#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c4o n GLY 2 N 0.00 -1.59 3.29 0.00 0.00 -1.26 -4.96 105.19 100.67 3c4o n GLY 2 Ca 0.00 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 3c4o n GLY 2 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3c4o n VAL 3 N -1.94 0.00 -1.88 1.61 0.24 -1.26 -4.90 118.33 110.19 3c4o n VAL 3 Ca -0.00 -0.99 -0.41 0.00 -2.04 0.00 0.00 64.34 60.90 3c4o n VAL 3 Cb 0.11 -1.39 -0.00 0.00 -1.47 0.00 0.00 33.84 31.09 3c4o n VAL 3 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 3c4o s MET 4 N -5.24 4.12 0.15 7.34 0.00 -0.41 -4.93 119.30 120.33 3c4o s MET 4 Ca 0.62 2.47 -0.00 0.00 0.00 0.00 0.00 55.69 58.78 3c4o s MET 4 Cb -0.02 -2.96 -0.04 0.00 0.00 0.00 0.00 34.83 31.81 3c4o s MET 4 CO 0.43 -0.48 0.06 0.95 0.00 0.00 0.00 175.02 175.98 3c4o s THR 5 N -1.14 0.20 0.31 10.11 -4.23 -1.26 -4.17 115.64 115.47 3c4o s THR 5 Ca 0.53 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 59.09 3c4o s THR 5 Cb -0.45 -2.15 0.25 0.00 1.34 0.00 0.00 72.50 71.49 3c4o s THR 5 CO 0.60 -0.38 1.96 1.23 -0.54 0.00 0.00 174.62 177.49 3c4o h GLY 6 N 2.78 1.04 0.98 3.99 0.00 -1.93 -0.79 103.07 109.14 3c4o h GLY 6 Ca -0.36 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.55 3c4o h GLY 6 CO 0.59 0.40 0.25 0.00 0.00 0.00 0.00 176.54 177.78 3c4o h ALA 7 N 1.50 0.54 -0.52 3.60 0.00 -1.96 -0.76 119.26 121.66 3c4o h ALA 7 Ca 0.26 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 3c4o h ALA 7 Cb -0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3c4o h ALA 7 CO -0.05 0.04 -0.09 0.87 0.00 0.00 0.00 179.25 180.02 3c4o h LYS 8 N 0.55 0.94 -0.74 0.00 1.57 -1.85 -1.78 116.57 115.27 3c4o h LYS 8 Ca 0.15 -0.33 0.02 0.00 -1.87 0.00 0.00 60.65 58.62 3c4o h LYS 8 Cb 0.02 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 3c4o h LYS 8 CO -0.03 0.99 0.48 0.35 -0.57 0.00 0.00 179.45 180.67 3c4o h PHE 9 N 0.85 0.91 -0.23 -1.35 3.57 -0.72 -1.25 116.94 118.72 3c4o h PHE 9 Ca 0.14 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 3c4o h PHE 9 Cb 0.62 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3c4o h PHE 9 CO 0.04 0.55 -0.41 1.15 -2.23 0.00 0.00 178.31 177.41 3c4o h THR 10 N 0.97 1.30 -0.03 4.41 2.02 -0.98 -2.96 112.91 117.64 3c4o h THR 10 Ca 0.28 -1.57 -0.12 0.00 0.77 0.00 0.00 66.41 65.77 3c4o h THR 10 Cb -0.06 1.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 3c4o h THR 10 CO -0.08 0.49 -0.52 -0.61 0.37 0.00 0.00 175.52 175.18 3c4o h GLN 11 N 0.44 0.08 -6.68 6.66 4.15 -0.91 -3.43 115.11 115.42 3c4o h GLN 11 Ca 0.04 -0.05 -0.52 0.00 0.77 0.00 0.00 58.65 58.89 3c4o h GLN 11 Cb 0.90 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.61 3c4o h GLN 11 CO 0.08 0.58 0.50 0.42 -1.93 0.00 0.00 178.83 178.48 3c4o s ILE 12 N -3.87 3.71 0.10 2.39 1.01 -0.51 -5.03 121.20 118.99 3c4o s ILE 12 Ca -0.03 1.50 0.06 0.00 0.00 0.00 0.00 60.65 62.19 3c4o s ILE 12 Cb 0.13 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.61 3c4o s ILE 12 CO 0.76 0.27 -0.17 -1.10 0.00 0.00 0.00 174.94 174.70 3c4o s GLN 13 N -0.51 0.99 0.37 2.79 -0.21 -1.26 -4.94 119.66 116.88 3c4o s GLN 13 Ca 0.50 -1.11 -0.27 0.00 0.02 0.00 0.00 55.36 54.50 3c4o s GLN 13 Cb -0.31 -1.06 -0.12 0.00 1.00 0.00 0.00 33.01 32.53 3c4o s GLN 13 CO 0.37 0.23 1.21 1.19 -2.12 0.00 0.00 175.29 176.17 3c4o n PHE 14 N 1.01 1.96 -0.04 0.91 3.01 -1.26 -2.19 117.46 120.85 3c4o n PHE 14 Ca -0.19 0.56 0.00 0.00 1.01 0.00 0.00 57.45 58.83 3c4o n PHE 14 Cb 0.55 -2.36 0.00 0.00 -0.01 0.00 0.00 39.48 37.66 3c4o n PHE 14 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c4o n GLY 15 N 0.89 0.73 3.82 1.37 0.00 -0.20 -4.89 105.19 106.91 3c4o n GLY 15 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 3c4o n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c4o s MET 16 N -0.75 3.71 0.69 1.61 -1.94 -0.93 -4.53 119.30 117.17 3c4o s MET 16 Ca 0.00 1.11 -0.09 0.00 -1.71 0.00 0.00 55.69 55.00 3c4o s MET 16 Cb 0.00 -2.09 0.03 0.00 2.01 0.00 0.00 34.83 34.78 3c4o s MET 16 CO 0.00 -0.48 1.04 0.95 -0.01 0.00 0.00 175.02 176.52 3c4o s THR 17 N -2.46 3.02 0.20 2.05 -4.23 -1.26 -0.48 115.64 112.48 3c4o s THR 17 Ca 0.62 0.11 -0.11 0.00 -1.18 0.00 0.00 61.69 61.12 3c4o s THR 17 Cb -0.13 -3.29 0.12 0.00 1.34 0.00 0.00 72.50 70.55 3c4o s THR 17 CO 0.31 -0.34 1.74 0.03 -0.54 0.00 0.00 174.62 175.82 3c4o h ARG 18 N -0.58 0.35 -0.57 3.99 3.08 -1.78 -2.07 114.38 116.80 3c4o h ARG 18 Ca -0.45 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.54 3c4o h ARG 18 Cb 1.28 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 3c4o h ARG 18 CO 0.63 0.23 0.20 0.37 -1.07 0.00 0.00 179.97 180.33 3c4o h GLN 19 N 0.36 0.83 -0.61 0.04 5.75 -1.94 -1.11 115.11 118.43 3c4o h GLN 19 Ca 0.27 -0.14 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 3c4o h GLN 19 Cb 0.33 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 3c4o h GLN 19 CO -0.29 0.70 0.26 1.96 -2.65 0.00 0.00 178.83 178.81 3c4o h GLN 20 N 0.82 0.90 -0.08 1.69 4.20 -1.81 -0.99 115.11 119.83 3c4o h GLN 20 Ca 0.19 -0.15 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 3c4o h GLN 20 Cb 0.20 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 3c4o h GLN 20 CO -0.01 0.75 0.04 0.28 -0.67 0.00 0.00 178.83 179.22 3c4o h VAL 21 N 0.84 1.11 -0.88 -0.54 2.07 -0.88 -2.67 116.25 115.31 3c4o h VAL 21 Ca 0.21 -0.33 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 3c4o h VAL 21 Cb 0.17 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 3c4o h VAL 21 CO -0.02 0.10 0.53 -0.07 0.02 0.00 0.00 177.57 178.13 3c4o h LEU 22 N 0.01 1.05 -0.84 2.57 3.38 -1.07 0.25 115.31 120.67 3c4o h LEU 22 Ca 0.03 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 3c4o h LEU 22 Cb 0.12 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3c4o h LEU 22 CO -0.00 0.81 0.26 0.44 0.09 0.00 0.00 178.44 180.04 3c4o h ASP 23 N 1.21 1.04 0.01 -0.43 3.32 -1.06 0.05 116.42 120.56 3c4o h ASP 23 Ca 0.32 -0.17 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 3c4o h ASP 23 Cb -0.05 -0.27 0.01 0.00 0.22 0.00 0.00 39.33 39.24 3c4o h ASP 23 CO -0.06 0.94 -0.35 0.40 -1.72 0.00 0.00 179.24 178.45 3c4o h ILE 24 N 1.08 1.54 -0.31 0.35 2.04 -1.12 -3.35 117.51 117.74 3c4o h ILE 24 Ca 0.24 -2.05 -0.11 0.00 1.00 0.00 0.00 64.86 63.94 3c4o h ILE 24 Cb 0.25 2.81 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 3c4o h ILE 24 CO -0.01 0.57 -0.26 0.00 0.00 0.00 0.00 178.15 178.44 3c4o h ALA 25 N 0.24 0.96 -0.44 1.87 0.00 -0.90 -3.48 119.26 117.51 3c4o h ALA 25 Ca -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3c4o h ALA 25 Cb 1.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3c4o h ALA 25 CO 0.07 0.60 0.00 0.41 0.00 0.00 0.00 179.25 180.33 3c4o n GLY 26 N -0.26 -0.04 0.35 0.00 0.00 -0.01 -4.51 105.19 100.72 3c4o n GLY 26 Ca -0.00 -0.88 0.17 0.00 0.00 0.00 0.00 46.02 45.31 3c4o n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c4o h ALA 27 N 0.00 2.37 0.00 4.61 0.00 -1.87 0.25 119.26 124.62 3c4o h ALA 27 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3c4o h ALA 27 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3c4o h ALA 27 CO 0.00 -0.49 0.00 -0.85 0.00 0.00 0.00 179.25 177.91 3c4o n GLU 28 N -4.41 0.16 0.00 0.00 0.00 -1.26 -1.55 120.64 113.59 3c4o n GLU 28 Ca 0.07 0.38 0.12 0.00 0.00 0.00 0.00 57.16 57.72 3c4o n GLU 28 Cb 0.48 -1.79 0.22 0.00 0.00 0.00 0.00 31.44 30.34 3c4o n GLU 28 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3c4o n ASN 29 N -2.09 0.78 -4.59 -1.84 3.02 0.08 -4.99 115.26 105.62 3c4o n ASN 29 Ca 0.03 -0.58 -0.26 0.00 -0.03 0.00 0.00 54.58 53.74 3c4o n ASN 29 Cb 0.23 0.34 -0.09 0.00 -0.61 0.00 0.00 39.78 39.65 3c4o n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c4o s GLU 31 N -3.10 0.73 0.23 0.00 -1.05 -0.11 -4.97 118.70 110.44 3c4o s GLU 31 Ca 0.27 -0.71 -0.04 0.00 -0.15 0.00 0.00 54.97 54.34 3c4o s GLU 31 Cb -0.08 0.30 -0.03 0.00 -0.44 0.00 0.00 34.13 33.89 3c4o s GLU 31 CO 0.17 -0.22 0.27 -0.08 0.95 0.00 0.00 175.26 176.35 3c4o s THR 32 N -2.88 0.00 0.02 1.83 -1.32 -1.26 -1.01 115.64 111.02 3c4o s THR 32 Ca -0.03 -1.79 0.00 0.00 -1.21 0.00 0.00 61.69 58.67 3c4o s THR 32 Cb 0.00 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.58 3c4o s THR 32 CO -0.06 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 3c4o n GLY 33 N -0.34 -1.78 7.00 6.08 0.00 0.20 -4.87 105.19 111.47 3c4o n GLY 33 Ca 0.01 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.73 3c4o n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c4o n GLY 34 N -0.36 3.46 0.33 -0.02 0.00 -1.26 -0.92 105.19 106.42 3c4o n GLY 34 Ca 0.00 0.04 0.22 0.00 0.00 0.00 0.00 46.02 46.28 3c4o n GLY 34 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3c4o h SER 35 N 0.00 0.00 -0.37 1.61 0.02 -2.02 -2.99 113.55 109.80 3c4o h SER 35 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3c4o h SER 35 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3c4o h SER 35 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 3c4o n PHE 36 N -3.10 0.48 -3.12 3.45 3.01 -0.09 -5.06 117.46 113.04 3c4o n PHE 36 Ca -0.02 -0.38 0.00 0.00 1.01 0.00 0.00 57.45 58.05 3c4o n PHE 36 Cb 0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 3c4o n PHE 36 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c4o n GLY 37 N 0.88 2.67 1.31 1.37 0.00 -1.13 -1.50 105.19 108.78 3c4o n GLY 37 Ca 0.14 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.92 3c4o n GLY 37 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3c4o n ASP 38 N 0.79 3.82 -4.91 1.61 5.68 -1.26 0.61 116.55 122.90 3c4o n ASP 38 Ca 0.00 -2.44 -0.28 0.00 -0.50 0.00 0.00 54.79 51.57 3c4o n ASP 38 Cb 0.00 -0.54 0.03 0.00 -1.14 0.00 0.00 41.12 39.47 3c4o n ASP 38 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3c4o s SER 39 N -0.69 5.69 -0.17 -1.12 0.01 -0.56 -4.68 113.70 112.18 3c4o s SER 39 Ca 0.37 0.85 -0.03 0.00 1.31 0.00 0.00 55.95 58.45 3c4o s SER 39 Cb 0.26 -1.85 -0.02 0.00 0.21 0.00 0.00 66.02 64.61 3c4o s SER 39 CO 0.15 -1.03 -0.07 -0.63 0.41 0.00 0.00 173.24 172.07 3c4o s ILE 40 N -3.03 3.46 -0.17 1.44 1.01 -0.27 -4.24 121.20 119.41 3c4o s ILE 40 Ca 0.54 -0.50 0.02 0.00 0.00 0.00 0.00 60.65 60.70 3c4o s ILE 40 Cb -0.11 -2.51 0.02 0.00 0.01 0.00 0.00 42.46 39.87 3c4o s ILE 40 CO 0.47 0.48 -0.21 -2.28 0.00 0.00 0.00 174.94 173.40 3c4o s HIS 41 N 0.67 2.74 -0.14 3.97 5.65 -0.18 -0.21 115.29 127.79 3c4o s HIS 41 Ca -0.04 -1.54 0.03 0.00 0.25 0.00 0.00 55.06 53.76 3c4o s HIS 41 Cb -0.15 -1.88 0.01 0.00 -1.18 0.00 0.00 32.58 29.38 3c4o s HIS 41 CO 0.02 -0.74 -0.22 0.00 -0.65 0.00 0.00 174.74 173.16 3c4o s ARG 43 N 0.81 4.59 0.00 0.00 0.52 -0.09 -1.45 118.95 123.32 3c4o s ARG 43 Ca -0.07 1.22 0.00 0.00 -0.52 0.00 0.00 55.73 56.35 3c4o s ARG 43 Cb -0.16 -3.35 0.00 0.00 0.52 0.00 0.00 34.95 31.97 3c4o s ARG 43 CO -0.01 0.32 0.00 0.41 0.02 0.00 0.00 175.30 176.04 3c4o n GLY 44 N 2.16 1.85 3.74 -3.53 0.00 0.17 -1.29 105.19 108.29 3c4o n GLY 44 Ca -0.02 -1.84 -0.33 0.00 0.00 0.00 0.00 46.02 43.84 3c4o n GLY 44 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3c4o s HIS 45 N 3.25 2.30 0.38 1.61 0.00 -1.26 -4.60 115.29 116.97 3c4o s HIS 45 Ca 0.00 1.60 -0.28 0.00 -3.00 0.00 0.00 55.06 53.38 3c4o s HIS 45 Cb 0.00 -3.26 -0.11 0.00 -4.00 0.00 0.00 32.58 25.21 3c4o s HIS 45 CO 0.00 -2.14 1.44 0.00 -1.00 0.00 0.00 174.74 173.04 3c4o s ALA 46 N -2.39 3.52 -0.12 -1.38 0.00 -1.26 -0.79 121.76 119.35 3c4o s ALA 46 Ca 0.68 1.50 -0.06 0.00 0.00 0.00 0.00 51.96 54.08 3c4o s ALA 46 Cb -0.23 -3.58 0.05 0.00 0.00 0.00 0.00 23.12 19.36 3c4o s ALA 46 CO 0.48 -0.99 0.27 0.00 0.00 0.00 0.00 175.76 175.52 3c4o s ALA 47 N -1.14 -0.65 0.00 0.00 0.00 -0.73 -4.67 121.76 114.58 3c4o s ALA 47 Ca 0.53 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.58 3c4o s ALA 47 Cb -0.45 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 21.99 3c4o s ALA 47 CO 0.60 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.57 3c4o n GLY 48 N 4.22 3.03 1.50 0.00 0.00 -0.42 -0.65 105.19 112.87 3c4o n GLY 48 Ca -0.25 -0.08 0.07 0.00 0.00 0.00 0.00 46.02 45.76 3c4o n GLY 48 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3c4o n ASP 49 N 2.79 4.44 0.00 1.61 2.03 -1.26 -4.89 116.55 121.27 3c4o n ASP 49 Ca 0.00 -2.54 0.00 0.00 0.52 0.00 0.00 54.79 52.77 3c4o n ASP 49 Cb 0.00 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 39.82 3c4o n ASP 49 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3c4o n TYR 50 N 0.75 0.00 -3.90 -0.67 9.36 0.17 -5.18 117.16 117.69 3c4o n TYR 50 Ca 0.22 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.34 3c4o n TYR 50 Cb 0.88 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.50 3c4o n TYR 50 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 3c4o s TYR 51 N 2.73 0.12 0.65 2.98 1.51 -1.22 -1.77 117.35 122.34 3c4o s TYR 51 Ca 0.00 -0.30 -0.18 0.00 -1.01 0.00 0.00 57.07 55.58 3c4o s TYR 51 Cb 0.00 -0.09 -0.01 0.00 -0.11 0.00 0.00 41.96 41.74 3c4o s TYR 51 CO 0.00 -0.31 1.25 0.00 -1.11 0.00 0.00 175.55 175.39 3c4o n ALA 52 N 1.22 1.03 -3.71 3.71 0.00 0.03 -4.71 120.51 118.07 3c4o n ALA 52 Ca -0.22 -0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.14 3c4o n ALA 52 Cb 0.56 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 3c4o n ALA 52 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3c4o s TYR 53 N -1.40 -0.30 0.12 0.00 -0.85 -0.76 0.46 117.35 114.61 3c4o s TYR 53 Ca 0.82 -0.07 0.09 0.00 -0.52 0.00 0.00 57.07 57.39 3c4o s TYR 53 Cb -0.38 0.66 -0.04 0.00 0.38 0.00 0.00 41.96 42.58 3c4o s TYR 53 CO 0.41 -1.09 -0.21 0.00 -1.52 0.00 0.00 175.55 173.13 3c4o s ALA 54 N -3.83 1.93 -0.05 9.51 0.00 -0.53 -1.29 121.76 127.50 3c4o s ALA 54 Ca 0.08 -1.32 0.01 0.00 0.00 0.00 0.00 51.96 50.74 3c4o s ALA 54 Cb -0.04 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.84 3c4o s ALA 54 CO 0.00 0.37 -0.07 0.99 0.00 0.00 0.00 175.76 177.06 3c4o s THR 55 N -1.27 0.70 -0.14 0.00 2.01 0.19 -0.80 115.64 116.33 3c4o s THR 55 Ca 0.09 -0.22 0.00 0.00 0.31 0.00 0.00 61.69 61.87 3c4o s THR 55 Cb -0.09 -0.70 -0.01 0.00 0.01 0.00 0.00 72.50 71.71 3c4o s THR 55 CO 0.05 0.26 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.74 3c4o s PHE 56 N 0.87 2.78 0.13 4.92 0.08 0.71 -1.14 117.98 126.33 3c4o s PHE 56 Ca -0.12 -0.89 0.03 0.00 0.12 0.00 0.00 56.93 56.08 3c4o s PHE 56 Cb -0.15 -1.87 -0.04 0.00 -0.57 0.00 0.00 43.02 40.40 3c4o s PHE 56 CO 0.01 -0.37 0.21 0.20 -0.10 0.00 0.00 175.22 175.16 3c4o s GLY 57 N 0.63 1.83 0.17 4.36 0.00 -0.38 -1.11 107.32 112.82 3c4o s GLY 57 Ca -0.08 -1.05 0.07 0.00 0.00 0.00 0.00 44.72 43.66 3c4o s GLY 57 CO 0.03 -1.04 -0.14 -1.36 0.00 0.00 0.00 173.10 170.58 3c4o s PHE 58 N -1.66 1.60 0.41 1.90 0.40 -1.26 -1.09 117.98 118.28 3c4o s PHE 58 Ca 0.33 -0.58 0.25 0.00 -0.60 0.00 0.00 56.93 56.34 3c4o s PHE 58 Cb -0.11 -0.78 1.36 0.00 0.51 0.00 0.00 43.02 44.00 3c4o s PHE 58 CO 0.26 0.27 2.05 1.79 0.70 0.00 0.00 175.22 180.29 3c4o h THR 59 N 2.92 0.65 -2.34 0.64 1.35 -1.58 -3.45 112.91 111.09 3c4o h THR 59 Ca -0.39 -0.58 0.03 0.00 -0.55 0.00 0.00 66.41 64.92 3c4o h THR 59 Cb 1.21 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 68.99 3c4o h THR 59 CO 0.58 0.13 0.24 -1.54 -0.25 0.00 0.00 175.52 174.68 3c4o n SER 60 N -3.72 -1.12 -0.09 5.36 3.41 -1.26 -5.00 113.62 111.19 3c4o n SER 60 Ca -0.02 -1.70 0.14 0.00 -0.26 0.00 0.00 58.87 57.03 3c4o n SER 60 Cb 0.25 1.85 0.55 0.00 -0.26 0.00 0.00 64.21 66.59 3c4o n SER 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3c4o n ALA 61 N -1.71 2.83 -1.45 7.33 0.00 -1.26 -4.76 120.51 121.49 3c4o n ALA 61 Ca -0.08 -0.27 -0.34 0.00 0.00 0.00 0.00 53.44 52.75 3c4o n ALA 61 Cb 0.32 -1.31 0.07 0.00 0.00 0.00 0.00 19.45 18.54 3c4o n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c4o s ALA 62 N -2.62 2.27 0.42 0.00 0.00 -1.26 -4.92 121.76 115.66 3c4o s ALA 62 Ca 0.24 0.80 0.11 0.00 0.00 0.00 0.00 51.96 53.12 3c4o s ALA 62 Cb 0.19 -3.43 0.91 0.00 0.00 0.00 0.00 23.12 20.80 3c4o s ALA 62 CO 0.52 -1.62 1.98 0.00 0.00 0.00 0.00 175.76 176.64 3c4o h ALA 63 N -0.05 1.64 -0.37 0.00 0.00 -2.05 -2.08 119.26 116.35 3c4o h ALA 63 Ca -0.48 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3c4o h ALA 63 Cb 1.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3c4o h ALA 63 CO 0.52 0.27 0.00 -0.40 0.00 0.00 0.00 179.25 179.63 3c4o n ASP 64 N -4.34 2.13 -4.73 0.00 5.75 -1.26 -4.47 116.55 109.63 3c4o n ASP 64 Ca -0.01 -1.95 -0.35 0.00 -0.01 0.00 0.00 54.79 52.47 3c4o n ASP 64 Cb 0.22 -0.24 0.08 0.00 -1.03 0.00 0.00 41.12 40.14 3c4o n ASP 64 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3c4o s ALA 65 N -1.51 2.25 0.09 2.12 0.00 -0.78 -4.93 121.76 119.00 3c4o s ALA 65 Ca 0.28 0.94 0.08 0.00 0.00 0.00 0.00 51.96 53.26 3c4o s ALA 65 Cb 0.15 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 3c4o s ALA 65 CO 0.20 -1.68 -0.18 0.15 0.00 0.00 0.00 175.76 174.26 3c4o s LYS 66 N -3.73 1.90 -0.05 0.00 -0.14 -1.26 -4.14 119.74 112.31 3c4o s LYS 66 Ca 0.76 -1.10 -0.33 0.00 -1.36 0.00 0.00 55.97 53.94 3c4o s LYS 66 Cb -0.30 -2.15 -0.11 0.00 -1.68 0.00 0.00 37.83 33.59 3c4o s LYS 66 CO 0.42 0.50 1.92 0.28 -0.76 0.00 0.00 175.35 177.71 3c4o n VAL 67 N 1.04 0.65 0.02 3.17 0.31 0.37 -1.47 118.33 122.43 3c4o n VAL 67 Ca -0.16 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 3c4o n VAL 67 Cb 0.52 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.42 3c4o n VAL 67 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3c4o n ASP 68 N 7.01 1.27 -3.71 4.52 5.68 -0.25 -1.03 116.55 130.05 3c4o n ASP 68 Ca 0.22 -1.23 -0.11 0.00 -0.50 0.00 0.00 54.79 53.16 3c4o n ASP 68 Cb 0.33 -0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.20 3c4o n ASP 68 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3c4o s SER 69 N -0.26 -0.44 -0.10 -1.12 0.15 -1.13 -0.70 113.70 110.11 3c4o s SER 69 Ca 0.01 0.78 0.02 0.00 0.70 0.00 0.00 55.95 57.46 3c4o s SER 69 Cb 0.01 0.67 0.01 0.00 -1.71 0.00 0.00 66.02 65.00 3c4o s SER 69 CO 0.01 -0.18 -0.16 -0.54 1.20 0.00 0.00 173.24 173.57 3c4o s LYS 70 N 1.28 2.23 0.04 5.44 1.02 -0.32 -1.25 119.74 128.17 3c4o s LYS 70 Ca -0.09 -0.57 0.04 0.00 0.02 0.00 0.00 55.97 55.37 3c4o s LYS 70 Cb -0.09 -1.85 -0.02 0.00 -0.52 0.00 0.00 37.83 35.36 3c4o s LYS 70 CO -0.11 -0.01 -0.12 -1.12 -0.92 0.00 0.00 175.35 173.07 3c4o s SER 71 N 0.84 1.41 -0.02 2.83 0.01 -0.29 -1.21 113.70 117.27 3c4o s SER 71 Ca -0.10 -0.44 -0.14 0.00 1.31 0.00 0.00 55.95 56.59 3c4o s SER 71 Cb -0.15 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.02 3c4o s SER 71 CO 0.01 -0.01 0.30 0.00 0.41 0.00 0.00 173.24 173.95 3c4o s GLN 72 N -1.11 0.63 -0.10 12.44 1.03 -0.43 -0.64 119.66 131.48 3c4o s GLN 72 Ca -0.00 -0.16 0.01 0.00 0.04 0.00 0.00 55.36 55.24 3c4o s GLN 72 Cb -0.08 0.28 0.02 0.00 0.03 0.00 0.00 33.01 33.26 3c4o s GLN 72 CO 0.01 -0.17 -0.11 1.41 -2.54 0.00 0.00 175.29 173.89 3c4o s MET 73 N -1.22 1.81 -1.56 9.60 1.75 -0.41 -4.63 119.30 124.63 3c4o s MET 73 Ca -0.13 -0.39 0.00 0.00 -1.25 0.00 0.00 55.69 53.92 3c4o s MET 73 Cb -0.05 -1.67 0.00 0.00 2.84 0.00 0.00 34.83 35.95 3c4o s MET 73 CO 0.04 -0.15 0.00 1.63 -0.65 0.00 0.00 175.02 175.89 3c4o n LYS 74 N 4.49 -1.38 0.01 4.11 5.02 -1.26 -1.82 118.16 127.32 3c4o n LYS 74 Ca -0.17 0.90 0.11 0.00 -2.02 0.00 0.00 58.31 57.12 3c4o n LYS 74 Cb 0.51 -5.34 -0.13 0.00 -0.02 0.00 0.00 35.03 30.04 3c4o n LYS 74 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3c4o n LEU 75 N -2.46 0.28 -4.00 -0.35 4.77 -1.26 -4.83 117.00 109.15 3c4o n LEU 75 Ca -0.21 -0.03 -0.17 0.00 -0.03 0.00 0.00 56.01 55.57 3c4o n LEU 75 Cb 0.65 -0.02 -0.14 0.00 -2.33 0.00 0.00 43.42 41.58 3c4o n LEU 75 CO 0.25 0.02 -0.42 -0.76 -1.33 0.00 0.00 177.39 175.15 3c4o s LEU 76 N -4.36 2.03 0.05 2.23 1.43 -1.26 -3.35 118.68 115.45 3c4o s LEU 76 Ca -0.04 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 3c4o s LEU 76 Cb 0.14 -0.36 -0.04 0.00 0.03 0.00 0.00 46.19 45.96 3c4o s LEU 76 CO 0.88 0.07 0.06 0.00 0.23 0.00 0.00 176.35 177.59 3c4o s ALA 77 N -0.26 3.50 0.49 4.21 0.00 -1.26 -4.97 121.76 123.47 3c4o s ALA 77 Ca 0.02 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.77 3c4o s ALA 77 Cb -0.03 -1.43 -0.06 0.00 0.00 0.00 0.00 23.12 21.59 3c4o s ALA 77 CO -0.00 0.72 1.25 -1.25 0.00 0.00 0.00 175.76 176.47 3c4o s PRO 78 N -2.11 3.53 0.12 0.00 0.04 -1.26 -4.94 135.00 130.38 3c4o s PRO 78 Ca 0.26 1.98 -0.05 0.00 0.04 0.00 0.00 61.00 63.23 3c4o s PRO 78 Cb -0.12 -2.37 -0.11 0.00 0.04 0.00 0.00 34.50 31.94 3c4o s PRO 78 CO 0.18 -0.80 1.29 0.66 0.04 0.00 0.00 177.00 178.37 3c4o h SER 79 N 1.85 0.54 -1.23 6.66 4.64 -1.71 -3.41 113.55 120.88 3c4o h SER 79 Ca -0.50 -0.44 -0.22 0.00 -0.47 0.00 0.00 61.79 60.16 3c4o h SER 79 Cb 1.27 -0.16 -0.20 0.00 -0.31 0.00 0.00 62.40 62.99 3c4o h SER 79 CO 0.59 1.24 -0.57 0.00 -0.87 0.00 0.00 176.83 177.22 3c4o s ALA 80 N -3.23 -1.52 -0.06 5.18 0.00 0.49 -5.04 121.76 117.57 3c4o s ALA 80 Ca -0.06 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 50.86 3c4o s ALA 80 Cb 0.09 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 3c4o s ALA 80 CO 0.87 -2.19 1.46 -2.14 0.00 0.00 0.00 175.76 173.76 3c4o s PRO 81 N 0.76 4.23 -0.02 0.00 0.02 -1.17 -3.56 135.00 135.26 3c4o s PRO 81 Ca 0.30 1.97 0.02 0.00 0.02 0.00 0.00 61.00 63.32 3c4o s PRO 81 Cb 0.00 -3.78 0.03 0.00 0.02 0.00 0.00 34.50 30.78 3c4o s PRO 81 CO -0.08 -0.72 0.84 0.25 -0.33 0.00 0.00 177.00 176.97 3c4o n THR 82 N 5.17 0.32 -1.94 0.99 -2.24 -1.23 -3.33 114.28 112.00 3c4o n THR 82 Ca 0.15 -0.36 -0.39 0.00 -2.27 0.00 0.00 64.05 61.18 3c4o n THR 82 Cb 0.44 0.59 0.01 0.00 -2.10 0.00 0.00 70.33 69.26 3c4o n THR 82 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3c4o s LEU 83 N -0.43 4.08 0.17 3.22 2.96 -1.11 -4.85 118.68 122.71 3c4o s LEU 83 Ca 0.04 2.71 0.00 0.00 -0.22 0.00 0.00 54.13 56.66 3c4o s LEU 83 Cb 0.03 -4.04 -0.04 0.00 0.50 0.00 0.00 46.19 42.64 3c4o s LEU 83 CO 0.00 -1.11 0.05 0.42 -1.32 0.00 0.00 176.35 174.39 3c4o s THR 84 N -1.29 0.33 0.31 3.68 -4.23 -1.26 -4.07 115.64 109.11 3c4o s THR 84 Ca 0.62 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 59.17 3c4o s THR 84 Cb -0.39 -2.20 0.27 0.00 1.34 0.00 0.00 72.50 71.52 3c4o s THR 84 CO 0.49 -0.35 1.95 0.25 -0.54 0.00 0.00 174.62 176.42 3c4o h LEU 85 N 2.72 0.91 -0.18 4.79 5.85 -1.96 -0.72 115.31 126.71 3c4o h LEU 85 Ca -0.36 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 3c4o h LEU 85 Cb 1.21 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 3c4o h LEU 85 CO 0.60 0.63 0.11 0.00 -0.34 0.00 0.00 178.44 179.44 3c4o h ALA 86 N 1.50 0.23 -0.74 1.25 0.00 -1.96 -1.52 119.26 118.03 3c4o h ALA 86 Ca 0.33 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 3c4o h ALA 86 Cb -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3c4o h ALA 86 CO -0.09 -0.27 0.24 0.87 0.00 0.00 0.00 179.25 180.00 3c4o h LYS 87 N 0.22 1.14 -0.82 0.00 1.57 -1.77 -2.56 116.57 114.36 3c4o h LYS 87 Ca 0.07 -0.24 0.03 0.00 -1.87 0.00 0.00 60.65 58.64 3c4o h LYS 87 Cb 0.01 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.11 3c4o h LYS 87 CO -0.01 0.97 0.54 0.35 -0.57 0.00 0.00 179.45 180.72 3c4o h PHE 88 N 1.09 0.98 0.00 -1.35 3.57 -0.85 -1.24 116.94 119.14 3c4o h PHE 88 Ca 0.24 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3c4o h PHE 88 Cb 0.29 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3c4o h PHE 88 CO 0.02 0.57 0.00 -0.91 -2.23 0.00 0.00 178.31 175.76 3c4o h ASN 89 N 1.01 0.00 1.42 0.41 2.35 -0.87 -2.28 115.58 117.61 3c4o h ASN 89 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 3c4o h ASN 89 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 3c4o h ASN 89 CO -0.10 0.00 -0.18 1.56 -1.65 0.00 0.00 177.43 177.07 3c4o h GLN 90 N 0.00 0.00 -6.62 0.81 4.20 -1.00 -3.45 115.11 109.06 3c4o h GLN 90 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 3c4o h GLN 90 Cb 0.53 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 3c4o h GLN 90 CO 0.00 0.00 0.44 0.08 -0.67 0.00 0.00 178.83 178.68 3c4o s VAL 91 N -3.15 4.09 0.01 -0.54 1.01 -0.86 -5.05 120.40 115.91 3c4o s VAL 91 Ca 0.09 1.76 0.03 0.00 0.00 0.00 0.00 61.98 63.85 3c4o s VAL 91 Cb 0.11 -4.12 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 3c4o s VAL 91 CO 0.64 0.28 -0.10 0.42 0.00 0.00 0.00 175.10 176.35 3c4o s THR 92 N -0.07 0.77 0.26 3.92 -4.23 -1.26 -5.04 115.64 109.99 3c4o s THR 92 Ca 0.49 -0.57 -0.31 0.00 -1.18 0.00 0.00 61.69 60.13 3c4o s THR 92 Cb -0.27 -0.68 -0.13 0.00 1.34 0.00 0.00 72.50 72.76 3c4o s THR 92 CO 0.33 0.11 1.41 0.52 -0.54 0.00 0.00 174.62 176.45 3c4o n VAL 93 N 2.54 1.10 0.00 2.29 0.31 -1.26 -1.69 118.33 121.62 3c4o n VAL 93 Ca -0.15 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3c4o n VAL 93 Cb 0.56 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 3c4o n VAL 93 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3c4o n GLY 94 N 1.97 2.00 3.75 2.92 0.00 -0.51 -5.01 105.19 110.32 3c4o n GLY 94 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 3c4o n GLY 94 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3c4o s MET 95 N -0.85 3.00 0.74 1.61 1.00 -0.68 -4.62 119.30 119.49 3c4o s MET 95 Ca 0.00 1.92 -0.11 0.00 0.00 0.00 0.00 55.69 57.50 3c4o s MET 95 Cb 0.00 -2.01 0.03 0.00 0.00 0.00 0.00 34.83 32.85 3c4o s MET 95 CO 0.00 -1.21 1.09 0.95 0.00 0.00 0.00 175.02 175.85 3c4o s THR 96 N -1.51 3.45 0.23 2.05 -4.23 -1.26 0.11 115.64 114.48 3c4o s THR 96 Ca 0.76 0.47 -0.06 0.00 -1.18 0.00 0.00 61.69 61.68 3c4o s THR 96 Cb -0.33 -3.34 0.19 0.00 1.34 0.00 0.00 72.50 70.36 3c4o s THR 96 CO 0.36 -0.61 1.82 -0.09 -0.54 0.00 0.00 174.62 175.56 3c4o h ARG 97 N -0.81 0.80 -0.64 3.99 2.43 -1.72 -1.17 114.38 117.26 3c4o h ARG 97 Ca -0.46 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3c4o h ARG 97 Cb 1.25 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 3c4o h ARG 97 CO 0.61 0.53 0.38 0.00 -1.51 0.00 0.00 179.97 179.98 3c4o h ALA 98 N 1.41 0.81 -0.67 2.80 0.00 -1.93 -1.32 119.26 120.36 3c4o h ALA 98 Ca 0.36 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 3c4o h ALA 98 Cb 0.24 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3c4o h ALA 98 CO -0.20 0.29 0.30 1.96 0.00 0.00 0.00 179.25 181.60 3c4o h GLN 99 N 0.86 0.98 -0.16 0.00 4.20 -1.78 -2.13 115.11 117.07 3c4o h GLN 99 Ca 0.23 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 3c4o h GLN 99 Cb -0.02 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 3c4o h GLN 99 CO -0.04 0.79 0.09 0.28 -0.67 0.00 0.00 178.83 179.27 3c4o h VAL 100 N 0.93 1.10 -0.74 -0.54 2.07 -0.68 -2.00 116.25 116.40 3c4o h VAL 100 Ca 0.23 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3c4o h VAL 100 Cb 0.15 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3c4o h VAL 100 CO -0.02 0.10 0.47 -0.07 0.02 0.00 0.00 177.57 178.06 3c4o h LEU 101 N 0.15 0.87 -1.70 2.57 -0.00 -1.16 0.74 115.31 116.78 3c4o h LEU 101 Ca 0.06 -0.04 -0.04 0.00 -0.00 0.00 0.00 57.88 57.86 3c4o h LEU 101 Cb 0.08 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.51 3c4o h LEU 101 CO -0.01 0.65 -0.18 0.00 -0.00 0.00 0.00 178.44 178.90 3c4o h ALA 102 N 1.50 1.56 0.17 1.53 0.00 -1.06 -0.54 119.26 122.42 3c4o h ALA 102 Ca 0.27 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.71 3c4o h ALA 102 Cb -0.08 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.69 3c4o h ALA 102 CO -0.05 0.22 -1.50 1.15 0.00 0.00 0.00 179.25 179.07 3c4o h THR 103 N 0.00 1.07 0.00 0.00 2.02 -0.19 -3.38 112.91 112.43 3c4o h THR 103 Ca -0.00 -2.50 0.00 0.00 0.77 0.00 0.00 66.41 64.68 3c4o h THR 103 Cb 0.35 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.59 3c4o h THR 103 CO 0.02 0.78 -0.83 1.33 0.37 0.00 0.00 175.52 177.20 3c4o n VAL 104 N -3.78 0.16 0.00 3.16 0.24 -0.12 -4.77 118.33 113.21 3c4o n VAL 104 Ca -0.23 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 3c4o n VAL 104 Cb 0.99 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 3c4o n VAL 104 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3c4o n GLY 105 N 1.40 3.05 0.31 7.63 0.00 -0.22 -3.22 105.19 114.14 3c4o n GLY 105 Ca 0.03 -1.32 0.20 0.00 0.00 0.00 0.00 46.02 44.94 3c4o n GLY 105 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3c4o h GLN 106 N 0.00 0.00 -0.09 1.61 1.08 -1.86 -2.16 115.11 113.70 3c4o h GLN 106 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3c4o h GLN 106 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3c4o h GLN 106 CO 0.00 0.00 -0.03 0.41 -0.95 0.00 0.00 178.83 178.26 3c4o n GLY 107 N -0.62 4.67 0.03 3.46 0.00 -1.26 -4.72 105.19 106.76 3c4o n GLY 107 Ca -0.01 -1.13 0.12 0.00 0.00 0.00 0.00 46.02 45.00 3c4o n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3c4o n SER 108 N -1.15 0.57 -4.49 1.61 7.64 -0.81 -0.38 113.62 116.61 3c4o n SER 108 Ca 0.18 -0.04 -0.26 0.00 1.01 0.00 0.00 58.87 59.77 3c4o n SER 108 Cb 0.73 0.20 -0.10 0.00 -1.01 0.00 0.00 64.21 64.02 3c4o n SER 108 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3c4o s THR 110 N -1.82 1.28 -0.33 0.00 -4.23 0.21 -4.63 115.64 106.12 3c4o s THR 110 Ca 0.24 -1.84 -0.22 0.00 -1.18 0.00 0.00 61.69 58.69 3c4o s THR 110 Cb -0.08 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.12 3c4o s THR 110 CO 0.13 -0.53 0.72 -0.89 -0.54 0.00 0.00 174.62 173.50 3c4o s THR 111 N -2.55 4.83 -0.13 3.99 2.01 -1.26 -1.29 115.64 121.24 3c4o s THR 111 Ca 0.12 0.91 -0.20 0.00 0.31 0.00 0.00 61.69 62.83 3c4o s THR 111 Cb -0.02 -4.11 -0.18 0.00 0.01 0.00 0.00 72.50 68.20 3c4o s THR 111 CO 0.02 -0.28 0.53 -0.25 -0.69 0.00 0.00 174.62 173.96 3c4o h TRP 112 N 8.29 0.00 -3.33 4.92 7.01 -1.03 -3.40 115.95 128.41 3c4o h TRP 112 Ca -0.25 0.00 -0.16 0.00 2.11 0.00 0.00 58.89 60.59 3c4o h TRP 112 Cb 1.10 0.00 -0.23 0.00 -2.10 0.00 0.00 29.16 27.93 3c4o h TRP 112 CO 0.77 0.69 -0.47 -1.54 -2.79 0.00 0.00 178.44 175.11 3c4o s SER 113 N -6.02 -0.11 -0.10 2.65 1.04 -1.01 -1.31 113.70 108.84 3c4o s SER 113 Ca -0.13 0.13 -0.04 0.00 0.48 0.00 0.00 55.95 56.39 3c4o s SER 113 Cb -0.02 0.32 0.05 0.00 0.10 0.00 0.00 66.02 66.47 3c4o s SER 113 CO 0.48 -0.22 0.20 -0.70 0.98 0.00 0.00 173.24 173.97 3c4o s GLU 114 N -0.62 0.10 -0.03 4.02 2.12 -0.35 -0.44 118.70 123.51 3c4o s GLU 114 Ca -0.07 0.57 0.00 0.00 0.36 0.00 0.00 54.97 55.84 3c4o s GLU 114 Cb -0.04 -0.17 0.03 0.00 0.26 0.00 0.00 34.13 34.21 3c4o s GLU 114 CO 0.01 -0.25 0.00 -0.47 -0.54 0.00 0.00 175.26 174.01 3c4o s TYR 115 N 1.95 0.31 -0.67 5.30 6.04 -0.26 -1.17 117.35 128.85 3c4o s TYR 115 Ca -0.02 0.00 -0.05 0.00 0.04 0.00 0.00 57.07 57.04 3c4o s TYR 115 Cb -0.12 -0.40 0.17 0.00 -1.04 0.00 0.00 41.96 40.58 3c4o s TYR 115 CO -0.07 -0.13 0.51 0.71 -1.54 0.00 0.00 175.55 175.03 3c4o s TYR 116 N 1.00 3.48 -0.30 4.97 1.51 0.12 -1.28 117.35 126.85 3c4o s TYR 116 Ca -0.10 -2.57 0.25 0.00 -1.01 0.00 0.00 57.07 53.64 3c4o s TYR 116 Cb -0.14 -3.32 1.14 0.00 -0.11 0.00 0.00 41.96 39.53 3c4o s TYR 116 CO -0.02 -0.87 1.76 -1.00 -1.11 0.00 0.00 175.55 174.31 3c4o h PRO 117 N 7.17 0.00 -0.07 -1.71 0.13 -1.81 -1.95 132.00 133.76 3c4o h PRO 117 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3c4o h PRO 117 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 3c4o h PRO 117 CO 0.72 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.49 3c4o n ALA 118 N -1.82 2.44 -1.50 -0.56 0.00 -1.26 -5.06 120.51 112.75 3c4o n ALA 118 Ca 0.01 -2.49 -0.54 0.00 0.00 0.00 0.00 53.44 50.43 3c4o n ALA 118 Cb 0.18 -0.46 -0.06 0.00 0.00 0.00 0.00 19.45 19.11 3c4o n ALA 118 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3c4o n TYR 119 N -1.15 0.63 1.71 0.00 4.19 -0.73 -0.88 117.16 120.92 3c4o n TYR 119 Ca 0.17 0.91 0.11 0.00 3.31 0.00 0.00 57.90 62.40 3c4o n TYR 119 Cb 0.69 -2.13 0.53 0.00 0.49 0.00 0.00 39.34 38.92 3c4o n TYR 119 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 3c4o n PRO 120 N 1.54 1.29 -2.35 2.98 -0.04 -1.26 -5.09 135.00 132.07 3c4o n PRO 120 Ca 0.18 -0.43 -0.35 0.00 -0.04 0.00 0.00 63.50 62.86 3c4o n PRO 120 Cb 0.17 -1.36 -0.01 0.00 -0.04 0.00 0.00 33.50 32.26 3c4o n PRO 120 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3c4o s SER 121 N -1.65 5.95 0.00 3.54 0.15 -0.06 -4.95 113.70 116.68 3c4o s SER 121 Ca 0.32 2.07 0.27 0.00 0.70 0.00 0.00 55.95 59.31 3c4o s SER 121 Cb 0.16 -2.57 0.87 0.00 -1.71 0.00 0.00 66.02 62.76 3c4o s SER 121 CO 0.25 -1.06 1.64 0.35 1.20 0.00 0.00 173.24 175.62 3c4o n THR 122 N -1.21 0.00 -1.69 6.45 -2.24 -1.26 -4.35 114.28 109.97 3c4o n THR 122 Ca 0.11 -0.21 -0.44 0.00 -2.27 0.00 0.00 64.05 61.24 3c4o n THR 122 Cb 0.52 0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 69.23 3c4o n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c4o n ALA 123 N -0.11 1.89 -0.87 6.98 0.00 -1.26 -1.69 120.51 125.44 3c4o n ALA 123 Ca 0.16 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3c4o n ALA 123 Cb 0.37 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.29 3c4o n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c4o n GLY 124 N 4.06 0.61 3.63 0.00 0.00 -1.26 -4.11 105.19 108.12 3c4o n GLY 124 Ca 0.18 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.70 3c4o n GLY 124 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3c4o n VAL 125 N -2.76 0.04 -4.59 1.61 3.14 -0.68 -4.61 118.33 110.46 3c4o n VAL 125 Ca 0.00 -0.01 -0.34 0.00 -2.96 0.00 0.00 64.34 61.04 3c4o n VAL 125 Cb 0.00 -1.15 -0.11 0.00 -1.06 0.00 0.00 33.84 31.52 3c4o n VAL 125 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 3c4o s THR 126 N 0.92 3.70 -0.02 1.55 -4.23 -0.40 -0.74 115.64 116.43 3c4o s THR 126 Ca 0.83 -0.53 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 3c4o s THR 126 Cb -0.85 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 70.49 3c4o s THR 126 CO 0.44 0.56 0.02 -0.22 -0.54 0.00 0.00 174.62 174.89 3c4o s LEU 127 N -0.92 1.26 -0.13 4.79 2.96 -0.62 -1.10 118.68 124.92 3c4o s LEU 127 Ca 0.13 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.09 3c4o s LEU 127 Cb -0.11 -0.08 0.00 0.00 0.50 0.00 0.00 46.19 46.50 3c4o s LEU 127 CO 0.03 -0.10 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.31 3c4o s SER 128 N 0.87 3.31 0.08 3.68 0.01 0.42 -0.13 113.70 121.94 3c4o s SER 128 Ca -0.07 -0.53 0.05 0.00 1.31 0.00 0.00 55.95 56.70 3c4o s SER 128 Cb -0.11 -1.47 -0.04 0.00 0.21 0.00 0.00 66.02 64.61 3c4o s SER 128 CO -0.02 0.12 -0.04 -0.76 0.41 0.00 0.00 173.24 172.95 3c4o s LEU 129 N 0.59 3.31 -0.14 2.44 1.43 0.35 -0.47 118.68 126.20 3c4o s LEU 129 Ca -0.12 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 3c4o s LEU 129 Cb -0.16 -2.04 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 3c4o s LEU 129 CO 0.03 0.19 -0.06 -0.54 0.23 0.00 0.00 176.35 176.20 3c4o s LYS 130 N -2.15 3.53 -0.01 1.70 1.02 -0.41 -1.40 119.74 122.01 3c4o s LYS 130 Ca 0.23 -0.56 0.08 0.00 0.02 0.00 0.00 55.97 55.74 3c4o s LYS 130 Cb -0.11 -2.82 -0.02 0.00 -0.52 0.00 0.00 37.83 34.36 3c4o s LYS 130 CO 0.15 0.27 -0.24 0.00 -0.92 0.00 0.00 175.35 174.62 3c4o s PHE 132 N -0.59 1.89 1.04 0.00 0.40 0.12 -0.02 117.98 120.82 3c4o s PHE 132 Ca 0.09 -0.40 -0.17 0.00 -0.60 0.00 0.00 56.93 55.86 3c4o s PHE 132 Cb -0.09 -1.07 0.23 0.00 0.51 0.00 0.00 43.02 42.59 3c4o s PHE 132 CO -0.01 0.18 1.25 0.16 0.70 0.00 0.00 175.22 177.50 3c4o s ASP 133 N -1.64 2.41 0.31 1.36 1.47 -0.87 -2.75 116.67 116.96 3c4o s ASP 133 Ca 0.08 0.40 0.07 0.00 1.18 0.00 0.00 52.55 54.28 3c4o s ASP 133 Cb -0.10 -0.52 0.81 0.00 -0.34 0.00 0.00 42.92 42.78 3c4o s ASP 133 CO 0.04 -3.18 1.72 1.62 0.68 0.00 0.00 175.17 176.04 3c4o h VAL 134 N -1.94 0.52 -0.10 2.11 3.04 -1.74 -1.09 116.25 117.05 3c4o h VAL 134 Ca -0.45 -0.18 -0.03 0.00 -1.01 0.00 0.00 66.70 65.04 3c4o h VAL 134 Cb 1.26 -0.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 3c4o h VAL 134 CO 0.37 0.09 -0.13 0.47 -1.01 0.00 0.00 177.57 177.36 3c4o n ASP 135 N -4.94 2.49 0.10 3.17 8.00 -1.26 -4.78 116.55 119.33 3c4o n ASP 135 Ca 0.25 -3.38 -0.15 0.00 0.71 0.00 0.00 54.79 52.21 3c4o n ASP 135 Cb 0.70 -0.51 -0.11 0.00 -0.02 0.00 0.00 41.12 41.18 3c4o n ASP 135 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3c4o h GLY 136 N 0.72 0.36 -3.42 0.44 0.00 -1.38 -3.41 103.07 96.39 3c4o h GLY 136 Ca 0.03 -0.82 -0.49 0.00 0.00 0.00 0.00 47.33 46.05 3c4o h GLY 136 CO 0.10 0.72 0.41 -0.47 0.00 0.00 0.00 176.54 177.30 3c4o s TYR 137 N -2.82 3.63 -0.02 5.60 5.04 -1.26 -0.59 117.35 126.93 3c4o s TYR 137 Ca -0.05 1.76 -0.00 0.00 -2.44 0.00 0.00 57.07 56.34 3c4o s TYR 137 Cb 0.07 -3.11 0.02 0.00 0.35 0.00 0.00 41.96 39.29 3c4o s TYR 137 CO 0.88 -0.19 0.03 0.45 -1.34 0.00 0.00 175.55 175.39 3c4o s SER 138 N -1.24 0.02 0.00 4.32 0.15 -1.26 -4.90 113.70 110.79 3c4o s SER 138 Ca 0.48 0.05 0.25 0.00 0.70 0.00 0.00 55.95 57.43 3c4o s SER 138 Cb -0.26 -0.01 0.46 0.00 -1.71 0.00 0.00 66.02 64.50 3c4o s SER 138 CO 0.33 -0.08 1.38 -1.54 1.20 0.00 0.00 173.24 174.53 3c4o n SER 139 N 3.70 0.68 0.00 5.45 3.41 -1.26 -4.43 113.62 121.17 3c4o n SER 139 Ca -0.21 -0.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.93 3c4o n SER 139 Cb 0.54 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 3c4o n SER 139 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3c4o n THR 140 N -1.32 0.00 0.00 6.66 -2.24 -1.26 -4.79 114.28 111.33 3c4o n THR 140 Ca 0.07 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3c4o n THR 140 Cb 0.34 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 3c4o n THR 140 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3c4o n GLY 141 N 0.98 3.15 3.13 3.38 0.00 -1.26 -1.30 105.19 113.28 3c4o n GLY 141 Ca 0.00 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 3c4o n GLY 141 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3c4o s PHE 142 N 2.73 1.34 0.70 1.61 0.40 -1.26 -4.45 117.98 119.04 3c4o s PHE 142 Ca 0.00 -0.28 -0.15 0.00 -0.60 0.00 0.00 56.93 55.90 3c4o s PHE 142 Cb 0.00 -0.84 0.02 0.00 0.51 0.00 0.00 43.02 42.71 3c4o s PHE 142 CO 0.00 -0.00 1.15 0.71 0.70 0.00 0.00 175.22 177.78 3c4o s TYR 143 N -0.49 2.37 -0.33 0.36 2.02 -1.26 -4.60 117.35 115.42 3c4o s TYR 143 Ca 0.05 1.58 0.15 0.00 -0.37 0.00 0.00 57.07 58.47 3c4o s TYR 143 Cb -0.06 -3.29 0.46 0.00 -0.40 0.00 0.00 41.96 38.67 3c4o s TYR 143 CO 0.00 -2.07 1.07 0.54 -1.57 0.00 0.00 175.55 173.52 3c4o n ARG 144 N -2.60 2.21 0.00 -0.62 1.74 0.24 -4.94 116.66 112.70 3c4o n ARG 144 Ca 0.12 -3.75 0.00 0.00 -0.77 0.00 0.00 57.85 53.45 3c4o n ARG 144 Cb 0.51 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 3c4o n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c4o n GLY 145 N -0.40 1.18 3.06 -0.13 0.00 -1.21 -4.29 105.19 103.40 3c4o n GLY 145 Ca 0.21 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3c4o n GLY 145 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3c4o s MET 146 N 0.00 0.27 -0.04 1.61 0.00 -0.53 -2.04 119.30 118.57 3c4o s MET 146 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 55.69 55.83 3c4o s MET 146 Cb 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 34.83 34.94 3c4o s MET 146 CO 0.00 -0.05 -0.23 0.00 0.00 0.00 0.00 175.02 174.75 3c4o s ALA 147 N -0.27 1.92 -0.33 4.11 0.00 0.98 -0.19 121.76 127.98 3c4o s ALA 147 Ca -0.04 -0.95 -0.14 0.00 0.00 0.00 0.00 51.96 50.83 3c4o s ALA 147 Cb -0.03 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3c4o s ALA 147 CO 0.01 0.41 0.31 -1.58 0.00 0.00 0.00 175.76 174.91 3c4o s HIS 148 N -0.30 3.22 -0.17 0.00 2.46 0.13 -0.82 115.29 119.81 3c4o s HIS 148 Ca 0.02 -0.03 0.01 0.00 0.47 0.00 0.00 55.06 55.52 3c4o s HIS 148 Cb -0.11 -2.58 0.01 0.00 -0.13 0.00 0.00 32.58 29.77 3c4o s HIS 148 CO 0.01 -0.37 -0.18 -0.51 -2.47 0.00 0.00 174.74 171.22 3c4o s LEU 149 N 1.91 2.25 0.05 8.88 1.43 -0.49 -1.37 118.68 131.33 3c4o s LEU 149 Ca 0.10 -0.58 0.09 0.00 -1.03 0.00 0.00 54.13 52.71 3c4o s LEU 149 Cb -0.17 -1.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3c4o s LEU 149 CO 0.11 0.04 -0.25 -1.66 0.23 0.00 0.00 176.35 174.82 3c4o s TRP 150 N 1.08 2.21 0.09 0.29 -2.14 -1.02 -0.49 118.94 118.97 3c4o s TRP 150 Ca -0.00 -0.40 0.05 0.00 2.66 0.00 0.00 56.10 58.40 3c4o s TRP 150 Cb -0.14 -1.32 -0.03 0.00 -3.10 0.00 0.00 33.47 28.87 3c4o s TRP 150 CO -0.07 0.12 -0.13 -0.06 -2.66 0.00 0.00 176.95 174.16 3c4o s PHE 151 N -0.80 1.22 -0.05 1.66 0.40 0.82 -0.08 117.98 121.15 3c4o s PHE 151 Ca 0.11 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 55.92 3c4o s PHE 151 Cb -0.10 -0.67 0.01 0.00 0.51 0.00 0.00 43.02 42.78 3c4o s PHE 151 CO 0.02 0.07 -0.10 0.99 0.70 0.00 0.00 175.22 176.90 3c4o s THR 152 N -1.87 0.94 -1.37 0.64 2.01 -0.72 -1.59 115.64 113.68 3c4o s THR 152 Ca 0.03 -0.39 -0.05 0.00 0.31 0.00 0.00 61.69 61.60 3c4o s THR 152 Cb -0.06 -0.87 0.03 0.00 0.01 0.00 0.00 72.50 71.60 3c4o s THR 152 CO 0.02 0.31 0.37 0.47 -0.69 0.00 0.00 174.62 175.09 3c4o n ASP 153 N 3.69 -4.74 -0.11 3.53 8.00 0.09 -1.61 116.55 125.40 3c4o n ASP 153 Ca -0.22 -0.19 -0.01 0.00 0.71 0.00 0.00 54.79 55.08 3c4o n ASP 153 Cb 0.52 -3.91 -0.01 0.00 -0.02 0.00 0.00 41.12 37.71 3c4o n ASP 153 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c4o n GLY 154 N -1.19 0.49 3.28 0.44 0.00 -1.26 -5.01 105.19 101.94 3c4o n GLY 154 Ca -0.10 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3c4o n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c4o s VAL 155 N -1.88 2.38 0.17 1.61 1.01 -0.63 -1.73 120.40 121.32 3c4o s VAL 155 Ca 0.00 -0.91 -0.32 0.00 0.00 0.00 0.00 61.98 60.75 3c4o s VAL 155 Cb 0.00 -1.93 -0.11 0.00 0.00 0.00 0.00 36.38 34.34 3c4o s VAL 155 CO 0.00 0.55 1.68 -0.22 0.00 0.00 0.00 175.10 177.11 3c4o s LEU 156 N 0.25 4.37 -0.08 3.92 2.96 0.12 -1.76 118.68 128.46 3c4o s LEU 156 Ca -0.14 2.73 0.14 0.00 -0.22 0.00 0.00 54.13 56.64 3c4o s LEU 156 Cb -0.17 -3.59 -0.21 0.00 0.50 0.00 0.00 46.19 42.72 3c4o s LEU 156 CO 0.07 -0.92 0.19 0.00 -1.32 0.00 0.00 176.35 174.38 3c4o n GLN 157 N 4.37 1.06 -3.66 1.98 1.13 0.89 -1.42 117.38 121.73 3c4o n GLN 157 Ca 0.15 -0.07 -0.04 0.00 -1.94 0.00 0.00 57.00 55.10 3c4o n GLN 157 Cb 0.37 -1.37 -0.01 0.00 0.11 0.00 0.00 30.24 29.34 3c4o n GLN 157 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 3c4o s GLY 158 N -4.31 -0.32 0.00 1.08 0.00 -1.18 -4.93 107.32 97.66 3c4o s GLY 158 Ca -0.06 0.52 -0.13 0.00 0.00 0.00 0.00 44.72 45.05 3c4o s GLY 158 CO 0.62 0.13 0.27 -1.59 0.00 0.00 0.00 173.10 172.53 3c4o s LYS 159 N -3.04 0.65 0.01 2.90 -2.85 -1.26 -2.42 119.74 113.73 3c4o s LYS 159 Ca 0.11 -0.31 -0.14 0.00 -1.00 0.00 0.00 55.97 54.63 3c4o s LYS 159 Cb -0.00 0.28 0.02 0.00 -2.06 0.00 0.00 37.83 36.07 3c4o s LYS 159 CO -0.02 -0.18 0.30 1.03 0.10 0.00 0.00 175.35 176.58 3c4o s ARG 160 N -1.59 0.72 0.04 1.78 0.52 -0.47 -4.99 118.95 114.95 3c4o s ARG 160 Ca -0.12 -0.32 -0.03 0.00 -0.52 0.00 0.00 55.73 54.74 3c4o s ARG 160 Cb -0.05 0.31 -0.02 0.00 0.52 0.00 0.00 34.95 35.71 3c4o s ARG 160 CO 0.02 -0.21 0.03 1.14 0.02 0.00 0.00 175.30 176.31 3c4o s GLN 161 N -1.79 0.55 -0.06 3.54 1.03 -1.26 0.21 119.66 121.88 3c4o s GLN 161 Ca -0.10 -0.88 0.01 0.00 0.04 0.00 0.00 55.36 54.43 3c4o s GLN 161 Cb -0.04 0.20 0.02 0.00 0.03 0.00 0.00 33.01 33.23 3c4o s GLN 161 CO 0.01 -0.12 -0.07 -1.58 -2.54 0.00 0.00 175.29 170.99 3c4o s TRP 162 N -2.84 1.05 0.00 9.60 0.51 0.73 -4.89 118.94 123.10 3c4o s TRP 162 Ca -0.03 -0.36 0.00 0.00 -2.12 0.00 0.00 56.10 53.59 3c4o s TRP 162 Cb 0.00 -0.85 0.00 0.00 -0.81 0.00 0.00 33.47 31.81 3c4o s TRP 162 CO -0.06 -0.25 0.00 -0.25 -0.51 0.00 0.00 176.95 175.88 3c4o n ASP 163 N 4.07 -4.34 -4.75 2.95 8.00 -1.26 -1.46 116.55 119.76 3c4o n ASP 163 Ca -0.23 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.86 3c4o n ASP 163 Cb 0.51 -1.90 -0.02 0.00 -0.02 0.00 0.00 41.12 39.69 3c4o n ASP 163 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3c4o s LEU 164 N 0.00 4.39 0.00 0.64 1.43 -1.26 -4.32 118.68 119.56 3c4o s LEU 164 Ca 0.00 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.76 3c4o s LEU 164 Cb 0.00 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.60 3c4o s LEU 164 CO 0.00 -0.69 0.00 0.52 0.23 0.00 0.00 176.35 176.41