#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rxc h ASP 5 N 0.00 0.00 -4.19 4.04 3.32 -1.81 -3.46 116.42 114.33 1rxc h ASP 5 Ca 0.00 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.62 1rxc h ASP 5 Cb 0.00 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 39.27 1rxc h ASP 5 CO 0.00 0.47 -0.79 0.68 -1.72 0.00 0.00 179.24 177.88 1rxc s VAL 6 N -3.22 0.94 0.12 -1.35 -7.23 -1.13 -5.05 120.40 103.47 1rxc s VAL 6 Ca 0.02 -0.63 -0.13 0.00 -1.81 0.00 0.00 61.98 59.44 1rxc s VAL 6 Cb 0.09 -0.81 -0.09 0.00 0.56 0.00 0.00 36.38 36.13 1rxc s VAL 6 CO 0.72 0.18 1.40 0.15 -0.31 0.00 0.00 175.10 177.24 1rxc h PHE 7 N 5.60 1.03 0.02 2.82 -0.00 -1.92 -3.16 116.94 121.33 1rxc h PHE 7 Ca -0.34 -0.36 -0.37 0.00 -0.00 0.00 0.00 57.97 56.90 1rxc h PHE 7 Cb 1.17 -0.20 -0.05 0.00 -0.00 0.00 0.00 35.95 36.87 1rxc h PHE 7 CO 0.44 1.17 -2.11 0.72 -0.00 0.00 0.00 178.31 178.53 1rxc n HIS 8 N -4.08 0.49 0.26 0.41 8.25 -1.26 -4.48 115.22 114.80 1rxc n HIS 8 Ca -0.04 0.16 0.14 0.00 -0.26 0.00 0.00 57.72 57.72 1rxc n HIS 8 Cb 0.59 -1.06 0.36 0.00 1.12 0.00 0.00 29.99 31.00 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 -0.58 0.00 -0.64 2.41 3.38 -1.92 -3.44 115.31 114.52 1rxc h LEU 9 Ca -0.54 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.17 1rxc h LEU 9 Cb 1.68 0.00 0.08 0.00 0.09 0.00 0.00 40.66 42.51 1rxc h LEU 9 CO -0.20 0.00 -0.43 0.61 0.09 0.00 0.00 178.44 178.50 1rxc n GLY 10 N 0.72 -0.04 3.43 0.83 0.00 -1.19 -4.73 105.19 104.21 1rxc n GLY 10 Ca 0.03 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 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 -5.00 2.49 0.36 0.99 1.43 -1.26 -4.88 118.68 112.81 1rxc s LEU 11 Ca 0.35 -0.93 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 1rxc s LEU 11 Cb -0.15 -1.10 -0.05 0.00 0.03 0.00 0.00 46.19 44.92 1rxc s LEU 11 CO 0.43 0.07 0.13 0.42 0.23 0.00 0.00 176.35 177.63 1rxc s THR 12 N -2.04 2.78 0.33 5.49 -4.23 -1.26 -2.14 115.64 114.58 1rxc s THR 12 Ca 0.24 -1.74 0.03 0.00 -1.18 0.00 0.00 61.69 59.03 1rxc s THR 12 Cb -0.06 -2.94 0.29 0.00 1.34 0.00 0.00 72.50 71.12 1rxc s THR 12 CO 0.11 -0.14 1.93 0.50 -0.54 0.00 0.00 174.62 176.48 1rxc h LYS 13 N 1.56 0.88 0.00 3.99 3.64 -1.97 -2.56 116.57 122.11 1rxc h LYS 13 Ca -0.43 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 58.80 1rxc h LYS 13 Cb 1.25 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1rxc h LYS 13 CO 0.65 0.58 -0.43 -0.97 -2.27 0.00 0.00 179.45 177.01 1rxc h ASN 14 N 0.90 0.00 -0.67 4.20 -0.73 -1.96 -2.53 115.58 114.79 1rxc h ASN 14 Ca 0.35 0.00 0.11 0.00 1.87 0.00 0.00 56.30 58.64 1rxc h ASN 14 Cb 0.23 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.77 1rxc h ASN 14 CO -0.13 0.43 0.45 0.44 -0.37 0.00 0.00 177.43 178.26 1rxc h ASP 15 N 0.00 0.42 1.35 1.15 3.32 -1.87 -2.05 116.42 118.74 1rxc h ASP 15 Ca -0.00 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1rxc h ASP 15 Cb 0.86 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 1rxc h ASP 15 CO 0.06 0.24 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.60 1rxc h LEU 16 N 0.46 0.00 -0.21 1.55 4.07 -1.55 -3.48 115.31 116.15 1rxc h LEU 16 Ca 0.32 0.00 -0.43 0.00 0.08 0.00 0.00 57.88 57.85 1rxc h LEU 16 Cb 0.61 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 1rxc h LEU 16 CO -0.10 0.15 -0.67 0.00 -1.08 0.00 0.00 178.44 176.74 1rxc n GLN 17 N -3.21 -5.24 -0.62 1.13 6.02 -0.77 -1.86 117.38 112.84 1rxc n GLN 17 Ca 0.02 0.66 0.00 0.00 -0.01 0.00 0.00 57.00 57.67 1rxc n GLN 17 Cb 0.48 -5.53 0.00 0.00 1.02 0.00 0.00 30.24 26.21 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 -1.58 0.78 3.78 1.08 0.00 -1.26 -4.81 105.19 103.16 1rxc n GLY 18 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.88 3.55 0.00 4.61 0.00 -0.78 -4.95 121.76 121.32 1rxc s ALA 19 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.46 1rxc s ALA 19 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1rxc s ALA 19 CO 0.00 -0.96 0.48 0.25 0.00 0.00 0.00 175.76 175.53 1rxc n THR 20 N 0.53 0.06 -5.18 0.00 -2.24 -1.26 -4.31 114.28 101.88 1rxc n THR 20 Ca 0.01 -0.48 -0.30 0.00 -2.27 0.00 0.00 64.05 61.01 1rxc n THR 20 Cb 0.40 1.07 -0.16 0.00 -2.10 0.00 0.00 70.33 69.54 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 -0.06 2.04 -0.03 3.22 0.20 -1.26 -1.07 118.68 121.71 1rxc s LEU 21 Ca 0.00 -0.46 0.03 0.00 0.69 0.00 0.00 54.13 54.39 1rxc s LEU 21 Cb 0.00 -1.26 0.00 0.00 -0.43 0.00 0.00 46.19 44.50 1rxc s LEU 21 CO 0.00 0.25 -0.12 0.00 -0.29 0.00 0.00 176.35 176.19 1rxc s ALA 22 N -0.27 1.08 -0.20 5.97 0.00 0.03 -2.11 121.76 126.25 1rxc s ALA 22 Ca 0.01 -0.44 -0.14 0.00 0.00 0.00 0.00 51.96 51.39 1rxc s ALA 22 Cb -0.12 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 1rxc s ALA 22 CO 0.02 0.18 0.33 0.42 0.00 0.00 0.00 175.76 176.71 1rxc s ILE 23 N 0.18 5.25 -0.53 0.00 1.01 -0.48 -1.41 121.20 125.22 1rxc s ILE 23 Ca -0.04 0.57 0.04 0.00 0.00 0.00 0.00 60.65 61.22 1rxc s ILE 23 Cb -0.10 -3.67 0.13 0.00 0.01 0.00 0.00 42.46 38.84 1rxc s ILE 23 CO 0.01 0.29 0.28 0.68 0.00 0.00 0.00 174.94 176.20 1rxc s VAL 24 N 1.13 2.48 0.96 2.92 -7.23 -0.14 -1.58 120.40 118.95 1rxc s VAL 24 Ca 0.16 -3.34 -0.12 0.00 -1.81 0.00 0.00 61.98 56.87 1rxc s VAL 24 Cb -0.14 -2.72 0.17 0.00 0.56 0.00 0.00 36.38 34.25 1rxc s VAL 24 CO 0.07 -0.83 1.10 -2.16 -0.31 0.00 0.00 175.10 172.96 1rxc s PRO 25 N -0.34 0.74 -0.06 4.82 0.04 -1.24 -3.12 135.00 135.84 1rxc s PRO 25 Ca 0.18 0.52 -0.11 0.00 0.04 0.00 0.00 61.00 61.64 1rxc s PRO 25 Cb -0.24 -1.77 -0.30 0.00 0.04 0.00 0.00 34.50 32.23 1rxc s PRO 25 CO -0.02 -2.52 0.62 0.78 0.04 0.00 0.00 177.00 175.91 1rxc h GLY 26 N -1.74 0.44 -6.65 0.56 0.00 -1.84 -1.43 103.07 92.41 1rxc h GLY 26 Ca -0.53 -1.12 -0.61 0.00 0.00 0.00 0.00 47.33 45.07 1rxc h GLY 26 CO 0.58 0.98 0.08 -0.35 0.00 0.00 0.00 176.54 177.83 1rxc s ASP 27 N -7.27 6.50 0.46 0.19 3.68 -1.26 -1.64 116.67 117.33 1rxc s ASP 27 Ca -0.17 0.59 0.20 0.00 2.13 0.00 0.00 52.55 55.30 1rxc s ASP 27 Cb 0.06 -2.31 1.19 0.00 -1.45 0.00 0.00 42.92 40.41 1rxc s ASP 27 CO 0.84 -0.34 1.93 1.55 0.13 0.00 0.00 175.17 179.28 1rxc h PRO 28 N 7.98 0.26 0.00 4.34 0.13 -1.90 -1.30 132.00 141.51 1rxc h PRO 28 Ca -0.28 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1rxc h PRO 28 Cb 1.13 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1rxc h PRO 28 CO 0.75 0.17 0.00 -0.44 -0.23 0.00 0.00 178.00 178.25 1rxc h ASP 29 N 0.26 0.00 0.60 1.44 3.32 -1.95 -2.95 116.42 117.14 1rxc h ASP 29 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1rxc h ASP 29 Cb 1.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1rxc h ASP 29 CO -0.08 0.00 -0.13 -1.14 -1.72 0.00 0.00 179.24 176.16 1rxc n ARG 30 N -2.59 0.33 -0.02 3.56 0.63 -0.49 -4.32 116.66 113.75 1rxc n ARG 30 Ca 0.03 -0.09 -0.13 0.00 -0.92 0.00 0.00 57.85 56.73 1rxc n ARG 30 Cb 0.34 -1.50 -0.10 0.00 0.45 0.00 0.00 32.46 31.66 1rxc n ARG 30 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1rxc h VAL 31 N 0.23 1.43 -1.00 5.15 2.07 -1.60 -2.68 116.25 119.85 1rxc h VAL 31 Ca 0.00 -1.31 0.06 0.00 0.82 0.00 0.00 66.70 66.27 1rxc h VAL 31 Cb 0.41 2.26 -0.06 0.00 -1.52 0.00 0.00 31.29 32.38 1rxc h VAL 31 CO 0.00 0.35 0.65 -0.08 0.02 0.00 0.00 177.57 178.51 1rxc h GLU 32 N -0.46 1.16 -0.92 1.57 4.81 -1.79 -2.06 114.58 116.90 1rxc h GLU 32 Ca 0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1rxc h GLU 32 Cb 0.58 -0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 1rxc h GLU 32 CO 0.01 0.77 0.58 0.87 -0.73 0.00 0.00 179.01 180.51 1rxc h LYS 33 N 1.20 1.23 -0.09 1.92 6.56 -1.74 -1.55 116.57 124.10 1rxc h LYS 33 Ca 0.42 -0.09 -0.23 0.00 -1.06 0.00 0.00 60.65 59.69 1rxc h LYS 33 Cb 0.12 -0.27 0.01 0.00 -0.57 0.00 0.00 32.23 31.52 1rxc h LYS 33 CO -0.16 0.84 -0.85 0.82 -2.06 0.00 0.00 179.45 178.04 1rxc h ILE 34 N 1.25 1.31 -0.39 1.86 2.04 -1.19 -3.16 117.51 119.23 1rxc h ILE 34 Ca 0.33 -2.12 -0.02 0.00 1.00 0.00 0.00 64.86 64.06 1rxc h ILE 34 Cb -0.09 2.14 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1rxc h ILE 34 CO -0.07 0.66 0.16 0.00 0.00 0.00 0.00 178.15 178.90 1rxc h ALA 35 N 0.61 1.55 0.00 1.87 0.00 -1.12 -2.83 119.26 119.33 1rxc h ALA 35 Ca -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1rxc h ALA 35 Cb 1.48 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1rxc h ALA 35 CO 0.17 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.77 1rxc h ALA 36 N 1.63 1.00 0.00 0.00 0.00 -1.25 -1.23 119.26 119.41 1rxc h ALA 36 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1rxc h ALA 36 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1rxc h ALA 36 CO -0.01 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1rxc n LEU 37 N -2.45 0.55 0.00 0.00 4.77 -1.07 -4.86 117.00 113.95 1rxc n LEU 37 Ca 0.03 0.59 -0.08 0.00 -0.03 0.00 0.00 56.01 56.52 1rxc n LEU 37 Cb 0.33 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1rxc n LEU 37 CO 0.26 -0.29 0.04 0.23 -1.33 0.00 0.00 177.39 176.30 1rxc n MET 38 N -2.06 1.15 -3.96 3.23 2.81 -0.46 -5.13 117.12 112.70 1rxc n MET 38 Ca 0.04 -1.12 -0.28 0.00 -1.81 0.00 0.00 57.70 54.54 1rxc n MET 38 Cb 0.32 0.08 -0.04 0.00 -0.71 0.00 0.00 33.22 32.87 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 -2.10 6.20 -1.29 7.83 -0.00 -0.22 -4.67 116.67 122.41 1rxc s ASP 39 Ca 0.12 0.15 -0.14 0.00 -0.00 0.00 0.00 52.55 52.69 1rxc s ASP 39 Cb -0.01 -1.84 0.01 0.00 -0.00 0.00 0.00 42.92 41.07 1rxc s ASP 39 CO 0.08 0.10 0.55 0.29 -0.00 0.00 0.00 175.17 176.19 1rxc n LYS 40 N -0.21 -1.80 -2.51 8.23 5.02 -1.26 -0.54 118.16 125.08 1rxc n LYS 40 Ca -0.07 0.33 -0.42 0.00 -2.02 0.00 0.00 58.31 56.13 1rxc n LYS 40 Cb 0.53 -3.93 -0.03 0.00 -0.02 0.00 0.00 35.03 31.58 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 -6.60 4.43 -0.03 1.97 0.04 -1.26 -4.51 135.00 129.03 1rxc s PRO 41 Ca 0.25 1.65 0.03 0.00 0.04 0.00 0.00 61.00 62.97 1rxc s PRO 41 Cb -0.11 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 30.98 1rxc s PRO 41 CO 0.91 -0.29 -0.11 0.08 0.04 0.00 0.00 177.00 177.63 1rxc s VAL 42 N 1.50 0.92 -0.01 -0.36 1.01 -0.52 -5.01 120.40 117.94 1rxc s VAL 42 Ca 0.56 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 1rxc s VAL 42 Cb -0.26 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 1rxc s VAL 42 CO 0.26 0.29 1.30 -0.75 0.00 0.00 0.00 175.10 176.19 1rxc s LYS 43 N 0.25 4.33 -0.20 2.72 2.20 -1.26 -1.70 119.74 126.09 1rxc s LYS 43 Ca -0.05 1.83 -0.16 0.00 -0.36 0.00 0.00 55.97 57.24 1rxc s LYS 43 Cb -0.10 -3.52 -0.10 0.00 -1.51 0.00 0.00 37.83 32.60 1rxc s LYS 43 CO 0.01 -0.47 -0.13 1.28 -0.36 0.00 0.00 175.35 175.68 1rxc n LEU 44 N 5.03 1.88 -3.52 5.43 4.77 -0.34 -4.95 117.00 125.29 1rxc n LEU 44 Ca 0.12 0.45 -0.11 0.00 -0.03 0.00 0.00 56.01 56.44 1rxc n LEU 44 Cb 0.45 -0.87 -0.02 0.00 -2.33 0.00 0.00 43.42 40.65 1rxc n LEU 44 CO 0.57 0.02 0.39 0.00 -1.33 0.00 0.00 177.39 177.04 1rxc s ALA 45 N -2.60 -1.47 -0.26 -1.18 0.00 -1.08 -5.01 121.76 110.16 1rxc s ALA 45 Ca -0.27 0.29 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 1rxc s ALA 45 Cb 0.06 0.87 0.12 0.00 0.00 0.00 0.00 23.12 24.18 1rxc s ALA 45 CO 0.43 -0.81 0.28 0.45 0.00 0.00 0.00 175.76 176.11 1rxc s SER 46 N -2.79 1.50 -0.04 0.00 0.15 -1.26 -1.22 113.70 110.05 1rxc s SER 46 Ca 0.03 -0.53 0.01 0.00 0.70 0.00 0.00 55.95 56.16 1rxc s SER 46 Cb -0.02 0.51 0.02 0.00 -1.71 0.00 0.00 66.02 64.82 1rxc s SER 46 CO -0.09 -0.37 -0.06 -1.00 1.20 0.00 0.00 173.24 172.93 1rxc s HIS 47 N 2.36 0.77 0.00 3.44 3.76 -0.78 -5.01 115.29 119.83 1rxc s HIS 47 Ca 0.09 -0.20 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 1rxc s HIS 47 Cb -0.15 -0.63 0.00 0.00 1.11 0.00 0.00 32.58 32.91 1rxc s HIS 47 CO -0.26 -0.15 0.00 0.54 -0.85 0.00 0.00 174.74 174.02 1rxc n ARG 48 N 3.76 0.00 -0.14 1.40 1.74 -1.26 -0.77 116.66 121.38 1rxc n ARG 48 Ca -0.23 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 56.93 1rxc n ARG 48 Cb 0.52 0.00 0.26 0.00 -1.02 0.00 0.00 32.46 32.23 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 1.81 -3.39 5.56 0.00 -1.26 -4.76 120.64 132.61 1rxc n GLU 49 Ca 0.00 -1.25 -0.44 0.00 0.00 0.00 0.00 57.16 55.47 1rxc n GLU 49 Cb 0.00 -1.34 -0.06 0.00 0.00 0.00 0.00 31.44 30.04 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 3.32 -0.23 -1.84 0.08 0.05 -3.92 117.98 113.81 1rxc s PHE 50 Ca 0.29 -1.50 -0.06 0.00 0.12 0.00 0.00 56.93 55.78 1rxc s PHE 50 Cb 0.15 -3.71 -0.02 0.00 -0.57 0.00 0.00 43.02 38.87 1rxc s PHE 50 CO 0.22 -1.01 0.03 0.99 -0.10 0.00 0.00 175.22 175.34 1rxc s THR 51 N 1.47 4.03 -0.13 0.64 2.01 -1.26 -1.87 115.64 120.53 1rxc s THR 51 Ca 0.04 -0.27 0.01 0.00 0.31 0.00 0.00 61.69 61.78 1rxc s THR 51 Cb -0.28 -2.86 -0.01 0.00 0.01 0.00 0.00 72.50 69.36 1rxc s THR 51 CO 0.01 0.39 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.27 1rxc s THR 52 N 1.36 2.68 0.29 -0.82 2.01 -0.36 -1.86 115.64 118.94 1rxc s THR 52 Ca 0.05 -0.79 0.11 0.00 0.31 0.00 0.00 61.69 61.37 1rxc s THR 52 Cb -0.15 -2.10 -0.05 0.00 0.01 0.00 0.00 72.50 70.21 1rxc s THR 52 CO 0.02 0.53 -0.16 0.26 -0.69 0.00 0.00 174.62 174.58 1rxc s TRP 53 N 0.44 2.36 -0.03 4.92 0.52 0.80 -1.20 118.94 126.75 1rxc s TRP 53 Ca -0.12 -0.34 0.07 0.00 0.02 0.00 0.00 56.10 55.73 1rxc s TRP 53 Cb -0.16 -1.08 -0.02 0.00 -1.15 0.00 0.00 33.47 31.06 1rxc s TRP 53 CO 0.06 0.68 -0.24 0.50 0.02 0.00 0.00 176.95 177.97 1rxc s ARG 54 N -3.55 2.12 0.00 4.98 3.52 -0.69 -0.68 118.95 124.66 1rxc s ARG 54 Ca 0.31 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 55.04 1rxc s ARG 54 Cb -0.04 -1.96 0.00 0.00 -1.56 0.00 0.00 34.95 31.39 1rxc s ARG 54 CO 0.16 0.47 0.00 0.00 -0.81 0.00 0.00 175.30 175.12 1rxc n ALA 55 N 2.64 0.00 -2.71 6.12 0.00 -0.07 -1.43 120.51 125.05 1rxc n ALA 55 Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.10 1rxc n ALA 55 Cb 0.52 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.83 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 -1.61 0.76 -0.08 0.00 2.02 0.30 -1.03 118.70 119.06 1rxc s GLU 56 Ca 0.00 -0.62 -0.03 0.00 0.02 0.00 0.00 54.97 54.34 1rxc s GLU 56 Cb 0.00 -0.71 0.04 0.00 0.10 0.00 0.00 34.13 33.56 1rxc s GLU 56 CO 0.00 0.18 0.08 -1.17 0.02 0.00 0.00 175.26 174.37 1rxc s LEU 57 N -0.96 0.16 -1.52 1.80 2.96 0.10 -1.06 118.68 120.15 1rxc s LEU 57 Ca -0.00 -0.07 -0.11 0.00 -0.22 0.00 0.00 54.13 53.72 1rxc s LEU 57 Cb -0.07 -0.10 0.08 0.00 0.50 0.00 0.00 46.19 46.60 1rxc s LEU 57 CO 0.01 -0.28 0.83 0.47 -1.32 0.00 0.00 176.35 176.06 1rxc n ASP 58 N 5.30 -3.35 0.00 3.68 8.00 -1.26 -1.39 116.55 127.52 1rxc n ASP 58 Ca -0.04 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.59 1rxc n ASP 58 Cb 0.50 -3.55 0.00 0.00 -0.02 0.00 0.00 41.12 38.05 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 -1.65 0.43 3.52 0.44 0.00 -1.26 -5.00 105.19 101.66 1rxc n GLY 59 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.55 2.46 0.21 1.61 1.02 -0.49 -5.08 119.74 118.93 1rxc s LYS 60 Ca 0.00 -0.74 -0.30 0.00 0.02 0.00 0.00 55.97 54.95 1rxc s LYS 60 Cb 0.00 -2.40 -0.08 0.00 -0.52 0.00 0.00 37.83 34.82 1rxc s LYS 60 CO 0.00 0.61 1.09 -1.25 -0.92 0.00 0.00 175.35 174.87 1rxc s PRO 61 N -1.08 4.63 0.04 -1.68 0.04 -1.26 -0.73 135.00 134.96 1rxc s PRO 61 Ca 0.14 1.73 0.02 0.00 0.04 0.00 0.00 61.00 62.93 1rxc s PRO 61 Cb -0.11 -3.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1rxc s PRO 61 CO 0.04 0.15 -0.08 0.08 0.04 0.00 0.00 177.00 177.23 1rxc s VAL 62 N -0.59 0.55 0.01 -0.36 1.01 -0.19 -4.38 120.40 116.44 1rxc s VAL 62 Ca 0.47 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1rxc s VAL 62 Cb -0.30 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1rxc s VAL 62 CO 0.36 -0.32 0.04 -0.63 0.00 0.00 0.00 175.10 174.56 1rxc s ILE 63 N -1.24 4.44 -0.12 2.22 -1.09 -0.90 -0.90 121.20 123.61 1rxc s ILE 63 Ca -0.08 -0.55 0.01 0.00 -2.23 0.00 0.00 60.65 57.80 1rxc s ILE 63 Cb -0.09 -3.02 0.02 0.00 -1.58 0.00 0.00 42.46 37.78 1rxc s ILE 63 CO 0.00 0.33 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.21 1rxc s VAL 64 N -1.17 1.49 -0.07 2.92 1.01 0.15 -1.38 120.40 123.35 1rxc s VAL 64 Ca 0.22 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1rxc s VAL 64 Cb -0.12 -1.38 0.04 0.00 0.00 0.00 0.00 36.38 34.92 1rxc s VAL 64 CO 0.13 0.44 0.13 0.00 0.00 0.00 0.00 175.10 175.80 1rxc s SER 66 N 1.86 6.90 -0.01 0.00 1.04 -0.78 -3.72 113.70 118.99 1rxc s SER 66 Ca -0.01 1.91 0.19 0.00 0.48 0.00 0.00 55.95 58.52 1rxc s SER 66 Cb -0.12 -2.57 -0.24 0.00 0.10 0.00 0.00 66.02 63.18 1rxc s SER 66 CO -0.05 -0.39 0.63 0.35 0.98 0.00 0.00 173.24 174.76 1rxc n THR 67 N -0.10 0.00 -1.83 2.02 -2.24 -0.54 -4.35 114.28 107.23 1rxc n THR 67 Ca 0.05 -0.23 0.10 0.00 -2.27 0.00 0.00 64.05 61.70 1rxc n THR 67 Cb 0.51 0.59 -0.02 0.00 -2.10 0.00 0.00 70.33 69.30 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 1.43 -1.87 3.70 3.38 0.00 -0.65 -3.26 105.19 107.92 1rxc n GLY 68 Ca 0.00 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.36 4.91 0.00 -0.61 1.01 -1.26 -4.69 121.20 119.21 1rxc s ILE 69 Ca 0.00 1.80 0.00 0.00 0.00 0.00 0.00 60.65 62.45 1rxc s ILE 69 Cb 0.00 -4.21 0.00 0.00 0.01 0.00 0.00 42.46 38.26 1rxc s ILE 69 CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.69 1rxc n GLY 70 N 3.08 2.95 0.36 6.18 0.00 -1.26 -4.68 105.19 111.83 1rxc n GLY 70 Ca 0.04 -1.75 0.06 0.00 0.00 0.00 0.00 46.02 44.37 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 1.26 0.73 -0.02 0.00 -1.87 -2.33 103.07 100.84 1rxc h GLY 71 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1rxc h GLY 71 CO 0.00 0.24 -0.40 -2.55 0.00 0.00 0.00 176.54 173.83 1rxc h PRO 72 N 0.91 -0.88 -0.13 4.80 0.11 -1.94 0.93 132.00 135.80 1rxc h PRO 72 Ca 0.40 0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.47 1rxc h PRO 72 Cb 0.33 0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 1rxc h PRO 72 CO -0.16 -0.58 -0.35 0.66 -0.21 0.00 0.00 178.00 177.35 1rxc h SER 73 N -0.91 0.28 -0.69 -2.05 4.64 -1.80 -2.59 113.55 110.44 1rxc h SER 73 Ca -0.06 -0.11 0.05 0.00 -0.47 0.00 0.00 61.79 61.20 1rxc h SER 73 Cb 0.77 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 62.73 1rxc h SER 73 CO 0.02 0.62 0.41 0.74 -0.87 0.00 0.00 176.83 177.75 1rxc h THR 74 N 0.24 1.03 -0.45 2.95 2.02 -1.31 -1.73 112.91 115.67 1rxc h THR 74 Ca 0.03 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 1rxc h THR 74 Cb 0.74 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 1rxc h THR 74 CO 0.06 0.14 0.27 0.77 0.37 0.00 0.00 175.52 177.13 1rxc h SER 75 N 0.78 0.53 0.11 4.18 4.64 -0.43 -1.75 113.55 121.60 1rxc h SER 75 Ca 0.30 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 1rxc h SER 75 Cb 0.11 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1rxc h SER 75 CO -0.15 0.41 -0.05 0.40 -0.87 0.00 0.00 176.83 176.57 1rxc h ILE 76 N 0.61 1.10 -0.17 0.95 2.04 -1.07 -2.39 117.51 118.57 1rxc h ILE 76 Ca 0.16 -0.89 0.05 0.00 1.00 0.00 0.00 64.86 65.17 1rxc h ILE 76 Cb -0.02 1.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.67 1rxc h ILE 76 CO -0.03 0.21 -0.14 0.00 0.00 0.00 0.00 178.15 178.20 1rxc h ALA 77 N 0.25 -0.01 -0.19 1.87 0.00 -1.13 -1.64 119.26 118.42 1rxc h ALA 77 Ca -0.01 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1rxc h ALA 77 Cb 0.46 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1rxc h ALA 77 CO 0.02 -0.57 0.06 0.28 0.00 0.00 0.00 179.25 179.04 1rxc h VAL 78 N -0.14 1.19 -0.61 0.00 2.07 -1.40 -0.71 116.25 116.65 1rxc h VAL 78 Ca 0.11 -0.61 0.07 0.00 0.82 0.00 0.00 66.70 67.08 1rxc h VAL 78 Cb 0.30 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 1rxc h VAL 78 CO -0.26 0.19 0.30 -0.08 0.02 0.00 0.00 177.57 177.74 1rxc h GLU 79 N 0.13 0.53 0.09 1.57 4.57 -1.28 -0.27 114.58 119.93 1rxc h GLU 79 Ca 0.06 -0.03 -0.26 0.00 -1.18 0.00 0.00 59.36 57.94 1rxc h GLU 79 Cb 0.24 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 28.72 1rxc h GLU 79 CO -0.00 0.35 -1.16 0.93 -1.18 0.00 0.00 179.01 177.95 1rxc h GLU 80 N 0.55 0.37 -0.87 1.92 5.08 -1.10 -1.68 114.58 118.85 1rxc h GLU 80 Ca 0.29 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1rxc h GLU 80 Cb 0.25 0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 1rxc h GLU 80 CO -0.22 1.21 0.55 -0.07 -1.00 0.00 0.00 179.01 179.49 1rxc h LEU 81 N 0.15 1.02 -0.85 1.33 3.38 -1.05 -2.40 115.31 116.89 1rxc h LEU 81 Ca -0.13 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1rxc h LEU 81 Cb 1.85 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 42.32 1rxc h LEU 81 CO 0.20 0.76 0.06 0.00 0.09 0.00 0.00 178.44 179.55 1rxc h ALA 82 N 1.42 1.05 -0.89 1.53 0.00 -0.72 -1.13 119.26 120.52 1rxc h ALA 82 Ca 0.32 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1rxc h ALA 82 Cb -0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.43 1rxc h ALA 82 CO -0.06 0.60 0.53 1.96 0.00 0.00 0.00 179.25 182.28 1rxc h GLN 83 N 0.86 1.21 0.00 0.00 4.20 -0.99 -2.51 115.11 117.88 1rxc h GLN 83 Ca 0.17 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1rxc h GLN 83 Cb 0.42 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1rxc h GLN 83 CO 0.01 0.85 0.00 1.28 -0.67 0.00 0.00 178.83 180.31 1rxc n LEU 84 N -4.40 0.00 0.00 1.46 4.32 -0.86 -4.91 117.00 112.62 1rxc n LEU 84 Ca 0.09 0.42 0.00 0.00 -0.02 0.00 0.00 56.01 56.51 1rxc n LEU 84 Cb 0.06 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.44 1rxc n LEU 84 CO 0.38 -0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.13 1rxc n GLY 85 N 1.24 0.82 3.72 -0.72 0.00 -0.52 -4.80 105.19 104.94 1rxc n GLY 85 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.79 3.78 0.00 -0.61 -1.09 -0.67 -4.55 121.20 116.28 1rxc s ILE 86 Ca 0.00 1.36 0.00 0.00 -2.23 0.00 0.00 60.65 59.78 1rxc s ILE 86 Cb 0.00 -3.87 0.00 0.00 -1.58 0.00 0.00 42.46 37.01 1rxc s ILE 86 CO 0.00 0.15 0.12 0.54 -1.23 0.00 0.00 174.94 174.52 1rxc n ARG 87 N 3.40 4.59 -4.06 2.79 5.12 -0.23 -4.22 116.66 124.05 1rxc n ARG 87 Ca 0.07 -0.12 -0.21 0.00 -1.93 0.00 0.00 57.85 55.66 1rxc n ARG 87 Cb 0.45 -0.60 -0.17 0.00 -1.16 0.00 0.00 32.46 30.99 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 -0.69 0.55 -0.06 0.55 2.01 -0.66 -1.33 115.64 116.01 1rxc s THR 88 Ca 0.00 -0.09 0.04 0.00 0.31 0.00 0.00 61.69 61.95 1rxc s THR 88 Cb 0.00 -0.61 0.00 0.00 0.01 0.00 0.00 72.50 71.90 1rxc s THR 88 CO 0.00 0.25 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.64 1rxc s PHE 89 N 1.24 1.88 -0.27 4.92 0.08 -0.02 -0.79 117.98 125.01 1rxc s PHE 89 Ca -0.06 -0.64 0.02 0.00 0.12 0.00 0.00 56.93 56.37 1rxc s PHE 89 Cb -0.14 -1.28 0.07 0.00 -0.57 0.00 0.00 43.02 41.10 1rxc s PHE 89 CO -0.02 -0.25 -0.06 -0.51 -0.10 0.00 0.00 175.22 174.27 1rxc s LEU 90 N 0.26 3.39 0.05 -0.37 1.43 -0.50 -1.31 118.68 121.63 1rxc s LEU 90 Ca -0.10 -1.47 -0.28 0.00 -1.03 0.00 0.00 54.13 51.25 1rxc s LEU 90 Cb -0.14 -1.45 -0.05 0.00 0.03 0.00 0.00 46.19 44.58 1rxc s LEU 90 CO 0.04 -0.24 0.91 -0.60 0.23 0.00 0.00 176.35 176.69 1rxc s ARG 91 N 1.16 4.60 -0.15 1.70 3.52 -0.51 -0.97 118.95 128.30 1rxc s ARG 91 Ca -0.05 1.32 0.01 0.00 -0.13 0.00 0.00 55.73 56.89 1rxc s ARG 91 Cb -0.19 -3.40 0.01 0.00 -1.56 0.00 0.00 34.95 29.80 1rxc s ARG 91 CO -0.06 0.14 -0.19 -1.50 -0.81 0.00 0.00 175.30 172.87 1rxc s ILE 92 N 0.36 2.29 0.25 4.11 -1.16 -1.18 -1.72 121.20 124.15 1rxc s ILE 92 Ca 0.46 -0.90 0.04 0.00 -0.51 0.00 0.00 60.65 59.75 1rxc s ILE 92 Cb -0.22 -1.94 -0.02 0.00 0.61 0.00 0.00 42.46 40.90 1rxc s ILE 92 CO 0.27 0.53 0.16 0.61 -2.81 0.00 0.00 174.94 173.71 1rxc n GLY 93 N 4.13 3.34 3.63 1.50 0.00 -0.81 -3.86 105.19 113.12 1rxc n GLY 93 Ca -0.20 -1.90 -0.23 0.00 0.00 0.00 0.00 46.02 43.69 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 -2.82 3.18 0.05 2.61 -4.23 -1.26 -1.37 115.64 111.80 1rxc s THR 94 Ca 0.23 -1.96 -0.27 0.00 -1.18 0.00 0.00 61.69 58.51 1rxc s THR 94 Cb 0.01 -2.79 0.07 0.00 1.34 0.00 0.00 72.50 71.14 1rxc s THR 94 CO 0.16 -0.34 0.66 0.28 -0.54 0.00 0.00 174.62 174.85 1rxc s THR 95 N -2.38 0.00 -0.20 3.99 -1.32 -0.68 -4.82 115.64 110.23 1rxc s THR 95 Ca 0.32 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.73 1rxc s THR 95 Cb -0.05 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.90 1rxc s THR 95 CO 0.19 0.00 0.07 -0.83 -2.21 0.00 0.00 174.62 171.85 1rxc s GLY 96 N -2.00 1.88 0.32 6.08 0.00 -1.10 -1.30 107.32 111.21 1rxc s GLY 96 Ca -0.04 -0.84 -0.26 0.00 0.00 0.00 0.00 44.72 43.58 1rxc s GLY 96 CO -0.02 0.18 0.94 0.00 0.00 0.00 0.00 173.10 174.21 1rxc s ALA 97 N 0.69 3.21 -0.45 3.20 0.00 0.00 -1.24 121.76 127.17 1rxc s ALA 97 Ca 0.04 0.52 0.07 0.00 0.00 0.00 0.00 51.96 52.59 1rxc s ALA 97 Cb -0.13 -3.18 0.18 0.00 0.00 0.00 0.00 23.12 19.99 1rxc s ALA 97 CO 0.02 0.17 1.15 0.44 0.00 0.00 0.00 175.76 177.54 1rxc n ILE 98 N 0.55 1.10 -4.95 0.00 -5.35 -0.11 -0.29 119.36 110.30 1rxc n ILE 98 Ca 0.02 -1.09 -0.32 0.00 -0.27 0.00 0.00 62.75 61.08 1rxc n ILE 98 Cb 0.50 0.43 -0.14 0.00 -1.74 0.00 0.00 39.64 38.70 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 -1.16 2.38 0.51 6.28 -1.52 -1.25 -4.72 119.66 120.18 1rxc s GLN 99 Ca 0.14 -0.77 0.30 0.00 -1.95 0.00 0.00 55.36 53.08 1rxc s GLN 99 Cb 0.08 -2.29 1.02 0.00 -0.22 0.00 0.00 33.01 31.60 1rxc s GLN 99 CO 0.08 0.60 1.86 -1.00 -0.25 0.00 0.00 175.29 176.58 1rxc h PRO 100 N 5.28 0.00 -0.00 2.91 0.13 -1.96 -2.82 132.00 135.54 1rxc h PRO 100 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1rxc h PRO 100 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1rxc h PRO 100 CO 0.49 0.03 -0.03 -2.39 -0.23 0.00 0.00 178.00 175.87 1rxc n HIS 101 N -3.12 0.00 -3.39 1.56 1.44 -1.26 -4.80 115.22 105.65 1rxc n HIS 101 Ca 0.02 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.35 1rxc n HIS 101 Cb 0.39 -0.38 -0.06 0.00 0.12 0.00 0.00 29.99 30.05 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 -2.79 5.17 0.20 0.61 1.01 -1.06 -5.08 121.20 119.26 1rxc s ILE 102 Ca 0.21 0.86 0.06 0.00 0.00 0.00 0.00 60.65 61.78 1rxc s ILE 102 Cb 0.20 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1rxc s ILE 102 CO 0.50 0.39 0.15 0.20 0.00 0.00 0.00 174.94 176.18 1rxc s ASN 103 N 0.22 5.44 0.30 3.58 0.01 -1.26 -4.93 114.94 118.30 1rxc s ASN 103 Ca 0.24 -0.21 -0.29 0.00 -0.71 0.00 0.00 52.86 51.88 1rxc s ASN 103 Cb -0.15 -1.38 -0.11 0.00 0.41 0.00 0.00 41.25 40.03 1rxc s ASN 103 CO 0.10 0.03 1.46 -0.69 -1.51 0.00 0.00 177.10 176.48 1rxc s VAL 104 N -1.92 2.43 0.00 1.60 1.01 -1.26 -2.24 120.40 120.02 1rxc s VAL 104 Ca 0.31 0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1rxc s VAL 104 Cb -0.09 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1rxc s VAL 104 CO 0.24 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1rxc n GLY 105 N 1.59 3.10 3.69 4.51 0.00 -0.24 -5.00 105.19 112.85 1rxc n GLY 105 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.15 3.26 -0.10 1.61 1.01 -0.95 -4.72 116.67 115.63 1rxc s ASP 106 Ca 0.00 1.94 0.02 0.00 0.71 0.00 0.00 52.55 55.21 1rxc s ASP 106 Cb 0.00 -2.48 -0.02 0.00 1.01 0.00 0.00 42.92 41.43 1rxc s ASP 106 CO 0.00 -2.85 -0.15 -0.69 0.21 0.00 0.00 175.17 171.70 1rxc s VAL 107 N -2.74 2.95 -0.17 -1.27 1.01 -0.89 -1.90 120.40 117.39 1rxc s VAL 107 Ca 0.65 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1rxc s VAL 107 Cb -0.21 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 33.99 1rxc s VAL 107 CO 0.58 0.55 -0.19 -0.76 0.00 0.00 0.00 175.10 175.28 1rxc s LEU 108 N -0.07 2.21 -0.22 3.92 1.43 -0.06 -0.82 118.68 125.07 1rxc s LEU 108 Ca -0.03 -0.60 -0.09 0.00 -1.03 0.00 0.00 54.13 52.37 1rxc s LEU 108 Cb -0.14 -1.50 -0.05 0.00 0.03 0.00 0.00 46.19 44.54 1rxc s LEU 108 CO 0.04 0.03 0.12 -0.69 0.23 0.00 0.00 176.35 176.08 1rxc s VAL 109 N 1.15 5.12 -0.18 -1.59 1.01 -0.46 -0.63 120.40 124.80 1rxc s VAL 109 Ca 0.01 0.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.92 1rxc s VAL 109 Cb -0.14 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 1rxc s VAL 109 CO -0.08 0.38 0.42 -0.89 0.00 0.00 0.00 175.10 174.93 1rxc s THR 110 N 0.88 5.19 -0.03 3.92 2.01 -0.85 -1.69 115.64 125.07 1rxc s THR 110 Ca 0.06 0.77 -0.02 0.00 0.31 0.00 0.00 61.69 62.82 1rxc s THR 110 Cb -0.13 -3.75 -0.27 0.00 0.01 0.00 0.00 72.50 68.36 1rxc s THR 110 CO 0.03 0.26 0.71 0.71 -0.69 0.00 0.00 174.62 175.64 1rxc h THR 111 N 4.96 0.98 -2.94 -0.82 1.35 -1.56 -3.41 112.91 111.46 1rxc h THR 111 Ca -0.37 -2.67 0.08 0.00 -0.55 0.00 0.00 66.41 62.90 1rxc h THR 111 Cb 1.16 2.65 -0.05 0.00 -1.73 0.00 0.00 68.15 70.18 1rxc h THR 111 CO 0.73 0.78 0.25 0.00 -0.25 0.00 0.00 175.52 177.04 1rxc s ALA 112 N -2.60 -1.24 -0.00 6.62 0.00 -1.26 -1.05 121.76 122.22 1rxc s ALA 112 Ca -0.11 -0.29 0.05 0.00 0.00 0.00 0.00 51.96 51.61 1rxc s ALA 112 Cb 0.07 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 24.00 1rxc s ALA 112 CO 0.83 -1.04 -0.17 -1.12 0.00 0.00 0.00 175.76 174.27 1rxc s SER 113 N -2.93 1.94 -0.05 0.00 0.01 -0.14 -1.92 113.70 110.61 1rxc s SER 113 Ca 0.11 -0.32 -0.30 0.00 1.31 0.00 0.00 55.95 56.75 1rxc s SER 113 Cb -0.06 -0.21 -0.04 0.00 0.21 0.00 0.00 66.02 65.92 1rxc s SER 113 CO 0.07 0.19 1.38 -0.69 0.41 0.00 0.00 173.24 174.60 1rxc s VAL 114 N -0.45 3.87 -1.11 3.43 1.01 0.87 -4.32 120.40 123.71 1rxc s VAL 114 Ca 0.06 1.19 -0.17 0.00 0.00 0.00 0.00 61.98 63.06 1rxc s VAL 114 Cb -0.07 -3.77 0.13 0.00 0.00 0.00 0.00 36.38 32.68 1rxc s VAL 114 CO -0.00 -0.04 1.38 -0.13 0.00 0.00 0.00 175.10 176.31 1rxc s ARG 115 N 2.82 3.85 -0.44 2.72 0.52 -1.26 -1.51 118.95 125.65 1rxc s ARG 115 Ca 0.62 -2.05 0.01 0.00 -0.52 0.00 0.00 55.73 53.80 1rxc s ARG 115 Cb -0.29 -5.12 0.46 0.00 0.52 0.00 0.00 34.95 30.52 1rxc s ARG 115 CO 0.24 -1.90 1.87 1.28 0.02 0.00 0.00 175.30 176.81 1rxc n LEU 116 N 6.75 6.58 -4.63 2.53 4.77 -0.62 -4.95 117.00 127.43 1rxc n LEU 116 Ca 0.34 -3.53 -0.29 0.00 -0.03 0.00 0.00 56.01 52.51 1rxc n LEU 116 Cb 0.46 -0.88 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 1rxc n LEU 116 CO 0.61 1.14 -0.27 1.51 -1.33 0.00 0.00 177.39 179.05 1rxc s ASP 117 N -0.96 3.70 -0.20 -1.43 3.84 -1.20 -1.78 116.67 118.63 1rxc s ASP 117 Ca 0.49 -1.47 0.06 0.00 -0.00 0.00 0.00 52.55 51.63 1rxc s ASP 117 Cb 0.40 -0.04 -0.16 0.00 -1.38 0.00 0.00 42.92 41.74 1rxc s ASP 117 CO 0.05 -0.62 -0.11 0.61 -0.00 0.00 0.00 175.17 175.10 1rxc n GLY 118 N -1.02 -0.47 0.28 2.12 0.00 -1.26 -4.69 105.19 100.15 1rxc n GLY 118 Ca -0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 46.02 45.72 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 0.26 1.22 -0.30 4.61 0.00 -1.98 -2.65 119.26 120.43 1rxc h ALA 119 Ca -0.48 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1rxc h ALA 119 Cb 1.85 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1rxc h ALA 119 CO -0.04 0.51 0.19 0.66 0.00 0.00 0.00 179.25 180.57 1rxc h SER 120 N 0.64 0.35 0.06 0.00 4.64 -1.85 -1.05 113.55 116.33 1rxc h SER 120 Ca 0.13 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1rxc h SER 120 Cb 0.39 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rxc h SER 120 CO 0.01 0.26 -0.02 -0.07 -0.87 0.00 0.00 176.83 176.15 1rxc h LEU 121 N 0.41 0.00 0.00 5.97 3.38 -1.59 -1.08 115.31 122.40 1rxc h LEU 121 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1rxc h LEU 121 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1rxc h LEU 121 CO -0.02 0.02 0.00 1.41 0.09 0.00 0.00 178.44 179.93 1rxc n HIS 122 N -3.74 0.00 -0.05 1.13 8.25 -0.40 -3.81 115.22 116.60 1rxc n HIS 122 Ca -0.03 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 1rxc n HIS 122 Cb 0.10 -0.41 -0.06 0.00 1.12 0.00 0.00 29.99 30.75 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 -1.41 0.00 -3.62 4.41 3.72 -0.52 -5.07 117.46 114.97 1rxc n PHE 123 Ca 0.09 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.34 1rxc n PHE 123 Cb 0.26 -0.41 -0.07 0.00 -0.94 0.00 0.00 39.48 38.32 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 -2.21 -1.55 0.76 4.37 0.00 -0.56 -5.01 121.76 117.57 1rxc s ALA 124 Ca -0.09 1.45 -0.14 0.00 0.00 0.00 0.00 51.96 53.18 1rxc s ALA 124 Cb 0.03 -0.54 0.06 0.00 0.00 0.00 0.00 23.12 22.67 1rxc s ALA 124 CO 0.29 -0.32 1.18 -1.25 0.00 0.00 0.00 175.76 175.67 1rxc s PRO 125 N -0.40 1.97 0.45 0.00 0.04 -1.26 -3.92 135.00 131.87 1rxc s PRO 125 Ca -0.06 1.66 0.25 0.00 0.04 0.00 0.00 61.00 62.89 1rxc s PRO 125 Cb -0.03 -1.82 1.26 0.00 0.04 0.00 0.00 34.50 33.95 1rxc s PRO 125 CO 0.05 -1.94 1.79 1.25 0.04 0.00 0.00 177.00 178.19 1rxc h LEU 126 N -0.64 0.28 -2.30 -3.56 5.85 -1.93 0.00 115.31 113.02 1rxc h LEU 126 Ca -0.46 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1rxc h LEU 126 Cb 1.28 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1rxc h LEU 126 CO 0.48 0.06 -0.05 1.05 -0.34 0.00 0.00 178.44 179.64 1rxc h GLU 127 N 0.25 0.00 -6.61 1.25 9.09 -2.03 -3.43 114.58 113.11 1rxc h GLU 127 Ca 0.57 0.00 -0.52 0.00 0.05 0.00 0.00 59.36 59.45 1rxc h GLU 127 Cb 1.72 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.83 1rxc h GLU 127 CO -0.19 0.05 0.57 0.12 0.05 0.00 0.00 179.01 179.61 1rxc s PHE 128 N -4.26 3.42 0.14 2.06 5.36 -0.02 -4.99 117.98 119.69 1rxc s PHE 128 Ca -0.04 1.36 -0.30 0.00 -0.96 0.00 0.00 56.93 56.99 1rxc s PHE 128 Cb 0.13 -3.45 -0.07 0.00 -0.34 0.00 0.00 43.02 39.30 1rxc s PHE 128 CO 0.53 -1.31 1.03 -1.25 -1.46 0.00 0.00 175.22 172.76 1rxc s PRO 129 N 0.19 4.65 -1.41 10.12 0.04 -1.26 -4.93 135.00 142.39 1rxc s PRO 129 Ca 0.55 1.58 -0.12 0.00 0.04 0.00 0.00 61.00 63.05 1rxc s PRO 129 Cb -0.32 -3.33 0.07 0.00 0.04 0.00 0.00 34.50 30.96 1rxc s PRO 129 CO 0.34 0.15 2.17 0.00 0.04 0.00 0.00 177.00 179.70 1rxc n ALA 130 N 2.60 5.63 -2.78 8.56 0.00 -1.26 -4.75 120.51 128.50 1rxc n ALA 130 Ca 0.03 -3.99 -0.37 0.00 0.00 0.00 0.00 53.44 49.10 1rxc n ALA 130 Cb 0.48 -3.36 -0.06 0.00 0.00 0.00 0.00 19.45 16.51 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 2.26 5.39 0.46 0.00 0.11 -1.26 -0.96 120.40 126.39 1rxc s VAL 131 Ca 0.46 0.36 -0.18 0.00 -2.93 0.00 0.00 61.98 59.69 1rxc s VAL 131 Cb 0.13 -3.48 -0.09 0.00 -1.53 0.00 0.00 36.38 31.41 1rxc s VAL 131 CO -0.06 0.59 0.93 0.00 -3.33 0.00 0.00 175.10 173.23 1rxc s ALA 132 N -0.89 3.10 0.41 1.54 0.00 -0.22 -4.68 121.76 121.02 1rxc s ALA 132 Ca 0.17 0.23 -0.26 0.00 0.00 0.00 0.00 51.96 52.09 1rxc s ALA 132 Cb -0.13 -3.07 -0.09 0.00 0.00 0.00 0.00 23.12 19.83 1rxc s ALA 132 CO 0.06 -0.03 1.36 0.34 0.00 0.00 0.00 175.76 177.49 1rxc s ASP 133 N -2.66 6.23 0.12 0.00 -1.08 0.73 -4.92 116.67 115.10 1rxc s ASP 133 Ca 0.59 2.79 -0.13 0.00 -0.52 0.00 0.00 52.55 55.27 1rxc s ASP 133 Cb -0.10 -2.65 -0.05 0.00 -1.46 0.00 0.00 42.92 38.67 1rxc s ASP 133 CO 0.23 -0.92 1.48 0.15 0.52 0.00 0.00 175.17 176.63 1rxc h PHE 134 N 2.69 0.93 -0.34 -5.34 3.04 -1.96 -1.61 116.94 114.35 1rxc h PHE 134 Ca -0.50 -0.25 -0.11 0.00 3.98 0.00 0.00 57.97 61.09 1rxc h PHE 134 Cb 1.25 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 39.54 1rxc h PHE 134 CO 0.52 1.01 -0.26 0.93 -2.02 0.00 0.00 178.31 178.49 1rxc h GLU 135 N 0.59 0.69 -0.26 1.11 5.08 -1.96 -0.62 114.58 119.21 1rxc h GLU 135 Ca 0.07 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 1rxc h GLU 135 Cb 0.80 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1rxc h GLU 135 CO 0.06 0.88 -0.09 0.00 -1.00 0.00 0.00 179.01 178.86 1rxc h THR 137 N 0.26 1.25 -0.46 0.00 2.02 -1.25 -2.12 112.91 112.60 1rxc h THR 137 Ca 0.06 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.36 1rxc h THR 137 Cb 0.57 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.59 1rxc h THR 137 CO 0.03 0.34 0.28 0.74 0.37 0.00 0.00 175.52 177.28 1rxc h THR 138 N 0.92 1.06 -0.26 3.16 2.02 -0.97 -2.19 112.91 116.64 1rxc h THR 138 Ca 0.20 -0.19 -0.09 0.00 0.77 0.00 0.00 66.41 67.10 1rxc h THR 138 Cb 0.34 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1rxc h THR 138 CO -0.00 0.10 -0.21 0.00 0.37 0.00 0.00 175.52 175.78 1rxc h ALA 139 N 1.20 1.16 -0.23 6.16 0.00 -0.86 -1.26 119.26 125.43 1rxc h ALA 139 Ca 0.18 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 1rxc h ALA 139 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1rxc h ALA 139 CO -0.08 0.53 -0.57 -0.07 0.00 0.00 0.00 179.25 179.06 1rxc h LEU 140 N 0.42 0.82 -0.17 0.00 3.38 -1.15 -0.74 115.31 117.87 1rxc h LEU 140 Ca 0.07 -0.45 -0.15 0.00 0.09 0.00 0.00 57.88 57.44 1rxc h LEU 140 Cb 0.61 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1rxc h LEU 140 CO 0.04 1.21 -0.47 0.58 0.09 0.00 0.00 178.44 179.90 1rxc h VAL 141 N 0.55 1.33 -0.60 1.22 2.07 -1.21 -1.39 116.25 118.23 1rxc h VAL 141 Ca 0.00 -1.72 -0.06 0.00 0.82 0.00 0.00 66.70 65.75 1rxc h VAL 141 Cb 1.16 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 32.85 1rxc h VAL 141 CO 0.12 0.53 0.12 -0.08 0.02 0.00 0.00 177.57 178.28 1rxc h GLU 142 N 0.29 0.95 -0.36 1.57 4.57 -1.24 -0.97 114.58 119.40 1rxc h GLU 142 Ca -0.01 -0.22 -0.15 0.00 -1.18 0.00 0.00 59.36 57.80 1rxc h GLU 142 Cb 1.08 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 1rxc h GLU 142 CO 0.10 0.86 -0.36 0.00 -1.18 0.00 0.00 179.01 178.43 1rxc h ALA 143 N 1.23 0.68 -0.54 2.92 0.00 -1.06 -2.05 119.26 120.43 1rxc h ALA 143 Ca 0.19 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.56 1rxc h ALA 143 Cb 0.36 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1rxc h ALA 143 CO 0.00 0.67 -0.06 0.00 0.00 0.00 0.00 179.25 179.86 1rxc h ALA 144 N 0.89 0.89 -0.91 0.00 0.00 -1.06 -2.83 119.26 116.23 1rxc h ALA 144 Ca 0.06 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1rxc h ALA 144 Cb 0.93 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 1rxc h ALA 144 CO 0.09 0.65 0.60 0.87 0.00 0.00 0.00 179.25 181.45 1rxc h LYS 145 N 0.87 1.17 -0.00 0.00 6.56 -0.96 -2.28 116.57 121.93 1rxc h LYS 145 Ca 0.15 -0.07 -0.16 0.00 -1.06 0.00 0.00 60.65 59.51 1rxc h LYS 145 Cb 0.59 -0.26 -0.02 0.00 -0.57 0.00 0.00 32.23 31.96 1rxc h LYS 145 CO 0.04 0.78 -0.76 0.66 -2.06 0.00 0.00 179.45 178.11 1rxc h SER 146 N 1.21 0.01 0.08 0.86 4.64 -1.14 -2.47 113.55 116.74 1rxc h SER 146 Ca 0.34 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1rxc h SER 146 Cb -0.10 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1rxc h SER 146 CO -0.09 0.76 -0.15 2.30 -0.87 0.00 0.00 176.83 178.78 1rxc n ILE 147 N -3.65 0.00 -2.24 0.95 -5.35 -1.13 -4.98 119.36 102.96 1rxc n ILE 147 Ca -0.01 -0.23 -0.07 0.00 -0.27 0.00 0.00 62.75 62.17 1rxc n ILE 147 Cb 0.73 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 39.29 1rxc n ILE 147 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rxc n GLY 148 N 1.29 0.15 3.73 3.28 0.00 -0.93 -5.02 105.19 107.67 1rxc n GLY 148 Ca 0.15 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.45 3.25 -0.08 4.61 0.00 -0.90 -5.01 121.76 121.17 1rxc s ALA 149 Ca 0.03 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1rxc s ALA 149 Cb -0.01 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1rxc s ALA 149 CO 0.03 -0.04 1.65 -0.08 0.00 0.00 0.00 175.76 177.32 1rxc s THR 150 N 0.11 3.61 0.00 0.00 -1.32 -1.26 -4.73 115.64 112.04 1rxc s THR 150 Ca 0.47 0.72 0.04 0.00 -1.21 0.00 0.00 61.69 61.71 1rxc s THR 150 Cb -0.23 -3.49 -0.01 0.00 -1.51 0.00 0.00 72.50 67.26 1rxc s THR 150 CO 0.29 -0.09 -0.11 -0.89 -2.21 0.00 0.00 174.62 171.60 1rxc s THR 151 N 4.24 0.90 0.02 5.08 2.01 -1.26 -2.10 115.64 124.53 1rxc s THR 151 Ca 0.73 -0.57 0.08 0.00 0.31 0.00 0.00 61.69 62.24 1rxc s THR 151 Cb -0.32 -0.77 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1rxc s THR 151 CO 0.29 0.19 -0.24 -1.00 -0.69 0.00 0.00 174.62 173.17 1rxc s HIS 152 N -0.39 2.11 -0.10 4.92 3.76 -0.00 -4.96 115.29 120.63 1rxc s HIS 152 Ca 0.03 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 54.58 1rxc s HIS 152 Cb -0.05 -1.30 0.01 0.00 1.11 0.00 0.00 32.58 32.35 1rxc s HIS 152 CO -0.00 0.06 -0.19 0.08 -0.85 0.00 0.00 174.74 173.84 1rxc s VAL 153 N -0.71 1.69 -4.37 -0.90 1.01 -1.26 -1.36 120.40 114.50 1rxc s VAL 153 Ca 0.10 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1rxc s VAL 153 Cb -0.09 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1rxc s VAL 153 CO 0.01 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1rxc n GLY 154 N 3.78 -0.50 3.81 4.51 0.00 -0.68 -4.97 105.19 111.14 1rxc n GLY 154 Ca -0.20 -1.01 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 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 -3.13 4.45 -0.02 1.61 1.01 -1.26 -1.37 120.40 121.69 1rxc s VAL 155 Ca 0.00 1.40 0.04 0.00 0.00 0.00 0.00 61.98 63.42 1rxc s VAL 155 Cb 0.00 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1rxc s VAL 155 CO 0.00 -0.03 -0.13 -0.89 0.00 0.00 0.00 175.10 174.05 1rxc s THR 156 N -1.82 1.02 -0.27 3.92 2.01 -0.81 -1.53 115.64 118.17 1rxc s THR 156 Ca 0.52 -0.53 -0.19 0.00 0.31 0.00 0.00 61.69 61.80 1rxc s THR 156 Cb -0.14 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 1rxc s THR 156 CO 0.19 0.30 0.58 0.00 -0.69 0.00 0.00 174.62 175.00 1rxc s ALA 157 N -0.14 3.58 -0.44 7.40 0.00 -0.27 -0.09 121.76 131.80 1rxc s ALA 157 Ca 0.02 -0.57 -0.09 0.00 0.00 0.00 0.00 51.96 51.32 1rxc s ALA 157 Cb -0.07 -2.99 0.09 0.00 0.00 0.00 0.00 23.12 20.15 1rxc s ALA 157 CO 0.00 -0.86 0.30 0.45 0.00 0.00 0.00 175.76 175.65 1rxc s SER 158 N 1.55 5.68 -0.09 0.00 0.15 -0.57 -1.97 113.70 118.45 1rxc s SER 158 Ca 0.24 -1.65 -0.05 0.00 0.70 0.00 0.00 55.95 55.18 1rxc s SER 158 Cb -0.15 -2.00 -0.04 0.00 -1.71 0.00 0.00 66.02 62.11 1rxc s SER 158 CO 0.10 -0.60 0.13 -0.55 1.20 0.00 0.00 173.24 173.51 1rxc s SER 159 N 2.35 6.21 0.25 5.45 0.15 -0.01 -1.59 113.70 126.51 1rxc s SER 159 Ca 0.04 0.39 0.24 0.00 0.70 0.00 0.00 55.95 57.33 1rxc s SER 159 Cb -0.24 -1.96 0.94 0.00 -1.71 0.00 0.00 66.02 63.04 1rxc s SER 159 CO 0.01 0.38 1.73 0.47 1.20 0.00 0.00 173.24 177.03 1rxc n ASP 160 N 1.80 0.71 -4.40 5.45 9.92 -0.73 -4.27 116.55 125.03 1rxc n ASP 160 Ca -0.18 0.64 -0.26 0.00 -0.53 0.00 0.00 54.79 54.46 1rxc n ASP 160 Cb 0.54 -0.80 -0.12 0.00 -0.64 0.00 0.00 41.12 40.10 1rxc n ASP 160 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1rxc s THR 161 N -3.26 2.21 0.06 -3.53 -4.23 -1.26 -5.01 115.64 100.62 1rxc s THR 161 Ca 0.06 -1.96 0.08 0.00 -1.18 0.00 0.00 61.69 58.69 1rxc s THR 161 Cb 0.10 -2.03 -0.22 0.00 1.34 0.00 0.00 72.50 71.69 1rxc s THR 161 CO 0.45 -0.13 1.05 0.15 -0.54 0.00 0.00 174.62 175.60 1rxc h PHE 162 N 3.33 0.05 0.00 3.99 3.57 -1.97 -3.38 116.94 122.53 1rxc h PHE 162 Ca -0.46 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.00 1rxc h PHE 162 Cb 1.20 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.94 1rxc h PHE 162 CO 0.67 1.04 0.00 0.66 -2.23 0.00 0.00 178.31 178.45 1rxc n TYR 163 N -3.27 0.00 0.01 0.41 4.01 -1.26 -4.36 117.16 112.70 1rxc n TYR 163 Ca -0.07 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.68 1rxc n TYR 163 Cb 0.99 0.00 0.33 0.00 -0.31 0.00 0.00 39.34 40.34 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 0.50 0.00 -0.72 0.13 -1.88 -1.57 132.00 128.47 1rxc h PRO 164 Ca 0.00 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1rxc h PRO 164 Cb 0.00 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.05 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 0.78 0.00 -2.12 1.56 0.00 -1.87 -1.82 103.07 99.60 1rxc h GLY 165 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1rxc h GLY 165 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.48 1rxc n GLN 166 N -2.95 3.35 -3.91 4.80 6.02 -0.67 -4.91 117.38 119.10 1rxc n GLN 166 Ca -0.00 -2.71 -0.25 0.00 -0.01 0.00 0.00 57.00 54.03 1rxc n GLN 166 Cb 0.24 -1.77 -0.01 0.00 1.02 0.00 0.00 30.24 29.72 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 0.28 -3.63 -3.06 -1.09 2.13 -0.68 -4.91 120.64 109.68 1rxc n GLU 167 Ca 0.21 0.45 -0.40 0.00 0.66 0.00 0.00 57.16 58.08 1rxc n GLU 167 Cb 0.82 -4.68 -0.05 0.00 0.27 0.00 0.00 31.44 27.80 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 -6.46 4.43 -0.02 5.31 0.52 -0.71 -4.98 118.95 117.04 1rxc s ARG 168 Ca 0.04 0.85 0.15 0.00 -0.52 0.00 0.00 55.73 56.25 1rxc s ARG 168 Cb -0.02 -3.44 -0.21 0.00 0.52 0.00 0.00 34.95 31.79 1rxc s ARG 168 CO 0.87 0.07 0.38 0.66 0.02 0.00 0.00 175.30 177.31 1rxc n TYR 169 N 3.75 0.00 -2.96 -0.53 4.01 -1.26 -4.46 117.16 115.71 1rxc n TYR 169 Ca -0.02 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.28 1rxc n TYR 169 Cb 0.51 -0.27 -0.01 0.00 -0.31 0.00 0.00 39.34 39.26 1rxc n TYR 169 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 1rxc s ASP 170 N -3.42 6.86 0.34 7.72 1.47 -1.26 -4.09 116.67 124.29 1rxc s ASP 170 Ca -0.03 -2.55 0.07 0.00 1.18 0.00 0.00 52.55 51.21 1rxc s ASP 170 Cb 0.10 -2.39 -0.02 0.00 -0.34 0.00 0.00 42.92 40.26 1rxc s ASP 170 CO 0.60 -0.88 0.24 0.35 0.68 0.00 0.00 175.17 176.17 1rxc n THR 171 N 4.96 0.00 0.02 2.11 -2.24 -1.26 -5.01 114.28 112.86 1rxc n THR 171 Ca 0.29 -2.37 -0.10 0.00 -2.27 0.00 0.00 64.05 59.61 1rxc n THR 171 Cb 0.46 1.10 -0.04 0.00 -2.10 0.00 0.00 70.33 69.74 1rxc n THR 171 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 1rxc h TYR 172 N 1.95 -0.24 0.00 4.78 3.20 -1.98 -2.94 116.97 121.75 1rxc h TYR 172 Ca -0.25 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.49 1rxc h TYR 172 Cb 1.18 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.54 1rxc h TYR 172 CO 0.00 -0.15 -0.87 0.66 -1.64 0.00 0.00 178.16 176.16 1rxc h SER 173 N -0.13 0.00 -0.67 -2.11 4.64 -1.98 -3.47 113.55 109.84 1rxc h SER 173 Ca 0.06 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.10 1rxc h SER 173 Cb 0.22 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.19 1rxc h SER 173 CO -0.15 0.63 -0.26 0.61 -0.87 0.00 0.00 176.83 176.78 1rxc n GLY 174 N 1.30 1.41 3.56 -0.77 0.00 -1.11 -4.99 105.19 104.60 1rxc n GLY 174 Ca -0.02 -0.17 -0.24 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.12 2.01 -0.02 1.61 0.52 -1.26 -4.93 118.95 113.76 1rxc s ARG 175 Ca 0.00 -1.53 0.00 0.00 -0.52 0.00 0.00 55.73 53.68 1rxc s ARG 175 Cb 0.00 -2.01 0.02 0.00 0.52 0.00 0.00 34.95 33.48 1rxc s ARG 175 CO 0.00 0.36 0.01 0.08 0.02 0.00 0.00 175.30 175.77 1rxc s VAL 176 N -2.29 0.03 0.47 3.52 1.01 -1.26 -4.91 120.40 116.96 1rxc s VAL 176 Ca 0.30 0.11 -0.24 0.00 0.00 0.00 0.00 61.98 62.15 1rxc s VAL 176 Cb -0.06 -0.11 -0.08 0.00 0.00 0.00 0.00 36.38 36.13 1rxc s VAL 176 CO 0.17 0.08 1.31 0.55 0.00 0.00 0.00 175.10 177.21 1rxc n VAL 177 N 3.82 3.01 -0.31 2.92 3.14 -1.26 -4.56 118.33 125.09 1rxc n VAL 177 Ca -0.23 -0.50 0.16 0.00 -2.96 0.00 0.00 64.34 60.81 1rxc n VAL 177 Cb 0.53 -1.62 0.34 0.00 -1.06 0.00 0.00 33.84 32.03 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 1.85 0.24 -0.75 1.45 2.43 -2.01 -0.81 114.38 116.78 1rxc h ARG 178 Ca -0.49 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 58.80 1rxc h ARG 178 Cb 1.30 -0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 30.70 1rxc h ARG 178 CO 0.59 0.16 0.30 1.25 -1.51 0.00 0.00 179.97 180.76 1rxc h HIS 179 N 0.24 0.52 -0.02 2.20 2.76 -2.02 -2.45 115.15 116.39 1rxc h HIS 179 Ca 0.60 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.81 1rxc h HIS 179 Cb 1.26 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 30.10 1rxc h HIS 179 CO -0.20 0.07 -0.14 1.19 -1.30 0.00 0.00 177.93 177.55 1rxc n PHE 180 N -4.99 0.00 -1.99 5.26 3.01 -0.36 -4.74 117.46 113.64 1rxc n PHE 180 Ca 0.14 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.18 1rxc n PHE 180 Cb 0.40 -0.02 -0.03 0.00 -0.01 0.00 0.00 39.48 39.83 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 -2.17 4.20 0.00 -1.08 2.20 -0.91 -2.18 119.74 119.79 1rxc s LYS 181 Ca 0.28 2.23 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 1rxc s LYS 181 Cb 0.20 -3.82 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1rxc s LYS 181 CO 0.40 -0.78 0.00 0.41 -0.36 0.00 0.00 175.35 175.02 1rxc n GLY 182 N 4.05 0.44 0.23 5.54 0.00 -1.26 -4.95 105.19 109.23 1rxc n GLY 182 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 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 0.95 -0.44 1.61 4.64 -1.73 -3.12 113.55 115.46 1rxc h SER 183 Ca 0.00 -0.62 0.03 0.00 -0.47 0.00 0.00 61.79 60.73 1rxc h SER 183 Cb 0.21 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 61.98 1rxc h SER 183 CO 0.00 1.43 0.23 -0.03 -0.87 0.00 0.00 176.83 177.58 1rxc h MET 184 N 0.55 0.44 -0.83 4.77 -1.53 -1.91 -1.01 114.93 115.41 1rxc h MET 184 Ca -0.05 -0.03 0.11 0.00 -3.44 0.00 0.00 59.70 56.29 1rxc h MET 184 Cb 1.41 -0.10 -0.08 0.00 -0.55 0.00 0.00 31.60 32.28 1rxc h MET 184 CO 0.16 0.29 0.47 1.49 0.14 0.00 0.00 176.91 179.46 1rxc h GLU 185 N 0.46 0.74 -0.16 0.39 4.81 -1.97 -0.09 114.58 118.75 1rxc h GLU 185 Ca 0.19 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1rxc h GLU 185 Cb 0.08 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 1rxc h GLU 185 CO -0.13 0.49 0.03 0.93 -0.73 0.00 0.00 179.01 179.60 1rxc h GLU 186 N 0.76 0.27 -0.91 1.92 4.39 -1.24 -1.73 114.58 118.04 1rxc h GLU 186 Ca 0.41 -0.07 0.06 0.00 0.34 0.00 0.00 59.36 60.10 1rxc h GLU 186 Cb 0.43 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.98 1rxc h GLU 186 CO -0.27 0.44 0.58 -1.49 -1.16 0.00 0.00 179.01 177.10 1rxc h TRP 187 N 0.06 1.07 -0.28 4.33 -0.00 -1.00 -1.77 115.95 118.36 1rxc h TRP 187 Ca 0.05 0.03 0.01 0.00 -0.00 0.00 0.00 58.89 58.98 1rxc h TRP 187 Cb 0.30 -0.35 -0.02 0.00 -0.00 0.00 0.00 29.16 29.09 1rxc h TRP 187 CO 0.02 0.56 0.15 1.96 -0.00 0.00 0.00 178.44 181.13 1rxc h GLN 188 N 1.06 0.31 0.00 0.49 4.20 -0.73 -1.49 115.11 118.96 1rxc h GLN 188 Ca 0.39 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 59.05 1rxc h GLN 188 Cb 0.13 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1rxc h GLN 188 CO -0.16 0.20 -0.16 0.00 -0.67 0.00 0.00 178.83 178.04 1rxc h ALA 189 N 1.13 1.53 -0.00 3.87 0.00 -1.01 -2.10 119.26 122.67 1rxc h ALA 189 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rxc h ALA 189 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1rxc h ALA 189 CO -0.06 0.20 -0.10 -1.33 0.00 0.00 0.00 179.25 177.95 1rxc n MET 190 N -4.05 0.68 -0.56 0.00 2.81 -0.69 -4.92 117.12 110.39 1rxc n MET 190 Ca -0.02 -0.22 0.00 0.00 -1.81 0.00 0.00 57.70 55.64 1rxc n MET 190 Cb 0.24 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.26 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 1.28 0.71 3.76 3.03 0.00 -0.79 -5.04 105.19 108.14 1rxc n GLY 191 Ca 0.15 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 2.40 -0.04 1.61 1.01 -0.63 -4.68 120.40 118.06 1rxc s VAL 192 Ca 0.00 0.35 -0.08 0.00 0.00 0.00 0.00 61.98 62.26 1rxc s VAL 192 Cb 0.00 -3.22 -0.29 0.00 0.00 0.00 0.00 36.38 32.86 1rxc s VAL 192 CO 0.00 0.07 0.68 0.24 0.00 0.00 0.00 175.10 176.08 1rxc h MET 193 N 4.38 0.33 -3.02 2.72 0.00 -1.60 -3.42 114.93 114.31 1rxc h MET 193 Ca -0.48 -0.57 0.06 0.00 0.00 0.00 0.00 59.70 58.72 1rxc h MET 193 Cb 1.22 0.21 -0.06 0.00 0.00 0.00 0.00 31.60 32.98 1rxc h MET 193 CO 0.74 1.23 0.22 0.54 0.00 0.00 0.00 176.91 179.64 1rxc s ASN 194 N -7.14 -0.28 -0.07 1.22 4.22 -1.26 -0.93 114.94 110.69 1rxc s ASN 194 Ca -0.15 -0.57 0.04 0.00 -2.14 0.00 0.00 52.86 50.05 1rxc s ASN 194 Cb 0.06 0.72 -0.01 0.00 1.28 0.00 0.00 41.25 43.29 1rxc s ASN 194 CO 0.84 -1.31 -0.20 -0.31 -2.04 0.00 0.00 177.10 174.08 1rxc s TYR 195 N -3.91 2.58 0.00 1.54 2.02 -0.38 -1.12 117.35 118.09 1rxc s TYR 195 Ca 0.10 -0.61 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 1rxc s TYR 195 Cb -0.05 -1.67 0.00 0.00 -0.40 0.00 0.00 41.96 39.84 1rxc s TYR 195 CO 0.05 -0.15 0.00 -0.85 -1.57 0.00 0.00 175.55 173.04 1rxc n GLU 196 N 2.98 0.00 0.00 -0.62 -0.00 -0.83 -2.70 120.64 119.47 1rxc n GLU 196 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.98 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 0.07 0.00 3.44 2.81 -1.26 -0.83 117.12 121.35 1rxc n MET 197 Ca 0.00 -0.17 0.00 0.00 -1.81 0.00 0.00 57.70 55.72 1rxc n MET 197 Cb 0.00 -0.63 0.00 0.00 -0.71 0.00 0.00 33.22 31.88 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 -0.06 2.04 -0.10 0.03 4.71 -1.26 -3.57 120.64 122.43 1rxc n GLU 198 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.16 57.11 1rxc n GLU 198 Cb 0.13 -0.81 0.17 0.00 -1.01 0.00 0.00 31.44 29.93 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 0.73 -0.75 1.62 4.64 -1.93 -1.94 113.55 115.92 1rxc h SER 199 Ca 0.00 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.13 1rxc h SER 199 Cb 0.00 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 61.86 1rxc h SER 199 CO 0.00 0.80 0.38 0.00 -0.87 0.00 0.00 176.83 177.14 1rxc h ALA 200 N 1.28 0.96 0.06 5.18 0.00 -1.88 0.21 119.26 125.07 1rxc h ALA 200 Ca 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rxc h ALA 200 Cb 0.44 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1rxc h ALA 200 CO 0.02 0.50 -0.03 1.15 0.00 0.00 0.00 179.25 180.89 1rxc h THR 201 N 1.04 1.23 0.01 0.00 2.02 -1.83 -2.33 112.91 113.05 1rxc h THR 201 Ca 0.26 -1.08 0.02 0.00 0.77 0.00 0.00 66.41 66.38 1rxc h THR 201 Cb 0.08 1.93 -0.03 0.00 -1.74 0.00 0.00 68.15 68.39 1rxc h THR 201 CO -0.04 0.27 -0.16 0.25 0.37 0.00 0.00 175.52 176.21 1rxc h LEU 202 N -0.57 -0.46 -0.57 2.58 5.85 -1.18 -0.80 115.31 120.16 1rxc h LEU 202 Ca -0.01 0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.64 1rxc h LEU 202 Cb 0.50 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1rxc h LEU 202 CO 0.01 -0.22 -0.31 -0.07 -0.34 0.00 0.00 178.44 177.51 1rxc h LEU 203 N -0.27 0.84 -0.15 2.25 3.38 -1.04 -2.13 115.31 118.19 1rxc h LEU 203 Ca 0.05 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.63 1rxc h LEU 203 Cb 0.33 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1rxc h LEU 203 CO -0.14 1.08 -0.06 0.74 0.09 0.00 0.00 178.44 180.15 1rxc h THR 204 N 0.68 1.31 -0.29 0.22 2.02 -1.18 -1.07 112.91 114.58 1rxc h THR 204 Ca 0.07 -1.07 -0.10 0.00 0.77 0.00 0.00 66.41 66.08 1rxc h THR 204 Cb 0.86 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 1rxc h THR 204 CO 0.08 0.31 -0.24 0.00 0.37 0.00 0.00 175.52 176.04 1rxc h MET 205 N -0.02 0.56 0.09 6.66 -0.00 -1.12 -1.83 114.93 119.27 1rxc h MET 205 Ca 0.03 -0.22 -0.00 0.00 -0.00 0.00 0.00 59.70 59.51 1rxc h MET 205 Cb 0.52 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 32.09 1rxc h MET 205 CO 0.02 0.76 -0.04 0.00 -0.00 0.00 0.00 176.91 177.65 1rxc h ALA 207 N -0.03 1.32 -0.01 0.00 0.00 -1.21 -1.71 119.26 117.61 1rxc h ALA 207 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1rxc h ALA 207 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1rxc h ALA 207 CO 0.02 0.06 -0.17 -1.13 0.00 0.00 0.00 179.25 178.03 1rxc n SER 208 N -3.61 1.10 -0.76 0.00 3.41 -0.69 -4.26 113.62 108.81 1rxc n SER 208 Ca -0.02 -1.03 0.05 0.00 -0.26 0.00 0.00 58.87 57.60 1rxc n SER 208 Cb 0.16 0.08 0.08 0.00 -0.26 0.00 0.00 64.21 64.27 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 -0.45 0.62 -1.30 4.33 6.02 -0.72 -5.00 117.38 120.87 1rxc n GLN 209 Ca 0.14 -2.17 -0.10 0.00 -0.01 0.00 0.00 57.00 54.86 1rxc n GLN 209 Cb 0.34 -0.80 -0.04 0.00 1.02 0.00 0.00 30.24 30.76 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 -0.38 1.18 3.73 1.08 0.00 -1.09 -5.01 105.19 104.70 1rxc n GLY 210 Ca 0.09 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.36 3.68 -0.04 0.99 1.43 -0.74 -5.05 118.68 116.59 1rxc s LEU 211 Ca 0.00 0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 1rxc s LEU 211 Cb 0.00 -2.23 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 1rxc s LEU 211 CO 0.00 0.24 0.42 -0.13 0.23 0.00 0.00 176.35 177.11 1rxc s ARG 212 N -1.92 4.07 -0.04 1.70 0.52 -0.44 -3.76 118.95 119.08 1rxc s ARG 212 Ca 0.24 0.40 -0.04 0.00 -0.52 0.00 0.00 55.73 55.81 1rxc s ARG 212 Cb -0.12 -3.30 0.01 0.00 0.52 0.00 0.00 34.95 32.06 1rxc s ARG 212 CO 0.15 0.51 0.11 0.00 0.02 0.00 0.00 175.30 176.10 1rxc s ALA 213 N -0.50 -0.27 0.24 2.13 0.00 -1.26 -0.84 121.76 121.26 1rxc s ALA 213 Ca 0.24 0.24 0.04 0.00 0.00 0.00 0.00 51.96 52.48 1rxc s ALA 213 Cb -0.16 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.76 1rxc s ALA 213 CO 0.12 -0.07 -0.01 0.20 0.00 0.00 0.00 175.76 176.00 1rxc s GLY 214 N -0.15 1.63 -0.17 0.00 0.00 -0.43 -0.19 107.32 108.02 1rxc s GLY 214 Ca -0.02 -1.81 -0.06 0.00 0.00 0.00 0.00 44.72 42.83 1rxc s GLY 214 CO 0.00 -1.70 0.35 -0.29 0.00 0.00 0.00 173.10 171.46 1rxc s MET 215 N -3.85 0.24 0.04 2.90 0.00 -1.26 -1.43 119.30 115.95 1rxc s MET 215 Ca 0.29 0.90 0.03 0.00 0.00 0.00 0.00 55.69 56.91 1rxc s MET 215 Cb 0.06 0.16 -0.02 0.00 0.00 0.00 0.00 34.83 35.02 1rxc s MET 215 CO 0.10 -0.27 -0.09 0.54 0.00 0.00 0.00 175.02 175.30 1rxc s VAL 216 N 2.51 0.63 -0.06 10.11 0.11 -0.70 -2.02 120.40 130.98 1rxc s VAL 216 Ca -0.00 -1.09 -0.20 0.00 -2.93 0.00 0.00 61.98 57.76 1rxc s VAL 216 Cb -0.12 -0.67 0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1rxc s VAL 216 CO -0.11 -0.34 0.46 0.00 -3.33 0.00 0.00 175.10 171.78 1rxc s ALA 217 N -1.32 -1.17 -0.03 1.54 0.00 0.19 -1.92 121.76 119.05 1rxc s ALA 217 Ca -0.08 0.86 -0.18 0.00 0.00 0.00 0.00 51.96 52.56 1rxc s ALA 217 Cb -0.10 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 1rxc s ALA 217 CO 0.01 -0.28 0.51 0.20 0.00 0.00 0.00 175.76 176.19 1rxc s GLY 218 N -0.91 2.51 -0.20 0.00 0.00 -0.47 -0.88 107.32 107.38 1rxc s GLY 218 Ca -0.10 -0.10 -0.28 0.00 0.00 0.00 0.00 44.72 44.24 1rxc s GLY 218 CO 0.05 0.58 0.99 0.14 0.00 0.00 0.00 173.10 174.86 1rxc s VAL 219 N -0.23 4.74 -0.91 1.40 1.01 -0.80 -1.69 120.40 123.93 1rxc s VAL 219 Ca 0.27 1.95 0.07 0.00 0.00 0.00 0.00 61.98 64.27 1rxc s VAL 219 Cb -0.17 -4.27 0.06 0.00 0.00 0.00 0.00 36.38 32.00 1rxc s VAL 219 CO 0.14 -0.11 0.73 2.30 0.00 0.00 0.00 175.10 178.17 1rxc n ILE 220 N 5.08 0.01 -3.50 2.22 -5.35 -0.42 -1.08 119.36 116.31 1rxc n ILE 220 Ca 0.10 -0.50 -0.14 0.00 -0.27 0.00 0.00 62.75 61.94 1rxc n ILE 220 Cb 0.47 1.15 -0.04 0.00 -1.74 0.00 0.00 39.64 39.48 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 -0.61 0.01 -0.21 7.28 0.11 -1.24 -4.37 120.40 121.36 1rxc s VAL 221 Ca 0.09 -0.11 0.02 0.00 -2.93 0.00 0.00 61.98 59.04 1rxc s VAL 221 Cb 0.06 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.94 1rxc s VAL 221 CO 0.09 -0.06 -0.16 0.21 -3.33 0.00 0.00 175.10 171.86 1rxc s ASN 222 N -2.18 3.65 0.02 3.54 3.84 -1.26 -0.82 114.94 121.73 1rxc s ASN 222 Ca -0.03 -0.96 0.22 0.00 0.21 0.00 0.00 52.86 52.30 1rxc s ASN 222 Cb -0.00 -1.48 0.94 0.00 -0.55 0.00 0.00 41.25 40.16 1rxc s ASN 222 CO -0.05 -0.09 1.71 0.54 -2.79 0.00 0.00 177.10 176.43 1rxc n ARG 223 N 4.56 0.02 0.12 0.43 5.12 0.60 -2.13 116.66 125.37 1rxc n ARG 223 Ca -0.18 0.13 0.11 0.00 -1.93 0.00 0.00 57.85 55.99 1rxc n ARG 223 Cb 0.47 -1.52 0.48 0.00 -1.16 0.00 0.00 32.46 30.72 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 -1.55 0.87 0.00 0.55 -2.24 -1.26 -4.08 114.28 106.57 1rxc n THR 224 Ca 0.05 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.11 1rxc n THR 224 Cb 0.26 -1.20 0.00 0.00 -2.10 0.00 0.00 70.33 67.30 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 -2.18 2.60 -3.70 -0.78 1.13 -0.94 -5.11 117.38 108.40 1rxc n GLN 225 Ca 0.02 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.97 1rxc n GLN 225 Cb 0.21 -0.91 -0.06 0.00 0.11 0.00 0.00 30.24 29.59 1rxc n GLN 225 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1rxc s GLN 226 N -1.82 0.96 -0.07 -1.09 -2.07 -0.91 -5.08 119.66 109.58 1rxc s GLN 226 Ca 0.00 -0.67 -0.18 0.00 -1.82 0.00 0.00 55.36 52.69 1rxc s GLN 226 Cb 0.00 0.42 -0.30 0.00 -1.09 0.00 0.00 33.01 32.04 1rxc s GLN 226 CO 0.00 -0.35 0.75 0.93 -1.32 0.00 0.00 175.29 175.30 1rxc h GLU 227 N 2.68 0.30 -5.53 9.60 5.08 -1.86 -3.32 114.58 121.53 1rxc h GLU 227 Ca -0.33 -0.51 -0.66 0.00 -1.00 0.00 0.00 59.36 56.86 1rxc h GLU 227 Cb 1.23 0.19 -0.24 0.00 0.50 0.00 0.00 28.75 30.42 1rxc h GLU 227 CO 0.48 1.24 -0.73 0.42 -1.00 0.00 0.00 179.01 179.42 1rxc s ILE 228 N -2.47 3.33 0.94 3.13 -1.09 -1.26 -4.98 121.20 118.80 1rxc s ILE 228 Ca -0.16 -0.57 -0.12 0.00 -2.23 0.00 0.00 60.65 57.57 1rxc s ILE 228 Cb 0.03 -2.40 0.07 0.00 -1.58 0.00 0.00 42.46 38.58 1rxc s ILE 228 CO 0.81 0.53 0.65 -2.65 -1.23 0.00 0.00 174.94 173.06 1rxc n PRO 229 N 3.23 -0.34 0.00 2.79 -0.02 -1.26 -5.01 135.00 134.39 1rxc n PRO 229 Ca -0.18 -0.05 -0.00 0.00 -2.02 0.00 0.00 63.50 61.25 1rxc n PRO 229 Cb 0.53 -2.03 -0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1rxc n PRO 229 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1rxc h ASN 230 N -1.67 -0.01 0.00 2.55 2.35 -2.00 -3.52 115.58 113.29 1rxc h ASN 230 Ca -0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1rxc h ASN 230 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 1rxc h ASN 230 CO 0.36 0.02 0.00 0.00 -1.65 0.00 0.00 177.43 176.16 1rxc n ALA 231 N -2.04 0.00 -2.78 -0.83 0.00 -1.26 -5.25 120.51 108.35 1rxc n ALA 231 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1rxc n ALA 231 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 1rxc n ALA 231 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1rxc n SER 239 N 0.00 -0.58 0.07 0.00 3.41 -1.26 -5.29 113.62 109.97 1rxc n SER 239 Ca 0.00 -2.90 -0.04 0.00 -0.26 0.00 0.00 58.87 55.68 1rxc n SER 239 Cb 0.00 0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 1rxc n SER 239 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1rxc h HIS 240 N 2.67 0.00 -0.37 7.33 -0.00 -1.99 -3.25 115.15 119.55 1rxc h HIS 240 Ca -0.12 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.13 1rxc h HIS 240 Cb 1.16 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.56 1rxc h HIS 240 CO 0.33 0.81 -0.26 0.00 -0.00 0.00 0.00 177.93 178.82 1rxc h ALA 241 N 1.19 0.86 -0.37 2.45 0.00 -1.93 -2.67 119.26 118.80 1rxc h ALA 241 Ca -0.05 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1rxc h ALA 241 Cb 1.66 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 1rxc h ALA 241 CO 0.10 0.63 0.09 0.28 0.00 0.00 0.00 179.25 180.35 1rxc h VAL 242 N 0.65 1.22 -0.49 0.00 2.07 -1.97 -0.30 116.25 117.42 1rxc h VAL 242 Ca 0.08 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.82 1rxc h VAL 242 Cb 0.77 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1rxc h VAL 242 CO 0.06 0.26 0.19 0.50 0.02 0.00 0.00 177.57 178.60 1rxc h LYS 243 N 0.45 0.71 -0.31 1.57 3.64 -1.58 -2.49 116.57 118.55 1rxc h LYS 243 Ca 0.12 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 1rxc h LYS 243 Cb 0.30 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1rxc h LYS 243 CO 0.00 0.59 -0.31 0.82 -2.27 0.00 0.00 179.45 178.29 1rxc h ILE 244 N 0.70 1.29 -0.16 2.00 2.04 -1.09 -2.52 117.51 119.78 1rxc h ILE 244 Ca 0.17 -1.48 -0.14 0.00 1.00 0.00 0.00 64.86 64.42 1rxc h ILE 244 Cb 0.15 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1rxc h ILE 244 CO -0.02 0.48 -0.49 1.62 0.00 0.00 0.00 178.15 179.75 1rxc h VAL 245 N 0.52 1.33 -0.20 1.67 3.04 -0.81 -0.60 116.25 121.20 1rxc h VAL 245 Ca 0.05 -1.71 -0.06 0.00 -1.01 0.00 0.00 66.70 63.97 1rxc h VAL 245 Cb 0.88 1.74 -0.00 0.00 -2.01 0.00 0.00 31.29 31.90 1rxc h VAL 245 CO 0.08 0.52 -0.12 0.58 -1.01 0.00 0.00 177.57 177.62 1rxc h VAL 246 N 0.33 1.31 -0.48 1.51 2.07 -1.49 -1.53 116.25 117.97 1rxc h VAL 246 Ca 0.02 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 1rxc h VAL 246 Cb 0.98 1.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 1rxc h VAL 246 CO 0.08 0.37 0.07 -0.08 0.02 0.00 0.00 177.57 178.04 1rxc h GLU 247 N 0.13 0.75 -0.59 1.57 4.57 -1.23 -1.46 114.58 118.32 1rxc h GLU 247 Ca 0.04 -0.16 -0.08 0.00 -1.18 0.00 0.00 59.36 57.98 1rxc h GLU 247 Cb 0.63 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 1rxc h GLU 247 CO 0.03 0.71 0.04 0.00 -1.18 0.00 0.00 179.01 178.61 1rxc h ALA 248 N 1.36 0.79 -0.98 2.92 0.00 -1.04 -2.70 119.26 119.61 1rxc h ALA 248 Ca 0.15 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.84 1rxc h ALA 248 Cb 0.33 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1rxc h ALA 248 CO 0.01 0.59 0.63 0.00 0.00 0.00 0.00 179.25 180.48 1rxc h ALA 249 N 0.99 1.35 -0.98 0.00 0.00 -0.70 -1.24 119.26 118.68 1rxc h ALA 249 Ca 0.17 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1rxc h ALA 249 Cb 0.50 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1rxc h ALA 249 CO 0.02 0.44 0.63 -0.09 0.00 0.00 0.00 179.25 180.25 1rxc h ARG 250 N 1.16 1.11 0.00 0.00 2.43 -0.98 -2.19 114.38 115.91 1rxc h ARG 250 Ca 0.42 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1rxc h ARG 250 Cb 0.14 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1rxc h ARG 250 CO -0.16 0.73 0.00 0.54 -1.51 0.00 0.00 179.97 179.57 1rxc n ARG 251 N -4.53 0.04 -0.00 0.20 1.74 -0.51 -3.53 116.66 110.07 1rxc n ARG 251 Ca 0.15 0.09 0.07 0.00 -0.77 0.00 0.00 57.85 57.40 1rxc n ARG 251 Cb 0.19 -1.56 -0.09 0.00 -1.02 0.00 0.00 32.46 29.99 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 -1.63 0.64 0.00 0.55 4.77 -0.86 -5.03 117.00 115.43 1rxc n LEU 252 Ca 0.06 -0.45 0.04 0.00 -0.03 0.00 0.00 56.01 55.63 1rxc n LEU 252 Cb 0.32 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.63 1rxc n LEU 252 CO 0.25 0.16 0.46 0.18 -1.33 0.00 0.00 177.39 177.10