#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zem s LYS 4 N 0.00 2.68 0.00 1.97 2.36 -1.26 -3.94 119.74 121.56 1zem s LYS 4 Ca 0.00 0.26 0.00 0.00 -2.55 0.00 0.00 55.97 53.68 1zem s LYS 4 Cb 0.00 -2.07 0.00 0.00 -1.05 0.00 0.00 37.83 34.71 1zem s LYS 4 CO 0.00 -1.07 0.00 1.19 1.55 0.00 0.00 175.35 177.02 1zem n PHE 5 N -2.96 0.00 -2.04 4.03 0.99 -1.26 -4.39 117.46 111.83 1zem n PHE 5 Ca 0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.10 1zem n PHE 5 Cb 0.58 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 39.03 1zem n PHE 5 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1zem s ASN 6 N -2.79 6.69 0.00 4.37 2.20 -1.24 -1.46 114.94 122.71 1zem s ASN 6 Ca 0.00 2.58 0.00 0.00 -0.94 0.00 0.00 52.86 54.50 1zem s ASN 6 Cb 0.00 -2.61 0.00 0.00 -2.00 0.00 0.00 41.25 36.64 1zem s ASN 6 CO 0.00 -0.70 0.00 0.61 -2.94 0.00 0.00 177.10 174.07 1zem n GLY 7 N 2.68 0.86 3.85 0.45 0.00 -1.24 -5.01 105.19 106.79 1zem n GLY 7 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1zem n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zem s LYS 8 N -0.24 3.96 -0.13 1.61 -0.14 -0.53 -4.95 119.74 119.32 1zem s LYS 8 Ca 0.00 0.58 0.03 0.00 -1.36 0.00 0.00 55.97 55.22 1zem s LYS 8 Cb 0.00 -2.50 0.01 0.00 -1.68 0.00 0.00 37.83 33.66 1zem s LYS 8 CO 0.00 0.20 -0.22 0.08 -0.76 0.00 0.00 175.35 174.65 1zem s VAL 9 N -1.93 2.03 -0.07 3.17 1.01 -1.26 -0.78 120.40 122.57 1zem s VAL 9 Ca 0.52 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.59 1zem s VAL 9 Cb -0.11 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 1zem s VAL 9 CO 0.18 0.54 -0.24 0.00 0.00 0.00 0.00 175.10 175.59 1zem s LEU 11 N 0.03 4.18 -0.18 0.00 2.96 0.82 -1.69 118.68 124.80 1zem s LEU 11 Ca -0.09 0.44 0.01 0.00 -0.22 0.00 0.00 54.13 54.27 1zem s LEU 11 Cb -0.15 -2.38 0.02 0.00 0.50 0.00 0.00 46.19 44.18 1zem s LEU 11 CO 0.05 0.02 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.22 1zem s VAL 12 N 0.92 2.13 0.13 1.68 1.01 -0.66 -0.52 120.40 125.10 1zem s VAL 12 Ca 0.16 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 1zem s VAL 12 Cb -0.14 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.29 1zem s VAL 12 CO 0.06 0.53 0.32 0.42 0.00 0.00 0.00 175.10 176.42 1zem s THR 13 N 1.30 5.26 -0.78 3.92 -4.23 -0.54 -0.96 115.64 119.61 1zem s THR 13 Ca 0.05 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.31 1zem s THR 13 Cb -0.13 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 70.05 1zem s THR 13 CO -0.12 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1zem n GLY 14 N -0.07 0.61 0.00 3.99 0.00 0.91 -2.64 105.19 107.99 1zem n GLY 14 Ca -0.04 -0.63 0.01 0.00 0.00 0.00 0.00 46.02 45.36 1zem n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zem n ALA 15 N 0.12 1.12 0.62 4.61 0.00 -0.73 -0.75 120.51 125.50 1zem n ALA 15 Ca -0.09 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1zem n ALA 15 Cb 0.39 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1zem n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zem n GLY 16 N -1.28 -1.17 3.95 0.00 0.00 -1.26 -3.54 105.19 101.89 1zem n GLY 16 Ca 0.01 -0.44 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1zem n GLY 16 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1zem s GLY 17 N -3.57 1.81 0.07 -0.02 0.00 0.07 -4.80 107.32 100.89 1zem s GLY 17 Ca 0.04 -1.40 -0.37 0.00 0.00 0.00 0.00 44.72 42.99 1zem s GLY 17 CO 0.81 -0.61 1.57 3.43 0.00 0.00 0.00 173.10 178.31 1zem h ASN 18 N -1.58 -1.26 -0.20 1.64 2.35 -1.93 -0.67 115.58 113.92 1zem h ASN 18 Ca -0.43 0.08 -0.13 0.00 -0.55 0.00 0.00 56.30 55.27 1zem h ASN 18 Cb 1.22 0.38 -0.01 0.00 0.05 0.00 0.00 38.32 39.96 1zem h ASN 18 CO 0.33 -0.74 -0.33 0.40 -1.65 0.00 0.00 177.43 175.44 1zem h ILE 19 N -1.17 1.28 -0.40 2.81 2.04 -1.93 -0.28 117.51 119.87 1zem h ILE 19 Ca -0.10 -1.48 -0.10 0.00 1.00 0.00 0.00 64.86 64.19 1zem h ILE 19 Cb 0.95 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1zem h ILE 19 CO 0.08 0.48 -0.14 1.23 0.00 0.00 0.00 178.15 179.79 1zem h GLY 20 N 0.97 0.87 0.65 5.37 0.00 -1.70 0.17 103.07 109.40 1zem h GLY 20 Ca 0.06 -0.75 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 1zem h GLY 20 CO 0.07 0.68 -0.06 -2.00 0.00 0.00 0.00 176.54 175.24 1zem h LEU 21 N 0.61 -0.13 -0.85 3.11 5.85 -1.05 -0.35 115.31 122.51 1zem h LEU 21 Ca 0.10 -0.28 0.13 0.00 0.84 0.00 0.00 57.88 58.66 1zem h LEU 21 Cb 0.68 0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.66 1zem h LEU 21 CO 0.05 0.22 0.46 0.00 -0.34 0.00 0.00 178.44 178.83 1zem h ALA 22 N 0.32 1.27 -0.35 1.25 0.00 -0.97 -0.81 119.26 119.97 1zem h ALA 22 Ca -0.02 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1zem h ALA 22 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1zem h ALA 22 CO 0.03 -0.03 -0.34 1.15 0.00 0.00 0.00 179.25 180.05 1zem h THR 23 N 0.68 1.28 -0.36 0.00 2.02 -0.49 -2.81 112.91 113.24 1zem h THR 23 Ca 0.45 -1.50 -0.08 0.00 0.77 0.00 0.00 66.41 66.04 1zem h THR 23 Cb 0.57 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1zem h THR 23 CO -0.33 0.49 -0.12 0.00 0.37 0.00 0.00 175.52 175.94 1zem h ALA 24 N 0.96 1.13 -0.29 6.16 0.00 0.18 -1.98 119.26 125.42 1zem h ALA 24 Ca 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1zem h ALA 24 Cb 0.89 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1zem h ALA 24 CO 0.08 0.55 0.12 -0.07 0.00 0.00 0.00 179.25 179.92 1zem h LEU 25 N 0.57 0.40 -0.49 0.00 3.38 -1.07 0.74 115.31 118.84 1zem h LEU 25 Ca 0.10 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1zem h LEU 25 Cb 0.54 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1zem h LEU 25 CO 0.03 0.45 0.32 -0.09 0.09 0.00 0.00 178.44 179.24 1zem h ARG 26 N 0.32 0.63 -0.28 1.13 9.65 -1.37 0.15 114.38 124.61 1zem h ARG 26 Ca 0.10 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.86 1zem h ARG 26 Cb 0.17 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.60 1zem h ARG 26 CO -0.01 0.42 -0.16 -0.07 2.80 0.00 0.00 179.97 182.95 1zem h LEU 27 N 0.65 0.48 -0.45 3.80 3.38 -1.13 -2.23 115.31 119.80 1zem h LEU 27 Ca 0.18 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1zem h LEU 27 Cb -0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1zem h LEU 27 CO -0.05 0.66 -0.02 0.00 0.09 0.00 0.00 178.44 179.13 1zem h ALA 28 N 1.39 0.61 0.00 1.53 0.00 0.00 0.50 119.26 123.30 1zem h ALA 28 Ca 0.08 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1zem h ALA 28 Cb 0.54 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1zem h ALA 28 CO 0.03 0.42 -0.00 0.93 0.00 0.00 0.00 179.25 180.63 1zem h GLU 29 N 0.66 0.00 -0.03 0.00 5.08 -0.17 0.46 114.58 120.58 1zem h GLU 29 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1zem h GLU 29 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1zem h GLU 29 CO 0.03 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.43 1zem n GLU 30 N -4.04 1.42 0.00 2.33 -0.58 -0.84 -4.90 120.64 114.02 1zem n GLU 30 Ca -0.03 -0.61 0.00 0.00 -0.42 0.00 0.00 57.16 56.10 1zem n GLU 30 Cb 0.09 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.50 1zem n GLU 30 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zem n GLY 31 N 1.08 0.89 3.73 0.62 0.00 0.16 -3.71 105.19 107.96 1zem n GLY 31 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1zem n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zem s THR 32 N -2.00 4.75 0.16 2.61 2.01 0.11 -3.62 115.64 119.66 1zem s THR 32 Ca 0.00 1.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.53 1zem s THR 32 Cb 0.00 -4.21 -0.07 0.00 0.01 0.00 0.00 72.50 68.23 1zem s THR 32 CO 0.00 0.28 1.09 0.00 -0.69 0.00 0.00 174.62 175.30 1zem s ALA 33 N 0.36 3.35 -0.09 7.40 0.00 0.04 -4.11 121.76 128.71 1zem s ALA 33 Ca 0.44 0.78 -0.02 0.00 0.00 0.00 0.00 51.96 53.16 1zem s ALA 33 Cb -0.21 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1zem s ALA 33 CO 0.25 -0.21 -0.01 0.42 0.00 0.00 0.00 175.76 176.21 1zem s ILE 34 N -0.08 4.17 -0.28 0.00 -1.09 -0.91 -1.31 121.20 121.71 1zem s ILE 34 Ca 0.50 -0.29 -0.01 0.00 -2.23 0.00 0.00 60.65 58.61 1zem s ILE 34 Cb -0.28 -2.76 0.04 0.00 -1.58 0.00 0.00 42.46 37.88 1zem s ILE 34 CO 0.34 0.59 -0.03 0.00 -1.23 0.00 0.00 174.94 174.60 1zem s ALA 35 N -0.68 2.75 -0.18 9.38 0.00 -0.68 -2.21 121.76 130.13 1zem s ALA 35 Ca 0.11 -1.64 -0.15 0.00 0.00 0.00 0.00 51.96 50.28 1zem s ALA 35 Cb -0.12 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 1zem s ALA 35 CO 0.02 -1.08 0.35 -0.51 0.00 0.00 0.00 175.76 174.55 1zem s LEU 36 N 1.27 4.19 -0.09 0.00 1.02 0.32 -1.65 118.68 123.75 1zem s LEU 36 Ca -0.03 0.51 0.04 0.00 0.02 0.00 0.00 54.13 54.67 1zem s LEU 36 Cb -0.18 -2.45 0.00 0.00 0.02 0.00 0.00 46.19 43.57 1zem s LEU 36 CO -0.03 0.00 -0.22 -0.22 0.02 0.00 0.00 176.35 175.91 1zem s LEU 37 N 0.94 2.00 0.18 1.79 0.20 -0.13 -0.11 118.68 123.56 1zem s LEU 37 Ca 0.18 -0.50 -0.24 0.00 0.69 0.00 0.00 54.13 54.27 1zem s LEU 37 Cb -0.14 -1.28 0.05 0.00 -0.43 0.00 0.00 46.19 44.39 1zem s LEU 37 CO 0.06 0.15 0.79 -0.62 -0.29 0.00 0.00 176.35 176.44 1zem s ASP 38 N 0.32 -0.31 0.14 3.68 2.15 -0.95 -0.06 116.67 121.64 1zem s ASP 38 Ca -0.16 -0.35 0.23 0.00 0.43 0.00 0.00 52.55 52.70 1zem s ASP 38 Cb -0.17 0.59 0.04 0.00 -0.30 0.00 0.00 42.92 43.08 1zem s ASP 38 CO 0.07 -1.05 1.04 1.15 -0.17 0.00 0.00 175.17 176.21 1zem n MET 39 N -0.42 0.49 -3.49 4.34 0.00 -1.20 -0.57 117.12 116.27 1zem n MET 39 Ca -0.08 0.06 -0.42 0.00 0.00 0.00 0.00 57.70 57.26 1zem n MET 39 Cb 0.61 -1.73 -0.10 0.00 0.00 0.00 0.00 33.22 32.00 1zem n MET 39 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 1zem s ASN 40 N -4.79 6.05 0.12 3.17 3.84 -1.26 -4.75 114.94 117.32 1zem s ASN 40 Ca 0.01 -0.86 -0.17 0.00 0.21 0.00 0.00 52.86 52.05 1zem s ASN 40 Cb 0.12 -2.14 -0.03 0.00 -0.55 0.00 0.00 41.25 38.65 1zem s ASN 40 CO 0.79 -0.42 1.67 -0.09 -2.79 0.00 0.00 177.10 176.26 1zem h ARG 41 N 8.59 0.52 -0.77 0.43 2.43 -1.98 -2.49 114.38 121.12 1zem h ARG 41 Ca -0.27 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 58.79 1zem h ARG 41 Cb 1.12 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.55 1zem h ARG 41 CO 0.71 0.51 0.42 1.49 -1.51 0.00 0.00 179.97 181.59 1zem h GLU 42 N 0.42 1.07 -0.13 0.20 4.81 -2.00 -0.58 114.58 118.36 1zem h GLU 42 Ca 0.12 -0.12 -0.14 0.00 -0.13 0.00 0.00 59.36 59.09 1zem h GLU 42 Cb 0.19 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1zem h GLU 42 CO -0.01 0.78 -0.52 0.00 -0.73 0.00 0.00 179.01 178.53 1zem h ALA 43 N 1.39 0.86 -0.69 2.92 0.00 -1.89 -2.81 119.26 119.04 1zem h ALA 43 Ca 0.27 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1zem h ALA 43 Cb 0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1zem h ALA 43 CO -0.04 0.68 0.37 -0.07 0.00 0.00 0.00 179.25 180.19 1zem h LEU 44 N 0.29 0.87 0.09 0.00 3.38 -0.88 -0.58 115.31 118.48 1zem h LEU 44 Ca 0.01 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1zem h LEU 44 Cb 1.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1zem h LEU 44 CO 0.09 0.72 -0.12 -0.33 0.09 0.00 0.00 178.44 178.89 1zem h GLU 45 N 0.95 -0.24 -0.10 1.13 5.08 -0.94 0.27 114.58 120.73 1zem h GLU 45 Ca 0.24 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1zem h GLU 45 Cb 0.05 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1zem h GLU 45 CO -0.04 -0.16 0.05 0.87 -1.00 0.00 0.00 179.01 178.73 1zem h LYS 46 N -0.25 0.15 -0.69 2.33 1.57 -1.39 -1.79 116.57 116.50 1zem h LYS 46 Ca 0.01 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1zem h LYS 46 Cb 0.25 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 1zem h LYS 46 CO -0.05 0.24 0.37 0.00 -0.57 0.00 0.00 179.45 179.44 1zem h ALA 47 N 0.90 0.94 -0.09 3.86 0.00 -0.91 -1.08 119.26 122.88 1zem h ALA 47 Ca 0.03 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1zem h ALA 47 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1zem h ALA 47 CO -0.00 0.02 -0.41 1.49 0.00 0.00 0.00 179.25 180.35 1zem h GLU 48 N 0.66 0.20 -0.33 0.00 4.81 -0.30 -1.88 114.58 117.74 1zem h GLU 48 Ca 0.32 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1zem h GLU 48 Cb 0.26 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1zem h GLU 48 CO -0.22 0.58 0.17 0.00 -0.73 0.00 0.00 179.01 178.81 1zem h ALA 49 N 1.41 0.43 -0.72 2.92 0.00 -0.34 0.06 119.26 123.02 1zem h ALA 49 Ca 0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1zem h ALA 49 Cb 0.79 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1zem h ALA 49 CO 0.06 -0.03 0.34 0.77 0.00 0.00 0.00 179.25 180.39 1zem h SER 50 N 0.41 0.96 -0.17 0.00 0.02 -0.92 -2.91 113.55 110.94 1zem h SER 50 Ca 0.12 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1zem h SER 50 Cb 0.09 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1zem h SER 50 CO -0.02 0.83 0.01 0.58 -1.14 0.00 0.00 176.83 177.09 1zem h VAL 51 N 1.02 1.25 -0.89 2.27 2.07 -1.03 -3.11 116.25 117.83 1zem h VAL 51 Ca 0.25 -0.82 0.18 0.00 0.82 0.00 0.00 66.70 67.13 1zem h VAL 51 Cb 0.14 1.47 -0.11 0.00 -1.52 0.00 0.00 31.29 31.27 1zem h VAL 51 CO -0.03 0.25 0.45 0.03 0.02 0.00 0.00 177.57 178.29 1zem h ARG 52 N 0.04 0.55 0.00 1.57 3.08 -0.87 0.22 114.38 118.97 1zem h ARG 52 Ca 0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1zem h ARG 52 Cb 0.36 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1zem h ARG 52 CO 0.01 0.36 0.07 -1.91 -1.07 0.00 0.00 179.97 177.43 1zem n GLU 53 N -4.91 0.03 0.00 0.04 2.13 -1.11 0.65 120.64 117.46 1zem n GLU 53 Ca 0.20 0.48 0.13 0.00 0.66 0.00 0.00 57.16 58.63 1zem n GLU 53 Cb 0.53 -1.66 0.42 0.00 0.27 0.00 0.00 31.44 31.01 1zem n GLU 53 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1zem n LYS 54 N -1.61 1.12 -2.07 5.31 4.01 0.78 -4.94 118.16 120.76 1zem n LYS 54 Ca -0.00 -0.66 -0.02 0.00 -0.51 0.00 0.00 58.31 57.12 1zem n LYS 54 Cb 0.07 -1.49 -0.00 0.00 -0.51 0.00 0.00 35.03 33.11 1zem n LYS 54 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1zem n GLY 55 N 1.29 0.34 3.43 0.72 0.00 0.21 -4.85 105.19 106.32 1zem n GLY 55 Ca 0.14 -0.80 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 1zem n GLY 55 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zem s VAL 56 N -2.15 2.28 0.21 1.61 -7.23 -1.25 -5.11 120.40 108.76 1zem s VAL 56 Ca 0.00 -2.27 -0.30 0.00 -1.81 0.00 0.00 61.98 57.60 1zem s VAL 56 Cb -0.00 -2.19 -0.09 0.00 0.56 0.00 0.00 36.38 34.65 1zem s VAL 56 CO 0.00 -0.38 1.41 -0.70 -0.31 0.00 0.00 175.10 175.13 1zem s GLU 57 N -3.33 4.31 -0.05 4.82 2.12 -1.26 -4.60 118.70 120.71 1zem s GLU 57 Ca 0.26 2.20 -0.19 0.00 0.36 0.00 0.00 54.97 57.61 1zem s GLU 57 Cb -0.05 -3.16 0.04 0.00 0.26 0.00 0.00 34.13 31.22 1zem s GLU 57 CO 0.12 -0.39 0.42 0.00 -0.54 0.00 0.00 175.26 174.87 1zem s ALA 58 N 0.28 -1.06 0.00 6.30 0.00 -1.26 -2.14 121.76 123.88 1zem s ALA 58 Ca 0.60 0.71 -0.13 0.00 0.00 0.00 0.00 51.96 53.15 1zem s ALA 58 Cb -0.40 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.65 1zem s ALA 58 CO 0.39 -0.28 0.27 1.03 0.00 0.00 0.00 175.76 177.17 1zem s ARG 59 N -1.02 0.66 0.16 0.00 0.52 -0.94 -5.00 118.95 113.33 1zem s ARG 59 Ca -0.11 -0.32 0.07 0.00 -0.52 0.00 0.00 55.73 54.85 1zem s ARG 59 Cb -0.04 0.29 -0.04 0.00 0.52 0.00 0.00 34.95 35.68 1zem s ARG 59 CO 0.05 -0.18 -0.00 -1.12 0.02 0.00 0.00 175.30 174.06 1zem s SER 60 N -1.52 4.80 -0.10 0.23 0.01 -1.26 -0.53 113.70 115.33 1zem s SER 60 Ca -0.12 -0.36 -0.03 0.00 1.31 0.00 0.00 55.95 56.75 1zem s SER 60 Cb -0.05 -1.04 0.05 0.00 0.21 0.00 0.00 66.02 65.19 1zem s SER 60 CO 0.02 0.10 0.11 -0.31 0.41 0.00 0.00 173.24 173.58 1zem s TYR 61 N -1.65 -0.01 -0.07 2.43 1.51 0.85 -4.91 117.35 115.51 1zem s TYR 61 Ca 0.27 0.20 -0.30 0.00 -1.01 0.00 0.00 57.07 56.23 1zem s TYR 61 Cb -0.10 -0.46 -0.02 0.00 -0.11 0.00 0.00 41.96 41.27 1zem s TYR 61 CO 0.18 -0.34 1.02 0.08 -1.11 0.00 0.00 175.55 175.38 1zem s VAL 62 N 2.21 4.76 -0.28 0.71 1.01 -1.26 -2.23 120.40 125.32 1zem s VAL 62 Ca 0.04 2.01 -0.19 0.00 0.00 0.00 0.00 61.98 63.84 1zem s VAL 62 Cb -0.13 -4.29 0.12 0.00 0.00 0.00 0.00 36.38 32.08 1zem s VAL 62 CO -0.06 0.06 0.92 0.00 0.00 0.00 0.00 175.10 176.01 1zem s ASP 64 N 1.09 6.19 0.46 0.00 3.68 -1.26 -3.24 116.67 123.59 1zem s ASP 64 Ca -0.06 -1.18 0.23 0.00 2.13 0.00 0.00 52.55 53.67 1zem s ASP 64 Cb -0.04 -2.24 1.27 0.00 -1.45 0.00 0.00 42.92 40.45 1zem s ASP 64 CO -0.13 -0.80 1.67 -0.37 0.13 0.00 0.00 175.17 175.67 1zem h VAL 65 N 5.82 0.00 0.00 1.11 -1.51 -1.95 0.16 116.25 119.88 1zem h VAL 65 Ca -0.28 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.19 1zem h VAL 65 Cb 1.10 0.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.78 1zem h VAL 65 CO 0.94 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 177.63 1zem n THR 66 N -2.46 0.56 -3.25 7.19 -2.24 -1.26 -4.38 114.28 108.43 1zem n THR 66 Ca -0.02 0.04 -0.44 0.00 -2.27 0.00 0.00 64.05 61.36 1zem n THR 66 Cb 0.25 -0.78 -0.06 0.00 -2.10 0.00 0.00 70.33 67.64 1zem n THR 66 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1zem s SER 67 N -3.61 6.19 0.36 3.42 0.15 0.54 -4.92 113.70 115.83 1zem s SER 67 Ca 0.10 -1.20 0.03 0.00 0.70 0.00 0.00 55.95 55.58 1zem s SER 67 Cb 0.13 -2.24 0.66 0.00 -1.71 0.00 0.00 66.02 62.86 1zem s SER 67 CO 0.45 -0.82 2.01 -0.08 1.20 0.00 0.00 173.24 176.01 1zem h GLU 68 N 8.91 0.78 -0.66 5.44 4.81 -1.84 -1.10 114.58 130.92 1zem h GLU 68 Ca -0.28 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1zem h GLU 68 Cb 1.10 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 1zem h GLU 68 CO 0.95 0.53 0.35 0.93 -0.73 0.00 0.00 179.01 181.04 1zem h GLU 69 N 0.80 0.93 -0.60 1.92 3.07 -1.95 -0.53 114.58 118.23 1zem h GLU 69 Ca 0.22 -0.12 -0.07 0.00 -0.50 0.00 0.00 59.36 58.89 1zem h GLU 69 Cb -0.08 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.63 1zem h GLU 69 CO -0.04 0.71 0.12 0.00 -1.40 0.00 0.00 179.01 178.40 1zem h ALA 70 N 1.17 0.79 -0.05 3.43 0.00 -1.68 -1.61 119.26 121.31 1zem h ALA 70 Ca 0.23 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1zem h ALA 70 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1zem h ALA 70 CO -0.03 0.52 -0.00 0.28 0.00 0.00 0.00 179.25 180.02 1zem h VAL 71 N 0.88 0.97 -0.68 0.00 2.07 -0.57 0.13 116.25 119.05 1zem h VAL 71 Ca 0.18 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.68 1zem h VAL 71 Cb 0.40 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1zem h VAL 71 CO 0.01 0.00 0.36 0.40 0.02 0.00 0.00 177.57 178.36 1zem h ILE 72 N 0.02 1.22 -0.66 4.57 2.04 -1.04 -0.85 117.51 122.80 1zem h ILE 72 Ca 0.02 -0.56 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 1zem h ILE 72 Cb 0.03 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 1zem h ILE 72 CO -0.04 0.24 0.26 1.23 0.00 0.00 0.00 178.15 179.84 1zem h GLY 73 N 0.93 1.07 1.01 5.37 0.00 -0.96 -1.41 103.07 109.07 1zem h GLY 73 Ca 0.24 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 1zem h GLY 73 CO -0.04 0.55 -0.01 -0.84 0.00 0.00 0.00 176.54 176.21 1zem h THR 74 N 0.94 1.26 -0.72 4.70 2.02 -0.43 -1.93 112.91 118.75 1zem h THR 74 Ca 0.22 -1.09 -0.03 0.00 0.77 0.00 0.00 66.41 66.28 1zem h THR 74 Cb 0.21 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1zem h THR 74 CO -0.02 0.38 0.35 0.58 0.37 0.00 0.00 175.52 177.18 1zem h VAL 75 N 0.74 1.24 -0.92 3.16 2.07 -0.92 0.68 116.25 122.30 1zem h VAL 75 Ca 0.14 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1zem h VAL 75 Cb 0.53 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1zem h VAL 75 CO 0.03 0.28 0.57 0.44 0.02 0.00 0.00 177.57 178.90 1zem h ASP 76 N 1.01 1.10 -0.62 0.57 3.32 -1.11 -0.64 116.42 120.06 1zem h ASP 76 Ca 0.25 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 1zem h ASP 76 Cb 0.12 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1zem h ASP 76 CO -0.03 0.83 0.02 0.28 -1.72 0.00 0.00 179.24 178.62 1zem h SER 77 N 1.27 1.06 -0.70 6.45 0.02 -0.48 -1.28 113.55 119.89 1zem h SER 77 Ca 0.33 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1zem h SER 77 Cb -0.07 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.15 1zem h SER 77 CO -0.06 1.10 0.34 0.58 -1.14 0.00 0.00 176.83 177.65 1zem h VAL 78 N 1.00 1.23 0.00 2.27 2.07 -0.17 0.24 116.25 122.88 1zem h VAL 78 Ca 0.18 -0.64 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1zem h VAL 78 Cb 0.55 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1zem h VAL 78 CO 0.03 0.27 -0.28 0.58 0.02 0.00 0.00 177.57 178.19 1zem h VAL 79 N 0.97 0.83 0.04 2.57 2.07 -0.77 0.42 116.25 122.37 1zem h VAL 79 Ca 0.24 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1zem h VAL 79 Cb 0.11 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1zem h VAL 79 CO -0.03 0.27 -0.02 -0.09 0.02 0.00 0.00 177.57 177.72 1zem h ARG 80 N 0.00 -0.05 -0.47 1.57 2.43 -0.16 0.15 114.38 117.85 1zem h ARG 80 Ca -0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1zem h ARG 80 Cb 0.66 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 1zem h ARG 80 CO 0.04 0.56 -0.15 -0.44 -1.51 0.00 0.00 179.97 178.46 1zem h ASP 81 N -0.70 0.91 0.00 -3.80 3.32 -0.28 -3.33 116.42 112.54 1zem h ASP 81 Ca -0.00 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1zem h ASP 81 Cb 0.63 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1zem h ASP 81 CO 0.01 1.05 -1.32 0.49 -1.72 0.00 0.00 179.24 177.75 1zem n PHE 82 N -4.13 0.00 0.00 4.55 3.01 0.11 -5.02 117.46 115.98 1zem n PHE 82 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1zem n PHE 82 Cb 0.41 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.66 1zem n PHE 82 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1zem n GLY 83 N 1.56 3.01 3.78 1.37 0.00 0.54 -4.97 105.19 110.48 1zem n GLY 83 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1zem n GLY 83 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zem s LYS 84 N -0.26 1.65 -0.33 1.61 -2.85 -1.26 -4.92 119.74 113.39 1zem s LYS 84 Ca 0.00 -0.87 -0.01 0.00 -1.00 0.00 0.00 55.97 54.08 1zem s LYS 84 Cb 0.00 0.59 0.11 0.00 -2.06 0.00 0.00 37.83 36.47 1zem s LYS 84 CO 0.00 -0.75 0.14 0.42 0.10 0.00 0.00 175.35 175.26 1zem s ILE 85 N -3.83 0.56 0.05 3.79 1.01 -1.26 -4.78 121.20 116.73 1zem s ILE 85 Ca 0.09 -1.40 -0.15 0.00 0.00 0.00 0.00 60.65 59.20 1zem s ILE 85 Cb -0.05 -1.43 -0.30 0.00 0.01 0.00 0.00 42.46 40.69 1zem s ILE 85 CO 0.03 -0.76 1.09 0.44 0.00 0.00 0.00 174.94 175.74 1zem h ASP 86 N 7.86 0.88 -4.30 3.58 5.19 -1.60 -3.43 116.42 124.60 1zem h ASP 86 Ca -0.11 -0.83 -0.58 0.00 -0.62 0.00 0.00 57.03 54.89 1zem h ASP 86 Cb 1.00 -0.28 -0.26 0.00 0.18 0.00 0.00 39.33 39.97 1zem h ASP 86 CO 0.43 1.63 -0.84 -0.36 -3.12 0.00 0.00 179.24 176.98 1zem s PHE 87 N -2.92 1.80 -0.08 4.55 0.08 -0.23 -1.70 117.98 119.49 1zem s PHE 87 Ca -0.09 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 56.60 1zem s PHE 87 Cb 0.05 -1.09 0.02 0.00 -0.57 0.00 0.00 43.02 41.43 1zem s PHE 87 CO 0.94 0.07 -0.11 -1.17 -0.10 0.00 0.00 175.22 174.85 1zem s LEU 88 N -1.09 1.55 -0.46 -0.37 2.96 -0.45 -0.13 118.68 120.69 1zem s LEU 88 Ca 0.07 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1zem s LEU 88 Cb -0.09 -0.82 0.12 0.00 0.50 0.00 0.00 46.19 45.90 1zem s LEU 88 CO 0.01 0.00 0.25 0.12 -1.32 0.00 0.00 176.35 175.42 1zem s PHE 89 N 0.88 3.54 -0.92 5.38 5.36 0.32 -0.69 117.98 131.85 1zem s PHE 89 Ca -0.10 -2.58 -0.20 0.00 -0.96 0.00 0.00 56.93 53.09 1zem s PHE 89 Cb -0.15 -3.18 0.11 0.00 -0.34 0.00 0.00 43.02 39.46 1zem s PHE 89 CO 0.01 -0.93 1.18 1.21 -1.46 0.00 0.00 175.22 175.23 1zem s ASN 90 N 1.37 6.56 0.00 6.13 2.47 0.30 -1.47 114.94 130.30 1zem s ASN 90 Ca 0.11 -1.81 0.00 0.00 0.42 0.00 0.00 52.86 51.58 1zem s ASN 90 Cb -0.22 -2.44 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 1zem s ASN 90 CO -0.04 -1.20 0.00 -3.20 -3.72 0.00 0.00 177.10 168.94 1zem n ASN 91 N 7.16 2.77 -4.66 -4.21 2.85 -1.24 -1.42 115.26 116.51 1zem n ASN 91 Ca 0.23 -0.08 -0.43 0.00 -0.11 0.00 0.00 54.58 54.20 1zem n ASN 91 Cb 0.49 0.71 -0.01 0.00 1.24 0.00 0.00 39.78 42.21 1zem n ASN 91 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1zem n ALA 92 N -0.98 0.74 -3.59 5.20 0.00 -1.08 -4.79 120.51 116.00 1zem n ALA 92 Ca 0.00 0.35 -0.07 0.00 0.00 0.00 0.00 53.44 53.72 1zem n ALA 92 Cb 0.00 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.26 1zem n ALA 92 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1zem s GLY 93 N -0.45 -0.39 -0.06 0.00 0.00 -1.26 -4.80 107.32 100.36 1zem s GLY 93 Ca 0.58 0.66 0.05 0.00 0.00 0.00 0.00 44.72 46.00 1zem s GLY 93 CO 0.61 0.20 -0.21 -0.47 0.00 0.00 0.00 173.10 173.23 1zem s TYR 94 N -3.22 2.17 0.13 1.90 5.04 -1.26 -5.05 117.35 117.06 1zem s TYR 94 Ca 0.07 -0.71 0.25 0.00 -2.44 0.00 0.00 57.07 54.25 1zem s TYR 94 Cb -0.01 -1.45 0.98 0.00 0.35 0.00 0.00 41.96 41.83 1zem s TYR 94 CO -0.05 -0.25 1.85 0.37 -1.34 0.00 0.00 175.55 176.13 1zem h GLN 95 N 6.33 0.00 0.00 4.97 4.15 -2.01 -3.47 115.11 125.07 1zem h GLN 95 Ca -0.29 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.13 1zem h GLN 95 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1zem h GLN 95 CO 0.47 0.19 0.00 0.41 -1.93 0.00 0.00 178.83 177.98 1zem n GLY 96 N 0.12 -1.53 3.79 2.39 0.00 -1.26 -4.66 105.19 104.04 1zem n GLY 96 Ca 0.00 -1.55 -0.29 0.00 0.00 0.00 0.00 46.02 44.18 1zem n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zem s ALA 97 N -1.72 1.86 -0.24 4.61 0.00 -1.26 -5.05 121.76 119.96 1zem s ALA 97 Ca 0.00 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.47 1zem s ALA 97 Cb 0.00 -3.04 0.06 0.00 0.00 0.00 0.00 23.12 20.14 1zem s ALA 97 CO 0.00 -2.20 -0.07 -0.06 0.00 0.00 0.00 175.76 173.42 1zem s PHE 98 N -3.28 2.71 -0.07 0.00 0.40 -1.26 -4.77 117.98 111.71 1zem s PHE 98 Ca 0.63 -1.96 -0.30 0.00 -0.60 0.00 0.00 56.93 54.70 1zem s PHE 98 Cb -0.15 -1.71 0.10 0.00 0.51 0.00 0.00 43.02 41.77 1zem s PHE 98 CO 0.53 -0.81 0.82 0.00 0.70 0.00 0.00 175.22 176.46 1zem s ALA 99 N 1.29 -1.82 0.63 5.36 0.00 -0.26 -4.85 121.76 122.11 1zem s ALA 99 Ca -0.07 1.31 -0.18 0.00 0.00 0.00 0.00 51.96 53.01 1zem s ALA 99 Cb -0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 1zem s ALA 99 CO -0.06 -0.42 1.29 -1.25 0.00 0.00 0.00 175.76 175.32 1zem s PRO 100 N -1.62 2.66 0.28 0.00 0.04 -1.26 -4.31 135.00 130.79 1zem s PRO 100 Ca -0.05 2.06 0.02 0.00 0.04 0.00 0.00 61.00 63.07 1zem s PRO 100 Cb -0.00 -1.90 0.64 0.00 0.04 0.00 0.00 34.50 33.28 1zem s PRO 100 CO 0.03 -1.51 1.73 -0.24 0.04 0.00 0.00 177.00 177.04 1zem h VAL 101 N 0.68 0.60 0.00 -0.36 3.04 -1.97 -0.95 116.25 117.28 1zem h VAL 101 Ca -0.51 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.01 1zem h VAL 101 Cb 1.33 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.65 1zem h VAL 101 CO 0.54 0.09 0.00 0.06 -1.01 0.00 0.00 177.57 177.25 1zem h GLN 102 N 0.51 0.00 -0.09 4.17 -0.00 -2.04 -1.94 115.11 115.72 1zem h GLN 102 Ca 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.17 1zem h GLN 102 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.35 1zem h GLN 102 CO -0.45 0.00 0.00 -0.25 -0.00 0.00 0.00 178.83 178.13 1zem n ASP 103 N -2.81 2.08 -4.69 0.06 10.43 -0.45 -5.04 116.55 116.13 1zem n ASP 103 Ca -0.02 -1.81 -0.42 0.00 2.57 0.00 0.00 54.79 55.11 1zem n ASP 103 Cb 0.12 -0.06 -0.03 0.00 1.84 0.00 0.00 41.12 42.99 1zem n ASP 103 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1zem s TYR 104 N -0.84 2.51 -0.08 1.24 5.04 -0.70 -4.84 117.35 119.67 1zem s TYR 104 Ca 0.07 0.41 -0.29 0.00 -2.44 0.00 0.00 57.07 54.82 1zem s TYR 104 Cb 0.04 -3.91 -0.07 0.00 0.35 0.00 0.00 41.96 38.37 1zem s TYR 104 CO 0.05 -3.60 1.98 -1.25 -1.34 0.00 0.00 175.55 171.39 1zem s PRO 105 N 2.57 3.79 0.46 4.97 0.04 -1.26 -4.88 135.00 140.69 1zem s PRO 105 Ca 0.72 2.28 0.11 0.00 0.04 0.00 0.00 61.00 64.15 1zem s PRO 105 Cb -0.38 -4.20 1.04 0.00 0.04 0.00 0.00 34.50 31.00 1zem s PRO 105 CO 0.31 -1.35 2.09 0.77 0.04 0.00 0.00 177.00 178.86 1zem h SER 106 N 11.93 0.24 -0.21 6.66 0.02 -1.99 -1.36 113.55 128.84 1zem h SER 106 Ca -0.44 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.40 1zem h SER 106 Cb 1.22 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 1zem h SER 106 CO 0.96 0.19 -0.24 -2.24 -1.14 0.00 0.00 176.83 174.36 1zem h ASP 107 N 0.28 0.58 -0.45 3.07 -0.00 -2.00 -2.94 116.42 114.95 1zem h ASP 107 Ca 0.07 -0.49 -0.02 0.00 -0.00 0.00 0.00 57.03 56.59 1zem h ASP 107 Cb -0.00 -0.16 -0.02 0.00 -0.00 0.00 0.00 39.33 39.14 1zem h ASP 107 CO -0.01 0.95 0.21 -0.78 -0.00 0.00 0.00 179.24 179.60 1zem h ASP 108 N 0.22 0.64 -0.24 4.15 1.82 -1.83 -1.26 116.42 119.92 1zem h ASP 108 Ca 0.03 -0.07 0.04 0.00 -0.39 0.00 0.00 57.03 56.64 1zem h ASP 108 Cb 0.79 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.61 1zem h ASP 108 CO 0.06 0.57 0.03 0.15 -1.61 0.00 0.00 179.24 178.44 1zem h PHE 109 N 0.71 0.05 -0.42 0.28 3.57 -1.10 0.62 116.94 120.65 1zem h PHE 109 Ca 0.17 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 1zem h PHE 109 Cb 0.13 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1zem h PHE 109 CO 0.01 0.00 -0.22 0.00 -2.23 0.00 0.00 178.31 175.87 1zem h ALA 110 N 1.19 0.82 -0.71 2.41 0.00 -1.32 -2.83 119.26 118.81 1zem h ALA 110 Ca 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1zem h ALA 110 Cb 0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1zem h ALA 110 CO -0.16 0.65 0.36 -0.09 0.00 0.00 0.00 179.25 180.00 1zem h ARG 111 N 0.74 1.01 0.07 0.00 2.43 -0.42 -1.64 114.38 116.56 1zem h ARG 111 Ca 0.10 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1zem h ARG 111 Cb 0.75 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1zem h ARG 111 CO 0.06 0.78 -0.17 0.28 -1.51 0.00 0.00 179.97 179.41 1zem h VAL 112 N 0.98 0.62 -0.52 0.20 2.07 -0.68 -1.44 116.25 117.48 1zem h VAL 112 Ca 0.25 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.83 1zem h VAL 112 Cb 0.09 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 1zem h VAL 112 CO -0.03 0.00 0.22 -0.07 0.02 0.00 0.00 177.57 177.70 1zem h LEU 113 N -0.31 0.26 -0.91 2.57 3.38 -1.29 -0.44 115.31 118.57 1zem h LEU 113 Ca 0.03 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1zem h LEU 113 Cb 0.34 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1zem h LEU 113 CO -0.11 0.18 0.37 0.74 0.09 0.00 0.00 178.44 179.71 1zem h THR 114 N 0.42 1.25 0.00 0.22 2.02 -1.06 0.96 112.91 116.73 1zem h THR 114 Ca 0.25 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1zem h THR 114 Cb 0.23 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1zem h THR 114 CO -0.22 0.31 -0.00 0.40 0.37 0.00 0.00 175.52 176.38 1zem h ILE 115 N 1.14 1.74 0.00 3.11 2.04 -1.05 0.12 117.51 124.60 1zem h ILE 115 Ca 0.27 -2.25 -0.07 0.00 1.00 0.00 0.00 64.86 63.82 1zem h ILE 115 Cb 0.14 3.26 -0.01 0.00 -0.74 0.00 0.00 36.82 39.47 1zem h ILE 115 CO -0.03 0.58 -0.32 0.78 0.00 0.00 0.00 178.15 179.16 1zem h ASN 116 N -0.97 0.00 0.00 1.72 4.21 -1.10 -3.21 115.58 116.23 1zem h ASN 116 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1zem h ASN 116 Cb 0.95 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.15 1zem h ASN 116 CO 0.00 0.32 -0.23 0.52 -1.29 0.00 0.00 177.43 176.75 1zem n VAL 117 N -3.26 0.94 -0.17 2.81 0.31 0.29 -4.36 118.33 114.88 1zem n VAL 117 Ca 0.02 0.28 -0.06 0.00 -0.01 0.00 0.00 64.34 64.56 1zem n VAL 117 Cb 0.59 -1.64 0.04 0.00 -0.91 0.00 0.00 33.84 31.92 1zem n VAL 117 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1zem h THR 118 N -0.23 1.05 -0.66 2.52 2.02 -1.43 0.30 112.91 116.49 1zem h THR 118 Ca 0.00 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 66.90 1zem h THR 118 Cb 0.23 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1zem h THR 118 CO 0.00 0.11 0.14 1.23 0.37 0.00 0.00 175.52 177.37 1zem h GLY 119 N 0.61 1.13 1.61 2.16 0.00 -0.76 0.26 103.07 108.08 1zem h GLY 119 Ca 0.20 -0.71 -0.10 0.00 0.00 0.00 0.00 47.33 46.73 1zem h GLY 119 CO -0.09 0.66 -0.27 0.00 0.00 0.00 0.00 176.54 176.84 1zem h ALA 120 N 1.15 1.10 -0.40 3.60 0.00 -1.45 -2.16 119.26 121.09 1zem h ALA 120 Ca 0.21 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1zem h ALA 120 Cb 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1zem h ALA 120 CO 0.00 0.56 -0.16 0.35 0.00 0.00 0.00 179.25 180.01 1zem h PHE 121 N 0.40 0.93 -0.42 0.00 3.57 0.29 -1.13 116.94 120.59 1zem h PHE 121 Ca 0.06 -0.22 0.06 0.00 3.53 0.00 0.00 57.97 61.40 1zem h PHE 121 Cb 0.68 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.15 1zem h PHE 121 CO 0.02 0.97 0.10 0.45 -2.23 0.00 0.00 178.31 177.62 1zem h HIS 122 N 0.63 0.17 -0.21 0.41 3.86 0.05 -0.13 115.15 119.94 1zem h HIS 122 Ca 0.10 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.32 1zem h HIS 122 Cb 0.70 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.15 1zem h HIS 122 CO 0.05 0.04 0.10 0.28 0.86 0.00 0.00 177.93 179.26 1zem h VAL 123 N 0.24 1.14 -0.43 2.45 2.07 -1.28 -2.39 116.25 118.05 1zem h VAL 123 Ca 0.20 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1zem h VAL 123 Cb 0.23 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 1zem h VAL 123 CO -0.25 0.13 0.22 0.25 0.02 0.00 0.00 177.57 177.94 1zem h LEU 124 N 0.21 0.31 0.77 2.57 5.85 -0.75 -1.12 115.31 123.14 1zem h LEU 124 Ca 0.07 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1zem h LEU 124 Cb 0.12 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1zem h LEU 124 CO -0.01 0.22 -0.40 0.50 -0.34 0.00 0.00 178.44 178.41 1zem h LYS 125 N 0.43 -1.04 -0.82 1.25 3.64 -0.99 0.68 116.57 119.73 1zem h LYS 125 Ca 0.19 0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.68 1zem h LYS 125 Cb 0.09 0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 1zem h LYS 125 CO -0.13 -0.69 0.51 0.00 -2.27 0.00 0.00 179.45 176.87 1zem h ALA 126 N -0.87 1.09 -0.11 5.00 0.00 -1.28 -1.94 119.26 121.15 1zem h ALA 126 Ca -0.10 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 1zem h ALA 126 Cb 0.84 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1zem h ALA 126 CO 0.15 0.31 -0.69 0.28 0.00 0.00 0.00 179.25 179.30 1zem h VAL 127 N 0.98 1.36 0.00 0.00 2.07 -1.20 -2.97 116.25 116.48 1zem h VAL 127 Ca 0.34 -2.04 -0.06 0.00 0.82 0.00 0.00 66.70 65.75 1zem h VAL 127 Cb 0.06 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.84 1zem h VAL 127 CO -0.13 0.62 -0.31 0.77 0.02 0.00 0.00 177.57 178.54 1zem h SER 128 N 0.33 0.00 -0.71 0.57 4.64 -0.42 0.68 113.55 118.64 1zem h SER 128 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 1zem h SER 128 Cb 1.26 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.32 1zem h SER 128 CO 0.12 0.31 0.35 0.03 -0.87 0.00 0.00 176.83 176.78 1zem h ARG 129 N 0.00 1.01 -0.02 4.77 3.08 -1.22 0.37 114.38 122.37 1zem h ARG 129 Ca -0.00 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1zem h ARG 129 Cb 0.57 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 1zem h ARG 129 CO 0.04 0.78 0.00 0.37 -1.07 0.00 0.00 179.97 180.10 1zem h GLN 130 N 0.98 0.04 -0.56 0.04 5.75 -1.13 -2.73 115.11 117.50 1zem h GLN 130 Ca 0.25 -0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.79 1zem h GLN 130 Cb 0.10 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 1zem h GLN 130 CO -0.03 0.31 0.37 0.52 -2.65 0.00 0.00 178.83 177.34 1zem h MET 131 N -0.23 0.52 -0.63 1.69 2.86 -0.53 -0.46 114.93 118.16 1zem h MET 131 Ca 0.01 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.55 1zem h MET 131 Cb 0.29 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1zem h MET 131 CO 0.00 0.34 0.12 0.82 1.06 0.00 0.00 176.91 179.26 1zem h ILE 132 N 0.53 1.26 -0.81 -1.22 2.04 -0.08 0.26 117.51 119.50 1zem h ILE 132 Ca 0.24 -0.98 0.14 0.00 1.00 0.00 0.00 64.86 65.26 1zem h ILE 132 Cb 0.26 0.68 -0.06 0.00 -0.74 0.00 0.00 36.82 36.96 1zem h ILE 132 CO -0.07 0.37 0.53 0.74 0.00 0.00 0.00 178.15 179.72 1zem h THR 133 N 0.94 0.84 0.00 -0.27 2.02 -0.79 -1.31 112.91 114.33 1zem h THR 133 Ca 0.19 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1zem h THR 133 Cb 0.40 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1zem h THR 133 CO 0.01 0.10 -0.60 0.00 0.37 0.00 0.00 175.52 175.40 1zem n GLN 134 N -4.51 0.22 -3.88 6.66 6.02 -0.82 -4.94 117.38 116.13 1zem n GLN 134 Ca 0.15 0.06 -0.26 0.00 -0.01 0.00 0.00 57.00 56.94 1zem n GLN 134 Cb 0.47 -1.64 0.01 0.00 1.02 0.00 0.00 30.24 30.10 1zem n GLN 134 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1zem n ASN 135 N -1.96 -2.08 -3.64 1.08 5.15 0.02 -4.98 115.26 108.86 1zem n ASN 135 Ca 0.04 -0.88 -0.06 0.00 -0.60 0.00 0.00 54.58 53.08 1zem n ASN 135 Cb 0.41 -3.61 -0.07 0.00 -0.53 0.00 0.00 39.78 35.98 1zem n ASN 135 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1zem s TYR 136 N -3.62 -0.65 -0.30 1.20 5.04 -0.95 -4.53 117.35 113.54 1zem s TYR 136 Ca 0.25 1.40 -0.28 0.00 -2.44 0.00 0.00 57.07 56.00 1zem s TYR 136 Cb -0.13 0.40 0.20 0.00 0.35 0.00 0.00 41.96 42.78 1zem s TYR 136 CO 0.85 -0.32 1.43 0.20 -1.34 0.00 0.00 175.55 176.37 1zem s GLY 137 N 0.98 0.24 -0.04 8.97 0.00 -0.86 -4.60 107.32 112.00 1zem s GLY 137 Ca -0.05 3.19 0.02 0.00 0.00 0.00 0.00 44.72 47.88 1zem s GLY 137 CO -0.12 1.43 -0.09 0.50 0.00 0.00 0.00 173.10 174.82 1zem s ARG 138 N -0.63 1.13 -0.02 2.90 3.00 -0.69 -1.92 118.95 122.72 1zem s ARG 138 Ca 0.09 -0.30 0.05 0.00 0.00 0.00 0.00 55.73 55.58 1zem s ARG 138 Cb -0.02 -1.02 -0.01 0.00 0.00 0.00 0.00 34.95 33.89 1zem s ARG 138 CO -0.12 0.06 -0.18 0.42 0.00 0.00 0.00 175.30 175.48 1zem s ILE 139 N 0.43 1.48 -0.13 1.52 1.01 0.15 -1.34 121.20 124.32 1zem s ILE 139 Ca -0.07 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1zem s ILE 139 Cb -0.11 -1.24 0.02 0.00 0.01 0.00 0.00 42.46 41.14 1zem s ILE 139 CO 0.01 0.42 -0.12 -0.69 0.00 0.00 0.00 174.94 174.57 1zem s VAL 140 N -0.34 1.34 -0.11 2.92 1.01 0.13 -1.32 120.40 124.04 1zem s VAL 140 Ca 0.05 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.47 1zem s VAL 140 Cb -0.08 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1zem s VAL 140 CO -0.00 0.42 0.13 0.20 0.00 0.00 0.00 175.10 175.85 1zem s ASN 141 N 1.55 6.31 -0.43 3.32 0.01 -0.20 -0.54 114.94 124.96 1zem s ASN 141 Ca 0.04 0.44 -0.22 0.00 -0.71 0.00 0.00 52.86 52.41 1zem s ASN 141 Cb -0.13 -2.03 0.02 0.00 0.41 0.00 0.00 41.25 39.53 1zem s ASN 141 CO -0.09 0.40 0.73 -0.89 -1.51 0.00 0.00 177.10 175.74 1zem s THR 142 N -1.03 4.73 0.00 1.60 2.01 -0.51 -2.10 115.64 120.34 1zem s THR 142 Ca 0.15 0.37 0.00 0.00 0.31 0.00 0.00 61.69 62.52 1zem s THR 142 Cb -0.12 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.13 1zem s THR 142 CO 0.04 -0.64 0.00 0.00 -0.69 0.00 0.00 174.62 173.34 1zem n ALA 143 N 6.51 0.00 0.00 7.40 0.00 0.13 -4.94 120.51 129.61 1zem n ALA 143 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1zem n ALA 143 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1zem n ALA 143 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1zem n SER 144 N 0.00 0.00 0.32 0.00 2.88 -1.24 -4.54 113.62 111.03 1zem n SER 144 Ca 0.00 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 57.74 1zem n SER 144 Cb 0.00 0.00 1.06 0.00 -0.75 0.00 0.00 64.21 64.52 1zem n SER 144 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1zem h MET 145 N 0.00 0.00 0.00 -1.46 2.86 -1.27 0.31 114.93 115.37 1zem h MET 145 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1zem h MET 145 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 1zem h MET 145 CO 0.00 0.01 -0.10 0.00 1.06 0.00 0.00 176.91 177.88 1zem h ALA 146 N 1.99 1.32 0.00 6.32 0.00 -1.83 -0.94 119.26 126.12 1zem h ALA 146 Ca -0.00 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1zem h ALA 146 Cb 0.09 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1zem h ALA 146 CO 0.00 0.13 -1.04 0.78 0.00 0.00 0.00 179.25 179.12 1zem h GLY 147 N 0.75 0.00 1.07 0.00 0.00 -1.11 -3.26 103.07 100.52 1zem h GLY 147 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1zem h GLY 147 CO 0.01 0.00 -0.49 -2.08 0.00 0.00 0.00 176.54 173.99 1zem h VAL 148 N 0.00 1.29 -2.97 4.60 2.07 -1.02 -3.38 116.25 116.85 1zem h VAL 148 Ca -0.09 -1.68 -0.22 0.00 0.82 0.00 0.00 66.70 65.52 1zem h VAL 148 Cb 1.49 1.70 -0.32 0.00 -1.52 0.00 0.00 31.29 32.65 1zem h VAL 148 CO 0.05 0.54 -0.54 -0.75 0.02 0.00 0.00 177.57 176.90 1zem s LYS 149 N -4.11 0.14 -0.04 1.57 2.20 -0.57 -5.12 119.74 113.81 1zem s LYS 149 Ca -0.11 0.63 -0.33 0.00 -0.36 0.00 0.00 55.97 55.80 1zem s LYS 149 Cb 0.09 -0.11 -0.11 0.00 -1.51 0.00 0.00 37.83 36.20 1zem s LYS 149 CO 0.87 -0.24 1.92 0.41 -0.36 0.00 0.00 175.35 177.95 1zem n GLY 150 N 4.92 1.62 3.90 5.54 0.00 -1.23 -4.36 105.19 115.57 1zem n GLY 150 Ca -0.13 0.85 -0.28 0.00 0.00 0.00 0.00 46.02 46.45 1zem n GLY 150 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1zem s PRO 151 N 4.26 3.63 0.40 1.61 0.05 -1.26 -5.03 135.00 138.66 1zem s PRO 151 Ca 0.91 0.28 -0.27 0.00 0.05 0.00 0.00 61.00 61.97 1zem s PRO 151 Cb -0.59 -2.40 -0.09 0.00 0.05 0.00 0.00 34.50 31.46 1zem s PRO 151 CO 0.48 -0.11 1.41 -1.25 0.05 0.00 0.00 177.00 177.58 1zem s PRO 152 N -4.34 3.97 -0.72 0.56 0.04 -1.26 -2.71 135.00 130.54 1zem s PRO 152 Ca 0.48 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.92 1zem s PRO 152 Cb -0.10 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1zem s PRO 152 CO 0.39 -0.58 0.00 0.09 0.04 0.00 0.00 177.00 176.94 1zem n ASN 153 N 0.21 -5.58 -2.45 6.66 3.02 -1.26 -4.87 115.26 110.99 1zem n ASN 153 Ca 0.03 0.17 -0.20 0.00 -0.03 0.00 0.00 54.58 54.55 1zem n ASN 153 Cb 0.41 -3.67 0.02 0.00 -0.61 0.00 0.00 39.78 35.93 1zem n ASN 153 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1zem n MET 154 N -0.45 2.82 -0.17 3.52 2.81 -1.10 -1.10 117.12 123.45 1zem n MET 154 Ca -0.07 -4.06 -0.07 0.00 -1.81 0.00 0.00 57.70 51.69 1zem n MET 154 Cb 0.52 -1.98 -0.01 0.00 -0.71 0.00 0.00 33.22 31.03 1zem n MET 154 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1zem h ALA 155 N 2.58 -0.18 -0.17 3.04 0.00 -1.80 -0.60 119.26 122.12 1zem h ALA 155 Ca 0.19 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 1zem h ALA 155 Cb 1.16 0.81 -0.01 0.00 0.00 0.00 0.00 17.79 19.75 1zem h ALA 155 CO 0.68 -0.74 -0.03 0.00 0.00 0.00 0.00 179.25 179.17 1zem h ALA 156 N 0.79 0.23 -0.32 0.00 0.00 -1.91 -2.46 119.26 115.59 1zem h ALA 156 Ca 0.19 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1zem h ALA 156 Cb 0.56 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1zem h ALA 156 CO -0.63 -0.02 0.12 -0.92 0.00 0.00 0.00 179.25 177.80 1zem h TYR 157 N 0.04 0.49 -0.81 0.00 3.20 -1.77 -0.47 116.97 117.64 1zem h TYR 157 Ca 0.04 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1zem h TYR 157 Cb 0.44 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 1zem h TYR 157 CO 0.05 0.47 0.46 0.78 -1.64 0.00 0.00 178.16 178.27 1zem h GLY 158 N 0.36 1.20 0.99 1.82 0.00 -1.16 -0.71 103.07 105.58 1zem h GLY 158 Ca 0.11 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 1zem h GLY 158 CO -0.01 0.51 0.28 0.00 0.00 0.00 0.00 176.54 177.33 1zem h THR 159 N 1.12 1.22 -0.38 4.70 1.03 -1.29 0.12 112.91 119.43 1zem h THR 159 Ca 0.29 -0.62 -0.06 0.00 -0.01 0.00 0.00 66.41 66.00 1zem h THR 159 Cb 0.01 0.51 -0.02 0.00 -1.07 0.00 0.00 68.15 67.58 1zem h THR 159 CO -0.05 0.25 -0.03 0.77 -0.01 0.00 0.00 175.52 176.45 1zem h SER 160 N 0.83 0.58 1.13 0.00 4.64 -0.43 -1.68 113.55 118.62 1zem h SER 160 Ca 0.21 -0.13 -0.18 0.00 -0.47 0.00 0.00 61.79 61.22 1zem h SER 160 Cb 0.14 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1zem h SER 160 CO -0.02 0.67 -0.87 0.11 -0.87 0.00 0.00 176.83 175.85 1zem h LYS 161 N 0.57 0.00 -0.05 4.77 1.79 -0.72 -1.86 116.57 121.08 1zem h LYS 161 Ca 0.12 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.51 1zem h LYS 161 Cb 0.41 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1zem h LYS 161 CO 0.02 0.87 -0.33 0.78 -1.08 0.00 0.00 179.45 179.71 1zem h GLY 162 N 3.13 0.10 0.88 3.86 0.00 -0.48 -2.37 103.07 108.19 1zem h GLY 162 Ca -0.01 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.17 1zem h GLY 162 CO 0.11 0.07 -0.13 0.00 0.00 0.00 0.00 176.54 176.59 1zem h ALA 163 N 1.59 0.37 -0.93 3.60 0.00 -1.12 -2.54 119.26 120.23 1zem h ALA 163 Ca 0.01 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.67 1zem h ALA 163 Cb 0.62 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.25 1zem h ALA 163 CO 0.05 0.25 0.59 0.82 0.00 0.00 0.00 179.25 180.95 1zem h ILE 164 N 0.29 1.04 -0.11 0.00 1.08 -1.10 0.13 117.51 118.85 1zem h ILE 164 Ca 0.06 -0.36 -0.01 0.00 -0.39 0.00 0.00 64.86 64.16 1zem h ILE 164 Cb 0.64 -0.10 -0.00 0.00 -3.07 0.00 0.00 36.82 34.29 1zem h ILE 164 CO 0.04 0.19 0.04 0.40 -0.69 0.00 0.00 178.15 178.13 1zem h ILE 165 N 1.05 1.15 0.11 -0.67 2.04 -1.31 0.28 117.51 120.17 1zem h ILE 165 Ca 0.41 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 1zem h ILE 165 Cb 0.21 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1zem h ILE 165 CO -0.19 0.13 -0.05 0.00 0.00 0.00 0.00 178.15 178.05 1zem h ALA 166 N 0.88 -0.15 -0.85 1.87 0.00 -1.01 -2.15 119.26 117.85 1zem h ALA 166 Ca 0.04 -0.04 0.18 0.00 0.00 0.00 0.00 54.91 55.08 1zem h ALA 166 Cb 0.18 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1zem h ALA 166 CO -0.00 -0.57 0.56 1.25 0.00 0.00 0.00 179.25 180.49 1zem h LEU 167 N -0.17 0.44 -0.63 0.00 5.85 -0.66 -0.30 115.31 119.82 1zem h LEU 167 Ca -0.02 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 1zem h LEU 167 Cb 0.14 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1zem h LEU 167 CO 0.02 0.20 0.12 0.74 -0.34 0.00 0.00 178.44 179.18 1zem h THR 168 N 0.45 1.26 -0.24 1.05 2.02 0.18 -1.07 112.91 116.57 1zem h THR 168 Ca 0.43 -0.99 -0.04 0.00 0.77 0.00 0.00 66.41 66.58 1zem h THR 168 Cb 1.00 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1zem h THR 168 CO -0.16 0.37 -0.01 -0.33 0.37 0.00 0.00 175.52 175.76 1zem h GLU 169 N 0.95 0.43 -0.41 6.66 5.08 -0.56 -0.53 114.58 126.20 1zem h GLU 169 Ca 0.19 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1zem h GLU 169 Cb 0.41 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1zem h GLU 169 CO 0.01 0.61 0.21 1.15 -1.00 0.00 0.00 179.01 180.00 1zem h THR 170 N 0.19 1.16 -0.49 1.13 2.02 -1.18 -1.82 112.91 113.93 1zem h THR 170 Ca 0.07 -0.43 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 1zem h THR 170 Cb 0.43 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1zem h THR 170 CO 0.01 0.17 0.07 0.00 0.37 0.00 0.00 175.52 176.14 1zem h ALA 171 N 1.07 1.20 -0.72 6.16 0.00 -1.12 0.44 119.26 126.29 1zem h ALA 171 Ca 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1zem h ALA 171 Cb 0.08 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 1zem h ALA 171 CO -0.02 0.53 0.42 0.00 0.00 0.00 0.00 179.25 180.19 1zem h ALA 172 N 1.34 0.92 -0.18 0.00 0.00 -0.79 -1.14 119.26 119.42 1zem h ALA 172 Ca 0.15 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1zem h ALA 172 Cb 0.35 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1zem h ALA 172 CO 0.01 0.41 0.02 -0.07 0.00 0.00 0.00 179.25 179.61 1zem h LEU 173 N 0.99 0.29 -0.63 0.00 3.38 -0.72 -2.49 115.31 116.13 1zem h LEU 173 Ca 0.26 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1zem h LEU 173 Cb -0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1zem h LEU 173 CO -0.05 0.50 0.27 0.44 0.09 0.00 0.00 178.44 179.70 1zem h ASP 174 N 0.08 0.84 0.33 -0.43 3.45 -0.64 -3.22 116.42 116.84 1zem h ASP 174 Ca 0.05 -0.15 0.00 0.00 0.43 0.00 0.00 57.03 57.36 1zem h ASP 174 Cb 0.34 -0.22 0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1zem h ASP 174 CO 0.01 0.76 -0.52 0.18 -1.57 0.00 0.00 179.24 178.09 1zem n LEU 175 N -4.47 0.79 -0.08 1.55 4.77 -0.45 -4.41 117.00 114.69 1zem n LEU 175 Ca 0.04 -0.19 0.10 0.00 -0.03 0.00 0.00 56.01 55.93 1zem n LEU 175 Cb 0.15 -0.17 0.47 0.00 -2.33 0.00 0.00 43.42 41.54 1zem n LEU 175 CO 0.39 0.18 1.19 0.00 -1.33 0.00 0.00 177.39 177.81 1zem h ALA 176 N 3.21 1.92 0.00 -1.18 0.00 -1.45 -1.37 119.26 120.39 1zem h ALA 176 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1zem h ALA 176 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1zem h ALA 176 CO 0.00 -0.03 0.00 -2.30 0.00 0.00 0.00 179.25 176.92 1zem n PRO 177 N -4.47 0.05 -0.81 0.00 -0.02 -1.26 -2.79 135.00 125.70 1zem n PRO 177 Ca 0.09 0.33 -0.02 0.00 -2.02 0.00 0.00 63.50 61.88 1zem n PRO 177 Cb 0.30 -1.60 0.26 0.00 -0.02 0.00 0.00 33.50 32.44 1zem n PRO 177 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1zem n TYR 178 N -1.70 1.69 -3.47 6.00 4.02 -0.52 -4.94 117.16 118.25 1zem n TYR 178 Ca 0.03 -1.24 -0.18 0.00 -0.01 0.00 0.00 57.90 56.49 1zem n TYR 178 Cb 0.16 -0.54 0.08 0.00 -0.02 0.00 0.00 39.34 39.02 1zem n TYR 178 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1zem n ASN 179 N -0.56 -2.42 -4.20 7.72 5.15 -1.12 -3.03 115.26 116.80 1zem n ASN 179 Ca 0.34 -0.63 -0.23 0.00 -0.60 0.00 0.00 54.58 53.46 1zem n ASN 179 Cb 1.17 -5.03 -0.14 0.00 -0.53 0.00 0.00 39.78 35.25 1zem n ASN 179 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1zem s ILE 180 N -3.38 1.43 0.07 -1.44 1.01 -1.19 -2.04 121.20 115.67 1zem s ILE 180 Ca 0.06 -1.10 0.08 0.00 0.00 0.00 0.00 60.65 59.69 1zem s ILE 180 Cb -0.03 -1.26 -0.03 0.00 0.01 0.00 0.00 42.46 41.15 1zem s ILE 180 CO 0.74 0.13 -0.22 -0.13 0.00 0.00 0.00 174.94 175.46 1zem s ARG 181 N -1.13 1.31 -0.06 2.79 0.52 -0.81 -3.88 118.95 117.69 1zem s ARG 181 Ca 0.05 -1.06 -0.01 0.00 -0.52 0.00 0.00 55.73 54.19 1zem s ARG 181 Cb -0.08 -1.51 0.03 0.00 0.52 0.00 0.00 34.95 33.90 1zem s ARG 181 CO 0.01 0.37 -0.00 0.08 0.02 0.00 0.00 175.30 175.79 1zem s VAL 182 N -0.96 0.34 0.23 3.52 1.01 -1.26 -0.67 120.40 122.61 1zem s VAL 182 Ca 0.08 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1zem s VAL 182 Cb -0.09 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 1zem s VAL 182 CO 0.03 0.24 0.12 0.20 0.00 0.00 0.00 175.10 175.69 1zem s ASN 183 N 1.76 0.69 0.16 3.32 0.01 -0.43 0.26 114.94 120.70 1zem s ASN 183 Ca 0.01 -1.40 0.04 0.00 -0.71 0.00 0.00 52.86 50.81 1zem s ASN 183 Cb -0.13 0.28 -0.05 0.00 0.41 0.00 0.00 41.25 41.77 1zem s ASN 183 CO -0.04 -0.79 -0.08 0.00 -1.51 0.00 0.00 177.10 174.67 1zem s ALA 184 N -3.95 1.49 0.11 0.60 0.00 0.56 -1.03 121.76 119.54 1zem s ALA 184 Ca 0.38 -1.53 0.10 0.00 0.00 0.00 0.00 51.96 50.91 1zem s ALA 184 Cb 0.07 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 1zem s ALA 184 CO 0.13 -0.13 -0.25 0.96 0.00 0.00 0.00 175.76 176.47 1zem s ILE 185 N -3.36 2.09 -0.53 0.00 -4.36 -0.89 -0.92 121.20 113.23 1zem s ILE 185 Ca 0.19 -1.63 0.04 0.00 -0.26 0.00 0.00 60.65 58.99 1zem s ILE 185 Cb 0.03 -1.85 0.17 0.00 1.25 0.00 0.00 42.46 42.06 1zem s ILE 185 CO 0.02 0.11 0.40 -0.44 0.24 0.00 0.00 174.94 175.26 1zem s SER 186 N -1.85 2.86 0.49 4.36 0.01 0.02 0.19 113.70 119.78 1zem s SER 186 Ca 0.12 -3.35 -0.24 0.00 1.31 0.00 0.00 55.95 53.79 1zem s SER 186 Cb -0.10 -0.93 -0.07 0.00 0.21 0.00 0.00 66.02 65.13 1zem s SER 186 CO 0.05 -0.14 1.37 -2.65 0.41 0.00 0.00 173.24 172.28 1zem n PRO 187 N 2.54 1.97 0.00 12.44 -0.02 -1.26 -2.23 135.00 148.44 1zem n PRO 187 Ca 0.25 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 1zem n PRO 187 Cb 0.42 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 1zem n PRO 187 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zem n GLY 188 N 0.69 0.61 3.62 -1.23 0.00 -0.16 -1.27 105.19 107.46 1zem n GLY 188 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1zem n GLY 188 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1zem s TYR 189 N 2.33 3.22 -0.12 1.61 4.12 -1.26 -4.85 117.35 122.40 1zem s TYR 189 Ca 0.00 0.94 0.03 0.00 0.02 0.00 0.00 57.07 58.06 1zem s TYR 189 Cb 0.00 -3.24 0.01 0.00 -1.52 0.00 0.00 41.96 37.21 1zem s TYR 189 CO 0.00 -0.55 -0.22 -1.64 0.02 0.00 0.00 175.55 173.15 1zem s MET 190 N 3.01 2.96 0.35 -0.62 -1.94 -1.26 -0.22 119.30 121.58 1zem s MET 190 Ca 0.35 -0.84 -0.06 0.00 -1.71 0.00 0.00 55.69 53.42 1zem s MET 190 Cb -0.14 -2.31 0.01 0.00 2.01 0.00 0.00 34.83 34.40 1zem s MET 190 CO 0.12 0.08 0.55 0.20 -0.01 0.00 0.00 175.02 175.96 1zem s GLY 191 N 0.58 1.16 0.00 -0.03 0.00 0.12 -4.58 107.32 104.58 1zem s GLY 191 Ca -0.13 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.30 1zem s GLY 191 CO 0.04 -0.81 0.00 -1.55 0.00 0.00 0.00 173.10 170.78 1zem n PRO 192 N -0.55 2.18 0.00 2.90 -0.04 -1.26 -4.18 135.00 134.05 1zem n PRO 192 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1zem n PRO 192 Cb 0.61 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.07 1zem n PRO 192 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zem n GLY 193 N 5.00 0.62 0.02 0.55 0.00 -1.26 -4.77 105.19 105.35 1zem n GLY 193 Ca 0.00 -2.22 0.12 0.00 0.00 0.00 0.00 46.02 43.92 1zem n GLY 193 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1zem n PHE 194 N 0.83 0.19 0.08 1.61 1.16 -1.26 -2.30 117.46 117.77 1zem n PHE 194 Ca 0.00 0.06 -0.06 0.00 -1.87 0.00 0.00 57.45 55.57 1zem n PHE 194 Cb 0.00 -0.36 -0.06 0.00 -1.61 0.00 0.00 39.48 37.45 1zem n PHE 194 CO 0.00 0.00 0.00 1.98 -1.87 0.00 0.00 176.76 176.87 1zem h MET 195 N 0.00 0.01 0.08 3.97 4.05 -1.96 0.30 114.93 121.38 1zem h MET 195 Ca 0.00 -0.01 -0.27 0.00 -0.28 0.00 0.00 59.70 59.14 1zem h MET 195 Cb 0.62 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 31.44 1zem h MET 195 CO 0.00 0.93 -1.14 2.35 0.23 0.00 0.00 176.91 179.27 1zem h TRP 196 N 0.00 0.81 -0.22 1.39 2.91 -1.81 -2.55 115.95 116.49 1zem h TRP 196 Ca -0.01 -0.50 -0.10 0.00 1.13 0.00 0.00 58.89 59.41 1zem h TRP 196 Cb 1.63 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 30.20 1zem h TRP 196 CO 0.00 1.34 -0.31 0.93 -1.03 0.00 0.00 178.44 179.38 1zem h GLU 197 N 0.24 0.44 -0.16 2.65 4.39 -1.33 -1.57 114.58 119.23 1zem h GLU 197 Ca -0.14 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.37 1zem h GLU 197 Cb 1.81 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.43 1zem h GLU 197 CO 0.21 0.70 0.07 -0.09 -1.16 0.00 0.00 179.01 178.74 1zem h ARG 198 N 0.38 0.24 -0.26 2.33 2.43 -0.33 0.11 114.38 119.28 1zem h ARG 198 Ca 0.05 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1zem h ARG 198 Cb 0.73 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 1zem h ARG 198 CO 0.06 0.31 0.02 0.37 -1.51 0.00 0.00 179.97 179.22 1zem h GLN 199 N 0.12 0.11 -0.30 0.20 4.15 -1.18 0.44 115.11 118.65 1zem h GLN 199 Ca 0.06 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1zem h GLN 199 Cb 0.15 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1zem h GLN 199 CO -0.01 0.07 0.19 0.28 -1.93 0.00 0.00 178.83 177.44 1zem h VAL 200 N 0.11 1.08 -0.32 2.39 2.07 -1.03 -0.93 116.25 119.63 1zem h VAL 200 Ca 0.12 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1zem h VAL 200 Cb 0.14 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1zem h VAL 200 CO -0.18 0.08 0.06 1.05 0.02 0.00 0.00 177.57 178.60 1zem h GLU 201 N 0.40 0.51 -0.17 1.57 4.11 -0.46 -2.14 114.58 118.41 1zem h GLU 201 Ca 0.11 -0.13 -0.15 0.00 0.07 0.00 0.00 59.36 59.26 1zem h GLU 201 Cb -0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1zem h GLU 201 CO -0.02 0.59 -0.53 -0.07 0.07 0.00 0.00 179.01 179.05 1zem h LEU 202 N 0.35 0.54 -0.24 3.06 3.38 -0.85 -0.16 115.31 121.39 1zem h LEU 202 Ca 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1zem h LEU 202 Cb 0.32 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1zem h LEU 202 CO 0.00 0.97 0.08 1.56 0.09 0.00 0.00 178.44 181.14 1zem h GLN 203 N 0.38 0.38 -0.80 1.13 1.08 -1.15 -2.62 115.11 113.50 1zem h GLN 203 Ca 0.01 -0.08 0.07 0.00 -1.45 0.00 0.00 58.65 57.20 1zem h GLN 203 Cb 1.05 -0.06 -0.06 0.00 -0.05 0.00 0.00 27.48 28.37 1zem h GLN 203 CO 0.10 0.45 0.47 0.00 -0.95 0.00 0.00 178.83 178.90 1zem h ALA 204 N 0.91 1.11 -0.42 3.87 0.00 -1.13 -1.86 119.26 121.74 1zem h ALA 204 Ca 0.08 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1zem h ALA 204 Cb 0.23 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1zem h ALA 204 CO -0.00 0.16 0.28 -0.22 0.00 0.00 0.00 179.25 179.47 1zem h LYS 205 N 0.84 0.47 -0.35 0.00 3.64 -0.81 -2.77 116.57 117.60 1zem h LYS 205 Ca 0.36 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 1zem h LYS 205 Cb 0.24 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1zem h LYS 205 CO -0.20 0.31 -0.09 0.28 -2.27 0.00 0.00 179.45 177.48 1zem h VAL 206 N 0.49 1.23 -2.46 2.00 2.07 -0.97 -3.47 116.25 115.15 1zem h VAL 206 Ca 0.17 -1.02 -0.21 0.00 0.82 0.00 0.00 66.70 66.45 1zem h VAL 206 Cb 0.07 1.07 0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1zem h VAL 206 CO -0.04 0.34 -0.31 0.61 0.02 0.00 0.00 177.57 178.19 1zem n GLY 207 N -0.63 0.04 3.93 2.17 0.00 -1.05 -5.02 105.19 104.64 1zem n GLY 207 Ca 0.01 -0.32 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 1zem n GLY 207 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zem s SER 208 N -2.81 4.24 0.08 1.61 1.04 -1.26 -4.95 113.70 111.64 1zem s SER 208 Ca 0.14 0.43 0.21 0.00 0.48 0.00 0.00 55.95 57.21 1zem s SER 208 Cb -0.06 -0.85 0.84 0.00 0.10 0.00 0.00 66.02 66.05 1zem s SER 208 CO 0.18 -2.01 1.64 0.00 0.98 0.00 0.00 173.24 174.03 1zem n GLN 209 N -3.25 0.07 0.17 4.02 10.64 -1.26 -3.41 117.38 124.36 1zem n GLN 209 Ca 0.11 0.23 0.13 0.00 -1.83 0.00 0.00 57.00 55.64 1zem n GLN 209 Cb 0.60 -1.61 0.33 0.00 -0.86 0.00 0.00 30.24 28.70 1zem n GLN 209 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.06 177.11 1zem h TYR 210 N 0.00 0.00 -3.83 2.61 0.05 -1.99 -3.46 116.97 110.35 1zem h TYR 210 Ca 0.00 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 1zem h TYR 210 Cb 0.37 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 37.98 1zem h TYR 210 CO 0.00 0.00 -0.32 -0.06 -1.05 0.00 0.00 178.16 176.73 1zem s PHE 211 N -3.21 0.28 0.87 4.88 0.40 -1.22 -5.08 117.98 114.92 1zem s PHE 211 Ca 0.08 -0.67 -0.11 0.00 -0.60 0.00 0.00 56.93 55.63 1zem s PHE 211 Cb 0.09 -0.03 0.12 0.00 0.51 0.00 0.00 43.02 43.70 1zem s PHE 211 CO 0.61 -0.67 1.10 0.45 0.70 0.00 0.00 175.22 177.41 1zem s SER 212 N -2.93 3.55 0.00 1.36 0.15 -1.26 -4.51 113.70 110.07 1zem s SER 212 Ca 0.13 1.75 0.25 0.00 0.70 0.00 0.00 55.95 58.78 1zem s SER 212 Cb 0.04 -2.39 0.55 0.00 -1.71 0.00 0.00 66.02 62.50 1zem s SER 212 CO -0.04 -2.63 1.43 0.35 1.20 0.00 0.00 173.24 173.56 1zem n THR 213 N -3.90 0.00 -3.32 6.45 -2.24 -1.26 -4.37 114.28 105.64 1zem n THR 213 Ca 0.08 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.35 1zem n THR 213 Cb 0.54 0.49 -0.09 0.00 -2.10 0.00 0.00 70.33 69.17 1zem n THR 213 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1zem s ASP 214 N -2.66 6.23 0.31 3.42 3.68 -1.26 -4.64 116.67 121.74 1zem s ASP 214 Ca 0.19 -0.26 0.07 0.00 2.13 0.00 0.00 52.55 54.67 1zem s ASP 214 Cb 0.18 -2.23 0.81 0.00 -1.45 0.00 0.00 42.92 40.24 1zem s ASP 214 CO 0.60 -0.45 1.71 -0.65 0.13 0.00 0.00 175.17 176.51 1zem h PRO 215 N 8.53 0.47 -0.81 4.34 0.11 -1.86 0.21 132.00 142.98 1zem h PRO 215 Ca -0.28 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.78 1zem h PRO 215 Cb 1.13 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1zem h PRO 215 CO 0.75 0.31 0.42 0.87 -0.21 0.00 0.00 178.00 180.14 1zem h LYS 216 N 0.48 1.14 -0.04 1.05 1.57 -1.94 -2.01 116.57 116.82 1zem h LYS 216 Ca 0.60 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 59.08 1zem h LYS 216 Cb 1.16 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 1zem h LYS 216 CO -0.51 0.85 -0.69 0.28 -0.57 0.00 0.00 179.45 178.82 1zem h VAL 217 N 1.14 1.43 -0.04 0.50 2.07 -1.42 -3.11 116.25 116.82 1zem h VAL 217 Ca 0.28 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1zem h VAL 217 Cb 0.06 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 1zem h VAL 217 CO -0.04 0.64 0.03 0.58 0.02 0.00 0.00 177.57 178.80 1zem h VAL 218 N 0.13 1.01 -0.77 2.57 2.07 -0.60 0.46 116.25 121.11 1zem h VAL 218 Ca -0.02 -0.02 0.14 0.00 0.82 0.00 0.00 66.70 67.63 1zem h VAL 218 Cb 1.22 0.95 -0.10 0.00 -1.52 0.00 0.00 31.29 31.85 1zem h VAL 218 CO 0.10 0.01 0.32 0.00 0.02 0.00 0.00 177.57 178.02 1zem h ALA 219 N 1.02 1.09 -0.18 1.67 0.00 -1.37 0.89 119.26 122.37 1zem h ALA 219 Ca 0.02 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1zem h ALA 219 Cb -0.01 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1zem h ALA 219 CO -0.00 -0.20 -0.39 1.96 0.00 0.00 0.00 179.25 180.61 1zem h GLN 220 N 0.47 0.41 -0.39 0.00 4.20 -1.24 -1.48 115.11 117.08 1zem h GLN 220 Ca 0.42 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.85 1zem h GLN 220 Cb 0.64 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1zem h GLN 220 CO -0.40 0.75 -0.09 1.96 -0.67 0.00 0.00 178.83 180.37 1zem h GLN 221 N 0.35 0.75 -0.02 1.46 4.20 0.54 0.30 115.11 122.68 1zem h GLN 221 Ca 0.03 -0.29 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 1zem h GLN 221 Cb 0.85 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 1zem h GLN 221 CO 0.07 0.89 0.01 0.52 -0.67 0.00 0.00 178.83 179.65 1zem h MET 222 N 0.55 0.03 -0.54 1.46 2.86 -0.74 -1.60 114.93 116.96 1zem h MET 222 Ca 0.10 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1zem h MET 222 Cb 0.61 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.24 1zem h MET 222 CO 0.04 0.10 0.23 0.82 1.06 0.00 0.00 176.91 179.15 1zem h ILE 223 N -0.04 1.19 0.00 -1.22 2.04 -1.15 -2.14 117.51 116.19 1zem h ILE 223 Ca 0.01 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1zem h ILE 223 Cb 0.07 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1zem h ILE 223 CO -0.00 0.23 0.00 1.23 0.00 0.00 0.00 178.15 179.61 1zem h GLY 224 N 0.89 0.00 0.98 5.37 0.00 0.07 -1.89 103.07 108.48 1zem h GLY 224 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1zem h GLY 224 CO -0.02 0.00 -0.26 -1.14 0.00 0.00 0.00 176.54 175.12 1zem n SER 225 N -2.59 0.52 -4.68 0.19 3.41 -0.64 -4.81 113.62 105.01 1zem n SER 225 Ca 0.01 -0.35 -0.40 0.00 -0.26 0.00 0.00 58.87 57.88 1zem n SER 225 Cb 0.25 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.15 1zem n SER 225 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1zem s VAL 226 N -2.75 5.05 0.25 -3.33 1.01 -0.71 -4.98 120.40 114.95 1zem s VAL 226 Ca 0.19 1.20 -0.03 0.00 0.00 0.00 0.00 61.98 63.34 1zem s VAL 226 Cb 0.19 -3.94 0.24 0.00 0.00 0.00 0.00 36.38 32.86 1zem s VAL 226 CO 0.57 0.16 1.85 -0.65 0.00 0.00 0.00 175.10 177.04 1zem h PRO 227 N 7.25 0.97 0.00 2.72 0.11 -1.84 0.37 132.00 141.58 1zem h PRO 227 Ca -0.34 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1zem h PRO 227 Cb 1.16 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1zem h PRO 227 CO 0.77 0.64 0.00 -1.33 -0.21 0.00 0.00 178.00 177.87 1zem n MET 228 N -4.61 0.44 -3.82 1.05 2.81 -0.45 -4.90 117.12 107.64 1zem n MET 228 Ca 0.14 0.04 -0.24 0.00 -1.81 0.00 0.00 57.70 55.83 1zem n MET 228 Cb 0.22 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.24 1zem n MET 228 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1zem n ARG 229 N -1.10 -3.68 -3.59 0.03 5.12 0.13 -4.99 116.66 108.57 1zem n ARG 229 Ca 0.11 0.50 -0.08 0.00 -1.93 0.00 0.00 57.85 56.45 1zem n ARG 229 Cb 0.09 -4.74 -0.05 0.00 -1.16 0.00 0.00 32.46 26.60 1zem n ARG 229 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 1zem s ARG 230 N -6.25 0.46 0.62 5.56 1.70 -1.25 -4.94 118.95 114.85 1zem s ARG 230 Ca 0.05 0.09 -0.12 0.00 -0.47 0.00 0.00 55.73 55.28 1zem s ARG 230 Cb -0.02 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.55 1zem s ARG 230 CO 0.86 -0.15 1.03 1.52 -1.08 0.00 0.00 175.30 177.48 1zem s TYR 231 N -1.20 3.43 0.35 5.89 -0.85 -1.26 -4.92 117.35 118.79 1zem s TYR 231 Ca 0.01 1.36 -0.20 0.00 -0.52 0.00 0.00 57.07 57.73 1zem s TYR 231 Cb -0.01 -2.79 -0.10 0.00 0.38 0.00 0.00 41.96 39.45 1zem s TYR 231 CO -0.01 -0.82 0.86 0.20 -1.52 0.00 0.00 175.55 174.26 1zem s GLY 232 N -3.85 2.48 0.20 5.49 0.00 0.69 -4.70 107.32 107.64 1zem s GLY 232 Ca 0.57 0.29 -0.24 0.00 0.00 0.00 0.00 44.72 45.33 1zem s GLY 232 CO 0.50 0.59 0.79 -0.35 0.00 0.00 0.00 173.10 174.63 1zem s ASP 233 N -2.03 7.32 0.48 1.64 -1.08 -1.26 -0.70 116.67 121.04 1zem s ASP 233 Ca 0.55 1.63 0.24 0.00 -0.52 0.00 0.00 52.55 54.45 1zem s ASP 233 Cb -0.12 -2.50 1.28 0.00 -1.46 0.00 0.00 42.92 40.12 1zem s ASP 233 CO 0.17 0.14 1.90 0.40 0.52 0.00 0.00 175.17 178.30 1zem h ILE 234 N 3.10 0.65 0.00 4.11 1.08 -1.93 0.68 117.51 125.20 1zem h ILE 234 Ca -0.47 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.93 1zem h ILE 234 Cb 1.20 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.39 1zem h ILE 234 CO 0.66 0.04 0.00 0.59 -0.69 0.00 0.00 178.15 178.74 1zem n ASN 235 N -4.40 0.00 -0.84 1.72 4.13 -1.26 -1.96 115.26 112.65 1zem n ASN 235 Ca 0.17 -0.29 0.07 0.00 1.68 0.00 0.00 54.58 56.21 1zem n ASN 235 Cb 0.76 -0.14 0.20 0.00 -1.54 0.00 0.00 39.78 39.05 1zem n ASN 235 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1zem n GLU 236 N -1.14 2.09 -0.10 3.52 1.02 0.24 -4.08 120.64 122.18 1zem n GLU 236 Ca 0.12 -1.60 -0.15 0.00 -0.02 0.00 0.00 57.16 55.51 1zem n GLU 236 Cb 0.11 -1.38 -0.09 0.00 -0.02 0.00 0.00 31.44 30.06 1zem n GLU 236 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1zem n ILE 237 N 0.76 1.17 -0.28 -3.67 5.41 -0.83 -4.65 119.36 117.27 1zem n ILE 237 Ca 0.15 -0.42 0.09 0.00 1.00 0.00 0.00 62.75 63.56 1zem n ILE 237 Cb 0.39 -1.30 0.24 0.00 -0.71 0.00 0.00 39.64 38.26 1zem n ILE 237 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1zem h PRO 238 N -0.12 0.37 -0.05 0.38 0.11 -1.71 -0.75 132.00 130.22 1zem h PRO 238 Ca -0.47 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1zem h PRO 238 Cb 1.67 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.69 1zem h PRO 238 CO -0.11 0.24 -0.02 0.78 -0.21 0.00 0.00 178.00 178.68 1zem h GLY 239 N 0.38 0.08 0.65 -0.55 0.00 -1.84 -0.65 103.07 101.14 1zem h GLY 239 Ca 0.48 -0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.73 1zem h GLY 239 CO -0.49 0.03 -0.13 -2.08 0.00 0.00 0.00 176.54 173.87 1zem h VAL 240 N 0.08 1.39 -0.62 4.60 2.07 -1.41 -0.26 116.25 122.10 1zem h VAL 240 Ca 0.02 -1.37 0.03 0.00 0.82 0.00 0.00 66.70 66.20 1zem h VAL 240 Cb 0.09 2.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 1zem h VAL 240 CO 0.00 0.39 0.38 0.58 0.02 0.00 0.00 177.57 178.94 1zem h VAL 241 N -0.20 1.07 -0.53 2.57 2.07 -1.24 0.33 116.25 120.32 1zem h VAL 241 Ca 0.01 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1zem h VAL 241 Cb 0.69 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 1zem h VAL 241 CO 0.03 0.13 0.04 0.00 0.02 0.00 0.00 177.57 177.80 1zem h ALA 242 N 1.27 1.08 -0.36 1.67 0.00 -1.02 -1.13 119.26 120.77 1zem h ALA 242 Ca 0.25 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1zem h ALA 242 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1zem h ALA 242 CO -0.11 0.59 0.22 0.35 0.00 0.00 0.00 179.25 180.30 1zem h PHE 243 N 0.81 0.48 0.00 0.00 3.57 -0.11 -0.22 116.94 121.48 1zem h PHE 243 Ca 0.16 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1zem h PHE 243 Cb 0.42 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 1zem h PHE 243 CO 0.02 0.35 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.32 1zem h LEU 244 N 0.47 0.00 0.00 0.59 3.38 -0.32 -2.66 115.31 116.78 1zem h LEU 244 Ca 0.13 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.91 1zem h LEU 244 Cb 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1zem h LEU 244 CO -0.02 0.07 -1.63 0.18 0.09 0.00 0.00 178.44 177.12 1zem n LEU 245 N -3.38 0.67 -4.95 1.67 4.77 -0.49 -4.83 117.00 110.46 1zem n LEU 245 Ca -0.01 0.30 -0.27 0.00 -0.03 0.00 0.00 56.01 55.99 1zem n LEU 245 Cb 0.22 0.14 0.13 0.00 -2.33 0.00 0.00 43.42 41.58 1zem n LEU 245 CO 0.27 0.21 0.72 -0.83 -1.33 0.00 0.00 177.39 176.42 1zem s GLY 246 N -4.90 1.74 0.01 -0.72 0.00 -0.13 -4.87 107.32 98.45 1zem s GLY 246 Ca -0.05 -1.25 0.16 0.00 0.00 0.00 0.00 44.72 43.58 1zem s GLY 246 CO 0.82 -0.64 1.52 1.22 0.00 0.00 0.00 173.10 176.02 1zem n ASP 247 N -3.27 0.02 0.26 1.64 8.00 -1.26 -2.48 116.55 119.46 1zem n ASP 247 Ca 0.13 0.51 0.15 0.00 0.71 0.00 0.00 54.79 56.29 1zem n ASP 247 Cb 0.60 -0.51 0.58 0.00 -0.02 0.00 0.00 41.12 41.77 1zem n ASP 247 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1zem h ASP 248 N 0.00 0.00 -0.72 -2.24 3.32 -1.94 -2.35 116.42 112.49 1zem h ASP 248 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 1zem h ASP 248 Cb 0.28 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 39.65 1zem h ASP 248 CO 0.00 0.04 0.32 -1.54 -1.72 0.00 0.00 179.24 176.34 1zem n SER 249 N -3.14 3.89 0.06 6.45 3.41 -1.04 -4.75 113.62 118.50 1zem n SER 249 Ca 0.01 -3.46 0.21 0.00 -0.26 0.00 0.00 58.87 55.37 1zem n SER 249 Cb 0.36 -0.74 0.74 0.00 -0.26 0.00 0.00 64.21 64.30 1zem n SER 249 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1zem h SER 250 N 1.66 0.00 -0.37 4.04 4.64 -1.57 -0.66 113.55 121.30 1zem h SER 250 Ca 0.37 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.60 1zem h SER 250 Cb 2.33 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.37 1zem h SER 250 CO 0.76 0.00 0.03 0.33 -0.87 0.00 0.00 176.83 177.09 1zem n PHE 251 N -3.83 1.26 -4.35 4.77 7.35 -1.26 -4.95 117.46 116.44 1zem n PHE 251 Ca 0.09 -1.13 -0.33 0.00 -0.76 0.00 0.00 57.45 55.32 1zem n PHE 251 Cb 0.65 -0.43 -0.16 0.00 0.35 0.00 0.00 39.48 39.89 1zem n PHE 251 CO 0.00 0.00 0.00 -1.64 -0.76 0.00 0.00 176.76 174.36 1zem s MET 252 N -2.97 3.06 -0.03 -4.13 -1.94 -0.25 -5.10 119.30 107.93 1zem s MET 252 Ca 0.45 -0.81 -0.22 0.00 -1.71 0.00 0.00 55.69 53.40 1zem s MET 252 Cb 0.38 -2.57 0.04 0.00 2.01 0.00 0.00 34.83 34.69 1zem s MET 252 CO 0.07 -0.11 0.47 -0.08 -0.01 0.00 0.00 175.02 175.37 1zem s THR 253 N 1.07 0.03 -0.06 2.05 -1.32 -1.26 -4.74 115.64 111.41 1zem s THR 253 Ca -0.01 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.21 1zem s THR 253 Cb -0.14 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 1zem s THR 253 CO -0.07 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.81 1zem n GLY 254 N 1.16 0.45 3.84 6.08 0.00 0.14 -4.96 105.19 111.91 1zem n GLY 254 Ca -0.20 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 1zem n GLY 254 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zem s VAL 255 N -1.87 4.77 -0.15 1.61 -7.23 -1.26 -4.72 120.40 111.55 1zem s VAL 255 Ca 0.00 -0.88 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1zem s VAL 255 Cb 0.00 -3.42 0.02 0.00 0.56 0.00 0.00 36.38 33.54 1zem s VAL 255 CO 0.00 -0.05 -0.18 0.21 -0.31 0.00 0.00 175.10 174.77 1zem s ASN 256 N -2.99 2.87 -0.36 4.85 3.04 -1.26 -0.32 114.94 120.77 1zem s ASN 256 Ca 0.32 -0.55 -0.12 0.00 0.04 0.00 0.00 52.86 52.55 1zem s ASN 256 Cb -0.11 -1.31 0.01 0.00 -1.54 0.00 0.00 41.25 38.30 1zem s ASN 256 CO 0.25 -0.00 0.21 -0.76 -3.04 0.00 0.00 177.10 173.76 1zem s LEU 257 N 1.23 4.58 0.26 3.21 1.02 -0.10 -4.92 118.68 123.96 1zem s LEU 257 Ca 0.01 -0.75 -0.30 0.00 0.02 0.00 0.00 54.13 53.12 1zem s LEU 257 Cb -0.14 -2.06 -0.09 0.00 0.02 0.00 0.00 46.19 43.92 1zem s LEU 257 CO -0.08 -0.32 1.26 -2.84 0.02 0.00 0.00 176.35 174.39 1zem s PRO 258 N 1.62 4.43 -0.59 1.29 0.02 -1.26 -0.80 135.00 139.71 1zem s PRO 258 Ca 0.04 2.05 0.05 0.00 0.02 0.00 0.00 61.00 63.16 1zem s PRO 258 Cb -0.18 -3.15 0.18 0.00 0.02 0.00 0.00 34.50 31.36 1zem s PRO 258 CO 0.08 -0.13 0.46 -0.89 -0.33 0.00 0.00 177.00 176.18 1zem n ILE 259 N 1.74 0.63 -0.69 2.83 5.41 -0.95 -4.87 119.36 123.46 1zem n ILE 259 Ca 0.03 -4.37 0.00 0.00 1.00 0.00 0.00 62.75 59.41 1zem n ILE 259 Cb 0.43 -1.99 0.00 0.00 -0.71 0.00 0.00 39.64 37.37 1zem n ILE 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1zem n ALA 260 N 2.18 0.99 -1.02 -1.39 0.00 -1.26 -0.99 120.51 119.03 1zem n ALA 260 Ca 0.24 -0.35 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 1zem n ALA 260 Cb 0.40 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.85 1zem n ALA 260 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zem n GLY 261 N -0.06 0.47 0.00 0.00 0.00 -1.26 -4.73 105.19 99.61 1zem n GLY 261 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1zem n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93