#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1czk h LYS 2 N 0.00 0.95 -5.36 0.00 3.64 -1.80 -3.44 116.57 110.56 1czk h LYS 2 Ca 0.00 -0.39 -0.65 0.00 -1.27 0.00 0.00 60.65 58.34 1czk h LYS 2 Cb 0.00 -0.04 -0.24 0.00 -0.41 0.00 0.00 32.23 31.54 1czk h LYS 2 CO 0.00 1.05 -0.72 0.42 -2.27 0.00 0.00 179.45 177.94 1czk s ILE 3 N -4.69 3.48 -0.29 2.00 1.01 -1.02 -4.03 121.20 117.66 1czk s ILE 3 Ca -0.11 -0.51 -0.08 0.00 0.00 0.00 0.00 60.65 59.95 1czk s ILE 3 Cb 0.13 -2.49 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 1czk s ILE 3 CO 0.86 0.51 0.11 -0.83 0.00 0.00 0.00 174.94 175.59 1czk s GLY 4 N 0.28 1.81 -0.29 6.18 0.00 -0.72 -0.93 107.32 113.66 1czk s GLY 4 Ca -0.06 -1.36 -0.11 0.00 0.00 0.00 0.00 44.72 43.18 1czk s GLY 4 CO 0.04 0.64 0.20 -2.27 0.00 0.00 0.00 173.10 171.72 1czk s LEU 5 N 1.57 4.07 -0.17 0.66 0.20 0.27 -1.53 118.68 123.76 1czk s LEU 5 Ca 0.04 -0.04 -0.00 0.00 0.69 0.00 0.00 54.13 54.82 1czk s LEU 5 Cb -0.17 -2.14 0.00 0.00 -0.43 0.00 0.00 46.19 43.46 1czk s LEU 5 CO 0.04 -0.08 -0.15 -0.36 -0.29 0.00 0.00 176.35 175.52 1czk s PHE 6 N 1.77 2.81 0.16 5.38 0.40 0.15 -0.21 117.98 128.44 1czk s PHE 6 Ca 0.07 -1.16 0.05 0.00 -0.60 0.00 0.00 56.93 55.29 1czk s PHE 6 Cb -0.16 -1.93 -0.05 0.00 0.51 0.00 0.00 43.02 41.39 1czk s PHE 6 CO 0.11 -0.56 -0.10 1.52 0.70 0.00 0.00 175.22 176.89 1czk s TYR 7 N 1.03 1.33 0.06 0.36 1.13 -0.69 -0.48 117.35 120.10 1czk s TYR 7 Ca -0.01 -0.76 0.05 0.00 -1.41 0.00 0.00 57.07 54.94 1czk s TYR 7 Cb -0.15 -0.68 -0.03 0.00 -1.10 0.00 0.00 41.96 40.00 1czk s TYR 7 CO -0.03 0.09 -0.15 0.20 -2.51 0.00 0.00 175.55 173.15 1czk s GLY 8 N -3.20 0.89 -0.15 5.49 0.00 -0.89 -0.51 107.32 108.96 1czk s GLY 8 Ca 0.18 -0.97 -0.17 0.00 0.00 0.00 0.00 44.72 43.76 1czk s GLY 8 CO 0.02 -0.98 0.47 -1.08 0.00 0.00 0.00 173.10 171.53 1czk s THR 9 N -1.10 0.01 -0.22 0.90 -1.32 -1.26 -4.32 115.64 108.31 1czk s THR 9 Ca 0.00 -0.07 -0.12 0.00 -1.21 0.00 0.00 61.69 60.30 1czk s THR 9 Cb -0.09 -0.69 -0.10 0.00 -1.51 0.00 0.00 72.50 70.12 1czk s THR 9 CO 0.02 -0.04 -0.30 1.67 -2.21 0.00 0.00 174.62 173.76 1czk n GLN 10 N 2.45 0.49 -0.35 7.08 -0.06 -1.26 -4.70 117.38 121.02 1czk n GLN 10 Ca -0.15 0.21 0.07 0.00 -2.00 0.00 0.00 57.00 55.14 1czk n GLN 10 Cb 0.57 -1.32 0.23 0.00 -4.06 0.00 0.00 30.24 25.65 1czk n GLN 10 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 1czk n THR 11 N -4.07 1.63 0.00 1.69 -2.24 -1.26 -4.99 114.28 105.05 1czk n THR 11 Ca -0.43 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 59.98 1czk n THR 11 Cb 0.79 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1czk n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1czk n GLY 12 N 0.23 1.93 0.11 3.38 0.00 -1.26 -4.94 105.19 104.64 1czk n GLY 12 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 1czk n GLY 12 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1czk h VAL 13 N 0.00 1.14 -0.13 1.61 2.07 -1.97 -2.48 116.25 116.49 1czk h VAL 13 Ca 0.00 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.10 1czk h VAL 13 Cb 0.00 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1czk h VAL 13 CO 0.00 0.13 0.04 0.74 0.02 0.00 0.00 177.57 178.50 1czk h THR 14 N 0.15 1.07 -0.42 2.57 2.02 -1.92 -1.70 112.91 114.68 1czk h THR 14 Ca 0.06 -0.23 -0.12 0.00 0.77 0.00 0.00 66.41 66.89 1czk h THR 14 Cb 0.14 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1czk h THR 14 CO -0.01 0.08 -0.21 -0.61 0.37 0.00 0.00 175.52 175.14 1czk h GLN 15 N 0.19 0.88 -0.61 6.66 4.15 -1.77 -0.72 115.11 123.88 1czk h GLN 15 Ca 0.05 -0.39 -0.03 0.00 0.77 0.00 0.00 58.65 59.05 1czk h GLN 15 Cb 0.07 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 1czk h GLN 15 CO -0.00 1.03 0.27 1.15 -1.93 0.00 0.00 178.83 179.35 1czk h THR 16 N 0.70 1.22 -0.39 2.39 2.02 -0.92 -1.16 112.91 116.77 1czk h THR 16 Ca 0.09 -0.67 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 1czk h THR 16 Cb 0.78 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1czk h THR 16 CO 0.06 0.27 0.20 0.40 0.37 0.00 0.00 175.52 176.82 1czk h ILE 17 N 0.85 1.16 -0.76 3.11 2.04 -1.14 -1.59 117.51 121.17 1czk h ILE 17 Ca 0.21 -0.45 0.09 0.00 1.00 0.00 0.00 64.86 65.70 1czk h ILE 17 Cb 0.17 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 36.92 1czk h ILE 17 CO -0.02 0.17 0.42 0.00 0.00 0.00 0.00 178.15 178.72 1czk h ALA 18 N 1.05 1.07 -0.49 1.87 0.00 -0.85 0.09 119.26 122.01 1czk h ALA 18 Ca 0.14 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1czk h ALA 18 Cb 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1czk h ALA 18 CO -0.02 0.06 0.03 0.93 0.00 0.00 0.00 179.25 180.25 1czk h GLU 19 N 0.73 0.79 -0.27 0.00 5.08 -0.81 -0.97 114.58 119.12 1czk h GLU 19 Ca 0.36 -0.20 -0.14 0.00 -1.00 0.00 0.00 59.36 58.39 1czk h GLU 19 Cb 0.32 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1czk h GLU 19 CO -0.24 0.77 -0.42 0.77 -1.00 0.00 0.00 179.01 178.90 1czk h SER 20 N 0.74 0.69 -0.50 1.42 0.02 -0.23 -1.62 113.55 114.06 1czk h SER 20 Ca 0.15 -0.32 -0.10 0.00 -0.84 0.00 0.00 61.79 60.69 1czk h SER 20 Cb 0.40 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1czk h SER 20 CO 0.01 1.02 -0.07 0.40 -1.14 0.00 0.00 176.83 177.06 1czk h ILE 21 N 0.53 1.27 -0.75 3.27 2.04 -0.71 -0.32 117.51 122.83 1czk h ILE 21 Ca 0.04 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 64.66 1czk h ILE 21 Cb 0.94 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 38.00 1czk h ILE 21 CO 0.09 0.42 0.28 -0.61 0.00 0.00 0.00 178.15 178.32 1czk h GLN 22 N 0.80 1.14 -0.36 2.37 4.15 -1.05 -1.91 115.11 120.26 1czk h GLN 22 Ca 0.13 -0.22 -0.04 0.00 0.77 0.00 0.00 58.65 59.29 1czk h GLN 22 Cb 0.61 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 1czk h GLN 22 CO 0.04 0.95 0.05 0.37 -1.93 0.00 0.00 178.83 178.31 1czk h GLN 23 N 1.10 0.60 -0.01 1.69 4.15 -1.07 -0.32 115.11 121.25 1czk h GLN 23 Ca 0.25 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.47 1czk h GLN 23 Cb 0.25 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 1czk h GLN 23 CO -0.02 0.67 -0.14 0.93 -1.93 0.00 0.00 178.83 178.34 1czk h GLU 24 N 0.44 0.02 0.00 1.69 4.39 -0.70 -1.71 114.58 118.70 1czk h GLU 24 Ca 0.11 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1czk h GLU 24 Cb 0.37 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1czk h GLU 24 CO 0.01 0.16 0.00 0.74 -1.16 0.00 0.00 179.01 178.76 1czk h PHE 25 N 0.02 0.00 0.00 4.33 0.04 -1.11 -3.47 116.94 116.74 1czk h PHE 25 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1czk h PHE 25 Cb 0.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.42 1czk h PHE 25 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12 1czk n GLY 26 N 0.84 0.63 0.08 -1.45 0.00 -0.64 -4.89 105.19 99.77 1czk n GLY 26 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1czk n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1czk n GLY 27 N 0.00 -2.05 0.38 -0.02 0.00 -0.15 -4.60 105.19 98.76 1czk n GLY 27 Ca 0.00 -2.06 0.20 0.00 0.00 0.00 0.00 46.02 44.16 1czk n GLY 27 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1czk h GLU 28 N 0.00 0.02 0.00 1.61 5.08 -1.84 -0.08 114.58 119.37 1czk h GLU 28 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1czk h GLU 28 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1czk h GLU 28 CO 0.00 0.01 0.00 0.66 -1.00 0.00 0.00 179.01 178.68 1czk h SER 29 N 0.02 0.00 0.00 1.42 4.64 -1.97 -3.31 113.55 114.34 1czk h SER 29 Ca 0.26 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.33 1czk h SER 29 Cb 1.02 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.07 1czk h SER 29 CO -0.01 0.00 -1.96 -0.38 -0.87 0.00 0.00 176.83 173.61 1czk n ILE 30 N -2.79 0.97 -4.67 0.95 2.08 -0.15 -4.56 119.36 111.18 1czk n ILE 30 Ca 0.01 -0.38 -0.26 0.00 0.56 0.00 0.00 62.75 62.68 1czk n ILE 30 Cb 0.27 -1.07 -0.17 0.00 -0.75 0.00 0.00 39.64 37.92 1czk n ILE 30 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1czk s VAL 31 N -2.34 1.28 -0.13 1.39 1.01 -0.56 -2.43 120.40 118.62 1czk s VAL 31 Ca -0.22 -0.56 -0.16 0.00 0.00 0.00 0.00 61.98 61.04 1czk s VAL 31 Cb 0.06 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1czk s VAL 31 CO 0.40 0.39 0.40 -1.81 0.00 0.00 0.00 175.10 174.48 1czk s ASP 32 N 0.63 6.59 -0.21 3.32 1.01 -0.11 -4.14 116.67 123.77 1czk s ASP 32 Ca -0.15 0.70 -0.13 0.00 0.71 0.00 0.00 52.55 53.68 1czk s ASP 32 Cb -0.16 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.48 1czk s ASP 32 CO 0.04 0.06 0.29 -0.22 0.21 0.00 0.00 175.17 175.55 1czk s LEU 33 N 0.47 4.15 -0.05 1.23 2.96 -1.26 -0.57 118.68 125.61 1czk s LEU 33 Ca 0.22 0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.48 1czk s LEU 33 Cb -0.14 -2.33 0.02 0.00 0.50 0.00 0.00 46.19 44.24 1czk s LEU 33 CO 0.08 0.00 -0.04 0.20 -1.32 0.00 0.00 176.35 175.27 1czk s ASN 34 N 0.98 1.01 -0.28 3.68 -0.87 0.70 -4.97 114.94 115.20 1czk s ASN 34 Ca 0.14 -0.12 -0.25 0.00 -1.57 0.00 0.00 52.86 51.06 1czk s ASN 34 Cb -0.14 -0.44 0.00 0.00 -0.02 0.00 0.00 41.25 40.65 1czk s ASN 34 CO 0.06 -0.08 0.86 -0.62 -2.57 0.00 0.00 177.10 174.76 1czk s ASP 35 N 1.07 6.80 0.63 -1.22 3.68 -1.26 -1.70 116.67 124.67 1czk s ASP 35 Ca -0.09 0.92 0.33 0.00 2.13 0.00 0.00 52.55 55.85 1czk s ASP 35 Cb -0.14 -2.45 1.87 0.00 -1.45 0.00 0.00 42.92 40.76 1czk s ASP 35 CO -0.01 -0.61 2.15 -0.29 0.13 0.00 0.00 175.17 176.54 1czk h ILE 36 N 5.53 0.26 -0.05 4.11 6.09 -1.15 -0.53 117.51 131.78 1czk h ILE 36 Ca -0.23 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.25 1czk h ILE 36 Cb 1.09 0.86 -0.00 0.00 0.47 0.00 0.00 36.82 39.23 1czk h ILE 36 CO 0.91 0.00 -0.03 0.00 -3.07 0.00 0.00 178.15 175.95 1czk h ALA 37 N 1.76 1.86 -0.42 0.18 0.00 -1.87 -2.61 119.26 118.16 1czk h ALA 37 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1czk h ALA 37 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1czk h ALA 37 CO -0.00 0.11 0.00 0.09 0.00 0.00 0.00 179.25 179.45 1czk n ASN 38 N -4.46 3.37 -4.79 0.00 3.02 -0.21 -5.00 115.26 107.19 1czk n ASN 38 Ca -0.02 -1.95 -0.22 0.00 -0.03 0.00 0.00 54.58 52.36 1czk n ASN 38 Cb 0.14 -0.27 -0.05 0.00 -0.61 0.00 0.00 39.78 38.99 1czk n ASN 38 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1czk s ALA 39 N -1.28 3.65 0.13 5.41 0.00 -0.98 -5.03 121.76 123.65 1czk s ALA 39 Ca 0.36 -1.71 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1czk s ALA 39 Cb 0.21 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1czk s ALA 39 CO 0.28 0.05 0.03 -0.51 0.00 0.00 0.00 175.76 175.61 1czk s ASP 40 N -3.91 5.08 0.33 0.00 -0.00 -1.26 -5.01 116.67 111.90 1czk s ASP 40 Ca 0.39 -0.22 0.08 0.00 -0.00 0.00 0.00 52.55 52.80 1czk s ASP 40 Cb -0.05 -1.21 0.80 0.00 -0.00 0.00 0.00 42.92 42.47 1czk s ASP 40 CO 0.24 0.13 1.79 0.00 -0.00 0.00 0.00 175.17 177.34 1czk h ALA 41 N 3.03 1.78 0.00 5.23 0.00 -1.93 -0.58 119.26 126.80 1czk h ALA 41 Ca -0.47 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1czk h ALA 41 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1czk h ALA 41 CO 0.60 -0.13 0.00 -1.13 0.00 0.00 0.00 179.25 178.59 1czk n SER 42 N -4.71 0.49 0.26 0.00 3.41 -1.26 -2.09 113.62 109.72 1czk n SER 42 Ca 0.23 0.66 0.14 0.00 -0.26 0.00 0.00 58.87 59.64 1czk n SER 42 Cb 0.60 -0.75 0.66 0.00 -0.26 0.00 0.00 64.21 64.45 1czk n SER 42 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1czk h ASP 43 N 0.00 0.00 1.13 4.04 3.45 -1.50 -2.26 116.42 121.27 1czk h ASP 43 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1czk h ASP 43 Cb 0.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 1czk h ASP 43 CO 0.00 0.10 0.00 -0.07 -1.57 0.00 0.00 179.24 177.70 1czk h LEU 44 N 0.00 0.00 -0.99 1.55 4.07 -1.60 -3.18 115.31 115.16 1czk h LEU 44 Ca -0.00 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.88 1czk h LEU 44 Cb 0.52 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1czk h LEU 44 CO 0.01 0.00 -0.36 0.78 -1.08 0.00 0.00 178.44 177.79 1czk h ASN 45 N 0.00 0.00 0.39 -0.43 2.35 -1.59 -3.20 115.58 113.10 1czk h ASN 45 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1czk h ASN 45 Cb 0.57 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.94 1czk h ASN 45 CO 0.00 0.36 0.00 0.00 -1.65 0.00 0.00 177.43 176.14 1czk n ALA 46 N -2.30 1.73 -2.39 -0.83 0.00 -1.20 -4.78 120.51 110.74 1czk n ALA 46 Ca -0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 53.44 53.09 1czk n ALA 46 Cb 0.49 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.57 1czk n ALA 46 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1czk s TYR 47 N -2.80 2.23 -0.77 0.00 1.51 -1.21 -5.00 117.35 111.31 1czk s TYR 47 Ca 0.10 -0.40 0.22 0.00 -1.01 0.00 0.00 57.07 55.98 1czk s TYR 47 Cb 0.09 -1.27 -0.18 0.00 -0.11 0.00 0.00 41.96 40.50 1czk s TYR 47 CO 0.24 0.22 0.86 -0.25 -1.11 0.00 0.00 175.55 175.51 1czk n ASP 48 N 1.37 0.73 -3.94 2.29 8.00 -1.26 -4.85 116.55 118.89 1czk n ASP 48 Ca -0.18 -0.68 -0.24 0.00 0.71 0.00 0.00 54.79 54.41 1czk n ASP 48 Cb 0.53 1.13 -0.17 0.00 -0.02 0.00 0.00 41.12 42.58 1czk n ASP 48 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1czk s TYR 49 N -3.12 1.24 0.03 1.24 2.02 -1.26 -2.14 117.35 115.36 1czk s TYR 49 Ca 0.05 -0.50 0.04 0.00 -0.37 0.00 0.00 57.07 56.29 1czk s TYR 49 Cb 0.16 -1.01 -0.02 0.00 -0.40 0.00 0.00 41.96 40.69 1czk s TYR 49 CO 0.86 -0.34 -0.13 -0.51 -1.57 0.00 0.00 175.55 173.86 1czk s LEU 50 N 1.15 2.15 -0.12 -1.29 1.43 -0.36 -1.76 118.68 119.88 1czk s LEU 50 Ca -0.06 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1czk s LEU 50 Cb -0.14 -0.56 0.01 0.00 0.03 0.00 0.00 46.19 45.53 1czk s LEU 50 CO -0.02 0.04 -0.17 -0.63 0.23 0.00 0.00 176.35 175.80 1czk s ILE 51 N -0.76 1.65 -0.19 -0.59 1.01 -0.58 -0.50 121.20 121.24 1czk s ILE 51 Ca 0.01 -0.74 -0.02 0.00 0.00 0.00 0.00 60.65 59.91 1czk s ILE 51 Cb -0.07 -1.49 -0.01 0.00 0.01 0.00 0.00 42.46 40.90 1czk s ILE 51 CO 0.01 0.47 -0.09 -0.63 0.00 0.00 0.00 174.94 174.70 1czk s ILE 52 N 0.94 3.09 -0.06 2.92 -1.09 0.38 -0.67 121.20 126.69 1czk s ILE 52 Ca -0.07 -0.61 0.05 0.00 -2.23 0.00 0.00 60.65 57.80 1czk s ILE 52 Cb -0.15 -2.36 -0.01 0.00 -1.58 0.00 0.00 42.46 38.35 1czk s ILE 52 CO -0.02 0.47 -0.23 -0.83 -1.23 0.00 0.00 174.94 173.10 1czk s GLY 53 N 1.15 1.34 -0.27 6.18 0.00 0.37 -1.30 107.32 114.78 1czk s GLY 53 Ca 0.01 -1.03 -0.14 0.00 0.00 0.00 0.00 44.72 43.56 1czk s GLY 53 CO -0.03 -0.62 0.66 0.00 0.00 0.00 0.00 173.10 173.12 1czk s PRO 55 N 1.84 3.78 -0.07 0.00 0.04 -1.26 -3.59 135.00 135.74 1czk s PRO 55 Ca -0.09 0.44 -0.15 0.00 0.04 0.00 0.00 61.00 61.24 1czk s PRO 55 Cb -0.07 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 32.00 1czk s PRO 55 CO -0.19 0.01 0.39 0.99 0.04 0.00 0.00 177.00 178.23 1czk s THR 56 N -2.31 5.16 0.21 1.26 2.01 -1.00 -3.38 115.64 117.59 1czk s THR 56 Ca 0.51 0.78 0.04 0.00 0.31 0.00 0.00 61.69 63.32 1czk s THR 56 Cb -0.10 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 1czk s THR 56 CO 0.30 0.47 -0.03 0.26 -0.69 0.00 0.00 174.62 174.93 1czk s TRP 57 N -0.26 1.47 -1.56 4.92 0.52 -0.61 -4.89 118.94 118.53 1czk s TRP 57 Ca 0.22 -0.89 -0.10 0.00 0.02 0.00 0.00 56.10 55.36 1czk s TRP 57 Cb -0.15 -0.83 0.08 0.00 -1.15 0.00 0.00 33.47 31.42 1czk s TRP 57 CO 0.10 -0.02 0.62 0.09 0.02 0.00 0.00 176.95 177.76 1czk n ASN 58 N -0.35 -2.01 -2.93 2.95 4.13 -1.26 -0.58 115.26 115.21 1czk n ASN 58 Ca -0.06 -1.00 -0.06 0.00 1.68 0.00 0.00 54.58 55.14 1czk n ASN 58 Cb 0.63 -2.92 0.01 0.00 -1.54 0.00 0.00 39.78 35.95 1czk n ASN 58 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1czk n VAL 59 N -4.42-10.73 -0.75 2.41 0.31 -1.26 -4.29 118.33 99.59 1czk n VAL 59 Ca -0.10 0.51 0.00 0.00 -0.01 0.00 0.00 64.34 64.73 1czk n VAL 59 Cb 0.58 -7.15 0.00 0.00 -0.91 0.00 0.00 33.84 26.37 1czk n VAL 59 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1czk n GLY 60 N -0.80 0.59 3.85 2.92 0.00 -1.22 -5.06 105.19 105.48 1czk n GLY 60 Ca 0.08 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 1czk n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1czk s GLU 61 N -0.65 2.70 0.42 1.61 2.02 0.26 -4.63 118.70 120.43 1czk s GLU 61 Ca 0.00 -1.31 -0.23 0.00 0.02 0.00 0.00 54.97 53.45 1czk s GLU 61 Cb 0.00 -2.46 -0.09 0.00 0.10 0.00 0.00 34.13 31.68 1czk s GLU 61 CO 0.00 0.08 1.03 -0.51 0.02 0.00 0.00 175.26 175.88 1czk s LEU 62 N -3.99 4.06 0.43 1.80 1.43 -1.26 -1.57 118.68 119.57 1czk s LEU 62 Ca 0.41 1.96 -0.26 0.00 -1.03 0.00 0.00 54.13 55.21 1czk s LEU 62 Cb -0.06 -4.30 -0.09 0.00 0.03 0.00 0.00 46.19 41.77 1czk s LEU 62 CO 0.26 -0.51 1.44 1.67 0.23 0.00 0.00 176.35 179.44 1czk n GLN 63 N -0.30 2.35 -0.19 1.70 0.00 -1.22 -4.63 117.38 115.10 1czk n GLN 63 Ca 0.06 0.83 0.18 0.00 -0.00 0.00 0.00 57.00 58.07 1czk n GLN 63 Cb 0.51 -2.62 0.53 0.00 0.00 0.00 0.00 30.24 28.66 1czk n GLN 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1czk h SER 64 N 2.48 0.35 -0.02 1.69 4.64 -1.94 -1.54 113.55 119.20 1czk h SER 64 Ca -0.50 0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 60.73 1czk h SER 64 Cb 1.26 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 1czk h SER 64 CO 0.62 0.16 -0.34 0.44 -0.87 0.00 0.00 176.83 176.84 1czk h ASP 65 N 0.36 0.52 -0.03 4.97 3.45 -1.93 -1.64 116.42 122.11 1czk h ASP 65 Ca 0.41 -0.20 -0.17 0.00 0.43 0.00 0.00 57.03 57.49 1czk h ASP 65 Cb 1.05 -0.14 -0.00 0.00 -0.56 0.00 0.00 39.33 39.67 1czk h ASP 65 CO -0.13 0.82 -0.59 -0.50 -1.57 0.00 0.00 179.24 177.27 1czk h TRP 66 N 0.43 0.81 -0.84 4.55 4.06 -1.67 -2.89 115.95 120.39 1czk h TRP 66 Ca 0.05 -0.30 0.06 0.00 2.06 0.00 0.00 58.89 60.76 1czk h TRP 66 Cb 0.79 -0.15 -0.06 0.00 -1.00 0.00 0.00 29.16 28.75 1czk h TRP 66 CO 0.03 1.07 0.51 1.49 -3.56 0.00 0.00 178.44 177.98 1czk h GLU 67 N 0.48 0.91 -0.88 0.49 4.57 -1.11 -1.30 114.58 117.74 1czk h GLU 67 Ca 0.00 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1czk h GLU 67 Cb 1.16 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 29.50 1czk h GLU 67 CO 0.11 0.60 0.48 0.78 -1.18 0.00 0.00 179.01 179.80 1czk h GLY 68 N 0.94 1.31 0.60 1.92 0.00 -1.09 -3.03 103.07 103.72 1czk h GLY 68 Ca 0.37 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1czk h GLY 68 CO -0.17 0.57 -0.61 4.51 0.00 0.00 0.00 176.54 180.83 1czk n ILE 69 N -4.33 0.00 -0.24 2.60 3.06 -1.04 -4.53 119.36 114.88 1czk n ILE 69 Ca 0.09 -0.02 0.04 0.00 -2.50 0.00 0.00 62.75 60.36 1czk n ILE 69 Cb 0.10 0.50 0.14 0.00 0.54 0.00 0.00 39.64 40.92 1czk n ILE 69 CO 0.00 0.00 0.00 0.22 -2.50 0.00 0.00 176.55 174.27 1czk h TYR 70 N 0.18 -0.03 0.00 9.51 3.20 -1.11 -0.12 116.97 128.60 1czk h TYR 70 Ca 0.00 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 1czk h TYR 70 Cb 0.51 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 1czk h TYR 70 CO 0.00 -0.20 -0.10 -0.44 -1.64 0.00 0.00 178.16 175.78 1czk h ASP 71 N 0.12 0.00 1.90 -2.11 3.32 -1.79 -2.67 116.42 115.18 1czk h ASP 71 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 1czk h ASP 71 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1czk h ASP 71 CO -0.61 0.10 0.00 0.44 -1.72 0.00 0.00 179.24 177.45 1czk h ASP 72 N 0.00 0.00 -0.18 6.45 3.32 -1.32 -3.31 116.42 121.39 1czk h ASP 72 Ca -0.00 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.10 1czk h ASP 72 Cb 0.55 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1czk h ASP 72 CO 0.01 0.00 0.24 -0.07 -1.72 0.00 0.00 179.24 177.70 1czk h LEU 73 N 0.00 0.00 -2.27 1.55 3.38 -1.25 -1.69 115.31 115.04 1czk h LEU 73 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1czk h LEU 73 Cb 0.95 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1czk h LEU 73 CO 0.00 0.00 -0.05 0.44 0.09 0.00 0.00 178.44 178.92 1czk h ASP 74 N 0.00 0.00 0.89 -0.43 3.32 -1.78 -2.24 116.42 116.19 1czk h ASP 74 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1czk h ASP 74 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1czk h ASP 74 CO -0.00 0.05 -0.05 -1.54 -1.72 0.00 0.00 179.24 175.98 1czk n SER 75 N -3.47 0.06 -4.82 6.45 3.41 -0.63 -4.80 113.62 109.82 1czk n SER 75 Ca -0.02 0.33 -0.37 0.00 -0.26 0.00 0.00 58.87 58.55 1czk n SER 75 Cb 0.17 -0.40 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1czk n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1czk s VAL 76 N -2.94 5.26 -0.46 -3.33 1.01 -0.84 -5.01 120.40 114.08 1czk s VAL 76 Ca 0.16 0.56 -0.17 0.00 0.00 0.00 0.00 61.98 62.52 1czk s VAL 76 Cb 0.19 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 33.02 1czk s VAL 76 CO 0.54 0.53 0.48 0.21 0.00 0.00 0.00 175.10 176.86 1czk s ASN 77 N -0.59 6.19 0.00 3.32 2.47 -1.26 -4.92 114.94 120.15 1czk s ASN 77 Ca 0.19 -0.89 0.23 0.00 0.42 0.00 0.00 52.86 52.81 1czk s ASN 77 Cb -0.14 -2.23 0.71 0.00 -1.45 0.00 0.00 41.25 38.14 1czk s ASN 77 CO 0.08 -0.68 1.54 0.49 -3.72 0.00 0.00 177.10 174.80 1czk n PHE 78 N 5.68 0.20 -1.74 0.43 3.01 -1.20 -4.93 117.46 118.90 1czk n PHE 78 Ca -0.08 -0.10 -0.42 0.00 1.01 0.00 0.00 57.45 57.86 1czk n PHE 78 Cb 0.46 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.90 1czk n PHE 78 CO 0.00 0.00 0.00 -1.14 1.01 0.00 0.00 176.76 176.63 1czk s GLN 79 N -1.80 4.14 0.00 -1.08 2.00 -1.23 -1.67 119.66 120.02 1czk s GLN 79 Ca 0.34 2.58 0.00 0.00 -2.00 0.00 0.00 55.36 56.28 1czk s GLN 79 Cb 0.19 -3.46 0.00 0.00 0.80 0.00 0.00 33.01 30.54 1czk s GLN 79 CO 0.29 -0.81 0.00 0.41 -0.50 0.00 0.00 175.29 174.68 1czk n GLY 80 N 4.15 1.50 3.84 2.59 0.00 -1.22 -4.97 105.19 111.08 1czk n GLY 80 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1czk n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1czk s LYS 81 N -0.74 4.07 -0.20 1.61 1.02 -0.67 -4.94 119.74 119.89 1czk s LYS 81 Ca 0.00 0.64 -0.08 0.00 0.02 0.00 0.00 55.97 56.54 1czk s LYS 81 Cb 0.00 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.44 1czk s LYS 81 CO 0.00 0.40 0.09 0.15 -0.92 0.00 0.00 175.35 175.06 1czk s LYS 82 N -2.15 3.97 -0.07 1.68 1.02 -0.91 -1.16 119.74 122.13 1czk s LYS 82 Ca 0.42 -0.34 0.03 0.00 0.02 0.00 0.00 55.97 56.11 1czk s LYS 82 Cb -0.15 -3.30 0.01 0.00 -0.52 0.00 0.00 37.83 33.87 1czk s LYS 82 CO 0.20 0.18 -0.16 0.08 -0.92 0.00 0.00 175.35 174.73 1czk s VAL 83 N 0.65 1.43 0.16 3.17 1.01 0.10 -1.23 120.40 125.70 1czk s VAL 83 Ca 0.05 -0.66 0.09 0.00 0.00 0.00 0.00 61.98 61.45 1czk s VAL 83 Cb -0.13 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1czk s VAL 83 CO 0.01 0.42 -0.10 0.00 0.00 0.00 0.00 175.10 175.43 1czk s ALA 84 N 0.51 2.94 0.07 5.51 0.00 0.34 -1.66 121.76 129.47 1czk s ALA 84 Ca -0.15 -1.43 0.06 0.00 0.00 0.00 0.00 51.96 50.44 1czk s ALA 84 Cb -0.16 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 1czk s ALA 84 CO 0.05 0.50 -0.16 0.71 0.00 0.00 0.00 175.76 176.86 1czk s TYR 85 N -1.59 1.36 0.04 0.00 1.51 -1.26 -0.47 117.35 116.94 1czk s TYR 85 Ca 0.24 -0.43 -0.07 0.00 -1.01 0.00 0.00 57.07 55.80 1czk s TYR 85 Cb -0.09 -0.77 -0.01 0.00 -0.11 0.00 0.00 41.96 40.98 1czk s TYR 85 CO 0.15 0.09 0.12 -0.59 -1.11 0.00 0.00 175.55 174.21 1czk s PHE 86 N -1.18 0.15 0.07 2.71 -0.71 -0.42 -0.92 117.98 117.70 1czk s PHE 86 Ca 0.01 -0.42 -0.17 0.00 -1.04 0.00 0.00 56.93 55.31 1czk s PHE 86 Cb -0.10 -0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.64 1czk s PHE 86 CO 0.03 -0.37 0.39 0.20 -1.34 0.00 0.00 175.22 174.12 1czk s GLY 87 N -2.06 -0.25 0.02 1.99 0.00 -0.32 -1.84 107.32 104.87 1czk s GLY 87 Ca -0.06 0.12 0.05 0.00 0.00 0.00 0.00 44.72 44.83 1czk s GLY 87 CO -0.04 -0.13 -0.11 0.00 0.00 0.00 0.00 173.10 172.82 1czk s ALA 88 N -3.00 2.84 0.23 3.20 0.00 -1.24 -0.95 121.76 122.84 1czk s ALA 88 Ca -0.02 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 50.72 1czk s ALA 88 Cb 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 23.12 22.21 1czk s ALA 88 CO -0.06 0.60 0.69 0.41 0.00 0.00 0.00 175.76 177.39 1czk n GLY 89 N 1.57 1.02 2.73 0.00 0.00 -0.77 -2.36 105.19 107.38 1czk n GLY 89 Ca -0.16 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 1czk n GLY 89 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1czk s ASP 90 N -2.70 3.61 0.42 1.61 2.15 -1.26 -4.29 116.67 116.20 1czk s ASP 90 Ca 0.14 -1.31 0.22 0.00 0.43 0.00 0.00 52.55 52.04 1czk s ASP 90 Cb -0.03 -0.76 0.85 0.00 -0.30 0.00 0.00 42.92 42.68 1czk s ASP 90 CO 0.07 -0.37 1.80 0.06 -0.17 0.00 0.00 175.17 176.56 1czk h GLN 91 N 8.16 0.00 0.00 4.34 3.07 -1.89 -1.88 115.11 126.91 1czk h GLN 91 Ca -0.15 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.56 1czk h GLN 91 Cb 1.05 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.61 1czk h GLN 91 CO 0.42 0.28 -0.15 0.28 0.09 0.00 0.00 178.83 179.75 1czk h VAL 92 N 0.00 1.31 0.00 1.86 2.07 -1.95 -3.08 116.25 116.46 1czk h VAL 92 Ca -0.00 -2.04 -0.11 0.00 0.82 0.00 0.00 66.70 65.37 1czk h VAL 92 Cb 0.78 2.53 -0.02 0.00 -1.52 0.00 0.00 31.29 33.07 1czk h VAL 92 CO 0.04 0.45 -0.52 1.23 0.02 0.00 0.00 177.57 178.78 1czk h GLY 93 N -1.00 0.00 -5.48 2.17 0.00 -2.00 -3.34 103.07 93.43 1czk h GLY 93 Ca -0.04 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.78 1czk h GLY 93 CO -0.02 0.00 -0.97 -1.72 0.00 0.00 0.00 176.54 173.83 1czk n TYR 94 N -3.87 1.92 0.19 5.60 4.01 -0.71 -4.93 117.16 119.38 1czk n TYR 94 Ca -0.01 -3.67 0.16 0.00 -0.16 0.00 0.00 57.90 54.22 1czk n TYR 94 Cb 0.54 -0.40 0.80 0.00 -0.31 0.00 0.00 39.34 39.96 1czk n TYR 94 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1czk h SER 95 N 2.95 0.00 -0.23 7.72 0.87 -1.66 -0.74 113.55 122.45 1czk h SER 95 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1czk h SER 95 Cb 0.84 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1czk h SER 95 CO 0.64 0.00 0.00 -0.90 -0.53 0.00 0.00 176.83 176.04 1czk n ASP 96 N -3.96 3.26 -1.40 6.23 5.75 -1.26 -0.21 116.55 124.96 1czk n ASP 96 Ca 0.02 -1.99 0.03 0.00 -0.01 0.00 0.00 54.79 52.84 1czk n ASP 96 Cb 0.31 -0.14 0.01 0.00 -1.03 0.00 0.00 41.12 40.28 1czk n ASP 96 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1czk n ASN 97 N 1.43 0.84 -4.65 -1.12 4.13 -0.39 -4.48 115.26 111.01 1czk n ASN 97 Ca 0.17 -2.00 -0.42 0.00 1.68 0.00 0.00 54.58 54.01 1czk n ASN 97 Cb 0.60 -0.27 -0.03 0.00 -1.54 0.00 0.00 39.78 38.55 1czk n ASN 97 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1czk s PHE 98 N 0.00 1.76 -1.86 3.10 5.99 -0.56 -2.89 117.98 123.52 1czk s PHE 98 Ca 0.30 0.07 0.00 0.00 0.00 0.00 0.00 56.93 57.30 1czk s PHE 98 Cb 0.34 -4.01 0.00 0.00 0.00 0.00 0.00 43.02 39.35 1czk s PHE 98 CO -0.15 -4.24 0.00 1.04 -0.00 0.00 0.00 175.22 171.87 1czk n GLN 99 N 7.37 -1.31 -0.11 10.12 1.13 -1.26 -4.43 117.38 128.89 1czk n GLN 99 Ca 0.19 1.09 0.13 0.00 -1.94 0.00 0.00 57.00 56.47 1czk n GLN 99 Cb 0.43 -5.41 0.50 0.00 0.11 0.00 0.00 30.24 25.86 1czk n GLN 99 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 1czk h ASN 100 N 0.00 0.38 -0.62 1.08 -0.26 -1.87 -2.44 115.58 111.85 1czk h ASN 100 Ca -0.39 0.01 0.01 0.00 -0.56 0.00 0.00 56.30 55.38 1czk h ASN 100 Cb 1.22 -0.07 -0.03 0.00 -1.06 0.00 0.00 38.32 38.38 1czk h ASN 100 CO 0.54 0.22 0.40 0.00 -1.06 0.00 0.00 177.43 177.53 1czk h ALA 101 N 1.68 0.79 -0.85 -0.83 0.00 -1.82 -0.71 119.26 117.51 1czk h ALA 101 Ca 0.31 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1czk h ALA 101 Cb 0.63 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1czk h ALA 101 CO -0.09 0.18 0.52 1.98 0.00 0.00 0.00 179.25 181.84 1czk h MET 102 N 0.80 0.90 -0.26 0.00 1.85 -1.65 -1.56 114.93 115.02 1czk h MET 102 Ca 0.23 -0.05 -0.15 0.00 -0.61 0.00 0.00 59.70 59.12 1czk h MET 102 Cb -0.05 -0.20 -0.01 0.00 0.43 0.00 0.00 31.60 31.77 1czk h MET 102 CO -0.07 0.60 -0.46 0.78 -0.40 0.00 0.00 176.91 177.36 1czk h GLY 103 N 0.93 0.74 0.94 1.39 0.00 -1.38 -1.17 103.07 104.51 1czk h GLY 103 Ca 0.38 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1czk h GLY 103 CO -0.19 0.71 0.14 -2.22 0.00 0.00 0.00 176.54 174.98 1czk h ILE 104 N 0.54 1.15 -0.56 2.60 2.04 -0.60 -1.17 117.51 121.51 1czk h ILE 104 Ca 0.03 -0.44 -0.10 0.00 1.00 0.00 0.00 64.86 65.35 1czk h ILE 104 Cb 1.01 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 1czk h ILE 104 CO 0.09 0.16 -0.04 -0.07 0.00 0.00 0.00 178.15 178.29 1czk h LEU 105 N 0.35 1.00 -0.50 1.44 3.38 -1.24 -2.49 115.31 117.24 1czk h LEU 105 Ca 0.10 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 1czk h LEU 105 Cb 0.12 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1czk h LEU 105 CO -0.01 1.07 -0.00 -0.08 0.09 0.00 0.00 178.44 179.51 1czk h GLU 106 N 0.92 0.88 -0.87 1.13 4.22 -1.03 -0.45 114.58 119.38 1czk h GLU 106 Ca 0.16 -0.28 -0.02 0.00 0.08 0.00 0.00 59.36 59.30 1czk h GLU 106 Cb 0.59 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 1czk h GLU 106 CO 0.04 0.92 0.47 1.49 -2.18 0.00 0.00 179.01 179.74 1czk h GLU 107 N 0.75 1.22 0.04 1.92 4.81 -1.14 -0.64 114.58 121.54 1czk h GLU 107 Ca 0.14 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1czk h GLU 107 Cb 0.52 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1czk h GLU 107 CO 0.03 0.90 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.96 1czk h LYS 108 N 1.22 -0.05 -0.33 1.92 1.63 -1.20 -2.74 116.57 117.02 1czk h LYS 108 Ca 0.31 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 60.01 1czk h LYS 108 Cb 0.04 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 1czk h LYS 108 CO -0.05 0.41 -0.23 0.82 -3.45 0.00 0.00 179.45 176.95 1czk h ILE 109 N -0.54 1.27 0.00 2.00 2.04 -1.00 -2.74 117.51 118.53 1czk h ILE 109 Ca -0.01 -1.29 -0.10 0.00 1.00 0.00 0.00 64.86 64.46 1czk h ILE 109 Cb 0.49 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 1czk h ILE 109 CO 0.01 0.42 -0.49 0.77 0.00 0.00 0.00 178.15 178.86 1czk h SER 110 N 0.56 0.00 0.73 1.72 4.64 -1.20 -1.95 113.55 118.06 1czk h SER 110 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1czk h SER 110 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1czk h SER 110 CO 0.05 0.49 0.00 0.77 -0.87 0.00 0.00 176.83 177.27 1czk h SER 111 N 0.00 0.00 -0.51 4.97 4.64 -1.18 -1.41 113.55 120.06 1czk h SER 111 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1czk h SER 111 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1czk h SER 111 CO 0.06 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.20 1czk n LEU 112 N -2.47 3.55 0.00 5.97 4.77 -0.73 -4.92 117.00 123.16 1czk n LEU 112 Ca 0.01 -1.79 0.00 0.00 -0.03 0.00 0.00 56.01 54.20 1czk n LEU 112 Cb 0.23 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1czk n LEU 112 CO 0.21 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1czk n GLY 113 N 1.04 0.94 3.94 -0.72 0.00 -0.53 -3.27 105.19 106.59 1czk n GLY 113 Ca 0.19 -0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 1czk n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1czk s SER 114 N -2.00 4.51 -0.14 1.61 1.04 -1.21 -3.42 113.70 114.09 1czk s SER 114 Ca 0.00 0.24 -0.00 0.00 0.48 0.00 0.00 55.95 56.67 1czk s SER 114 Cb 0.00 -0.77 -0.01 0.00 0.10 0.00 0.00 66.02 65.34 1czk s SER 114 CO 0.00 -1.78 -0.13 -1.10 0.98 0.00 0.00 173.24 171.21 1czk s GLN 115 N -5.29 3.34 -0.17 4.02 -0.21 -0.30 -4.75 119.66 116.29 1czk s GLN 115 Ca 0.63 -0.70 -0.21 0.00 0.02 0.00 0.00 55.36 55.10 1czk s GLN 115 Cb -0.09 -2.65 -0.03 0.00 1.00 0.00 0.00 33.01 31.25 1czk s GLN 115 CO 0.45 0.14 0.64 0.99 -2.12 0.00 0.00 175.29 175.39 1czk s THR 116 N 0.54 5.03 0.13 -0.19 2.01 -1.26 -0.72 115.64 121.17 1czk s THR 116 Ca -0.09 1.23 0.08 0.00 0.31 0.00 0.00 61.69 63.22 1czk s THR 116 Cb -0.16 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1czk s THR 116 CO 0.04 0.14 -0.18 0.68 -0.69 0.00 0.00 174.62 174.60 1czk s VAL 117 N 1.71 1.65 0.00 3.82 -7.23 -0.66 -4.89 120.40 114.79 1czk s VAL 117 Ca 0.30 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 1czk s VAL 117 Cb -0.16 -1.64 0.00 0.00 0.56 0.00 0.00 36.38 35.14 1czk s VAL 117 CO 0.11 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.28 1czk n GLY 118 N 0.68 1.38 3.53 2.32 0.00 -1.26 -4.12 105.19 107.70 1czk n GLY 118 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1czk n GLY 118 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1czk n TYR 119 N -1.21 0.08 -4.14 1.61 4.02 -1.26 -4.12 117.16 112.14 1czk n TYR 119 Ca 0.00 0.50 -0.15 0.00 -0.01 0.00 0.00 57.90 58.24 1czk n TYR 119 Cb 0.00 -2.06 -0.13 0.00 -0.02 0.00 0.00 39.34 37.13 1czk n TYR 119 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1czk s TRP 120 N -1.52 0.60 0.40 -0.72 -0.11 -0.48 -4.90 118.94 112.22 1czk s TRP 120 Ca 0.67 -0.27 -0.25 0.00 1.22 0.00 0.00 56.10 57.47 1czk s TRP 120 Cb -0.50 -0.37 -0.08 0.00 -1.50 0.00 0.00 33.47 31.01 1czk s TRP 120 CO 0.54 -0.04 1.20 -2.14 -4.62 0.00 0.00 176.95 171.90 1czk s PRO 121 N -0.75 4.03 0.05 5.86 0.02 -1.26 -0.27 135.00 142.67 1czk s PRO 121 Ca -0.03 1.92 0.24 0.00 0.02 0.00 0.00 61.00 63.16 1czk s PRO 121 Cb -0.05 -2.70 0.35 0.00 0.02 0.00 0.00 34.50 32.12 1czk s PRO 121 CO 0.00 -0.37 1.30 0.44 -0.33 0.00 0.00 177.00 178.04 1czk n ILE 122 N 0.09 0.15 0.31 2.83 -5.35 -1.26 -4.38 119.36 111.74 1czk n ILE 122 Ca 0.04 -0.14 0.17 0.00 -0.27 0.00 0.00 62.75 62.56 1czk n ILE 122 Cb 0.46 0.13 0.99 0.00 -1.74 0.00 0.00 39.64 39.48 1czk n ILE 122 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1czk h GLU 123 N 0.00 0.00 -0.56 6.28 3.07 -1.92 -2.50 114.58 118.94 1czk h GLU 123 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1czk h GLU 123 Cb 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1czk h GLU 123 CO 0.00 0.02 0.00 0.41 -1.40 0.00 0.00 179.01 178.04 1czk n GLY 124 N -1.10 1.05 3.28 -3.84 0.00 -1.26 -4.86 105.19 98.46 1czk n GLY 124 Ca -0.03 -0.26 -0.15 0.00 0.00 0.00 0.00 46.02 45.58 1czk n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1czk s TYR 125 N -1.61 1.35 -0.25 1.61 2.02 -0.94 -5.13 117.35 114.39 1czk s TYR 125 Ca 0.16 -0.97 -0.02 0.00 -0.37 0.00 0.00 57.07 55.87 1czk s TYR 125 Cb 0.10 -0.77 0.08 0.00 -0.40 0.00 0.00 41.96 40.97 1czk s TYR 125 CO 0.07 -0.13 0.06 0.34 -1.57 0.00 0.00 175.55 174.32 1czk s ASP 126 N -3.22 3.43 0.16 2.29 2.15 -1.26 -5.06 116.67 115.16 1czk s ASP 126 Ca 0.25 -1.18 -0.13 0.00 0.43 0.00 0.00 52.55 51.93 1czk s ASP 126 Cb 0.06 -0.72 0.01 0.00 -0.30 0.00 0.00 42.92 41.97 1czk s ASP 126 CO 0.06 -0.35 0.38 0.72 -0.17 0.00 0.00 175.17 175.80 1czk s PHE 127 N 1.75 0.09 -0.23 -5.34 -0.12 -1.26 -4.65 117.98 108.22 1czk s PHE 127 Ca 0.03 -0.44 -0.07 0.00 -0.05 0.00 0.00 56.93 56.39 1czk s PHE 127 Cb -0.17 0.15 -0.18 0.00 -0.63 0.00 0.00 43.02 42.19 1czk s PHE 127 CO -0.16 -0.76 -0.07 0.09 -0.05 0.00 0.00 175.22 174.26 1czk n ASN 128 N -0.24 1.99 -3.86 1.98 3.02 0.71 -5.02 115.26 113.84 1czk n ASN 128 Ca -0.11 0.14 -0.11 0.00 -0.03 0.00 0.00 54.58 54.47 1czk n ASN 128 Cb 0.63 -0.69 -0.11 0.00 -0.61 0.00 0.00 39.78 38.99 1czk n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1czk s GLU 129 N -2.50 0.32 -0.20 3.52 0.41 -0.81 -4.98 118.70 114.45 1czk s GLU 129 Ca -0.32 -0.15 -0.10 0.00 -0.41 0.00 0.00 54.97 53.98 1czk s GLU 129 Cb 0.10 0.14 0.07 0.00 -1.78 0.00 0.00 34.13 32.65 1czk s GLU 129 CO 0.61 -0.06 0.48 0.45 -0.49 0.00 0.00 175.26 176.25 1czk s SER 130 N -0.73 -0.60 0.00 -0.19 0.15 -1.26 -2.90 113.70 108.16 1czk s SER 130 Ca -0.08 1.07 0.23 0.00 0.70 0.00 0.00 55.95 57.87 1czk s SER 130 Cb -0.05 1.03 1.22 0.00 -1.71 0.00 0.00 66.02 66.52 1czk s SER 130 CO 0.01 -0.21 1.75 0.29 1.20 0.00 0.00 173.24 176.28 1czk n LYS 131 N 4.46 0.44 -0.23 5.44 5.02 -1.26 -2.90 118.16 129.12 1czk n LYS 131 Ca -0.20 0.05 0.09 0.00 -2.02 0.00 0.00 58.31 56.23 1czk n LYS 131 Cb 0.55 -1.50 0.25 0.00 -0.02 0.00 0.00 35.03 34.31 1czk n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1czk n ALA 132 N -1.20 2.43 -2.86 7.82 0.00 -1.26 -4.46 120.51 120.98 1czk n ALA 132 Ca 0.13 -0.89 -0.34 0.00 0.00 0.00 0.00 53.44 52.34 1czk n ALA 132 Cb 0.15 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.53 1czk n ALA 132 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1czk s VAL 133 N -1.38 4.47 -0.05 0.00 1.01 -1.14 -0.98 120.40 122.32 1czk s VAL 133 Ca 0.36 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.18 1czk s VAL 133 Cb 0.19 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.61 1czk s VAL 133 CO 0.25 0.48 -0.01 -0.60 0.00 0.00 0.00 175.10 175.23 1czk s ARG 134 N 0.26 0.59 -1.40 2.72 3.52 -0.19 -4.88 118.95 119.57 1czk s ARG 134 Ca 0.01 0.04 -0.01 0.00 -0.13 0.00 0.00 55.73 55.64 1czk s ARG 134 Cb -0.13 -0.80 0.00 0.00 -1.56 0.00 0.00 34.95 32.46 1czk s ARG 134 CO 0.01 -0.19 0.40 -1.71 -0.81 0.00 0.00 175.30 173.00 1czk n ASN 135 N 4.56 -0.46 -1.43 -2.12 5.15 -1.26 -2.14 115.26 117.57 1czk n ASN 135 Ca -0.17 -1.03 -0.15 0.00 -0.60 0.00 0.00 54.58 52.62 1czk n ASN 135 Cb 0.50 -2.94 -0.04 0.00 -0.53 0.00 0.00 39.78 36.77 1czk n ASN 135 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1czk n ASN 136 N -2.96 -4.78 -3.97 1.20 3.02 -1.26 -5.00 115.26 101.52 1czk n ASN 136 Ca -0.30 0.22 -0.09 0.00 -0.03 0.00 0.00 54.58 54.37 1czk n ASN 136 Cb 0.68 -3.75 -0.11 0.00 -0.61 0.00 0.00 39.78 35.99 1czk n ASN 136 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1czk s GLN 137 N -3.92 0.36 0.41 3.52 -0.21 -0.91 -4.30 119.66 114.62 1czk s GLN 137 Ca 0.00 -0.62 -0.22 0.00 0.02 0.00 0.00 55.36 54.54 1czk s GLN 137 Cb 0.00 0.13 -0.10 0.00 1.00 0.00 0.00 33.01 34.04 1czk s GLN 137 CO 0.00 -0.07 0.96 -0.06 -2.12 0.00 0.00 175.29 174.01 1czk s PHE 138 N -1.63 3.35 -1.88 0.91 0.08 0.62 -1.03 117.98 118.41 1czk s PHE 138 Ca -0.14 1.64 0.28 0.00 0.12 0.00 0.00 56.93 58.83 1czk s PHE 138 Cb -0.08 -2.91 1.61 0.00 -0.57 0.00 0.00 43.02 41.07 1czk s PHE 138 CO -0.01 -0.16 2.00 1.33 -0.10 0.00 0.00 175.22 178.28 1czk n VAL 139 N -0.39 0.03 -3.89 -0.44 0.24 -0.15 -1.38 118.33 112.35 1czk n VAL 139 Ca 0.06 0.01 -0.01 0.00 -2.04 0.00 0.00 64.34 62.36 1czk n VAL 139 Cb 0.53 -0.57 0.02 0.00 -1.47 0.00 0.00 33.84 32.35 1czk n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1czk n GLY 140 N 0.81 0.56 3.68 7.63 0.00 -1.26 -4.38 105.19 112.23 1czk n GLY 140 Ca 0.19 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 1czk n GLY 140 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1czk s LEU 141 N 0.00 4.29 -0.31 0.99 2.96 -0.09 -4.40 118.68 122.12 1czk s LEU 141 Ca 0.22 2.06 -0.12 0.00 -0.22 0.00 0.00 54.13 56.07 1czk s LEU 141 Cb -0.02 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.08 1czk s LEU 141 CO 0.03 -0.76 0.22 0.00 -1.32 0.00 0.00 176.35 174.52 1czk s ALA 142 N 2.87 3.52 -0.07 5.97 0.00 -1.26 -1.17 121.76 131.61 1czk s ALA 142 Ca 0.64 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1czk s ALA 142 Cb -0.30 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.21 1czk s ALA 142 CO 0.25 -0.75 -0.06 0.42 0.00 0.00 0.00 175.76 175.62 1czk s ILE 143 N 1.75 3.79 -0.33 0.00 -1.09 -0.13 -4.99 121.20 120.20 1czk s ILE 143 Ca 0.07 -0.45 -0.01 0.00 -2.23 0.00 0.00 60.65 58.03 1czk s ILE 143 Cb -0.17 -2.56 0.11 0.00 -1.58 0.00 0.00 42.46 38.27 1czk s ILE 143 CO 0.11 0.60 0.15 -0.62 -1.23 0.00 0.00 174.94 173.94 1czk s ASP 144 N -0.79 3.67 0.37 3.58 -1.08 -1.26 -1.84 116.67 119.32 1czk s ASP 144 Ca 0.12 -1.81 0.22 0.00 -0.52 0.00 0.00 52.55 50.55 1czk s ASP 144 Cb -0.11 -0.69 0.23 0.00 -1.46 0.00 0.00 42.92 40.89 1czk s ASP 144 CO 0.02 -0.38 1.48 -0.33 0.52 0.00 0.00 175.17 176.47 1czk h GLU 145 N 7.76 0.00 -0.07 4.34 4.39 -1.83 0.13 114.58 129.29 1czk h GLU 145 Ca -0.10 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.40 1czk h GLU 145 Cb 0.99 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.64 1czk h GLU 145 CO 0.43 0.08 -0.78 -0.44 -1.16 0.00 0.00 179.01 177.13 1czk h ASP 146 N 0.00 0.57 0.00 1.42 3.45 -1.94 -3.36 116.42 116.56 1czk h ASP 146 Ca -0.01 -0.39 -0.00 0.00 0.43 0.00 0.00 57.03 57.06 1czk h ASP 146 Cb 1.07 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 39.67 1czk h ASP 146 CO 0.01 1.15 -1.03 0.59 -1.57 0.00 0.00 179.24 178.39 1czk n ASN 147 N -3.83 4.87 -2.84 6.45 3.02 -1.24 -4.85 115.26 116.84 1czk n ASN 147 Ca -0.05 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.36 1czk n ASN 147 Cb 0.74 0.99 0.01 0.00 -0.61 0.00 0.00 39.78 40.91 1czk n ASN 147 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1czk n GLN 148 N -1.55 1.28 0.23 3.52 6.02 0.44 -4.92 117.38 122.40 1czk n GLN 148 Ca -0.00 -3.42 0.09 0.00 -0.01 0.00 0.00 57.00 53.66 1czk n GLN 148 Cb 0.05 -1.49 0.57 0.00 1.02 0.00 0.00 30.24 30.39 1czk n GLN 148 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1czk h PRO 149 N 2.98 0.00 0.00 -1.09 0.13 -1.68 -2.53 132.00 129.80 1czk h PRO 149 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1czk h PRO 149 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1czk h PRO 149 CO 0.53 0.20 0.00 0.38 -0.23 0.00 0.00 178.00 178.88 1czk h ASP 150 N 0.00 0.00 0.15 1.44 2.03 -1.91 -2.97 116.42 115.15 1czk h ASP 150 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1czk h ASP 150 Cb 0.47 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 1czk h ASP 150 CO 0.03 0.00 -1.26 0.18 -1.03 0.00 0.00 179.24 177.16 1czk n LEU 151 N -2.89 0.61 -0.12 0.15 4.77 -0.95 -4.58 117.00 113.99 1czk n LEU 151 Ca -0.00 -0.21 -0.05 0.00 -0.03 0.00 0.00 56.01 55.72 1czk n LEU 151 Cb 0.22 -0.04 0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1czk n LEU 151 CO 0.23 0.12 0.88 0.74 -1.33 0.00 0.00 177.39 178.03 1czk h THR 152 N 0.00 0.76 -0.14 -5.08 2.02 -1.57 -1.79 112.91 107.12 1czk h THR 152 Ca 0.00 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 67.15 1czk h THR 152 Cb 0.70 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1czk h THR 152 CO 0.00 0.03 -0.02 0.50 0.37 0.00 0.00 175.52 176.40 1czk h LYS 153 N 0.17 0.02 0.00 6.66 3.64 -1.81 -1.20 116.57 124.05 1czk h LYS 153 Ca 0.19 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.49 1czk h LYS 153 Cb 0.25 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1czk h LYS 153 CO -0.28 0.01 -0.39 -0.97 -2.27 0.00 0.00 179.45 175.56 1czk h ASN 154 N 0.02 0.00 -0.34 4.20 -1.24 -1.83 -1.92 115.58 114.47 1czk h ASN 154 Ca 0.07 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.02 1czk h ASN 154 Cb 0.09 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.13 1czk h ASN 154 CO -0.13 0.39 -0.01 0.03 -1.29 0.00 0.00 177.43 176.42 1czk h ARG 155 N 0.00 0.61 -0.25 6.67 3.08 -0.84 -1.43 114.38 122.23 1czk h ARG 155 Ca -0.00 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 59.81 1czk h ARG 155 Cb 0.93 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1czk h ARG 155 CO 0.05 0.74 0.03 0.82 -1.07 0.00 0.00 179.97 180.54 1czk h ILE 156 N 0.41 1.24 -0.42 2.04 2.04 -1.05 -0.69 117.51 121.07 1czk h ILE 156 Ca 0.10 -0.80 0.04 0.00 1.00 0.00 0.00 64.86 65.19 1czk h ILE 156 Cb 0.47 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 1czk h ILE 156 CO 0.02 0.25 0.20 0.11 0.00 0.00 0.00 178.15 178.73 1czk h LYS 157 N 0.21 0.39 -0.27 2.37 1.57 -1.30 0.52 116.57 120.05 1czk h LYS 157 Ca 0.07 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1czk h LYS 157 Cb 0.35 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1czk h LYS 157 CO 0.01 0.26 0.03 1.15 -0.57 0.00 0.00 179.45 180.33 1czk h THR 158 N 0.40 1.24 -0.11 -0.16 2.02 -1.17 -2.08 112.91 113.03 1czk h THR 158 Ca 0.19 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1czk h THR 158 Cb 0.11 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1czk h THR 158 CO -0.15 0.26 0.06 -0.25 0.37 0.00 0.00 175.52 175.82 1czk h TRP 159 N 0.27 0.16 -0.73 3.16 7.01 -0.84 -2.10 115.95 122.87 1czk h TRP 159 Ca 0.08 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 1czk h TRP 159 Cb 0.36 -0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.33 1czk h TRP 159 CO 0.03 0.19 0.45 0.28 -2.79 0.00 0.00 178.44 176.60 1czk h VAL 160 N 0.08 1.20 -0.76 2.65 2.07 -0.89 0.30 116.25 120.90 1czk h VAL 160 Ca 0.04 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1czk h VAL 160 Cb 0.09 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 29.98 1czk h VAL 160 CO -0.01 0.21 0.44 -1.28 0.02 0.00 0.00 177.57 176.95 1czk h SER 161 N 1.01 0.92 -0.13 0.57 0.87 -1.13 -0.73 113.55 114.92 1czk h SER 161 Ca 0.27 -0.08 -0.15 0.00 -1.23 0.00 0.00 61.79 60.59 1czk h SER 161 Cb -0.06 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.66 1czk h SER 161 CO -0.05 0.73 -0.46 1.56 -0.53 0.00 0.00 176.83 178.08 1czk h GLN 162 N 1.04 0.69 -0.44 2.24 4.20 -0.60 -3.14 115.11 119.10 1czk h GLN 162 Ca 0.27 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.48 1czk h GLN 162 Cb -0.01 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1czk h GLN 162 CO -0.05 1.01 -0.15 -0.07 -0.67 0.00 0.00 178.83 178.90 1czk h LEU 163 N 0.55 0.82 -0.76 1.46 3.38 -0.56 -3.02 115.31 117.18 1czk h LEU 163 Ca 0.03 -0.27 0.16 0.00 0.09 0.00 0.00 57.88 57.90 1czk h LEU 163 Cb 1.01 -0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.43 1czk h LEU 163 CO 0.10 0.97 0.25 0.11 0.09 0.00 0.00 178.44 179.95 1czk h LYS 164 N 0.73 0.33 -0.72 1.13 1.57 -1.09 0.29 116.57 118.81 1czk h LYS 164 Ca 0.11 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1czk h LYS 164 Cb 0.66 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 1czk h LYS 164 CO 0.05 0.22 0.32 0.77 -0.57 0.00 0.00 179.45 180.24 1czk h SER 165 N 0.34 0.95 0.64 0.86 0.02 -1.61 0.60 113.55 115.35 1czk h SER 165 Ca 0.43 -0.12 -0.16 0.00 -0.84 0.00 0.00 61.79 61.10 1czk h SER 165 Cb 0.72 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1czk h SER 165 CO -0.48 0.82 -0.73 -0.33 -1.14 0.00 0.00 176.83 174.97 1czk h GLU 166 N 1.03 0.08 -0.06 3.45 4.39 -0.75 -3.22 114.58 119.51 1czk h GLU 166 Ca 0.25 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1czk h GLU 166 Cb 0.15 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1czk h GLU 166 CO -0.03 0.78 0.00 1.19 -1.16 0.00 0.00 179.01 179.79 1czk n PHE 167 N -3.71 0.05 -2.27 4.33 3.72 0.76 -4.95 117.46 115.40 1czk n PHE 167 Ca -0.02 -0.03 -0.04 0.00 -0.05 0.00 0.00 57.45 57.31 1czk n PHE 167 Cb 0.71 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.25 1czk n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1czk n GLY 168 N 1.22 0.32 0.69 1.37 0.00 -0.59 -5.05 105.19 103.15 1czk n GLY 168 Ca 0.18 -0.65 0.09 0.00 0.00 0.00 0.00 46.02 45.64 1czk n GLY 168 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36