#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzf n ALA 3 N 0.00 2.19 -2.24 -0.43 0.00 -1.26 -5.06 120.51 113.71 3kzf n ALA 3 Ca 0.00 -0.68 -0.32 0.00 0.00 0.00 0.00 53.44 52.43 3kzf n ALA 3 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 3kzf n ALA 3 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3kzf s GLY 4 N -0.40 2.31 0.41 0.00 0.00 -1.25 -5.05 107.32 103.34 3kzf s GLY 4 Ca 0.00 -0.08 -0.23 0.00 0.00 0.00 0.00 44.72 44.41 3kzf s GLY 4 CO 0.00 0.10 1.01 0.54 0.00 0.00 0.00 173.10 174.76 3kzf s LYS 5 N -2.92 4.18 -0.14 2.90 1.02 -1.26 -4.53 119.74 118.98 3kzf s LYS 5 Ca 0.52 1.38 -0.18 0.00 0.02 0.00 0.00 55.97 57.71 3kzf s LYS 5 Cb -0.11 -2.44 -0.04 0.00 -0.52 0.00 0.00 37.83 34.73 3kzf s LYS 5 CO 0.19 -0.10 0.49 0.95 -0.92 0.00 0.00 175.35 175.95 3kzf s THR 6 N -1.80 5.17 -0.10 2.17 -4.23 -1.26 -1.72 115.64 113.86 3kzf s THR 6 Ca 0.59 0.95 -0.00 0.00 -1.18 0.00 0.00 61.69 62.04 3kzf s THR 6 Cb -0.18 -3.82 -0.03 0.00 1.34 0.00 0.00 72.50 69.81 3kzf s THR 6 CO 0.23 0.28 -0.07 0.54 -0.54 0.00 0.00 174.62 175.05 3kzf s VAL 7 N 0.94 3.61 -0.34 2.29 0.11 -0.20 -1.64 120.40 125.17 3kzf s VAL 7 Ca 0.25 -0.49 -0.09 0.00 -2.93 0.00 0.00 61.98 58.72 3kzf s VAL 7 Cb -0.15 -2.51 0.02 0.00 -1.53 0.00 0.00 36.38 32.21 3kzf s VAL 7 CO 0.10 0.56 0.16 -0.69 -3.33 0.00 0.00 175.10 171.90 3kzf s VAL 8 N -0.29 4.36 -0.09 2.04 1.01 0.36 -2.19 120.40 125.59 3kzf s VAL 8 Ca 0.04 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 3kzf s VAL 8 Cb -0.13 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 3kzf s VAL 8 CO 0.02 -0.12 0.10 -0.63 0.00 0.00 0.00 175.10 174.48 3kzf s ILE 9 N 1.53 5.14 -0.66 2.22 1.01 -0.62 -0.45 121.20 129.37 3kzf s ILE 9 Ca 0.02 0.02 0.06 0.00 0.00 0.00 0.00 60.65 60.74 3kzf s ILE 9 Cb -0.19 -3.25 0.22 0.00 0.01 0.00 0.00 42.46 39.26 3kzf s ILE 9 CO 0.05 0.57 0.65 0.00 0.00 0.00 0.00 174.94 176.21 3kzf n ALA 10 N 1.87 3.80 -1.63 9.38 0.00 0.11 -1.69 120.51 132.35 3kzf n ALA 10 Ca -0.18 -4.65 -0.63 0.00 0.00 0.00 0.00 53.44 47.97 3kzf n ALA 10 Cb 0.54 -0.95 -0.09 0.00 0.00 0.00 0.00 19.45 18.96 3kzf n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3kzf n LEU 11 N 1.29 0.64 -4.77 0.00 4.77 -0.72 -3.29 117.00 114.92 3kzf n LEU 11 Ca 0.26 1.17 -0.34 0.00 -0.03 0.00 0.00 56.01 57.08 3kzf n LEU 11 Cb 0.39 -0.90 0.04 0.00 -2.33 0.00 0.00 43.42 40.61 3kzf n LEU 11 CO 0.35 -1.35 0.76 -0.83 -1.33 0.00 0.00 177.39 174.99 3kzf s GLY 12 N 1.54 2.32 0.31 -0.72 0.00 -1.26 -2.21 107.32 107.30 3kzf s GLY 12 Ca 0.98 0.66 0.16 0.00 0.00 0.00 0.00 44.72 46.52 3kzf s GLY 12 CO 0.69 1.02 1.59 -1.33 0.00 0.00 0.00 173.10 175.08 3kzf h GLY 13 N 0.35 0.00 1.86 0.20 0.00 -1.94 -2.31 103.07 101.24 3kzf h GLY 13 Ca -0.48 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.86 3kzf h GLY 13 CO 0.55 0.00 0.06 -0.57 0.00 0.00 0.00 176.54 176.58 3kzf h ASN 14 N 0.00 0.00 -0.12 0.19 -0.73 -1.94 -2.85 115.58 110.14 3kzf h ASN 14 Ca -0.01 0.00 -0.05 0.00 1.87 0.00 0.00 56.30 58.11 3kzf h ASN 14 Cb 1.15 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.70 3kzf h ASN 14 CO 0.07 0.00 0.07 0.00 -0.37 0.00 0.00 177.43 177.19 3kzf n ALA 15 N -2.20 2.85 0.00 1.57 0.00 -0.87 -3.11 120.51 118.75 3kzf n ALA 15 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3kzf n ALA 15 Cb 0.14 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3kzf n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kzf n MET 16 N 0.26 0.00 -3.73 0.00 -0.00 -1.10 -4.32 117.12 108.23 3kzf n MET 16 Ca 0.07 0.00 -0.29 0.00 -0.00 0.00 0.00 57.70 57.48 3kzf n MET 16 Cb 0.60 -0.09 -0.13 0.00 -0.00 0.00 0.00 33.22 33.61 3kzf n MET 16 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 3kzf s LEU 17 N -3.33 3.07 0.37 3.17 2.96 -1.10 -4.12 118.68 119.70 3kzf s LEU 17 Ca 0.00 -2.92 -0.28 0.00 -0.22 0.00 0.00 54.13 50.71 3kzf s LEU 17 Cb 0.00 -1.13 -0.11 0.00 0.50 0.00 0.00 46.19 45.45 3kzf s LEU 17 CO 0.00 -0.22 1.50 -1.10 -1.32 0.00 0.00 176.35 175.21 3kzf s GLN 18 N -0.04 4.11 0.06 1.98 -0.21 -1.18 -4.45 119.66 119.93 3kzf s GLN 18 Ca 0.20 2.57 0.01 0.00 0.02 0.00 0.00 55.36 58.16 3kzf s GLN 18 Cb -0.18 -2.98 0.17 0.00 1.00 0.00 0.00 33.01 31.02 3kzf s GLN 18 CO -0.05 -0.54 0.31 0.00 -2.12 0.00 0.00 175.29 172.89 3kzf n ALA 19 N 0.66 0.12 -0.16 6.09 0.00 -1.26 0.95 120.51 126.91 3kzf n ALA 19 Ca 0.02 0.21 0.10 0.00 0.00 0.00 0.00 53.44 53.77 3kzf n ALA 19 Cb 0.39 -0.16 0.25 0.00 0.00 0.00 0.00 19.45 19.93 3kzf n ALA 19 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3kzf n LYS 20 N -3.93 2.64 -4.13 0.00 5.02 -1.26 -4.80 118.16 111.71 3kzf n LYS 20 Ca 0.05 -2.40 -0.34 0.00 -2.02 0.00 0.00 58.31 53.60 3kzf n LYS 20 Cb 0.17 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 33.63 3kzf n LYS 20 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3kzf s GLU 21 N -1.09 3.09 0.00 1.97 2.02 0.27 -5.06 118.70 119.89 3kzf s GLU 21 Ca 0.40 -0.43 0.00 0.00 0.02 0.00 0.00 54.97 54.95 3kzf s GLU 21 Cb 0.21 -2.88 0.00 0.00 0.10 0.00 0.00 34.13 31.56 3kzf s GLU 21 CO 0.28 0.67 0.00 1.63 0.02 0.00 0.00 175.26 177.87 3kzf n LYS 22 N 1.45 0.00 0.00 1.61 5.02 -1.26 -4.69 118.16 120.29 3kzf n LYS 22 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 3kzf n LYS 22 Cb 0.53 -0.08 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 3kzf n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kzf n GLY 23 N 0.00 -0.40 3.42 0.72 0.00 -1.26 -5.05 105.19 102.62 3kzf n GLY 23 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3kzf n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3kzf n ASP 24 N 0.00 -1.39 0.45 1.61 -0.08 -1.26 -4.85 116.55 111.03 3kzf n ASP 24 Ca 0.00 0.85 -0.19 0.00 -1.51 0.00 0.00 54.79 53.94 3kzf n ASP 24 Cb 0.00 -1.07 -0.09 0.00 2.34 0.00 0.00 41.12 42.29 3kzf n ASP 24 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 3kzf h TYR 25 N 0.58 -1.23 -0.90 -0.67 3.20 -2.00 -1.88 116.97 114.06 3kzf h TYR 25 Ca -0.41 -0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.53 3kzf h TYR 25 Cb 1.41 0.43 -0.12 0.00 1.54 0.00 0.00 36.73 39.99 3kzf h TYR 25 CO 0.33 -0.72 -0.57 -0.44 -1.64 0.00 0.00 178.16 175.13 3kzf h ASP 26 N -1.20 -2.05 -0.77 -2.11 3.32 -1.98 0.26 116.42 111.88 3kzf h ASP 26 Ca -0.11 0.31 0.18 0.00 0.02 0.00 0.00 57.03 57.43 3kzf h ASP 26 Cb 0.95 0.91 -0.13 0.00 0.22 0.00 0.00 39.33 41.28 3kzf h ASP 26 CO 0.14 -0.26 0.04 0.74 -1.72 0.00 0.00 179.24 178.18 3kzf h THR 27 N -0.06 0.35 0.50 0.35 2.02 -1.91 0.18 112.91 114.33 3kzf h THR 27 Ca 0.16 -0.04 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 3kzf h THR 27 Cb 0.46 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3kzf h THR 27 CO -0.89 0.02 -0.24 1.56 0.37 0.00 0.00 175.52 176.35 3kzf h GLN 28 N 0.12 -0.64 -0.76 6.66 4.20 0.23 -3.15 115.11 121.77 3kzf h GLN 28 Ca 0.43 0.04 0.17 0.00 0.06 0.00 0.00 58.65 59.35 3kzf h GLN 28 Cb 0.77 0.15 -0.14 0.00 0.30 0.00 0.00 27.48 28.56 3kzf h GLN 28 CO -0.66 -0.35 -0.05 -0.09 -0.67 0.00 0.00 178.83 177.02 3kzf h ARG 29 N -1.06 0.07 -0.39 1.46 2.43 -0.39 -1.75 114.38 114.74 3kzf h ARG 29 Ca -0.07 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.17 3kzf h ARG 29 Cb 0.59 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.03 3kzf h ARG 29 CO 0.11 0.04 -0.41 0.87 -1.51 0.00 0.00 179.97 179.08 3kzf h LYS 30 N 0.07 -0.31 -0.76 0.20 1.57 -0.64 0.43 116.57 117.13 3kzf h LYS 30 Ca 0.41 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.21 3kzf h LYS 30 Cb 0.70 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 3kzf h LYS 30 CO -0.71 -0.21 0.47 -0.91 -0.57 0.00 0.00 179.45 177.52 3kzf h ASN 31 N -0.32 0.90 -0.36 0.86 -0.26 -1.33 -2.43 115.58 112.64 3kzf h ASN 31 Ca 0.14 -0.04 -0.07 0.00 -0.56 0.00 0.00 56.30 55.77 3kzf h ASN 31 Cb 0.58 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.59 3kzf h ASN 31 CO -0.56 0.68 -0.01 0.58 -1.06 0.00 0.00 177.43 177.06 3kzf h VAL 32 N 1.04 1.24 -0.06 2.81 2.07 -0.63 -2.34 116.25 120.37 3kzf h VAL 32 Ca 0.27 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.83 3kzf h VAL 32 Cb -0.06 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 3kzf h VAL 32 CO -0.05 0.34 0.04 -0.33 0.02 0.00 0.00 177.57 177.59 3kzf h GLU 33 N 0.69 0.05 0.28 1.57 5.08 -0.44 0.23 114.58 122.04 3kzf h GLU 33 Ca 0.14 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3kzf h GLU 33 Cb 0.44 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3kzf h GLU 33 CO 0.02 0.03 -0.13 0.82 -1.00 0.00 0.00 179.01 178.75 3kzf h ILE 34 N 0.05 0.76 0.79 3.13 1.08 -1.26 -2.89 117.51 119.17 3kzf h ILE 34 Ca 0.03 -0.41 -0.03 0.00 -0.39 0.00 0.00 64.86 64.05 3kzf h ILE 34 Cb 0.04 0.99 -0.00 0.00 -3.07 0.00 0.00 36.82 34.78 3kzf h ILE 34 CO -0.00 0.09 -0.46 0.00 -0.69 0.00 0.00 178.15 177.08 3kzf h ALA 35 N 0.06 -1.20 -0.48 1.87 0.00 -1.31 -2.24 119.26 115.96 3kzf h ALA 35 Ca -0.04 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.69 3kzf h ALA 35 Cb 0.43 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 18.70 3kzf h ALA 35 CO 0.06 -1.19 -0.21 0.00 0.00 0.00 0.00 179.25 177.91 3kzf n ALA 36 N -2.68 -0.13 -0.27 0.00 0.00 0.05 0.92 120.51 118.40 3kzf n ALA 36 Ca -0.15 0.45 -0.05 0.00 0.00 0.00 0.00 53.44 53.70 3kzf n ALA 36 Cb 0.48 -0.17 0.10 0.00 0.00 0.00 0.00 19.45 19.86 3kzf n ALA 36 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kzf h SER 37 N 0.00 1.05 0.48 0.00 0.87 -1.23 -0.15 113.55 114.56 3kzf h SER 37 Ca 0.14 -0.15 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 3kzf h SER 37 Cb 0.26 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 3kzf h SER 37 CO -0.47 0.92 -0.43 -0.33 -0.53 0.00 0.00 176.83 175.99 3kzf h GLU 38 N 1.12 0.00 0.02 2.24 4.39 0.11 -3.07 114.58 119.40 3kzf h GLU 38 Ca 0.26 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.71 3kzf h GLU 38 Cb 0.19 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.85 3kzf h GLU 38 CO -0.02 0.43 -1.02 0.82 -1.16 0.00 0.00 179.01 178.06 3kzf h ILE 39 N 0.00 1.37 -0.88 3.13 5.03 -0.19 -3.29 117.51 122.67 3kzf h ILE 39 Ca -0.00 -2.45 0.13 0.00 -0.12 0.00 0.00 64.86 62.41 3kzf h ILE 39 Cb 0.79 2.48 -0.09 0.00 -3.03 0.00 0.00 36.82 36.97 3kzf h ILE 39 CO 0.06 0.74 0.50 0.22 -0.68 0.00 0.00 178.15 178.98 3kzf h TYR 40 N 0.26 0.89 -1.00 1.37 3.20 -0.95 0.30 116.97 121.05 3kzf h TYR 40 Ca -0.11 0.03 0.23 0.00 3.14 0.00 0.00 58.73 62.03 3kzf h TYR 40 Cb 1.67 -0.27 -0.09 0.00 1.54 0.00 0.00 36.73 39.58 3kzf h TYR 40 CO 0.08 0.30 0.63 0.87 -1.64 0.00 0.00 178.16 178.40 3kzf h LYS 41 N 0.77 0.50 -0.12 1.82 1.57 -1.62 0.19 116.57 119.67 3kzf h LYS 41 Ca 0.45 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.16 3kzf h LYS 41 Cb 0.53 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 3kzf h LYS 41 CO -0.30 0.33 -0.08 0.82 -0.57 0.00 0.00 179.45 179.64 3kzf h ILE 42 N 0.51 1.34 0.14 1.86 5.03 -0.55 -1.04 117.51 124.79 3kzf h ILE 42 Ca 0.56 -1.17 0.01 0.00 -0.12 0.00 0.00 64.86 64.14 3kzf h ILE 42 Cb 1.24 1.86 -0.03 0.00 -3.03 0.00 0.00 36.82 36.87 3kzf h ILE 42 CO -0.30 0.34 -0.21 -0.74 -0.68 0.00 0.00 178.15 176.55 3kzf h HIS 43 N -0.11 -0.57 -0.95 1.37 2.76 -1.14 -1.11 115.15 115.41 3kzf h HIS 43 Ca 0.02 0.01 0.22 0.00 -2.20 0.00 0.00 60.37 58.43 3kzf h HIS 43 Cb 0.57 0.23 -0.18 0.00 1.55 0.00 0.00 27.41 29.59 3kzf h HIS 43 CO 0.08 -0.31 -0.09 -0.22 -1.30 0.00 0.00 177.93 176.09 3kzf h LYS 44 N -0.42 0.02 0.00 5.26 1.63 -0.69 0.40 116.57 122.77 3kzf h LYS 44 Ca 0.02 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 3kzf h LYS 44 Cb 0.43 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.05 3kzf h LYS 44 CO -0.10 0.01 0.00 0.00 -3.45 0.00 0.00 179.45 175.91 3kzf n ALA 45 N -3.30 1.82 -0.07 5.00 0.00 -0.40 -4.81 120.51 118.76 3kzf n ALA 45 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3kzf n ALA 45 Cb 0.60 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.83 3kzf n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzf n GLY 46 N -0.10 0.89 3.86 0.00 0.00 0.14 -5.09 105.19 104.89 3kzf n GLY 46 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3kzf n GLY 46 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kzf s TYR 47 N -2.02 3.54 0.11 1.61 1.51 -1.14 -3.91 117.35 117.05 3kzf s TYR 47 Ca 0.00 1.31 -0.28 0.00 -1.01 0.00 0.00 57.07 57.09 3kzf s TYR 47 Cb 0.00 -2.69 -0.06 0.00 -0.11 0.00 0.00 41.96 39.09 3kzf s TYR 47 CO 0.00 -0.47 0.88 0.15 -1.11 0.00 0.00 175.55 175.00 3kzf s LYS 48 N -4.56 4.65 -0.14 -0.62 -0.14 -0.70 -4.47 119.74 113.76 3kzf s LYS 48 Ca 0.56 1.31 0.02 0.00 -1.36 0.00 0.00 55.97 56.51 3kzf s LYS 48 Cb -0.10 -3.35 0.01 0.00 -1.68 0.00 0.00 37.83 32.71 3kzf s LYS 48 CO 0.42 0.31 -0.22 0.08 -0.76 0.00 0.00 175.35 175.18 3kzf s VAL 49 N -0.28 2.07 -0.21 3.17 1.01 -1.26 -1.03 120.40 123.87 3kzf s VAL 49 Ca 0.43 -0.98 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 3kzf s VAL 49 Cb -0.23 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3kzf s VAL 49 CO 0.28 0.55 0.04 -0.69 0.00 0.00 0.00 175.10 175.28 3kzf s VAL 50 N 0.82 4.32 -0.18 2.92 1.01 -0.93 -2.34 120.40 126.02 3kzf s VAL 50 Ca -0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 3kzf s VAL 50 Cb -0.15 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 3kzf s VAL 50 CO -0.02 0.41 -0.08 -0.76 0.00 0.00 0.00 175.10 174.65 3kzf s LEU 51 N 0.96 2.88 0.22 3.92 1.43 0.33 -1.59 118.68 126.83 3kzf s LEU 51 Ca 0.03 -0.33 0.04 0.00 -1.03 0.00 0.00 54.13 52.84 3kzf s LEU 51 Cb -0.14 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.33 3kzf s LEU 51 CO 0.02 0.08 -0.02 0.42 0.23 0.00 0.00 176.35 177.09 3kzf s THR 52 N 0.87 1.10 0.04 5.49 -4.23 -0.68 -1.21 115.64 117.01 3kzf s THR 52 Ca -0.02 -2.04 -0.01 0.00 -1.18 0.00 0.00 61.69 58.44 3kzf s THR 52 Cb -0.15 -2.29 0.00 0.00 1.34 0.00 0.00 72.50 71.40 3kzf s THR 52 CO 0.01 -0.37 0.07 -1.54 -0.54 0.00 0.00 174.62 172.24 3kzf n SER 53 N -0.40 -0.19 -0.91 3.99 3.41 -1.26 -1.75 113.62 116.50 3kzf n SER 53 Ca -0.06 -1.19 0.00 0.00 -0.26 0.00 0.00 58.87 57.37 3kzf n SER 53 Cb 0.63 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.91 3kzf n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kzf n GLY 54 N -0.06 2.63 0.00 5.00 0.00 -0.94 -1.96 105.19 109.86 3kzf n GLY 54 Ca -0.00 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3kzf n GLY 54 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3kzf n ASN 55 N -1.22 0.00 0.00 1.61 5.15 -1.26 -3.66 115.26 115.89 3kzf n ASN 55 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 3kzf n ASN 55 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 3kzf n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3kzf n GLY 56 N -0.04 -0.59 0.24 8.20 0.00 -1.26 -0.02 105.19 111.71 3kzf n GLY 56 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 46.02 46.18 3kzf n GLY 56 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3kzf n PRO 57 N -0.23 -0.08 -0.06 1.61 -0.01 -1.26 -2.27 135.00 132.72 3kzf n PRO 57 Ca 0.00 1.01 -0.13 0.00 -0.01 0.00 0.00 63.50 64.37 3kzf n PRO 57 Cb 0.00 -1.50 -0.12 0.00 -0.01 0.00 0.00 33.50 31.87 3kzf n PRO 57 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 175.50 177.45 3kzf h GLN 58 N 0.00 -0.01 -0.28 -0.52 7.50 -0.91 -2.55 115.11 118.33 3kzf h GLN 58 Ca 0.30 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 59.39 3kzf h GLN 58 Cb 0.46 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.97 3kzf h GLN 58 CO -0.66 0.85 -0.07 -0.24 -1.50 0.00 0.00 178.83 177.21 3kzf h VAL 59 N -0.92 1.21 -0.52 -0.54 3.04 -0.34 -2.59 116.25 115.59 3kzf h VAL 59 Ca -0.00 -0.87 -0.09 0.00 -1.01 0.00 0.00 66.70 64.73 3kzf h VAL 59 Cb 0.86 1.07 -0.02 0.00 -2.01 0.00 0.00 31.29 31.20 3kzf h VAL 59 CO 0.00 0.29 -0.05 1.23 -1.01 0.00 0.00 177.57 178.02 3kzf h GLY 60 N 0.85 0.99 0.95 3.17 0.00 -1.50 -2.26 103.07 105.28 3kzf h GLY 60 Ca 0.09 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.67 3kzf h GLY 60 CO 0.02 0.68 0.18 0.00 0.00 0.00 0.00 176.54 177.42 3kzf h ALA 61 N 1.09 0.46 -0.34 3.60 0.00 -1.09 -2.02 119.26 120.97 3kzf h ALA 61 Ca 0.15 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 3kzf h ALA 61 Cb 0.57 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3kzf h ALA 61 CO 0.03 0.01 -0.31 0.82 0.00 0.00 0.00 179.25 179.81 3kzf h ILE 62 N 0.45 1.29 -0.13 0.00 2.04 -1.18 -2.47 117.51 117.50 3kzf h ILE 62 Ca 0.12 -1.47 -0.11 0.00 1.00 0.00 0.00 64.86 64.40 3kzf h ILE 62 Cb 0.09 1.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3kzf h ILE 62 CO -0.02 0.48 -0.42 0.50 0.00 0.00 0.00 178.15 178.69 3kzf h LYS 63 N 0.60 0.29 -0.47 2.37 1.63 -1.43 -1.11 116.57 118.45 3kzf h LYS 63 Ca 0.06 -0.14 0.07 0.00 -0.85 0.00 0.00 60.65 59.79 3kzf h LYS 63 Cb 0.89 -0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.45 3kzf h LYS 63 CO 0.08 0.67 0.11 1.25 -3.45 0.00 0.00 179.45 178.10 3kzf h LEU 64 N 0.24 0.04 -0.46 5.20 6.46 -0.98 -0.80 115.31 125.01 3kzf h LEU 64 Ca 0.02 0.08 -0.09 0.00 -0.12 0.00 0.00 57.88 57.77 3kzf h LEU 64 Cb 0.85 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.86 3kzf h LEU 64 CO 0.07 0.05 -0.05 1.56 -0.62 0.00 0.00 178.44 179.45 3kzf h GLN 65 N 0.25 0.85 -0.88 1.25 4.20 -0.98 -2.07 115.11 117.74 3kzf h GLN 65 Ca 0.23 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3kzf h GLN 65 Cb 0.29 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 3kzf h GLN 65 CO -0.29 0.93 0.55 -0.91 -0.67 0.00 0.00 178.83 178.44 3kzf h ASN 66 N 0.69 1.03 0.26 1.46 4.21 -0.76 -1.36 115.58 121.11 3kzf h ASN 66 Ca 0.12 -0.05 -0.04 0.00 1.21 0.00 0.00 56.30 57.55 3kzf h ASN 66 Cb 0.58 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.51 3kzf h ASN 66 CO 0.03 0.78 -0.19 1.56 -1.29 0.00 0.00 177.43 178.32 3kzf h GLN 67 N 1.20 0.00 -5.86 0.81 4.20 -0.49 -3.14 115.11 111.83 3kzf h GLN 67 Ca 0.32 0.00 -0.41 0.00 0.06 0.00 0.00 58.65 58.62 3kzf h GLN 67 Cb -0.09 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.62 3kzf h GLN 67 CO -0.06 0.19 1.04 0.00 -0.67 0.00 0.00 178.83 179.33 3kzf s ALA 68 N -4.45 2.07 -0.39 3.87 0.00 -0.51 -4.84 121.76 117.51 3kzf s ALA 68 Ca -0.03 -1.82 0.12 0.00 0.00 0.00 0.00 51.96 50.23 3kzf s ALA 68 Cb 0.15 -4.55 0.37 0.00 0.00 0.00 0.00 23.12 19.09 3kzf s ALA 68 CO 0.67 -4.37 0.82 0.00 0.00 0.00 0.00 175.76 172.88 3kzf n ALA 69 N 12.04 2.75 -0.67 0.00 0.00 -1.19 -4.48 120.51 128.96 3kzf n ALA 69 Ca 0.38 -3.56 0.00 0.00 0.00 0.00 0.00 53.44 50.26 3kzf n ALA 69 Cb 0.48 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3kzf n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kzf n ALA 70 N 0.12 0.18 -0.60 0.00 0.00 -1.25 -4.79 120.51 114.17 3kzf n ALA 70 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.26 3kzf n ALA 70 Cb 0.65 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.99 3kzf n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzf n GLY 71 N 0.00 0.43 2.14 0.00 0.00 -1.26 -3.97 105.19 102.53 3kzf n GLY 71 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3kzf n GLY 71 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3kzf n VAL 72 N 7.02 0.00 -3.84 1.61 0.24 -1.26 -4.88 118.33 117.22 3kzf n VAL 72 Ca 0.45 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 62.39 3kzf n VAL 72 Cb 0.42 -0.01 -0.13 0.00 -1.47 0.00 0.00 33.84 32.64 3kzf n VAL 72 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 3kzf s SER 73 N -0.06 4.81 0.61 -1.34 0.15 -1.26 -5.08 113.70 111.54 3kzf s SER 73 Ca 0.00 -0.79 -0.18 0.00 0.70 0.00 0.00 55.95 55.68 3kzf s SER 73 Cb 0.00 -1.79 -0.10 0.00 -1.71 0.00 0.00 66.02 62.42 3kzf s SER 73 CO 0.00 -0.17 0.22 -0.81 1.20 0.00 0.00 173.24 173.68 3kzf n PRO 74 N 4.78 0.26 -3.69 5.44 -0.04 -1.26 -3.86 135.00 136.63 3kzf n PRO 74 Ca -0.15 0.11 -0.36 0.00 -0.04 0.00 0.00 63.50 63.06 3kzf n PRO 74 Cb 0.47 -1.45 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 3kzf n PRO 74 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3kzf s GLU 75 N -1.86 4.15 0.15 0.54 2.12 -1.26 -4.99 118.70 117.55 3kzf s GLU 75 Ca 0.62 -0.13 -0.16 0.00 0.36 0.00 0.00 54.97 55.67 3kzf s GLU 75 Cb -0.42 -3.40 -0.07 0.00 0.26 0.00 0.00 34.13 30.49 3kzf s GLU 75 CO 0.61 0.32 0.58 -1.64 -0.54 0.00 0.00 175.26 174.59 3kzf s MET 76 N 0.28 4.04 1.10 4.30 -1.94 -1.26 -5.06 119.30 120.76 3kzf s MET 76 Ca 0.11 0.58 -0.12 0.00 -1.71 0.00 0.00 55.69 54.54 3kzf s MET 76 Cb -0.12 -2.95 0.25 0.00 2.01 0.00 0.00 34.83 34.03 3kzf s MET 76 CO 0.00 0.48 1.06 -1.25 -0.01 0.00 0.00 175.02 175.29 3kzf s PRO 77 N -1.89 -0.44 0.16 2.03 0.04 -1.26 -4.77 135.00 128.87 3kzf s PRO 77 Ca 0.38 1.00 -0.10 0.00 0.04 0.00 0.00 61.00 62.33 3kzf s PRO 77 Cb -0.16 -1.60 0.01 0.00 0.04 0.00 0.00 34.50 32.80 3kzf s PRO 77 CO 0.19 -3.45 1.53 1.25 0.04 0.00 0.00 177.00 176.56 3kzf h LEU 78 N -2.43 0.98 -0.02 -3.56 5.85 -1.94 -1.64 115.31 112.54 3kzf h LEU 78 Ca -0.57 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 57.77 3kzf h LEU 78 Cb 1.32 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 3kzf h LEU 78 CO 0.48 1.20 -0.16 1.12 -0.34 0.00 0.00 178.44 180.74 3kzf h HIS 79 N 0.79 -0.42 -0.81 1.25 2.07 -1.84 0.11 115.15 116.29 3kzf h HIS 79 Ca 0.09 0.02 0.14 0.00 -2.85 0.00 0.00 60.37 57.76 3kzf h HIS 79 Cb 0.88 0.19 -0.15 0.00 2.57 0.00 0.00 27.41 30.90 3kzf h HIS 79 CO 0.06 -0.24 -0.32 0.28 -3.07 0.00 0.00 177.93 174.65 3kzf h VAL 80 N -0.26 0.10 -0.64 6.12 2.07 -1.89 0.36 116.25 122.12 3kzf h VAL 80 Ca 0.06 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.71 3kzf h VAL 80 Cb 0.33 0.10 -0.10 0.00 -1.52 0.00 0.00 31.29 30.11 3kzf h VAL 80 CO -0.17 0.00 0.11 0.00 0.02 0.00 0.00 177.57 177.53 3kzf h GLY 82 N 0.23 0.12 0.13 0.00 0.00 0.13 0.17 103.07 103.84 3kzf h GLY 82 Ca 0.34 0.41 0.11 0.00 0.00 0.00 0.00 47.33 48.19 3kzf h GLY 82 CO -0.46 -0.23 0.02 0.00 0.00 0.00 0.00 176.54 175.86 3kzf h ALA 83 N 1.31 0.54 -0.05 3.60 0.00 0.56 -2.25 119.26 122.96 3kzf h ALA 83 Ca 0.30 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.37 3kzf h ALA 83 Cb 0.57 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 3kzf h ALA 83 CO -0.80 -0.37 0.03 0.52 0.00 0.00 0.00 179.25 178.62 3kzf h MET 84 N 0.14 0.08 -0.86 0.00 2.86 0.17 -2.58 114.93 114.73 3kzf h MET 84 Ca 0.28 -0.01 0.10 0.00 -2.06 0.00 0.00 59.70 58.00 3kzf h MET 84 Cb 0.42 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.99 3kzf h MET 84 CO -0.44 0.17 0.51 0.66 1.06 0.00 0.00 176.91 178.87 3kzf h SER 85 N -0.04 0.73 0.02 1.22 4.64 -0.28 -1.06 113.55 118.79 3kzf h SER 85 Ca 0.02 0.05 0.03 0.00 -0.47 0.00 0.00 61.79 61.42 3kzf h SER 85 Cb 0.12 -0.09 -0.05 0.00 -0.31 0.00 0.00 62.40 62.07 3kzf h SER 85 CO -0.00 0.41 -0.35 1.56 -0.87 0.00 0.00 176.83 177.58 3kzf h GLN 86 N 0.84 -0.50 -0.96 4.77 4.20 -1.22 0.12 115.11 122.36 3kzf h GLN 86 Ca 0.42 0.03 0.15 0.00 0.06 0.00 0.00 58.65 59.31 3kzf h GLN 86 Cb 0.39 0.11 -0.08 0.00 0.30 0.00 0.00 27.48 28.20 3kzf h GLN 86 CO -0.25 -0.33 0.61 0.78 -0.67 0.00 0.00 178.83 178.96 3kzf h GLY 87 N -0.52 1.48 0.00 3.46 0.00 -0.85 -1.04 103.07 105.59 3kzf h GLY 87 Ca 0.05 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3kzf h GLY 87 CO -0.27 0.08 0.00 0.33 0.00 0.00 0.00 176.54 176.68 3kzf n PHE 88 N -4.62 0.00 -0.33 5.60 7.35 -0.52 -0.96 117.46 123.98 3kzf n PHE 88 Ca 0.19 0.00 0.19 0.00 -0.76 0.00 0.00 57.45 57.07 3kzf n PHE 88 Cb 0.47 0.00 0.36 0.00 0.35 0.00 0.00 39.48 40.66 3kzf n PHE 88 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3kzf h ILE 89 N 0.00 0.06 -0.69 -2.13 2.04 -0.87 0.88 117.51 116.80 3kzf h ILE 89 Ca 0.00 -0.01 -0.06 0.00 1.00 0.00 0.00 64.86 65.79 3kzf h ILE 89 Cb 0.00 0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.07 3kzf h ILE 89 CO 0.00 0.01 0.21 1.23 0.00 0.00 0.00 178.15 179.60 3kzf h GLY 90 N 0.04 1.15 0.70 5.37 0.00 -1.30 0.27 103.07 109.29 3kzf h GLY 90 Ca 0.65 -0.67 0.02 0.00 0.00 0.00 0.00 47.33 47.34 3kzf h GLY 90 CO -0.85 0.63 -0.10 -1.82 0.00 0.00 0.00 176.54 174.39 3kzf h TYR 91 N 1.02 -0.25 -1.00 5.60 3.20 0.26 -2.22 116.97 123.58 3kzf h TYR 91 Ca 0.22 0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.18 3kzf h TYR 91 Cb 0.30 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 38.62 3kzf h TYR 91 CO 0.02 -0.15 0.64 0.52 -1.64 0.00 0.00 178.16 177.55 3kzf h MET 92 N -0.16 1.09 -0.04 1.82 2.86 -0.15 -2.13 114.93 118.22 3kzf h MET 92 Ca 0.05 -0.07 -0.25 0.00 -2.06 0.00 0.00 59.70 57.38 3kzf h MET 92 Cb 0.22 -0.25 0.01 0.00 0.06 0.00 0.00 31.60 31.65 3kzf h MET 92 CO -0.12 0.72 -0.96 0.52 1.06 0.00 0.00 176.91 178.13 3kzf h MET 93 N 1.13 0.67 -0.01 1.72 2.86 -0.39 -2.39 114.93 118.51 3kzf h MET 93 Ca 0.44 -0.67 0.03 0.00 -2.06 0.00 0.00 59.70 57.45 3kzf h MET 93 Cb 0.24 0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.04 3kzf h MET 93 CO -0.19 1.26 -0.20 0.77 1.06 0.00 0.00 176.91 179.61 3kzf h SER 94 N 0.40 -0.58 -0.36 1.22 0.02 -1.35 0.16 113.55 113.07 3kzf h SER 94 Ca -0.10 0.08 -0.14 0.00 -0.84 0.00 0.00 61.79 60.79 3kzf h SER 94 Cb 1.60 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 64.37 3kzf h SER 94 CO 0.19 -0.26 -0.30 -0.61 -1.14 0.00 0.00 176.83 174.71 3kzf h GLN 95 N -0.31 0.89 -0.03 3.45 4.15 -1.35 -1.63 115.11 120.28 3kzf h GLN 95 Ca 0.06 -0.41 -0.04 0.00 0.77 0.00 0.00 58.65 59.03 3kzf h GLN 95 Cb 0.39 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.07 3kzf h GLN 95 CO -0.19 1.06 -0.14 0.00 -1.93 0.00 0.00 178.83 177.63 3kzf h ALA 96 N 0.91 0.05 -0.44 3.38 0.00 -1.36 -0.53 119.26 121.28 3kzf h ALA 96 Ca 0.08 -0.39 0.13 0.00 0.00 0.00 0.00 54.91 54.74 3kzf h ALA 96 Cb 0.86 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3kzf h ALA 96 CO 0.08 -0.01 0.38 1.98 0.00 0.00 0.00 179.25 181.67 3kzf h MET 97 N -0.46 0.00 0.12 0.00 1.85 -0.57 -1.18 114.93 114.69 3kzf h MET 97 Ca -0.01 0.00 -0.19 0.00 -0.61 0.00 0.00 59.70 58.89 3kzf h MET 97 Cb 0.81 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.85 3kzf h MET 97 CO 0.03 0.00 -0.88 -0.44 -0.40 0.00 0.00 176.91 175.22 3kzf h ASP 98 N 0.00 0.40 -0.42 1.39 3.45 -1.14 -2.77 116.42 117.34 3kzf h ASP 98 Ca 0.21 -0.93 0.08 0.00 0.43 0.00 0.00 57.03 56.82 3kzf h ASP 98 Cb 0.96 -0.13 -0.09 0.00 -0.56 0.00 0.00 39.33 39.51 3kzf h ASP 98 CO -0.00 1.41 -0.37 0.78 -1.57 0.00 0.00 179.24 179.49 3kzf h ASN 99 N -0.43 -1.23 -0.32 6.45 2.35 -0.08 0.47 115.58 122.79 3kzf h ASN 99 Ca -0.17 0.21 0.07 0.00 -0.55 0.00 0.00 56.30 55.86 3kzf h ASN 99 Cb 1.61 0.56 -0.08 0.00 0.05 0.00 0.00 38.32 40.46 3kzf h ASN 99 CO 0.11 -0.34 -0.24 1.62 -1.65 0.00 0.00 177.43 176.93 3kzf h VAL 100 N -0.28 0.37 0.07 2.81 3.04 -1.40 0.96 116.25 121.82 3kzf h VAL 100 Ca 0.16 0.00 0.03 0.00 -1.01 0.00 0.00 66.70 65.88 3kzf h VAL 100 Cb 0.56 0.37 -0.05 0.00 -2.01 0.00 0.00 31.29 30.17 3kzf h VAL 100 CO -0.56 0.00 -0.34 -0.26 -1.01 0.00 0.00 177.57 175.39 3kzf h PHE 101 N -0.21 -0.95 0.04 3.17 -1.00 -0.82 -1.50 116.94 115.68 3kzf h PHE 101 Ca 0.16 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.98 3kzf h PHE 101 Cb 0.46 0.41 -0.02 0.00 3.61 0.00 0.00 35.95 40.41 3kzf h PHE 101 CO -0.43 -0.44 -0.11 0.00 -1.61 0.00 0.00 178.31 175.71 3kzf h ALA 103 N 0.72 3.24 0.00 0.00 0.00 0.14 0.30 119.26 123.66 3kzf h ALA 103 Ca 0.03 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3kzf h ALA 103 Cb 0.25 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3kzf h ALA 103 CO -0.09 -1.88 -0.60 0.09 0.00 0.00 0.00 179.25 176.78 3kzf n ASN 104 N -4.41 0.58 -1.31 0.00 3.02 0.94 -4.92 115.26 109.17 3kzf n ASN 104 Ca 0.42 -0.07 -0.10 0.00 -0.03 0.00 0.00 54.58 54.79 3kzf n ASN 104 Cb 1.73 0.25 0.01 0.00 -0.61 0.00 0.00 39.78 41.16 3kzf n ASN 104 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3kzf n ASN 105 N -1.80 -3.42 -3.74 6.41 3.02 0.11 -4.94 115.26 110.89 3kzf n ASN 105 Ca 0.04 -0.08 -0.39 0.00 -0.03 0.00 0.00 54.58 54.12 3kzf n ASN 105 Cb 0.39 -2.47 -0.00 0.00 -0.61 0.00 0.00 39.78 37.08 3kzf n ASN 105 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3kzf n GLU 106 N -2.08 4.39 -1.67 3.52 2.13 -0.92 -5.05 120.64 120.97 3kzf n GLU 106 Ca -0.07 -4.63 -0.44 0.00 0.66 0.00 0.00 57.16 52.68 3kzf n GLU 106 Cb 0.57 -2.44 -0.03 0.00 0.27 0.00 0.00 31.44 29.80 3kzf n GLU 106 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 3kzf n PRO 107 N 0.75 2.69 -0.21 5.31 -0.02 -1.26 -4.21 135.00 138.06 3kzf n PRO 107 Ca 0.33 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.79 3kzf n PRO 107 Cb 0.33 -2.91 0.00 0.00 -0.02 0.00 0.00 33.50 30.90 3kzf n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kzf n ALA 108 N 7.02 0.00 -3.57 3.55 0.00 -1.26 -5.07 120.51 121.18 3kzf n ALA 108 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.42 3kzf n ALA 108 Cb 0.37 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.66 3kzf n ALA 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3kzf s ASN 109 N 1.37 1.39 -0.29 0.00 4.22 -1.26 -5.07 114.94 115.30 3kzf s ASN 109 Ca 0.00 -0.21 -0.15 0.00 -2.14 0.00 0.00 52.86 50.36 3kzf s ASN 109 Cb 0.00 -0.64 0.12 0.00 1.28 0.00 0.00 41.25 42.02 3kzf s ASN 109 CO 0.00 -0.02 0.80 0.00 -2.04 0.00 0.00 177.10 175.84 3kzf s VAL 111 N 1.96 1.46 -0.13 0.00 -7.23 -1.14 -5.01 120.40 110.31 3kzf s VAL 111 Ca -0.08 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.10 3kzf s VAL 111 Cb -0.06 -2.82 0.02 0.00 0.56 0.00 0.00 36.38 34.08 3kzf s VAL 111 CO -0.18 0.00 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.57 3kzf s THR 112 N -3.05 1.58 -0.16 5.32 2.01 -1.26 -1.22 115.64 118.86 3kzf s THR 112 Ca 0.34 -0.67 -0.08 0.00 0.31 0.00 0.00 61.69 61.59 3kzf s THR 112 Cb 0.09 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 3kzf s THR 112 CO 0.16 0.46 0.11 0.00 -0.69 0.00 0.00 174.62 174.66 3kzf s VAL 114 N -0.19 4.58 -0.08 0.00 0.11 -1.26 -4.26 120.40 119.31 3kzf s VAL 114 Ca 0.10 1.86 -0.01 0.00 -2.93 0.00 0.00 61.98 61.00 3kzf s VAL 114 Cb -0.12 -4.20 -0.03 0.00 -1.53 0.00 0.00 36.38 30.50 3kzf s VAL 114 CO 0.01 0.04 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.91 3kzf s THR 115 N 1.83 4.16 -0.13 5.04 2.01 -1.26 -4.97 115.64 122.31 3kzf s THR 115 Ca 0.52 -0.30 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 3kzf s THR 115 Cb -0.22 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 3kzf s THR 115 CO 0.22 0.60 0.09 -1.10 -0.69 0.00 0.00 174.62 173.74 3kzf s GLN 116 N -0.85 3.51 -0.16 4.92 -0.21 -1.26 -1.71 119.66 123.90 3kzf s GLN 116 Ca 0.13 -0.25 -0.07 0.00 0.02 0.00 0.00 55.36 55.19 3kzf s GLN 116 Cb -0.11 -3.12 -0.04 0.00 1.00 0.00 0.00 33.01 30.73 3kzf s GLN 116 CO 0.02 0.61 0.09 0.99 -2.12 0.00 0.00 175.29 174.88 3kzf s THR 117 N -0.58 5.04 0.34 -0.19 2.01 -0.68 -1.66 115.64 119.91 3kzf s THR 117 Ca 0.12 0.05 -0.21 0.00 0.31 0.00 0.00 61.69 61.95 3kzf s THR 117 Cb -0.12 -3.24 -0.10 0.00 0.01 0.00 0.00 72.50 69.05 3kzf s THR 117 CO 0.02 0.51 0.86 -0.76 -0.69 0.00 0.00 174.62 174.56 3kzf s LEU 118 N -0.10 4.15 0.12 4.42 1.43 0.34 -2.03 118.68 127.01 3kzf s LEU 118 Ca 0.08 1.60 -0.04 0.00 -1.03 0.00 0.00 54.13 54.74 3kzf s LEU 118 Cb -0.12 -4.12 -0.03 0.00 0.03 0.00 0.00 46.19 41.95 3kzf s LEU 118 CO 0.01 -0.17 0.12 0.68 0.23 0.00 0.00 176.35 177.22 3kzf s VAL 119 N -1.86 0.11 -0.26 -1.59 -7.23 0.08 -0.05 120.40 109.61 3kzf s VAL 119 Ca 0.54 -1.68 -0.25 0.00 -1.81 0.00 0.00 61.98 58.78 3kzf s VAL 119 Cb -0.13 -1.84 -0.00 0.00 0.56 0.00 0.00 36.38 34.96 3kzf s VAL 119 CO 0.18 -0.51 0.86 -0.62 -0.31 0.00 0.00 175.10 174.70 3kzf s ASP 120 N -2.99 6.84 0.43 4.85 -1.08 -1.26 -4.53 116.67 118.93 3kzf s ASP 120 Ca 0.18 1.01 0.11 0.00 -0.52 0.00 0.00 52.55 53.33 3kzf s ASP 120 Cb 0.06 -2.45 0.94 0.00 -1.46 0.00 0.00 42.92 40.01 3kzf s ASP 120 CO -0.02 -0.57 2.02 1.55 0.52 0.00 0.00 175.17 178.68 3kzf h PRO 121 N 7.75 0.26 -0.21 4.34 0.13 -2.00 0.63 132.00 142.89 3kzf h PRO 121 Ca -0.23 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3kzf h PRO 121 Cb 1.09 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3kzf h PRO 121 CO 0.89 0.26 0.00 1.17 -0.23 0.00 0.00 178.00 180.10 3kzf n LYS 122 N -4.41 0.88 -1.66 0.86 0.00 -1.26 -4.83 118.16 107.75 3kzf n LYS 122 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 58.31 57.97 3kzf n LYS 122 Cb 0.16 -1.10 0.06 0.00 0.00 0.00 0.00 35.03 34.15 3kzf n LYS 122 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3kzf s ASP 123 N -0.88 4.79 0.23 3.14 -1.08 0.22 -4.93 116.67 118.16 3kzf s ASP 123 Ca 0.00 2.14 0.13 0.00 -0.52 0.00 0.00 52.55 54.30 3kzf s ASP 123 Cb 0.00 -2.57 -0.02 0.00 -1.46 0.00 0.00 42.92 38.88 3kzf s ASP 123 CO 0.00 -1.85 1.36 0.06 0.52 0.00 0.00 175.17 175.26 3kzf h GLN 124 N -0.03 0.00 0.00 4.34 -0.00 -1.88 -3.20 115.11 114.34 3kzf h GLN 124 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.18 3kzf h GLN 124 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 3kzf h GLN 124 CO 0.52 0.61 0.00 0.00 -0.00 0.00 0.00 178.83 179.97 3kzf h ALA 125 N 1.37 1.00 0.00 0.06 0.00 -1.89 -0.95 119.26 118.85 3kzf h ALA 125 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3kzf h ALA 125 Cb 1.50 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 3kzf h ALA 125 CO 0.08 0.00 -0.40 0.74 0.00 0.00 0.00 179.25 179.67 3kzf h PHE 126 N 0.00 0.00 -2.29 0.00 0.04 -1.88 -2.91 116.94 109.90 3kzf h PHE 126 Ca 0.00 0.00 -0.71 0.00 2.80 0.00 0.00 57.97 60.06 3kzf h PHE 126 Cb 0.17 0.00 -0.34 0.00 2.20 0.00 0.00 35.95 37.98 3kzf h PHE 126 CO 0.00 0.40 0.26 0.25 -0.60 0.00 0.00 178.31 178.63 3kzf n THR 127 N -3.98 4.68 0.00 -1.55 -2.24 -0.36 -4.73 114.28 106.10 3kzf n THR 127 Ca -0.02 -5.79 0.00 0.00 -2.27 0.00 0.00 64.05 55.97 3kzf n THR 127 Cb 0.44 -1.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.14 3kzf n THR 127 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kzf n ASN 128 N -0.05 0.00 -4.55 3.42 4.05 -1.10 -5.01 115.26 112.02 3kzf n ASN 128 Ca 0.39 0.00 -0.38 0.00 0.45 0.00 0.00 54.58 55.03 3kzf n ASN 128 Cb 0.32 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.30 3kzf n ASN 128 CO 0.00 0.00 0.00 -2.84 -3.05 0.00 0.00 177.26 171.37 3kzf s PRO 129 N 0.00 2.60 0.00 1.20 0.02 -1.23 -4.50 135.00 133.09 3kzf s PRO 129 Ca 0.00 0.78 0.09 0.00 0.02 0.00 0.00 61.00 61.89 3kzf s PRO 129 Cb 0.00 -4.40 -0.09 0.00 0.02 0.00 0.00 34.50 30.02 3kzf s PRO 129 CO 0.00 -2.75 0.40 0.25 -0.33 0.00 0.00 177.00 174.57 3kzf n THR 130 N 7.34 0.00 -3.77 0.99 -2.24 -0.96 -4.56 114.28 111.08 3kzf n THR 130 Ca 0.23 -0.29 -0.37 0.00 -2.27 0.00 0.00 64.05 61.34 3kzf n THR 130 Cb 0.52 1.01 -0.13 0.00 -2.10 0.00 0.00 70.33 69.63 3kzf n THR 130 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3kzf s LYS 131 N -1.82 2.71 0.57 -0.78 2.20 -1.19 -4.93 119.74 116.50 3kzf s LYS 131 Ca 0.04 -1.11 -0.18 0.00 -0.36 0.00 0.00 55.97 54.35 3kzf s LYS 131 Cb 0.07 -3.41 -0.07 0.00 -1.51 0.00 0.00 37.83 32.90 3kzf s LYS 131 CO 0.36 -0.61 0.70 -0.35 -0.36 0.00 0.00 175.35 175.10 3kzf n PRO 132 N 4.81 0.67 -3.64 4.03 -0.04 -1.25 -2.31 135.00 137.27 3kzf n PRO 132 Ca -0.13 0.26 -0.10 0.00 -0.04 0.00 0.00 63.50 63.49 3kzf n PRO 132 Cb 0.45 -1.88 -0.07 0.00 -0.04 0.00 0.00 33.50 31.97 3kzf n PRO 132 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3kzf s VAL 133 N -1.62 0.00 0.00 0.52 1.01 -0.57 -4.84 120.40 114.90 3kzf s VAL 133 Ca 0.71 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.69 3kzf s VAL 133 Cb -0.44 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 34.94 3kzf s VAL 133 CO 0.52 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.23 3kzf n GLY 134 N 2.96 0.98 1.07 4.51 0.00 -1.10 -2.92 105.19 110.70 3kzf n GLY 134 Ca -0.15 -1.50 -0.09 0.00 0.00 0.00 0.00 46.02 44.27 3kzf n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kzf n ARG 135 N 1.77 1.39 -4.24 1.61 1.74 -1.26 -4.03 116.66 113.65 3kzf n ARG 135 Ca 0.00 -1.10 -0.35 0.00 -0.77 0.00 0.00 57.85 55.64 3kzf n ARG 135 Cb 0.00 0.38 -0.08 0.00 -1.02 0.00 0.00 32.46 31.73 3kzf n ARG 135 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3kzf s PHE 136 N -1.68 3.24 0.00 -1.55 0.08 -1.26 -4.36 117.98 112.45 3kzf s PHE 136 Ca 0.02 0.23 0.00 0.00 0.12 0.00 0.00 56.93 57.30 3kzf s PHE 136 Cb 0.00 -1.79 0.00 0.00 -0.57 0.00 0.00 43.02 40.66 3kzf s PHE 136 CO 0.01 0.53 0.00 2.48 -0.10 0.00 0.00 175.22 178.14 3kzf n TYR 137 N 1.84 0.00 -2.58 0.36 -0.00 -0.85 -5.01 117.16 110.92 3kzf n TYR 137 Ca -0.17 0.00 -0.41 0.00 -0.00 0.00 0.00 57.90 57.32 3kzf n TYR 137 Cb 0.54 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.83 3kzf n TYR 137 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 3kzf s THR 138 N -0.58 3.98 0.13 -3.48 -1.32 -1.26 -4.16 115.64 108.96 3kzf s THR 138 Ca 0.00 1.75 0.01 0.00 -1.21 0.00 0.00 61.69 62.24 3kzf s THR 138 Cb 0.00 -4.12 -0.04 0.00 -1.51 0.00 0.00 72.50 66.83 3kzf s THR 138 CO 0.00 0.32 -0.02 -0.70 -2.21 0.00 0.00 174.62 172.00 3kzf s GLU 139 N -0.48 0.96 0.00 7.08 -6.30 -1.26 -5.09 118.70 113.61 3kzf s GLU 139 Ca 0.47 -1.43 0.00 0.00 -2.50 0.00 0.00 54.97 51.51 3kzf s GLU 139 Cb -0.28 -0.19 0.00 0.00 0.00 0.00 0.00 34.13 33.66 3kzf s GLU 139 CO 0.34 -0.09 0.00 0.44 0.02 0.00 0.00 175.26 175.97 3kzf n ILE 153 N -0.13 0.00 -3.65 -3.70 -6.64 -1.26 -4.88 119.36 99.10 3kzf n ILE 153 Ca -0.09 0.00 -0.02 0.00 -1.77 0.00 0.00 62.75 60.87 3kzf n ILE 153 Cb 0.62 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.77 3kzf n ILE 153 CO 0.00 0.00 0.00 -0.22 -1.77 0.00 0.00 176.55 174.56 3kzf s LEU 154 N 0.00 -0.04 -0.06 7.28 2.96 -1.26 -5.07 118.68 122.48 3kzf s LEU 154 Ca 0.00 0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 53.93 3kzf s LEU 154 Cb 0.00 1.09 -0.04 0.00 0.50 0.00 0.00 46.19 47.74 3kzf s LEU 154 CO 0.00 -0.03 0.16 -0.13 -1.32 0.00 0.00 176.35 175.04 3kzf s ARG 155 N -0.51 3.44 0.17 1.98 0.52 -1.26 -2.51 118.95 120.78 3kzf s ARG 155 Ca 0.08 -0.22 0.06 0.00 -0.52 0.00 0.00 55.73 55.13 3kzf s ARG 155 Cb -0.03 -3.14 -0.04 0.00 0.52 0.00 0.00 34.95 32.25 3kzf s ARG 155 CO -0.12 0.73 -0.13 -1.21 0.02 0.00 0.00 175.30 174.59 3kzf s GLU 156 N -1.49 1.19 0.00 3.54 2.02 0.52 -4.91 118.70 119.57 3kzf s GLU 156 Ca 0.21 -1.50 0.00 0.00 0.02 0.00 0.00 54.97 53.70 3kzf s GLU 156 Cb -0.12 -0.89 0.00 0.00 0.10 0.00 0.00 34.13 33.21 3kzf s GLU 156 CO 0.11 0.14 0.00 -3.47 0.02 0.00 0.00 175.26 172.06 3kzf n ASP 157 N -0.23 0.00 0.00 -0.19 -0.08 -1.26 -1.37 116.55 113.42 3kzf n ASP 157 Ca -0.10 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.18 3kzf n ASP 157 Cb 0.60 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.06 3kzf n ASP 157 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kzf n ALA 158 N -3.00 0.00 0.00 -1.67 0.00 -1.26 -2.32 120.51 112.26 3kzf n ALA 158 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3kzf n ALA 158 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3kzf n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzf n GLY 159 N -0.04 2.52 0.17 0.00 0.00 -1.26 -4.75 105.19 101.83 3kzf n GLY 159 Ca 0.00 -0.70 0.13 0.00 0.00 0.00 0.00 46.02 45.46 3kzf n GLY 159 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3kzf h ARG 160 N 0.00 0.00 0.00 1.61 9.65 -1.98 -3.45 114.38 120.21 3kzf h ARG 160 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3kzf h ARG 160 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 3kzf h ARG 160 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.18 3kzf n GLY 161 N -0.11 -0.26 3.20 2.80 0.00 -1.26 -4.88 105.19 104.67 3kzf n GLY 161 Ca 0.01 0.36 -0.12 0.00 0.00 0.00 0.00 46.02 46.28 3kzf n GLY 161 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3kzf n TRP 162 N 0.00 -0.46 -0.79 1.61 7.02 -0.98 -2.01 117.44 121.83 3kzf n TRP 162 Ca 0.00 0.21 -0.29 0.00 -1.02 0.00 0.00 57.50 56.40 3kzf n TRP 162 Cb 0.00 -1.01 0.22 0.00 -2.42 0.00 0.00 31.31 28.09 3kzf n TRP 162 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3kzf s ARG 163 N -4.66 -0.28 0.54 -0.99 0.52 -0.47 -4.04 118.95 109.57 3kzf s ARG 163 Ca 0.01 0.78 -0.14 0.00 -0.52 0.00 0.00 55.73 55.87 3kzf s ARG 163 Cb -0.01 -1.63 -0.06 0.00 0.52 0.00 0.00 34.95 33.77 3kzf s ARG 163 CO 0.36 -3.28 0.98 0.08 0.02 0.00 0.00 175.30 173.47 3kzf s VAL 164 N -2.65 4.62 0.05 3.52 1.01 -1.15 0.20 120.40 126.00 3kzf s VAL 164 Ca 0.67 1.03 0.04 0.00 0.00 0.00 0.00 61.98 63.72 3kzf s VAL 164 Cb -0.22 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 3kzf s VAL 164 CO 0.62 -0.85 -0.12 0.68 0.00 0.00 0.00 175.10 175.43 3kzf s VAL 165 N -2.81 0.91 0.38 2.92 -7.23 -1.04 -1.51 120.40 112.02 3kzf s VAL 165 Ca 0.57 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.74 3kzf s VAL 165 Cb -0.10 -0.88 -0.07 0.00 0.56 0.00 0.00 36.38 35.88 3kzf s VAL 165 CO 0.40 -0.16 0.01 0.68 -0.31 0.00 0.00 175.10 175.72 3kzf s VAL 166 N -1.07 1.82 0.73 1.32 -7.23 -0.98 -4.52 120.40 110.47 3kzf s VAL 166 Ca -0.03 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 57.97 3kzf s VAL 166 Cb -0.09 -2.92 0.01 0.00 0.56 0.00 0.00 36.38 33.94 3kzf s VAL 166 CO 0.01 -0.02 0.96 -2.65 -0.31 0.00 0.00 175.10 173.09 3kzf n PRO 167 N -0.89 0.49 -3.20 4.82 -0.02 -1.26 -2.28 135.00 132.66 3kzf n PRO 167 Ca -0.04 0.22 -0.23 0.00 -2.02 0.00 0.00 63.50 61.43 3kzf n PRO 167 Cb 0.67 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 3kzf n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kzf n SER 168 N -1.69 0.69 -4.87 2.55 2.88 -1.25 -1.99 113.62 109.93 3kzf n SER 168 Ca 0.13 -2.84 -0.30 0.00 -1.33 0.00 0.00 58.87 54.53 3kzf n SER 168 Cb 0.49 -0.64 0.08 0.00 -0.75 0.00 0.00 64.21 63.39 3kzf n SER 168 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3kzf s PRO 169 N -1.60 2.29 0.32 -1.46 0.04 -1.26 -4.83 135.00 128.49 3kzf s PRO 169 Ca 0.37 0.33 -0.29 0.00 0.04 0.00 0.00 61.00 61.45 3kzf s PRO 169 Cb 0.21 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.68 3kzf s PRO 169 CO -0.10 -1.41 1.34 0.50 0.04 0.00 0.00 177.00 177.37 3kzf s ARG 170 N -5.42 4.33 0.46 4.56 3.52 -1.26 -4.61 118.95 120.54 3kzf s ARG 170 Ca 0.60 2.24 -0.21 0.00 -0.13 0.00 0.00 55.73 58.23 3kzf s ARG 170 Cb -0.12 -3.08 -0.09 0.00 -1.56 0.00 0.00 34.95 30.11 3kzf s ARG 170 CO 0.51 -0.24 1.05 -1.25 -0.81 0.00 0.00 175.30 174.55 3kzf s PRO 171 N -1.53 3.89 0.00 5.12 0.04 -1.26 -4.46 135.00 136.80 3kzf s PRO 171 Ca 0.51 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.96 3kzf s PRO 171 Cb -0.40 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 31.92 3kzf s PRO 171 CO 0.51 -0.36 0.00 1.28 0.04 0.00 0.00 177.00 178.47 3kzf n LEU 172 N -0.73 1.03 -3.66 -3.56 4.77 0.93 -4.99 117.00 110.80 3kzf n LEU 172 Ca 0.08 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.82 3kzf n LEU 172 Cb 0.52 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.43 3kzf n LEU 172 CO 0.41 0.10 -0.34 -0.70 -1.33 0.00 0.00 177.39 175.53 3kzf s GLU 173 N -1.87 0.17 -0.15 3.23 2.12 -1.23 -4.92 118.70 116.04 3kzf s GLU 173 Ca 0.00 -0.01 -0.30 0.00 0.36 0.00 0.00 54.97 55.02 3kzf s GLU 173 Cb 0.00 -1.50 -0.07 0.00 0.26 0.00 0.00 34.13 32.82 3kzf s GLU 173 CO 0.00 -0.56 2.13 -0.89 -0.54 0.00 0.00 175.26 175.40 3kzf n ILE 174 N 5.24 0.46 -0.03 -3.70 2.08 -1.26 -0.50 119.36 121.64 3kzf n ILE 174 Ca -0.06 -0.33 -0.09 0.00 0.56 0.00 0.00 62.75 62.82 3kzf n ILE 174 Cb 0.49 -2.36 -0.03 0.00 -0.75 0.00 0.00 39.64 36.98 3kzf n ILE 174 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3kzf h VAL 175 N 6.61 0.91 -0.10 1.39 2.07 -1.69 -3.24 116.25 122.20 3kzf h VAL 175 Ca -0.43 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.06 3kzf h VAL 175 Cb 1.25 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 3kzf h VAL 175 CO 0.96 0.02 0.00 -0.62 0.02 0.00 0.00 177.57 177.95 3kzf n GLU 176 N -5.10 1.42 -0.32 1.57 4.71 -1.26 -4.53 120.64 117.13 3kzf n GLU 176 Ca -0.03 -0.63 0.18 0.00 -0.01 0.00 0.00 57.16 56.67 3kzf n GLU 176 Cb 0.09 -1.35 0.38 0.00 -1.01 0.00 0.00 31.44 29.55 3kzf n GLU 176 CO 0.00 0.00 0.00 0.10 0.09 0.00 0.00 177.13 177.32 3kzf h TYR 177 N 1.27 0.66 -0.89 -0.32 -0.00 -1.95 -1.30 116.97 114.44 3kzf h TYR 177 Ca 0.00 0.04 0.15 0.00 0.00 0.00 0.00 58.73 58.92 3kzf h TYR 177 Cb 0.28 -0.14 -0.09 0.00 0.00 0.00 0.00 36.73 36.78 3kzf h TYR 177 CO 0.06 -0.18 0.48 0.78 -0.00 0.00 0.00 178.16 179.31 3kzf h GLY 178 N 0.29 1.47 0.35 0.10 0.00 -1.89 0.16 103.07 103.54 3kzf h GLY 178 Ca 0.64 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 3kzf h GLY 178 CO -0.62 -0.02 -0.03 -2.08 0.00 0.00 0.00 176.54 173.79 3kzf h VAL 179 N 0.68 1.27 -0.41 4.60 2.07 -1.61 -1.71 116.25 121.14 3kzf h VAL 179 Ca 0.48 -1.39 0.07 0.00 0.82 0.00 0.00 66.70 66.69 3kzf h VAL 179 Cb 0.68 2.14 -0.09 0.00 -1.52 0.00 0.00 31.29 32.49 3kzf h VAL 179 CO -0.36 0.33 -0.41 0.40 0.02 0.00 0.00 177.57 177.56 3kzf h ILE 180 N -0.73 0.13 -0.58 4.57 2.04 -1.40 1.19 117.51 122.73 3kzf h ILE 180 Ca -0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.91 3kzf h ILE 180 Cb 0.61 0.13 -0.08 0.00 -0.74 0.00 0.00 36.82 36.73 3kzf h ILE 180 CO 0.01 0.00 -0.48 0.50 0.00 0.00 0.00 178.15 178.18 3kzf h LYS 181 N -0.31 -0.16 -0.70 2.37 1.63 -0.77 0.50 116.57 119.13 3kzf h LYS 181 Ca 0.15 0.01 0.15 0.00 -0.85 0.00 0.00 60.65 60.11 3kzf h LYS 181 Cb 0.58 0.04 -0.12 0.00 -0.60 0.00 0.00 32.23 32.13 3kzf h LYS 181 CO -0.57 -0.11 0.05 1.15 -3.45 0.00 0.00 179.45 176.52 3kzf h THR 182 N -0.17 0.44 0.00 1.00 2.02 -0.41 0.15 112.91 115.94 3kzf h THR 182 Ca 0.10 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 3kzf h THR 182 Cb 0.42 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3kzf h THR 182 CO -0.64 0.03 -0.08 -0.07 0.37 0.00 0.00 175.52 175.13 3kzf h LEU 183 N 0.15 0.00 0.13 2.58 3.38 0.36 -1.57 115.31 120.34 3kzf h LEU 183 Ca 0.38 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.07 3kzf h LEU 183 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3kzf h LEU 183 CO -0.57 0.08 -1.40 0.16 0.09 0.00 0.00 178.44 176.80 3kzf h ILE 184 N 0.00 1.07 -0.82 1.22 3.07 0.25 0.20 117.51 122.50 3kzf h ILE 184 Ca -0.00 -2.44 0.20 0.00 1.55 0.00 0.00 64.86 64.18 3kzf h ILE 184 Cb 0.47 2.78 -0.05 0.00 -0.27 0.00 0.00 36.82 39.75 3kzf h ILE 184 CO 0.01 0.73 0.56 0.44 -1.05 0.00 0.00 178.15 178.84 3kzf h ASP 185 N -0.24 0.22 -0.43 2.16 3.32 -0.72 0.90 116.42 121.63 3kzf h ASP 185 Ca -0.29 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 3kzf h ASP 185 Cb 1.80 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 41.29 3kzf h ASP 185 CO 0.09 0.09 0.08 0.59 -1.72 0.00 0.00 179.24 178.38 3kzf n ASN 186 N -4.42 3.99 -3.75 6.45 3.02 -0.61 -4.25 115.26 115.70 3kzf n ASN 186 Ca 0.17 -2.70 -0.27 0.00 -0.03 0.00 0.00 54.58 51.75 3kzf n ASN 186 Cb 0.73 -0.64 0.02 0.00 -0.61 0.00 0.00 39.78 39.29 3kzf n ASN 186 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3kzf n ASN 187 N 0.22 -3.06 -4.65 6.41 2.85 0.31 -4.98 115.26 112.36 3kzf n ASN 187 Ca 0.22 -0.97 -0.35 0.00 -0.11 0.00 0.00 54.58 53.38 3kzf n ASN 187 Cb 0.95 -3.48 -0.10 0.00 1.24 0.00 0.00 39.78 38.40 3kzf n ASN 187 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3kzf s VAL 188 N -3.65 4.20 -0.39 3.44 1.01 0.69 -4.98 120.40 120.73 3kzf s VAL 188 Ca 0.24 -0.28 -0.25 0.00 0.00 0.00 0.00 61.98 61.70 3kzf s VAL 188 Cb -0.08 -2.77 0.02 0.00 0.00 0.00 0.00 36.38 33.54 3kzf s VAL 188 CO 0.86 0.59 0.87 -0.22 0.00 0.00 0.00 175.10 177.19 3kzf s LEU 189 N -0.67 4.06 -0.12 3.92 1.98 -1.21 -4.34 118.68 122.30 3kzf s LEU 189 Ca 0.11 0.37 -0.00 0.00 -2.89 0.00 0.00 54.13 51.72 3kzf s LEU 189 Cb -0.12 -3.15 -0.02 0.00 0.66 0.00 0.00 46.19 43.57 3kzf s LEU 189 CO 0.02 -0.85 -0.11 0.54 -1.89 0.00 0.00 176.35 174.06 3kzf s VAL 190 N 3.38 3.26 -0.15 1.68 0.11 -0.99 -2.89 120.40 124.80 3kzf s VAL 190 Ca 0.35 -0.60 -0.12 0.00 -2.93 0.00 0.00 61.98 58.68 3kzf s VAL 190 Cb -0.12 -2.37 -0.05 0.00 -1.53 0.00 0.00 36.38 32.32 3kzf s VAL 190 CO 0.20 0.54 0.23 -0.63 -3.33 0.00 0.00 175.10 172.10 3kzf s ILE 191 N 0.09 5.35 0.18 7.04 -1.09 -0.36 -0.51 121.20 131.89 3kzf s ILE 191 Ca -0.04 0.41 -0.05 0.00 -2.23 0.00 0.00 60.65 58.73 3kzf s ILE 191 Cb -0.14 -3.55 0.02 0.00 -1.58 0.00 0.00 42.46 37.20 3kzf s ILE 191 CO 0.04 0.45 0.32 0.00 -1.23 0.00 0.00 174.94 174.53 3kzf n THR 193 N -0.25 -0.86 -2.30 0.00 -1.04 -1.26 -4.27 114.28 104.30 3kzf n THR 193 Ca -0.03 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.62 3kzf n THR 193 Cb 0.27 -1.54 -0.01 0.00 -1.82 0.00 0.00 70.33 67.23 3kzf n THR 193 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 3kzf s ASN 194 N -2.94 6.20 -1.38 8.00 0.01 -1.26 -0.06 114.94 123.50 3kzf s ASN 194 Ca 0.55 2.25 0.00 0.00 -0.71 0.00 0.00 52.86 54.95 3kzf s ASN 194 Cb -0.30 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 38.76 3kzf s ASN 194 CO 0.68 -0.90 0.00 0.61 -1.51 0.00 0.00 177.10 175.99 3kzf n GLY 195 N 0.38 0.72 2.36 0.66 0.00 -0.83 -1.79 105.19 106.69 3kzf n GLY 195 Ca 0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 3kzf n GLY 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzf n GLY 196 N -0.45 0.21 0.00 -0.02 0.00 0.92 -4.30 105.19 101.54 3kzf n GLY 196 Ca -0.15 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3kzf n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzf n GLY 197 N -1.00 -1.42 3.60 -0.02 0.00 -0.74 -4.57 105.19 101.04 3kzf n GLY 197 Ca -0.19 -1.35 -0.43 0.00 0.00 0.00 0.00 46.02 44.05 3kzf n GLY 197 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3kzf n ILE 198 N -0.27 0.40 -1.68 -0.61 2.08 -0.70 -4.54 119.36 114.04 3kzf n ILE 198 Ca 0.00 -0.41 -0.50 0.00 0.56 0.00 0.00 62.75 62.41 3kzf n ILE 198 Cb 0.00 -2.49 -0.05 0.00 -0.75 0.00 0.00 39.64 36.35 3kzf n ILE 198 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 3kzf n PRO 199 N 8.55 1.98 -4.09 0.38 -0.02 -1.26 -1.69 135.00 138.85 3kzf n PRO 199 Ca 0.29 0.72 -0.19 0.00 -2.02 0.00 0.00 63.50 62.30 3kzf n PRO 199 Cb 0.43 -2.53 -0.07 0.00 -0.02 0.00 0.00 33.50 31.31 3kzf n PRO 199 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kzf s LYS 201 N -3.29 0.20 0.00 0.00 -2.85 0.13 -0.74 119.74 113.19 3kzf s LYS 201 Ca 0.32 -0.21 0.00 0.00 -1.00 0.00 0.00 55.97 55.08 3kzf s LYS 201 Cb 0.02 -0.10 0.00 0.00 -2.06 0.00 0.00 37.83 35.69 3kzf s LYS 201 CO 0.23 0.02 0.00 -2.13 0.10 0.00 0.00 175.35 173.57 3kzf n ARG 202 N 2.66 0.00 -2.51 1.78 3.00 -1.26 -1.10 116.66 119.23 3kzf n ARG 202 Ca -0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.67 3kzf n ARG 202 Cb 0.58 -0.10 -0.02 0.00 0.00 0.00 0.00 32.46 32.92 3kzf n ARG 202 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 3kzf n GLU 203 N 0.00 -4.44 -2.82 -0.14 1.02 -1.26 -3.72 120.64 109.28 3kzf n GLU 203 Ca 0.00 3.30 -0.09 0.00 -0.02 0.00 0.00 57.16 60.35 3kzf n GLU 203 Cb 0.00 -4.46 0.03 0.00 -0.02 0.00 0.00 31.44 27.00 3kzf n GLU 203 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3kzf n ASN 204 N 1.85 -3.17 -2.32 1.62 5.15 -1.26 -2.95 115.26 114.18 3kzf n ASN 204 Ca -0.21 -0.23 -0.16 0.00 -0.60 0.00 0.00 54.58 53.37 3kzf n ASN 204 Cb 0.33 -2.39 -0.01 0.00 -0.53 0.00 0.00 39.78 37.18 3kzf n ASN 204 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3kzf n LYS 205 N -2.34 -1.93 -3.54 1.20 5.02 -1.26 -4.96 118.16 110.35 3kzf n LYS 205 Ca -0.04 0.79 -0.17 0.00 -2.02 0.00 0.00 58.31 56.86 3kzf n LYS 205 Cb 0.54 -5.38 -0.13 0.00 -0.02 0.00 0.00 35.03 30.04 3kzf n LYS 205 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3kzf s VAL 206 N -2.74 -0.33 0.33 -0.18 0.11 -1.15 -5.13 120.40 111.31 3kzf s VAL 206 Ca 0.00 -0.01 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 3kzf s VAL 206 Cb 0.00 -0.60 -0.09 0.00 -1.53 0.00 0.00 36.38 34.15 3kzf s VAL 206 CO 0.00 -0.12 1.15 -0.63 -3.33 0.00 0.00 175.10 172.17 3kzf s ILE 207 N 2.34 3.26 0.13 7.04 1.01 -1.24 -4.15 121.20 129.58 3kzf s ILE 207 Ca 0.06 1.18 -0.15 0.00 0.00 0.00 0.00 60.65 61.74 3kzf s ILE 207 Cb -0.15 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.63 3kzf s ILE 207 CO -0.11 0.22 0.40 -0.94 0.00 0.00 0.00 174.94 174.50 3kzf s SER 208 N -0.94 -0.20 -0.18 3.58 1.04 -0.26 -4.96 113.70 111.78 3kzf s SER 208 Ca 0.50 -0.38 -0.07 0.00 0.48 0.00 0.00 55.95 56.47 3kzf s SER 208 Cb -0.32 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.23 3kzf s SER 208 CO 0.41 -0.87 0.07 -0.83 0.98 0.00 0.00 173.24 173.00 3kzf s GLY 209 N -2.82 1.93 -0.07 7.32 0.00 -1.26 0.22 107.32 112.63 3kzf s GLY 209 Ca 0.04 -0.74 -0.06 0.00 0.00 0.00 0.00 44.72 43.97 3kzf s GLY 209 CO -0.10 0.03 0.18 -1.34 0.00 0.00 0.00 173.10 171.87 3kzf s VAL 210 N 0.29 5.45 -0.62 1.40 -7.23 -0.92 -4.92 120.40 113.85 3kzf s VAL 210 Ca 0.04 0.11 -0.27 0.00 -1.81 0.00 0.00 61.98 60.05 3kzf s VAL 210 Cb -0.12 -3.47 0.03 0.00 0.56 0.00 0.00 36.38 33.38 3kzf s VAL 210 CO 0.00 0.50 1.15 -1.81 -0.31 0.00 0.00 175.10 174.63 3kzf s ASP 211 N -1.39 6.34 0.32 4.85 -0.00 -1.26 -4.41 116.67 121.12 3kzf s ASP 211 Ca 0.20 -0.19 -0.18 0.00 -0.00 0.00 0.00 52.55 52.38 3kzf s ASP 211 Cb -0.12 -2.52 0.03 0.00 -0.00 0.00 0.00 42.92 40.30 3kzf s ASP 211 CO 0.10 -1.52 0.73 0.00 -0.00 0.00 0.00 175.17 174.48 3kzf s ALA 212 N 4.90 -0.94 -0.11 5.23 0.00 -1.26 -4.53 121.76 125.05 3kzf s ALA 212 Ca 0.37 -0.54 -0.04 0.00 0.00 0.00 0.00 51.96 51.75 3kzf s ALA 212 Cb -0.09 0.80 0.05 0.00 0.00 0.00 0.00 23.12 23.87 3kzf s ALA 212 CO 0.21 -1.00 0.09 0.08 0.00 0.00 0.00 175.76 175.13 3kzf s VAL 213 N -3.25 -0.13 0.31 0.00 1.01 -0.84 -4.70 120.40 112.80 3kzf s VAL 213 Ca 0.14 0.12 -0.21 0.00 0.00 0.00 0.00 61.98 62.02 3kzf s VAL 213 Cb -0.05 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.85 3kzf s VAL 213 CO 0.09 -0.06 0.84 -0.63 0.00 0.00 0.00 175.10 175.34 3kzf s ILE 214 N 2.18 4.44 -0.20 2.22 1.01 -1.26 -4.36 121.20 125.23 3kzf s ILE 214 Ca 0.04 1.45 -0.29 0.00 0.00 0.00 0.00 60.65 61.84 3kzf s ILE 214 Cb -0.14 -3.82 -0.03 0.00 0.01 0.00 0.00 42.46 38.48 3kzf s ILE 214 CO -0.07 0.03 1.58 -0.62 0.00 0.00 0.00 174.94 175.86 3kzf s ASP 215 N -1.84 6.48 0.36 3.58 -1.08 -1.26 -4.49 116.67 118.42 3kzf s ASP 215 Ca 0.51 1.69 0.18 0.00 -0.52 0.00 0.00 52.55 54.41 3kzf s ASP 215 Cb -0.15 -2.53 1.23 0.00 -1.46 0.00 0.00 42.92 40.00 3kzf s ASP 215 CO 0.20 -1.16 1.62 0.50 0.52 0.00 0.00 175.17 176.85 3kzf h LYS 216 N 10.28 0.16 0.03 4.34 3.64 -1.88 0.36 116.57 133.49 3kzf h LYS 216 Ca -0.33 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 58.82 3kzf h LYS 216 Cb 1.15 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.92 3kzf h LYS 216 CO 0.99 0.10 -0.98 -0.44 -2.27 0.00 0.00 179.45 176.86 3kzf h ASP 217 N 0.16 0.15 0.02 4.20 3.32 -1.92 0.23 116.42 122.58 3kzf h ASP 217 Ca 0.79 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.70 3kzf h ASP 217 Cb 1.98 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 41.48 3kzf h ASP 217 CO -0.68 1.04 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.80 3kzf h LEU 218 N 0.04 -0.02 -1.66 1.55 3.38 -1.25 -0.80 115.31 116.56 3kzf h LEU 218 Ca -0.04 -0.60 0.02 0.00 0.09 0.00 0.00 57.88 57.35 3kzf h LEU 218 Cb 1.68 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.41 3kzf h LEU 218 CO 0.14 0.61 0.27 0.00 0.09 0.00 0.00 178.44 179.54 3kzf h ALA 219 N 0.29 1.81 -0.12 1.53 0.00 -1.45 1.17 119.26 122.49 3kzf h ALA 219 Ca -0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 3kzf h ALA 219 Cb 0.62 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.29 3kzf h ALA 219 CO 0.00 0.15 -0.78 1.15 0.00 0.00 0.00 179.25 179.77 3kzf h THR 220 N 0.45 1.31 0.13 0.00 2.02 -0.96 0.95 112.91 116.81 3kzf h THR 220 Ca 0.16 -2.04 0.01 0.00 0.77 0.00 0.00 66.41 65.31 3kzf h THR 220 Cb 0.07 2.04 -0.03 0.00 -1.74 0.00 0.00 68.15 68.49 3kzf h THR 220 CO -0.04 0.64 -0.22 -1.28 0.37 0.00 0.00 175.52 174.98 3kzf h SER 221 N 0.46 -0.62 -0.95 4.18 0.87 -0.26 -0.00 113.55 117.23 3kzf h SER 221 Ca -0.05 0.07 0.07 0.00 -1.23 0.00 0.00 61.79 60.65 3kzf h SER 221 Cb 1.39 0.23 -0.06 0.00 -0.44 0.00 0.00 62.40 63.52 3kzf h SER 221 CO 0.15 -0.31 0.61 0.25 -0.53 0.00 0.00 176.83 177.00 3kzf h LEU 222 N -0.43 0.95 -0.43 2.23 5.85 0.16 -2.23 115.31 121.41 3kzf h LEU 222 Ca 0.02 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 3kzf h LEU 222 Cb 0.44 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3kzf h LEU 222 CO -0.12 0.60 -0.11 0.25 -0.34 0.00 0.00 178.44 178.72 3kzf h LEU 223 N 1.07 0.84 0.64 2.25 5.85 -0.51 -2.02 115.31 123.42 3kzf h LEU 223 Ca 0.42 -0.36 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3kzf h LEU 223 Cb 0.23 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3kzf h LEU 223 CO -0.17 1.01 -0.47 0.00 -0.34 0.00 0.00 178.44 178.47 3kzf h ALA 224 N 0.86 -1.14 -0.75 1.25 0.00 -0.41 -1.12 119.26 117.95 3kzf h ALA 224 Ca 0.11 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.93 3kzf h ALA 224 Cb 0.64 0.62 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 3kzf h ALA 224 CO 0.04 -1.17 0.35 1.57 0.00 0.00 0.00 179.25 180.04 3kzf h LYS 225 N -1.07 0.53 -0.18 0.00 2.10 -1.50 -1.01 116.57 115.45 3kzf h LYS 225 Ca -0.08 -0.03 0.05 0.00 -2.00 0.00 0.00 60.65 58.59 3kzf h LYS 225 Cb 0.89 -0.12 -0.05 0.00 -0.90 0.00 0.00 32.23 32.05 3kzf h LYS 225 CO 0.03 0.35 -0.14 1.15 -2.00 0.00 0.00 179.45 178.84 3kzf h THR 226 N 0.55 0.60 0.00 0.07 2.02 -1.06 -1.59 112.91 113.49 3kzf h THR 226 Ca 0.39 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.57 3kzf h THR 226 Cb 0.51 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3kzf h THR 226 CO -0.33 0.00 -0.00 -0.07 0.37 0.00 0.00 175.52 175.49 3kzf h LEU 227 N -0.15 0.00 -2.63 2.58 4.07 -0.92 -3.48 115.31 114.77 3kzf h LEU 227 Ca 0.11 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.72 3kzf h LEU 227 Cb 0.31 0.00 0.13 0.00 1.08 0.00 0.00 40.66 42.19 3kzf h LEU 227 CO -0.27 0.00 -0.88 0.59 -1.08 0.00 0.00 178.44 176.80 3kzf n ASN 228 N -3.09 -5.20 -4.79 -0.43 4.13 -0.41 -5.00 115.26 100.47 3kzf n ASN 228 Ca 0.00 -0.85 -0.33 0.00 1.68 0.00 0.00 54.58 55.09 3kzf n ASN 228 Cb 0.29 -4.32 0.01 0.00 -1.54 0.00 0.00 39.78 34.23 3kzf n ASN 228 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3kzf s SER 229 N -3.59 5.66 0.40 6.41 0.15 -1.03 -4.95 113.70 116.74 3kzf s SER 229 Ca 0.39 1.94 0.22 0.00 0.70 0.00 0.00 55.95 59.20 3kzf s SER 229 Cb -0.09 -2.55 0.39 0.00 -1.71 0.00 0.00 66.02 62.06 3kzf s SER 229 CO 0.80 -1.26 1.61 0.44 1.20 0.00 0.00 173.24 176.03 3kzf h ASP 230 N 0.60 0.00 -4.62 5.45 3.32 -1.68 -3.46 116.42 116.03 3kzf h ASP 230 Ca -0.48 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.43 3kzf h ASP 230 Cb 1.23 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.56 3kzf h ASP 230 CO 0.57 0.16 -0.42 -0.31 -1.72 0.00 0.00 179.24 177.52 3kzf s TYR 231 N -3.21 -0.11 -0.22 4.55 1.51 -0.96 -4.28 117.35 114.62 3kzf s TYR 231 Ca 0.05 0.21 0.01 0.00 -1.01 0.00 0.00 57.07 56.33 3kzf s TYR 231 Cb 0.06 0.03 0.03 0.00 -0.11 0.00 0.00 41.96 41.98 3kzf s TYR 231 CO 0.68 -0.26 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.55 3kzf s LEU 232 N -0.90 2.80 -0.24 -1.29 2.96 -1.20 -0.49 118.68 120.32 3kzf s LEU 232 Ca -0.10 -0.90 0.01 0.00 -0.22 0.00 0.00 54.13 52.92 3kzf s LEU 232 Cb -0.05 -1.56 0.06 0.00 0.50 0.00 0.00 46.19 45.14 3kzf s LEU 232 CO 0.02 -0.09 -0.05 -0.32 -1.32 0.00 0.00 176.35 174.59 3kzf s MET 233 N 1.26 1.64 -0.53 1.98 -2.45 0.40 -0.18 119.30 121.41 3kzf s MET 233 Ca -0.00 -1.06 -0.19 0.00 -1.25 0.00 0.00 55.69 53.19 3kzf s MET 233 Cb -0.16 -2.62 0.07 0.00 1.25 0.00 0.00 34.83 33.37 3kzf s MET 233 CO -0.08 -0.62 0.65 0.42 1.05 0.00 0.00 175.02 176.44 3kzf s ILE 234 N 1.36 4.85 0.49 10.11 1.01 0.97 0.09 121.20 140.08 3kzf s ILE 234 Ca -0.05 -0.63 -0.23 0.00 0.00 0.00 0.00 60.65 59.74 3kzf s ILE 234 Cb -0.19 -4.36 -0.07 0.00 0.01 0.00 0.00 42.46 37.86 3kzf s ILE 234 CO -0.07 -0.90 1.25 -0.76 0.00 0.00 0.00 174.94 174.46 3kzf s LEU 235 N 2.66 3.97 0.00 2.97 1.43 -1.21 -2.88 118.68 125.63 3kzf s LEU 235 Ca 0.14 2.50 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 3kzf s LEU 235 Cb -0.21 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 41.79 3kzf s LEU 235 CO 0.10 -1.15 0.00 0.35 0.23 0.00 0.00 176.35 175.88 3kzf n THR 236 N -0.63 0.00 0.00 5.49 -2.24 0.22 -4.05 114.28 113.07 3kzf n THR 236 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 3kzf n THR 236 Cb 0.47 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 3kzf n THR 236 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3kzf n ASP 237 N 0.00 2.39 -4.27 3.42 5.68 -1.26 -2.62 116.55 119.89 3kzf n ASP 237 Ca 0.00 0.00 -0.39 0.00 -0.50 0.00 0.00 54.79 53.90 3kzf n ASP 237 Cb 0.00 0.46 -0.11 0.00 -1.14 0.00 0.00 41.12 40.33 3kzf n ASP 237 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3kzf s VAL 238 N -1.01 4.06 -0.02 2.12 1.01 -1.26 -4.73 120.40 120.57 3kzf s VAL 238 Ca 0.00 -1.28 -0.30 0.00 0.00 0.00 0.00 61.98 60.40 3kzf s VAL 238 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 3kzf s VAL 238 CO 0.00 -0.37 1.17 -1.48 0.00 0.00 0.00 175.10 174.41 3kzf s LEU 239 N 1.41 4.31 0.00 3.92 2.34 -1.26 -4.37 118.68 125.03 3kzf s LEU 239 Ca 0.02 1.84 0.00 0.00 0.06 0.00 0.00 54.13 56.05 3kzf s LEU 239 Cb -0.21 -3.57 0.00 0.00 -0.56 0.00 0.00 46.19 41.85 3kzf s LEU 239 CO 0.02 -0.51 0.00 0.59 -1.06 0.00 0.00 176.35 175.39 3kzf n ASN 240 N 4.70 -2.51 -3.96 1.48 5.03 -1.26 -4.90 115.26 113.85 3kzf n ASN 240 Ca 0.10 0.00 -0.09 0.00 0.87 0.00 0.00 54.58 55.45 3kzf n ASN 240 Cb 0.47 0.00 -0.11 0.00 -1.02 0.00 0.00 39.78 39.12 3kzf n ASN 240 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3kzf s ALA 241 N -1.44 0.04 0.00 5.41 0.00 -1.26 -4.99 121.76 119.52 3kzf s ALA 241 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.43 3kzf s ALA 241 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.27 3kzf s ALA 241 CO 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 175.76 175.57 3kzf n ILE 243 N 0.00 0.00 -2.16 0.00 5.41 -1.26 -4.46 119.36 116.89 3kzf n ILE 243 Ca 0.00 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.33 3kzf n ILE 243 Cb 0.00 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 38.90 3kzf n ILE 243 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3kzf s LYS 246 N -1.06 4.27 0.10 0.38 -0.14 -1.26 -3.10 119.74 118.93 3kzf s LYS 246 Ca 0.00 2.05 -0.17 0.00 -1.36 0.00 0.00 55.97 56.49 3kzf s LYS 246 Cb 0.00 -3.54 0.04 0.00 -1.68 0.00 0.00 37.83 32.64 3kzf s LYS 246 CO 0.00 -0.59 0.41 0.15 -0.76 0.00 0.00 175.35 174.56 3kzf s LYS 247 N 2.30 1.02 0.20 1.68 -0.14 -1.26 -5.07 119.74 118.47 3kzf s LYS 247 Ca 0.66 -0.58 -0.20 0.00 -1.36 0.00 0.00 55.97 54.49 3kzf s LYS 247 Cb -0.34 0.45 0.15 0.00 -1.68 0.00 0.00 37.83 36.42 3kzf s LYS 247 CO 0.28 -0.39 1.58 -1.35 -0.76 0.00 0.00 175.35 174.71 3kzf h PRO 248 N 2.57 -0.12 -1.79 -1.68 0.11 -2.07 -3.16 132.00 125.86 3kzf h PRO 248 Ca -0.33 0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.63 3kzf h PRO 248 Cb 1.24 0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 3kzf h PRO 248 CO 0.46 -0.08 0.19 -0.40 -0.21 0.00 0.00 178.00 177.95 3kzf n ASP 249 N -5.44 5.87 -4.77 -2.05 3.85 -1.26 -4.97 116.55 107.78 3kzf n ASP 249 Ca 0.06 -2.71 -0.32 0.00 -0.71 0.00 0.00 54.79 51.10 3kzf n ASP 249 Cb 0.37 -1.10 0.08 0.00 -1.35 0.00 0.00 41.12 39.11 3kzf n ASP 249 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 3kzf s GLU 250 N -0.82 2.41 -0.30 0.11 2.12 -1.18 -5.03 118.70 116.01 3kzf s GLU 250 Ca 0.16 1.26 -0.12 0.00 0.36 0.00 0.00 54.97 56.62 3kzf s GLU 250 Cb 0.12 -1.91 0.13 0.00 0.26 0.00 0.00 34.13 32.73 3kzf s GLU 250 CO -0.00 -1.54 0.72 0.50 -0.54 0.00 0.00 175.26 174.40 3kzf s ARG 251 N -4.62 0.54 0.22 4.30 3.52 -1.20 -5.03 118.95 116.68 3kzf s ARG 251 Ca 0.63 1.28 0.10 0.00 -0.13 0.00 0.00 55.73 57.61 3kzf s ARG 251 Cb -0.18 0.70 -0.04 0.00 -1.56 0.00 0.00 34.95 33.86 3kzf s ARG 251 CO 0.51 -0.17 -0.10 -1.59 -0.81 0.00 0.00 175.30 173.14 3kzf s LYS 252 N 2.64 2.01 0.24 5.12 0.00 -1.26 -4.29 119.74 124.19 3kzf s LYS 252 Ca -0.06 -1.41 -0.30 0.00 0.00 0.00 0.00 55.97 54.20 3kzf s LYS 252 Cb -0.10 -2.07 -0.09 0.00 0.00 0.00 0.00 37.83 35.57 3kzf s LYS 252 CO -0.19 0.40 0.97 -0.51 0.00 0.00 0.00 175.35 176.02 3kzf s LEU 253 N -3.14 4.62 0.00 2.77 1.43 -1.19 -4.96 118.68 118.22 3kzf s LEU 253 Ca 0.27 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 3kzf s LEU 253 Cb -0.07 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.53 3kzf s LEU 253 CO 0.16 0.09 0.00 -0.62 0.23 0.00 0.00 176.35 176.21 3kzf n GLU 254 N 1.52 2.90 -0.74 1.70 -0.58 -1.26 -4.13 120.64 120.05 3kzf n GLU 254 Ca -0.02 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.43 3kzf n GLU 254 Cb 0.47 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.29 3kzf n GLU 254 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3kzf n GLU 255 N 0.00 0.00 -3.92 3.49 2.13 -1.25 -4.50 120.64 116.58 3kzf n GLU 255 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 3kzf n GLU 255 Cb 0.00 -0.65 -0.09 0.00 0.27 0.00 0.00 31.44 30.97 3kzf n GLU 255 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 3kzf s ILE 256 N 1.42 0.14 0.32 6.31 -5.25 -0.84 -4.98 121.20 118.32 3kzf s ILE 256 Ca 0.46 -1.14 -0.12 0.00 -0.99 0.00 0.00 60.65 58.86 3kzf s ILE 256 Cb -0.65 -1.01 -0.08 0.00 2.95 0.00 0.00 42.46 43.68 3kzf s ILE 256 CO 0.35 -0.63 0.68 -0.54 -1.79 0.00 0.00 174.94 173.01 3kzf s LYS 257 N -2.88 3.88 0.61 0.37 1.02 -1.26 -1.43 119.74 120.06 3kzf s LYS 257 Ca -0.03 0.48 0.32 0.00 0.02 0.00 0.00 55.97 56.76 3kzf s LYS 257 Cb 0.00 -2.49 1.81 0.00 -0.52 0.00 0.00 37.83 36.63 3kzf s LYS 257 CO -0.06 0.16 2.13 1.25 -0.92 0.00 0.00 175.35 177.91 3kzf h LEU 258 N 2.06 0.00 -0.01 3.17 5.85 -1.76 -1.25 115.31 123.36 3kzf h LEU 258 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3kzf h LEU 258 Cb 1.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3kzf h LEU 258 CO 0.66 0.00 -0.05 0.28 -0.34 0.00 0.00 178.44 178.99 3kzf h SER 259 N 0.00 -0.17 -0.95 1.25 0.02 -1.92 -3.21 113.55 108.56 3kzf h SER 259 Ca 0.05 0.02 0.16 0.00 -0.84 0.00 0.00 61.79 61.18 3kzf h SER 259 Cb 0.40 0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.92 3kzf h SER 259 CO -0.00 -0.05 0.60 -0.33 -1.14 0.00 0.00 176.83 175.92 3kzf h GLU 260 N -0.06 0.74 -0.00 3.45 4.39 -1.61 -3.07 114.58 118.41 3kzf h GLU 260 Ca 0.00 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.66 3kzf h GLU 260 Cb 0.07 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 3kzf h GLU 260 CO -0.04 0.49 -0.51 0.44 -1.16 0.00 0.00 179.01 178.22 3kzf n ILE 261 N -4.62 0.00 -0.01 3.13 -0.00 -1.18 -1.53 119.36 115.14 3kzf n ILE 261 Ca 0.20 -0.24 -0.11 0.00 -0.00 0.00 0.00 62.75 62.59 3kzf n ILE 261 Cb 0.50 1.05 -0.06 0.00 -0.00 0.00 0.00 39.64 41.13 3kzf n ILE 261 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.55 176.80 3kzf h LEU 262 N 0.50 0.11 0.46 7.28 6.46 -1.58 -1.90 115.31 126.64 3kzf h LEU 262 Ca 0.00 -0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.63 3kzf h LEU 262 Cb 0.36 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 3kzf h LEU 262 CO 0.00 0.19 -0.23 0.00 -0.62 0.00 0.00 178.44 177.78 3kzf h ALA 263 N 0.92 -0.63 -0.15 1.25 0.00 -1.66 -3.17 119.26 115.82 3kzf h ALA 263 Ca 0.03 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3kzf h ALA 263 Cb 0.11 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3kzf h ALA 263 CO -0.00 -0.86 -0.36 1.25 0.00 0.00 0.00 179.25 179.27 3kzf h LEU 264 N -0.63 0.32 -1.69 0.00 5.85 -1.32 -2.00 115.31 115.84 3kzf h LEU 264 Ca -0.06 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 3kzf h LEU 264 Cb 0.49 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.43 3kzf h LEU 264 CO 0.09 0.67 -0.16 -0.08 -0.34 0.00 0.00 178.44 178.62 3kzf h GLU 265 N 0.27 0.00 0.00 1.25 4.81 -1.46 -2.88 114.58 116.57 3kzf h GLU 265 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3kzf h GLU 265 Cb 0.77 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.15 3kzf h GLU 265 CO 0.06 0.16 0.00 1.57 -0.73 0.00 0.00 179.01 180.07 3kzf h LYS 266 N 0.00 0.00 0.00 1.92 2.10 -1.33 -2.99 116.57 116.27 3kzf h LYS 266 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kzf h LYS 266 Cb 0.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.62 3kzf h LYS 266 CO 0.02 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.22 3kzf n ASP 267 N -2.56 0.00 0.00 7.07 9.92 -1.09 -4.85 116.55 125.05 3kzf n ASP 267 Ca 0.04 -1.33 0.00 0.00 -0.53 0.00 0.00 54.79 52.97 3kzf n ASP 267 Cb 0.41 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.89 3kzf n ASP 267 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3kzf n GLY 268 N 0.38 1.35 0.11 0.44 0.00 -1.13 -4.93 105.19 101.42 3kzf n GLY 268 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3kzf n GLY 268 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3kzf n HIS 269 N -2.00 0.00 -3.63 1.61 8.25 -1.25 -4.99 115.22 113.21 3kzf n HIS 269 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 3kzf n HIS 269 Cb 0.00 -0.01 -0.17 0.00 1.12 0.00 0.00 29.99 30.93 3kzf n HIS 269 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3kzf s PHE 270 N -1.78 0.33 -0.10 4.41 0.08 -1.26 -4.95 117.98 114.70 3kzf s PHE 270 Ca 0.00 -0.41 -0.12 0.00 0.12 0.00 0.00 56.93 56.52 3kzf s PHE 270 Cb 0.00 -0.75 -0.10 0.00 -0.57 0.00 0.00 43.02 41.60 3kzf s PHE 270 CO 0.00 -0.53 0.36 0.78 -0.10 0.00 0.00 175.22 175.73 3kzf h GLY 273 N 8.39 -0.05 0.47 4.36 0.00 -2.00 -2.79 103.07 111.46 3kzf h GLY 273 Ca -0.15 0.02 -0.34 0.00 0.00 0.00 0.00 47.33 46.86 3kzf h GLY 273 CO 0.30 -0.02 -2.08 -1.14 0.00 0.00 0.00 176.54 173.60 3kzf n SER 274 N -4.76 0.86 -0.03 0.19 3.41 -1.26 -4.31 113.62 107.73 3kzf n SER 274 Ca -0.04 0.18 0.12 0.00 -0.26 0.00 0.00 58.87 58.86 3kzf n SER 274 Cb 0.19 0.16 0.70 0.00 -0.26 0.00 0.00 64.21 64.99 3kzf n SER 274 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3kzf n MET 275 N -3.02 1.03 0.02 4.33 2.00 -1.26 -4.48 117.12 115.75 3kzf n MET 275 Ca -0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 57.70 57.35 3kzf n MET 275 Cb 1.08 -1.38 -0.01 0.00 0.00 0.00 0.00 33.22 32.92 3kzf n MET 275 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 3kzf h GLY 276 N 5.24 -0.17 2.00 3.03 0.00 -1.68 -2.46 103.07 109.03 3kzf h GLY 276 Ca 0.00 0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.33 3kzf h GLY 276 CO 0.00 -0.06 -0.28 -0.56 0.00 0.00 0.00 176.54 175.64 3kzf h PRO 277 N -0.97 0.00 0.00 4.80 0.13 -1.86 -0.45 132.00 133.65 3kzf h PRO 277 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3kzf h PRO 277 Cb 0.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.25 3kzf h PRO 277 CO 0.03 0.28 0.00 1.63 -0.23 0.00 0.00 178.00 179.70 3kzf n LYS 278 N -3.69 0.00 -0.32 0.86 5.02 -1.25 -0.65 118.16 118.13 3kzf n LYS 278 Ca -0.01 0.69 0.15 0.00 -2.02 0.00 0.00 58.31 57.12 3kzf n LYS 278 Cb 0.39 -1.48 0.34 0.00 -0.02 0.00 0.00 35.03 34.26 3kzf n LYS 278 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3kzf h VAL 279 N 0.00 0.50 -0.97 -0.18 2.07 -1.26 0.31 116.25 116.72 3kzf h VAL 279 Ca 0.00 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3kzf h VAL 279 Cb 0.00 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.71 3kzf h VAL 279 CO 0.00 0.09 0.62 -0.09 0.02 0.00 0.00 177.57 178.20 3kzf h ARG 280 N 0.48 1.30 0.04 1.57 9.65 -0.70 0.15 114.38 126.87 3kzf h ARG 280 Ca 0.59 -0.10 -0.00 0.00 -1.10 0.00 0.00 59.98 59.37 3kzf h ARG 280 Cb 1.13 -0.28 0.00 0.00 -1.39 0.00 0.00 29.97 29.43 3kzf h ARG 280 CO -0.51 0.89 -0.02 0.00 2.80 0.00 0.00 179.97 183.14 3kzf h ALA 281 N 1.34 -0.05 -0.84 2.80 0.00 0.12 -1.27 119.26 121.37 3kzf h ALA 281 Ca 0.35 -0.29 0.12 0.00 0.00 0.00 0.00 54.91 55.09 3kzf h ALA 281 Cb -0.10 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 3kzf h ALA 281 CO -0.07 -0.22 0.46 0.00 0.00 0.00 0.00 179.25 179.42 3kzf h ALA 282 N 0.25 1.24 -0.82 0.00 0.00 -1.19 -0.34 119.26 118.40 3kzf h ALA 282 Ca -0.00 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3kzf h ALA 282 Cb 0.60 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3kzf h ALA 282 CO 0.01 0.02 0.52 0.82 0.00 0.00 0.00 179.25 180.62 3kzf h ILE 283 N 0.73 1.10 -0.29 0.00 2.04 -0.61 -0.99 117.51 119.48 3kzf h ILE 283 Ca 0.43 -0.34 -0.07 0.00 1.00 0.00 0.00 64.86 65.88 3kzf h ILE 283 Cb 0.50 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 3kzf h ILE 283 CO -0.30 0.18 -0.10 -0.33 0.00 0.00 0.00 178.15 177.60 3kzf h GLU 284 N 0.99 0.58 0.18 2.37 5.08 0.05 -1.91 114.58 121.92 3kzf h GLU 284 Ca 0.34 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3kzf h GLU 284 Cb 0.06 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3kzf h GLU 284 CO -0.13 0.80 -0.09 0.35 -1.00 0.00 0.00 179.01 178.94 3kzf h PHE 285 N 0.34 -0.23 0.00 4.33 3.57 -0.97 -2.65 116.94 121.33 3kzf h PHE 285 Ca 0.07 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3kzf h PHE 285 Cb 0.60 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 3kzf h PHE 285 CO 0.06 0.08 -0.14 1.15 -2.23 0.00 0.00 178.31 177.22 3kzf h THR 286 N -0.54 0.83 -0.23 4.41 2.02 -1.22 -1.05 112.91 117.14 3kzf h THR 286 Ca -0.02 -0.54 -0.13 0.00 0.77 0.00 0.00 66.41 66.49 3kzf h THR 286 Cb 0.41 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3kzf h THR 286 CO 0.04 0.14 -0.39 -0.61 0.37 0.00 0.00 175.52 175.07 3kzf h GLN 287 N 0.00 0.52 -0.02 6.66 4.15 -1.20 -2.74 115.11 122.48 3kzf h GLN 287 Ca -0.00 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.16 3kzf h GLN 287 Cb 0.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 3kzf h GLN 287 CO 0.02 0.83 -0.11 0.00 -1.93 0.00 0.00 178.83 177.63 3kzf n ALA 288 N -2.50 2.70 -0.47 3.38 0.00 -0.46 -4.55 120.51 118.62 3kzf n ALA 288 Ca -0.02 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.84 3kzf n ALA 288 Cb 0.50 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.42 3kzf n ALA 288 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3kzf n THR 289 N 0.51 0.00 0.00 0.00 -2.24 -0.84 -5.00 114.28 106.71 3kzf n THR 289 Ca 0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3kzf n THR 289 Cb 0.37 1.47 0.00 0.00 -2.10 0.00 0.00 70.33 70.06 3kzf n THR 289 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kzf n GLY 290 N 0.06 2.06 3.65 3.38 0.00 -1.03 -4.94 105.19 108.37 3kzf n GLY 290 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3kzf n GLY 290 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kzf n LYS 291 N -0.90 1.20 -2.55 1.61 4.76 -1.26 -3.33 118.16 117.69 3kzf n LYS 291 Ca 0.00 0.45 -0.39 0.00 -2.87 0.00 0.00 58.31 55.50 3kzf n LYS 291 Cb 0.00 -2.26 -0.05 0.00 -1.84 0.00 0.00 35.03 30.89 3kzf n LYS 291 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 3kzf s MET 292 N -2.66 4.53 0.03 1.97 -2.45 -1.26 -4.15 119.30 115.31 3kzf s MET 292 Ca 0.72 1.64 0.06 0.00 -1.25 0.00 0.00 55.69 56.86 3kzf s MET 292 Cb -0.44 -2.99 -0.02 0.00 1.25 0.00 0.00 34.83 32.63 3kzf s MET 292 CO 0.49 0.16 -0.17 -1.54 1.05 0.00 0.00 175.02 175.01 3kzf s SER 293 N -1.17 1.97 -0.08 1.11 1.04 -0.89 -3.26 113.70 112.42 3kzf s SER 293 Ca 0.48 -0.45 0.01 0.00 0.48 0.00 0.00 55.95 56.47 3kzf s SER 293 Cb -0.27 -0.15 0.02 0.00 0.10 0.00 0.00 66.02 65.71 3kzf s SER 293 CO 0.35 0.10 -0.10 -0.63 0.98 0.00 0.00 173.24 173.94 3kzf s ILE 294 N -0.76 1.03 -0.20 -1.02 1.01 0.75 0.80 121.20 122.81 3kzf s ILE 294 Ca 0.04 -0.38 -0.03 0.00 0.00 0.00 0.00 60.65 60.28 3kzf s ILE 294 Cb -0.08 -0.99 -0.01 0.00 0.01 0.00 0.00 42.46 41.39 3kzf s ILE 294 CO 0.01 0.34 -0.05 -0.63 0.00 0.00 0.00 174.94 174.62 3kzf s ILE 295 N 1.04 3.47 0.06 2.92 1.09 -0.65 -0.02 121.20 129.11 3kzf s ILE 295 Ca -0.08 -0.48 -0.07 0.00 -1.10 0.00 0.00 60.65 58.93 3kzf s ILE 295 Cb -0.15 -2.55 -0.01 0.00 -1.06 0.00 0.00 42.46 38.69 3kzf s ILE 295 CO -0.01 0.45 0.13 -0.89 -0.10 0.00 0.00 174.94 174.52 3kzf s THR 296 N 1.11 0.15 0.37 2.92 2.01 -1.14 -1.97 115.64 119.09 3kzf s THR 296 Ca 0.01 -1.20 -0.25 0.00 0.31 0.00 0.00 61.69 60.56 3kzf s THR 296 Cb -0.15 -1.17 -0.12 0.00 0.01 0.00 0.00 72.50 71.08 3kzf s THR 296 CO -0.00 -0.66 0.93 -1.54 -0.69 0.00 0.00 174.62 172.65 3kzf n SER 297 N 0.33 0.89 -0.34 3.53 3.41 -1.26 0.73 113.62 120.91 3kzf n SER 297 Ca -0.17 1.07 0.10 0.00 -0.26 0.00 0.00 58.87 59.61 3kzf n SER 297 Cb 0.60 -1.29 0.28 0.00 -0.26 0.00 0.00 64.21 63.55 3kzf n SER 297 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3kzf h LEU 298 N 1.57 0.72 -0.48 1.04 5.85 -1.81 -2.65 115.31 119.55 3kzf h LEU 298 Ca -0.42 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.46 3kzf h LEU 298 Cb 1.35 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.29 3kzf h LEU 298 CO 0.57 0.28 0.14 0.77 -0.34 0.00 0.00 178.44 179.87 3kzf h SER 299 N 0.74 0.12 -0.39 1.25 4.64 -1.90 -2.52 113.55 115.49 3kzf h SER 299 Ca 0.53 0.07 -0.06 0.00 -0.47 0.00 0.00 61.79 61.86 3kzf h SER 299 Cb 0.78 0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.90 3kzf h SER 299 CO -0.37 0.09 0.08 0.35 -0.87 0.00 0.00 176.83 176.12 3kzf n THR 300 N -5.04 1.78 0.00 2.95 -2.24 -1.00 -4.53 114.28 106.20 3kzf n THR 300 Ca 0.05 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 60.93 3kzf n THR 300 Cb 0.20 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 3kzf n THR 300 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kzf n ALA 301 N 0.20 -0.20 -0.32 6.98 0.00 -0.95 -1.57 120.51 124.65 3kzf n ALA 301 Ca 0.20 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.85 3kzf n ALA 301 Cb 0.90 0.29 0.47 0.00 0.00 0.00 0.00 19.45 21.10 3kzf n ALA 301 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kzf h VAL 302 N 0.00 0.57 -0.25 0.00 2.07 -1.86 -1.08 116.25 115.71 3kzf h VAL 302 Ca 0.00 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 3kzf h VAL 302 Cb 0.00 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.82 3kzf h VAL 302 CO 0.00 0.09 0.06 0.44 0.02 0.00 0.00 177.57 178.17 3kzf h ASP 303 N 0.47 0.38 0.05 0.57 3.32 -1.75 -2.95 116.42 116.51 3kzf h ASP 303 Ca 0.58 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 57.39 3kzf h ASP 303 Cb 1.34 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 3kzf h ASP 303 CO -0.31 0.52 -0.03 0.00 -1.72 0.00 0.00 179.24 177.70 3kzf h ALA 304 N 0.87 1.76 0.00 3.45 0.00 -0.16 -0.42 119.26 124.76 3kzf h ALA 304 Ca 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3kzf h ALA 304 Cb 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3kzf h ALA 304 CO 0.00 0.04 -0.01 -0.07 0.00 0.00 0.00 179.25 179.22 3kzf h LEU 305 N 0.00 0.00 -1.62 0.00 -0.00 -1.42 -2.98 115.31 109.29 3kzf h LEU 305 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3kzf h LEU 305 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.73 3kzf h LEU 305 CO 0.00 0.01 0.00 0.59 -0.00 0.00 0.00 178.44 179.04 3kzf n ASN 306 N -3.10 2.44 -1.70 -0.43 5.03 -0.17 -4.96 115.26 112.37 3kzf n ASN 306 Ca -0.00 -1.83 -0.08 0.00 0.87 0.00 0.00 54.58 53.54 3kzf n ASN 306 Cb 0.27 -0.13 0.03 0.00 -1.02 0.00 0.00 39.78 38.92 3kzf n ASN 306 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3kzf n GLY 307 N 1.29 0.35 0.00 7.41 0.00 -1.13 -4.98 105.19 108.14 3kzf n GLY 307 Ca 0.17 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3kzf n GLY 307 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kzf n LYS 308 N -2.16 1.79 -3.21 1.61 5.02 -1.20 -5.06 118.16 114.96 3kzf n LYS 308 Ca -0.02 -1.12 0.00 0.00 -2.02 0.00 0.00 58.31 55.14 3kzf n LYS 308 Cb 0.53 -0.89 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 3kzf n LYS 308 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kzf n GLY 310 N -0.11 -1.69 3.54 0.00 0.00 -1.26 -4.51 105.19 101.15 3kzf n GLY 310 Ca 0.00 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 3kzf n GLY 310 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kzf s THR 311 N -2.55 4.04 -0.36 2.61 2.01 -0.83 -3.88 115.64 116.67 3kzf s THR 311 Ca 0.00 -0.73 -0.18 0.00 0.31 0.00 0.00 61.69 61.10 3kzf s THR 311 Cb 0.00 -4.98 -0.00 0.00 0.01 0.00 0.00 72.50 67.53 3kzf s THR 311 CO 0.00 -1.84 0.50 -0.13 -0.69 0.00 0.00 174.62 172.45 3kzf s ARG 312 N 4.68 3.56 -0.21 4.92 0.52 -1.26 -1.63 118.95 129.52 3kzf s ARG 312 Ca 0.42 -0.25 -0.09 0.00 -0.52 0.00 0.00 55.73 55.29 3kzf s ARG 312 Cb -0.02 -3.83 -0.05 0.00 0.52 0.00 0.00 34.95 31.57 3kzf s ARG 312 CO -0.06 -0.66 0.11 0.96 0.02 0.00 0.00 175.30 175.67 3kzf s ILE 313 N 2.35 5.09 0.33 1.52 -4.36 0.24 -1.98 121.20 124.39 3kzf s ILE 313 Ca 0.18 0.08 0.08 0.00 -0.26 0.00 0.00 60.65 60.72 3kzf s ILE 313 Cb -0.16 -3.34 -0.06 0.00 1.25 0.00 0.00 42.46 40.15 3kzf s ILE 313 CO 0.13 0.40 -0.06 0.27 0.24 0.00 0.00 174.94 175.92 3kzf s ILE 314 N 0.75 1.97 0.34 8.37 -4.36 -0.51 -2.09 121.20 125.65 3kzf s ILE 314 Ca 0.06 -2.14 0.08 0.00 -0.26 0.00 0.00 60.65 58.39 3kzf s ILE 314 Cb -0.13 -2.64 0.32 0.00 1.25 0.00 0.00 42.46 41.26 3kzf s ILE 314 CO 0.02 -0.19 1.83 0.07 0.24 0.00 0.00 174.94 176.91 3kzf h LYS 315 N 2.07 0.69 0.00 0.37 2.10 -1.82 -2.70 116.57 117.28 3kzf h LYS 315 Ca -0.42 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3kzf h LYS 315 Cb 1.24 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 3kzf h LYS 315 CO 0.71 0.46 0.00 -3.47 -2.00 0.00 0.00 179.45 175.15