#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rxc n ASP 5 N 0.00 0.48 -4.27 -3.46 8.00 -0.12 -4.95 116.55 112.23 1rxc n ASP 5 Ca 0.00 0.04 -0.20 0.00 0.71 0.00 0.00 54.79 55.34 1rxc n ASP 5 Cb 0.00 1.11 -0.11 0.00 -0.02 0.00 0.00 41.12 42.10 1rxc n ASP 5 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1rxc s VAL 6 N -3.37 1.55 0.15 2.53 -7.23 -1.25 -5.06 120.40 107.72 1rxc s VAL 6 Ca -0.02 -1.72 -0.11 0.00 -1.81 0.00 0.00 61.98 58.32 1rxc s VAL 6 Cb 0.13 -1.60 -0.03 0.00 0.56 0.00 0.00 36.38 35.43 1rxc s VAL 6 CO 0.84 -0.30 1.50 0.15 -0.31 0.00 0.00 175.10 176.97 1rxc h PHE 7 N 3.59 1.14 0.00 2.82 -0.00 -1.96 -3.36 116.94 119.18 1rxc h PHE 7 Ca -0.42 -0.32 -0.40 0.00 -0.00 0.00 0.00 57.97 56.83 1rxc h PHE 7 Cb 1.20 -0.25 -0.07 0.00 -0.00 0.00 0.00 35.95 36.83 1rxc h PHE 7 CO 0.65 1.15 -2.47 0.72 -0.00 0.00 0.00 178.31 178.36 1rxc n HIS 8 N -4.08 0.04 0.13 0.41 8.25 -1.26 -4.71 115.22 114.00 1rxc n HIS 8 Ca -0.02 0.01 -0.02 0.00 -0.26 0.00 0.00 57.72 57.43 1rxc n HIS 8 Cb 0.52 -1.00 0.13 0.00 1.12 0.00 0.00 29.99 30.76 1rxc n HIS 8 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1rxc h LEU 9 N -0.15 0.01 -1.49 2.41 3.38 -1.93 -3.45 115.31 114.10 1rxc h LEU 9 Ca -0.59 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.23 1rxc h LEU 9 Cb 1.86 -0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.67 1rxc h LEU 9 CO -0.14 0.67 -0.29 0.61 0.09 0.00 0.00 178.44 179.39 1rxc n GLY 10 N 0.39 0.22 3.24 0.83 0.00 -1.26 -4.67 105.19 103.94 1rxc n GLY 10 Ca -0.01 -0.27 -0.16 0.00 0.00 0.00 0.00 46.02 45.57 1rxc n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rxc s LEU 11 N -3.63 2.46 0.37 0.99 1.43 -1.26 -4.78 118.68 114.26 1rxc s LEU 11 Ca 0.09 -0.89 0.08 0.00 -1.03 0.00 0.00 54.13 52.38 1rxc s LEU 11 Cb -0.04 -0.47 -0.04 0.00 0.03 0.00 0.00 46.19 45.67 1rxc s LEU 11 CO 0.29 -0.22 0.17 0.42 0.23 0.00 0.00 176.35 177.24 1rxc s THR 12 N -2.62 2.70 0.25 5.49 -4.23 -1.26 -0.95 115.64 115.02 1rxc s THR 12 Ca 0.12 -1.68 -0.04 0.00 -1.18 0.00 0.00 61.69 58.91 1rxc s THR 12 Cb -0.02 -2.97 0.22 0.00 1.34 0.00 0.00 72.50 71.07 1rxc s THR 12 CO 0.02 -0.10 1.83 0.50 -0.54 0.00 0.00 174.62 176.33 1rxc h LYS 13 N 1.47 0.86 -0.62 3.99 3.64 -1.97 -2.94 116.57 121.01 1rxc h LYS 13 Ca -0.43 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.87 1rxc h LYS 13 Cb 1.25 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.85 1rxc h LYS 13 CO 0.65 0.57 0.28 -0.97 -2.27 0.00 0.00 179.45 177.71 1rxc h ASN 14 N 0.89 0.83 -0.72 4.20 -0.73 -1.95 -2.38 115.58 115.72 1rxc h ASN 14 Ca 0.40 -0.15 0.15 0.00 1.87 0.00 0.00 56.30 58.58 1rxc h ASN 14 Cb 0.31 -0.21 -0.13 0.00 0.27 0.00 0.00 38.32 38.55 1rxc h ASN 14 CO -0.22 0.75 -0.11 0.44 -0.37 0.00 0.00 177.43 177.91 1rxc h ASP 15 N 0.86 -0.55 -0.02 1.15 3.32 -1.92 -0.49 116.42 118.76 1rxc h ASP 15 Ca 0.21 0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.46 1rxc h ASP 15 Cb 0.15 0.41 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 1rxc h ASP 15 CO -0.02 -0.22 -0.00 -0.07 -1.72 0.00 0.00 179.24 177.21 1rxc h LEU 16 N 0.03 0.08 -0.28 1.55 4.07 -1.46 -3.47 115.31 115.84 1rxc h LEU 16 Ca 0.37 -0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.95 1rxc h LEU 16 Cb 0.59 -0.02 0.10 0.00 1.08 0.00 0.00 40.66 42.42 1rxc h LEU 16 CO -0.71 0.10 -0.60 0.00 -1.08 0.00 0.00 178.44 176.16 1rxc n GLN 17 N -4.48 -6.42 -0.08 1.13 6.02 -0.20 -2.47 117.38 110.89 1rxc n GLN 17 Ca -0.02 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 1rxc n GLN 17 Cb 0.12 -5.60 0.00 0.00 1.02 0.00 0.00 30.24 25.79 1rxc n GLN 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rxc n GLY 18 N -1.75 0.71 3.76 1.08 0.00 -1.26 -4.81 105.19 102.92 1rxc n GLY 18 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1rxc n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxc s ALA 19 N -2.33 3.64 0.00 4.61 0.00 -1.03 -4.92 121.76 121.73 1rxc s ALA 19 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1rxc s ALA 19 Cb 0.00 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1rxc s ALA 19 CO 0.00 -0.99 0.77 0.25 0.00 0.00 0.00 175.76 175.80 1rxc n THR 20 N 1.28 0.59 -4.85 0.00 -2.24 -1.26 -4.27 114.28 103.54 1rxc n THR 20 Ca 0.04 -0.72 -0.26 0.00 -2.27 0.00 0.00 64.05 60.84 1rxc n THR 20 Cb 0.39 0.75 -0.16 0.00 -2.10 0.00 0.00 70.33 69.21 1rxc n THR 20 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1rxc s LEU 21 N -0.59 1.93 -0.06 3.22 0.20 -1.26 -1.28 118.68 120.84 1rxc s LEU 21 Ca 0.00 -0.35 0.02 0.00 0.69 0.00 0.00 54.13 54.48 1rxc s LEU 21 Cb 0.00 -0.97 0.02 0.00 -0.43 0.00 0.00 46.19 44.80 1rxc s LEU 21 CO 0.00 0.16 -0.09 0.00 -0.29 0.00 0.00 176.35 176.13 1rxc s ALA 22 N -0.01 1.09 -0.02 5.97 0.00 -0.59 -1.76 121.76 126.45 1rxc s ALA 22 Ca -0.03 -0.32 -0.22 0.00 0.00 0.00 0.00 51.96 51.39 1rxc s ALA 22 Cb -0.11 -0.57 -0.05 0.00 0.00 0.00 0.00 23.12 22.39 1rxc s ALA 22 CO 0.02 0.01 0.66 0.42 0.00 0.00 0.00 175.76 176.87 1rxc s ILE 23 N 0.87 4.92 -0.45 0.00 1.01 -0.23 -1.43 121.20 125.90 1rxc s ILE 23 Ca -0.11 1.38 0.02 0.00 0.00 0.00 0.00 60.65 61.95 1rxc s ILE 23 Cb -0.15 -4.00 0.14 0.00 0.01 0.00 0.00 42.46 38.45 1rxc s ILE 23 CO 0.01 0.35 0.25 0.68 0.00 0.00 0.00 174.94 176.23 1rxc s VAL 24 N 0.19 1.40 0.89 2.92 -7.23 -0.06 -1.63 120.40 116.89 1rxc s VAL 24 Ca 0.35 -2.60 -0.12 0.00 -1.81 0.00 0.00 61.98 57.80 1rxc s VAL 24 Cb -0.18 -1.98 0.12 0.00 0.56 0.00 0.00 36.38 34.90 1rxc s VAL 24 CO 0.18 -0.91 1.14 -2.16 -0.31 0.00 0.00 175.10 173.04 1rxc s PRO 25 N 0.30 1.34 -0.04 4.82 0.04 -1.24 -3.37 135.00 136.85 1rxc s PRO 25 Ca 0.18 0.31 -0.14 0.00 0.04 0.00 0.00 61.00 61.39 1rxc s PRO 25 Cb -0.23 -1.86 -0.32 0.00 0.04 0.00 0.00 34.50 32.13 1rxc s PRO 25 CO -0.01 -2.06 0.76 0.78 0.04 0.00 0.00 177.00 176.50 1rxc h GLY 26 N -1.40 0.46 -5.87 0.56 0.00 -1.82 -0.11 103.07 94.89 1rxc h GLY 26 Ca -0.50 -1.17 -0.59 0.00 0.00 0.00 0.00 47.33 45.07 1rxc h GLY 26 CO 0.62 1.02 0.35 -0.35 0.00 0.00 0.00 176.54 178.19 1rxc s ASP 27 N -7.30 6.78 0.57 0.19 3.68 -1.26 -1.41 116.67 117.92 1rxc s ASP 27 Ca -0.15 0.97 0.27 0.00 2.13 0.00 0.00 52.55 55.77 1rxc s ASP 27 Cb 0.04 -2.41 1.50 0.00 -1.45 0.00 0.00 42.92 40.61 1rxc s ASP 27 CO 0.86 -0.43 2.00 1.55 0.13 0.00 0.00 175.17 179.28 1rxc h PRO 28 N 7.63 0.00 0.00 4.34 0.13 -1.89 -2.30 132.00 139.91 1rxc h PRO 28 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1rxc h PRO 28 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1rxc h PRO 28 CO 0.83 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 178.16 1rxc h ASP 29 N 0.00 0.00 1.73 1.44 3.32 -1.96 -3.00 116.42 117.95 1rxc h ASP 29 Ca 0.18 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1rxc h ASP 29 Cb 0.87 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.42 1rxc h ASP 29 CO -0.00 0.00 -0.12 -0.09 -1.72 0.00 0.00 179.24 177.31 1rxc h ARG 30 N 0.00 0.00 -0.67 3.56 2.43 -1.82 -3.38 114.38 114.50 1rxc h ARG 30 Ca 0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1rxc h ARG 30 Cb 0.84 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.35 1rxc h ARG 30 CO 0.00 0.12 0.43 0.28 -1.51 0.00 0.00 179.97 179.29 1rxc h VAL 31 N 0.00 1.15 -0.61 0.20 2.07 -1.60 -1.14 116.25 116.32 1rxc h VAL 31 Ca -0.00 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 67.14 1rxc h VAL 31 Cb 1.01 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1rxc h VAL 31 CO 0.02 0.16 0.06 -0.08 0.02 0.00 0.00 177.57 177.75 1rxc h GLU 32 N 0.88 1.03 -0.92 1.57 4.81 -1.78 -2.41 114.58 117.76 1rxc h GLU 32 Ca 0.25 -0.30 0.07 0.00 -0.13 0.00 0.00 59.36 59.25 1rxc h GLU 32 Cb -0.07 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 29.14 1rxc h GLU 32 CO -0.07 0.98 0.60 0.87 -0.73 0.00 0.00 179.01 180.66 1rxc h LYS 33 N 0.93 1.01 0.01 1.92 6.56 -1.44 -2.21 116.57 123.36 1rxc h LYS 33 Ca 0.18 -0.06 -0.06 0.00 -1.06 0.00 0.00 60.65 59.65 1rxc h LYS 33 Cb 0.48 -0.23 0.01 0.00 -0.57 0.00 0.00 32.23 31.92 1rxc h LYS 33 CO 0.02 0.67 -0.25 0.82 -2.06 0.00 0.00 179.45 178.65 1rxc h ILE 34 N 1.04 1.58 -0.25 1.86 2.04 -1.19 -3.18 117.51 119.41 1rxc h ILE 34 Ca 0.40 -2.04 0.07 0.00 1.00 0.00 0.00 64.86 64.29 1rxc h ILE 34 Cb 0.22 2.89 -0.01 0.00 -0.74 0.00 0.00 36.82 39.18 1rxc h ILE 34 CO -0.15 0.55 0.22 0.00 0.00 0.00 0.00 178.15 178.77 1rxc h ALA 35 N 0.21 2.04 0.00 1.87 0.00 -1.40 -2.22 119.26 119.75 1rxc h ALA 35 Ca -0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1rxc h ALA 35 Cb 1.05 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1rxc h ALA 35 CO 0.05 -0.35 -0.23 0.00 0.00 0.00 0.00 179.25 178.72 1rxc h ALA 36 N 1.79 0.99 0.00 0.00 0.00 -1.37 -1.82 119.26 118.84 1rxc h ALA 36 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1rxc h ALA 36 Cb 0.57 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1rxc h ALA 36 CO -0.00 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1rxc n LEU 37 N -3.35 0.03 0.00 0.00 4.77 -0.83 -4.81 117.00 112.81 1rxc n LEU 37 Ca 0.00 0.51 -0.26 0.00 -0.03 0.00 0.00 56.01 56.24 1rxc n LEU 37 Cb 0.45 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1rxc n LEU 37 CO 0.34 -0.22 0.11 0.23 -1.33 0.00 0.00 177.39 176.51 1rxc n MET 38 N -1.53 0.66 -3.69 3.23 2.81 -0.69 -5.11 117.12 112.80 1rxc n MET 38 Ca 0.04 -3.43 -0.28 0.00 -1.81 0.00 0.00 57.70 52.22 1rxc n MET 38 Cb 0.20 0.30 -0.03 0.00 -0.71 0.00 0.00 33.22 32.98 1rxc n MET 38 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1rxc s ASP 39 N -4.30 6.40 -1.37 7.83 -0.00 -0.57 -4.58 116.67 120.08 1rxc s ASP 39 Ca 0.35 0.42 -0.05 0.00 -0.00 0.00 0.00 52.55 53.27 1rxc s ASP 39 Cb -0.03 -2.02 0.00 0.00 -0.00 0.00 0.00 42.92 40.88 1rxc s ASP 39 CO 0.22 -0.03 0.45 0.29 -0.00 0.00 0.00 175.17 176.10 1rxc n LYS 40 N -0.57 -2.56 -2.38 8.23 5.02 -1.26 -0.68 118.16 123.95 1rxc n LYS 40 Ca -0.04 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.18 1rxc n LYS 40 Cb 0.54 -4.25 -0.03 0.00 -0.02 0.00 0.00 35.03 31.27 1rxc n LYS 40 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1rxc s PRO 41 N -6.59 4.31 0.02 1.97 0.04 -1.26 -4.49 135.00 129.00 1rxc s PRO 41 Ca 0.10 1.75 0.06 0.00 0.04 0.00 0.00 61.00 62.96 1rxc s PRO 41 Cb -0.04 -3.62 -0.02 0.00 0.04 0.00 0.00 34.50 30.86 1rxc s PRO 41 CO 0.90 -0.54 -0.18 0.08 0.04 0.00 0.00 177.00 177.30 1rxc s VAL 42 N 2.58 1.43 0.11 -0.36 1.01 -0.06 -5.00 120.40 120.10 1rxc s VAL 42 Ca 0.58 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 1rxc s VAL 42 Cb -0.26 -1.23 -0.06 0.00 0.00 0.00 0.00 36.38 34.83 1rxc s VAL 42 CO 0.22 0.22 0.93 -0.75 0.00 0.00 0.00 175.10 175.73 1rxc s LYS 43 N -0.89 4.68 -0.24 2.72 2.20 -1.26 -1.01 119.74 125.93 1rxc s LYS 43 Ca 0.06 1.40 -0.16 0.00 -0.36 0.00 0.00 55.97 56.91 1rxc s LYS 43 Cb -0.08 -3.37 -0.09 0.00 -1.51 0.00 0.00 37.83 32.78 1rxc s LYS 43 CO 0.01 0.23 -0.35 1.28 -0.36 0.00 0.00 175.35 176.16 1rxc n LEU 44 N 2.75 1.95 -3.49 5.43 4.77 0.26 -4.90 117.00 123.77 1rxc n LEU 44 Ca 0.02 0.33 -0.11 0.00 -0.03 0.00 0.00 56.01 56.22 1rxc n LEU 44 Cb 0.49 -0.78 -0.03 0.00 -2.33 0.00 0.00 43.42 40.77 1rxc n LEU 44 CO 0.50 0.21 0.60 0.00 -1.33 0.00 0.00 177.39 177.37 1rxc s ALA 45 N -2.68 -1.77 -0.14 -1.18 0.00 -0.98 -5.00 121.76 109.99 1rxc s ALA 45 Ca -0.35 0.98 -0.04 0.00 0.00 0.00 0.00 51.96 52.55 1rxc s ALA 45 Cb 0.10 0.36 0.06 0.00 0.00 0.00 0.00 23.12 23.65 1rxc s ALA 45 CO 0.46 -0.63 0.14 0.45 0.00 0.00 0.00 175.76 176.18 1rxc s SER 46 N -2.25 1.54 -0.06 0.00 0.15 -1.26 -0.37 113.70 111.46 1rxc s SER 46 Ca 0.01 -0.19 -0.02 0.00 0.70 0.00 0.00 55.95 56.44 1rxc s SER 46 Cb -0.01 0.08 0.04 0.00 -1.71 0.00 0.00 66.02 64.42 1rxc s SER 46 CO -0.07 -0.31 0.13 -1.00 1.20 0.00 0.00 173.24 173.19 1rxc s HIS 47 N 2.23 -0.13 0.00 3.44 3.76 -0.89 -5.01 115.29 118.70 1rxc s HIS 47 Ca 0.04 0.45 0.00 0.00 -0.15 0.00 0.00 55.06 55.40 1rxc s HIS 47 Cb -0.15 -0.16 0.00 0.00 1.11 0.00 0.00 32.58 33.39 1rxc s HIS 47 CO -0.08 -0.18 0.00 0.54 -0.85 0.00 0.00 174.74 174.17 1rxc n ARG 48 N 4.48 0.00 -0.14 1.40 1.74 -1.26 -1.31 116.66 121.57 1rxc n ARG 48 Ca -0.21 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 56.95 1rxc n ARG 48 Cb 0.51 0.00 0.27 0.00 -1.02 0.00 0.00 32.46 32.22 1rxc n ARG 48 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 1rxc n GLU 49 N 14.00 1.85 -3.37 5.56 0.00 -1.26 -4.75 120.64 132.67 1rxc n GLU 49 Ca 0.00 -1.31 -0.45 0.00 0.00 0.00 0.00 57.16 55.41 1rxc n GLU 49 Cb 0.00 -1.36 -0.05 0.00 0.00 0.00 0.00 31.44 30.03 1rxc n GLU 49 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 1rxc s PHE 50 N -1.63 3.39 -0.21 -1.84 0.08 -0.43 -3.84 117.98 113.49 1rxc s PHE 50 Ca 0.30 -1.58 -0.08 0.00 0.12 0.00 0.00 56.93 55.69 1rxc s PHE 50 Cb 0.16 -3.73 -0.04 0.00 -0.57 0.00 0.00 43.02 38.84 1rxc s PHE 50 CO 0.23 -1.00 0.08 0.99 -0.10 0.00 0.00 175.22 175.41 1rxc s THR 51 N 1.23 4.73 -0.12 0.64 2.01 -1.26 -2.09 115.64 120.77 1rxc s THR 51 Ca 0.07 -0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.05 1rxc s THR 51 Cb -0.25 -3.17 0.01 0.00 0.01 0.00 0.00 72.50 69.10 1rxc s THR 51 CO -0.00 0.40 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.24 1rxc s THR 52 N 0.87 1.85 0.26 -0.82 2.01 0.50 -2.09 115.64 118.23 1rxc s THR 52 Ca 0.04 -0.87 0.11 0.00 0.31 0.00 0.00 61.69 61.29 1rxc s THR 52 Cb -0.14 -1.65 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 1rxc s THR 52 CO 0.03 0.51 -0.16 0.26 -0.69 0.00 0.00 174.62 174.57 1rxc s TRP 53 N 0.76 2.40 0.08 4.92 0.52 0.05 -0.57 118.94 127.10 1rxc s TRP 53 Ca -0.10 -0.30 0.10 0.00 0.02 0.00 0.00 56.10 55.82 1rxc s TRP 53 Cb -0.16 -1.08 -0.03 0.00 -1.15 0.00 0.00 33.47 31.05 1rxc s TRP 53 CO 0.01 0.65 -0.25 0.50 0.02 0.00 0.00 176.95 177.88 1rxc s ARG 54 N -3.36 1.69 0.00 4.98 3.52 -0.18 -0.81 118.95 124.79 1rxc s ARG 54 Ca 0.28 -1.19 0.00 0.00 -0.13 0.00 0.00 55.73 54.70 1rxc s ARG 54 Cb -0.06 -1.99 0.00 0.00 -1.56 0.00 0.00 34.95 31.34 1rxc s ARG 54 CO 0.15 0.49 0.00 0.00 -0.81 0.00 0.00 175.30 175.13 1rxc n ALA 55 N 1.34 0.00 -3.75 6.12 0.00 -0.22 -0.88 120.51 123.13 1rxc n ALA 55 Ca -0.17 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.11 1rxc n ALA 55 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.81 1rxc n ALA 55 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1rxc s GLU 56 N -0.51 -0.02 -0.22 0.00 2.02 0.14 -1.29 118.70 118.81 1rxc s GLU 56 Ca 0.00 0.26 0.01 0.00 0.02 0.00 0.00 54.97 55.27 1rxc s GLU 56 Cb 0.00 -0.28 0.05 0.00 0.10 0.00 0.00 34.13 34.00 1rxc s GLU 56 CO 0.00 -0.20 -0.09 -1.17 0.02 0.00 0.00 175.26 173.82 1rxc s LEU 57 N 1.31 2.62 -1.49 1.80 2.96 -0.42 -1.51 118.68 123.95 1rxc s LEU 57 Ca -0.06 -1.09 -0.08 0.00 -0.22 0.00 0.00 54.13 52.68 1rxc s LEU 57 Cb -0.13 -1.29 0.06 0.00 0.50 0.00 0.00 46.19 45.34 1rxc s LEU 57 CO -0.04 -0.18 0.73 0.47 -1.32 0.00 0.00 176.35 176.01 1rxc n ASP 58 N 4.62 -2.49 0.00 3.68 8.00 -1.26 -1.98 116.55 127.12 1rxc n ASP 58 Ca -0.14 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1rxc n ASP 58 Cb 0.45 -3.45 0.00 0.00 -0.02 0.00 0.00 41.12 38.10 1rxc n ASP 58 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rxc n GLY 59 N -1.69 2.18 3.64 0.44 0.00 -1.26 -5.02 105.19 103.48 1rxc n GLY 59 Ca -0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 1rxc n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rxc s LYS 60 N -0.16 3.26 0.15 1.61 -0.14 -0.84 -5.06 119.74 118.57 1rxc s LYS 60 Ca 0.00 -0.42 -0.30 0.00 -1.36 0.00 0.00 55.97 53.89 1rxc s LYS 60 Cb 0.00 -2.88 -0.08 0.00 -1.68 0.00 0.00 37.83 33.19 1rxc s LYS 60 CO 0.00 0.55 1.28 -1.25 -0.76 0.00 0.00 175.35 175.17 1rxc s PRO 61 N -0.46 4.41 -0.01 -1.68 0.04 -1.26 -1.30 135.00 134.73 1rxc s PRO 61 Ca 0.08 1.96 0.06 0.00 0.04 0.00 0.00 61.00 63.15 1rxc s PRO 61 Cb -0.12 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1rxc s PRO 61 CO 0.02 -0.25 -0.21 0.08 0.04 0.00 0.00 177.00 176.69 1rxc s VAL 62 N 0.44 1.63 -0.09 -0.36 1.01 -0.41 -4.42 120.40 118.20 1rxc s VAL 62 Ca 0.58 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1rxc s VAL 62 Cb -0.34 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 1rxc s VAL 62 CO 0.34 0.46 0.20 -0.63 0.00 0.00 0.00 175.10 175.47 1rxc s ILE 63 N -0.49 5.41 -0.08 2.22 -1.09 -0.72 -1.05 121.20 125.40 1rxc s ILE 63 Ca 0.08 0.34 0.04 0.00 -2.23 0.00 0.00 60.65 58.88 1rxc s ILE 63 Cb -0.08 -3.47 -0.01 0.00 -1.58 0.00 0.00 42.46 37.32 1rxc s ILE 63 CO -0.01 0.61 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.40 1rxc s VAL 64 N -1.04 2.27 -0.22 2.92 1.01 0.01 -1.07 120.40 124.27 1rxc s VAL 64 Ca 0.17 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 1rxc s VAL 64 Cb -0.13 -1.86 0.10 0.00 0.00 0.00 0.00 36.38 34.50 1rxc s VAL 64 CO 0.06 0.56 0.47 0.00 0.00 0.00 0.00 175.10 176.19 1rxc s SER 66 N 2.68 6.30 -0.02 0.00 1.04 -0.89 -3.66 113.70 119.15 1rxc s SER 66 Ca -0.01 2.03 0.18 0.00 0.48 0.00 0.00 55.95 58.62 1rxc s SER 66 Cb -0.12 -2.57 -0.26 0.00 0.10 0.00 0.00 66.02 63.17 1rxc s SER 66 CO -0.14 -0.81 0.47 0.35 0.98 0.00 0.00 173.24 174.08 1rxc n THR 67 N -0.80 0.00 -0.72 2.02 -2.24 -0.05 -4.35 114.28 108.14 1rxc n THR 67 Ca 0.09 -0.34 0.08 0.00 -2.27 0.00 0.00 64.05 61.61 1rxc n THR 67 Cb 0.51 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 69.01 1rxc n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rxc n GLY 68 N 1.47 -2.10 3.71 3.38 0.00 -0.50 -3.46 105.19 107.69 1rxc n GLY 68 Ca -0.02 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.23 1rxc n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rxc s ILE 69 N -1.49 5.01 0.00 -0.61 1.01 -1.26 -4.64 121.20 119.23 1rxc s ILE 69 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 60.65 62.19 1rxc s ILE 69 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.39 1rxc s ILE 69 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.77 1rxc n GLY 70 N 3.12 2.98 0.29 6.18 0.00 -1.26 -4.66 105.19 111.84 1rxc n GLY 70 Ca 0.00 -1.65 0.08 0.00 0.00 0.00 0.00 46.02 44.45 1rxc n GLY 70 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1rxc h GLY 71 N 0.00 1.27 0.56 -0.02 0.00 -1.87 -1.69 103.07 101.31 1rxc h GLY 71 Ca 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.19 1rxc h GLY 71 CO 0.00 -0.15 -0.25 -2.55 0.00 0.00 0.00 176.54 173.60 1rxc h PRO 72 N 0.44 -0.43 0.00 4.80 0.11 -1.94 0.32 132.00 135.29 1rxc h PRO 72 Ca 0.46 0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.47 1rxc h PRO 72 Cb 0.75 0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 1rxc h PRO 72 CO -0.44 -0.29 -0.62 0.66 -0.21 0.00 0.00 178.00 177.10 1rxc h SER 73 N -0.45 0.00 -0.54 -2.05 4.64 -1.79 -2.53 113.55 110.83 1rxc h SER 73 Ca 0.03 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.43 1rxc h SER 73 Cb 0.48 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.51 1rxc h SER 73 CO -0.15 0.62 0.20 0.74 -0.87 0.00 0.00 176.83 177.37 1rxc h THR 74 N 0.00 0.81 -0.28 2.95 2.02 -0.96 -2.17 112.91 115.27 1rxc h THR 74 Ca -0.01 -0.13 -0.09 0.00 0.77 0.00 0.00 66.41 66.95 1rxc h THR 74 Cb 1.12 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1rxc h THR 74 CO 0.08 0.07 -0.22 0.77 0.37 0.00 0.00 175.52 176.59 1rxc h SER 75 N 0.38 0.52 -0.24 4.18 4.64 0.04 -1.67 113.55 121.40 1rxc h SER 75 Ca 0.26 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.40 1rxc h SER 75 Cb 0.30 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1rxc h SER 75 CO -0.27 0.74 0.08 0.40 -0.87 0.00 0.00 176.83 176.92 1rxc h ILE 76 N 0.47 1.18 -0.37 0.95 2.04 -1.31 -2.13 117.51 118.33 1rxc h ILE 76 Ca 0.07 -0.58 -0.16 0.00 1.00 0.00 0.00 64.86 65.19 1rxc h ILE 76 Cb 0.64 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1rxc h ILE 76 CO 0.05 0.19 -0.40 0.00 0.00 0.00 0.00 178.15 177.99 1rxc h ALA 77 N 0.92 0.58 -0.32 1.87 0.00 -0.93 -1.16 119.26 120.21 1rxc h ALA 77 Ca 0.08 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 1rxc h ALA 77 Cb 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1rxc h ALA 77 CO -0.00 0.68 -0.37 0.28 0.00 0.00 0.00 179.25 179.84 1rxc h VAL 78 N 0.74 1.29 -0.26 0.00 2.07 -1.38 -0.98 116.25 117.73 1rxc h VAL 78 Ca 0.06 -1.54 -0.03 0.00 0.82 0.00 0.00 66.70 66.01 1rxc h VAL 78 Cb 0.99 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1rxc h VAL 78 CO 0.10 0.50 0.06 -0.08 0.02 0.00 0.00 177.57 178.17 1rxc h GLU 79 N 0.60 0.43 -0.03 1.57 4.57 -1.30 -0.16 114.58 120.26 1rxc h GLU 79 Ca 0.05 -0.11 -0.15 0.00 -1.18 0.00 0.00 59.36 57.97 1rxc h GLU 79 Cb 0.96 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.48 1rxc h GLU 79 CO 0.09 0.53 -0.65 0.93 -1.18 0.00 0.00 179.01 178.72 1rxc h GLU 80 N 0.25 0.12 -0.28 1.92 5.08 -1.17 -1.62 114.58 118.89 1rxc h GLU 80 Ca 0.08 -0.09 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1rxc h GLU 80 Cb 0.30 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1rxc h GLU 80 CO 0.00 0.73 -0.31 -0.07 -1.00 0.00 0.00 179.01 178.37 1rxc h LEU 81 N 0.09 0.60 -0.95 1.33 3.38 -1.12 -2.82 115.31 115.82 1rxc h LEU 81 Ca -0.01 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.65 1rxc h LEU 81 Cb 1.17 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1rxc h LEU 81 CO 0.09 0.87 -0.08 0.00 0.09 0.00 0.00 178.44 179.41 1rxc h ALA 82 N 1.17 1.12 -0.34 1.53 0.00 -0.44 -1.74 119.26 120.56 1rxc h ALA 82 Ca 0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1rxc h ALA 82 Cb 0.78 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1rxc h ALA 82 CO 0.06 0.55 -0.01 1.96 0.00 0.00 0.00 179.25 181.81 1rxc h GLN 83 N 0.62 0.54 -0.00 0.00 4.20 -1.17 -2.51 115.11 116.79 1rxc h GLN 83 Ca 0.11 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1rxc h GLN 83 Cb 0.51 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1rxc h GLN 83 CO 0.03 0.58 -0.04 1.28 -0.67 0.00 0.00 178.83 180.01 1rxc n LEU 84 N -4.27 0.16 0.00 1.46 4.32 -0.86 -4.92 117.00 112.89 1rxc n LEU 84 Ca 0.01 0.16 0.00 0.00 -0.02 0.00 0.00 56.01 56.17 1rxc n LEU 84 Cb 0.26 -0.22 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 1rxc n LEU 84 CO 0.39 0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.20 1rxc n GLY 85 N 1.26 1.15 3.71 -0.72 0.00 -0.78 -4.85 105.19 104.96 1rxc n GLY 85 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1rxc n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rxc s ILE 86 N -2.00 4.06 -0.09 -0.61 -1.09 -0.72 -4.40 121.20 116.35 1rxc s ILE 86 Ca 0.00 1.47 0.08 0.00 -2.23 0.00 0.00 60.65 59.97 1rxc s ILE 86 Cb 0.00 -3.95 -0.11 0.00 -1.58 0.00 0.00 42.46 36.83 1rxc s ILE 86 CO 0.00 0.10 0.20 0.54 -1.23 0.00 0.00 174.94 174.55 1rxc n ARG 87 N 4.04 1.22 -5.14 2.79 5.12 -0.40 -4.29 116.66 120.00 1rxc n ARG 87 Ca 0.09 -0.05 -0.30 0.00 -1.93 0.00 0.00 57.85 55.65 1rxc n ARG 87 Cb 0.46 -1.10 -0.17 0.00 -1.16 0.00 0.00 32.46 30.49 1rxc n ARG 87 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1rxc s THR 88 N -2.34 1.90 -0.11 0.55 2.01 -0.81 -1.37 115.64 115.48 1rxc s THR 88 Ca -0.02 -0.95 0.01 0.00 0.31 0.00 0.00 61.69 61.04 1rxc s THR 88 Cb 0.05 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.94 1rxc s THR 88 CO 0.31 0.53 -0.13 -0.36 -0.69 0.00 0.00 174.62 174.28 1rxc s PHE 89 N 0.17 1.79 -0.28 4.92 0.08 0.14 -1.54 117.98 123.26 1rxc s PHE 89 Ca -0.12 -0.84 0.01 0.00 0.12 0.00 0.00 56.93 56.10 1rxc s PHE 89 Cb -0.16 -1.33 0.06 0.00 -0.57 0.00 0.00 43.02 41.02 1rxc s PHE 89 CO 0.06 -0.47 -0.07 -0.51 -0.10 0.00 0.00 175.22 174.14 1rxc s LEU 90 N 1.14 3.64 0.14 -0.37 1.43 -0.52 -0.97 118.68 123.16 1rxc s LEU 90 Ca -0.04 -1.36 -0.27 0.00 -1.03 0.00 0.00 54.13 51.43 1rxc s LEU 90 Cb -0.14 -1.61 -0.07 0.00 0.03 0.00 0.00 46.19 44.39 1rxc s LEU 90 CO -0.03 -0.22 0.82 -0.60 0.23 0.00 0.00 176.35 176.55 1rxc s ARG 91 N 1.16 4.61 -0.15 1.70 3.52 -0.37 -0.88 118.95 128.54 1rxc s ARG 91 Ca -0.07 1.22 0.01 0.00 -0.13 0.00 0.00 55.73 56.76 1rxc s ARG 91 Cb -0.20 -3.31 0.02 0.00 -1.56 0.00 0.00 34.95 29.90 1rxc s ARG 91 CO -0.03 0.44 -0.15 -1.50 -0.81 0.00 0.00 175.30 173.24 1rxc s ILE 92 N -0.71 1.66 0.40 4.11 -1.16 -1.22 -1.69 121.20 122.59 1rxc s ILE 92 Ca 0.39 -0.69 0.05 0.00 -0.51 0.00 0.00 60.65 59.89 1rxc s ILE 92 Cb -0.23 -1.54 -0.02 0.00 0.61 0.00 0.00 42.46 41.28 1rxc s ILE 92 CO 0.27 0.47 0.20 0.61 -2.81 0.00 0.00 174.94 173.68 1rxc n GLY 93 N 4.67 3.10 3.90 1.50 0.00 -0.52 -4.07 105.19 113.77 1rxc n GLY 93 Ca -0.18 -2.05 -0.21 0.00 0.00 0.00 0.00 46.02 43.58 1rxc n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rxc s THR 94 N -3.23 4.47 -0.04 2.61 -4.23 -1.26 -1.57 115.64 112.40 1rxc s THR 94 Ca 0.28 -1.20 -0.29 0.00 -1.18 0.00 0.00 61.69 59.29 1rxc s THR 94 Cb 0.01 -3.51 0.09 0.00 1.34 0.00 0.00 72.50 70.43 1rxc s THR 94 CO 0.20 -0.28 0.76 0.28 -0.54 0.00 0.00 174.62 175.04 1rxc s THR 95 N -2.12 0.00 -0.22 3.99 -1.32 -0.94 -4.84 115.64 110.19 1rxc s THR 95 Ca 0.37 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.77 1rxc s THR 95 Cb -0.08 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.87 1rxc s THR 95 CO 0.27 0.00 0.09 -0.83 -2.21 0.00 0.00 174.62 171.94 1rxc s GLY 96 N -1.52 1.86 0.36 6.08 0.00 -1.06 -1.72 107.32 111.32 1rxc s GLY 96 Ca -0.06 -0.92 -0.24 0.00 0.00 0.00 0.00 44.72 43.50 1rxc s GLY 96 CO 0.03 0.31 0.96 0.00 0.00 0.00 0.00 173.10 174.39 1rxc s ALA 97 N 0.99 3.14 -0.59 3.20 0.00 0.16 -1.14 121.76 127.52 1rxc s ALA 97 Ca 0.05 0.50 0.05 0.00 0.00 0.00 0.00 51.96 52.57 1rxc s ALA 97 Cb -0.14 -3.18 0.02 0.00 0.00 0.00 0.00 23.12 19.82 1rxc s ALA 97 CO 0.03 0.12 0.57 0.44 0.00 0.00 0.00 175.76 176.92 1rxc n ILE 98 N 0.13 0.00 -3.70 0.00 -5.35 -0.34 -0.73 119.36 109.37 1rxc n ILE 98 Ca 0.04 -0.47 -0.37 0.00 -0.27 0.00 0.00 62.75 61.68 1rxc n ILE 98 Cb 0.51 1.09 -0.06 0.00 -1.74 0.00 0.00 39.64 39.44 1rxc n ILE 98 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1rxc s GLN 99 N -0.71 3.67 0.37 6.28 -1.52 -1.24 -4.73 119.66 121.78 1rxc s GLN 99 Ca 0.05 0.11 0.09 0.00 -1.95 0.00 0.00 55.36 53.67 1rxc s GLN 99 Cb 0.04 -3.18 0.71 0.00 -0.22 0.00 0.00 33.01 30.36 1rxc s GLN 99 CO 0.10 0.72 1.86 -1.35 -0.25 0.00 0.00 175.29 176.37 1rxc h PRO 100 N 4.69 0.22 0.00 2.91 0.11 -1.96 -2.95 132.00 135.02 1rxc h PRO 100 Ca -0.53 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.52 1rxc h PRO 100 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1rxc h PRO 100 CO 0.61 0.43 0.00 -2.39 -0.21 0.00 0.00 178.00 176.44 1rxc n HIS 101 N -4.21 0.40 -3.12 0.65 1.44 -1.26 -4.75 115.22 104.37 1rxc n HIS 101 Ca -0.01 0.12 -0.40 0.00 -2.01 0.00 0.00 57.72 55.41 1rxc n HIS 101 Cb 0.32 -0.69 -0.06 0.00 0.12 0.00 0.00 29.99 29.68 1rxc n HIS 101 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1rxc s ILE 102 N -3.05 4.99 0.17 0.61 1.01 -1.12 -5.06 121.20 118.75 1rxc s ILE 102 Ca 0.12 1.13 0.02 0.00 0.00 0.00 0.00 60.65 61.91 1rxc s ILE 102 Cb 0.16 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1rxc s ILE 102 CO 0.54 0.04 0.32 0.20 0.00 0.00 0.00 174.94 176.04 1rxc s ASN 103 N 1.44 6.35 0.22 3.58 0.01 -1.26 -4.89 114.94 120.39 1rxc s ASN 103 Ca 0.26 0.24 -0.32 0.00 -0.71 0.00 0.00 52.86 52.33 1rxc s ASN 103 Cb -0.16 -1.94 -0.13 0.00 0.41 0.00 0.00 41.25 39.43 1rxc s ASN 103 CO 0.09 0.02 1.50 0.52 -1.51 0.00 0.00 177.10 177.71 1rxc n VAL 104 N -0.61 0.58 0.00 1.60 0.31 -1.26 -1.72 118.33 117.22 1rxc n VAL 104 Ca -0.06 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1rxc n VAL 104 Cb 0.54 -1.57 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 1rxc n VAL 104 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1rxc n GLY 105 N 2.67 3.37 3.76 2.92 0.00 -0.26 -5.01 105.19 112.64 1rxc n GLY 105 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1rxc n GLY 105 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rxc s ASP 106 N -0.63 4.49 -0.10 1.61 1.11 -0.70 -4.74 116.67 117.71 1rxc s ASP 106 Ca 0.00 1.87 -0.00 0.00 0.18 0.00 0.00 52.55 54.60 1rxc s ASP 106 Cb 0.00 -2.53 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 1rxc s ASP 106 CO 0.00 -2.05 -0.08 -0.69 1.18 0.00 0.00 175.17 173.53 1rxc s VAL 107 N -2.80 3.55 -0.17 -1.27 1.01 -0.71 -1.49 120.40 118.51 1rxc s VAL 107 Ca 0.62 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 62.10 1rxc s VAL 107 Cb -0.18 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.74 1rxc s VAL 107 CO 0.54 0.56 -0.20 -0.76 0.00 0.00 0.00 175.10 175.24 1rxc s LEU 108 N -0.28 2.18 -0.21 3.92 1.43 -0.39 -1.03 118.68 124.31 1rxc s LEU 108 Ca 0.03 -0.61 -0.10 0.00 -1.03 0.00 0.00 54.13 52.42 1rxc s LEU 108 Cb -0.13 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 1rxc s LEU 108 CO 0.03 0.03 0.14 -0.69 0.23 0.00 0.00 176.35 176.09 1rxc s VAL 109 N 1.10 5.40 -0.25 -1.59 1.01 -0.54 -1.52 120.40 124.01 1rxc s VAL 109 Ca 0.00 0.20 -0.18 0.00 0.00 0.00 0.00 61.98 62.00 1rxc s VAL 109 Cb -0.14 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 1rxc s VAL 109 CO -0.08 0.42 0.51 -0.89 0.00 0.00 0.00 175.10 175.06 1rxc s THR 110 N 0.51 5.08 0.04 3.92 2.01 -0.84 -2.33 115.64 124.03 1rxc s THR 110 Ca 0.08 0.89 -0.12 0.00 0.31 0.00 0.00 61.69 62.84 1rxc s THR 110 Cb -0.12 -3.83 -0.33 0.00 0.01 0.00 0.00 72.50 68.23 1rxc s THR 110 CO -0.00 0.10 1.01 0.71 -0.69 0.00 0.00 174.62 175.75 1rxc h THR 111 N 5.35 1.31 -2.75 -0.82 1.35 -1.66 -3.42 112.91 112.28 1rxc h THR 111 Ca -0.30 -2.79 0.07 0.00 -0.55 0.00 0.00 66.41 62.84 1rxc h THR 111 Cb 1.14 3.00 -0.10 0.00 -1.73 0.00 0.00 68.15 70.46 1rxc h THR 111 CO 0.72 0.83 0.32 0.00 -0.25 0.00 0.00 175.52 177.14 1rxc s ALA 112 N -2.61 -1.54 -0.03 6.62 0.00 -1.26 -0.93 121.76 122.00 1rxc s ALA 112 Ca -0.08 0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.24 1rxc s ALA 112 Cb 0.05 0.74 -0.01 0.00 0.00 0.00 0.00 23.12 23.90 1rxc s ALA 112 CO 0.92 -0.88 -0.20 -1.12 0.00 0.00 0.00 175.76 174.48 1rxc s SER 113 N -2.78 2.46 -0.04 0.00 0.01 -0.24 -2.21 113.70 110.91 1rxc s SER 113 Ca 0.07 -0.39 -0.30 0.00 1.31 0.00 0.00 55.95 56.64 1rxc s SER 113 Cb -0.02 -0.45 -0.05 0.00 0.21 0.00 0.00 66.02 65.70 1rxc s SER 113 CO -0.04 0.23 1.55 -0.69 0.41 0.00 0.00 173.24 174.69 1rxc s VAL 114 N -0.29 3.63 -0.99 3.43 1.01 0.54 -4.34 120.40 123.39 1rxc s VAL 114 Ca 0.03 0.87 -0.21 0.00 0.00 0.00 0.00 61.98 62.67 1rxc s VAL 114 Cb -0.10 -3.56 0.09 0.00 0.00 0.00 0.00 36.38 32.81 1rxc s VAL 114 CO 0.01 -0.05 1.30 -0.13 0.00 0.00 0.00 175.10 176.23 1rxc s ARG 115 N 3.41 3.61 -0.41 2.72 0.52 -1.26 -1.91 118.95 125.63 1rxc s ARG 115 Ca 0.69 -1.46 0.05 0.00 -0.52 0.00 0.00 55.73 54.49 1rxc s ARG 115 Cb -0.32 -5.15 0.64 0.00 0.52 0.00 0.00 34.95 30.64 1rxc s ARG 115 CO 0.27 -2.00 1.82 1.28 0.02 0.00 0.00 175.30 176.69 1rxc n LEU 116 N 7.72 6.17 -4.74 2.53 4.77 -0.41 -4.96 117.00 128.09 1rxc n LEU 116 Ca 0.29 -3.61 -0.28 0.00 -0.03 0.00 0.00 56.01 52.37 1rxc n LEU 116 Cb 0.50 -0.79 -0.08 0.00 -2.33 0.00 0.00 43.42 40.72 1rxc n LEU 116 CO 0.59 1.07 -0.20 1.51 -1.33 0.00 0.00 177.39 179.04 1rxc s ASP 117 N -1.53 4.21 -0.19 -1.43 3.84 -1.20 -1.89 116.67 118.48 1rxc s ASP 117 Ca 0.54 -1.36 0.10 0.00 -0.00 0.00 0.00 52.55 51.83 1rxc s ASP 117 Cb 0.46 -0.02 -0.19 0.00 -1.38 0.00 0.00 42.92 41.79 1rxc s ASP 117 CO 0.09 -0.69 -0.03 0.61 -0.00 0.00 0.00 175.17 175.15 1rxc n GLY 118 N -1.24 -0.65 0.17 2.12 0.00 -1.26 -4.68 105.19 99.64 1rxc n GLY 118 Ca -0.08 -0.24 -0.01 0.00 0.00 0.00 0.00 46.02 45.69 1rxc n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxc h ALA 119 N 0.54 1.10 -0.37 4.61 0.00 -1.98 -2.80 119.26 120.36 1rxc h ALA 119 Ca -0.47 -0.46 0.04 0.00 0.00 0.00 0.00 54.91 54.02 1rxc h ALA 119 Cb 1.95 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.63 1rxc h ALA 119 CO -0.01 0.64 0.25 0.66 0.00 0.00 0.00 179.25 180.79 1rxc h SER 120 N 0.08 0.28 0.76 0.00 4.64 -1.85 -1.08 113.55 116.37 1rxc h SER 120 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rxc h SER 120 Cb 0.91 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1rxc h SER 120 CO 0.07 0.19 0.00 -0.07 -0.87 0.00 0.00 176.83 176.15 1rxc h LEU 121 N 0.33 0.00 0.00 5.97 3.38 -1.61 -2.34 115.31 121.03 1rxc h LEU 121 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1rxc h LEU 121 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1rxc h LEU 121 CO -0.03 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.91 1rxc n HIS 122 N -2.57 0.00 -0.01 1.13 8.25 -0.41 -3.86 115.22 117.76 1rxc n HIS 122 Ca 0.01 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1rxc n HIS 122 Cb 0.24 -0.29 -0.02 0.00 1.12 0.00 0.00 29.99 31.04 1rxc n HIS 122 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1rxc n PHE 123 N -1.29 0.00 -3.56 4.41 3.72 -0.92 -5.09 117.46 114.73 1rxc n PHE 123 Ca 0.14 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.40 1rxc n PHE 123 Cb 0.24 -0.08 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 1rxc n PHE 123 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rxc s ALA 124 N -2.11 -1.84 0.97 4.37 0.00 -0.98 -4.96 121.76 117.22 1rxc s ALA 124 Ca -0.01 1.52 -0.12 0.00 0.00 0.00 0.00 51.96 53.35 1rxc s ALA 124 Cb 0.01 -0.46 0.17 0.00 0.00 0.00 0.00 23.12 22.84 1rxc s ALA 124 CO 0.10 -0.34 1.09 -1.25 0.00 0.00 0.00 175.76 175.36 1rxc s PRO 125 N -0.91 0.61 0.50 0.00 0.04 -1.26 -3.94 135.00 130.04 1rxc s PRO 125 Ca -0.06 0.76 0.15 0.00 0.04 0.00 0.00 61.00 61.89 1rxc s PRO 125 Cb -0.01 -1.74 1.19 0.00 0.04 0.00 0.00 34.50 33.98 1rxc s PRO 125 CO 0.05 -2.67 2.12 1.25 0.04 0.00 0.00 177.00 177.80 1rxc h LEU 126 N -1.86 0.10 -1.60 -3.56 5.85 -1.94 -2.24 115.31 110.06 1rxc h LEU 126 Ca -0.53 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.19 1rxc h LEU 126 Cb 1.31 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.31 1rxc h LEU 126 CO 0.54 0.07 0.00 1.05 -0.34 0.00 0.00 178.44 179.76 1rxc h GLU 127 N 0.12 0.00 -6.63 1.25 9.09 -2.03 -3.43 114.58 112.95 1rxc h GLU 127 Ca 0.05 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 58.93 1rxc h GLU 127 Cb 0.04 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.17 1rxc h GLU 127 CO -0.01 0.00 0.62 0.12 0.05 0.00 0.00 179.01 179.79 1rxc s PHE 128 N -3.71 3.33 0.08 2.06 5.36 -0.85 -4.99 117.98 119.27 1rxc s PHE 128 Ca 0.01 1.26 -0.30 0.00 -0.96 0.00 0.00 56.93 56.93 1rxc s PHE 128 Cb 0.09 -3.54 -0.05 0.00 -0.34 0.00 0.00 43.02 39.18 1rxc s PHE 128 CO 0.52 -1.66 1.09 -1.25 -1.46 0.00 0.00 175.22 172.46 1rxc s PRO 129 N 0.19 4.53 -1.43 10.12 0.04 -1.26 -4.93 135.00 142.25 1rxc s PRO 129 Ca 0.57 1.63 -0.14 0.00 0.04 0.00 0.00 61.00 63.10 1rxc s PRO 129 Cb -0.34 -3.36 0.03 0.00 0.04 0.00 0.00 34.50 30.87 1rxc s PRO 129 CO 0.35 -0.08 2.20 0.00 0.04 0.00 0.00 177.00 179.51 1rxc n ALA 130 N 3.46 5.40 -2.87 8.56 0.00 -1.26 -4.79 120.51 129.01 1rxc n ALA 130 Ca 0.06 -3.86 -0.35 0.00 0.00 0.00 0.00 53.44 49.29 1rxc n ALA 130 Cb 0.48 -3.55 -0.06 0.00 0.00 0.00 0.00 19.45 16.32 1rxc n ALA 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1rxc s VAL 131 N 3.31 5.38 0.48 0.00 0.11 -1.26 -1.08 120.40 127.34 1rxc s VAL 131 Ca 0.48 0.03 -0.15 0.00 -2.93 0.00 0.00 61.98 59.41 1rxc s VAL 131 Cb 0.14 -3.40 -0.08 0.00 -1.53 0.00 0.00 36.38 31.51 1rxc s VAL 131 CO -0.08 0.51 0.92 0.00 -3.33 0.00 0.00 175.10 173.12 1rxc s ALA 132 N -1.13 3.15 0.28 1.54 0.00 -0.11 -4.72 121.76 120.77 1rxc s ALA 132 Ca 0.19 0.09 -0.30 0.00 0.00 0.00 0.00 51.96 51.95 1rxc s ALA 132 Cb -0.12 -3.00 -0.10 0.00 0.00 0.00 0.00 23.12 19.90 1rxc s ALA 132 CO 0.09 -0.14 1.42 0.34 0.00 0.00 0.00 175.76 177.48 1rxc s ASP 133 N -3.02 6.64 0.27 0.00 -1.08 -0.41 -4.93 116.67 114.13 1rxc s ASP 133 Ca 0.57 2.72 -0.00 0.00 -0.52 0.00 0.00 52.55 55.31 1rxc s ASP 133 Cb -0.10 -2.63 0.36 0.00 -1.46 0.00 0.00 42.92 39.09 1rxc s ASP 133 CO 0.30 -0.69 1.73 0.15 0.52 0.00 0.00 175.17 177.18 1rxc h PHE 134 N 4.53 0.72 -0.39 -5.34 3.04 -1.95 -1.73 116.94 115.81 1rxc h PHE 134 Ca -0.47 -0.13 -0.13 0.00 3.98 0.00 0.00 57.97 61.23 1rxc h PHE 134 Cb 1.22 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 39.53 1rxc h PHE 134 CO 0.59 0.75 -0.25 0.93 -2.02 0.00 0.00 178.31 178.31 1rxc h GLU 135 N 0.60 0.86 -0.50 1.11 5.08 -1.96 -2.16 114.58 117.61 1rxc h GLU 135 Ca 0.11 -0.40 -0.07 0.00 -1.00 0.00 0.00 59.36 57.99 1rxc h GLU 135 Cb 0.56 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 1rxc h GLU 135 CO 0.04 1.04 0.04 0.00 -1.00 0.00 0.00 179.01 179.13 1rxc h THR 137 N 0.73 1.26 0.32 0.00 2.02 -1.34 -1.54 112.91 114.35 1rxc h THR 137 Ca 0.15 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.30 1rxc h THR 137 Cb 0.46 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1rxc h THR 137 CO 0.02 0.37 -0.15 0.74 0.37 0.00 0.00 175.52 176.87 1rxc h THR 138 N 0.96 0.69 -0.96 3.16 2.02 -1.25 -1.28 112.91 116.25 1rxc h THR 138 Ca 0.19 -0.03 0.08 0.00 0.77 0.00 0.00 66.41 67.42 1rxc h THR 138 Cb 0.42 0.71 -0.07 0.00 -1.74 0.00 0.00 68.15 67.47 1rxc h THR 138 CO 0.01 0.01 0.61 0.00 0.37 0.00 0.00 175.52 176.52 1rxc h ALA 139 N 0.24 1.35 -0.35 6.16 0.00 -1.16 0.16 119.26 125.66 1rxc h ALA 139 Ca -0.04 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1rxc h ALA 139 Cb 0.34 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1rxc h ALA 139 CO 0.07 0.34 -0.17 -0.07 0.00 0.00 0.00 179.25 179.42 1rxc h LEU 140 N 1.07 0.75 -0.25 0.00 3.38 -1.13 -0.17 115.31 118.95 1rxc h LEU 140 Ca 0.43 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1rxc h LEU 140 Cb 0.24 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1rxc h LEU 140 CO -0.20 0.99 -0.10 0.58 0.09 0.00 0.00 178.44 179.81 1rxc h VAL 141 N 0.50 1.29 0.00 1.22 2.07 -0.68 -1.95 116.25 118.71 1rxc h VAL 141 Ca 0.08 -1.15 -0.05 0.00 0.82 0.00 0.00 66.70 66.39 1rxc h VAL 141 Cb 0.71 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1rxc h VAL 141 CO 0.05 0.36 -0.25 -0.33 0.02 0.00 0.00 177.57 177.42 1rxc h GLU 142 N 0.25 0.00 -0.14 1.57 5.08 -1.01 -1.29 114.58 119.04 1rxc h GLU 142 Ca 0.06 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.22 1rxc h GLU 142 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1rxc h GLU 142 CO 0.03 0.25 -0.72 0.00 -1.00 0.00 0.00 179.01 177.58 1rxc h ALA 143 N 1.75 0.48 -0.40 3.43 0.00 -0.80 -2.40 119.26 121.31 1rxc h ALA 143 Ca -0.00 -0.59 -0.11 0.00 0.00 0.00 0.00 54.91 54.21 1rxc h ALA 143 Cb 0.63 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1rxc h ALA 143 CO 0.03 0.72 -0.18 0.00 0.00 0.00 0.00 179.25 179.81 1rxc h ALA 144 N 0.77 0.92 -0.21 0.00 0.00 -1.12 -2.90 119.26 116.72 1rxc h ALA 144 Ca -0.03 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.57 1rxc h ALA 144 Cb 1.31 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1rxc h ALA 144 CO 0.14 0.62 -0.09 0.87 0.00 0.00 0.00 179.25 180.78 1rxc h LYS 145 N 0.68 -0.06 0.00 0.00 6.56 -1.15 -2.11 116.57 120.49 1rxc h LYS 145 Ca 0.10 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.69 1rxc h LYS 145 Cb 0.68 0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.35 1rxc h LYS 145 CO 0.05 -0.04 -0.01 0.66 -2.06 0.00 0.00 179.45 178.05 1rxc h SER 146 N -0.06 0.00 -0.14 0.86 4.64 -1.28 -2.47 113.55 115.10 1rxc h SER 146 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1rxc h SER 146 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1rxc h SER 146 CO -0.25 0.01 0.00 2.30 -0.87 0.00 0.00 176.83 178.02 1rxc n ILE 147 N -3.11 0.19 -1.08 0.95 -6.64 -1.11 -5.00 119.36 103.56 1rxc n ILE 147 Ca 0.01 -0.60 -0.03 0.00 -1.77 0.00 0.00 62.75 60.37 1rxc n ILE 147 Cb 0.37 1.25 -0.01 0.00 -1.44 0.00 0.00 39.64 39.80 1rxc n ILE 147 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1rxc n GLY 148 N 1.19 0.60 3.77 3.28 0.00 -0.82 -5.01 105.19 108.20 1rxc n GLY 148 Ca 0.14 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 1rxc n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxc s ALA 149 N -2.02 3.41 -0.32 4.61 0.00 -1.05 -4.97 121.76 121.43 1rxc s ALA 149 Ca 0.00 1.25 -0.29 0.00 0.00 0.00 0.00 51.96 52.92 1rxc s ALA 149 Cb 0.00 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.65 1rxc s ALA 149 CO 0.00 -0.70 1.12 -0.08 0.00 0.00 0.00 175.76 176.10 1rxc s THR 150 N -1.19 4.42 0.06 0.00 -1.32 -1.26 -4.76 115.64 111.59 1rxc s THR 150 Ca 0.52 1.62 0.09 0.00 -1.21 0.00 0.00 61.69 62.71 1rxc s THR 150 Cb -0.39 -4.37 -0.03 0.00 -1.51 0.00 0.00 72.50 66.19 1rxc s THR 150 CO 0.51 -0.51 -0.26 -0.89 -2.21 0.00 0.00 174.62 171.26 1rxc s THR 151 N 3.83 2.21 -0.01 5.08 2.01 -1.26 -1.75 115.64 125.75 1rxc s THR 151 Ca 0.48 -1.45 0.04 0.00 0.31 0.00 0.00 61.69 61.06 1rxc s THR 151 Cb -0.13 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.48 1rxc s THR 151 CO 0.18 0.31 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.28 1rxc s HIS 152 N -0.87 1.21 -0.10 4.92 3.76 -0.19 -4.97 115.29 119.05 1rxc s HIS 152 Ca 0.12 -0.25 0.03 0.00 -0.15 0.00 0.00 55.06 54.81 1rxc s HIS 152 Cb -0.10 -0.79 0.01 0.00 1.11 0.00 0.00 32.58 32.81 1rxc s HIS 152 CO 0.03 -0.04 -0.18 0.08 -0.85 0.00 0.00 174.74 173.78 1rxc s VAL 153 N -0.23 1.62 -3.38 -0.90 1.01 -1.26 -1.47 120.40 115.79 1rxc s VAL 153 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1rxc s VAL 153 Cb -0.06 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.87 1rxc s VAL 153 CO -0.00 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1rxc n GLY 154 N 3.88 -1.00 3.83 4.51 0.00 -0.98 -4.97 105.19 110.46 1rxc n GLY 154 Ca -0.20 -1.03 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 1rxc n GLY 154 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rxc s VAL 155 N -3.00 4.49 -0.03 1.61 1.01 -1.26 -1.64 120.40 121.58 1rxc s VAL 155 Ca 0.00 1.31 0.05 0.00 0.00 0.00 0.00 61.98 63.34 1rxc s VAL 155 Cb 0.00 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1rxc s VAL 155 CO 0.00 -0.15 -0.18 -0.89 0.00 0.00 0.00 175.10 173.88 1rxc s THR 156 N -1.96 1.48 -0.20 3.92 2.01 -0.94 -1.55 115.64 118.40 1rxc s THR 156 Ca 0.55 -0.77 -0.23 0.00 0.31 0.00 0.00 61.69 61.56 1rxc s THR 156 Cb -0.12 -1.25 -0.02 0.00 0.01 0.00 0.00 72.50 71.13 1rxc s THR 156 CO 0.17 0.42 0.74 0.00 -0.69 0.00 0.00 174.62 175.26 1rxc s ALA 157 N -0.18 3.56 -0.28 7.40 0.00 0.18 -0.34 121.76 132.12 1rxc s ALA 157 Ca 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 51.96 51.82 1rxc s ALA 157 Cb -0.10 -3.13 0.05 0.00 0.00 0.00 0.00 23.12 19.94 1rxc s ALA 157 CO 0.01 -0.69 -0.05 0.45 0.00 0.00 0.00 175.76 175.48 1rxc s SER 158 N 1.24 4.61 -0.07 0.00 0.15 -0.80 -1.93 113.70 116.89 1rxc s SER 158 Ca 0.33 -1.24 0.02 0.00 0.70 0.00 0.00 55.95 55.76 1rxc s SER 158 Cb -0.16 -1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 62.48 1rxc s SER 158 CO 0.10 -0.21 -0.12 -0.55 1.20 0.00 0.00 173.24 173.66 1rxc s SER 159 N 1.21 4.20 0.33 5.45 0.15 -0.09 -1.29 113.70 123.66 1rxc s SER 159 Ca -0.06 -0.16 0.26 0.00 0.70 0.00 0.00 55.95 56.69 1rxc s SER 159 Cb -0.19 -1.03 1.04 0.00 -1.71 0.00 0.00 66.02 64.13 1rxc s SER 159 CO -0.03 0.33 1.78 0.44 1.20 0.00 0.00 173.24 176.96 1rxc h ASP 160 N 5.50 0.00 -3.16 5.45 5.19 -1.65 -3.39 116.42 124.36 1rxc h ASP 160 Ca -0.44 0.00 -0.65 0.00 -0.62 0.00 0.00 57.03 55.32 1rxc h ASP 160 Cb 1.16 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.50 1rxc h ASP 160 CO 0.52 0.00 -0.80 0.42 -3.12 0.00 0.00 179.24 176.26 1rxc s THR 161 N -3.38 2.60 0.02 0.35 -4.23 -1.26 -5.00 115.64 104.74 1rxc s THR 161 Ca 0.04 -1.91 -0.05 0.00 -1.18 0.00 0.00 61.69 58.58 1rxc s THR 161 Cb 0.09 -2.26 -0.29 0.00 1.34 0.00 0.00 72.50 71.39 1rxc s THR 161 CO 0.46 -0.11 0.93 0.15 -0.54 0.00 0.00 174.62 175.52 1rxc h PHE 162 N 3.14 0.55 0.00 3.99 3.57 -1.97 -3.39 116.94 122.82 1rxc h PHE 162 Ca -0.47 -0.40 0.00 0.00 3.53 0.00 0.00 57.97 60.64 1rxc h PHE 162 Cb 1.21 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.92 1rxc h PHE 162 CO 0.68 1.40 0.00 0.66 -2.23 0.00 0.00 178.31 178.81 1rxc n TYR 163 N -3.51 0.00 -0.12 0.41 4.01 -1.26 -4.28 117.16 112.40 1rxc n TYR 163 Ca -0.15 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.62 1rxc n TYR 163 Cb 1.05 0.00 0.33 0.00 -0.31 0.00 0.00 39.34 40.41 1rxc n TYR 163 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1rxc h PRO 164 N 0.00 0.77 0.00 -0.72 0.13 -1.88 -1.88 132.00 128.42 1rxc h PRO 164 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1rxc h PRO 164 Cb 0.00 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 30.96 1rxc h PRO 164 CO 0.00 0.51 0.00 0.78 -0.23 0.00 0.00 178.00 179.06 1rxc h GLY 165 N 0.80 0.00 -1.99 1.56 0.00 -1.84 -0.90 103.07 100.69 1rxc h GLY 165 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.50 1rxc h GLY 165 CO -0.05 0.00 0.02 -1.06 0.00 0.00 0.00 176.54 175.45 1rxc n GLN 166 N -2.54 2.88 -3.93 4.80 6.02 -0.99 -4.94 117.38 118.69 1rxc n GLN 166 Ca 0.02 -2.95 -0.31 0.00 -0.01 0.00 0.00 57.00 53.75 1rxc n GLN 166 Cb 0.31 -1.90 -0.00 0.00 1.02 0.00 0.00 30.24 29.66 1rxc n GLN 166 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1rxc n GLU 167 N -0.55 -1.94 -3.62 -1.09 2.13 -0.34 -4.95 120.64 110.28 1rxc n GLU 167 Ca 0.26 0.33 -0.36 0.00 0.66 0.00 0.00 57.16 58.05 1rxc n GLU 167 Cb 0.99 -3.99 -0.07 0.00 0.27 0.00 0.00 31.44 28.64 1rxc n GLU 167 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1rxc s ARG 168 N -6.61 4.07 -0.00 5.31 0.52 -0.74 -4.99 118.95 116.51 1rxc s ARG 168 Ca 0.22 0.05 0.11 0.00 -0.52 0.00 0.00 55.73 55.60 1rxc s ARG 168 Cb -0.09 -3.36 -0.13 0.00 0.52 0.00 0.00 34.95 31.89 1rxc s ARG 168 CO 0.91 0.40 0.44 0.66 0.02 0.00 0.00 175.30 177.72 1rxc n TYR 169 N 3.07 0.00 -2.53 -0.53 4.01 -1.26 -4.39 117.16 115.53 1rxc n TYR 169 Ca -0.14 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.17 1rxc n TYR 169 Cb 0.52 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.51 1rxc n TYR 169 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1rxc n ASP 170 N -1.37 5.09 -3.87 7.72 4.64 -1.26 -4.15 116.55 123.36 1rxc n ASP 170 Ca 0.01 -3.05 -0.16 0.00 -1.38 0.00 0.00 54.79 50.21 1rxc n ASP 170 Cb 0.19 -1.52 -0.09 0.00 -1.04 0.00 0.00 41.12 38.66 1rxc n ASP 170 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 1rxc s THR 171 N 0.99 0.07 0.16 5.18 -4.23 -1.26 -5.02 115.64 111.53 1rxc s THR 171 Ca 0.41 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.75 1rxc s THR 171 Cb 0.05 -2.50 0.08 0.00 1.34 0.00 0.00 72.50 71.47 1rxc s THR 171 CO 0.00 0.00 1.67 0.22 -0.54 0.00 0.00 174.62 175.97 1rxc h TYR 172 N 2.37 -0.23 0.00 3.99 3.20 -1.99 -3.02 116.97 121.29 1rxc h TYR 172 Ca -0.32 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.33 1rxc h TYR 172 Cb 1.24 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 39.63 1rxc h TYR 172 CO 0.96 -0.17 -1.45 0.66 -1.64 0.00 0.00 178.16 176.51 1rxc h SER 173 N -0.02 0.00 -0.58 -2.11 4.64 -1.97 -3.48 113.55 110.03 1rxc h SER 173 Ca 0.18 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.25 1rxc h SER 173 Cb 0.29 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.28 1rxc h SER 173 CO -0.39 0.99 -0.23 0.61 -0.87 0.00 0.00 176.83 176.94 1rxc n GLY 174 N 1.48 1.32 3.32 -0.77 0.00 -1.14 -5.01 105.19 104.39 1rxc n GLY 174 Ca -0.11 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.25 1rxc n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rxc s ARG 175 N -3.02 1.24 -0.05 1.61 0.52 -1.26 -4.93 118.95 113.06 1rxc s ARG 175 Ca 0.00 -1.33 0.05 0.00 -0.52 0.00 0.00 55.73 53.93 1rxc s ARG 175 Cb 0.00 -1.39 -0.01 0.00 0.52 0.00 0.00 34.95 34.07 1rxc s ARG 175 CO 0.00 0.30 -0.21 0.08 0.02 0.00 0.00 175.30 175.49 1rxc s VAL 176 N -1.71 1.74 0.55 3.52 1.01 -1.26 -4.91 120.40 119.35 1rxc s VAL 176 Ca 0.13 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 1rxc s VAL 176 Cb -0.07 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.77 1rxc s VAL 176 CO 0.06 0.49 1.23 0.55 0.00 0.00 0.00 175.10 177.43 1rxc n VAL 177 N 3.02 3.67 -0.26 2.92 3.14 -1.26 -4.57 118.33 124.99 1rxc n VAL 177 Ca -0.18 -0.50 0.07 0.00 -2.96 0.00 0.00 64.34 60.77 1rxc n VAL 177 Cb 0.52 -1.48 0.19 0.00 -1.06 0.00 0.00 33.84 32.01 1rxc n VAL 177 CO 0.00 0.00 0.00 -0.09 -6.46 0.00 0.00 176.83 170.28 1rxc h ARG 178 N 1.21 0.19 -0.80 1.45 2.43 -2.00 -0.84 114.38 116.03 1rxc h ARG 178 Ca -0.49 -0.01 0.19 0.00 -0.81 0.00 0.00 59.98 58.85 1rxc h ARG 178 Cb 1.32 -0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 30.69 1rxc h ARG 178 CO 0.56 0.13 0.04 1.25 -1.51 0.00 0.00 179.97 180.43 1rxc h HIS 179 N 0.19 0.00 -0.00 2.20 2.76 -2.03 -2.74 115.15 115.53 1rxc h HIS 179 Ca 0.44 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.66 1rxc h HIS 179 Cb 0.78 0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.87 1rxc h HIS 179 CO -0.32 -0.25 -0.65 1.19 -1.30 0.00 0.00 177.93 176.60 1rxc n PHE 180 N -5.34 0.00 -2.20 5.26 3.01 -0.37 -4.72 117.46 113.09 1rxc n PHE 180 Ca 0.16 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.19 1rxc n PHE 180 Cb 0.53 -0.08 -0.03 0.00 -0.01 0.00 0.00 39.48 39.89 1rxc n PHE 180 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1rxc s LYS 181 N -2.81 4.31 0.00 -1.08 2.20 -0.88 -1.78 119.74 119.70 1rxc s LYS 181 Ca 0.14 2.02 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 1rxc s LYS 181 Cb 0.17 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 33.10 1rxc s LYS 181 CO 0.71 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 175.62 1rxc n GLY 182 N 3.55 0.91 0.13 5.54 0.00 -1.26 -4.95 105.19 109.11 1rxc n GLY 182 Ca 0.12 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 1rxc n GLY 182 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rxc h SER 183 N 0.00 0.43 -0.89 1.61 4.64 -1.63 -2.99 113.55 114.72 1rxc h SER 183 Ca 0.00 -0.70 0.16 0.00 -0.47 0.00 0.00 61.79 60.79 1rxc h SER 183 Cb 0.00 -0.13 -0.10 0.00 -0.31 0.00 0.00 62.40 61.86 1rxc h SER 183 CO 0.00 1.06 0.47 -0.03 -0.87 0.00 0.00 176.83 177.46 1rxc h MET 184 N -0.16 0.61 -0.56 4.77 -1.53 -1.93 -0.75 114.93 115.38 1rxc h MET 184 Ca -0.04 -0.04 -0.01 0.00 -3.44 0.00 0.00 59.70 56.17 1rxc h MET 184 Cb 1.09 -0.14 -0.03 0.00 -0.55 0.00 0.00 31.60 31.97 1rxc h MET 184 CO 0.08 0.40 0.30 1.49 0.14 0.00 0.00 176.91 179.32 1rxc h GLU 185 N 0.63 0.79 -0.21 0.39 4.81 -1.95 -0.74 114.58 118.29 1rxc h GLU 185 Ca 0.50 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.63 1rxc h GLU 185 Cb 0.75 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1rxc h GLU 185 CO -0.39 0.62 0.13 0.93 -0.73 0.00 0.00 179.01 179.57 1rxc h GLU 186 N 0.75 0.29 -0.98 1.92 4.39 -1.04 -2.16 114.58 117.76 1rxc h GLU 186 Ca 0.20 -0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1rxc h GLU 186 Cb 0.07 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 1rxc h GLU 186 CO -0.03 0.24 0.64 -1.49 -1.16 0.00 0.00 179.01 177.21 1rxc h TRP 187 N 0.26 1.19 -0.24 4.33 -0.00 -1.04 -1.91 115.95 118.54 1rxc h TRP 187 Ca 0.08 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.99 1rxc h TRP 187 Cb 0.03 -0.40 -0.01 0.00 -0.00 0.00 0.00 29.16 28.78 1rxc h TRP 187 CO -0.05 0.68 0.12 1.96 -0.00 0.00 0.00 178.44 181.16 1rxc h GLN 188 N 1.23 0.35 -0.15 0.49 4.20 -0.90 -1.30 115.11 119.02 1rxc h GLN 188 Ca 0.39 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 59.03 1rxc h GLN 188 Cb 0.02 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1rxc h GLN 188 CO -0.12 0.34 -0.02 0.00 -0.67 0.00 0.00 178.83 178.36 1rxc h ALA 189 N 0.99 1.69 -0.15 3.87 0.00 -1.16 -1.24 119.26 123.26 1rxc h ALA 189 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rxc h ALA 189 Cb 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1rxc h ALA 189 CO -0.01 0.24 0.00 -1.33 0.00 0.00 0.00 179.25 178.14 1rxc n MET 190 N -4.39 1.37 -1.05 0.00 2.81 -0.74 -4.89 117.12 110.24 1rxc n MET 190 Ca -0.01 -0.57 -0.02 0.00 -1.81 0.00 0.00 57.70 55.29 1rxc n MET 190 Cb 0.18 -1.17 -0.01 0.00 -0.71 0.00 0.00 33.22 31.51 1rxc n MET 190 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rxc n GLY 191 N 0.80 0.53 3.75 3.03 0.00 -0.47 -5.01 105.19 107.82 1rxc n GLY 191 Ca 0.07 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 1rxc n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rxc s VAL 192 N -1.97 2.72 -0.02 1.61 1.01 -0.54 -4.62 120.40 118.59 1rxc s VAL 192 Ca 0.00 0.64 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 1rxc s VAL 192 Cb 0.00 -3.41 -0.26 0.00 0.00 0.00 0.00 36.38 32.71 1rxc s VAL 192 CO 0.00 0.12 0.77 0.24 0.00 0.00 0.00 175.10 176.23 1rxc h MET 193 N 4.43 0.20 -2.46 2.72 0.00 -1.60 -3.41 114.93 114.80 1rxc h MET 193 Ca -0.47 -0.34 0.14 0.00 0.00 0.00 0.00 59.70 59.03 1rxc h MET 193 Cb 1.22 0.13 -0.09 0.00 0.00 0.00 0.00 31.60 32.86 1rxc h MET 193 CO 0.73 1.02 0.43 0.54 0.00 0.00 0.00 176.91 179.63 1rxc s ASN 194 N -6.83 -0.23 -0.05 1.22 4.22 -1.26 -1.20 114.94 110.80 1rxc s ASN 194 Ca -0.10 -0.36 0.04 0.00 -2.14 0.00 0.00 52.86 50.30 1rxc s ASN 194 Cb 0.07 0.52 -0.02 0.00 1.28 0.00 0.00 41.25 43.09 1rxc s ASN 194 CO 0.83 -0.93 -0.17 -0.31 -2.04 0.00 0.00 177.10 174.48 1rxc s TYR 195 N -3.38 2.62 0.00 1.54 2.02 -0.29 -0.64 117.35 119.21 1rxc s TYR 195 Ca 0.10 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 1rxc s TYR 195 Cb -0.02 -1.63 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 1rxc s TYR 195 CO 0.01 0.07 0.00 -0.85 -1.57 0.00 0.00 175.55 173.21 1rxc n GLU 196 N 2.52 0.00 0.00 -0.62 -0.00 -0.82 -2.56 120.64 119.16 1rxc n GLU 196 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.99 1rxc n GLU 196 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.96 1rxc n GLU 196 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1rxc n MET 197 N 0.00 0.87 0.00 3.44 2.81 -1.26 -0.91 117.12 122.07 1rxc n MET 197 Ca 0.00 -0.13 0.00 0.00 -1.81 0.00 0.00 57.70 55.76 1rxc n MET 197 Cb 0.00 -0.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 1rxc n MET 197 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1rxc n GLU 198 N -0.16 4.11 0.19 0.03 4.71 -1.26 -3.58 120.64 124.67 1rxc n GLU 198 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.16 57.19 1rxc n GLU 198 Cb 0.09 -0.44 0.35 0.00 -1.01 0.00 0.00 31.44 30.42 1rxc n GLU 198 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1rxc h SER 199 N 0.00 0.00 -0.27 1.62 4.64 -1.94 -2.19 113.55 115.41 1rxc h SER 199 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1rxc h SER 199 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1rxc h SER 199 CO 0.00 0.40 -0.06 0.00 -0.87 0.00 0.00 176.83 176.29 1rxc h ALA 200 N 1.60 0.37 0.03 5.18 0.00 -1.88 -1.64 119.26 122.92 1rxc h ALA 200 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1rxc h ALA 200 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1rxc h ALA 200 CO 0.05 0.17 -0.02 1.15 0.00 0.00 0.00 179.25 180.61 1rxc h THR 201 N 0.26 1.19 0.43 0.00 2.02 -1.88 -2.43 112.91 112.51 1rxc h THR 201 Ca 0.07 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1rxc h THR 201 Cb 0.53 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 1rxc h THR 201 CO 0.03 0.19 -0.39 0.25 0.37 0.00 0.00 175.52 175.96 1rxc h LEU 202 N -0.37 -1.05 -0.99 2.58 5.85 -1.40 -0.87 115.31 119.05 1rxc h LEU 202 Ca -0.00 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1rxc h LEU 202 Cb 0.34 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1rxc h LEU 202 CO 0.01 -0.55 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.37 1rxc h LEU 203 N -0.83 0.58 -0.07 2.25 3.38 -1.39 -1.71 115.31 117.52 1rxc h LEU 203 Ca -0.04 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.65 1rxc h LEU 203 Cb 0.73 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.33 1rxc h LEU 203 CO -0.04 0.73 -0.44 0.74 0.09 0.00 0.00 178.44 179.52 1rxc h THR 204 N 0.55 1.40 -0.21 0.22 2.02 -1.36 -1.49 112.91 114.06 1rxc h THR 204 Ca 0.10 -1.83 -0.09 0.00 0.77 0.00 0.00 66.41 65.36 1rxc h THR 204 Cb 0.53 2.33 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 1rxc h THR 204 CO 0.03 0.54 -0.25 0.00 0.37 0.00 0.00 175.52 176.21 1rxc h MET 205 N -0.04 0.38 0.08 6.66 -0.00 -1.11 -2.13 114.93 118.76 1rxc h MET 205 Ca -0.03 -0.14 -0.23 0.00 -0.00 0.00 0.00 59.70 59.30 1rxc h MET 205 Cb 1.10 -0.03 0.02 0.00 -0.00 0.00 0.00 31.60 32.69 1rxc h MET 205 CO 0.09 0.61 -0.93 0.00 -0.00 0.00 0.00 176.91 176.68 1rxc h ALA 207 N 0.26 1.05 -0.00 0.00 0.00 -1.18 -1.48 119.26 117.91 1rxc h ALA 207 Ca -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1rxc h ALA 207 Cb 1.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1rxc h ALA 207 CO 0.18 0.13 -0.52 -1.13 0.00 0.00 0.00 179.25 177.91 1rxc n SER 208 N -3.29 0.87 -0.01 0.00 3.41 -0.81 -4.28 113.62 109.51 1rxc n SER 208 Ca -0.00 -0.67 0.01 0.00 -0.26 0.00 0.00 58.87 57.94 1rxc n SER 208 Cb 0.33 0.38 0.01 0.00 -0.26 0.00 0.00 64.21 64.67 1rxc n SER 208 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rxc n GLN 209 N -1.13 2.40 -1.03 4.33 6.02 -0.96 -5.00 117.38 122.01 1rxc n GLN 209 Ca 0.07 -1.40 -0.01 0.00 -0.01 0.00 0.00 57.00 55.66 1rxc n GLN 209 Cb 0.35 -0.94 -0.00 0.00 1.02 0.00 0.00 30.24 30.66 1rxc n GLN 209 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rxc n GLY 210 N -0.47 0.49 3.87 1.08 0.00 -1.07 -5.04 105.19 104.04 1rxc n GLY 210 Ca 0.01 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.19 1rxc n GLY 210 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rxc s LEU 211 N -0.20 4.41 -0.07 0.99 1.43 -0.60 -5.06 118.68 119.59 1rxc s LEU 211 Ca 0.00 0.67 -0.23 0.00 -1.03 0.00 0.00 54.13 53.54 1rxc s LEU 211 Cb 0.00 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 1rxc s LEU 211 CO 0.00 0.32 0.70 -0.13 0.23 0.00 0.00 176.35 177.47 1rxc s ARG 212 N -1.33 4.43 -0.01 1.70 0.52 -0.47 -3.96 118.95 119.84 1rxc s ARG 212 Ca 0.23 0.87 0.01 0.00 -0.52 0.00 0.00 55.73 56.31 1rxc s ARG 212 Cb -0.14 -3.45 0.00 0.00 0.52 0.00 0.00 34.95 31.88 1rxc s ARG 212 CO 0.12 0.06 -0.03 0.00 0.02 0.00 0.00 175.30 175.47 1rxc s ALA 213 N 0.82 0.27 0.28 2.13 0.00 -1.26 -0.69 121.76 123.31 1rxc s ALA 213 Ca 0.37 -0.08 0.07 0.00 0.00 0.00 0.00 51.96 52.32 1rxc s ALA 213 Cb -0.18 -0.11 -0.06 0.00 0.00 0.00 0.00 23.12 22.78 1rxc s ALA 213 CO 0.18 0.04 -0.06 0.20 0.00 0.00 0.00 175.76 176.12 1rxc s GLY 214 N 0.10 1.83 -0.12 0.00 0.00 -0.15 -1.29 107.32 107.69 1rxc s GLY 214 Ca -0.01 -1.90 -0.04 0.00 0.00 0.00 0.00 44.72 42.77 1rxc s GLY 214 CO -0.00 -1.84 0.23 -0.29 0.00 0.00 0.00 173.10 171.19 1rxc s MET 215 N -3.72 0.12 0.03 2.90 0.00 -1.26 -1.23 119.30 116.13 1rxc s MET 215 Ca 0.29 0.66 0.03 0.00 0.00 0.00 0.00 55.69 56.68 1rxc s MET 215 Cb 0.03 -0.17 -0.02 0.00 0.00 0.00 0.00 34.83 34.67 1rxc s MET 215 CO 0.12 -0.32 -0.10 0.54 0.00 0.00 0.00 175.02 175.27 1rxc s VAL 216 N 2.38 0.74 -0.00 10.11 0.11 -0.68 -1.98 120.40 131.07 1rxc s VAL 216 Ca 0.02 -0.84 -0.10 0.00 -2.93 0.00 0.00 61.98 58.14 1rxc s VAL 216 Cb -0.12 -0.71 0.01 0.00 -1.53 0.00 0.00 36.38 34.03 1rxc s VAL 216 CO -0.08 -0.10 0.19 0.00 -3.33 0.00 0.00 175.10 171.78 1rxc s ALA 217 N -0.86 -0.48 -0.10 1.54 0.00 -0.57 -1.44 121.76 119.85 1rxc s ALA 217 Ca -0.02 0.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.84 1rxc s ALA 217 Cb -0.07 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 1rxc s ALA 217 CO 0.01 -0.23 0.25 0.20 0.00 0.00 0.00 175.76 175.99 1rxc s GLY 218 N -1.37 2.25 -0.36 0.00 0.00 -0.61 -1.26 107.32 105.99 1rxc s GLY 218 Ca -0.14 -0.48 -0.29 0.00 0.00 0.00 0.00 44.72 43.81 1rxc s GLY 218 CO 0.02 0.02 1.19 0.14 0.00 0.00 0.00 173.10 174.47 1rxc s VAL 219 N -0.56 4.26 -1.27 1.40 1.01 -0.55 -2.21 120.40 122.48 1rxc s VAL 219 Ca 0.17 1.40 0.16 0.00 0.00 0.00 0.00 61.98 63.71 1rxc s VAL 219 Cb -0.13 -4.36 -0.05 0.00 0.00 0.00 0.00 36.38 31.84 1rxc s VAL 219 CO 0.06 -0.63 0.80 2.30 0.00 0.00 0.00 175.10 177.64 1rxc n ILE 220 N 6.31 0.00 -3.58 2.22 -5.35 -0.70 -1.11 119.36 117.15 1rxc n ILE 220 Ca 0.13 -0.27 -0.15 0.00 -0.27 0.00 0.00 62.75 62.19 1rxc n ILE 220 Cb 0.47 1.14 -0.06 0.00 -1.74 0.00 0.00 39.64 39.45 1rxc n ILE 220 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1rxc s VAL 221 N -2.08 0.02 -0.15 7.28 0.11 -1.24 -4.39 120.40 119.96 1rxc s VAL 221 Ca 0.11 -0.19 0.01 0.00 -2.93 0.00 0.00 61.98 58.99 1rxc s VAL 221 Cb 0.13 -0.92 0.01 0.00 -1.53 0.00 0.00 36.38 34.06 1rxc s VAL 221 CO 0.48 -0.10 -0.19 0.21 -3.33 0.00 0.00 175.10 172.16 1rxc s ASN 222 N -1.58 3.32 0.00 3.54 3.84 -1.26 -0.67 114.94 122.13 1rxc s ASN 222 Ca -0.09 -0.56 0.29 0.00 0.21 0.00 0.00 52.86 52.71 1rxc s ASN 222 Cb -0.01 -1.50 1.22 0.00 -0.55 0.00 0.00 41.25 40.41 1rxc s ASN 222 CO 0.03 0.07 1.88 0.54 -2.79 0.00 0.00 177.10 176.84 1rxc n ARG 223 N 4.15 0.23 0.00 0.43 5.12 0.10 -1.51 116.66 125.18 1rxc n ARG 223 Ca -0.20 -0.04 0.16 0.00 -1.93 0.00 0.00 57.85 55.84 1rxc n ARG 223 Cb 0.51 -1.50 0.89 0.00 -1.16 0.00 0.00 32.46 31.20 1rxc n ARG 223 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1rxc n THR 224 N -1.35 0.00 -0.01 0.55 -2.24 -1.26 -4.18 114.28 105.79 1rxc n THR 224 Ca 0.10 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.87 1rxc n THR 224 Cb 0.30 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 68.02 1rxc n THR 224 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rxc n GLN 225 N -1.08 0.05 -3.43 -0.78 6.02 -0.57 -5.13 117.38 112.45 1rxc n GLN 225 Ca 0.21 0.01 -0.12 0.00 -0.01 0.00 0.00 57.00 57.10 1rxc n GLN 225 Cb 0.15 -0.92 -0.02 0.00 1.02 0.00 0.00 30.24 30.46 1rxc n GLN 225 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 1rxc s GLN 226 N -2.04 1.24 -0.04 -1.09 -2.07 -0.78 -5.07 119.66 109.82 1rxc s GLN 226 Ca -0.03 -0.46 -0.13 0.00 -1.82 0.00 0.00 55.36 52.92 1rxc s GLN 226 Cb 0.01 0.57 -0.32 0.00 -1.09 0.00 0.00 33.01 32.18 1rxc s GLN 226 CO 0.04 -0.54 0.74 0.93 -1.32 0.00 0.00 175.29 175.13 1rxc h GLU 227 N 2.00 0.42 -5.22 9.60 5.08 -1.87 -3.35 114.58 121.23 1rxc h GLU 227 Ca -0.33 -0.71 -0.65 0.00 -1.00 0.00 0.00 59.36 56.68 1rxc h GLU 227 Cb 1.30 0.26 -0.24 0.00 0.50 0.00 0.00 28.75 30.58 1rxc h GLU 227 CO 0.37 1.34 -0.69 0.42 -1.00 0.00 0.00 179.01 179.45 1rxc s ILE 228 N -2.57 3.67 0.35 3.13 -1.09 -1.26 -5.02 121.20 118.40 1rxc s ILE 228 Ca -0.15 -0.43 -0.27 0.00 -2.23 0.00 0.00 60.65 57.57 1rxc s ILE 228 Cb 0.05 -2.62 -0.12 0.00 -1.58 0.00 0.00 42.46 38.19 1rxc s ILE 228 CO 0.87 0.48 1.18 -2.65 -1.23 0.00 0.00 174.94 173.58 1rxc n PRO 229 N 3.86 1.81 -2.37 2.79 -0.02 -1.26 -4.98 135.00 134.84 1rxc n PRO 229 Ca -0.18 0.64 -0.41 0.00 -2.02 0.00 0.00 63.50 61.54 1rxc n PRO 229 Cb 0.52 -2.17 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 1rxc n PRO 229 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1rxc s ASN 230 N -0.45 7.12 0.60 2.55 0.01 -1.26 -4.95 114.94 118.55 1rxc s ASN 230 Ca 0.58 2.33 0.38 0.00 -0.71 0.00 0.00 52.86 55.43 1rxc s ASN 230 Cb -0.59 -2.62 1.80 0.00 0.41 0.00 0.00 41.25 40.25 1rxc s ASN 230 CO 0.61 -0.30 2.15 0.00 -1.51 0.00 0.00 177.10 178.05 1rxc h ALA 231 N 4.29 1.02 -0.03 0.60 0.00 -1.96 -3.36 119.26 119.83 1rxc h ALA 231 Ca -0.46 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.28 1rxc h ALA 231 Cb 1.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1rxc h ALA 231 CO 0.70 0.01 -0.68 1.05 0.00 0.00 0.00 179.25 180.33 1rxc h GLU 232 N 0.00 0.17 -0.03 0.00 9.09 -1.99 -3.30 114.58 118.51 1rxc h GLU 232 Ca -0.00 -0.13 -0.00 0.00 0.05 0.00 0.00 59.36 59.27 1rxc h GLU 232 Cb 0.30 0.03 -0.00 0.00 -1.65 0.00 0.00 28.75 27.42 1rxc h GLU 232 CO 0.00 0.79 -0.02 -2.37 0.05 0.00 0.00 179.01 177.45 1rxc n THR 233 N -3.79 1.95 -0.03 -1.06 5.66 -1.26 -4.71 114.28 111.05 1rxc n THR 233 Ca -0.02 -2.28 -0.15 0.00 -3.05 0.00 0.00 64.05 58.55 1rxc n THR 233 Cb 0.67 -0.24 -0.10 0.00 -1.55 0.00 0.00 70.33 69.11 1rxc n THR 233 CO 0.00 0.00 0.00 0.24 -3.05 0.00 0.00 175.07 172.26 1rxc h MET 234 N 0.23 0.28 -0.78 1.09 2.86 -1.75 -3.18 114.93 113.68 1rxc h MET 234 Ca 0.00 -0.25 0.04 0.00 -2.06 0.00 0.00 59.70 57.43 1rxc h MET 234 Cb 1.05 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.72 1rxc h MET 234 CO 0.03 0.92 0.49 -0.22 1.06 0.00 0.00 176.91 179.18 1rxc h LYS 235 N -0.28 0.91 -0.46 1.72 3.64 -1.84 -1.88 116.57 118.39 1rxc h LYS 235 Ca -0.03 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.20 1rxc h LYS 235 Cb 0.99 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1rxc h LYS 235 CO 0.06 0.60 -0.08 0.37 -2.27 0.00 0.00 179.45 178.13 1rxc h GLN 236 N 0.93 0.87 -0.35 1.90 4.15 -1.90 -2.74 115.11 117.98 1rxc h GLN 236 Ca 0.32 -0.32 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 1rxc h GLN 236 Cb 0.06 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1rxc h GLN 236 CO -0.13 0.96 0.06 1.15 -1.93 0.00 0.00 178.83 178.93 1rxc h THR 237 N 0.71 1.23 -0.33 2.39 2.02 -1.50 -2.87 112.91 114.56 1rxc h THR 237 Ca 0.12 -0.82 0.07 0.00 0.77 0.00 0.00 66.41 66.55 1rxc h THR 237 Cb 0.62 1.11 -0.07 0.00 -1.74 0.00 0.00 68.15 68.07 1rxc h THR 237 CO 0.04 0.28 -0.12 -0.08 0.37 0.00 0.00 175.52 176.00 1rxc h GLU 238 N 0.41 -0.06 -0.80 6.66 4.81 -1.33 -2.70 114.58 121.58 1rxc h GLU 238 Ca 0.11 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 1rxc h GLU 238 Cb 0.35 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.70 1rxc h GLU 238 CO 0.01 -0.04 0.52 0.77 -0.73 0.00 0.00 179.01 179.54 1rxc h SER 239 N -0.06 0.85 -0.16 1.04 0.02 -1.44 -2.12 113.55 111.68 1rxc h SER 239 Ca 0.17 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 1rxc h SER 239 Cb 0.31 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1rxc h SER 239 CO -0.37 0.59 -0.00 -0.74 -1.14 0.00 0.00 176.83 175.16 1rxc h HIS 240 N 0.99 0.31 -0.19 3.45 2.76 -1.25 -2.16 115.15 119.06 1rxc h HIS 240 Ca 0.31 -0.05 -0.14 0.00 -2.20 0.00 0.00 60.37 58.28 1rxc h HIS 240 Cb 0.02 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 28.89 1rxc h HIS 240 CO -0.00 0.51 -0.49 0.00 -1.30 0.00 0.00 177.93 176.65 1rxc h ALA 241 N 0.76 0.80 -0.70 5.26 0.00 -1.44 -2.93 119.26 121.02 1rxc h ALA 241 Ca 0.04 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1rxc h ALA 241 Cb 0.39 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1rxc h ALA 241 CO 0.01 0.67 0.29 0.28 0.00 0.00 0.00 179.25 180.49 1rxc h VAL 242 N 0.40 1.24 -0.45 0.00 2.07 -1.33 -1.03 116.25 117.15 1rxc h VAL 242 Ca 0.02 -0.73 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 1rxc h VAL 242 Cb 1.00 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1rxc h VAL 242 CO 0.09 0.30 0.01 0.11 0.02 0.00 0.00 177.57 178.09 1rxc h LYS 243 N 1.00 0.73 -0.16 1.57 1.57 -1.24 -2.69 116.57 117.35 1rxc h LYS 243 Ca 0.24 -0.18 -0.22 0.00 -1.87 0.00 0.00 60.65 58.62 1rxc h LYS 243 Cb 0.18 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.40 1rxc h LYS 243 CO -0.02 0.73 -0.75 0.82 -0.57 0.00 0.00 179.45 179.66 1rxc h ILE 244 N 0.68 1.28 -0.11 1.86 2.04 -1.24 -2.24 117.51 119.79 1rxc h ILE 244 Ca 0.14 -1.95 -0.12 0.00 1.00 0.00 0.00 64.86 63.93 1rxc h ILE 244 Cb 0.41 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 1rxc h ILE 244 CO 0.02 0.62 -0.48 1.62 0.00 0.00 0.00 178.15 179.93 1rxc h VAL 245 N 0.53 1.34 -0.12 1.67 3.04 -1.11 0.92 116.25 122.52 1rxc h VAL 245 Ca -0.05 -1.69 -0.05 0.00 -1.01 0.00 0.00 66.70 63.91 1rxc h VAL 245 Cb 1.39 1.78 -0.00 0.00 -2.01 0.00 0.00 31.29 32.45 1rxc h VAL 245 CO 0.16 0.50 -0.11 0.58 -1.01 0.00 0.00 177.57 177.69 1rxc h VAL 246 N 0.22 1.35 -0.58 1.51 2.07 -1.53 -1.32 116.25 117.96 1rxc h VAL 246 Ca 0.01 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.28 1rxc h VAL 246 Cb 0.93 1.91 -0.03 0.00 -1.52 0.00 0.00 31.29 32.58 1rxc h VAL 246 CO 0.08 0.36 0.33 -0.08 0.02 0.00 0.00 177.57 178.28 1rxc h GLU 247 N -0.11 0.79 -0.36 1.57 4.57 -1.13 -1.39 114.58 118.53 1rxc h GLU 247 Ca 0.02 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.06 1rxc h GLU 247 Cb 0.62 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1rxc h GLU 247 CO 0.03 0.57 -0.03 0.00 -1.18 0.00 0.00 179.01 178.39 1rxc h ALA 248 N 1.57 0.49 -0.96 2.92 0.00 -0.78 -2.96 119.26 119.55 1rxc h ALA 248 Ca 0.21 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1rxc h ALA 248 Cb -0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1rxc h ALA 248 CO -0.04 0.29 0.61 0.00 0.00 0.00 0.00 179.25 180.11 1rxc h ALA 249 N 0.85 1.31 -0.54 0.00 0.00 -0.63 -1.63 119.26 118.61 1rxc h ALA 249 Ca 0.10 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.09 1rxc h ALA 249 Cb 0.51 -0.30 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 1rxc h ALA 249 CO 0.03 0.42 -0.05 -0.09 0.00 0.00 0.00 179.25 179.55 1rxc h ARG 250 N 1.13 0.07 0.00 0.00 2.43 -1.19 -1.64 114.38 115.18 1rxc h ARG 250 Ca 0.41 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.57 1rxc h ARG 250 Cb 0.13 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1rxc h ARG 250 CO -0.16 0.04 0.00 0.54 -1.51 0.00 0.00 179.97 178.88 1rxc n ARG 251 N -5.30 0.20 -0.02 0.20 1.74 -0.64 -3.32 116.66 109.52 1rxc n ARG 251 Ca 0.06 0.12 0.03 0.00 -0.77 0.00 0.00 57.85 57.30 1rxc n ARG 251 Cb 0.30 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.28 1rxc n ARG 251 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1rxc n LEU 252 N -1.34 1.77 0.00 0.55 4.77 -0.63 -5.03 117.00 117.08 1rxc n LEU 252 Ca 0.08 -1.21 0.10 0.00 -0.03 0.00 0.00 56.01 54.95 1rxc n LEU 252 Cb 0.17 -0.03 0.59 0.00 -2.33 0.00 0.00 43.42 41.82 1rxc n LEU 252 CO 0.15 0.39 0.78 0.18 -1.33 0.00 0.00 177.39 177.56