#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fra s LEU 2 N 0.00 2.41 0.05 -4.42 2.96 -1.26 -0.06 118.68 118.36 3fra s LEU 2 Ca 0.00 -0.89 0.05 0.00 -0.22 0.00 0.00 54.13 53.07 3fra s LEU 2 Cb 0.00 -1.34 -0.02 0.00 0.50 0.00 0.00 46.19 45.32 3fra s LEU 2 CO 0.00 -0.11 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.33 3fra s SER 3 N 1.33 1.72 0.06 3.68 0.01 0.05 -0.22 113.70 120.32 3fra s SER 3 Ca -0.01 -0.50 -0.22 0.00 1.31 0.00 0.00 55.95 56.53 3fra s SER 3 Cb -0.16 -0.10 -0.06 0.00 0.21 0.00 0.00 66.02 65.91 3fra s SER 3 CO -0.09 0.02 0.67 -0.63 0.41 0.00 0.00 173.24 173.61 3fra s ILE 4 N -0.94 4.72 -0.19 1.44 1.01 -0.57 0.55 121.20 127.22 3fra s ILE 4 Ca 0.01 1.42 -0.01 0.00 0.00 0.00 0.00 60.65 62.07 3fra s ILE 4 Cb -0.08 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3fra s ILE 4 CO 0.02 0.46 -0.13 -0.22 0.00 0.00 0.00 174.94 175.06 3fra s LEU 5 N -0.55 2.50 -0.11 2.97 2.96 0.27 -0.14 118.68 126.57 3fra s LEU 5 Ca 0.33 -0.51 -0.19 0.00 -0.22 0.00 0.00 54.13 53.53 3fra s LEU 5 Cb -0.20 -1.60 0.05 0.00 0.50 0.00 0.00 46.19 44.94 3fra s LEU 5 CO 0.21 0.01 0.48 0.54 -1.32 0.00 0.00 176.35 176.27 3fra s VAL 6 N 1.28 0.02 -0.13 1.68 0.11 -0.75 -4.46 120.40 118.15 3fra s VAL 6 Ca 0.04 -0.14 0.02 0.00 -2.93 0.00 0.00 61.98 58.97 3fra s VAL 6 Cb -0.14 -0.74 0.00 0.00 -1.53 0.00 0.00 36.38 33.98 3fra s VAL 6 CO -0.07 -0.08 -0.20 0.00 -3.33 0.00 0.00 175.10 171.42 3fra s ALA 7 N -0.50 2.32 0.02 1.54 0.00 -1.26 -0.47 121.76 123.41 3fra s ALA 7 Ca -0.06 -1.01 -0.06 0.00 0.00 0.00 0.00 51.96 50.83 3fra s ALA 7 Cb -0.03 -1.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.08 3fra s ALA 7 CO 0.04 0.13 0.11 -3.38 0.00 0.00 0.00 175.76 172.66 3fra s HIS 8 N 0.57 0.13 0.00 0.00 -3.43 0.19 -4.53 115.29 108.22 3fra s HIS 8 Ca -0.12 -0.34 0.00 0.00 -0.80 0.00 0.00 55.06 53.80 3fra s HIS 8 Cb -0.16 -0.10 0.00 0.00 -1.43 0.00 0.00 32.58 30.88 3fra s HIS 8 CO 0.04 -0.32 0.00 -0.40 -2.00 0.00 0.00 174.74 172.05 3fra n ASP 9 N 1.10 0.00 0.21 7.38 5.75 -0.82 0.10 116.55 130.27 3fra n ASP 9 Ca -0.21 -0.89 0.15 0.00 -0.01 0.00 0.00 54.79 53.82 3fra n ASP 9 Cb 0.57 0.00 0.56 0.00 -1.03 0.00 0.00 41.12 41.22 3fra n ASP 9 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3fra h LEU 10 N 0.00 0.00 -3.20 -2.12 3.38 -1.26 0.15 115.31 112.27 3fra h LEU 10 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fra h LEU 10 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3fra h LEU 10 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3fra n GLN 11 N -2.73 2.61 -1.43 1.13 6.02 -1.26 -4.97 117.38 116.74 3fra n GLN 11 Ca 0.02 -2.76 -0.09 0.00 -0.01 0.00 0.00 57.00 54.16 3fra n GLN 11 Cb 0.30 -1.76 -0.03 0.00 1.02 0.00 0.00 30.24 29.78 3fra n GLN 11 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3fra n ARG 12 N -0.66 -0.62 -2.05 -1.09 1.74 0.52 -4.90 116.66 109.61 3fra n ARG 12 Ca 0.20 0.73 -0.41 0.00 -0.77 0.00 0.00 57.85 57.60 3fra n ARG 12 Cb 0.83 -4.61 -0.02 0.00 -1.02 0.00 0.00 32.46 27.64 3fra n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3fra s VAL 13 N -2.34 2.57 0.00 1.55 1.01 -1.26 0.21 120.40 122.14 3fra s VAL 13 Ca 0.00 0.57 0.00 0.00 0.00 0.00 0.00 61.98 62.55 3fra s VAL 13 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.01 3fra s VAL 13 CO 0.00 0.14 0.00 2.30 0.00 0.00 0.00 175.10 177.54 3fra n ILE 14 N 0.75 0.00 -3.74 2.22 -5.35 -0.53 -1.95 119.36 110.76 3fra n ILE 14 Ca 0.00 -0.07 -0.13 0.00 -0.27 0.00 0.00 62.75 62.28 3fra n ILE 14 Cb 0.41 0.47 -0.09 0.00 -1.74 0.00 0.00 39.64 38.69 3fra n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fra s GLY 15 N -1.23 -0.21 -0.04 3.28 0.00 -1.19 -4.65 107.32 103.27 3fra s GLY 15 Ca 0.00 0.62 -0.02 0.00 0.00 0.00 0.00 44.72 45.32 3fra s GLY 15 CO 0.00 0.42 0.07 -0.12 0.00 0.00 0.00 173.10 173.48 3fra s PHE 16 N -0.79 0.00 -1.43 1.90 2.19 -0.09 -0.85 117.98 118.90 3fra s PHE 16 Ca -0.09 0.30 -0.01 0.00 0.33 0.00 0.00 56.93 57.46 3fra s PHE 16 Cb -0.04 -0.37 0.00 0.00 -1.31 0.00 0.00 43.02 41.30 3fra s PHE 16 CO 0.03 -0.18 0.32 0.39 1.83 0.00 0.00 175.22 177.61 3fra n GLU 17 N 4.98 -2.55 -1.11 10.12 1.02 -1.26 -1.46 120.64 130.38 3fra n GLU 17 Ca -0.10 0.32 -0.04 0.00 -0.02 0.00 0.00 57.16 57.31 3fra n GLU 17 Cb 0.50 -4.22 -0.02 0.00 -0.02 0.00 0.00 31.44 27.68 3fra n GLU 17 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3fra n ASN 18 N -2.94 -4.50 -4.50 1.62 3.02 -1.26 -4.96 115.26 101.74 3fra n ASN 18 Ca -0.31 0.10 -0.26 0.00 -0.03 0.00 0.00 54.58 54.08 3fra n ASN 18 Cb 0.69 -2.35 -0.10 0.00 -0.61 0.00 0.00 39.78 37.41 3fra n ASN 18 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3fra s GLN 19 N -1.73 1.88 0.01 3.52 -0.21 -0.54 -4.74 119.66 117.85 3fra s GLN 19 Ca 0.00 -2.10 -0.29 0.00 0.02 0.00 0.00 55.36 52.99 3fra s GLN 19 Cb 0.00 -1.18 -0.04 0.00 1.00 0.00 0.00 33.01 32.80 3fra s GLN 19 CO 0.00 -0.22 0.94 -0.51 -2.12 0.00 0.00 175.29 173.38 3fra s LEU 20 N -3.64 4.38 0.39 2.90 1.43 -1.26 -0.92 118.68 121.96 3fra s LEU 20 Ca 0.29 1.62 0.28 0.00 -1.03 0.00 0.00 54.13 55.29 3fra s LEU 20 Cb 0.07 -3.51 1.24 0.00 0.03 0.00 0.00 46.19 44.01 3fra s LEU 20 CO 0.14 -0.21 1.84 -0.65 0.23 0.00 0.00 176.35 177.70 3fra h PRO 21 N 6.59 0.00 -6.17 1.29 0.11 -1.87 -3.44 132.00 128.51 3fra h PRO 21 Ca -0.41 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.13 3fra h PRO 21 Cb 1.22 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.14 3fra h PRO 21 CO 0.74 0.00 -0.80 1.67 -0.21 0.00 0.00 178.00 179.41 3fra s TRP 22 N -3.52 1.98 -0.36 0.65 -2.14 -1.26 -5.06 118.94 109.24 3fra s TRP 22 Ca 0.02 -0.43 -0.08 0.00 2.66 0.00 0.00 56.10 58.27 3fra s TRP 22 Cb 0.09 -0.99 0.04 0.00 -3.10 0.00 0.00 33.47 29.51 3fra s TRP 22 CO 0.41 0.39 0.15 -1.58 -2.66 0.00 0.00 176.95 173.66 3fra s HIS 23 N -1.88 3.26 -0.39 1.66 2.46 -1.26 -5.03 115.29 114.10 3fra s HIS 23 Ca 0.17 -1.28 0.03 0.00 0.47 0.00 0.00 55.06 54.45 3fra s HIS 23 Cb -0.07 -2.37 0.16 0.00 -0.13 0.00 0.00 32.58 30.17 3fra s HIS 23 CO 0.08 -0.71 0.37 -1.17 -2.47 0.00 0.00 174.74 170.83 3fra s LEU 24 N 1.45 0.37 0.24 8.88 2.96 -1.26 -4.76 118.68 126.57 3fra s LEU 24 Ca -0.00 -2.09 -0.04 0.00 -0.22 0.00 0.00 54.13 51.77 3fra s LEU 24 Cb -0.20 0.25 0.42 0.00 0.50 0.00 0.00 46.19 47.17 3fra s LEU 24 CO 0.04 -0.23 1.78 -0.65 -1.32 0.00 0.00 176.35 175.97 3fra h PRO 25 N 6.49 0.62 -0.62 0.98 0.11 -1.96 -2.08 132.00 135.53 3fra h PRO 25 Ca 0.11 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.30 3fra h PRO 25 Cb 1.01 -0.14 -0.12 0.00 0.11 0.00 0.00 31.00 31.86 3fra h PRO 25 CO 0.23 0.41 -0.23 -0.91 -0.21 0.00 0.00 178.00 177.29 3fra h ASN 26 N 0.64 -0.83 -0.89 -2.05 -0.26 -1.95 0.52 115.58 110.75 3fra h ASN 26 Ca 0.40 0.21 0.04 0.00 -0.56 0.00 0.00 56.30 56.39 3fra h ASN 26 Cb 0.48 0.47 -0.06 0.00 -1.06 0.00 0.00 38.32 38.16 3fra h ASN 26 CO -0.31 -0.26 0.57 -0.78 -1.06 0.00 0.00 177.43 175.60 3fra h ASP 27 N -0.07 0.93 -0.17 5.81 1.82 -1.81 0.40 116.42 123.33 3fra h ASP 27 Ca 0.28 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.77 3fra h ASP 27 Cb 0.51 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 3fra h ASP 27 CO -0.67 0.63 -0.45 -0.07 -1.61 0.00 0.00 179.24 177.06 3fra h LEU 28 N 1.08 0.78 -0.83 2.28 3.38 -1.06 -0.08 115.31 120.87 3fra h LEU 28 Ca 0.36 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3fra h LEU 28 Cb 0.06 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 3fra h LEU 28 CO -0.14 1.12 0.44 0.11 0.09 0.00 0.00 178.44 180.07 3fra h LYS 29 N 0.58 1.16 0.44 1.13 1.57 -0.52 -1.94 116.57 118.99 3fra h LYS 29 Ca 0.04 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3fra h LYS 29 Cb 1.01 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 3fra h LYS 29 CO 0.10 0.86 -0.35 1.25 -0.57 0.00 0.00 179.45 180.74 3fra h HIS 30 N 1.16 -0.95 -0.66 -1.35 2.76 -0.23 0.26 115.15 116.14 3fra h HIS 30 Ca 0.29 0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.58 3fra h HIS 30 Cb 0.05 0.36 -0.12 0.00 1.55 0.00 0.00 27.41 29.24 3fra h HIS 30 CO 0.01 -0.51 -0.31 0.28 -1.30 0.00 0.00 177.93 176.10 3fra h VAL 31 N -0.79 0.17 0.30 5.26 2.07 -0.98 0.02 116.25 122.30 3fra h VAL 31 Ca -0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 3fra h VAL 31 Cb 0.68 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 3fra h VAL 31 CO -0.01 0.00 -0.51 0.50 0.02 0.00 0.00 177.57 177.56 3fra h LYS 32 N -0.11 -0.84 -0.40 1.57 3.64 -1.09 -2.28 116.57 117.06 3fra h LYS 32 Ca 0.27 0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.79 3fra h LYS 32 Cb 0.55 0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 32.47 3fra h LYS 32 CO -0.73 -0.56 -0.23 -0.22 -2.27 0.00 0.00 179.45 175.45 3fra h LYS 33 N -0.87 -0.16 -0.77 1.90 1.63 -0.34 -1.51 116.57 116.46 3fra h LYS 33 Ca -0.03 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.80 3fra h LYS 33 Cb 0.81 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.43 3fra h LYS 33 CO -0.18 -0.10 0.49 -0.07 -3.45 0.00 0.00 179.45 176.14 3fra h LEU 34 N -0.16 0.83 -1.56 5.20 3.38 -0.88 -3.26 115.31 118.85 3fra h LEU 34 Ca 0.19 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3fra h LEU 34 Cb 0.46 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3fra h LEU 34 CO -0.50 0.58 -0.05 -1.54 0.09 0.00 0.00 178.44 177.03 3fra n SER 35 N -4.59 2.33 -4.65 -0.43 3.41 -0.87 -4.94 113.62 103.89 3fra n SER 35 Ca 0.08 -1.67 -0.49 0.00 -0.26 0.00 0.00 58.87 56.54 3fra n SER 35 Cb 0.06 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.03 3fra n SER 35 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3fra n THR 36 N 0.82 0.08 -0.94 6.66 -1.04 -0.62 -2.01 114.28 117.24 3fra n THR 36 Ca 0.10 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 3fra n THR 36 Cb 0.42 -1.29 0.00 0.00 -1.82 0.00 0.00 70.33 67.64 3fra n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3fra n GLY 37 N 3.26 0.51 0.00 3.41 0.00 -0.80 -4.98 105.19 106.59 3fra n GLY 37 Ca 0.19 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3fra n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fra n HIS 38 N -2.94 0.00 -4.94 1.61 -0.00 -0.85 -4.93 115.22 103.17 3fra n HIS 38 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.43 3fra n HIS 38 Cb 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 29.99 29.82 3fra n HIS 38 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3fra s THR 39 N 0.24 1.64 -0.20 1.59 2.01 -0.87 -1.04 115.64 119.02 3fra s THR 39 Ca 0.00 -0.78 -0.07 0.00 0.31 0.00 0.00 61.69 61.15 3fra s THR 39 Cb 0.00 -1.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 3fra s THR 39 CO 0.00 0.47 0.05 -0.76 -0.69 0.00 0.00 174.62 173.69 3fra s LEU 40 N 0.42 3.64 -0.02 4.42 1.43 0.64 0.14 118.68 129.35 3fra s LEU 40 Ca -0.15 -0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 52.91 3fra s LEU 40 Cb -0.16 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 3fra s LEU 40 CO 0.06 0.12 0.10 -0.69 0.23 0.00 0.00 176.35 176.17 3fra s VAL 41 N 0.69 4.87 -0.23 -1.59 1.01 0.52 -0.34 120.40 125.33 3fra s VAL 41 Ca 0.03 -0.31 -0.27 0.00 0.00 0.00 0.00 61.98 61.43 3fra s VAL 41 Cb -0.13 -3.21 0.11 0.00 0.00 0.00 0.00 36.38 33.14 3fra s VAL 41 CO 0.02 0.38 0.94 0.00 0.00 0.00 0.00 175.10 176.44 3fra s MET 42 N -1.66 0.64 0.64 2.72 0.00 -0.83 0.01 119.30 120.82 3fra s MET 42 Ca 0.22 0.54 -0.12 0.00 0.00 0.00 0.00 55.69 56.34 3fra s MET 42 Cb -0.12 0.31 -0.02 0.00 0.00 0.00 0.00 34.83 34.99 3fra s MET 42 CO 0.13 -0.12 1.04 0.20 0.00 0.00 0.00 175.02 176.27 3fra s GLY 43 N -0.16 1.71 0.28 3.16 0.00 -0.42 -0.12 107.32 111.77 3fra s GLY 43 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 44.72 44.75 3fra s GLY 43 CO -0.02 0.31 1.84 -0.09 0.00 0.00 0.00 173.10 175.14 3fra h ARG 44 N -0.35 0.98 -0.35 2.90 1.12 -1.78 -1.75 114.38 115.15 3fra h ARG 44 Ca -0.44 -0.06 -0.04 0.00 -1.11 0.00 0.00 59.98 58.33 3fra h ARG 44 Cb 1.20 -0.22 -0.01 0.00 -0.01 0.00 0.00 29.97 30.92 3fra h ARG 44 CO 0.60 0.65 0.06 0.87 -3.11 0.00 0.00 179.97 179.04 3fra h LYS 45 N 1.01 0.58 -0.82 0.20 1.57 -1.93 -0.76 116.57 116.42 3fra h LYS 45 Ca 0.49 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 59.10 3fra h LYS 45 Cb 0.45 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 3fra h LYS 45 CO -0.26 0.65 0.46 1.15 -0.57 0.00 0.00 179.45 180.89 3fra h THR 46 N 0.42 1.24 -0.61 -0.16 2.02 -1.68 -0.03 112.91 114.12 3fra h THR 46 Ca 0.11 -0.58 -0.06 0.00 0.77 0.00 0.00 66.41 66.65 3fra h THR 46 Cb 0.35 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 3fra h THR 46 CO 0.01 0.26 0.14 0.15 0.37 0.00 0.00 175.52 176.45 3fra h PHE 47 N 1.14 1.02 0.00 3.16 3.04 -1.06 -2.05 116.94 122.20 3fra h PHE 47 Ca 0.29 -0.12 -0.06 0.00 3.98 0.00 0.00 57.97 62.06 3fra h PHE 47 Cb 0.01 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.23 3fra h PHE 47 CO 0.00 0.86 -0.28 0.93 -2.02 0.00 0.00 178.31 177.81 3fra h GLU 48 N 0.88 0.00 -0.87 1.11 4.39 -0.82 0.60 114.58 119.88 3fra h GLU 48 Ca 0.19 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.86 3fra h GLU 48 Cb 0.36 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.97 3fra h GLU 48 CO 0.00 0.28 0.44 1.03 -1.16 0.00 0.00 179.01 179.60 3fra h SER 49 N 0.00 1.12 0.56 1.42 0.87 -0.56 -3.26 113.55 113.70 3fra h SER 49 Ca -0.00 -0.12 -0.28 0.00 -1.23 0.00 0.00 61.79 60.15 3fra h SER 49 Cb 0.84 -0.29 -0.04 0.00 -0.44 0.00 0.00 62.40 62.47 3fra h SER 49 CO 0.04 0.93 -1.59 0.40 -0.53 0.00 0.00 176.83 176.07 3fra h ILE 50 N 1.23 1.00 0.00 2.23 2.04 -0.50 -3.48 117.51 120.03 3fra h ILE 50 Ca 0.30 -2.82 0.00 0.00 1.00 0.00 0.00 64.86 63.34 3fra h ILE 50 Cb 0.09 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 3fra h ILE 50 CO -0.04 0.59 0.00 0.61 0.00 0.00 0.00 178.15 179.31 3fra n GLY 51 N 1.54 2.18 3.50 5.37 0.00 0.20 -4.92 105.19 113.06 3fra n GLY 51 Ca -0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 3fra n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fra s LYS 52 N -0.37 0.99 0.50 1.61 -2.85 -1.26 -5.02 119.74 113.35 3fra s LYS 52 Ca 0.00 -0.06 -0.21 0.00 -1.00 0.00 0.00 55.97 54.70 3fra s LYS 52 Cb 0.00 0.46 -0.09 0.00 -2.06 0.00 0.00 37.83 36.14 3fra s LYS 52 CO 0.00 -0.37 0.79 -2.30 0.10 0.00 0.00 175.35 173.57 3fra n PRO 53 N 0.32 0.88 -2.77 1.78 -0.02 -1.26 -4.92 135.00 129.01 3fra n PRO 53 Ca -0.15 0.33 -0.42 0.00 -2.02 0.00 0.00 63.50 61.24 3fra n PRO 53 Cb 0.60 -1.88 -0.03 0.00 -0.02 0.00 0.00 33.50 32.17 3fra n PRO 53 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3fra s LEU 54 N -0.13 4.14 0.53 2.45 1.02 -1.26 -5.02 118.68 120.41 3fra s LEU 54 Ca 0.68 1.28 -0.21 0.00 0.02 0.00 0.00 54.13 55.89 3fra s LEU 54 Cb -0.50 -3.39 -0.06 0.00 0.02 0.00 0.00 46.19 42.25 3fra s LEU 54 CO 0.54 -0.54 1.13 -2.65 0.02 0.00 0.00 176.35 174.86 3fra n PRO 55 N 5.78 1.35 -1.54 1.29 -0.02 -1.26 -3.70 135.00 136.89 3fra n PRO 55 Ca 0.08 0.50 -0.06 0.00 -2.02 0.00 0.00 63.50 62.00 3fra n PRO 55 Cb 0.47 -2.30 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 3fra n PRO 55 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3fra n ASN 56 N -0.51 -3.32 -3.46 2.55 5.03 -1.26 -4.96 115.26 109.33 3fra n ASN 56 Ca 0.11 0.10 -0.12 0.00 0.87 0.00 0.00 54.58 55.54 3fra n ASN 56 Cb 0.44 -1.86 -0.02 0.00 -1.02 0.00 0.00 39.78 37.32 3fra n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3fra s ARG 57 N -3.21 1.32 -0.26 3.52 1.70 -1.24 -1.91 118.95 118.86 3fra s ARG 57 Ca 0.00 -0.51 -0.29 0.00 -0.47 0.00 0.00 55.73 54.46 3fra s ARG 57 Cb 0.00 0.59 -0.01 0.00 -0.57 0.00 0.00 34.95 34.96 3fra s ARG 57 CO 0.00 -0.58 1.40 0.50 -1.08 0.00 0.00 175.30 175.54 3fra s ARG 58 N -3.76 3.91 -0.31 3.89 3.52 -0.20 -4.85 118.95 121.14 3fra s ARG 58 Ca 0.02 1.43 -0.17 0.00 -0.13 0.00 0.00 55.73 56.88 3fra s ARG 58 Cb -0.01 -3.92 -0.02 0.00 -1.56 0.00 0.00 34.95 29.44 3fra s ARG 58 CO -0.11 -1.13 0.45 -0.80 -0.81 0.00 0.00 175.30 172.89 3fra s ASN 59 N 3.18 6.30 -0.16 -2.12 0.01 -1.26 -0.26 114.94 120.63 3fra s ASN 59 Ca 0.61 0.12 -0.01 0.00 -0.71 0.00 0.00 52.86 52.87 3fra s ASN 59 Cb -0.20 -2.24 -0.01 0.00 0.41 0.00 0.00 41.25 39.21 3fra s ASN 59 CO 0.24 -0.34 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.68 3fra s VAL 60 N 2.23 2.96 -0.21 1.60 1.01 0.54 -1.52 120.40 127.02 3fra s VAL 60 Ca 0.17 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 3fra s VAL 60 Cb -0.16 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 3fra s VAL 60 CO 0.11 0.50 -0.03 -0.69 0.00 0.00 0.00 175.10 174.99 3fra s VAL 61 N 0.78 3.55 -0.19 2.92 1.01 0.05 -1.97 120.40 126.55 3fra s VAL 61 Ca -0.05 -0.44 -0.21 0.00 0.00 0.00 0.00 61.98 61.28 3fra s VAL 61 Cb -0.15 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 3fra s VAL 61 CO 0.01 0.43 0.63 -0.22 0.00 0.00 0.00 175.10 175.94 3fra s LEU 62 N 1.24 4.15 0.06 3.92 2.96 0.83 -2.28 118.68 129.57 3fra s LEU 62 Ca 0.03 0.84 -0.18 0.00 -0.22 0.00 0.00 54.13 54.60 3fra s LEU 62 Cb -0.14 -2.89 0.04 0.00 0.50 0.00 0.00 46.19 43.70 3fra s LEU 62 CO -0.01 -0.26 0.42 0.28 -1.32 0.00 0.00 176.35 175.47 3fra s THR 63 N 1.83 0.06 -2.13 3.68 -1.32 -0.72 -2.07 115.64 114.96 3fra s THR 63 Ca 0.29 -0.46 0.29 0.00 -1.21 0.00 0.00 61.69 60.60 3fra s THR 63 Cb -0.16 -1.00 0.55 0.00 -1.51 0.00 0.00 72.50 70.38 3fra s THR 63 CO 0.11 -0.25 1.82 -1.54 -2.21 0.00 0.00 174.62 172.55 3fra n SER 64 N 0.33 0.96 -4.56 8.08 3.41 -1.26 -4.17 113.62 116.41 3fra n SER 64 Ca -0.18 -1.13 -0.41 0.00 -0.26 0.00 0.00 58.87 56.89 3fra n SER 64 Cb 0.61 0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 3fra n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fra s ASP 65 N -2.17 6.29 0.00 4.04 3.68 -1.26 -4.93 116.67 122.32 3fra s ASP 65 Ca 0.36 -0.01 0.25 0.00 2.13 0.00 0.00 52.55 55.27 3fra s ASP 65 Cb 0.21 -2.25 1.12 0.00 -1.45 0.00 0.00 42.92 40.55 3fra s ASP 65 CO 0.40 -0.41 1.76 0.35 0.13 0.00 0.00 175.17 177.40 3fra n THR 66 N 5.34 0.07 1.22 1.71 -2.24 -1.26 -2.30 114.28 116.82 3fra n THR 66 Ca -0.06 -0.19 0.13 0.00 -2.27 0.00 0.00 64.05 61.65 3fra n THR 66 Cb 0.49 0.15 0.29 0.00 -2.10 0.00 0.00 70.33 69.15 3fra n THR 66 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fra n SER 67 N -0.15 1.76 -4.65 3.42 7.64 -1.26 -4.90 113.62 115.48 3fra n SER 67 Ca 0.18 -1.41 -0.43 0.00 1.01 0.00 0.00 58.87 58.22 3fra n SER 67 Cb 0.25 0.14 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 3fra n SER 67 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3fra s PHE 68 N -2.26 2.09 -0.48 1.43 5.36 -0.97 -4.92 117.98 118.23 3fra s PHE 68 Ca 0.28 0.42 0.06 0.00 -0.96 0.00 0.00 56.93 56.73 3fra s PHE 68 Cb 0.20 -3.91 0.18 0.00 -0.34 0.00 0.00 43.02 39.15 3fra s PHE 68 CO 0.44 -3.29 0.61 1.21 -1.46 0.00 0.00 175.22 172.73 3fra s ASN 69 N 3.71 -0.64 -0.07 6.13 2.47 -1.26 -4.93 114.94 120.34 3fra s ASN 69 Ca 0.72 -2.03 -0.11 0.00 0.42 0.00 0.00 52.86 51.86 3fra s ASN 69 Cb -0.29 1.26 -0.05 0.00 -1.45 0.00 0.00 41.25 40.73 3fra s ASN 69 CO 0.28 -0.09 0.26 -0.69 -3.72 0.00 0.00 177.10 173.14 3fra s VAL 70 N 0.73 5.30 0.15 -5.21 1.01 -1.26 -5.04 120.40 116.07 3fra s VAL 70 Ca 0.30 0.49 -0.31 0.00 0.00 0.00 0.00 61.98 62.45 3fra s VAL 70 Cb 0.00 -3.54 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 3fra s VAL 70 CO -0.09 0.59 1.43 -0.70 0.00 0.00 0.00 175.10 176.34 3fra s GLU 71 N -0.96 4.29 0.00 2.72 -6.30 -1.26 -2.17 118.70 115.03 3fra s GLU 71 Ca 0.19 2.17 0.00 0.00 -2.50 0.00 0.00 54.97 54.83 3fra s GLU 71 Cb -0.14 -3.20 0.00 0.00 0.00 0.00 0.00 34.13 30.79 3fra s GLU 71 CO 0.08 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.31 3fra n GLY 72 N 3.32 0.18 3.01 -1.50 0.00 -1.26 -4.78 105.19 104.16 3fra n GLY 72 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 3fra n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fra s VAL 73 N -2.06 1.07 -0.06 1.61 1.01 -0.92 -4.46 120.40 116.60 3fra s VAL 73 Ca 0.00 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 3fra s VAL 73 Cb 0.00 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.34 3fra s VAL 73 CO 0.00 0.34 0.29 -1.81 0.00 0.00 0.00 175.10 173.92 3fra s ASP 74 N 0.72 6.62 -0.01 3.32 -0.00 -0.58 -4.44 116.67 122.30 3fra s ASP 74 Ca -0.14 0.74 0.02 0.00 -0.00 0.00 0.00 52.55 53.17 3fra s ASP 74 Cb -0.16 -2.17 -0.03 0.00 -0.00 0.00 0.00 42.92 40.56 3fra s ASP 74 CO 0.03 0.36 -0.04 0.54 -0.00 0.00 0.00 175.17 176.07 3fra s VAL 75 N -1.05 3.89 0.11 -1.27 0.11 -1.26 -0.77 120.40 120.16 3fra s VAL 75 Ca 0.20 -0.65 0.03 0.00 -2.93 0.00 0.00 61.98 58.62 3fra s VAL 75 Cb -0.15 -2.70 -0.04 0.00 -1.53 0.00 0.00 36.38 31.96 3fra s VAL 75 CO 0.09 0.42 -0.08 0.27 -3.33 0.00 0.00 175.10 172.47 3fra s ILE 76 N -1.01 0.85 0.00 7.04 -4.36 -0.96 -4.93 121.20 117.83 3fra s ILE 76 Ca 0.17 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 58.61 3fra s ILE 76 Cb -0.11 -1.70 0.00 0.00 1.25 0.00 0.00 42.46 41.89 3fra s ILE 76 CO 0.08 -0.81 0.31 1.41 0.24 0.00 0.00 174.94 176.17 3fra n HIS 77 N -0.04 0.00 -4.39 1.37 8.25 -1.26 -1.76 115.22 117.39 3fra n HIS 77 Ca -0.12 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.15 3fra n HIS 77 Cb 0.60 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.57 3fra n HIS 77 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3fra s SER 78 N -0.13 1.35 0.36 0.41 0.15 -1.26 -4.84 113.70 109.73 3fra s SER 78 Ca 0.00 -0.31 0.12 0.00 0.70 0.00 0.00 55.95 56.47 3fra s SER 78 Cb 0.00 -0.11 0.92 0.00 -1.71 0.00 0.00 66.02 65.12 3fra s SER 78 CO 0.00 0.07 1.79 0.40 1.20 0.00 0.00 173.24 176.71 3fra h ILE 79 N 4.73 0.65 0.00 6.45 1.08 -2.00 -2.70 117.51 125.72 3fra h ILE 79 Ca -0.34 -0.20 -0.03 0.00 -0.39 0.00 0.00 64.86 63.90 3fra h ILE 79 Cb 1.18 0.02 -0.00 0.00 -3.07 0.00 0.00 36.82 34.94 3fra h ILE 79 CO 0.47 0.10 -0.14 -0.33 -0.69 0.00 0.00 178.15 177.56 3fra h GLU 80 N 0.57 0.00 0.00 2.37 4.39 -2.03 -1.65 114.58 118.24 3fra h GLU 80 Ca 0.56 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.25 3fra h GLU 80 Cb 1.13 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3fra h GLU 80 CO -0.31 0.14 -0.06 -0.44 -1.16 0.00 0.00 179.01 177.18 3fra h ASP 81 N 0.00 0.00 -0.96 1.42 3.32 -1.90 -2.50 116.42 115.80 3fra h ASP 81 Ca -0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 3fra h ASP 81 Cb 0.43 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.93 3fra h ASP 81 CO 0.02 0.06 0.63 0.40 -1.72 0.00 0.00 179.24 178.63 3fra h ILE 82 N 0.00 1.18 0.00 0.35 2.04 -1.46 -1.81 117.51 117.82 3fra h ILE 82 Ca -0.00 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.44 3fra h ILE 82 Cb 0.32 -0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 3fra h ILE 82 CO 0.01 0.22 0.00 -1.22 0.00 0.00 0.00 178.15 177.16 3fra n TYR 83 N -4.43 0.00 0.09 1.37 4.01 -0.94 -1.95 117.16 115.31 3fra n TYR 83 Ca 0.13 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.83 3fra n TYR 83 Cb 0.09 -0.50 -0.07 0.00 -0.31 0.00 0.00 39.34 38.55 3fra n TYR 83 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3fra h GLN 84 N 0.00 0.00 -6.70 -0.72 7.50 -1.44 -3.47 115.11 110.28 3fra h GLN 84 Ca 0.00 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 58.62 3fra h GLN 84 Cb 0.35 0.00 0.05 0.00 0.05 0.00 0.00 27.48 27.93 3fra h GLN 84 CO 0.00 0.84 0.77 -0.51 -1.50 0.00 0.00 178.83 178.43 3fra s LEU 85 N -6.64 4.38 0.50 1.46 1.43 -0.82 -5.00 118.68 113.99 3fra s LEU 85 Ca 0.02 2.62 -0.18 0.00 -1.03 0.00 0.00 54.13 55.56 3fra s LEU 85 Cb 0.09 -3.61 -0.08 0.00 0.03 0.00 0.00 46.19 42.61 3fra s LEU 85 CO 0.80 -0.71 0.99 -2.16 0.23 0.00 0.00 176.35 175.50 3fra s PRO 86 N 0.01 3.94 0.40 1.29 0.04 -1.26 -4.96 135.00 134.45 3fra s PRO 86 Ca 0.61 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.73 3fra s PRO 86 Cb -0.41 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 31.99 3fra s PRO 86 CO 0.40 -0.28 0.00 0.41 0.04 0.00 0.00 177.00 177.57 3fra n GLY 87 N -1.11 -1.80 3.63 0.56 0.00 -1.26 -4.75 105.19 100.46 3fra n GLY 87 Ca 0.07 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 3fra n GLY 87 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3fra s HIS 88 N 0.00 3.14 -0.25 1.61 5.65 -1.26 -3.10 115.29 121.08 3fra s HIS 88 Ca 0.00 1.12 -0.09 0.00 0.25 0.00 0.00 55.06 56.35 3fra s HIS 88 Cb 0.00 -3.68 -0.04 0.00 -1.18 0.00 0.00 32.58 27.68 3fra s HIS 88 CO 0.00 -0.77 0.11 0.08 -0.65 0.00 0.00 174.74 173.51 3fra s VAL 89 N 3.62 4.73 -0.25 0.89 1.01 0.92 -2.04 120.40 129.29 3fra s VAL 89 Ca 0.44 -0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.29 3fra s VAL 89 Cb -0.12 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 3fra s VAL 89 CO 0.16 0.32 0.15 -0.36 0.00 0.00 0.00 175.10 175.37 3fra s PHE 90 N 1.52 3.25 -0.29 5.22 0.08 0.12 -0.77 117.98 127.11 3fra s PHE 90 Ca 0.06 0.10 -0.29 0.00 0.12 0.00 0.00 56.93 56.92 3fra s PHE 90 Cb -0.15 -2.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.02 3fra s PHE 90 CO 0.06 -0.04 1.29 0.42 -0.10 0.00 0.00 175.22 176.85 3fra s ILE 91 N 1.25 4.16 -1.15 0.64 -1.09 0.19 -0.36 121.20 124.85 3fra s ILE 91 Ca 0.07 1.32 0.16 0.00 -2.23 0.00 0.00 60.65 59.96 3fra s ILE 91 Cb -0.14 -4.16 -0.07 0.00 -1.58 0.00 0.00 42.46 36.51 3fra s ILE 91 CO 0.06 -0.45 0.76 0.33 -1.23 0.00 0.00 174.94 174.41 3fra n PHE 92 N 7.53 0.00 0.00 3.97 -0.00 0.10 -0.57 117.46 128.50 3fra n PHE 92 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 3fra n PHE 92 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.94 3fra n PHE 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fra n GLY 93 N 1.24 2.36 0.00 7.13 0.00 -1.26 -4.92 105.19 109.74 3fra n GLY 93 Ca 0.05 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3fra n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fra n GLY 94 N -1.08 2.46 0.28 -0.02 0.00 -1.26 -1.31 105.19 104.26 3fra n GLY 94 Ca 0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 46.02 45.04 3fra n GLY 94 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3fra h GLN 95 N 0.00 0.74 -0.63 1.61 4.15 -1.98 -0.63 115.11 118.36 3fra h GLN 95 Ca 0.00 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.35 3fra h GLN 95 Cb 0.00 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 27.49 3fra h GLN 95 CO 0.00 0.49 0.28 1.79 -1.93 0.00 0.00 178.83 179.46 3fra h THR 96 N 0.76 1.23 -0.21 2.39 1.35 -1.94 -1.42 112.91 115.07 3fra h THR 96 Ca 0.33 -0.67 -0.01 0.00 -0.55 0.00 0.00 66.41 65.51 3fra h THR 96 Cb 0.21 0.49 -0.01 0.00 -1.73 0.00 0.00 68.15 67.12 3fra h THR 96 CO -0.19 0.27 0.08 -0.07 -0.25 0.00 0.00 175.52 175.36 3fra h LEU 97 N 0.88 0.28 -0.72 3.87 -0.00 -1.46 -1.77 115.31 116.38 3fra h LEU 97 Ca 0.21 -0.16 0.05 0.00 -0.00 0.00 0.00 57.88 57.98 3fra h LEU 97 Cb 0.16 -0.07 -0.05 0.00 -0.00 0.00 0.00 40.66 40.69 3fra h LEU 97 CO -0.02 0.37 0.43 1.88 -0.00 0.00 0.00 178.44 181.10 3fra h TYR 98 N 0.18 0.81 -0.32 1.13 0.05 -1.01 0.41 116.97 118.22 3fra h TYR 98 Ca 0.07 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.79 3fra h TYR 98 Cb 0.17 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 3fra h TYR 98 CO -0.01 0.43 -0.13 0.93 -1.05 0.00 0.00 178.16 178.32 3fra h GLU 99 N 0.82 0.56 0.00 4.88 5.08 -1.11 -0.95 114.58 123.85 3fra h GLU 99 Ca 0.31 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.37 3fra h GLU 99 Cb 0.11 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 3fra h GLU 99 CO -0.15 0.68 -0.59 0.93 -1.00 0.00 0.00 179.01 178.88 3fra h GLU 100 N 0.51 0.00 0.00 2.33 5.08 -0.35 -3.36 114.58 118.79 3fra h GLU 100 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3fra h GLU 100 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3fra h GLU 100 CO 0.03 0.59 -1.09 -1.33 -1.00 0.00 0.00 179.01 176.21 3fra n MET 101 N -3.28 1.61 0.25 2.33 2.81 0.03 -4.66 117.12 116.21 3fra n MET 101 Ca 0.01 -0.06 0.09 0.00 -1.81 0.00 0.00 57.70 55.93 3fra n MET 101 Cb 0.76 -1.15 0.63 0.00 -0.71 0.00 0.00 33.22 32.74 3fra n MET 101 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3fra h ILE 102 N 0.00 0.89 -0.14 2.02 -0.00 -1.33 0.27 117.51 119.22 3fra h ILE 102 Ca 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 64.86 64.39 3fra h ILE 102 Cb 0.39 1.27 0.00 0.00 -0.00 0.00 0.00 36.82 38.48 3fra h ILE 102 CO 0.00 0.13 0.00 0.47 -0.00 0.00 0.00 178.15 178.75 3fra n ASP 103 N -4.09 1.35 0.00 2.19 10.43 -1.26 -4.23 116.55 120.94 3fra n ASP 103 Ca -0.02 -1.67 0.00 0.00 2.57 0.00 0.00 54.79 55.66 3fra n ASP 103 Cb 0.21 -0.09 0.00 0.00 1.84 0.00 0.00 41.12 43.08 3fra n ASP 103 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3fra n LYS 104 N 0.12 3.77 -1.84 -1.24 4.76 0.89 -5.05 118.16 119.57 3fra n LYS 104 Ca 0.15 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.26 3fra n LYS 104 Cb 0.27 -1.00 0.04 0.00 -1.84 0.00 0.00 35.03 32.51 3fra n LYS 104 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3fra s VAL 105 N -1.99 3.21 0.04 -0.18 -7.23 -0.76 -4.96 120.40 108.52 3fra s VAL 105 Ca 0.00 0.59 -0.16 0.00 -1.81 0.00 0.00 61.98 60.61 3fra s VAL 105 Cb 0.00 -3.13 -0.30 0.00 0.56 0.00 0.00 36.38 33.51 3fra s VAL 105 CO 0.00 -0.32 1.07 0.44 -0.31 0.00 0.00 175.10 175.99 3fra h ASP 106 N 0.23 0.85 -5.39 4.85 3.32 -0.97 -3.46 116.42 115.85 3fra h ASP 106 Ca -0.47 -0.84 -0.16 0.00 0.02 0.00 0.00 57.03 55.58 3fra h ASP 106 Cb 1.25 -0.27 -0.10 0.00 0.22 0.00 0.00 39.33 40.43 3fra h ASP 106 CO 0.54 1.62 -0.22 1.51 -1.72 0.00 0.00 179.24 180.97 3fra s ASP 107 N -7.42 0.27 -0.04 6.45 3.84 -1.20 -2.33 116.67 116.24 3fra s ASP 107 Ca -0.10 -1.19 0.02 0.00 -0.00 0.00 0.00 52.55 51.28 3fra s ASP 107 Cb 0.05 0.58 0.02 0.00 -1.38 0.00 0.00 42.92 42.19 3fra s ASP 107 CO 0.93 -1.15 -0.06 -0.04 -0.00 0.00 0.00 175.17 174.85 3fra s MET 108 N -3.71 0.91 -0.40 2.11 -1.94 -0.50 -1.50 119.30 114.27 3fra s MET 108 Ca 0.28 -0.18 -0.15 0.00 -1.71 0.00 0.00 55.69 53.92 3fra s MET 108 Cb 0.01 -0.87 0.01 0.00 2.01 0.00 0.00 34.83 35.99 3fra s MET 108 CO 0.13 -0.01 0.33 0.71 -0.01 0.00 0.00 175.02 176.17 3fra s TYR 109 N 0.66 3.22 -0.11 -0.03 1.51 0.80 -1.26 117.35 122.14 3fra s TYR 109 Ca -0.09 -0.42 0.03 0.00 -1.01 0.00 0.00 57.07 55.57 3fra s TYR 109 Cb -0.13 -2.66 -0.00 0.00 -0.11 0.00 0.00 41.96 39.06 3fra s TYR 109 CO 0.01 -0.57 -0.21 0.42 -1.11 0.00 0.00 175.55 174.09 3fra s ILE 110 N 1.84 2.32 -0.42 2.71 1.01 -0.10 -1.81 121.20 126.75 3fra s ILE 110 Ca 0.08 -0.93 -0.18 0.00 0.00 0.00 0.00 60.65 59.62 3fra s ILE 110 Cb -0.18 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.40 3fra s ILE 110 CO 0.11 0.55 0.48 -0.89 0.00 0.00 0.00 174.94 175.19 3fra s THR 111 N 0.31 5.03 -0.36 2.92 2.01 0.38 -0.20 115.64 125.73 3fra s THR 111 Ca -0.16 -0.22 -0.28 0.00 0.31 0.00 0.00 61.69 61.34 3fra s THR 111 Cb -0.17 -4.07 0.02 0.00 0.01 0.00 0.00 72.50 68.29 3fra s THR 111 CO 0.08 -0.45 1.03 -0.69 -0.69 0.00 0.00 174.62 173.90 3fra s VAL 112 N 2.29 4.49 -0.37 3.82 1.01 -0.45 -0.63 120.40 130.56 3fra s VAL 112 Ca 0.14 1.45 -0.23 0.00 0.00 0.00 0.00 61.98 63.35 3fra s VAL 112 Cb -0.16 -4.41 0.01 0.00 0.00 0.00 0.00 36.38 31.81 3fra s VAL 112 CO 0.15 -0.58 0.76 -0.63 0.00 0.00 0.00 175.10 174.79 3fra s ILE 113 N 3.71 4.75 -1.03 2.22 -1.09 0.12 -1.33 121.20 128.55 3fra s ILE 113 Ca 0.43 0.80 -0.08 0.00 -2.23 0.00 0.00 60.65 59.57 3fra s ILE 113 Cb -0.11 -4.20 -0.15 0.00 -1.58 0.00 0.00 42.46 36.42 3fra s ILE 113 CO 0.19 -0.43 3.19 -0.62 -1.23 0.00 0.00 174.94 176.04 3fra n GLU 114 N 6.38 3.11 -4.19 2.79 -0.58 0.38 -2.82 120.64 125.71 3fra n GLU 114 Ca 0.02 -1.80 -0.13 0.00 -0.42 0.00 0.00 57.16 54.83 3fra n GLU 114 Cb 0.48 -2.50 -0.09 0.00 -0.57 0.00 0.00 31.44 28.76 3fra n GLU 114 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3fra s GLY 115 N 2.05 1.48 -0.24 0.62 0.00 -1.26 -4.67 107.32 105.29 3fra s GLY 115 Ca 0.68 -1.66 -0.03 0.00 0.00 0.00 0.00 44.72 43.72 3fra s GLY 115 CO -0.04 -1.32 -0.05 0.54 0.00 0.00 0.00 173.10 172.24 3fra s LYS 116 N -4.00 3.01 0.23 2.90 1.02 -1.26 -2.10 119.74 119.54 3fra s LYS 116 Ca 0.37 -0.86 0.09 0.00 0.02 0.00 0.00 55.97 55.59 3fra s LYS 116 Cb 0.05 -3.02 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 3fra s LYS 116 CO 0.14 -0.34 -0.04 -0.06 -0.92 0.00 0.00 175.35 174.13 3fra s PHE 117 N 1.38 2.68 -0.03 3.18 0.08 -1.26 -5.09 117.98 118.92 3fra s PHE 117 Ca 0.02 -0.22 -0.30 0.00 0.12 0.00 0.00 56.93 56.56 3fra s PHE 117 Cb -0.16 -1.23 -0.04 0.00 -0.57 0.00 0.00 43.02 41.02 3fra s PHE 117 CO -0.04 0.58 1.30 0.50 -0.10 0.00 0.00 175.22 177.47 3fra s ARG 118 N -3.35 4.31 0.27 0.44 3.52 -1.26 -4.95 118.95 117.93 3fra s ARG 118 Ca 0.29 1.82 0.02 0.00 -0.13 0.00 0.00 55.73 57.72 3fra s ARG 118 Cb -0.07 -3.58 -0.05 0.00 -1.56 0.00 0.00 34.95 29.69 3fra s ARG 118 CO 0.18 -0.52 0.10 0.20 -0.81 0.00 0.00 175.30 174.45 3fra s GLY 119 N 1.71 1.80 0.00 8.12 0.00 -1.26 -4.69 107.32 113.01 3fra s GLY 119 Ca 0.60 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 43.45 3fra s GLY 119 CO 0.24 -1.62 0.41 2.09 0.00 0.00 0.00 173.10 174.22 3fra n ASP 120 N -0.53 0.62 -4.09 1.64 3.85 -0.03 -4.95 116.55 113.06 3fra n ASP 120 Ca -0.00 -1.17 -0.13 0.00 -0.71 0.00 0.00 54.79 52.78 3fra n ASP 120 Cb 0.66 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.32 3fra n ASP 120 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 3fra s THR 121 N -0.17 0.61 0.04 2.12 -4.23 -1.13 -5.01 115.64 107.86 3fra s THR 121 Ca 0.00 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.29 3fra s THR 121 Cb 0.00 -0.81 -0.02 0.00 1.34 0.00 0.00 72.50 73.01 3fra s THR 121 CO 0.00 -0.45 -0.06 -0.36 -0.54 0.00 0.00 174.62 173.22 3fra s PHE 122 N -1.72 0.50 0.12 3.99 0.08 -1.26 -1.45 117.98 118.24 3fra s PHE 122 Ca -0.06 -0.54 -0.27 0.00 0.12 0.00 0.00 56.93 56.18 3fra s PHE 122 Cb -0.08 -0.32 -0.07 0.00 -0.57 0.00 0.00 43.02 41.99 3fra s PHE 122 CO -0.00 -0.14 0.85 0.12 -0.10 0.00 0.00 175.22 175.95 3fra s PHE 123 N -1.56 3.84 0.38 0.36 5.36 0.13 -4.71 117.98 121.79 3fra s PHE 123 Ca -0.11 1.67 -0.26 0.00 -0.96 0.00 0.00 56.93 57.26 3fra s PHE 123 Cb -0.09 -2.90 -0.11 0.00 -0.34 0.00 0.00 43.02 39.58 3fra s PHE 123 CO -0.01 0.34 1.23 -0.35 -1.46 0.00 0.00 175.22 174.97 3fra n PRO 124 N 2.32 1.90 -1.68 10.12 -0.04 -1.26 -4.88 135.00 141.48 3fra n PRO 124 Ca -0.02 0.67 -0.40 0.00 -0.04 0.00 0.00 63.50 63.71 3fra n PRO 124 Cb 0.49 -2.29 0.02 0.00 -0.04 0.00 0.00 33.50 31.68 3fra n PRO 124 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3fra n PRO 125 N 0.29 1.72 -3.82 0.54 -0.04 -1.26 -5.03 135.00 127.40 3fra n PRO 125 Ca 0.06 0.62 -0.09 0.00 -0.04 0.00 0.00 63.50 64.05 3fra n PRO 125 Cb 0.38 -2.33 -0.07 0.00 -0.04 0.00 0.00 33.50 31.44 3fra n PRO 125 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3fra s TYR 126 N -1.25 0.09 -0.05 0.54 -0.85 -1.26 -5.17 117.35 109.41 3fra s TYR 126 Ca 0.64 -0.50 0.06 0.00 -0.52 0.00 0.00 57.07 56.75 3fra s TYR 126 Cb -0.50 -0.00 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 3fra s TYR 126 CO 0.56 -0.57 -0.24 0.99 -1.52 0.00 0.00 175.55 174.77 3fra s THR 127 N -3.85 2.21 -0.30 -3.49 2.01 -1.26 -4.98 115.64 105.97 3fra s THR 127 Ca 0.05 -1.03 0.25 0.00 0.31 0.00 0.00 61.69 61.27 3fra s THR 127 Cb 0.04 -1.80 0.26 0.00 0.01 0.00 0.00 72.50 71.02 3fra s THR 127 CO -0.11 0.57 1.75 -0.26 -0.69 0.00 0.00 174.62 175.88 3fra h PHE 128 N 5.80 0.00 -0.18 4.92 0.04 -2.03 0.33 116.94 125.82 3fra h PHE 128 Ca -0.37 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.45 3fra h PHE 128 Cb 1.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.30 3fra h PHE 128 CO 0.43 0.00 0.24 1.49 -0.60 0.00 0.00 178.31 179.87 3fra h GLU 129 N 0.00 0.00 0.00 1.51 4.81 -2.04 -2.65 114.58 116.22 3fra h GLU 129 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3fra h GLU 129 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 3fra h GLU 129 CO 0.00 0.00 -1.61 -0.25 -0.73 0.00 0.00 179.01 176.42 3fra n ASP 130 N -3.60 1.10 -3.86 1.04 10.43 0.11 -4.94 116.55 116.84 3fra n ASP 130 Ca 0.02 -0.14 -0.18 0.00 2.57 0.00 0.00 54.79 57.06 3fra n ASP 130 Cb 0.36 1.64 -0.16 0.00 1.84 0.00 0.00 41.12 44.81 3fra n ASP 130 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 3fra s TRP 131 N -3.06 0.45 -0.07 1.24 0.52 -1.00 -1.20 118.94 115.82 3fra s TRP 131 Ca -0.04 -0.07 -0.01 0.00 0.02 0.00 0.00 56.10 56.00 3fra s TRP 131 Cb 0.11 -0.46 -0.03 0.00 -1.15 0.00 0.00 33.47 31.94 3fra s TRP 131 CO 0.69 -0.13 -0.01 -2.00 0.02 0.00 0.00 176.95 175.53 3fra s GLU 132 N 0.84 2.92 -0.81 4.98 2.12 -0.46 -4.47 118.70 123.82 3fra s GLU 132 Ca -0.09 -0.46 -0.21 0.00 0.36 0.00 0.00 54.97 54.57 3fra s GLU 132 Cb -0.12 -2.75 0.09 0.00 0.26 0.00 0.00 34.13 31.61 3fra s GLU 132 CO -0.01 0.69 1.10 0.08 -0.54 0.00 0.00 175.26 176.58 3fra s VAL 133 N -0.91 4.40 0.25 3.70 1.01 -1.26 -1.08 120.40 126.51 3fra s VAL 133 Ca 0.14 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.34 3fra s VAL 133 Cb -0.11 -4.78 -0.03 0.00 0.00 0.00 0.00 36.38 31.46 3fra s VAL 133 CO 0.03 -1.56 1.60 0.00 0.00 0.00 0.00 175.10 175.17 3fra h ALA 134 N 9.34 0.92 -2.19 5.51 0.00 -1.15 -3.45 119.26 128.24 3fra h ALA 134 Ca -0.06 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.26 3fra h ALA 134 Cb 1.04 -0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.56 3fra h ALA 134 CO 1.19 0.71 0.05 -1.54 0.00 0.00 0.00 179.25 179.66 3fra s SER 135 N -6.89 -0.51 -0.09 0.00 1.04 -1.05 -4.98 113.70 101.22 3fra s SER 135 Ca -0.04 0.49 -0.03 0.00 0.48 0.00 0.00 55.95 56.85 3fra s SER 135 Cb 0.12 0.47 0.04 0.00 0.10 0.00 0.00 66.02 66.76 3fra s SER 135 CO 0.79 -0.58 0.09 -0.55 0.98 0.00 0.00 173.24 173.97 3fra s SER 136 N -1.30 1.49 -0.08 7.02 0.15 -1.26 -1.38 113.70 118.34 3fra s SER 136 Ca -0.11 -0.13 -0.01 0.00 0.70 0.00 0.00 55.95 56.41 3fra s SER 136 Cb -0.02 -0.11 0.03 0.00 -1.71 0.00 0.00 66.02 64.21 3fra s SER 136 CO 0.07 -0.28 -0.03 -0.69 1.20 0.00 0.00 173.24 173.51 3fra s VAL 137 N 2.18 0.61 -0.08 4.45 1.01 -0.52 -4.98 120.40 123.08 3fra s VAL 137 Ca 0.04 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 3fra s VAL 137 Cb -0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 3fra s VAL 137 CO -0.06 0.29 1.44 -1.61 0.00 0.00 0.00 175.10 175.16 3fra s GLU 138 N 1.66 4.23 0.61 2.72 2.02 -1.26 -0.45 118.70 128.22 3fra s GLU 138 Ca 0.01 1.93 -0.18 0.00 0.02 0.00 0.00 54.97 56.76 3fra s GLU 138 Cb -0.13 -3.80 -0.11 0.00 0.10 0.00 0.00 34.13 30.20 3fra s GLU 138 CO -0.05 -0.72 0.19 0.41 0.02 0.00 0.00 175.26 175.11 3fra n GLY 139 N 3.81 -2.37 3.71 -1.39 0.00 0.99 -4.93 105.19 105.01 3fra n GLY 139 Ca 0.15 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3fra n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fra s LYS 140 N -1.81 4.20 0.05 1.61 3.01 -1.26 -4.75 119.74 120.79 3fra s LYS 140 Ca 0.62 -0.03 -0.21 0.00 -1.01 0.00 0.00 55.97 55.33 3fra s LYS 140 Cb -0.43 -3.45 -0.06 0.00 -1.01 0.00 0.00 37.83 32.88 3fra s LYS 140 CO 0.61 0.19 0.63 -0.51 0.51 0.00 0.00 175.35 176.79 3fra s LEU 141 N 0.63 4.48 0.00 3.17 1.43 -1.26 -4.81 118.68 122.32 3fra s LEU 141 Ca 0.13 1.29 -0.08 0.00 -1.03 0.00 0.00 54.13 54.44 3fra s LEU 141 Cb -0.13 -3.00 0.03 0.00 0.03 0.00 0.00 46.19 43.13 3fra s LEU 141 CO 0.03 0.16 0.49 -0.90 0.23 0.00 0.00 176.35 176.36 3fra n ASP 142 N 2.29 -1.43 -0.28 2.29 3.85 -0.01 -4.96 116.55 118.31 3fra n ASP 142 Ca -0.07 -2.15 0.09 0.00 -0.71 0.00 0.00 54.79 51.95 3fra n ASP 142 Cb 0.51 2.42 0.24 0.00 -1.35 0.00 0.00 41.12 42.94 3fra n ASP 142 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 3fra h GLU 143 N 0.00 0.40 0.00 0.11 4.39 -2.02 -1.74 114.58 115.72 3fra h GLU 143 Ca -0.22 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.43 3fra h GLU 143 Cb 0.84 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.40 3fra h GLU 143 CO 0.28 0.26 -0.58 0.87 -1.16 0.00 0.00 179.01 178.69 3fra h LYS 144 N 0.41 0.00 -3.63 2.33 6.56 -1.97 -3.43 116.57 116.84 3fra h LYS 144 Ca 0.48 0.00 -0.59 0.00 -1.06 0.00 0.00 60.65 59.48 3fra h LYS 144 Cb 0.83 0.00 -0.40 0.00 -0.57 0.00 0.00 32.23 32.09 3fra h LYS 144 CO -0.48 0.08 -0.75 -0.80 -2.06 0.00 0.00 179.45 175.44 3fra s ASN 145 N -5.86 4.08 0.00 0.86 0.01 -0.65 -4.55 114.94 108.83 3fra s ASN 145 Ca 0.03 -1.68 0.00 0.00 -0.71 0.00 0.00 52.86 50.50 3fra s ASN 145 Cb 0.07 -0.92 0.00 0.00 0.41 0.00 0.00 41.25 40.82 3fra s ASN 145 CO 0.74 -0.41 0.52 0.35 -1.51 0.00 0.00 177.10 176.79 3fra n THR 146 N 4.80 0.10 -4.31 1.60 -2.24 -1.26 -0.83 114.28 112.15 3fra n THR 146 Ca -0.02 -0.52 -0.34 0.00 -2.27 0.00 0.00 64.05 60.90 3fra n THR 146 Cb 0.42 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.54 3fra n THR 146 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fra s ILE 147 N -0.10 4.20 0.43 2.28 1.09 -1.26 -5.01 121.20 122.82 3fra s ILE 147 Ca 0.00 -0.26 -0.26 0.00 -1.10 0.00 0.00 60.65 59.03 3fra s ILE 147 Cb 0.00 -2.83 -0.09 0.00 -1.06 0.00 0.00 42.46 38.48 3fra s ILE 147 CO 0.00 0.51 1.41 -2.65 -0.10 0.00 0.00 174.94 174.12 3fra n PRO 148 N 3.17 2.28 -3.59 2.79 -0.02 -1.26 -4.89 135.00 133.48 3fra n PRO 148 Ca -0.17 0.81 -0.14 0.00 -2.02 0.00 0.00 63.50 61.97 3fra n PRO 148 Cb 0.53 -2.59 -0.06 0.00 -0.02 0.00 0.00 33.50 31.36 3fra n PRO 148 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3fra s HIS 149 N -1.18 -0.62 -0.05 6.00 -3.43 -1.26 -0.47 115.29 114.28 3fra s HIS 149 Ca 0.59 1.32 0.02 0.00 -0.80 0.00 0.00 55.06 56.19 3fra s HIS 149 Cb -0.47 0.36 0.02 0.00 -1.43 0.00 0.00 32.58 31.06 3fra s HIS 149 CO 0.59 -0.43 -0.08 0.99 -2.00 0.00 0.00 174.74 173.81 3fra s THR 150 N -0.41 0.83 -0.46 -5.38 2.01 -0.44 -0.01 115.64 111.78 3fra s THR 150 Ca -0.03 -0.31 -0.25 0.00 0.31 0.00 0.00 61.69 61.41 3fra s THR 150 Cb -0.03 -0.79 0.03 0.00 0.01 0.00 0.00 72.50 71.72 3fra s THR 150 CO 0.03 0.28 0.88 -0.36 -0.69 0.00 0.00 174.62 174.76 3fra s PHE 151 N 0.72 2.95 -0.18 4.92 0.08 0.40 -1.34 117.98 125.53 3fra s PHE 151 Ca -0.12 0.32 -0.09 0.00 0.12 0.00 0.00 56.93 57.15 3fra s PHE 151 Cb -0.15 -3.86 -0.05 0.00 -0.57 0.00 0.00 43.02 38.39 3fra s PHE 151 CO 0.02 -1.06 0.13 -0.51 -0.10 0.00 0.00 175.22 173.70 3fra s LEU 152 N 3.60 4.25 -0.27 -0.37 1.43 0.72 -1.43 118.68 126.61 3fra s LEU 152 Ca 0.35 0.28 -0.05 0.00 -1.03 0.00 0.00 54.13 53.68 3fra s LEU 152 Cb -0.11 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 44.03 3fra s LEU 152 CO 0.25 0.23 0.03 -2.28 0.23 0.00 0.00 176.35 174.81 3fra s HIS 153 N 0.05 3.09 -0.00 0.29 5.65 -0.48 -0.92 115.29 122.96 3fra s HIS 153 Ca 0.10 -1.04 0.03 0.00 0.25 0.00 0.00 55.06 54.40 3fra s HIS 153 Cb -0.11 -2.19 -0.03 0.00 -1.18 0.00 0.00 32.58 29.07 3fra s HIS 153 CO -0.01 -0.58 -0.08 -0.51 -0.65 0.00 0.00 174.74 172.91 3fra s LEU 154 N 1.47 3.08 -0.03 8.88 1.43 -0.39 -0.50 118.68 132.62 3fra s LEU 154 Ca 0.03 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.00 3fra s LEU 154 Cb -0.16 -1.75 -0.00 0.00 0.03 0.00 0.00 46.19 44.30 3fra s LEU 154 CO 0.00 0.29 -0.14 -0.63 0.23 0.00 0.00 176.35 176.11 3fra s ILE 155 N -0.95 1.15 0.10 -0.59 1.01 -0.24 -1.41 121.20 120.26 3fra s ILE 155 Ca 0.16 -0.57 -0.32 0.00 0.00 0.00 0.00 60.65 59.92 3fra s ILE 155 Cb -0.11 -0.99 -0.11 0.00 0.01 0.00 0.00 42.46 41.25 3fra s ILE 155 CO 0.06 0.34 1.80 -1.14 0.00 0.00 0.00 174.94 176.00 3fra n ARG 156 N 3.16 2.61 0.00 2.79 0.63 -0.99 -1.35 116.66 123.51 3fra n ARG 156 Ca -0.18 0.95 0.05 0.00 -0.92 0.00 0.00 57.85 57.75 3fra n ARG 156 Cb 0.54 -2.82 0.28 0.00 0.45 0.00 0.00 32.46 30.91 3fra n ARG 156 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75