 1lkf h GLU 283 Ca -0.00 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1lkf h GLU 283 Cb 0.50 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1lkf h GLU 283 CO 0.03 0.94 0.00 0.09 -0.73 0.00 0.00 179.01 179.35 1lkf n ASN 284 N -4.36 3.69 -4.09 1.04 3.02 -1.18 -4.97 115.26 108.41 1lkf n ASN 284 Ca -0.07 -2.00 -0.30 0.00 -0.03 0.00 0.00 54.58 52.18 1lkf n ASN 284 Cb 0.51 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.30 1lkf n ASN 284 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1lkf n HIS 285 N 1.57 -1.65 -4.38 3.10 8.25 0.49 -4.98 115.22 117.63 1lkf n HIS 285 Ca 0.22 0.75 -0.19 0.00 -0.26 0.00 0.00 57.72 58.24 1lkf n HIS 285 Cb 0.62 -3.37 -0.10 0.00 1.12 0.00 0.00 29.99 28.26 1lkf n HIS 285 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1lkf s LYS 286 N -6.77 1.42 0.08 -0.41 1.02 -0.97 -4.79 119.74 109.31 1lkf s LYS 286 Ca 0.28 -1.67 0.04 0.00 0.02 0.00 0.00 55.97 54.64 1lkf s LYS 286 Cb -0.15 -1.09 -0.03 0.00 -0.52 0.00 0.00 37.83 36.04 1lkf s LYS 286 CO 0.91 0.10 -0.12 0.14 -0.92 0.00 0.00 175.35 175.47 1lkf s VAL 287 N -3.03 0.98 -0.04 3.17 -7.23 -1.26 -0.40 120.40 112.59 1lkf s VAL 287 Ca 0.26 -1.40 -0.00 0.00 -1.81 0.00 0.00 61.98 59.03 1lkf s VAL 287 Cb 0.02 -1.11 0.03 0.00 0.56 0.00 0.00 36.38 35.87 1lkf s VAL 287 CO 0.09 -0.37 0.01 -0.75 -0.31 0.00 0.00 175.10 173.77 1lkf s LYS 288 N -2.10 0.31 0.03 4.82 2.20 -0.52 -4.95 119.74 119.54 1lkf s LYS 288 Ca -0.00 0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.41 1lkf s LYS 288 Cb -0.07 -0.56 -0.07 0.00 -1.51 0.00 0.00 37.83 35.62 1lkf s LYS 288 CO 0.01 -0.18 1.47 -1.17 -0.36 0.00 0.00 175.35 175.13 1lkf s LEU 289 N 1.28 4.34 -0.18 5.43 2.96 -1.26 -0.51 118.68 130.73 1lkf s LEU 289 Ca -0.06 2.25 0.09 0.00 -0.22 0.00 0.00 54.13 56.18 1lkf s LEU 289 Cb -0.13 -3.56 -0.17 0.00 0.50 0.00 0.00 46.19 42.82 1lkf s LEU 289 CO -0.02 -0.76 -0.05 0.18 -1.32 0.00 0.00 176.35 174.38 1lkf n LEU 290 N 5.26 1.32 -3.53 -0.68 4.77 0.58 -4.92 117.00 119.79 1lkf n LEU 290 Ca 0.14 -0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.96 1lkf n LEU 290 Cb 0.43 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 41.38 1lkf n LEU 290 CO 0.60 0.60 0.68 -0.62 -1.33 0.00 0.00 177.39 177.31 1lkf s ASP 291 N -5.43 -0.41 0.02 -1.43 2.15 -1.12 -4.99 116.67 105.46 1lkf s ASP 291 Ca -0.17 0.24 0.02 0.00 0.43 0.00 0.00 52.55 53.07 1lkf s ASP 291 Cb 0.06 0.38 -0.01 0.00 -0.30 0.00 0.00 42.92 43.05 1lkf s ASP 291 CO 0.58 -0.53 -0.06 0.42 -0.17 0.00 0.00 175.17 175.40 1lkf s THR 292 N -2.17 0.46 -0.10 1.71 -4.23 -1.26 -0.59 115.64 109.45 1lkf s THR 292 Ca 0.00 -0.58 -0.04 0.00 -1.18 0.00 0.00 61.69 59.90 1lkf s THR 292 Cb -0.01 -0.45 0.05 0.00 1.34 0.00 0.00 72.50 73.43 1lkf s THR 292 CO -0.03 -0.09 0.21 -0.75 -0.54 0.00 0.00 174.62 173.41 1lkf s LYS 293 N -0.73 0.13 -0.19 3.99 2.20 -0.32 -5.00 119.74 119.81 1lkf s LYS 293 Ca -0.03 0.55 -0.08 0.00 -0.36 0.00 0.00 55.97 56.05 1lkf s LYS 293 Cb -0.05 -0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.07 1lkf s LYS 293 CO 0.00 -0.22 0.08 -1.21 -0.36 0.00 0.00 175.35 173.64 1lkf s GLU 294 N 1.72 3.99 0.04 4.03 2.02 -1.26 -1.79 118.70 127.45 1lkf s GLU 294 Ca -0.04 -0.33 0.04 0.00 0.02 0.00 0.00 54.97 54.65 1lkf s GLU 294 Cb -0.11 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.82 1lkf s GLU 294 CO -0.07 0.23 -0.11 0.95 0.02 0.00 0.00 175.26 176.27 1lkf s THR 295 N 0.51 0.89 0.06 3.63 -4.23 -0.39 -5.00 115.64 111.10 1lkf s THR 295 Ca 0.04 -1.01 0.05 0.00 -1.18 0.00 0.00 61.69 59.59 1lkf s THR 295 Cb -0.12 -0.85 -0.03 0.00 1.34 0.00 0.00 72.50 72.84 1lkf s THR 295 CO 0.01 -0.14 -0.15 -1.61 -0.54 0.00 0.00 174.62 172.18 1lkf s GLU 296 N -1.29 0.92 -0.03 3.99 2.02 -1.26 -0.64 118.70 122.41 1lkf s GLU 296 Ca -0.02 -0.89 0.04 0.00 0.02 0.00 0.00 54.97 54.11 1lkf s GLU 296 Cb -0.08 -0.96 -0.00 0.00 0.10 0.00 0.00 34.13 33.19 1lkf s GLU 296 CO 0.01 0.23 -0.14 1.21 0.02 0.00 0.00 175.26 176.58 1lkf s ASN 297 N -1.48 1.83 -0.18 -0.19 3.84 0.17 -4.95 114.94 113.97 1lkf s ASN 297 Ca 0.01 -0.29 -0.05 0.00 0.21 0.00 0.00 52.86 52.74 1lkf s ASN 297 Cb -0.09 -0.46 0.07 0.00 -0.55 0.00 0.00 41.25 40.22 1lkf s ASN 297 CO 0.02 0.13 0.12 0.20 -2.79 0.00 0.00 177.10 174.78 1lkf s ASN 298 N 0.03 2.17 0.00 -4.21 0.01 -1.26 -0.27 114.94 111.41 1lkf s ASN 298 Ca -0.02 -0.55 0.31 0.00 -0.71 0.00 0.00 52.86 51.89 1lkf s ASN 298 Cb -0.10 -0.10 1.71 0.00 0.41 0.00 0.00 41.25 43.16 1lkf s ASN 298 CO 0.01 -0.35 2.12 0.29 -1.51 0.00 0.00 177.10 177.66