#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ikf s ILE 2 N 0.00 4.88 -0.14 0.53 1.01 -1.26 -5.07 121.20 121.15 1ikf s ILE 2 Ca 0.00 0.92 -0.03 0.00 0.00 0.00 0.00 60.65 61.54 1ikf s ILE 2 Cb 0.00 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1ikf s ILE 2 CO 0.00 0.43 -0.03 0.00 0.00 0.00 0.00 174.94 175.34 1ikf s GLN 3 N -1.46 3.57 -0.13 2.79 -2.07 -1.26 -4.80 119.66 116.31 1ikf s GLN 3 Ca 0.31 -0.50 -0.07 0.00 -1.82 0.00 0.00 55.36 53.28 1ikf s GLN 3 Cb -0.17 -2.90 -0.04 0.00 -1.09 0.00 0.00 33.01 28.81 1ikf s GLN 3 CO 0.18 0.32 0.12 -1.64 -1.32 0.00 0.00 175.29 172.94 1ikf s MET 4 N 0.17 3.48 -0.12 9.60 -1.94 -1.26 -1.35 119.30 127.87 1ikf s MET 4 Ca -0.01 -0.18 0.00 0.00 -1.71 0.00 0.00 55.69 53.80 1ikf s MET 4 Cb -0.14 -3.17 0.02 0.00 2.01 0.00 0.00 34.83 33.56 1ikf s MET 4 CO 0.03 0.71 -0.11 0.99 -0.01 0.00 0.00 175.02 176.62 1ikf s THR 5 N -0.84 1.28 -0.24 2.05 2.01 0.72 -4.54 115.64 116.08 1ikf s THR 5 Ca 0.14 -0.47 -0.07 0.00 0.31 0.00 0.00 61.69 61.60 1ikf s THR 5 Cb -0.12 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 1ikf s THR 5 CO 0.03 0.41 0.06 -1.10 -0.69 0.00 0.00 174.62 173.33 1ikf s GLN 6 N 1.44 3.67 0.38 4.92 -0.21 -1.26 -1.21 119.66 127.39 1ikf s GLN 6 Ca 0.02 -0.48 0.09 0.00 0.02 0.00 0.00 55.36 55.01 1ikf s GLN 6 Cb -0.13 -3.27 0.85 0.00 1.00 0.00 0.00 33.01 31.45 1ikf s GLN 6 CO -0.07 -0.12 1.94 1.15 -2.12 0.00 0.00 175.29 176.07 1ikf h THR 7 N 5.47 0.94 -4.34 -0.19 2.02 -1.93 -3.42 112.91 111.44 1ikf h THR 7 Ca -0.38 -0.22 -0.60 0.00 0.77 0.00 0.00 66.41 65.98 1ikf h THR 7 Cb 1.17 0.24 -0.28 0.00 -1.74 0.00 0.00 68.15 67.55 1ikf h THR 7 CO 0.59 0.12 -0.85 -0.89 0.37 0.00 0.00 175.52 174.86 1ikf s THR 8 N -5.59 1.66 -0.99 3.16 2.01 -1.26 -5.02 115.64 109.61 1ikf s THR 8 Ca -0.09 -1.00 0.12 0.00 0.31 0.00 0.00 61.69 61.03 1ikf s THR 8 Cb 0.20 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 71.28 1ikf s THR 8 CO 0.77 0.38 0.67 -1.54 -0.69 0.00 0.00 174.62 174.20 1ikf n SER 9 N 2.32 1.17 -3.68 3.53 3.41 -1.26 -4.26 113.62 114.84 1ikf n SER 9 Ca -0.16 -1.08 -0.10 0.00 -0.26 0.00 0.00 58.87 57.27 1ikf n SER 9 Cb 0.53 0.61 -0.09 0.00 -0.26 0.00 0.00 64.21 64.99 1ikf n SER 9 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1ikf s SER 10 N -1.72 -0.65 0.01 4.04 0.01 -1.25 -0.81 113.70 113.35 1ikf s SER 10 Ca 0.09 1.09 -0.01 0.00 1.31 0.00 0.00 55.95 58.43 1ikf s SER 10 Cb 0.10 0.98 -0.01 0.00 0.21 0.00 0.00 66.02 67.30 1ikf s SER 10 CO 0.36 -0.21 0.01 -1.48 0.41 0.00 0.00 173.24 172.33 1ikf s LEU 11 N 1.34 2.07 -0.03 2.44 2.34 0.18 -4.90 118.68 122.13 1ikf s LEU 11 Ca -0.09 -0.36 0.05 0.00 0.06 0.00 0.00 54.13 53.80 1ikf s LEU 11 Cb -0.07 0.19 -0.01 0.00 -0.56 0.00 0.00 46.19 45.74 1ikf s LEU 11 CO -0.13 -0.26 -0.19 -0.94 -1.06 0.00 0.00 176.35 173.76 1ikf s SER 12 N -1.20 2.30 0.11 1.48 1.04 -1.26 -0.89 113.70 115.28 1ikf s SER 12 Ca -0.13 -0.37 -0.06 0.00 0.48 0.00 0.00 55.95 55.87 1ikf s SER 12 Cb -0.08 -0.47 -0.02 0.00 0.10 0.00 0.00 66.02 65.55 1ikf s SER 12 CO -0.00 0.20 0.16 0.00 0.98 0.00 0.00 173.24 174.57 1ikf s ALA 13 N -0.20 0.12 0.38 5.32 0.00 -0.75 -4.79 121.76 121.85 1ikf s ALA 13 Ca 0.01 -0.91 -0.10 0.00 0.00 0.00 0.00 51.96 50.96 1ikf s ALA 13 Cb -0.10 0.60 -0.06 0.00 0.00 0.00 0.00 23.12 23.55 1ikf s ALA 13 CO 0.01 -0.52 0.74 -1.12 0.00 0.00 0.00 175.76 174.87 1ikf s SER 14 N -2.93 6.52 0.39 0.00 0.01 -1.26 -1.06 113.70 115.38 1ikf s SER 14 Ca 0.11 1.08 -0.26 0.00 1.31 0.00 0.00 55.95 58.19 1ikf s SER 14 Cb 0.05 -2.30 -0.11 0.00 0.21 0.00 0.00 66.02 63.88 1ikf s SER 14 CO -0.06 -0.36 1.25 0.18 0.41 0.00 0.00 173.24 174.66 1ikf n LEU 15 N -1.20 3.75 0.00 2.44 7.99 -1.26 -1.12 117.00 127.60 1ikf n LEU 15 Ca 0.02 1.14 0.00 0.00 -0.01 0.00 0.00 56.01 57.15 1ikf n LEU 15 Cb 0.54 -1.48 0.00 0.00 -0.11 0.00 0.00 43.42 42.37 1ikf n LEU 15 CO 0.47 -0.66 0.00 0.61 -1.51 0.00 0.00 177.39 176.30 1ikf n GLY 16 N 0.83 2.84 3.38 -0.72 0.00 0.02 -4.85 105.19 106.70 1ikf n GLY 16 Ca 0.06 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 1ikf n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ikf n ASP 17 N 1.22 -2.20 -4.56 1.61 8.00 -0.28 -3.67 116.55 116.68 1ikf n ASP 17 Ca 0.00 0.25 -0.34 0.00 0.71 0.00 0.00 54.79 55.41 1ikf n ASP 17 Cb 0.00 -1.16 -0.11 0.00 -0.02 0.00 0.00 41.12 39.83 1ikf n ASP 17 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1ikf s ARG 18 N -3.58 3.80 -0.05 -1.24 3.52 -1.26 -0.49 118.95 119.66 1ikf s ARG 18 Ca 0.56 -0.44 0.04 0.00 -0.13 0.00 0.00 55.73 55.76 1ikf s ARG 18 Cb -0.19 -3.05 -0.00 0.00 -1.56 0.00 0.00 34.95 30.14 1ikf s ARG 18 CO 0.67 0.25 -0.17 0.08 -0.81 0.00 0.00 175.30 175.33 1ikf s VAL 19 N 0.39 1.41 -0.22 7.11 1.01 -0.67 -4.97 120.40 124.46 1ikf s VAL 19 Ca -0.01 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 1ikf s VAL 19 Cb -0.13 -1.22 0.02 0.00 0.00 0.00 0.00 36.38 35.04 1ikf s VAL 19 CO 0.02 0.41 -0.11 -0.89 0.00 0.00 0.00 175.10 174.53 1ikf s THR 20 N 0.15 2.70 -0.05 3.92 2.01 -1.26 -0.62 115.64 122.49 1ikf s THR 20 Ca -0.06 -0.87 -0.20 0.00 0.31 0.00 0.00 61.69 60.87 1ikf s THR 20 Cb -0.12 -2.26 -0.05 0.00 0.01 0.00 0.00 72.50 70.07 1ikf s THR 20 CO 0.03 0.37 0.55 -0.63 -0.69 0.00 0.00 174.62 174.25 1ikf s ILE 21 N 1.35 5.03 0.10 1.82 -1.09 0.17 -4.92 121.20 123.65 1ikf s ILE 21 Ca 0.03 1.14 0.07 0.00 -2.23 0.00 0.00 60.65 59.66 1ikf s ILE 21 Cb -0.15 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 36.80 1ikf s ILE 21 CO -0.07 0.38 -0.12 -0.44 -1.23 0.00 0.00 174.94 173.45 1ikf s SER 22 N 0.13 4.24 0.05 3.58 0.01 -1.26 -1.12 113.70 119.33 1ikf s SER 22 Ca 0.30 -0.42 0.04 0.00 1.31 0.00 0.00 55.95 57.17 1ikf s SER 22 Cb -0.17 -0.76 -0.03 0.00 0.21 0.00 0.00 66.02 65.27 1ikf s SER 22 CO 0.15 0.19 -0.11 0.00 0.41 0.00 0.00 173.24 173.88 1ikf s ARG 24 N -1.55 0.24 0.01 0.00 3.52 -0.35 -1.99 118.95 118.83 1ikf s ARG 24 Ca -0.05 0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 56.06 1ikf s ARG 24 Cb -0.10 -0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.14 1ikf s ARG 24 CO 0.01 -0.16 0.28 0.00 -0.81 0.00 0.00 175.30 174.62 1ikf s ALA 25 N 1.29 3.83 -1.32 6.12 0.00 -0.11 -0.20 121.76 131.36 1ikf s ALA 25 Ca -0.09 -0.54 0.14 0.00 0.00 0.00 0.00 51.96 51.47 1ikf s ALA 25 Cb -0.10 -2.10 0.70 0.00 0.00 0.00 0.00 23.12 21.63 1ikf s ALA 25 CO -0.09 0.63 1.41 -1.13 0.00 0.00 0.00 175.76 176.58 1ikf n SER 26 N 1.15 0.00 -3.69 0.00 3.41 -0.46 -4.75 113.62 109.29 1ikf n SER 26 Ca -0.11 0.18 -0.10 0.00 -0.26 0.00 0.00 58.87 58.58 1ikf n SER 26 Cb 0.53 -0.34 -0.05 0.00 -0.26 0.00 0.00 64.21 64.09 1ikf n SER 26 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1ikf s GLN 27 N -2.68 1.10 0.01 4.33 0.74 -1.26 -4.98 119.66 116.93 1ikf s GLN 27 Ca 0.12 -0.78 -0.30 0.00 0.05 0.00 0.00 55.36 54.44 1ikf s GLN 27 Cb 0.10 0.46 -0.07 0.00 1.10 0.00 0.00 33.01 34.60 1ikf s GLN 27 CO 0.23 -0.43 1.61 0.34 -0.55 0.00 0.00 175.29 176.49 1ikf s ASP 28 N -2.83 6.67 -0.21 6.67 -1.08 -1.26 -4.46 116.67 120.17 1ikf s ASP 28 Ca 0.05 2.33 0.15 0.00 -0.52 0.00 0.00 52.55 54.56 1ikf s ASP 28 Cb 0.02 -2.55 0.59 0.00 -1.46 0.00 0.00 42.92 39.51 1ikf s ASP 28 CO -0.10 -0.87 1.50 2.30 0.52 0.00 0.00 175.17 178.53 1ikf n ILE 29 N 4.98 2.43 -3.04 4.11 -5.35 -0.15 -4.98 119.36 117.36 1ikf n ILE 29 Ca 0.16 -1.86 -0.17 0.00 -0.27 0.00 0.00 62.75 60.61 1ikf n ILE 29 Cb 0.42 -0.27 -0.01 0.00 -1.74 0.00 0.00 39.64 38.04 1ikf n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1ikf n SER 30 N -0.37 -2.93 0.00 7.28 7.64 -1.26 -1.28 113.62 122.71 1ikf n SER 30 Ca 0.25 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.02 1ikf n SER 30 Cb 0.99 -2.49 0.00 0.00 -1.01 0.00 0.00 64.21 61.69 1ikf n SER 30 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1ikf n THR 31 N -3.47 0.00 -2.61 0.44 -1.04 -1.26 -4.91 114.28 101.43 1ikf n THR 31 Ca -0.03 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.55 1ikf n THR 31 Cb 0.54 -0.18 0.00 0.00 -1.82 0.00 0.00 70.33 68.87 1ikf n THR 31 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1ikf n TYR 32 N -2.32 3.78 -3.98 -1.42 4.01 -0.40 -1.77 117.16 115.07 1ikf n TYR 32 Ca 0.00 -3.03 -0.15 0.00 -0.16 0.00 0.00 57.90 54.56 1ikf n TYR 32 Cb 0.06 -2.03 -0.15 0.00 -0.31 0.00 0.00 39.34 36.91 1ikf n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1ikf s LEU 33 N 0.48 1.75 0.07 7.72 1.98 -1.26 -0.67 118.68 128.75 1ikf s LEU 33 Ca 0.41 -0.04 0.06 0.00 -2.89 0.00 0.00 54.13 51.67 1ikf s LEU 33 Cb 0.04 -0.15 -0.03 0.00 0.66 0.00 0.00 46.19 46.71 1ikf s LEU 33 CO 0.01 -0.01 -0.17 0.20 -1.89 0.00 0.00 176.35 174.49 1ikf s ASN 34 N 0.27 2.00 -0.02 3.68 0.01 -0.79 -0.72 114.94 119.37 1ikf s ASN 34 Ca -0.02 -0.60 0.06 0.00 -0.71 0.00 0.00 52.86 51.58 1ikf s ASN 34 Cb -0.05 -0.10 -0.03 0.00 0.41 0.00 0.00 41.25 41.49 1ikf s ASN 34 CO -0.01 0.00 -0.19 0.26 -1.51 0.00 0.00 177.10 175.65 1ikf s TRP 35 N -1.12 2.54 0.11 2.20 0.52 0.36 -1.42 118.94 122.13 1ikf s TRP 35 Ca 0.02 -0.28 0.07 0.00 0.02 0.00 0.00 56.10 55.94 1ikf s TRP 35 Cb -0.09 -1.55 -0.04 0.00 -1.15 0.00 0.00 33.47 30.64 1ikf s TRP 35 CO 0.03 0.12 -0.18 0.71 0.02 0.00 0.00 176.95 177.65 1ikf s TYR 36 N -0.73 1.64 -0.18 -1.98 2.02 -0.20 -1.11 117.35 116.80 1ikf s TYR 36 Ca 0.12 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 1ikf s TYR 36 Cb -0.10 -0.88 0.03 0.00 -0.40 0.00 0.00 41.96 40.61 1ikf s TYR 36 CO 0.01 0.20 -0.16 -1.14 -1.57 0.00 0.00 175.55 172.89 1ikf s GLN 37 N -2.19 2.53 -0.22 -0.62 0.74 -0.53 -1.63 119.66 117.73 1ikf s GLN 37 Ca 0.07 -0.81 -0.05 0.00 0.05 0.00 0.00 55.36 54.63 1ikf s GLN 37 Cb -0.08 -2.44 -0.01 0.00 1.10 0.00 0.00 33.01 31.57 1ikf s GLN 37 CO 0.04 -0.30 -0.01 -1.14 -0.55 0.00 0.00 175.29 173.33 1ikf s GLN 38 N 1.35 3.47 0.63 1.67 0.74 -0.07 -1.89 119.66 125.56 1ikf s GLN 38 Ca 0.02 -0.58 -0.07 0.00 0.05 0.00 0.00 55.36 54.78 1ikf s GLN 38 Cb -0.14 -3.08 0.02 0.00 1.10 0.00 0.00 33.01 30.90 1ikf s GLN 38 CO -0.11 -0.17 0.96 0.15 -0.55 0.00 0.00 175.29 175.57 1ikf s LYS 39 N 1.44 2.80 0.65 1.67 1.02 0.18 -0.19 119.74 127.30 1ikf s LYS 39 Ca 0.05 0.05 0.13 0.00 0.02 0.00 0.00 55.97 56.22 1ikf s LYS 39 Cb -0.14 -2.21 0.73 0.00 -0.52 0.00 0.00 37.83 35.68 1ikf s LYS 39 CO -0.01 -0.85 1.40 -1.35 -0.92 0.00 0.00 175.35 173.62 1ikf h PRO 40 N -0.33 0.00 -0.68 -1.68 0.11 -1.90 -2.01 132.00 125.51 1ikf h PRO 40 Ca -0.45 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.34 1ikf h PRO 40 Cb 1.26 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.19 1ikf h PRO 40 CO 0.61 0.00 0.29 -0.40 -0.21 0.00 0.00 178.00 178.29 1ikf n ASP 41 N -2.64 3.47 0.00 -2.05 5.68 -1.26 -4.94 116.55 114.81 1ikf n ASP 41 Ca -0.01 -3.57 0.00 0.00 -0.50 0.00 0.00 54.79 50.71 1ikf n ASP 41 Cb 0.71 -0.73 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1ikf n ASP 41 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ikf n GLY 42 N -0.94 2.68 3.69 6.12 0.00 -0.76 -5.00 105.19 110.97 1ikf n GLY 42 Ca 0.45 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 46.02 1ikf n GLY 42 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ikf n THR 43 N -0.03 0.49 -5.18 2.61 5.66 -1.26 -4.70 114.28 111.88 1ikf n THR 43 Ca 0.00 -0.12 -0.32 0.00 -3.05 0.00 0.00 64.05 60.56 1ikf n THR 43 Cb 0.00 -1.63 -0.15 0.00 -1.55 0.00 0.00 70.33 67.00 1ikf n THR 43 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1ikf s VAL 44 N 0.45 2.31 0.03 1.08 1.01 -1.26 -0.65 120.40 123.37 1ikf s VAL 44 Ca 0.72 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 1ikf s VAL 44 Cb -0.62 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 1ikf s VAL 44 CO 0.43 0.58 -0.02 -1.59 0.00 0.00 0.00 175.10 174.49 1ikf s LYS 45 N -0.43 0.39 0.18 2.72 -2.85 -0.79 -4.95 119.74 114.01 1ikf s LYS 45 Ca 0.05 -0.75 -0.30 0.00 -1.00 0.00 0.00 55.97 53.96 1ikf s LYS 45 Cb -0.12 0.14 -0.08 0.00 -2.06 0.00 0.00 37.83 35.71 1ikf s LYS 45 CO 0.01 -0.07 1.20 -1.17 0.10 0.00 0.00 175.35 175.43 1ikf s LEU 46 N -1.82 4.45 -0.08 2.77 0.20 -1.26 -1.46 118.68 121.48 1ikf s LEU 46 Ca -0.10 2.24 -0.06 0.00 0.69 0.00 0.00 54.13 56.89 1ikf s LEU 46 Cb -0.05 -3.61 -0.04 0.00 -0.43 0.00 0.00 46.19 42.06 1ikf s LEU 46 CO -0.03 -0.38 -0.15 -0.11 -0.29 0.00 0.00 176.35 175.39 1ikf n LEU 47 N 2.52 1.06 -3.88 -0.68 7.94 -0.27 -4.87 117.00 118.82 1ikf n LEU 47 Ca 0.04 0.17 -0.11 0.00 -1.11 0.00 0.00 56.01 55.00 1ikf n LEU 47 Cb 0.45 -0.40 -0.12 0.00 0.53 0.00 0.00 43.42 43.88 1ikf n LEU 47 CO 0.56 -0.07 -0.26 -0.63 -1.11 0.00 0.00 177.39 175.89 1ikf s ILE 48 N -2.27 0.05 0.06 1.96 1.01 -1.14 -2.72 121.20 118.15 1ikf s ILE 48 Ca -0.14 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.08 1ikf s ILE 48 Cb 0.04 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.22 1ikf s ILE 48 CO 0.19 -0.24 -0.05 0.72 0.00 0.00 0.00 174.94 175.56 1ikf s PHE 49 N -0.76 0.67 -1.17 3.97 -0.71 0.07 -0.48 117.98 119.57 1ikf s PHE 49 Ca -0.08 -0.83 -0.15 0.00 -1.04 0.00 0.00 56.93 54.82 1ikf s PHE 49 Cb -0.05 -0.42 -0.01 0.00 -1.21 0.00 0.00 43.02 41.32 1ikf s PHE 49 CO 0.00 -0.21 0.77 0.98 -1.34 0.00 0.00 175.22 175.42 1ikf n TYR 50 N 0.48 -1.95 0.00 3.49 4.19 -0.97 -2.14 117.16 120.26 1ikf n TYR 50 Ca -0.16 0.57 0.00 0.00 3.31 0.00 0.00 57.90 61.62 1ikf n TYR 50 Cb 0.59 -3.65 0.00 0.00 0.49 0.00 0.00 39.34 36.77 1ikf n TYR 50 CO 0.00 0.00 0.00 -2.37 0.91 0.00 0.00 176.86 175.40 1ikf n THR 51 N -4.10 0.00 0.39 2.97 5.66 0.10 -3.20 114.28 116.10 1ikf n THR 51 Ca -0.13 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 60.91 1ikf n THR 51 Cb 0.61 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.35 1ikf n THR 51 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1ikf n SER 52 N 0.00 0.52 -4.58 1.09 3.41 -1.16 -3.89 113.62 109.01 1ikf n SER 52 Ca 0.00 -0.76 -0.42 0.00 -0.26 0.00 0.00 58.87 57.43 1ikf n SER 52 Cb 0.00 0.91 -0.06 0.00 -0.26 0.00 0.00 64.21 64.80 1ikf n SER 52 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1ikf s ARG 53 N -1.70 3.76 0.39 4.33 3.52 -0.91 -4.44 118.95 123.90 1ikf s ARG 53 Ca 0.04 0.21 -0.24 0.00 -0.13 0.00 0.00 55.73 55.60 1ikf s ARG 53 Cb 0.06 -3.79 -0.09 0.00 -1.56 0.00 0.00 34.95 29.58 1ikf s ARG 53 CO 0.32 -0.72 1.02 -0.51 -0.81 0.00 0.00 175.30 174.60 1ikf s LEU 54 N 2.79 4.16 0.36 -0.88 1.02 -1.26 -0.75 118.68 124.12 1ikf s LEU 54 Ca 0.27 1.97 0.03 0.00 0.02 0.00 0.00 54.13 56.41 1ikf s LEU 54 Cb -0.14 -4.18 -0.02 0.00 0.02 0.00 0.00 46.19 41.87 1ikf s LEU 54 CO 0.14 -0.39 0.53 0.00 0.02 0.00 0.00 176.35 176.66 1ikf s ARG 55 N -2.46 3.24 0.23 1.70 1.04 -1.10 -4.92 118.95 116.68 1ikf s ARG 55 Ca 0.57 -0.64 -0.30 0.00 -1.04 0.00 0.00 55.73 54.31 1ikf s ARG 55 Cb -0.20 -2.71 -0.10 0.00 -2.04 0.00 0.00 34.95 29.90 1ikf s ARG 55 CO 0.26 0.04 1.41 -1.12 -0.04 0.00 0.00 175.30 175.84 1ikf s SER 56 N -4.12 6.72 0.00 -2.89 0.01 -1.26 -2.65 113.70 109.51 1ikf s SER 56 Ca 0.43 2.58 0.00 0.00 1.31 0.00 0.00 55.95 60.27 1ikf s SER 56 Cb -0.10 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.52 1ikf s SER 56 CO 0.34 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.95 1ikf n GLY 57 N 2.36 1.89 3.76 3.44 0.00 -1.26 -5.07 105.19 110.32 1ikf n GLY 57 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1ikf n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ikf s VAL 58 N -2.42 4.87 0.26 1.61 1.01 -1.08 -5.04 120.40 119.61 1ikf s VAL 58 Ca 0.00 1.29 -0.28 0.00 0.00 0.00 0.00 61.98 62.99 1ikf s VAL 58 Cb 0.00 -3.95 -0.15 0.00 0.00 0.00 0.00 36.38 32.28 1ikf s VAL 58 CO 0.00 0.42 0.82 -2.65 0.00 0.00 0.00 175.10 173.70 1ikf n PRO 59 N 2.66 0.86 0.24 2.72 -0.02 -1.26 -4.90 135.00 135.29 1ikf n PRO 59 Ca -0.07 0.30 0.16 0.00 -2.02 0.00 0.00 63.50 61.88 1ikf n PRO 59 Cb 0.51 -1.54 0.86 0.00 -0.02 0.00 0.00 33.50 33.31 1ikf n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ikf h SER 60 N 1.60 0.00 -0.58 2.55 4.64 -1.98 -1.21 113.55 118.57 1ikf h SER 60 Ca -0.36 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.13 1ikf h SER 60 Cb 1.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.44 1ikf h SER 60 CO 0.59 0.00 0.49 0.03 -0.87 0.00 0.00 176.83 177.07 1ikf h ARG 61 N 0.00 0.00 -5.70 4.77 3.08 -1.91 -3.40 114.38 111.23 1ikf h ARG 61 Ca 0.05 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.52 1ikf h ARG 61 Cb 0.30 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.27 1ikf h ARG 61 CO -0.00 0.00 -0.14 -0.06 -1.07 0.00 0.00 179.97 178.70 1ikf s PHE 62 N -4.82 3.49 0.08 3.04 0.40 -0.46 -0.21 117.98 119.50 1ikf s PHE 62 Ca -0.05 0.86 0.02 0.00 -0.60 0.00 0.00 56.93 57.17 1ikf s PHE 62 Cb 0.18 -2.55 -0.03 0.00 0.51 0.00 0.00 43.02 41.13 1ikf s PHE 62 CO 0.66 0.14 -0.08 -1.54 0.70 0.00 0.00 175.22 175.10 1ikf s SER 63 N 0.68 1.09 -0.06 1.36 1.04 -0.52 -4.97 113.70 112.32 1ikf s SER 63 Ca 0.25 -0.79 -0.02 0.00 0.48 0.00 0.00 55.95 55.87 1ikf s SER 63 Cb -0.15 0.06 0.04 0.00 0.10 0.00 0.00 66.02 66.06 1ikf s SER 63 CO 0.10 -0.32 0.13 -0.83 0.98 0.00 0.00 173.24 173.30 1ikf s GLY 64 N -2.35 -0.01 0.49 7.32 0.00 -1.26 -1.17 107.32 110.34 1ikf s GLY 64 Ca 0.02 0.62 0.02 0.00 0.00 0.00 0.00 44.72 45.38 1ikf s GLY 64 CO -0.02 1.01 0.02 -1.35 0.00 0.00 0.00 173.10 172.76 1ikf s SER 65 N 1.25 3.93 0.00 1.64 1.04 -1.01 -2.99 113.70 117.56 1ikf s SER 65 Ca -0.08 -1.65 0.00 0.00 0.48 0.00 0.00 55.95 54.70 1ikf s SER 65 Cb -0.12 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1ikf s SER 65 CO -0.06 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1ikf n GLY 66 N -1.20 3.48 3.24 7.32 0.00 -1.26 -2.36 105.19 114.41 1ikf n GLY 66 Ca -0.17 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 1ikf n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ikf s SER 67 N 0.00 -0.40 0.46 1.61 0.01 -0.95 -4.84 113.70 109.59 1ikf s SER 67 Ca 0.00 0.75 0.00 0.00 1.31 0.00 0.00 55.95 58.01 1ikf s SER 67 Cb 0.00 0.73 0.00 0.00 0.21 0.00 0.00 66.02 66.96 1ikf s SER 67 CO 0.00 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1ikf n GLY 68 N 3.28 1.67 0.00 3.44 0.00 -1.26 -2.24 105.19 110.08 1ikf n GLY 68 Ca -0.16 0.03 0.02 0.00 0.00 0.00 0.00 46.02 45.91 1ikf n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ikf n THR 69 N 0.00 0.00 -4.27 2.61 -2.24 -1.26 -0.98 114.28 108.14 1ikf n THR 69 Ca 0.00 -0.32 -0.34 0.00 -2.27 0.00 0.00 64.05 61.12 1ikf n THR 69 Cb 0.00 0.85 -0.11 0.00 -2.10 0.00 0.00 70.33 68.96 1ikf n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ikf s ASP 70 N -1.73 5.09 0.07 3.42 1.01 -0.95 -0.94 116.67 122.64 1ikf s ASP 70 Ca 0.01 -0.05 0.01 0.00 0.71 0.00 0.00 52.55 53.23 1ikf s ASP 70 Cb 0.04 -1.84 -0.04 0.00 1.01 0.00 0.00 42.92 42.09 1ikf s ASP 70 CO 0.20 0.17 -0.06 -0.31 0.21 0.00 0.00 175.17 175.38 1ikf s TYR 71 N 0.35 0.73 -0.04 4.23 2.02 -0.84 -2.23 117.35 121.57 1ikf s TYR 71 Ca -0.02 -0.80 -0.11 0.00 -0.37 0.00 0.00 57.07 55.77 1ikf s TYR 71 Cb -0.14 -0.45 0.02 0.00 -0.40 0.00 0.00 41.96 41.00 1ikf s TYR 71 CO 0.02 -0.17 0.26 -1.12 -1.57 0.00 0.00 175.55 172.97 1ikf s SER 72 N -2.53 -0.18 -0.16 2.29 0.01 -0.99 -2.05 113.70 110.08 1ikf s SER 72 Ca 0.03 0.20 -0.00 0.00 1.31 0.00 0.00 55.95 57.49 1ikf s SER 72 Cb 0.01 0.39 -0.00 0.00 0.21 0.00 0.00 66.02 66.62 1ikf s SER 72 CO -0.04 -0.30 -0.14 -0.22 0.41 0.00 0.00 173.24 172.96 1ikf s LEU 73 N -0.79 2.55 -0.09 2.44 2.96 -0.27 -2.40 118.68 123.08 1ikf s LEU 73 Ca -0.09 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.39 1ikf s LEU 73 Cb -0.05 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 1ikf s LEU 73 CO 0.02 0.07 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.10 1ikf s THR 74 N 0.89 3.04 -0.37 3.68 2.01 -0.32 -0.65 115.64 123.92 1ikf s THR 74 Ca -0.03 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 61.23 1ikf s THR 74 Cb -0.15 -2.23 0.08 0.00 0.01 0.00 0.00 72.50 70.21 1ikf s THR 74 CO -0.01 0.56 0.14 -0.63 -0.69 0.00 0.00 174.62 173.99 1ikf s ILE 75 N -0.23 3.32 -0.21 1.82 1.01 0.21 -1.43 121.20 125.69 1ikf s ILE 75 Ca 0.01 -1.71 -0.29 0.00 0.00 0.00 0.00 60.65 58.66 1ikf s ILE 75 Cb -0.13 -3.11 -0.00 0.00 0.01 0.00 0.00 42.46 39.23 1ikf s ILE 75 CO 0.03 -0.45 1.18 -0.44 0.00 0.00 0.00 174.94 175.26 1ikf s SER 76 N 1.63 6.98 -0.16 3.58 0.01 0.71 -1.67 113.70 124.78 1ikf s SER 76 Ca 0.03 1.52 -0.02 0.00 1.31 0.00 0.00 55.95 58.78 1ikf s SER 76 Cb -0.22 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.48 1ikf s SER 76 CO -0.02 -0.76 0.04 0.59 0.41 0.00 0.00 173.24 173.50 1ikf n ASN 77 N 6.59 -4.14 -4.68 2.44 5.03 -0.86 -4.67 115.26 114.98 1ikf n ASN 77 Ca 0.13 0.81 -0.42 0.00 0.87 0.00 0.00 54.58 55.97 1ikf n ASN 77 Cb 0.45 -3.47 -0.03 0.00 -1.02 0.00 0.00 39.78 35.72 1ikf n ASN 77 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1ikf s LEU 78 N -0.77 4.32 0.30 3.41 1.43 0.36 -4.74 118.68 122.99 1ikf s LEU 78 Ca -0.05 2.21 0.07 0.00 -1.03 0.00 0.00 54.13 55.33 1ikf s LEU 78 Cb 0.00 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1ikf s LEU 78 CO 0.45 -0.81 0.30 -1.61 0.23 0.00 0.00 176.35 174.91 1ikf s GLU 79 N 2.93 2.92 0.31 1.70 2.02 -1.26 -0.80 118.70 126.52 1ikf s GLU 79 Ca 0.68 -1.12 0.06 0.00 0.02 0.00 0.00 54.97 54.61 1ikf s GLU 79 Cb -0.33 -2.60 0.74 0.00 0.10 0.00 0.00 34.13 32.04 1ikf s GLU 79 CO 0.28 0.21 1.79 0.37 0.02 0.00 0.00 175.26 177.94 1ikf h GLN 80 N 1.25 0.75 0.00 1.61 5.75 -1.95 -1.87 115.11 120.66 1ikf h GLN 80 Ca -0.47 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 57.98 1ikf h GLN 80 Cb 1.25 -0.17 -0.00 0.00 1.07 0.00 0.00 27.48 29.63 1ikf h GLN 80 CO 0.58 0.49 -0.02 0.93 -2.65 0.00 0.00 178.83 178.17 1ikf h GLU 81 N 0.77 0.00 0.00 1.69 3.07 -1.96 -3.21 114.58 114.94 1ikf h GLU 81 Ca 0.56 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.42 1ikf h GLU 81 Cb 0.87 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 1ikf h GLU 81 CO -0.35 0.02 0.00 -0.25 -1.40 0.00 0.00 179.01 177.03 1ikf n ASP 82 N -3.51 0.00 -4.64 1.42 8.00 -0.70 -4.74 116.55 112.38 1ikf n ASP 82 Ca -0.03 -1.55 -0.43 0.00 0.71 0.00 0.00 54.79 53.50 1ikf n ASP 82 Cb 0.11 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 1ikf n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ikf s ILE 83 N -2.00 3.80 0.01 0.53 1.01 -1.22 -4.84 121.20 118.49 1ikf s ILE 83 Ca 0.17 0.93 -0.08 0.00 0.00 0.00 0.00 60.65 61.67 1ikf s ILE 83 Cb 0.08 -3.74 0.03 0.00 0.01 0.00 0.00 42.46 38.83 1ikf s ILE 83 CO 0.13 -0.24 0.35 0.00 0.00 0.00 0.00 174.94 175.19 1ikf n ALA 84 N 7.81 -0.98 -3.16 9.38 0.00 -1.26 -4.46 120.51 127.84 1ikf n ALA 84 Ca 0.17 -0.25 -0.30 0.00 0.00 0.00 0.00 53.44 53.07 1ikf n ALA 84 Cb 0.45 0.07 -0.17 0.00 0.00 0.00 0.00 19.45 19.80 1ikf n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ikf s THR 85 N -2.19 1.78 -0.16 0.00 2.01 0.73 -2.41 115.64 115.41 1ikf s THR 85 Ca 0.08 -0.87 -0.05 0.00 0.31 0.00 0.00 61.69 61.16 1ikf s THR 85 Cb -0.00 -1.55 -0.03 0.00 0.01 0.00 0.00 72.50 70.93 1ikf s THR 85 CO 0.00 0.50 -0.01 -0.31 -0.69 0.00 0.00 174.62 174.12 1ikf s TYR 86 N 0.30 3.10 -0.06 4.92 2.02 -0.42 -0.89 117.35 126.32 1ikf s TYR 86 Ca -0.14 -0.16 0.04 0.00 -0.37 0.00 0.00 57.07 56.44 1ikf s TYR 86 Cb -0.16 -1.98 -0.00 0.00 -0.40 0.00 0.00 41.96 39.42 1ikf s TYR 86 CO 0.06 0.05 -0.19 -0.06 -1.57 0.00 0.00 175.55 173.85 1ikf s PHE 87 N 0.28 1.94 0.31 2.71 0.40 -0.65 -2.31 117.98 120.66 1ikf s PHE 87 Ca -0.01 -0.65 -0.07 0.00 -0.60 0.00 0.00 56.93 55.60 1ikf s PHE 87 Cb -0.13 -1.31 -0.06 0.00 0.51 0.00 0.00 43.02 42.02 1ikf s PHE 87 CO 0.02 -0.25 0.61 0.00 0.70 0.00 0.00 175.22 176.30 1ikf s GLN 89 N -3.48 0.04 -0.01 0.00 -0.44 -0.51 -0.93 119.66 114.33 1ikf s GLN 89 Ca 0.46 0.15 -0.09 0.00 -2.50 0.00 0.00 55.36 53.38 1ikf s GLN 89 Cb -0.11 -0.08 -0.05 0.00 -1.64 0.00 0.00 33.01 31.13 1ikf s GLN 89 CO 0.28 -0.08 0.30 1.14 0.50 0.00 0.00 175.29 177.43 1ikf s GLN 90 N 0.51 3.66 -0.22 1.67 1.03 -0.65 -1.89 119.66 123.77 1ikf s GLN 90 Ca -0.04 0.07 0.13 0.00 0.04 0.00 0.00 55.36 55.57 1ikf s GLN 90 Cb -0.06 -3.13 0.48 0.00 0.03 0.00 0.00 33.01 30.34 1ikf s GLN 90 CO -0.02 0.68 1.39 0.41 -2.54 0.00 0.00 175.29 175.21 1ikf n GLY 91 N 1.45 4.59 0.12 2.60 0.00 0.15 -3.55 105.19 110.55 1ikf n GLY 91 Ca -0.13 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.55 1ikf n GLY 91 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1ikf h SER 92 N 1.16 0.48 -2.57 1.61 0.87 -1.83 -3.47 113.55 109.80 1ikf h SER 92 Ca 0.09 -0.88 -0.54 0.00 -1.23 0.00 0.00 61.79 59.23 1ikf h SER 92 Cb 1.45 -0.15 -0.14 0.00 -0.44 0.00 0.00 62.40 63.12 1ikf h SER 92 CO 0.25 1.32 -0.66 -0.13 -0.53 0.00 0.00 176.83 177.08 1ikf s ARG 93 N -2.72 1.68 -0.17 2.24 1.81 -1.26 -5.12 118.95 115.40 1ikf s ARG 93 Ca -0.13 -1.88 -0.09 0.00 -1.72 0.00 0.00 55.73 51.91 1ikf s ARG 93 Cb 0.02 -1.32 -0.05 0.00 -0.45 0.00 0.00 34.95 33.16 1ikf s ARG 93 CO 0.83 0.03 0.13 0.42 -0.68 0.00 0.00 175.30 176.02 1ikf s ILE 94 N -2.91 5.38 0.71 1.52 1.01 -1.26 -3.65 121.20 122.00 1ikf s ILE 94 Ca 0.32 0.17 -0.14 0.00 0.00 0.00 0.00 60.65 61.00 1ikf s ILE 94 Cb 0.05 -3.42 0.03 0.00 0.01 0.00 0.00 42.46 39.12 1ikf s ILE 94 CO 0.14 0.50 1.14 -2.16 0.00 0.00 0.00 174.94 174.56 1ikf s PRO 95 N -0.09 2.44 0.15 2.79 0.04 -1.26 -4.91 135.00 134.16 1ikf s PRO 95 Ca 0.10 1.50 -0.34 0.00 0.04 0.00 0.00 61.00 62.30 1ikf s PRO 95 Cb -0.11 -1.90 -0.14 0.00 0.04 0.00 0.00 34.50 32.39 1ikf s PRO 95 CO 0.00 -1.55 1.59 -0.35 0.04 0.00 0.00 177.00 176.73 1ikf n PRO 96 N -2.70 2.14 -4.76 0.56 -0.04 -1.24 -4.75 135.00 124.21 1ikf n PRO 96 Ca 0.11 0.77 -0.24 0.00 -0.04 0.00 0.00 63.50 64.10 1ikf n PRO 96 Cb 0.51 -2.54 -0.15 0.00 -0.04 0.00 0.00 33.50 31.28 1ikf n PRO 96 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ikf s THR 97 N 1.06 1.40 0.15 0.52 -4.23 -1.23 -4.98 115.64 108.32 1ikf s THR 97 Ca 0.79 -0.84 0.02 0.00 -1.18 0.00 0.00 61.69 60.48 1ikf s THR 97 Cb -0.68 -1.18 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 1ikf s THR 97 CO 0.39 0.32 0.30 -0.36 -0.54 0.00 0.00 174.62 174.73 1ikf s PHE 98 N -0.51 3.49 0.85 3.99 0.40 -1.26 -1.63 117.98 123.30 1ikf s PHE 98 Ca 0.06 0.18 -0.09 0.00 -0.60 0.00 0.00 56.93 56.48 1ikf s PHE 98 Cb -0.07 -1.71 0.17 0.00 0.51 0.00 0.00 43.02 41.91 1ikf s PHE 98 CO -0.00 0.50 1.18 0.20 0.70 0.00 0.00 175.22 177.79 1ikf s GLY 99 N -3.15 1.77 0.17 4.36 0.00 -0.10 -4.52 107.32 105.84 1ikf s GLY 99 Ca 0.35 -1.41 0.25 0.00 0.00 0.00 0.00 44.72 43.92 1ikf s GLY 99 CO 0.29 -0.73 1.57 0.61 0.00 0.00 0.00 173.10 174.84 1ikf n GLY 100 N -3.36 -1.57 0.00 0.20 0.00 -1.26 -4.78 105.19 94.41 1ikf n GLY 100 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ikf n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ikf n GLY 101 N 1.32 2.51 2.90 -0.02 0.00 -1.26 -5.00 105.19 105.64 1ikf n GLY 101 Ca 0.05 -1.74 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 1ikf n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ikf s THR 102 N -2.01 1.10 0.01 2.61 2.01 -0.98 -4.30 115.64 114.09 1ikf s THR 102 Ca 0.00 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.19 1ikf s THR 102 Cb 0.00 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 1ikf s THR 102 CO 0.00 0.19 0.82 -0.75 -0.69 0.00 0.00 174.62 174.19 1ikf s LYS 103 N 1.65 4.52 -0.12 4.92 2.20 0.01 -1.30 119.74 131.62 1ikf s LYS 103 Ca 0.02 1.14 -0.03 0.00 -0.36 0.00 0.00 55.97 56.73 1ikf s LYS 103 Cb -0.15 -3.41 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 1ikf s LYS 103 CO -0.08 0.15 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.88 1ikf s LEU 104 N 0.39 3.48 0.10 5.43 2.96 -1.01 -0.65 118.68 129.39 1ikf s LEU 104 Ca 0.42 0.04 0.09 0.00 -0.22 0.00 0.00 54.13 54.46 1ikf s LEU 104 Cb -0.20 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 1ikf s LEU 104 CO 0.24 0.28 -0.23 -0.70 -1.32 0.00 0.00 176.35 174.61 1ikf s GLU 105 N -0.28 1.32 -0.15 1.98 2.12 -0.07 -4.09 118.70 119.54 1ikf s GLU 105 Ca 0.06 -1.18 -0.05 0.00 0.36 0.00 0.00 54.97 54.15 1ikf s GLU 105 Cb -0.12 -1.63 -0.04 0.00 0.26 0.00 0.00 34.13 32.60 1ikf s GLU 105 CO 0.02 0.39 0.02 0.42 -0.54 0.00 0.00 175.26 175.58 1ikf s ILE 106 N -1.04 4.47 0.23 -3.70 1.01 -1.26 -1.81 121.20 119.11 1ikf s ILE 106 Ca 0.10 -0.16 -0.29 0.00 0.00 0.00 0.00 60.65 60.30 1ikf s ILE 106 Cb -0.10 -2.97 -0.09 0.00 0.01 0.00 0.00 42.46 39.32 1ikf s ILE 106 CO 0.04 0.51 0.91 -0.22 0.00 0.00 0.00 174.94 176.19 1ikf s LEU 107 N -0.00 4.64 0.36 2.97 2.96 -0.22 -4.83 118.68 124.56 1ikf s LEU 107 Ca 0.04 1.90 -0.04 0.00 -0.22 0.00 0.00 54.13 55.81 1ikf s LEU 107 Cb -0.13 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.02 1ikf s LEU 107 CO 0.02 0.17 0.54 0.00 -1.32 0.00 0.00 176.35 175.75 1ikf s ARG 108 N -1.17 2.03 0.47 1.98 1.70 -1.26 -4.56 118.95 118.13 1ikf s ARG 108 Ca 0.40 -1.75 -0.23 0.00 -0.47 0.00 0.00 55.73 53.68 1ikf s ARG 108 Cb -0.26 0.48 -0.07 0.00 -0.57 0.00 0.00 34.95 34.53 1ikf s ARG 108 CO 0.31 -0.86 1.20 0.00 -1.08 0.00 0.00 175.30 174.87 1ikf s ALA 109 N -2.79 2.96 0.29 7.88 0.00 -1.26 -4.96 121.76 123.87 1ikf s ALA 109 Ca 0.28 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.96 1ikf s ALA 109 Cb -0.01 -3.42 -0.11 0.00 0.00 0.00 0.00 23.12 19.58 1ikf s ALA 109 CO 0.20 -0.78 1.47 -0.51 0.00 0.00 0.00 175.76 176.14 1ikf s ASP 110 N -1.26 6.56 -0.03 0.00 1.11 -1.26 -4.81 116.67 116.98 1ikf s ASP 110 Ca 0.64 2.79 0.02 0.00 0.18 0.00 0.00 52.55 56.18 1ikf s ASP 110 Cb -0.31 -2.64 0.01 0.00 1.07 0.00 0.00 42.92 41.05 1ikf s ASP 110 CO 0.37 -0.76 -0.07 0.00 1.18 0.00 0.00 175.17 175.90 1ikf s ALA 111 N -0.30 0.70 0.17 5.23 0.00 -0.90 -4.90 121.76 121.76 1ikf s ALA 111 Ca 0.58 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 52.19 1ikf s ALA 111 Cb -0.44 -0.31 -0.07 0.00 0.00 0.00 0.00 23.12 22.30 1ikf s ALA 111 CO 0.48 0.08 0.57 0.00 0.00 0.00 0.00 175.76 176.90 1ikf s ALA 112 N 0.38 3.55 0.46 0.00 0.00 -1.26 -1.17 121.76 123.72 1ikf s ALA 112 Ca -0.05 -0.11 -0.22 0.00 0.00 0.00 0.00 51.96 51.58 1ikf s ALA 112 Cb -0.09 -2.55 -0.08 0.00 0.00 0.00 0.00 23.12 20.39 1ikf s ALA 112 CO 0.00 0.44 1.12 -1.25 0.00 0.00 0.00 175.76 176.07 1ikf s PRO 113 N -2.09 3.81 -0.35 0.00 0.04 -1.26 -4.68 135.00 130.47 1ikf s PRO 113 Ca 0.40 1.64 -0.17 0.00 0.04 0.00 0.00 61.00 62.91 1ikf s PRO 113 Cb -0.15 -2.34 -0.01 0.00 0.04 0.00 0.00 34.50 32.04 1ikf s PRO 113 CO 0.19 -0.48 0.43 0.99 0.04 0.00 0.00 177.00 178.18 1ikf s THR 114 N -1.66 5.10 -0.01 1.26 2.01 0.32 -4.84 115.64 117.81 1ikf s THR 114 Ca 0.64 0.18 -0.10 0.00 0.31 0.00 0.00 61.69 62.71 1ikf s THR 114 Cb -0.25 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.32 1ikf s THR 114 CO 0.30 -0.15 0.31 0.54 -0.69 0.00 0.00 174.62 174.93 1ikf s VAL 115 N 2.19 5.21 0.01 3.82 0.11 -1.26 -0.30 120.40 130.18 1ikf s VAL 115 Ca 0.15 0.47 0.03 0.00 -2.93 0.00 0.00 61.98 59.70 1ikf s VAL 115 Cb -0.16 -3.60 -0.01 0.00 -1.53 0.00 0.00 36.38 31.08 1ikf s VAL 115 CO 0.12 0.48 -0.10 -0.44 -3.33 0.00 0.00 175.10 171.83 1ikf s SER 116 N -1.34 1.23 -0.10 3.54 0.01 0.03 -4.97 113.70 112.10 1ikf s SER 116 Ca 0.24 -0.27 0.03 0.00 1.31 0.00 0.00 55.95 57.26 1ikf s SER 116 Cb -0.14 -0.11 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 1ikf s SER 116 CO 0.13 0.07 -0.19 -0.51 0.41 0.00 0.00 173.24 173.15 1ikf s ILE 117 N -0.47 2.55 -0.20 1.44 2.07 -1.26 -1.28 121.20 124.05 1ikf s ILE 117 Ca 0.02 -0.86 -0.01 0.00 -1.41 0.00 0.00 60.65 58.39 1ikf s ILE 117 Cb -0.05 -2.01 0.01 0.00 0.13 0.00 0.00 42.46 40.54 1ikf s ILE 117 CO 0.00 0.55 -0.13 -0.36 -1.91 0.00 0.00 174.94 173.09 1ikf s PHE 118 N 0.16 2.87 0.78 3.50 0.08 0.90 -4.98 117.98 121.28 1ikf s PHE 118 Ca -0.10 -1.37 -0.13 0.00 0.12 0.00 0.00 56.93 55.44 1ikf s PHE 118 Cb -0.16 -2.00 0.07 0.00 -0.57 0.00 0.00 43.02 40.36 1ikf s PHE 118 CO 0.06 -0.70 1.19 -1.25 -0.10 0.00 0.00 175.22 174.41 1ikf s PRO 119 N 1.36 1.88 0.61 0.24 0.04 -1.26 -1.32 135.00 136.55 1ikf s PRO 119 Ca 0.05 1.67 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 1ikf s PRO 119 Cb -0.14 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1ikf s PRO 119 CO -0.09 -2.02 1.32 -2.30 0.04 0.00 0.00 177.00 173.96 1ikf n PRO 120 N -3.14 1.35 -3.03 0.56 -0.02 -1.23 -4.84 135.00 124.66 1ikf n PRO 120 Ca 0.13 0.51 -0.32 0.00 -2.02 0.00 0.00 63.50 61.81 1ikf n PRO 120 Cb 0.51 -2.56 -0.05 0.00 -0.02 0.00 0.00 33.50 31.38 1ikf n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ikf s SER 121 N -1.19 6.68 0.31 2.55 1.04 -1.26 -4.93 113.70 116.89 1ikf s SER 121 Ca 0.78 1.22 0.07 0.00 0.48 0.00 0.00 55.95 58.51 1ikf s SER 121 Cb -0.39 -2.35 0.80 0.00 0.10 0.00 0.00 66.02 64.17 1ikf s SER 121 CO 0.44 -0.28 1.75 0.28 0.98 0.00 0.00 173.24 176.41 1ikf h SER 122 N 1.88 0.71 -0.14 7.02 0.02 -2.00 0.75 113.55 121.80 1ikf h SER 122 Ca -0.48 0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.53 1ikf h SER 122 Cb 1.18 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.70 1ikf h SER 122 CO 0.65 0.19 -0.10 -0.33 -1.14 0.00 0.00 176.83 176.09 1ikf h GLU 123 N 0.66 0.48 0.10 3.45 5.08 -1.99 -2.30 114.58 120.06 1ikf h GLU 123 Ca 0.60 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.83 1ikf h GLU 123 Cb 1.04 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1ikf h GLU 123 CO -0.43 0.59 -0.05 0.37 -1.00 0.00 0.00 179.01 178.49 1ikf h GLN 124 N 0.45 -0.12 -0.58 2.33 4.15 -1.16 -3.06 115.11 117.11 1ikf h GLN 124 Ca 0.09 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.59 1ikf h GLN 124 Cb 0.46 0.03 -0.06 0.00 0.21 0.00 0.00 27.48 28.11 1ikf h GLN 124 CO 0.03 0.26 0.25 -0.07 -1.93 0.00 0.00 178.83 177.37 1ikf h LEU 125 N -0.54 0.31 -1.59 -2.39 3.38 -1.26 0.11 115.31 113.32 1ikf h LEU 125 Ca -0.01 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1ikf h LEU 125 Cb 0.45 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1ikf h LEU 125 CO 0.02 0.20 0.14 0.71 0.09 0.00 0.00 178.44 179.59 1ikf h THR 126 N 0.47 1.11 0.00 0.22 1.35 -1.46 0.30 112.91 114.89 1ikf h THR 126 Ca 0.28 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1ikf h THR 126 Cb 0.28 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.44 1ikf h THR 126 CO -0.24 0.12 0.00 0.28 -0.25 0.00 0.00 175.52 175.43 1ikf h SER 127 N 0.41 0.00 0.00 5.36 0.02 -0.73 -3.48 113.55 115.12 1ikf h SER 127 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1ikf h SER 127 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 1ikf h SER 127 CO -0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.29 1ikf n GLY 128 N 0.80 4.24 3.98 -3.77 0.00 0.10 -5.09 105.19 105.45 1ikf n GLY 128 Ca 0.03 -0.81 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 1ikf n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ikf s GLY 129 N 0.00 1.70 -0.13 -0.02 0.00 -1.23 -0.77 107.32 106.87 1ikf s GLY 129 Ca 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 44.72 43.35 1ikf s GLY 129 CO 0.00 -1.17 0.03 0.00 0.00 0.00 0.00 173.10 171.97 1ikf s ALA 130 N -2.46 0.71 -0.12 3.20 0.00 -0.17 -2.97 121.76 119.95 1ikf s ALA 130 Ca 0.51 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 52.18 1ikf s ALA 130 Cb -0.10 -0.93 0.01 0.00 0.00 0.00 0.00 23.12 22.10 1ikf s ALA 130 CO 0.35 -0.83 -0.21 -1.12 0.00 0.00 0.00 175.76 173.95 1ikf s SER 131 N 1.98 2.94 -0.18 0.00 0.01 -1.26 -0.80 113.70 116.40 1ikf s SER 131 Ca 0.02 -0.55 -0.06 0.00 1.31 0.00 0.00 55.95 56.68 1ikf s SER 131 Cb -0.14 -1.35 -0.03 0.00 0.21 0.00 0.00 66.02 64.70 1ikf s SER 131 CO -0.07 0.10 0.02 0.54 0.41 0.00 0.00 173.24 174.24 1ikf s VAL 132 N 0.66 4.30 0.02 3.43 0.11 -0.29 -3.52 120.40 125.11 1ikf s VAL 132 Ca -0.12 -0.20 0.01 0.00 -2.93 0.00 0.00 61.98 58.74 1ikf s VAL 132 Cb -0.16 -2.93 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 1ikf s VAL 132 CO 0.02 0.46 0.08 -0.69 -3.33 0.00 0.00 175.10 171.64 1ikf s VAL 133 N 0.54 4.64 -0.12 2.04 1.01 -0.43 -1.40 120.40 126.68 1ikf s VAL 133 Ca 0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 1ikf s VAL 133 Cb -0.14 -3.15 0.03 0.00 0.00 0.00 0.00 36.38 33.12 1ikf s VAL 133 CO 0.02 0.28 -0.03 0.00 0.00 0.00 0.00 175.10 175.37 1ikf s PHE 135 N 1.82 3.35 -0.56 0.00 0.08 -0.40 -1.09 117.98 121.17 1ikf s PHE 135 Ca 0.04 0.27 0.03 0.00 0.12 0.00 0.00 56.93 57.38 1ikf s PHE 135 Cb -0.13 -2.24 0.14 0.00 -0.57 0.00 0.00 43.02 40.21 1ikf s PHE 135 CO -0.07 0.13 0.32 -0.51 -0.10 0.00 0.00 175.22 175.00 1ikf s LEU 136 N 0.84 4.54 0.29 -0.37 2.01 -0.37 -0.79 118.68 124.83 1ikf s LEU 136 Ca 0.08 -3.07 -0.02 0.00 0.01 0.00 0.00 54.13 51.13 1ikf s LEU 136 Cb -0.13 -1.68 -0.04 0.00 0.01 0.00 0.00 46.19 44.35 1ikf s LEU 136 CO 0.03 -0.24 0.51 0.20 1.01 0.00 0.00 176.35 177.85 1ikf s ASN 137 N -0.22 6.37 -0.61 2.29 0.01 0.59 -1.66 114.94 121.71 1ikf s ASN 137 Ca 0.18 0.53 -0.12 0.00 -0.71 0.00 0.00 52.86 52.73 1ikf s ASN 137 Cb -0.23 -2.06 0.02 0.00 0.41 0.00 0.00 41.25 39.38 1ikf s ASN 137 CO -0.02 -0.19 0.64 0.59 -1.51 0.00 0.00 177.10 176.61 1ikf n ASN 138 N -1.18 -6.78 -4.09 -1.22 4.13 -0.73 -0.53 115.26 104.87 1ikf n ASN 138 Ca -0.04 -0.10 -0.15 0.00 1.68 0.00 0.00 54.58 55.97 1ikf n ASN 138 Cb 0.55 -3.85 -0.10 0.00 -1.54 0.00 0.00 39.78 34.84 1ikf n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1ikf s PHE 139 N -2.58 1.38 -0.25 3.10 -0.12 -0.41 -4.27 117.98 114.83 1ikf s PHE 139 Ca 0.15 -1.37 -0.18 0.00 -0.05 0.00 0.00 56.93 55.48 1ikf s PHE 139 Cb -0.03 -0.70 0.07 0.00 -0.63 0.00 0.00 43.02 41.73 1ikf s PHE 139 CO 0.81 -0.58 0.63 -0.47 -0.05 0.00 0.00 175.22 175.56 1ikf s TYR 140 N -3.90 -0.82 0.87 3.49 5.04 -0.32 -1.62 117.35 120.09 1ikf s TYR 140 Ca 0.38 1.82 -0.15 0.00 -2.44 0.00 0.00 57.07 56.69 1ikf s TYR 140 Cb 0.06 0.39 0.21 0.00 0.35 0.00 0.00 41.96 42.97 1ikf s TYR 140 CO 0.15 -0.41 0.95 -2.30 -1.34 0.00 0.00 175.55 172.60 1ikf n PRO 141 N 3.49 -1.88 0.19 4.97 -0.02 -1.26 -2.12 135.00 138.37 1ikf n PRO 141 Ca -0.17 -1.49 0.03 0.00 -2.02 0.00 0.00 63.50 59.85 1ikf n PRO 141 Cb 0.57 -1.18 0.36 0.00 -0.02 0.00 0.00 33.50 33.23 1ikf n PRO 141 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ikf h LYS 142 N 0.00 0.00 -6.44 -0.52 3.64 -1.98 -3.43 116.57 107.84 1ikf h LYS 142 Ca -0.33 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.48 1ikf h LYS 142 Cb 0.96 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.73 1ikf h LYS 142 CO 0.22 0.37 1.09 -0.51 -2.27 0.00 0.00 179.45 178.36 1ikf s ASP 143 N -6.87 6.32 0.05 4.20 1.01 -1.26 -4.96 116.67 115.17 1ikf s ASP 143 Ca -0.03 1.03 -0.04 0.00 0.71 0.00 0.00 52.55 54.23 1ikf s ASP 143 Cb 0.14 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.51 1ikf s ASP 143 CO 0.72 -1.41 0.06 -0.51 0.21 0.00 0.00 175.17 174.25 1ikf s ILE 144 N 5.48 0.17 -0.05 0.77 2.07 -1.26 -4.65 121.20 123.73 1ikf s ILE 144 Ca 0.64 -1.39 0.01 0.00 -1.41 0.00 0.00 60.65 58.50 1ikf s ILE 144 Cb -0.17 -1.23 0.02 0.00 0.13 0.00 0.00 42.46 41.22 1ikf s ILE 144 CO 0.31 -0.77 -0.06 0.21 -1.91 0.00 0.00 174.94 172.72 1ikf s ASN 145 N -2.60 1.16 0.02 4.50 2.47 -0.73 -4.99 114.94 114.77 1ikf s ASN 145 Ca 0.02 -0.16 0.05 0.00 0.42 0.00 0.00 52.86 53.18 1ikf s ASN 145 Cb 0.04 -0.53 -0.03 0.00 -1.45 0.00 0.00 41.25 39.27 1ikf s ASN 145 CO -0.08 -0.04 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.45 1ikf s VAL 146 N 0.93 3.30 -0.04 -5.21 1.01 -1.26 -0.54 120.40 118.59 1ikf s VAL 146 Ca -0.11 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 60.95 1ikf s VAL 146 Cb -0.14 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.82 1ikf s VAL 146 CO 0.00 0.37 -0.10 -0.54 0.00 0.00 0.00 175.10 174.83 1ikf s LYS 147 N -1.44 1.20 -0.02 2.72 1.02 -0.09 -4.96 119.74 118.16 1ikf s LYS 147 Ca 0.16 -0.35 -0.07 0.00 0.02 0.00 0.00 55.97 55.74 1ikf s LYS 147 Cb -0.11 -1.08 -0.05 0.00 -0.52 0.00 0.00 37.83 36.08 1ikf s LYS 147 CO 0.07 0.09 0.24 -1.58 -0.92 0.00 0.00 175.35 173.26 1ikf s TRP 148 N 0.34 3.59 -0.05 3.18 0.52 -1.26 -0.31 118.94 124.95 1ikf s TRP 148 Ca -0.06 0.58 -0.01 0.00 0.02 0.00 0.00 56.10 56.63 1ikf s TRP 148 Cb -0.11 -1.99 0.03 0.00 -1.15 0.00 0.00 33.47 30.25 1ikf s TRP 148 CO 0.01 0.65 0.01 0.15 0.02 0.00 0.00 176.95 177.79 1ikf s LYS 149 N -1.56 0.38 -0.28 4.98 1.02 -0.69 -0.31 119.74 123.28 1ikf s LYS 149 Ca 0.24 0.14 -0.02 0.00 0.02 0.00 0.00 55.97 56.36 1ikf s LYS 149 Cb -0.13 -0.72 0.04 0.00 -0.52 0.00 0.00 37.83 36.50 1ikf s LYS 149 CO 0.13 -0.24 -0.02 0.42 -0.92 0.00 0.00 175.35 174.72 1ikf s ILE 150 N 1.66 2.99 -1.40 2.17 1.01 0.24 -1.67 121.20 126.20 1ikf s ILE 150 Ca -0.01 -1.22 -0.04 0.00 0.00 0.00 0.00 60.65 59.39 1ikf s ILE 150 Cb -0.13 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.73 1ikf s ILE 150 CO -0.03 0.02 0.67 0.47 0.00 0.00 0.00 174.94 176.07 1ikf n ASP 151 N 4.65 -1.68 0.00 3.58 8.00 -0.63 -2.43 116.55 128.04 1ikf n ASP 151 Ca -0.14 -0.88 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1ikf n ASP 151 Cb 0.45 -3.66 0.00 0.00 -0.02 0.00 0.00 41.12 37.89 1ikf n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ikf n GLY 152 N -1.71 2.72 3.71 0.44 0.00 -1.26 -5.01 105.19 104.08 1ikf n GLY 152 Ca -0.22 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 1ikf n GLY 152 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ikf s SER 153 N 0.50 6.65 0.28 1.61 1.04 -1.02 -4.96 113.70 117.80 1ikf s SER 153 Ca 0.00 0.77 -0.30 0.00 0.48 0.00 0.00 55.95 56.90 1ikf s SER 153 Cb 0.00 -2.28 -0.11 0.00 0.10 0.00 0.00 66.02 63.73 1ikf s SER 153 CO 0.00 -0.02 1.56 -0.70 0.98 0.00 0.00 173.24 175.07 1ikf s GLU 154 N 0.75 4.15 -0.18 4.02 2.12 -1.26 -0.59 118.70 127.71 1ikf s GLU 154 Ca 0.25 2.52 -0.04 0.00 0.36 0.00 0.00 54.97 58.06 1ikf s GLU 154 Cb -0.15 -3.04 -0.02 0.00 0.26 0.00 0.00 34.13 31.18 1ikf s GLU 154 CO 0.10 -0.59 -0.04 0.50 -0.54 0.00 0.00 175.26 174.69 1ikf s ARG 155 N -0.50 3.56 -0.04 4.30 3.52 0.58 -4.87 118.95 125.49 1ikf s ARG 155 Ca 0.62 -0.56 0.21 0.00 -0.13 0.00 0.00 55.73 55.87 1ikf s ARG 155 Cb -0.47 -2.96 -0.32 0.00 -1.56 0.00 0.00 34.95 29.65 1ikf s ARG 155 CO 0.47 0.07 0.42 1.04 -0.81 0.00 0.00 175.30 176.50 1ikf n GLN 156 N 4.03 0.65 -3.12 5.12 6.02 -1.26 -4.36 117.38 124.46 1ikf n GLN 156 Ca -0.18 -0.18 -0.29 0.00 -0.01 0.00 0.00 57.00 56.35 1ikf n GLN 156 Cb 0.52 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.25 1ikf n GLN 156 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1ikf s ASN 157 N -4.50 6.49 -0.83 1.08 2.47 -1.26 -4.44 114.94 113.95 1ikf s ASN 157 Ca -0.08 0.91 -0.01 0.00 0.42 0.00 0.00 52.86 54.10 1ikf s ASN 157 Cb 0.13 -2.23 0.00 0.00 -1.45 0.00 0.00 41.25 37.70 1ikf s ASN 157 CO 0.86 -0.28 0.70 0.61 -3.72 0.00 0.00 177.10 175.27 1ikf n GLY 158 N -1.07 -0.10 3.14 1.21 0.00 -1.26 -4.81 105.19 102.30 1ikf n GLY 158 Ca 0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 1ikf n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ikf s VAL 159 N -3.24 1.84 -0.24 1.61 1.01 -1.26 -1.72 120.40 118.40 1ikf s VAL 159 Ca 0.05 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1ikf s VAL 159 Cb -0.02 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.74 1ikf s VAL 159 CO 0.50 0.51 -0.03 -0.22 0.00 0.00 0.00 175.10 175.85 1ikf s LEU 160 N 0.77 3.17 -0.16 3.92 0.20 -0.59 -4.95 118.68 121.04 1ikf s LEU 160 Ca -0.09 -0.68 -0.03 0.00 0.69 0.00 0.00 54.13 54.02 1ikf s LEU 160 Cb -0.16 -1.72 -0.02 0.00 -0.43 0.00 0.00 46.19 43.86 1ikf s LEU 160 CO 0.00 -0.10 -0.04 0.20 -0.29 0.00 0.00 176.35 176.12 1ikf s ASN 161 N 1.41 4.69 -0.03 3.68 0.02 -1.26 -1.47 114.94 121.98 1ikf s ASN 161 Ca 0.03 -0.17 0.02 0.00 -1.02 0.00 0.00 52.86 51.72 1ikf s ASN 161 Cb -0.16 -1.77 0.00 0.00 0.02 0.00 0.00 41.25 39.35 1ikf s ASN 161 CO -0.03 0.15 -0.09 -0.55 0.02 0.00 0.00 177.10 176.60 1ikf s SER 162 N 0.50 1.16 0.09 -1.22 0.15 -0.54 -4.99 113.70 108.84 1ikf s SER 162 Ca -0.04 -0.18 0.05 0.00 0.70 0.00 0.00 55.95 56.49 1ikf s SER 162 Cb -0.14 -0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 63.81 1ikf s SER 162 CO 0.03 0.06 -0.01 0.26 1.20 0.00 0.00 173.24 174.78 1ikf s TRP 163 N 0.21 2.97 0.75 3.44 0.51 -1.26 -1.45 118.94 124.11 1ikf s TRP 163 Ca -0.03 -0.04 -0.09 0.00 -2.12 0.00 0.00 56.10 53.82 1ikf s TRP 163 Cb -0.08 -1.53 0.08 0.00 -0.81 0.00 0.00 33.47 31.13 1ikf s TRP 163 CO 0.00 0.48 1.08 0.95 -0.51 0.00 0.00 176.95 178.95 1ikf s THR 164 N -1.30 2.17 0.81 2.01 -4.23 0.74 -4.97 115.64 110.86 1ikf s THR 164 Ca 0.25 -0.19 -0.12 0.00 -1.18 0.00 0.00 61.69 60.46 1ikf s THR 164 Cb -0.12 -2.98 0.08 0.00 1.34 0.00 0.00 72.50 70.82 1ikf s THR 164 CO 0.18 0.00 1.12 -1.81 -0.54 0.00 0.00 174.62 173.57 1ikf s ASP 165 N -4.57 4.42 -0.03 3.99 1.01 -1.26 -4.61 116.67 115.62 1ikf s ASP 165 Ca 0.62 1.08 -0.30 0.00 0.71 0.00 0.00 52.55 54.66 1ikf s ASP 165 Cb -0.10 -1.73 -0.08 0.00 1.01 0.00 0.00 42.92 42.02 1ikf s ASP 165 CO 0.46 -1.99 1.96 -1.58 0.21 0.00 0.00 175.17 174.24 1ikf s GLN 166 N -5.31 3.95 -0.19 8.23 0.74 -1.26 -4.77 119.66 121.06 1ikf s GLN 166 Ca 0.61 2.43 -0.35 0.00 0.05 0.00 0.00 55.36 58.10 1ikf s GLN 166 Cb -0.13 -4.18 -0.11 0.00 1.10 0.00 0.00 33.01 29.69 1ikf s GLN 166 CO 0.52 -1.16 1.97 -3.47 -0.55 0.00 0.00 175.29 172.60 1ikf n ASP 167 N 8.27 3.00 -0.40 6.67 -0.08 0.08 -4.87 116.55 129.21 1ikf n ASP 167 Ca 0.21 0.78 0.32 0.00 -1.51 0.00 0.00 54.79 54.60 1ikf n ASP 167 Cb 0.42 -1.33 0.60 0.00 2.34 0.00 0.00 41.12 43.15 1ikf n ASP 167 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1ikf h SER 168 N 10.26 0.31 0.04 1.67 0.02 -1.90 0.15 113.55 124.10 1ikf h SER 168 Ca -0.43 0.12 -0.37 0.00 -0.84 0.00 0.00 61.79 60.27 1ikf h SER 168 Cb 1.29 0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.85 1ikf h SER 168 CO 0.97 -0.10 -2.36 1.17 -1.14 0.00 0.00 176.83 175.36 1ikf n LYS 169 N -4.69 0.67 -0.19 3.45 3.00 -1.26 -4.60 118.16 114.54 1ikf n LYS 169 Ca 0.33 0.10 0.08 0.00 -0.00 0.00 0.00 58.31 58.82 1ikf n LYS 169 Cb 1.25 -1.55 0.16 0.00 0.00 0.00 0.00 35.03 34.89 1ikf n LYS 169 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1ikf n ASP 170 N -3.03 2.86 -1.80 3.14 5.75 -1.20 -4.98 116.55 117.29 1ikf n ASP 170 Ca -0.37 -2.81 -0.17 0.00 -0.01 0.00 0.00 54.79 51.42 1ikf n ASP 170 Cb 1.07 -0.39 -0.05 0.00 -1.03 0.00 0.00 41.12 40.72 1ikf n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1ikf n SER 171 N -0.81 -4.70 -4.97 -1.12 7.64 0.51 -4.97 113.62 105.19 1ikf n SER 171 Ca 0.15 0.31 -0.21 0.00 1.01 0.00 0.00 58.87 60.13 1ikf n SER 171 Cb 0.65 -4.14 0.01 0.00 -1.01 0.00 0.00 64.21 59.71 1ikf n SER 171 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ikf s THR 172 N -2.59 3.96 0.25 0.44 2.01 -1.26 -4.67 115.64 113.78 1ikf s THR 172 Ca 0.00 -0.69 0.11 0.00 0.31 0.00 0.00 61.69 61.42 1ikf s THR 172 Cb 0.00 -3.43 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 1ikf s THR 172 CO 0.00 -0.25 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.20 1ikf s TYR 173 N -2.42 2.38 0.02 4.92 2.02 -0.64 -0.74 117.35 122.89 1ikf s TYR 173 Ca 0.48 -0.31 0.01 0.00 -0.37 0.00 0.00 57.07 56.87 1ikf s TYR 173 Cb -0.10 -1.08 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 1ikf s TYR 173 CO 0.35 0.64 -0.04 -1.12 -1.57 0.00 0.00 175.55 173.81 1ikf s SER 174 N -3.28 0.45 0.05 2.29 0.01 -1.26 -1.29 113.70 110.66 1ikf s SER 174 Ca 0.28 -0.44 0.02 0.00 1.31 0.00 0.00 55.95 57.12 1ikf s SER 174 Cb -0.06 0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.20 1ikf s SER 174 CO 0.14 -0.21 -0.08 -0.32 0.41 0.00 0.00 173.24 173.19 1ikf s MET 175 N -1.26 0.57 -0.05 12.44 1.75 -0.67 -0.19 119.30 131.91 1ikf s MET 175 Ca -0.11 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.52 1ikf s MET 175 Cb -0.08 -0.30 0.02 0.00 2.84 0.00 0.00 34.83 37.30 1ikf s MET 175 CO -0.00 0.05 -0.07 0.45 -0.65 0.00 0.00 175.02 174.80 1ikf s SER 176 N -1.74 1.13 -0.18 1.11 0.15 -0.53 -1.23 113.70 112.41 1ikf s SER 176 Ca -0.07 -0.17 0.01 0.00 0.70 0.00 0.00 55.95 56.41 1ikf s SER 176 Cb -0.08 -0.51 0.02 0.00 -1.71 0.00 0.00 66.02 63.73 1ikf s SER 176 CO -0.00 -0.02 -0.19 -0.55 1.20 0.00 0.00 173.24 173.68 1ikf s SER 177 N 0.76 3.23 -0.08 5.45 0.15 -0.25 -1.47 113.70 121.48 1ikf s SER 177 Ca -0.12 -0.62 0.02 0.00 0.70 0.00 0.00 55.95 55.94 1ikf s SER 177 Cb -0.14 -1.50 -0.02 0.00 -1.71 0.00 0.00 66.02 62.65 1ikf s SER 177 CO 0.01 0.01 -0.13 -0.89 1.20 0.00 0.00 173.24 173.45 1ikf s THR 178 N 1.21 3.14 -0.21 6.45 2.01 -0.54 -0.79 115.64 126.91 1ikf s THR 178 Ca 0.03 -0.67 -0.06 0.00 0.31 0.00 0.00 61.69 61.30 1ikf s THR 178 Cb -0.14 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 1ikf s THR 178 CO -0.10 0.57 0.03 -0.22 -0.69 0.00 0.00 174.62 174.21 1ikf s LEU 179 N -0.37 3.39 -0.11 4.42 1.98 -0.49 -1.55 118.68 125.95 1ikf s LEU 179 Ca 0.04 -0.16 -0.02 0.00 -2.89 0.00 0.00 54.13 51.10 1ikf s LEU 179 Cb -0.12 -1.87 -0.03 0.00 0.66 0.00 0.00 46.19 44.82 1ikf s LEU 179 CO 0.02 0.05 -0.03 -0.89 -1.89 0.00 0.00 176.35 173.62 1ikf s THR 180 N 1.07 3.99 0.37 3.68 2.01 -0.70 -1.14 115.64 124.93 1ikf s THR 180 Ca 0.03 -0.35 0.06 0.00 0.31 0.00 0.00 61.69 61.74 1ikf s THR 180 Cb -0.14 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.64 1ikf s THR 180 CO 0.02 0.55 0.22 -0.76 -0.69 0.00 0.00 174.62 173.97 1ikf s LEU 181 N -0.33 1.85 0.33 4.42 1.02 0.02 -4.83 118.68 121.17 1ikf s LEU 181 Ca 0.06 -1.75 -0.16 0.00 0.02 0.00 0.00 54.13 52.30 1ikf s LEU 181 Cb -0.12 0.31 -0.09 0.00 0.02 0.00 0.00 46.19 46.30 1ikf s LEU 181 CO 0.02 -1.03 0.76 0.42 0.02 0.00 0.00 176.35 176.54 1ikf s THR 182 N -3.33 4.65 0.21 5.49 -4.23 -1.26 -1.00 115.64 116.16 1ikf s THR 182 Ca 0.33 1.01 -0.13 0.00 -1.18 0.00 0.00 61.69 61.72 1ikf s THR 182 Cb 0.02 -3.61 0.22 0.00 1.34 0.00 0.00 72.50 70.47 1ikf s THR 182 CO 0.23 -0.20 1.63 0.50 -0.54 0.00 0.00 174.62 176.24 1ikf h LYS 183 N 2.22 0.01 0.01 3.99 3.64 -1.18 0.17 116.57 125.43 1ikf h LYS 183 Ca -0.48 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.92 1ikf h LYS 183 Cb 1.18 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.95 1ikf h LYS 183 CO 0.65 0.01 -0.42 -0.44 -2.27 0.00 0.00 179.45 176.97 1ikf h ASP 184 N 0.01 -1.31 -1.00 4.20 3.32 -1.94 0.27 116.42 119.98 1ikf h ASP 184 Ca 0.30 0.15 0.18 0.00 0.02 0.00 0.00 57.03 57.68 1ikf h ASP 184 Cb 0.46 0.50 -0.11 0.00 0.22 0.00 0.00 39.33 40.40 1ikf h ASP 184 CO -0.62 -0.42 0.60 -0.08 -1.72 0.00 0.00 179.24 177.01 1ikf h GLU 185 N -0.54 0.75 -0.56 3.56 4.57 -1.69 -2.21 114.58 118.47 1ikf h GLU 185 Ca 0.01 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 1ikf h GLU 185 Cb 0.57 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 1ikf h GLU 185 CO -0.28 0.50 0.02 -0.92 -1.18 0.00 0.00 179.01 177.15 1ikf h TYR 186 N 0.78 1.02 -0.00 0.92 3.20 0.15 -2.64 116.97 120.40 1ikf h TYR 186 Ca 0.57 -0.15 0.00 0.00 3.14 0.00 0.00 58.73 62.29 1ikf h TYR 186 Cb 0.86 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.85 1ikf h TYR 186 CO -0.01 0.91 -0.05 0.39 -1.64 0.00 0.00 178.16 177.76 1ikf n GLU 187 N -4.20 0.53 -0.02 1.82 1.02 0.71 -3.20 120.64 117.31 1ikf n GLU 187 Ca 0.03 -0.09 0.11 0.00 -0.02 0.00 0.00 57.16 57.19 1ikf n GLU 187 Cb 0.32 -1.50 0.56 0.00 -0.02 0.00 0.00 31.44 30.79 1ikf n GLU 187 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ikf n ARG 188 N -1.15 1.21 -3.86 3.49 0.63 -1.00 -4.86 116.66 111.13 1ikf n ARG 188 Ca 0.14 -0.32 -0.11 0.00 -0.92 0.00 0.00 57.85 56.64 1ikf n ARG 188 Cb 0.25 -1.35 -0.11 0.00 0.45 0.00 0.00 32.46 31.70 1ikf n ARG 188 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1ikf s HIS 189 N -1.95 -0.02 -0.31 -0.14 3.76 -1.19 -5.09 115.29 110.35 1ikf s HIS 189 Ca 0.32 0.03 0.10 0.00 -0.15 0.00 0.00 55.06 55.36 1ikf s HIS 189 Cb 0.15 -0.02 -0.13 0.00 1.11 0.00 0.00 32.58 33.70 1ikf s HIS 189 CO 0.25 -0.21 0.35 0.27 -0.85 0.00 0.00 174.74 174.56 1ikf n ASN 190 N 2.01 1.26 -4.10 1.40 0.23 -1.26 -4.79 115.26 110.01 1ikf n ASN 190 Ca -0.19 -0.47 -0.28 0.00 -0.53 0.00 0.00 54.58 53.11 1ikf n ASN 190 Cb 0.57 1.17 -0.17 0.00 -2.08 0.00 0.00 39.78 39.27 1ikf n ASN 190 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 1ikf s SER 191 N -2.40 2.31 -0.17 0.53 0.01 -1.26 0.06 113.70 112.78 1ikf s SER 191 Ca 0.01 -0.40 0.00 0.00 1.31 0.00 0.00 55.95 56.87 1ikf s SER 191 Cb 0.07 -1.06 0.01 0.00 0.21 0.00 0.00 66.02 65.25 1ikf s SER 191 CO 0.42 0.08 -0.17 -0.31 0.41 0.00 0.00 173.24 173.67 1ikf s TYR 192 N 0.55 2.79 -0.05 2.43 1.51 -0.55 -1.60 117.35 122.43 1ikf s TYR 192 Ca -0.16 -1.32 0.04 0.00 -1.01 0.00 0.00 57.07 54.62 1ikf s TYR 192 Cb -0.17 -1.92 -0.00 0.00 -0.11 0.00 0.00 41.96 39.76 1ikf s TYR 192 CO 0.06 -0.64 -0.18 0.99 -1.11 0.00 0.00 175.55 174.66 1ikf s THR 193 N 1.11 1.52 -0.28 -0.71 2.01 -0.67 -2.20 115.64 116.42 1ikf s THR 193 Ca 0.00 -0.76 -0.05 0.00 0.31 0.00 0.00 61.69 61.19 1ikf s THR 193 Cb -0.14 -1.30 0.01 0.00 0.01 0.00 0.00 72.50 71.07 1ikf s THR 193 CO -0.06 0.43 0.04 0.00 -0.69 0.00 0.00 174.62 174.34 1ikf s GLU 195 N 1.46 2.34 -0.16 0.00 2.12 0.57 -1.45 118.70 123.59 1ikf s GLU 195 Ca 0.02 -1.37 -0.14 0.00 0.36 0.00 0.00 54.97 53.84 1ikf s GLU 195 Cb -0.17 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.90 1ikf s GLU 195 CO 0.01 -0.71 0.32 0.00 -0.54 0.00 0.00 175.26 174.33 1ikf s ALA 196 N 1.24 3.57 -0.10 6.30 0.00 -0.03 -0.92 121.76 131.83 1ikf s ALA 196 Ca -0.02 -0.43 0.03 0.00 0.00 0.00 0.00 51.96 51.54 1ikf s ALA 196 Cb -0.20 -2.43 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 1ikf s ALA 196 CO -0.01 0.06 -0.20 0.99 0.00 0.00 0.00 175.76 176.59 1ikf s THR 197 N 0.54 2.41 0.09 0.00 2.01 0.30 -0.66 115.64 120.32 1ikf s THR 197 Ca 0.18 -0.91 -0.20 0.00 0.31 0.00 0.00 61.69 61.06 1ikf s THR 197 Cb -0.13 -1.94 0.05 0.00 0.01 0.00 0.00 72.50 70.49 1ikf s THR 197 CO 0.05 0.55 0.50 -2.28 -0.69 0.00 0.00 174.62 172.75 1ikf s HIS 198 N 0.17 -0.38 0.27 4.92 2.46 -1.26 -1.77 115.29 119.69 1ikf s HIS 198 Ca -0.12 0.26 -0.00 0.00 0.47 0.00 0.00 55.06 55.68 1ikf s HIS 198 Cb -0.16 0.36 0.57 0.00 -0.13 0.00 0.00 32.58 33.22 1ikf s HIS 198 CO 0.06 -0.70 1.75 -0.22 -2.47 0.00 0.00 174.74 173.16 1ikf h LYS 199 N 2.51 0.56 0.00 2.88 3.64 -1.93 -2.73 116.57 121.50 1ikf h LYS 199 Ca -0.32 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 1ikf h LYS 199 Cb 1.25 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1ikf h LYS 199 CO 0.42 0.37 0.00 0.25 -2.27 0.00 0.00 179.45 178.22 1ikf n THR 200 N -4.91 0.00 -3.92 1.00 -2.24 -1.26 -4.70 114.28 98.25 1ikf n THR 200 Ca 0.18 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.87 1ikf n THR 200 Cb 0.48 -0.77 -0.09 0.00 -2.10 0.00 0.00 70.33 67.85 1ikf n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ikf s SER 201 N -1.95 0.16 -0.14 3.42 0.15 -1.03 -4.96 113.70 109.36 1ikf s SER 201 Ca 0.08 -0.51 -0.10 0.00 0.70 0.00 0.00 55.95 56.13 1ikf s SER 201 Cb 0.04 0.23 -0.06 0.00 -1.71 0.00 0.00 66.02 64.52 1ikf s SER 201 CO 0.07 -0.51 -0.02 0.71 1.20 0.00 0.00 173.24 174.69 1ikf h THR 202 N 3.65 0.24 -3.54 6.45 1.35 -1.85 -3.44 112.91 115.77 1ikf h THR 202 Ca -0.32 -1.25 -0.52 0.00 -0.55 0.00 0.00 66.41 63.77 1ikf h THR 202 Cb 1.19 0.52 -0.03 0.00 -1.73 0.00 0.00 68.15 68.10 1ikf h THR 202 CO 0.50 0.08 0.25 -0.44 -0.25 0.00 0.00 175.52 175.66 1ikf s SER 203 N -5.87 7.41 0.52 5.36 0.01 -1.26 -5.01 113.70 114.86 1ikf s SER 203 Ca -0.13 1.67 -0.18 0.00 1.31 0.00 0.00 55.95 58.62 1ikf s SER 203 Cb 0.02 -2.53 -0.13 0.00 0.21 0.00 0.00 66.02 63.58 1ikf s SER 203 CO 0.24 0.07 0.06 -0.81 0.41 0.00 0.00 173.24 173.22 1ikf n PRO 204 N 2.25 0.14 -3.23 12.44 -0.04 -1.26 -4.95 135.00 140.35 1ikf n PRO 204 Ca -0.02 0.06 -0.39 0.00 -0.04 0.00 0.00 63.50 63.10 1ikf n PRO 204 Cb 0.49 -1.19 -0.06 0.00 -0.04 0.00 0.00 33.50 32.69 1ikf n PRO 204 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ikf s ILE 205 N -1.91 5.11 -0.12 0.52 -1.09 0.17 -4.92 121.20 118.94 1ikf s ILE 205 Ca 0.60 1.02 0.02 0.00 -2.23 0.00 0.00 60.65 60.05 1ikf s ILE 205 Cb -0.49 -3.86 0.02 0.00 -1.58 0.00 0.00 42.46 36.54 1ikf s ILE 205 CO 0.63 0.20 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.68 1ikf s VAL 206 N 1.44 1.62 0.03 2.92 1.01 -1.26 -0.85 120.40 125.32 1ikf s VAL 206 Ca 0.26 -0.70 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1ikf s VAL 206 Cb -0.16 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1ikf s VAL 206 CO 0.10 0.47 -0.17 -0.54 0.00 0.00 0.00 175.10 174.96 1ikf s LYS 207 N 1.07 2.13 0.07 2.72 -0.14 -0.53 -4.99 119.74 120.07 1ikf s LYS 207 Ca -0.04 -0.95 -0.08 0.00 -1.36 0.00 0.00 55.97 53.55 1ikf s LYS 207 Cb -0.14 -2.22 -0.01 0.00 -1.68 0.00 0.00 37.83 33.78 1ikf s LYS 207 CO -0.04 0.55 0.16 -1.12 -0.76 0.00 0.00 175.35 174.14 1ikf s SER 208 N -1.40 0.16 -0.10 2.83 0.01 -1.26 -0.95 113.70 112.99 1ikf s SER 208 Ca 0.15 -0.65 -0.11 0.00 1.31 0.00 0.00 55.95 56.65 1ikf s SER 208 Cb -0.11 0.31 0.03 0.00 0.21 0.00 0.00 66.02 66.46 1ikf s SER 208 CO 0.05 -0.68 0.30 0.72 0.41 0.00 0.00 173.24 174.04 1ikf s PHE 209 N -3.63 -0.30 -0.19 2.43 -0.12 -0.93 -5.00 117.98 110.24 1ikf s PHE 209 Ca 0.03 0.71 -0.07 0.00 -0.05 0.00 0.00 56.93 57.56 1ikf s PHE 209 Cb 0.04 0.11 -0.04 0.00 -0.63 0.00 0.00 43.02 42.50 1ikf s PHE 209 CO -0.10 -0.19 0.04 1.21 -0.05 0.00 0.00 175.22 176.14 1ikf s ASN 210 N -0.07 5.41 0.36 1.98 3.84 -0.56 -1.49 114.94 124.41 1ikf s ASN 210 Ca -0.02 0.00 0.11 0.00 0.21 0.00 0.00 52.86 53.17 1ikf s ASN 210 Cb -0.03 -1.92 0.62 0.00 -0.55 0.00 0.00 41.25 39.36 1ikf s ASN 210 CO 0.01 0.15 1.22 0.03 -2.79 0.00 0.00 177.10 175.72 1ikf h ARG 211 N 6.90 0.00 0.00 0.43 3.08 -0.68 0.24 114.38 124.34 1ikf h ARG 211 Ca -0.36 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.52 1ikf h ARG 211 Cb 1.17 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 1ikf h ARG 211 CO 0.67 0.00 -2.18 0.00 -1.07 0.00 0.00 179.97 177.39 1ikf n ALA 212 N -1.52 2.18 -3.18 0.04 0.00 -1.26 -4.48 120.51 112.28 1ikf n ALA 212 Ca -0.01 -0.91 -0.25 0.00 0.00 0.00 0.00 53.44 52.28 1ikf n ALA 212 Cb 0.44 -0.47 -0.06 0.00 0.00 0.00 0.00 19.45 19.36 1ikf n ALA 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ikf n ALA 213 N -2.49 3.57 1.93 0.00 0.00 0.66 -5.27 120.51 118.90 1ikf n ALA 213 Ca -0.18 -4.24 0.16 0.00 0.00 0.00 0.00 53.44 49.18 1ikf n ALA 213 Cb 0.85 -0.84 0.89 0.00 0.00 0.00 0.00 19.45 20.35 1ikf n ALA 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50