#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 1.22 -4.03 -3.46 8.00 -0.66 -4.90 116.55 112.72 1rxc n ASP 5 Ca 0.00 -1.46 -0.08 0.00 0.71 0.00 0.00 54.79 53.95 1rxc n ASP 5 Cb 0.00 -0.02 -0.11 0.00 -0.02 0.00 0.00 41.12 40.97 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 -1.95 0.17 0.14 2.53 -7.23 -1.24 -5.04 120.40 107.78 1rxc s VAL 6 Ca 0.38 -1.34 -0.03 0.00 -1.81 0.00 0.00 61.98 59.17 1rxc s VAL 6 Cb 0.20 -0.87 -0.17 0.00 0.56 0.00 0.00 36.38 36.10 1rxc s VAL 6 CO 0.32 -0.73 1.32 0.15 -0.31 0.00 0.00 175.10 175.84 1rxc h PHE 7 N 3.93 0.55 0.00 2.82 3.57 -1.95 -3.39 116.94 122.48 1rxc h PHE 7 Ca -0.33 -0.30 -0.25 0.00 3.53 0.00 0.00 57.97 60.62 1rxc h PHE 7 Cb 1.18 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 1rxc h PHE 7 CO 0.60 1.12 -1.94 0.72 -2.23 0.00 0.00 178.31 176.57 1rxc n HIS 8 N -3.73 0.00 0.13 0.41 8.25 -1.26 -4.74 115.22 114.29 1rxc n HIS 8 Ca -0.06 0.00 -0.00 0.00 -0.26 0.00 0.00 57.72 57.40 1rxc n HIS 8 Cb 0.83 -0.63 0.13 0.00 1.12 0.00 0.00 29.99 31.44 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 -0.06 0.00 -1.22 2.41 3.38 -1.92 -3.43 115.31 114.47 1rxc h LEU 9 Ca -0.38 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 1rxc h LEU 9 Cb 1.55 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.33 1rxc h LEU 9 CO -0.08 0.62 -0.15 0.61 0.09 0.00 0.00 178.44 179.53 1rxc n GLY 10 N 0.61 0.55 3.28 0.83 0.00 -1.26 -4.59 105.19 104.60 1rxc n GLY 10 Ca -0.00 -0.45 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.48 2.52 0.31 0.99 1.43 -1.26 -4.79 118.68 115.40 1rxc s LEU 11 Ca 0.09 -0.98 0.10 0.00 -1.03 0.00 0.00 54.13 52.31 1rxc s LEU 11 Cb -0.04 -0.47 -0.05 0.00 0.03 0.00 0.00 46.19 45.65 1rxc s LEU 11 CO 0.15 -0.25 -0.07 0.42 0.23 0.00 0.00 176.35 176.83 1rxc s THR 12 N -3.03 2.63 0.23 5.49 -4.23 -1.26 -1.65 115.64 113.82 1rxc s THR 12 Ca 0.17 -2.13 -0.07 0.00 -1.18 0.00 0.00 61.69 58.48 1rxc s THR 12 Cb 0.00 -2.64 0.19 0.00 1.34 0.00 0.00 72.50 71.39 1rxc s THR 12 CO 0.03 -0.28 1.72 0.50 -0.54 0.00 0.00 174.62 176.05 1rxc h LYS 13 N 1.99 0.37 -0.72 3.99 3.64 -1.95 -2.22 116.57 121.67 1rxc h LYS 13 Ca -0.42 -0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.09 1rxc h LYS 13 Cb 1.25 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 32.88 1rxc h LYS 13 CO 0.65 0.25 0.17 -0.91 -2.27 0.00 0.00 179.45 177.34 1rxc h ASN 14 N 0.38 0.01 -0.21 4.20 2.35 -1.96 -2.32 115.58 118.03 1rxc h ASN 14 Ca 0.36 0.14 0.06 0.00 -0.55 0.00 0.00 56.30 56.31 1rxc h ASN 14 Cb 0.53 0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.08 1rxc h ASN 14 CO -0.39 -0.03 0.15 0.44 -1.65 0.00 0.00 177.43 175.95 1rxc h ASP 15 N 0.27 0.03 1.27 5.81 3.32 -1.80 -1.28 116.42 124.03 1rxc h ASP 15 Ca 0.41 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 1rxc h ASP 15 Cb 0.68 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 1rxc h ASP 15 CO -0.50 0.02 -0.06 -0.07 -1.72 0.00 0.00 179.24 176.91 1rxc h LEU 16 N 0.03 0.00 -1.05 1.55 4.07 -1.45 -3.47 115.31 114.99 1rxc h LEU 16 Ca 0.10 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.55 1rxc h LEU 16 Cb 0.36 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 42.00 1rxc h LEU 16 CO -0.00 0.06 -0.79 0.00 -1.08 0.00 0.00 178.44 176.62 1rxc n GLN 17 N -3.15 -4.59 -0.86 1.13 6.02 -0.49 -1.22 117.38 114.23 1rxc n GLN 17 Ca 0.01 0.51 0.00 0.00 -0.01 0.00 0.00 57.00 57.51 1rxc n GLN 17 Cb 0.40 -5.33 0.00 0.00 1.02 0.00 0.00 30.24 26.33 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 0.70 3.65 1.08 0.00 -1.26 -4.75 105.19 103.02 1rxc n GLY 18 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 1rxc n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rxc n ALA 19 N 0.58 0.71 0.01 4.61 0.00 -0.36 -4.91 120.51 121.16 1rxc n ALA 19 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1rxc n ALA 19 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.24 1rxc n ALA 19 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1rxc n THR 20 N 1.57 0.00 -4.90 0.00 -2.24 -1.26 -4.33 114.28 103.13 1rxc n THR 20 Ca 0.11 -0.50 -0.27 0.00 -2.27 0.00 0.00 64.05 61.13 1rxc n THR 20 Cb 0.31 1.00 -0.16 0.00 -2.10 0.00 0.00 70.33 69.38 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 -0.75 1.95 -0.04 3.22 0.20 -1.26 -0.49 118.68 121.52 1rxc s LEU 21 Ca 0.00 -0.37 0.04 0.00 0.69 0.00 0.00 54.13 54.49 1rxc s LEU 21 Cb 0.00 -1.02 -0.00 0.00 -0.43 0.00 0.00 46.19 44.74 1rxc s LEU 21 CO 0.00 0.18 -0.15 0.00 -0.29 0.00 0.00 176.35 176.09 1rxc s ALA 22 N -0.05 1.35 -0.19 5.97 0.00 -0.14 -1.43 121.76 127.26 1rxc s ALA 22 Ca -0.02 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 1rxc s ALA 22 Cb -0.11 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 1rxc s ALA 22 CO 0.02 0.24 0.29 0.42 0.00 0.00 0.00 175.76 176.73 1rxc s ILE 23 N 0.10 5.29 -0.46 0.00 1.01 0.80 -1.70 121.20 126.23 1rxc s ILE 23 Ca -0.04 0.51 0.03 0.00 0.00 0.00 0.00 60.65 61.15 1rxc s ILE 23 Cb -0.11 -3.63 0.12 0.00 0.01 0.00 0.00 42.46 38.86 1rxc s ILE 23 CO 0.02 0.34 0.21 0.68 0.00 0.00 0.00 174.94 176.19 1rxc s VAL 24 N 0.84 2.23 0.75 2.92 -7.23 -0.10 -1.60 120.40 118.22 1rxc s VAL 24 Ca 0.15 -2.92 -0.12 0.00 -1.81 0.00 0.00 61.98 57.29 1rxc s VAL 24 Cb -0.13 -2.57 0.04 0.00 0.56 0.00 0.00 36.38 34.27 1rxc s VAL 24 CO 0.05 -0.78 1.11 -2.16 -0.31 0.00 0.00 175.10 173.01 1rxc s PRO 25 N 0.13 2.47 0.02 4.82 0.04 -1.25 -3.39 135.00 137.84 1rxc s PRO 25 Ca 0.16 0.45 -0.04 0.00 0.04 0.00 0.00 61.00 61.61 1rxc s PRO 25 Cb -0.24 -1.98 -0.28 0.00 0.04 0.00 0.00 34.50 32.04 1rxc s PRO 25 CO -0.02 -1.31 0.92 0.78 0.04 0.00 0.00 177.00 177.41 1rxc h GLY 26 N -0.85 0.30 -6.36 0.56 0.00 -1.84 -1.59 103.07 93.28 1rxc h GLY 26 Ca -0.46 -0.77 -0.61 0.00 0.00 0.00 0.00 47.33 45.49 1rxc h GLY 26 CO 0.63 0.68 0.20 -0.35 0.00 0.00 0.00 176.54 177.69 1rxc s ASP 27 N -7.03 6.61 0.53 0.19 3.68 -1.26 -1.53 116.67 117.85 1rxc s ASP 27 Ca -0.08 0.75 0.21 0.00 2.13 0.00 0.00 52.55 55.55 1rxc s ASP 27 Cb 0.07 -2.35 1.35 0.00 -1.45 0.00 0.00 42.92 40.54 1rxc s ASP 27 CO 0.86 -0.39 2.09 1.55 0.13 0.00 0.00 175.17 179.42 1rxc h PRO 28 N 7.87 0.00 0.00 4.34 0.13 -1.88 -1.81 132.00 140.64 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 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1rxc h PRO 28 CO 0.78 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.30 1rxc n ASP 29 N -4.42 0.73 0.00 1.44 8.00 -1.26 -2.82 116.55 118.22 1rxc n ASP 29 Ca 0.02 0.66 0.12 0.00 0.71 0.00 0.00 54.79 56.31 1rxc n ASP 29 Cb 0.31 -0.83 0.31 0.00 -0.02 0.00 0.00 41.12 40.90 1rxc n ASP 29 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1rxc n ARG 30 N -2.29 0.02 -0.07 -1.24 0.63 -0.68 -4.35 116.66 108.68 1rxc n ARG 30 Ca 0.02 0.01 -0.14 0.00 -0.92 0.00 0.00 57.85 56.82 1rxc n ARG 30 Cb 0.26 -1.51 -0.05 0.00 0.45 0.00 0.00 32.46 31.60 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 0.00 1.31 -0.73 5.15 2.07 -1.61 -2.48 116.25 119.96 1rxc h VAL 31 Ca 0.00 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 1rxc h VAL 31 Cb 0.52 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1rxc h VAL 31 CO 0.00 0.49 0.41 -0.08 0.02 0.00 0.00 177.57 178.41 1rxc h GLU 32 N 0.38 1.00 -0.65 1.57 4.81 -1.79 -2.03 114.58 117.87 1rxc h GLU 32 Ca 0.02 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1rxc h GLU 32 Cb 0.95 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 1rxc h GLU 32 CO 0.08 0.73 0.09 0.87 -0.73 0.00 0.00 179.01 180.05 1rxc h LYS 33 N 1.01 1.09 -0.15 1.92 6.56 -1.74 -1.70 116.57 123.57 1rxc h LYS 33 Ca 0.26 -0.30 -0.15 0.00 -1.06 0.00 0.00 60.65 59.40 1rxc h LYS 33 Cb 0.01 -0.12 0.01 0.00 -0.57 0.00 0.00 32.23 31.55 1rxc h LYS 33 CO -0.04 1.01 -0.50 0.82 -2.06 0.00 0.00 179.45 178.68 1rxc h ILE 34 N 1.02 1.34 0.00 1.86 2.04 -1.25 -3.14 117.51 119.38 1rxc h ILE 34 Ca 0.20 -1.77 -0.05 0.00 1.00 0.00 0.00 64.86 64.24 1rxc h ILE 34 Cb 0.46 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 1rxc h ILE 34 CO 0.02 0.54 -0.22 0.00 0.00 0.00 0.00 178.15 178.49 1rxc h ALA 35 N 0.53 1.38 0.00 1.87 0.00 -1.28 -2.73 119.26 119.03 1rxc h ALA 35 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1rxc h ALA 35 Cb 1.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1rxc h ALA 35 CO 0.11 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1rxc h ALA 36 N 1.78 1.00 0.00 0.00 0.00 -1.26 -1.35 119.26 119.43 1rxc h ALA 36 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rxc h ALA 36 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1rxc h ALA 36 CO 0.03 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.21 1rxc h LEU 37 N 0.00 0.00-10.57 0.00 -0.00 -1.55 -3.46 115.31 99.73 1rxc h LEU 37 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 57.88 57.40 1rxc h LEU 37 Cb 0.59 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 41.27 1rxc h LEU 37 CO 0.00 0.00 -0.15 -0.04 -0.00 0.00 0.00 178.44 178.25 1rxc s MET 38 N -3.52 2.41 0.19 1.13 -1.94 -0.51 -5.11 119.30 111.95 1rxc s MET 38 Ca 0.03 -1.60 -0.22 0.00 -1.71 0.00 0.00 55.69 52.19 1rxc s MET 38 Cb 0.09 -2.61 -0.08 0.00 2.01 0.00 0.00 34.83 34.24 1rxc s MET 38 CO 0.53 -0.71 0.74 -0.51 -0.01 0.00 0.00 175.02 175.06 1rxc s ASP 39 N -4.56 7.21 -1.28 3.03 -0.00 0.44 -4.44 116.67 117.08 1rxc s ASP 39 Ca 0.58 1.52 -0.02 0.00 -0.00 0.00 0.00 52.55 54.63 1rxc s ASP 39 Cb -0.06 -2.45 -0.00 0.00 -0.00 0.00 0.00 42.92 40.40 1rxc s ASP 39 CO 0.36 0.13 0.71 0.29 -0.00 0.00 0.00 175.17 176.66 1rxc n LYS 40 N 1.18 -4.50 -2.04 8.23 5.02 -1.26 -0.14 118.16 124.64 1rxc n LYS 40 Ca -0.04 0.62 -0.39 0.00 -2.02 0.00 0.00 58.31 56.47 1rxc n LYS 40 Cb 0.50 -5.12 0.00 0.00 -0.02 0.00 0.00 35.03 30.39 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 -5.91 3.84 -0.23 1.97 0.04 -1.26 -4.51 135.00 128.95 1rxc s PRO 41 Ca 0.06 2.12 -0.09 0.00 0.04 0.00 0.00 61.00 63.13 1rxc s PRO 41 Cb -0.01 -2.66 0.09 0.00 0.04 0.00 0.00 34.50 31.96 1rxc s PRO 41 CO 0.81 -0.59 0.50 0.08 0.04 0.00 0.00 177.00 177.85 1rxc s VAL 42 N -1.30 -0.59 0.04 -0.36 1.01 0.15 -4.99 120.40 114.36 1rxc s VAL 42 Ca 0.59 0.10 -0.31 0.00 0.00 0.00 0.00 61.98 62.37 1rxc s VAL 42 Cb -0.37 -0.77 -0.07 0.00 0.00 0.00 0.00 36.38 35.17 1rxc s VAL 42 CO 0.47 0.04 1.49 -0.75 0.00 0.00 0.00 175.10 176.36 1rxc s LYS 43 N 2.42 4.25 -0.24 2.72 2.20 -1.26 -0.73 119.74 129.09 1rxc s LYS 43 Ca -0.05 2.12 -0.18 0.00 -0.36 0.00 0.00 55.97 57.50 1rxc s LYS 43 Cb -0.11 -3.53 -0.16 0.00 -1.51 0.00 0.00 37.83 32.52 1rxc s LYS 43 CO -0.15 -0.62 -0.07 1.28 -0.36 0.00 0.00 175.35 175.43 1rxc n LEU 44 N 5.25 1.91 -3.54 5.43 4.77 -0.53 -4.91 117.00 125.38 1rxc n LEU 44 Ca 0.14 0.38 -0.08 0.00 -0.03 0.00 0.00 56.01 56.42 1rxc n LEU 44 Cb 0.42 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.60 1rxc n LEU 44 CO 0.60 0.43 0.68 0.00 -1.33 0.00 0.00 177.39 177.76 1rxc s ALA 45 N -2.44 -1.78 -0.20 -1.18 0.00 -1.09 -5.02 121.76 110.06 1rxc s ALA 45 Ca -0.34 0.85 -0.06 0.00 0.00 0.00 0.00 51.96 52.41 1rxc s ALA 45 Cb 0.10 0.48 0.10 0.00 0.00 0.00 0.00 23.12 23.80 1rxc s ALA 45 CO 0.54 -0.75 0.40 -1.54 0.00 0.00 0.00 175.76 174.42 1rxc s SER 46 N -2.57 -0.15 -0.03 0.00 1.04 -1.26 -0.32 113.70 110.41 1rxc s SER 46 Ca 0.06 0.85 0.01 0.00 0.48 0.00 0.00 55.95 57.35 1rxc s SER 46 Cb -0.01 1.28 0.02 0.00 0.10 0.00 0.00 66.02 67.40 1rxc s SER 46 CO -0.08 -0.24 -0.04 -1.00 0.98 0.00 0.00 173.24 172.86 1rxc s HIS 47 N 2.59 0.63 0.00 5.02 3.76 -0.85 -4.99 115.29 121.45 1rxc s HIS 47 Ca 0.01 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 54.77 1rxc s HIS 47 Cb -0.13 -0.55 0.00 0.00 1.11 0.00 0.00 32.58 33.02 1rxc s HIS 47 CO -0.13 -0.14 0.00 0.54 -0.85 0.00 0.00 174.74 174.16 1rxc n ARG 48 N 3.79 0.00 -0.02 1.40 1.74 -1.26 -1.87 116.66 120.43 1rxc n ARG 48 Ca -0.23 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 56.98 1rxc n ARG 48 Cb 0.52 0.00 0.56 0.00 -1.02 0.00 0.00 32.46 32.52 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 1.52 -3.36 5.56 0.00 -1.26 -4.75 120.64 132.35 1rxc n GLU 49 Ca 0.00 -0.76 -0.45 0.00 0.00 0.00 0.00 57.16 55.95 1rxc n GLU 49 Cb 0.00 -1.44 -0.06 0.00 0.00 0.00 0.00 31.44 29.94 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 -1.94 3.31 -0.20 -1.84 0.40 -0.78 -3.89 117.98 113.03 1rxc s PHE 50 Ca 0.37 -1.45 -0.07 0.00 -0.60 0.00 0.00 56.93 55.19 1rxc s PHE 50 Cb 0.19 -3.74 -0.03 0.00 0.51 0.00 0.00 43.02 39.95 1rxc s PHE 50 CO 0.31 -1.01 0.05 0.99 0.70 0.00 0.00 175.22 176.26 1rxc s THR 51 N 1.47 4.47 -0.07 0.64 2.01 -1.26 -2.01 115.64 120.89 1rxc s THR 51 Ca 0.04 -0.14 0.05 0.00 0.31 0.00 0.00 61.69 61.95 1rxc s THR 51 Cb -0.28 -3.03 -0.01 0.00 0.01 0.00 0.00 72.50 69.18 1rxc s THR 51 CO 0.02 0.42 -0.22 -0.89 -0.69 0.00 0.00 174.62 173.26 1rxc s THR 52 N 0.82 2.37 0.13 -0.82 2.01 0.56 -1.25 115.64 119.46 1rxc s THR 52 Ca 0.03 -0.95 0.08 0.00 0.31 0.00 0.00 61.69 61.16 1rxc s THR 52 Cb -0.14 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.44 1rxc s THR 52 CO 0.02 0.57 -0.19 0.26 -0.69 0.00 0.00 174.62 174.59 1rxc s TRP 53 N -0.18 1.74 -0.06 4.92 0.52 0.71 -1.45 118.94 125.15 1rxc s TRP 53 Ca -0.02 -0.45 0.00 0.00 0.02 0.00 0.00 56.10 55.65 1rxc s TRP 53 Cb -0.14 -0.92 -0.03 0.00 -1.15 0.00 0.00 33.47 31.24 1rxc s TRP 53 CO 0.04 0.25 -0.04 0.50 0.02 0.00 0.00 176.95 177.71 1rxc s ARG 54 N -2.33 2.79 0.00 4.98 3.52 0.09 -1.17 118.95 126.82 1rxc s ARG 54 Ca 0.10 -0.54 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 1rxc s ARG 54 Cb -0.08 -2.64 0.00 0.00 -1.56 0.00 0.00 34.95 30.67 1rxc s ARG 54 CO 0.05 0.66 0.00 0.00 -0.81 0.00 0.00 175.30 175.20 1rxc n ALA 55 N 2.03 0.00 -3.30 6.12 0.00 -0.40 -0.68 120.51 124.28 1rxc n ALA 55 Ca -0.17 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.13 1rxc n ALA 55 Cb 0.53 0.00 -0.15 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 -1.03 0.04 -0.15 0.00 2.02 0.80 -1.46 118.70 118.91 1rxc s GLU 56 Ca 0.00 0.07 -0.01 0.00 0.02 0.00 0.00 54.97 55.05 1rxc s GLU 56 Cb 0.00 -0.17 0.04 0.00 0.10 0.00 0.00 34.13 34.10 1rxc s GLU 56 CO 0.00 -0.07 -0.04 -1.17 0.02 0.00 0.00 175.26 174.00 1rxc s LEU 57 N 0.51 1.42 -1.47 1.80 2.96 -0.49 -0.42 118.68 122.99 1rxc s LEU 57 Ca -0.04 -0.59 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 1rxc s LEU 57 Cb -0.07 -0.82 0.06 0.00 0.50 0.00 0.00 46.19 45.87 1rxc s LEU 57 CO -0.01 -0.19 1.05 0.47 -1.32 0.00 0.00 176.35 176.34 1rxc n ASP 58 N 4.93 -5.22 -0.14 3.68 8.00 -1.26 -2.35 116.55 124.19 1rxc n ASP 58 Ca -0.11 -0.70 -0.02 0.00 0.71 0.00 0.00 54.79 54.67 1rxc n ASP 58 Cb 0.48 -4.26 -0.01 0.00 -0.02 0.00 0.00 41.12 37.31 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 -1.79 0.43 3.47 0.44 0.00 -1.26 -5.01 105.19 101.47 1rxc n GLY 59 Ca 0.02 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.28 2.98 0.37 1.61 -0.14 -0.99 -5.08 119.74 117.21 1rxc s LYS 60 Ca 0.00 -0.64 -0.27 0.00 -1.36 0.00 0.00 55.97 53.70 1rxc s LYS 60 Cb 0.00 -2.57 -0.09 0.00 -1.68 0.00 0.00 37.83 33.49 1rxc s LYS 60 CO 0.00 0.45 1.26 -1.25 -0.76 0.00 0.00 175.35 175.05 1rxc s PRO 61 N -0.27 4.14 -0.02 -1.68 0.04 -1.26 -1.40 135.00 134.56 1rxc s PRO 61 Ca 0.02 2.08 -0.03 0.00 0.04 0.00 0.00 61.00 63.11 1rxc s PRO 61 Cb -0.13 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.56 1rxc s PRO 61 CO 0.03 -0.32 0.08 0.08 0.04 0.00 0.00 177.00 176.91 1rxc s VAL 62 N -1.25 0.03 -0.08 -0.36 1.01 -0.53 -4.34 120.40 114.88 1rxc s VAL 62 Ca 0.54 -0.24 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 1rxc s VAL 62 Cb -0.36 -0.20 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1rxc s VAL 62 CO 0.47 -0.13 0.09 -0.63 0.00 0.00 0.00 175.10 174.90 1rxc s ILE 63 N -0.40 5.00 -0.12 2.22 -1.09 -0.52 -1.28 121.20 125.01 1rxc s ILE 63 Ca -0.05 -0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.32 1rxc s ILE 63 Cb -0.03 -3.20 0.01 0.00 -1.58 0.00 0.00 42.46 37.66 1rxc s ILE 63 CO 0.00 0.54 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.36 1rxc s VAL 64 N -1.05 1.85 -0.13 2.92 1.01 -0.32 -0.14 120.40 124.54 1rxc s VAL 64 Ca 0.17 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 61.23 1rxc s VAL 64 Cb -0.12 -1.64 0.06 0.00 0.00 0.00 0.00 36.38 34.67 1rxc s VAL 64 CO 0.07 0.51 0.29 0.00 0.00 0.00 0.00 175.10 175.97 1rxc s SER 66 N 1.66 6.61 -0.00 0.00 1.04 -0.38 -3.79 113.70 118.84 1rxc s SER 66 Ca -0.06 1.83 0.16 0.00 0.48 0.00 0.00 55.95 58.36 1rxc s SER 66 Cb -0.11 -2.55 -0.18 0.00 0.10 0.00 0.00 66.02 63.28 1rxc s SER 66 CO -0.10 -0.59 0.62 0.35 0.98 0.00 0.00 173.24 174.51 1rxc n THR 67 N -0.80 0.00 -1.02 2.02 -2.24 -0.60 -4.38 114.28 107.27 1rxc n THR 67 Ca 0.08 -0.16 0.14 0.00 -2.27 0.00 0.00 64.05 61.84 1rxc n THR 67 Cb 0.53 0.87 -0.04 0.00 -2.10 0.00 0.00 70.33 69.60 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 1.40 -1.74 3.70 3.38 0.00 -0.58 -3.11 105.19 108.23 1rxc n GLY 68 Ca 0.02 -1.27 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.90 4.88 0.00 -0.61 1.01 -1.26 -4.70 121.20 118.62 1rxc s ILE 69 Ca 0.00 1.85 0.00 0.00 0.00 0.00 0.00 60.65 62.50 1rxc s ILE 69 Cb 0.00 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.24 1rxc s ILE 69 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.65 1rxc n GLY 70 N 3.12 2.72 0.21 6.18 0.00 -1.26 -4.67 105.19 111.48 1rxc n GLY 70 Ca 0.05 -1.87 -0.02 0.00 0.00 0.00 0.00 46.02 44.18 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 0.69 0.48 -0.02 0.00 -1.87 -2.28 103.07 100.06 1rxc h GLY 71 Ca 0.00 -0.09 0.02 0.00 0.00 0.00 0.00 47.33 47.26 1rxc h GLY 71 CO 0.00 -0.01 -0.28 -2.55 0.00 0.00 0.00 176.54 173.70 1rxc h PRO 72 N 0.34 -0.46 -0.18 4.80 0.11 -1.94 0.37 132.00 135.03 1rxc h PRO 72 Ca 0.25 0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.27 1rxc h PRO 72 Cb 0.29 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1rxc h PRO 72 CO -0.27 -0.31 -0.44 0.66 -0.21 0.00 0.00 178.00 177.43 1rxc h SER 73 N -0.48 0.48 -0.47 -2.05 4.64 -1.78 -2.32 113.55 111.56 1rxc h SER 73 Ca 0.04 -0.22 0.08 0.00 -0.47 0.00 0.00 61.79 61.21 1rxc h SER 73 Cb 0.52 -0.13 -0.06 0.00 -0.31 0.00 0.00 62.40 62.41 1rxc h SER 73 CO -0.18 0.86 0.11 0.74 -0.87 0.00 0.00 176.83 177.48 1rxc h THR 74 N 0.36 0.76 0.00 2.95 2.02 -1.19 -2.00 112.91 115.81 1rxc h THR 74 Ca 0.03 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 1rxc h THR 74 Cb 0.92 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1rxc h THR 74 CO 0.08 0.04 -0.23 0.77 0.37 0.00 0.00 175.52 176.55 1rxc h SER 75 N 0.25 0.00 -0.21 4.18 4.64 0.26 -0.87 113.55 121.79 1rxc h SER 75 Ca 0.23 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.47 1rxc h SER 75 Cb 0.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1rxc h SER 75 CO -0.30 0.23 -0.19 0.40 -0.87 0.00 0.00 176.83 176.10 1rxc h ILE 76 N 0.00 1.32 -0.38 0.95 2.04 -1.07 -2.77 117.51 117.59 1rxc h ILE 76 Ca -0.00 -1.35 -0.14 0.00 1.00 0.00 0.00 64.86 64.37 1rxc h ILE 76 Cb 0.42 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1rxc h ILE 76 CO 0.03 0.41 -0.30 0.00 0.00 0.00 0.00 178.15 178.30 1rxc h ALA 77 N 0.66 0.55 0.08 1.87 0.00 -0.62 -1.85 119.26 119.95 1rxc h ALA 77 Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 1rxc h ALA 77 Cb 0.74 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1rxc h ALA 77 CO 0.05 0.59 -0.04 0.28 0.00 0.00 0.00 179.25 180.13 1rxc h VAL 78 N 0.68 1.10 -0.70 0.00 2.07 -1.29 -1.37 116.25 116.75 1rxc h VAL 78 Ca 0.07 -0.70 0.09 0.00 0.82 0.00 0.00 66.70 66.99 1rxc h VAL 78 Cb 0.88 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 32.13 1rxc h VAL 78 CO 0.08 0.17 0.34 -0.08 0.02 0.00 0.00 177.57 178.10 1rxc h GLU 79 N -0.43 0.57 0.07 1.57 4.57 -1.48 -0.32 114.58 119.13 1rxc h GLU 79 Ca -0.01 -0.03 -0.25 0.00 -1.18 0.00 0.00 59.36 57.89 1rxc h GLU 79 Cb 0.37 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1rxc h GLU 79 CO 0.02 0.38 -1.12 0.93 -1.18 0.00 0.00 179.01 178.04 1rxc h GLU 80 N 0.59 0.20 -0.49 1.92 5.08 -1.28 -1.26 114.58 119.35 1rxc h GLU 80 Ca 0.34 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1rxc h GLU 80 Cb 0.36 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1rxc h GLU 80 CO -0.27 1.12 0.09 -0.07 -1.00 0.00 0.00 179.01 178.88 1rxc h LEU 81 N 0.07 0.71 -0.46 1.33 3.38 -1.13 -2.69 115.31 116.51 1rxc h LEU 81 Ca -0.09 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 1rxc h LEU 81 Cb 1.84 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 1rxc h LEU 81 CO 0.17 0.72 -0.17 0.00 0.09 0.00 0.00 178.44 179.25 1rxc h ALA 82 N 1.37 0.65 -0.33 1.53 0.00 -0.73 -1.52 119.26 120.22 1rxc h ALA 82 Ca 0.16 -0.37 0.08 0.00 0.00 0.00 0.00 54.91 54.78 1rxc h ALA 82 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1rxc h ALA 82 CO 0.00 0.60 0.23 1.96 0.00 0.00 0.00 179.25 182.05 1rxc h GLN 83 N 0.78 0.09 -0.00 0.00 4.20 -1.13 -2.14 115.11 116.90 1rxc h GLN 83 Ca 0.11 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1rxc h GLN 83 Cb 0.74 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1rxc h GLN 83 CO 0.06 0.06 -0.18 1.28 -0.67 0.00 0.00 178.83 179.37 1rxc n LEU 84 N -4.46 0.37 0.00 1.46 4.77 -0.74 -4.93 117.00 113.47 1rxc n LEU 84 Ca 0.05 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1rxc n LEU 84 Cb 0.35 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1rxc n LEU 84 CO 0.35 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1rxc n GLY 85 N 1.39 1.01 3.71 -0.72 0.00 -0.80 -4.79 105.19 104.98 1rxc n GLY 85 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 4.42 0.00 -0.61 -1.09 -0.65 -4.44 121.20 116.83 1rxc s ILE 86 Ca 0.00 1.75 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 1rxc s ILE 86 Cb 0.00 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 1rxc s ILE 86 CO 0.00 0.14 0.00 0.54 -1.23 0.00 0.00 174.94 174.39 1rxc n ARG 87 N 3.84 5.60 -4.18 2.79 5.12 0.36 -4.18 116.66 126.00 1rxc n ARG 87 Ca 0.07 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.75 1rxc n ARG 87 Cb 0.49 -0.51 -0.17 0.00 -1.16 0.00 0.00 32.46 31.11 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 -1.01 0.90 -0.13 0.55 2.01 -1.01 -1.23 115.64 115.73 1rxc s THR 88 Ca 0.00 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1rxc s THR 88 Cb 0.00 -0.89 0.02 0.00 0.01 0.00 0.00 72.50 71.64 1rxc s THR 88 CO 0.00 0.32 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.76 1rxc s PHE 89 N 1.20 1.95 -0.27 4.92 0.08 -0.23 -0.97 117.98 124.67 1rxc s PHE 89 Ca -0.05 -1.03 -0.03 0.00 0.12 0.00 0.00 56.93 55.94 1rxc s PHE 89 Cb -0.14 -1.46 0.03 0.00 -0.57 0.00 0.00 43.02 40.88 1rxc s PHE 89 CO -0.02 -0.58 -0.01 -0.51 -0.10 0.00 0.00 175.22 174.00 1rxc s LEU 90 N 1.39 3.55 0.02 -0.37 1.43 -0.69 -1.88 118.68 122.13 1rxc s LEU 90 Ca 0.02 -0.95 -0.24 0.00 -1.03 0.00 0.00 54.13 51.93 1rxc s LEU 90 Cb -0.13 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 1rxc s LEU 90 CO -0.08 -0.18 0.72 -0.60 0.23 0.00 0.00 176.35 176.44 1rxc s ARG 91 N 1.35 4.45 -0.14 1.70 3.52 0.03 -0.92 118.95 128.94 1rxc s ARG 91 Ca -0.01 0.97 0.01 0.00 -0.13 0.00 0.00 55.73 56.58 1rxc s ARG 91 Cb -0.18 -3.37 -0.00 0.00 -1.56 0.00 0.00 34.95 29.84 1rxc s ARG 91 CO -0.02 0.27 -0.17 -1.50 -0.81 0.00 0.00 175.30 173.07 1rxc s ILE 92 N 0.02 2.55 0.30 4.11 1.10 -1.22 -1.75 121.20 126.32 1rxc s ILE 92 Ca 0.37 -0.82 0.05 0.00 -0.51 0.00 0.00 60.65 59.73 1rxc s ILE 92 Cb -0.20 -2.05 -0.03 0.00 0.15 0.00 0.00 42.46 40.33 1rxc s ILE 92 CO 0.21 0.53 0.23 -0.83 -2.11 0.00 0.00 174.94 172.97 1rxc s GLY 93 N 0.62 2.11 0.23 1.50 0.00 -0.85 -4.10 107.32 106.83 1rxc s GLY 93 Ca -0.09 -1.93 0.08 0.00 0.00 0.00 0.00 44.72 42.78 1rxc s GLY 93 CO 0.03 -1.48 0.08 -0.51 0.00 0.00 0.00 173.10 171.22 1rxc s THR 94 N -3.62 3.97 0.09 0.90 -4.23 -1.26 -1.90 115.64 109.59 1rxc s THR 94 Ca 0.39 -1.53 -0.25 0.00 -1.18 0.00 0.00 61.69 59.12 1rxc s THR 94 Cb 0.04 -3.09 0.08 0.00 1.34 0.00 0.00 72.50 70.87 1rxc s THR 94 CO 0.23 -0.27 0.70 0.28 -0.54 0.00 0.00 174.62 175.01 1rxc s THR 95 N -2.06 0.00 -0.23 3.99 -1.32 -0.89 -4.87 115.64 110.26 1rxc s THR 95 Ca 0.31 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.77 1rxc s THR 95 Cb -0.08 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.93 1rxc s THR 95 CO 0.22 0.00 -0.07 -0.83 -2.21 0.00 0.00 174.62 171.73 1rxc s GLY 96 N -2.52 1.59 0.43 6.08 0.00 -1.20 -1.72 107.32 109.98 1rxc s GLY 96 Ca 0.01 -1.35 -0.24 0.00 0.00 0.00 0.00 44.72 43.14 1rxc s GLY 96 CO -0.10 0.47 1.15 0.00 0.00 0.00 0.00 173.10 174.62 1rxc s ALA 97 N 1.37 3.05 -0.87 3.20 0.00 -0.55 -1.80 121.76 126.16 1rxc s ALA 97 Ca 0.02 0.90 0.08 0.00 0.00 0.00 0.00 51.96 52.97 1rxc s ALA 97 Cb -0.16 -3.36 0.14 0.00 0.00 0.00 0.00 23.12 19.74 1rxc s ALA 97 CO -0.05 -0.53 0.96 0.44 0.00 0.00 0.00 175.76 176.57 1rxc n ILE 98 N -0.22 0.45 -4.19 0.00 -5.35 0.26 -0.94 119.36 109.38 1rxc n ILE 98 Ca 0.06 -0.73 -0.35 0.00 -0.27 0.00 0.00 62.75 61.46 1rxc n ILE 98 Cb 0.48 0.87 -0.10 0.00 -1.74 0.00 0.00 39.64 39.15 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 -0.83 3.57 0.51 6.28 -1.52 -1.24 -4.80 119.66 121.63 1rxc s GLN 99 Ca 0.13 -0.38 0.34 0.00 -1.95 0.00 0.00 55.36 53.50 1rxc s GLN 99 Cb 0.08 -3.02 1.50 0.00 -0.22 0.00 0.00 33.01 31.34 1rxc s GLN 99 CO 0.11 0.44 2.00 -1.00 -0.25 0.00 0.00 175.29 176.59 1rxc h PRO 100 N 6.08 0.00 -0.00 2.91 0.13 -1.96 -2.79 132.00 136.37 1rxc h PRO 100 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1rxc h PRO 100 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1rxc h PRO 100 CO 0.63 0.00 -0.18 -2.39 -0.23 0.00 0.00 178.00 175.83 1rxc n HIS 101 N -2.90 0.00 -3.34 1.56 1.44 -1.26 -4.77 115.22 105.95 1rxc n HIS 101 Ca 0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 1rxc n HIS 101 Cb 0.23 -0.30 -0.09 0.00 0.12 0.00 0.00 29.99 29.96 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 -2.78 5.11 0.35 0.61 1.01 -1.05 -5.07 121.20 119.38 1rxc s ILE 102 Ca 0.19 -0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.69 1rxc s ILE 102 Cb 0.19 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1rxc s ILE 102 CO 0.55 -0.28 0.60 0.20 0.00 0.00 0.00 174.94 176.02 1rxc s ASN 103 N 1.78 6.35 0.35 3.58 0.02 -1.26 -4.86 114.94 120.90 1rxc s ASN 103 Ca 0.13 0.65 -0.28 0.00 -1.02 0.00 0.00 52.86 52.33 1rxc s ASN 103 Cb -0.17 -2.12 -0.11 0.00 0.02 0.00 0.00 41.25 38.88 1rxc s ASN 103 CO 0.13 -0.31 1.41 -0.69 0.02 0.00 0.00 177.10 177.65 1rxc s VAL 104 N -2.31 2.37 0.00 1.60 1.01 -1.26 -1.99 120.40 119.81 1rxc s VAL 104 Ca 0.43 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1rxc s VAL 104 Cb -0.10 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1rxc s VAL 104 CO 0.35 0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.15 1rxc n GLY 105 N 0.68 3.11 3.63 4.51 0.00 -0.98 -5.04 105.19 111.11 1rxc n GLY 105 Ca 0.01 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.74 1rxc n GLY 105 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rxc n ASP 106 N 0.62 -0.07 -4.40 1.61 10.43 -0.84 -4.54 116.55 119.35 1rxc n ASP 106 Ca 0.00 0.33 -0.32 0.00 2.57 0.00 0.00 54.79 57.37 1rxc n ASP 106 Cb 0.00 -1.43 -0.14 0.00 1.84 0.00 0.00 41.12 41.38 1rxc n ASP 106 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1rxc s VAL 107 N -2.59 2.59 -0.20 2.53 1.01 -0.97 -1.32 120.40 121.44 1rxc s VAL 107 Ca 0.67 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.67 1rxc s VAL 107 Cb -0.23 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 34.19 1rxc s VAL 107 CO 0.59 0.52 -0.14 -0.76 0.00 0.00 0.00 175.10 175.32 1rxc s LEU 108 N -0.85 2.43 -0.23 3.92 1.43 -0.30 -1.55 118.68 123.52 1rxc s LEU 108 Ca 0.12 -0.88 -0.13 0.00 -1.03 0.00 0.00 54.13 52.21 1rxc s LEU 108 Cb -0.10 -1.39 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 1rxc s LEU 108 CO 0.01 -0.09 0.28 -0.69 0.23 0.00 0.00 176.35 176.08 1rxc s VAL 109 N 1.30 5.27 -0.21 -1.59 1.01 -0.74 -1.47 120.40 123.97 1rxc s VAL 109 Ca -0.00 0.43 -0.19 0.00 0.00 0.00 0.00 61.98 62.23 1rxc s VAL 109 Cb -0.16 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1rxc s VAL 109 CO -0.09 0.29 0.53 -0.89 0.00 0.00 0.00 175.10 174.93 1rxc s THR 110 N 1.28 5.09 0.01 3.92 2.01 -0.69 -2.55 115.64 124.71 1rxc s THR 110 Ca 0.13 0.96 -0.01 0.00 0.31 0.00 0.00 61.69 63.09 1rxc s THR 110 Cb -0.14 -3.85 -0.27 0.00 0.01 0.00 0.00 72.50 68.25 1rxc s THR 110 CO 0.07 0.16 0.86 0.71 -0.69 0.00 0.00 174.62 175.73 1rxc h THR 111 N 5.16 1.16 -2.40 -0.82 1.35 -1.28 -3.40 112.91 112.67 1rxc h THR 111 Ca -0.33 -2.83 0.12 0.00 -0.55 0.00 0.00 66.41 62.82 1rxc h THR 111 Cb 1.15 2.72 -0.12 0.00 -1.73 0.00 0.00 68.15 70.18 1rxc h THR 111 CO 0.74 0.80 0.45 0.00 -0.25 0.00 0.00 175.52 177.26 1rxc s ALA 112 N -2.62 -1.71 0.04 6.62 0.00 -1.25 -1.39 121.76 121.45 1rxc s ALA 112 Ca -0.08 0.58 0.08 0.00 0.00 0.00 0.00 51.96 52.54 1rxc s ALA 112 Cb 0.07 0.56 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 1rxc s ALA 112 CO 0.84 -0.84 -0.22 -1.12 0.00 0.00 0.00 175.76 174.42 1rxc s SER 113 N -2.69 2.62 -0.09 0.00 0.01 -0.24 -2.09 113.70 111.22 1rxc s SER 113 Ca 0.07 -0.54 -0.30 0.00 1.31 0.00 0.00 55.95 56.50 1rxc s SER 113 Cb -0.01 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.96 1rxc s SER 113 CO -0.05 0.18 1.36 -0.69 0.41 0.00 0.00 173.24 174.46 1rxc s VAL 114 N -0.80 4.01 -1.15 3.43 1.01 0.60 -4.35 120.40 123.15 1rxc s VAL 114 Ca 0.08 1.28 -0.17 0.00 0.00 0.00 0.00 61.98 63.17 1rxc s VAL 114 Cb -0.09 -3.83 0.12 0.00 0.00 0.00 0.00 36.38 32.58 1rxc s VAL 114 CO 0.02 -0.07 1.47 -0.13 0.00 0.00 0.00 175.10 176.38 1rxc s ARG 115 N 3.18 3.89 -0.58 2.72 0.52 -1.26 -1.84 118.95 125.57 1rxc s ARG 115 Ca 0.61 -2.03 -0.02 0.00 -0.52 0.00 0.00 55.73 53.77 1rxc s ARG 115 Cb -0.27 -5.22 0.36 0.00 0.52 0.00 0.00 34.95 30.34 1rxc s ARG 115 CO 0.21 -1.98 2.07 1.28 0.02 0.00 0.00 175.30 176.90 1rxc n LEU 116 N 7.12 7.31 -4.35 2.53 4.77 -0.57 -4.96 117.00 128.85 1rxc n LEU 116 Ca 0.37 -4.06 -0.18 0.00 -0.03 0.00 0.00 56.01 52.11 1rxc n LEU 116 Cb 0.46 -1.02 -0.10 0.00 -2.33 0.00 0.00 43.42 40.43 1rxc n LEU 116 CO 0.65 1.44 -0.24 1.51 -1.33 0.00 0.00 177.39 179.42 1rxc s ASP 117 N -1.12 1.46 -0.22 -1.43 -4.77 -1.24 -1.92 116.67 107.42 1rxc s ASP 117 Ca 0.54 -1.42 0.07 0.00 -3.30 0.00 0.00 52.55 48.44 1rxc s ASP 117 Cb 0.43 0.18 -0.20 0.00 -1.09 0.00 0.00 42.92 42.23 1rxc s ASP 117 CO -0.06 -0.75 -0.07 0.61 0.70 0.00 0.00 175.17 175.61 1rxc n GLY 118 N -0.53 -0.59 0.22 2.12 0.00 -1.26 -4.64 105.19 100.51 1rxc n GLY 118 Ca -0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 46.02 45.76 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 0.34 1.09 -0.94 4.61 0.00 -1.98 -2.51 119.26 119.88 1rxc h ALA 119 Ca -0.55 -0.37 0.14 0.00 0.00 0.00 0.00 54.91 54.12 1rxc h ALA 119 Cb 2.02 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 19.62 1rxc h ALA 119 CO -0.04 0.57 0.60 0.66 0.00 0.00 0.00 179.25 181.04 1rxc h SER 120 N 0.35 0.77 0.62 0.00 4.64 -1.83 -1.17 113.55 116.92 1rxc h SER 120 Ca 0.04 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1rxc h SER 120 Cb 0.73 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1rxc h SER 120 CO 0.06 0.39 0.00 -0.07 -0.87 0.00 0.00 176.83 176.34 1rxc h LEU 121 N 0.82 0.00 -0.04 5.97 3.38 -1.57 -1.44 115.31 122.43 1rxc h LEU 121 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 1rxc h LEU 121 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1rxc h LEU 121 CO -0.24 0.00 -0.02 1.41 0.09 0.00 0.00 178.44 179.69 1rxc n HIS 122 N -2.54 0.00 -0.01 1.13 8.25 -0.44 -3.91 115.22 117.69 1rxc n HIS 122 Ca 0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.45 1rxc n HIS 122 Cb 0.20 -0.22 -0.02 0.00 1.12 0.00 0.00 29.99 31.07 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 -1.18 0.00 -3.57 4.41 3.72 -0.60 -5.09 117.46 115.15 1rxc n PHE 123 Ca 0.16 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.40 1rxc n PHE 123 Cb 0.22 -0.13 -0.07 0.00 -0.94 0.00 0.00 39.48 38.57 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 -2.07 -1.75 0.94 4.37 0.00 -0.86 -5.01 121.76 117.38 1rxc s ALA 124 Ca -0.02 1.61 -0.11 0.00 0.00 0.00 0.00 51.96 53.43 1rxc s ALA 124 Cb 0.01 -0.51 0.16 0.00 0.00 0.00 0.00 23.12 22.78 1rxc s ALA 124 CO 0.10 -0.35 1.09 -1.25 0.00 0.00 0.00 175.76 175.35 1rxc s PRO 125 N -0.51 0.87 0.41 0.00 0.04 -1.26 -3.95 135.00 130.60 1rxc s PRO 125 Ca -0.06 1.06 0.13 0.00 0.04 0.00 0.00 61.00 62.16 1rxc s PRO 125 Cb -0.02 -1.75 0.97 0.00 0.04 0.00 0.00 34.50 33.74 1rxc s PRO 125 CO 0.06 -2.57 1.92 1.25 0.04 0.00 0.00 177.00 177.70 1rxc h LEU 126 N -1.80 0.47 -2.03 -3.56 5.85 -1.94 -1.22 115.31 111.08 1rxc h LEU 126 Ca -0.50 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.29 1rxc h LEU 126 Cb 1.28 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 1rxc h LEU 126 CO 0.50 0.25 0.10 1.05 -0.34 0.00 0.00 178.44 180.01 1rxc h GLU 127 N 0.51 0.00 -6.75 1.25 9.09 -2.03 -3.42 114.58 113.22 1rxc h GLU 127 Ca 0.37 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 59.25 1rxc h GLU 127 Cb 0.73 0.00 0.07 0.00 -1.65 0.00 0.00 28.75 27.90 1rxc h GLU 127 CO -0.13 0.00 0.84 0.12 0.05 0.00 0.00 179.01 179.89 1rxc s PHE 128 N -5.02 2.90 0.09 2.06 5.36 -0.46 -4.97 117.98 117.94 1rxc s PHE 128 Ca -0.05 0.84 -0.30 0.00 -0.96 0.00 0.00 56.93 56.46 1rxc s PHE 128 Cb 0.18 -3.96 -0.05 0.00 -0.34 0.00 0.00 43.02 38.84 1rxc s PHE 128 CO 0.68 -3.24 0.99 -1.25 -1.46 0.00 0.00 175.22 170.94 1rxc s PRO 129 N -0.18 4.64 -1.42 10.12 0.04 -1.26 -4.94 135.00 141.99 1rxc s PRO 129 Ca 0.63 1.49 -0.14 0.00 0.04 0.00 0.00 61.00 63.02 1rxc s PRO 129 Cb -0.45 -3.38 0.06 0.00 0.04 0.00 0.00 34.50 30.76 1rxc s PRO 129 CO 0.43 0.11 2.12 0.00 0.04 0.00 0.00 177.00 179.70 1rxc n ALA 130 N 3.06 5.18 -2.78 8.56 0.00 -1.26 -4.76 120.51 128.51 1rxc n ALA 130 Ca 0.04 -3.91 -0.36 0.00 0.00 0.00 0.00 53.44 49.21 1rxc n ALA 130 Cb 0.49 -3.51 -0.08 0.00 0.00 0.00 0.00 19.45 16.35 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 3.16 4.92 0.46 0.00 0.11 -1.26 -1.08 120.40 126.71 1rxc s VAL 131 Ca 0.48 -0.01 -0.20 0.00 -2.93 0.00 0.00 61.98 59.31 1rxc s VAL 131 Cb 0.12 -3.12 -0.10 0.00 -1.53 0.00 0.00 36.38 31.76 1rxc s VAL 131 CO -0.05 0.60 0.98 0.00 -3.33 0.00 0.00 175.10 173.30 1rxc s ALA 132 N -0.88 3.00 0.43 1.54 0.00 -0.48 -4.65 121.76 120.72 1rxc s ALA 132 Ca 0.14 0.40 -0.26 0.00 0.00 0.00 0.00 51.96 52.24 1rxc s ALA 132 Cb -0.12 -3.17 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 1rxc s ALA 132 CO 0.03 -0.06 1.40 -3.47 0.00 0.00 0.00 175.76 173.67 1rxc n ASP 133 N -0.93 3.21 0.00 0.00 -0.08 0.08 -4.92 116.55 113.92 1rxc n ASP 133 Ca 0.07 1.13 -0.18 0.00 -1.51 0.00 0.00 54.79 54.30 1rxc n ASP 133 Cb 0.54 -1.58 -0.09 0.00 2.34 0.00 0.00 41.12 42.32 1rxc n ASP 133 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1rxc h PHE 134 N 2.33 0.97 -0.38 -0.67 3.04 -1.96 -1.78 116.94 118.50 1rxc h PHE 134 Ca -0.50 -0.48 -0.07 0.00 3.98 0.00 0.00 57.97 60.90 1rxc h PHE 134 Cb 1.27 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.63 1rxc h PHE 134 CO 0.50 1.30 -0.07 0.93 -2.02 0.00 0.00 178.31 178.95 1rxc h GLU 135 N 0.36 0.64 -0.19 1.11 5.08 -1.96 -0.36 114.58 119.26 1rxc h GLU 135 Ca -0.08 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 1rxc h GLU 135 Cb 1.48 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 1rxc h GLU 135 CO 0.17 0.71 -0.07 0.00 -1.00 0.00 0.00 179.01 178.82 1rxc h THR 137 N 0.08 1.25 -0.49 0.00 2.02 -1.23 -0.98 112.91 113.56 1rxc h THR 137 Ca 0.05 -0.96 0.06 0.00 0.77 0.00 0.00 66.41 66.32 1rxc h THR 137 Cb 0.53 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 1rxc h THR 137 CO 0.02 0.34 0.20 0.74 0.37 0.00 0.00 175.52 177.20 1rxc h THR 138 N 0.71 0.88 0.00 3.16 2.02 -1.06 -1.00 112.91 117.62 1rxc h THR 138 Ca 0.15 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.09 1rxc h THR 138 Cb 0.42 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1rxc h THR 138 CO 0.01 0.07 -0.50 0.00 0.37 0.00 0.00 175.52 175.47 1rxc h ALA 139 N 1.31 1.06 -0.07 6.16 0.00 -0.86 -0.77 119.26 126.08 1rxc h ALA 139 Ca 0.23 -0.46 -0.23 0.00 0.00 0.00 0.00 54.91 54.45 1rxc h ALA 139 Cb 0.21 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1rxc h ALA 139 CO -0.21 0.63 -0.88 -0.07 0.00 0.00 0.00 179.25 178.72 1rxc h LEU 140 N 0.00 0.80 -0.41 0.00 3.38 -0.92 -2.11 115.31 116.05 1rxc h LEU 140 Ca -0.01 -0.58 -0.10 0.00 0.09 0.00 0.00 57.88 57.29 1rxc h LEU 140 Cb 0.95 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1rxc h LEU 140 CO 0.07 1.37 -0.12 0.58 0.09 0.00 0.00 178.44 180.43 1rxc h VAL 141 N 0.41 1.28 -0.05 1.22 2.07 -0.96 -1.87 116.25 118.35 1rxc h VAL 141 Ca -0.08 -1.22 -0.13 0.00 0.82 0.00 0.00 66.70 66.09 1rxc h VAL 141 Cb 1.51 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 1rxc h VAL 141 CO 0.17 0.41 -0.57 -0.33 0.02 0.00 0.00 177.57 177.27 1rxc h GLU 142 N 0.62 0.14 -0.15 1.57 5.08 -1.19 -1.78 114.58 118.87 1rxc h GLU 142 Ca 0.10 -0.09 -0.17 0.00 -1.00 0.00 0.00 59.36 58.20 1rxc h GLU 142 Cb 0.65 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 1rxc h GLU 142 CO 0.04 0.67 -0.61 0.00 -1.00 0.00 0.00 179.01 178.12 1rxc h ALA 143 N 1.31 0.65 -0.25 3.43 0.00 -1.32 -1.93 119.26 121.15 1rxc h ALA 143 Ca -0.00 -0.54 -0.10 0.00 0.00 0.00 0.00 54.91 54.26 1rxc h ALA 143 Cb 1.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1rxc h ALA 143 CO 0.08 0.71 -0.27 0.00 0.00 0.00 0.00 179.25 179.77 1rxc h ALA 144 N 0.94 1.08 0.00 0.00 0.00 -1.10 -2.56 119.26 117.61 1rxc h ALA 144 Ca -0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1rxc h ALA 144 Cb 1.17 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1rxc h ALA 144 CO 0.11 0.57 -0.40 -0.22 0.00 0.00 0.00 179.25 179.31 1rxc h LYS 145 N 0.43 0.00 -0.12 0.00 3.64 -1.22 -2.08 116.57 117.21 1rxc h LYS 145 Ca 0.06 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.26 1rxc h LYS 145 Cb 0.69 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1rxc h LYS 145 CO 0.05 0.40 -0.68 0.66 -2.27 0.00 0.00 179.45 177.61 1rxc h SER 146 N 0.00 0.57 -0.18 4.20 4.64 -0.95 -3.14 113.55 118.70 1rxc h SER 146 Ca -0.00 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1rxc h SER 146 Cb 0.98 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1rxc h SER 146 CO 0.05 1.09 0.00 2.30 -0.87 0.00 0.00 176.83 179.40 1rxc n ILE 147 N -3.89 0.20 -2.20 0.95 -6.64 -1.08 -5.00 119.36 101.71 1rxc n ILE 147 Ca -0.04 -0.58 -0.11 0.00 -1.77 0.00 0.00 62.75 60.24 1rxc n ILE 147 Cb 0.68 1.22 -0.01 0.00 -1.44 0.00 0.00 39.64 40.10 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 1.40 -0.07 3.79 3.28 0.00 -0.82 -5.02 105.19 107.76 1rxc n GLY 148 Ca 0.16 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.56 2.85 -0.10 4.61 0.00 -1.01 -5.02 121.76 120.53 1rxc s ALA 149 Ca 0.00 0.63 -0.26 0.00 0.00 0.00 0.00 51.96 52.33 1rxc s ALA 149 Cb 0.00 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 1rxc s ALA 149 CO 0.00 -0.38 0.86 0.95 0.00 0.00 0.00 175.76 177.19 1rxc s THR 150 N -1.96 4.90 -0.03 0.00 -4.23 -1.26 -4.75 115.64 108.31 1rxc s THR 150 Ca 0.68 1.74 0.05 0.00 -1.18 0.00 0.00 61.69 62.98 1rxc s THR 150 Cb -0.17 -4.18 -0.01 0.00 1.34 0.00 0.00 72.50 69.48 1rxc s THR 150 CO 0.21 0.11 -0.18 -0.89 -0.54 0.00 0.00 174.62 173.32 1rxc s THR 151 N 1.56 1.48 -0.07 3.99 2.01 -1.26 -2.29 115.64 121.06 1rxc s THR 151 Ca 0.43 -0.77 0.03 0.00 0.31 0.00 0.00 61.69 61.69 1rxc s THR 151 Cb -0.18 -1.26 -0.02 0.00 0.01 0.00 0.00 72.50 71.05 1rxc s THR 151 CO 0.18 0.42 -0.17 -1.00 -0.69 0.00 0.00 174.62 173.36 1rxc s HIS 152 N -0.17 2.64 -0.18 4.92 3.76 -0.60 -5.00 115.29 120.67 1rxc s HIS 152 Ca 0.01 -0.47 0.00 0.00 -0.15 0.00 0.00 55.06 54.45 1rxc s HIS 152 Cb -0.10 -1.68 0.01 0.00 1.11 0.00 0.00 32.58 31.93 1rxc s HIS 152 CO 0.01 -0.05 -0.17 0.08 -0.85 0.00 0.00 174.74 173.76 1rxc s VAL 153 N -0.26 2.38 -2.26 -0.90 1.01 -1.26 -1.79 120.40 117.31 1rxc s VAL 153 Ca 0.01 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1rxc s VAL 153 Cb -0.13 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1rxc s VAL 153 CO 0.03 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1rxc n GLY 154 N 4.52 -0.62 3.84 4.51 0.00 -1.05 -4.96 105.19 111.42 1rxc n GLY 154 Ca -0.20 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 44.85 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 -3.67 5.02 -0.03 1.61 1.01 -1.26 -0.74 120.40 122.33 1rxc s VAL 155 Ca 0.00 0.77 0.07 0.00 0.00 0.00 0.00 61.98 62.81 1rxc s VAL 155 Cb 0.00 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1rxc s VAL 155 CO 0.00 0.48 -0.22 -0.89 0.00 0.00 0.00 175.10 174.47 1rxc s THR 156 N -1.19 2.38 -0.22 3.92 2.01 -0.89 -1.31 115.64 120.34 1rxc s THR 156 Ca 0.27 -0.98 -0.19 0.00 0.31 0.00 0.00 61.69 61.10 1rxc s THR 156 Cb -0.16 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 1rxc s THR 156 CO 0.15 0.58 0.53 0.00 -0.69 0.00 0.00 174.62 175.20 1rxc s ALA 157 N -0.63 3.56 -0.26 7.40 0.00 0.30 -0.29 121.76 131.84 1rxc s ALA 157 Ca 0.10 -0.45 -0.00 0.00 0.00 0.00 0.00 51.96 51.60 1rxc s ALA 157 Cb -0.10 -2.86 0.04 0.00 0.00 0.00 0.00 23.12 20.20 1rxc s ALA 157 CO -0.00 -0.55 -0.06 0.45 0.00 0.00 0.00 175.76 175.59 1rxc s SER 158 N 1.28 4.47 -0.03 0.00 0.15 -0.77 -1.74 113.70 117.05 1rxc s SER 158 Ca 0.24 -1.12 0.06 0.00 0.70 0.00 0.00 55.95 55.83 1rxc s SER 158 Cb -0.15 -1.64 -0.02 0.00 -1.71 0.00 0.00 66.02 62.49 1rxc s SER 158 CO 0.09 -0.18 -0.21 -0.55 1.20 0.00 0.00 173.24 173.59 1rxc s SER 159 N 1.24 3.47 0.01 5.45 0.15 -0.22 -1.52 113.70 122.28 1rxc s SER 159 Ca -0.04 -0.35 0.23 0.00 0.70 0.00 0.00 55.95 56.49 1rxc s SER 159 Cb -0.18 -0.55 0.96 0.00 -1.71 0.00 0.00 66.02 64.53 1rxc s SER 159 CO -0.04 0.33 1.72 0.47 1.20 0.00 0.00 173.24 176.92 1rxc n ASP 160 N 2.38 0.03 -4.33 5.45 10.43 -0.81 -4.31 116.55 125.39 1rxc n ASP 160 Ca -0.16 0.51 -0.26 0.00 2.57 0.00 0.00 54.79 57.44 1rxc n ASP 160 Cb 0.52 -0.51 -0.13 0.00 1.84 0.00 0.00 41.12 42.84 1rxc n ASP 160 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1rxc s THR 161 N -3.01 1.94 0.19 -3.53 -4.23 -1.26 -5.01 115.64 100.73 1rxc s THR 161 Ca 0.11 -1.65 0.11 0.00 -1.18 0.00 0.00 61.69 59.08 1rxc s THR 161 Cb 0.15 -1.75 -0.04 0.00 1.34 0.00 0.00 72.50 72.20 1rxc s THR 161 CO 0.42 -0.01 1.55 0.15 -0.54 0.00 0.00 174.62 176.18 1rxc h PHE 162 N 3.96 0.00 0.00 3.99 3.57 -1.98 -3.38 116.94 123.10 1rxc h PHE 162 Ca -0.48 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.02 1rxc h PHE 162 Cb 1.18 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.92 1rxc h PHE 162 CO 0.61 0.66 0.00 0.66 -2.23 0.00 0.00 178.31 178.01 1rxc n TYR 163 N -3.62 0.00 -0.06 0.41 4.02 -1.26 -4.36 117.16 112.29 1rxc n TYR 163 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1rxc n TYR 163 Cb 0.68 0.00 0.29 0.00 -0.02 0.00 0.00 39.34 40.29 1rxc n TYR 163 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1rxc h PRO 164 N 0.00 0.66 0.00 -0.72 0.13 -1.87 -0.97 132.00 129.24 1rxc h PRO 164 Ca 0.00 -0.10 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1rxc h PRO 164 Cb 0.00 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.01 1rxc h PRO 164 CO 0.00 0.57 -0.01 0.78 -0.23 0.00 0.00 178.00 179.10 1rxc h GLY 165 N 0.83 0.00 -2.70 1.56 0.00 -1.86 -2.05 103.07 98.83 1rxc h GLY 165 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.32 1rxc h GLY 165 CO -0.01 0.00 0.13 -1.06 0.00 0.00 0.00 176.54 175.60 1rxc n GLN 166 N -3.12 2.96 -3.97 4.80 6.02 -0.96 -4.94 117.38 118.17 1rxc n GLN 166 Ca 0.00 -3.04 -0.32 0.00 -0.01 0.00 0.00 57.00 53.63 1rxc n GLN 166 Cb 0.29 -2.01 -0.02 0.00 1.02 0.00 0.00 30.24 29.51 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 -0.61 -3.32 -1.09 2.13 -0.77 -4.93 120.64 111.49 1rxc n GLU 167 Ca 0.35 -0.02 -0.38 0.00 0.66 0.00 0.00 57.16 57.76 1rxc n GLU 167 Cb 1.18 -2.11 -0.06 0.00 0.27 0.00 0.00 31.44 30.72 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 -6.73 4.28 0.00 5.31 0.52 -0.41 -4.99 118.95 116.93 1rxc s ARG 168 Ca 0.23 0.38 0.18 0.00 -0.52 0.00 0.00 55.73 56.00 1rxc s ARG 168 Cb -0.13 -3.48 -0.16 0.00 0.52 0.00 0.00 34.95 31.70 1rxc s ARG 168 CO 0.76 0.06 0.81 0.66 0.02 0.00 0.00 175.30 177.62 1rxc n TYR 169 N 4.05 0.00 -2.41 -0.53 4.01 -1.26 -4.45 117.16 116.57 1rxc n TYR 169 Ca -0.07 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.24 1rxc n TYR 169 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 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 -1.16 5.15 -3.75 7.72 4.64 -1.26 -4.24 116.55 123.66 1rxc n ASP 170 Ca 0.04 -3.11 -0.22 0.00 -1.38 0.00 0.00 54.79 50.12 1rxc n ASP 170 Cb 0.31 -1.48 -0.08 0.00 -1.04 0.00 0.00 41.12 38.83 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 0.34 0.26 0.14 5.18 -4.23 -1.26 -5.01 115.64 111.06 1rxc s THR 171 Ca 0.39 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.69 1rxc s THR 171 Cb 0.08 -2.43 -0.00 0.00 1.34 0.00 0.00 72.50 71.49 1rxc s THR 171 CO 0.01 0.00 1.66 0.22 -0.54 0.00 0.00 174.62 175.97 1rxc h TYR 172 N 2.01 -0.40 0.04 3.99 5.03 -1.99 -3.08 116.97 122.58 1rxc h TYR 172 Ca -0.30 0.03 -0.26 0.00 2.58 0.00 0.00 58.73 60.77 1rxc h TYR 172 Cb 1.25 0.20 -0.03 0.00 1.55 0.00 0.00 36.73 39.71 1rxc h TYR 172 CO 1.53 -0.23 -1.34 0.66 -1.32 0.00 0.00 178.16 177.47 1rxc h SER 173 N -0.18 0.14 0.00 -2.11 4.64 -1.97 -3.48 113.55 110.59 1rxc h SER 173 Ca 0.11 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1rxc h SER 173 Cb 0.34 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1rxc h SER 173 CO -0.27 1.15 0.00 0.61 -0.87 0.00 0.00 176.83 177.45 1rxc n GLY 174 N 1.50 0.59 3.37 -0.77 0.00 -1.17 -5.02 105.19 103.70 1rxc n GLY 174 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 1rxc n GLY 174 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1rxc s ARG 175 N -0.27 1.40 -0.12 1.61 1.70 -1.26 -4.86 118.95 117.15 1rxc s ARG 175 Ca 0.00 -1.55 0.02 0.00 -0.47 0.00 0.00 55.73 53.72 1rxc s ARG 175 Cb 0.00 -1.40 0.01 0.00 -0.57 0.00 0.00 34.95 32.99 1rxc s ARG 175 CO 0.00 0.27 -0.16 0.08 -1.08 0.00 0.00 175.30 174.41 1rxc s VAL 176 N -2.41 1.57 0.46 4.99 1.01 -1.26 -4.93 120.40 119.83 1rxc s VAL 176 Ca 0.21 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.31 1rxc s VAL 176 Cb -0.04 -1.43 -0.13 0.00 0.00 0.00 0.00 36.38 34.78 1rxc s VAL 176 CO 0.09 0.46 0.35 0.55 0.00 0.00 0.00 175.10 176.55 1rxc n VAL 177 N 4.24 1.40 -0.30 2.92 3.14 -1.26 -4.57 118.33 123.90 1rxc n VAL 177 Ca -0.19 -0.50 0.09 0.00 -2.96 0.00 0.00 64.34 60.78 1rxc n VAL 177 Cb 0.51 -0.39 0.25 0.00 -1.06 0.00 0.00 33.84 33.16 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 0.47 0.55 -0.94 1.45 2.43 -2.00 -1.73 114.38 114.61 1rxc h ARG 178 Ca -0.41 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 58.83 1rxc h ARG 178 Cb 1.42 -0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.77 1rxc h ARG 178 CO 0.48 0.36 0.60 1.25 -1.51 0.00 0.00 179.97 181.16 1rxc h HIS 179 N 0.57 1.03 -0.30 2.20 2.76 -2.02 -2.01 115.15 117.38 1rxc h HIS 179 Ca 0.50 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.70 1rxc h HIS 179 Cb 0.79 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.42 1rxc h HIS 179 CO -0.10 0.46 0.00 1.19 -1.30 0.00 0.00 177.93 178.18 1rxc n PHE 180 N -4.55 0.37 -2.27 5.26 3.01 -0.69 -4.80 117.46 113.80 1rxc n PHE 180 Ca 0.16 -0.19 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 1rxc n PHE 180 Cb 0.32 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.76 1rxc n PHE 180 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1rxc s LYS 181 N -1.60 4.28 0.00 -1.08 1.02 -0.76 -2.32 119.74 119.28 1rxc s LYS 181 Ca 0.36 1.90 0.00 0.00 0.02 0.00 0.00 55.97 58.25 1rxc s LYS 181 Cb 0.22 -3.61 0.00 0.00 -0.52 0.00 0.00 37.83 33.92 1rxc s LYS 181 CO 0.31 -0.58 0.00 0.41 -0.92 0.00 0.00 175.35 174.57 1rxc n GLY 182 N 3.62 0.51 0.22 -3.33 0.00 -1.26 -4.95 105.19 100.00 1rxc n GLY 182 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 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 0.87 -0.54 1.61 4.64 -1.77 -2.99 113.55 115.37 1rxc h SER 183 Ca 0.00 -0.59 0.11 0.00 -0.47 0.00 0.00 61.79 60.83 1rxc h SER 183 Cb 0.16 -0.25 -0.09 0.00 -0.31 0.00 0.00 62.40 61.91 1rxc h SER 183 CO 0.00 1.31 0.03 -0.03 -0.87 0.00 0.00 176.83 177.27 1rxc h MET 184 N 0.48 0.14 -0.48 4.77 -1.53 -1.92 -1.62 114.93 114.77 1rxc h MET 184 Ca -0.02 -0.01 0.07 0.00 -3.44 0.00 0.00 59.70 56.30 1rxc h MET 184 Cb 1.24 -0.03 -0.06 0.00 -0.55 0.00 0.00 31.60 32.20 1rxc h MET 184 CO 0.13 0.09 0.13 1.49 0.14 0.00 0.00 176.91 178.90 1rxc h GLU 185 N 0.14 0.28 -0.23 0.39 4.81 -1.94 0.11 114.58 118.14 1rxc h GLU 185 Ca 0.28 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.50 1rxc h GLU 185 Cb 0.43 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1rxc h GLU 185 CO -0.44 0.18 0.14 0.93 -0.73 0.00 0.00 179.01 179.10 1rxc h GLU 186 N 0.29 0.29 -0.24 1.92 4.39 -1.30 -1.64 114.58 118.29 1rxc h GLU 186 Ca 0.24 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.84 1rxc h GLU 186 Cb 0.29 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1rxc h GLU 186 CO -0.28 0.19 -0.19 -1.49 -1.16 0.00 0.00 179.01 176.08 1rxc h TRP 187 N 0.29 0.46 -0.52 4.33 -0.00 -0.90 -1.09 115.95 118.52 1rxc h TRP 187 Ca 0.09 -0.08 -0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1rxc h TRP 187 Cb -0.02 -0.12 -0.03 0.00 -0.00 0.00 0.00 29.16 29.00 1rxc h TRP 187 CO -0.07 0.60 0.32 1.96 -0.00 0.00 0.00 178.44 181.24 1rxc h GLN 188 N 0.39 0.71 0.00 0.49 4.20 -0.46 -0.72 115.11 119.72 1rxc h GLN 188 Ca 0.07 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 1rxc h GLN 188 Cb 0.56 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1rxc h GLN 188 CO 0.04 0.51 -0.56 0.00 -0.67 0.00 0.00 178.83 178.15 1rxc h ALA 189 N 1.16 0.81 -0.01 3.87 0.00 -1.04 -2.59 119.26 121.45 1rxc h ALA 189 Ca 0.19 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1rxc h ALA 189 Cb -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1rxc h ALA 189 CO -0.04 0.70 0.00 -1.33 0.00 0.00 0.00 179.25 178.59 1rxc n MET 190 N -3.49 1.03 -0.91 0.00 2.81 -0.44 -4.89 117.12 111.23 1rxc n MET 190 Ca 0.00 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1rxc n MET 190 Cb 0.66 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.89 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 0.78 0.51 3.75 3.03 0.00 -0.98 -5.01 105.19 107.28 1rxc n GLY 191 Ca 0.13 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 2.63 -0.03 1.61 1.01 -0.31 -4.67 120.40 118.64 1rxc s VAL 192 Ca 0.00 0.56 -0.11 0.00 0.00 0.00 0.00 61.98 62.43 1rxc s VAL 192 Cb 0.00 -3.36 -0.31 0.00 0.00 0.00 0.00 36.38 32.71 1rxc s VAL 192 CO 0.00 0.10 0.75 0.24 0.00 0.00 0.00 175.10 176.19 1rxc h MET 193 N 4.47 0.41 -2.68 2.72 0.00 -1.51 -3.41 114.93 114.92 1rxc h MET 193 Ca -0.47 -0.70 0.07 0.00 0.00 0.00 0.00 59.70 58.60 1rxc h MET 193 Cb 1.22 0.26 -0.11 0.00 0.00 0.00 0.00 31.60 32.98 1rxc h MET 193 CO 0.74 1.33 0.34 0.54 0.00 0.00 0.00 176.91 179.86 1rxc s ASN 194 N -7.33 -0.38 -0.16 1.22 4.22 -1.26 -0.57 114.94 110.68 1rxc s ASN 194 Ca -0.14 -0.19 -0.05 0.00 -2.14 0.00 0.00 52.86 50.33 1rxc s ASN 194 Cb 0.05 0.55 -0.03 0.00 1.28 0.00 0.00 41.25 43.09 1rxc s ASN 194 CO 0.87 -0.94 0.01 -0.31 -2.04 0.00 0.00 177.10 174.70 1rxc s TYR 195 N -3.53 3.14 0.00 1.54 4.12 -0.74 -0.54 117.35 121.35 1rxc s TYR 195 Ca 0.06 -0.07 0.00 0.00 0.02 0.00 0.00 57.07 57.08 1rxc s TYR 195 Cb -0.02 -1.99 0.00 0.00 -1.52 0.00 0.00 41.96 38.43 1rxc s TYR 195 CO -0.05 0.12 0.00 -0.85 0.02 0.00 0.00 175.55 174.79 1rxc n GLU 196 N 3.34 0.00 0.00 -0.62 -0.00 -0.71 -3.27 120.64 119.37 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 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 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 -0.16 0.00 3.44 2.81 -1.26 -1.06 117.12 120.88 1rxc n MET 197 Ca 0.00 -0.12 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1rxc n MET 197 Cb 0.00 -0.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.90 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 -0.01 3.53 0.15 0.03 4.71 -1.26 -3.66 120.64 124.13 1rxc n GLU 198 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.16 1rxc n GLU 198 Cb 0.18 -0.52 0.21 0.00 -1.01 0.00 0.00 31.44 30.30 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 -0.23 1.62 4.64 -1.94 -1.59 113.55 116.04 1rxc h SER 199 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1rxc h SER 199 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1rxc h SER 199 CO 0.00 0.55 -0.15 0.00 -0.87 0.00 0.00 176.83 176.36 1rxc h ALA 200 N 1.45 1.07 0.12 5.18 0.00 -1.88 -0.35 119.26 124.86 1rxc h ALA 200 Ca -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1rxc h ALA 200 Cb 1.07 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1rxc h ALA 200 CO 0.07 0.57 -0.06 1.15 0.00 0.00 0.00 179.25 180.98 1rxc h THR 201 N 0.59 0.98 0.49 0.00 2.02 -1.86 -2.69 112.91 112.44 1rxc h THR 201 Ca 0.10 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.04 1rxc h THR 201 Cb 0.59 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1rxc h THR 201 CO 0.04 0.26 -0.44 0.25 0.37 0.00 0.00 175.52 176.00 1rxc h LEU 202 N -0.82 -1.18 -0.75 2.58 5.85 -1.25 -0.95 115.31 118.79 1rxc h LEU 202 Ca -0.02 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1rxc h LEU 202 Cb 0.55 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1rxc h LEU 202 CO 0.03 -0.61 0.39 -0.07 -0.34 0.00 0.00 178.44 177.83 1rxc h LEU 203 N -0.93 0.96 -0.19 2.25 3.38 -1.20 -1.58 115.31 118.00 1rxc h LEU 203 Ca -0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1rxc h LEU 203 Cb 0.80 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1rxc h LEU 203 CO -0.04 0.80 0.00 0.74 0.09 0.00 0.00 178.44 180.04 1rxc h THR 204 N 1.04 1.25 -0.18 0.22 2.02 -1.36 0.07 112.91 115.98 1rxc h THR 204 Ca 0.26 -0.86 -0.08 0.00 0.77 0.00 0.00 66.41 66.50 1rxc h THR 204 Cb 0.08 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1rxc h THR 204 CO -0.04 0.26 -0.22 0.00 0.37 0.00 0.00 175.52 175.89 1rxc h MET 205 N 0.10 0.31 0.01 6.66 -0.00 -1.01 -2.21 114.93 118.79 1rxc h MET 205 Ca 0.06 -0.10 -0.03 0.00 -0.00 0.00 0.00 59.70 59.63 1rxc h MET 205 Cb 0.39 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 31.96 1rxc h MET 205 CO 0.01 0.53 -0.11 0.00 -0.00 0.00 0.00 176.91 177.34 1rxc h ALA 207 N 0.11 1.26 -0.24 0.00 0.00 -0.95 -1.73 119.26 117.71 1rxc h ALA 207 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rxc h ALA 207 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1rxc h ALA 207 CO 0.02 -0.04 0.00 -1.13 0.00 0.00 0.00 179.25 178.10 1rxc n SER 208 N -3.38 3.14 -0.22 0.00 3.41 -0.84 -4.40 113.62 111.33 1rxc n SER 208 Ca -0.03 -1.94 0.01 0.00 -0.26 0.00 0.00 58.87 56.66 1rxc n SER 208 Cb 0.11 -0.15 0.02 0.00 -0.26 0.00 0.00 64.21 63.93 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 1.31 0.45 -1.21 4.33 6.02 -0.78 -5.02 117.38 122.49 1rxc n GLN 209 Ca 0.16 -1.07 -0.01 0.00 -0.01 0.00 0.00 57.00 56.07 1rxc n GLN 209 Cb 0.56 -0.67 -0.01 0.00 1.02 0.00 0.00 30.24 31.14 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 -0.22 0.46 3.69 1.08 0.00 -1.02 -5.03 105.19 104.15 1rxc n GLY 210 Ca 0.02 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.35 3.61 -0.04 0.99 1.43 -0.72 -5.06 118.68 118.55 1rxc s LEU 211 Ca 0.00 0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 53.02 1rxc s LEU 211 Cb 0.00 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1rxc s LEU 211 CO 0.00 0.37 0.66 -0.13 0.23 0.00 0.00 176.35 177.48 1rxc s ARG 212 N -0.96 4.40 0.03 1.70 0.52 -0.36 -3.84 118.95 120.44 1rxc s ARG 212 Ca 0.14 0.83 0.01 0.00 -0.52 0.00 0.00 55.73 56.19 1rxc s ARG 212 Cb -0.11 -3.40 -0.02 0.00 0.52 0.00 0.00 34.95 31.93 1rxc s ARG 212 CO 0.03 0.19 -0.05 0.00 0.02 0.00 0.00 175.30 175.49 1rxc s ALA 213 N 0.37 0.34 0.06 2.13 0.00 -1.26 -1.06 121.76 122.34 1rxc s ALA 213 Ca 0.35 -0.67 -0.08 0.00 0.00 0.00 0.00 51.96 51.56 1rxc s ALA 213 Cb -0.18 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 1rxc s ALA 213 CO 0.18 -0.09 0.16 0.20 0.00 0.00 0.00 175.76 176.21 1rxc s GLY 214 N -1.51 0.11 -0.03 0.00 0.00 -0.78 -0.74 107.32 104.37 1rxc s GLY 214 Ca -0.13 -0.54 0.01 0.00 0.00 0.00 0.00 44.72 44.05 1rxc s GLY 214 CO -0.00 -0.72 -0.01 1.06 0.00 0.00 0.00 173.10 173.43 1rxc s MET 215 N -3.29 0.42 -0.00 2.90 -1.94 -1.26 -0.79 119.30 115.34 1rxc s MET 215 Ca 0.01 0.00 -0.00 0.00 -1.71 0.00 0.00 55.69 53.99 1rxc s MET 215 Cb 0.02 -0.53 -0.00 0.00 2.01 0.00 0.00 34.83 36.33 1rxc s MET 215 CO -0.08 -0.09 0.00 0.54 -0.01 0.00 0.00 175.02 175.38 1rxc s VAL 216 N 0.83 0.01 0.01 -6.03 0.11 -0.71 -1.70 120.40 112.92 1rxc s VAL 216 Ca -0.09 -0.08 -0.06 0.00 -2.93 0.00 0.00 61.98 58.83 1rxc s VAL 216 Cb -0.12 -0.04 -0.01 0.00 -1.53 0.00 0.00 36.38 34.68 1rxc s VAL 216 CO -0.01 -0.04 0.10 0.00 -3.33 0.00 0.00 175.10 171.82 1rxc s ALA 217 N -0.12 -0.19 -0.05 1.54 0.00 -0.54 -2.00 121.76 120.40 1rxc s ALA 217 Ca -0.01 -0.31 -0.08 0.00 0.00 0.00 0.00 51.96 51.56 1rxc s ALA 217 Cb -0.01 0.15 -0.05 0.00 0.00 0.00 0.00 23.12 23.22 1rxc s ALA 217 CO -0.00 -0.23 0.23 0.20 0.00 0.00 0.00 175.76 175.97 1rxc s GLY 218 N -1.57 2.25 -0.26 0.00 0.00 -0.80 -1.15 107.32 105.79 1rxc s GLY 218 Ca -0.13 -0.55 -0.24 0.00 0.00 0.00 0.00 44.72 43.80 1rxc s GLY 218 CO -0.00 -0.30 0.79 0.14 0.00 0.00 0.00 173.10 173.73 1rxc s VAL 219 N -1.14 4.84 -0.11 1.40 1.01 -0.43 -2.10 120.40 123.87 1rxc s VAL 219 Ca 0.21 1.42 0.19 0.00 0.00 0.00 0.00 61.98 63.80 1rxc s VAL 219 Cb -0.13 -4.10 -0.28 0.00 0.00 0.00 0.00 36.38 31.87 1rxc s VAL 219 CO 0.10 -0.10 0.45 2.30 0.00 0.00 0.00 175.10 177.85 1rxc n ILE 220 N 5.32 0.00 -3.67 2.22 -5.35 -0.70 -2.32 119.36 114.85 1rxc n ILE 220 Ca 0.04 -0.39 -0.15 0.00 -0.27 0.00 0.00 62.75 61.99 1rxc n ILE 220 Cb 0.48 0.17 -0.08 0.00 -1.74 0.00 0.00 39.64 38.47 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 -3.23 0.03 -0.27 7.28 0.11 -1.24 -4.88 120.40 118.19 1rxc s VAL 221 Ca -0.05 -0.21 -0.10 0.00 -2.93 0.00 0.00 61.98 58.69 1rxc s VAL 221 Cb 0.12 -0.76 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 1rxc s VAL 221 CO 0.77 -0.12 0.15 0.21 -3.33 0.00 0.00 175.10 172.79 1rxc s ASN 222 N -0.92 5.75 0.21 3.54 2.47 -1.26 -1.48 114.94 123.25 1rxc s ASN 222 Ca -0.10 -0.07 0.20 0.00 0.42 0.00 0.00 52.86 53.31 1rxc s ASN 222 Cb -0.03 -2.06 0.89 0.00 -1.45 0.00 0.00 41.25 38.60 1rxc s ASN 222 CO 0.05 -0.04 1.60 0.54 -3.72 0.00 0.00 177.10 175.52 1rxc n ARG 223 N 5.01 0.13 0.00 0.43 5.12 -0.11 -2.13 116.66 125.11 1rxc n ARG 223 Ca -0.15 0.46 0.12 0.00 -1.93 0.00 0.00 57.85 56.36 1rxc n ARG 223 Cb 0.52 -1.81 0.61 0.00 -1.16 0.00 0.00 32.46 30.62 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 -2.07 0.23 -0.02 0.55 -2.24 -1.26 -4.00 114.28 105.47 1rxc n THR 224 Ca 0.01 0.06 -0.03 0.00 -2.27 0.00 0.00 64.05 61.82 1rxc n THR 224 Cb 0.15 -0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 67.72 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 -1.33 0.15 -3.12 -0.78 3.00 -0.91 -5.12 117.38 109.28 1rxc n GLN 225 Ca 0.11 0.06 -0.18 0.00 -0.01 0.00 0.00 57.00 56.97 1rxc n GLN 225 Cb 0.21 -0.68 0.01 0.00 0.00 0.00 0.00 30.24 29.78 1rxc n GLN 225 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1rxc n GLN 226 N -3.21 0.89 -0.03 -1.09 6.02 -1.14 -5.08 117.38 113.74 1rxc n GLN 226 Ca -0.04 -2.47 -0.05 0.00 -0.01 0.00 0.00 57.00 54.43 1rxc n GLN 226 Cb 0.15 0.23 -0.02 0.00 1.02 0.00 0.00 30.24 31.62 1rxc n GLN 226 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1rxc n GLU 227 N -1.48 0.12 -3.64 -1.09 1.02 -1.26 -4.43 120.64 109.88 1rxc n GLU 227 Ca -0.00 0.04 -0.36 0.00 -0.02 0.00 0.00 57.16 56.82 1rxc n GLU 227 Cb 0.45 -0.80 -0.07 0.00 -0.02 0.00 0.00 31.44 31.00 1rxc n GLU 227 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1rxc s ILE 228 N -2.10 5.36 1.32 -3.67 1.09 -1.26 -4.99 121.20 116.94 1rxc s ILE 228 Ca -0.07 0.38 -0.20 0.00 -1.10 0.00 0.00 60.65 59.66 1rxc s ILE 228 Cb 0.03 -3.55 0.31 0.00 -1.06 0.00 0.00 42.46 38.19 1rxc s ILE 228 CO 0.10 0.43 0.74 -2.65 -0.10 0.00 0.00 174.94 173.46 1rxc n PRO 229 N 3.39 -3.81 -0.84 2.79 -0.02 -1.26 -5.07 135.00 130.18 1rxc n PRO 229 Ca -0.14 -1.12 0.00 0.00 -2.02 0.00 0.00 63.50 60.22 1rxc n PRO 229 Cb 0.52 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1rxc n PRO 229 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rxc n MET 234 N -4.67 0.00 -0.34 -0.52 -0.00 -1.26 -5.02 117.12 105.32 1rxc n MET 234 Ca 0.09 0.00 0.03 0.00 -0.00 0.00 0.00 57.70 57.83 1rxc n MET 234 Cb 0.54 -2.89 0.17 0.00 -0.00 0.00 0.00 33.22 31.04 1rxc n MET 234 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1rxc n LYS 235 N -2.00 2.47 0.00 3.17 3.00 -1.26 -3.94 118.16 119.60 1rxc n LYS 235 Ca 0.00 -1.30 0.00 0.00 -0.00 0.00 0.00 58.31 57.01 1rxc n LYS 235 Cb 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 35.03 33.33 1rxc n LYS 235 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1rxc n GLN 236 N 0.30 0.70 -0.08 1.64 7.27 -1.26 -3.64 117.38 122.31 1rxc n GLN 236 Ca 0.12 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.05 1rxc n GLN 236 Cb 0.57 -1.07 -0.07 0.00 2.41 0.00 0.00 30.24 32.08 1rxc n GLN 236 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 1rxc n THR 237 N -0.37 0.92 -0.10 1.69 -1.04 -1.25 -2.94 114.28 111.18 1rxc n THR 237 Ca 0.00 -0.31 0.06 0.00 -2.04 0.00 0.00 64.05 61.76 1rxc n THR 237 Cb 0.04 -1.29 0.39 0.00 -1.82 0.00 0.00 70.33 67.65 1rxc n THR 237 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1rxc h GLU 238 N -0.20 0.63 -0.27 -2.82 4.81 -1.87 -1.51 114.58 113.35 1rxc h GLU 238 Ca -0.38 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.81 1rxc h GLU 238 Cb 1.50 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.72 1rxc h GLU 238 CO -0.12 0.42 0.16 1.03 -0.73 0.00 0.00 179.01 179.76 1rxc h SER 239 N 0.65 0.32 -0.88 1.04 0.87 -1.72 -2.38 113.55 111.45 1rxc h SER 239 Ca 0.25 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1rxc h SER 239 Cb 0.16 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 61.99 1rxc h SER 239 CO -0.07 0.29 0.49 0.45 -0.53 0.00 0.00 176.83 177.46 1rxc h HIS 240 N 0.33 1.20 -0.17 2.24 3.86 -1.27 -1.92 115.15 119.42 1rxc h HIS 240 Ca 0.10 -0.03 -0.19 0.00 -1.16 0.00 0.00 60.37 59.09 1rxc h HIS 240 Cb 0.03 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.12 1rxc h HIS 240 CO -0.04 0.83 -0.66 0.00 0.86 0.00 0.00 177.93 178.92 1rxc h ALA 241 N 1.27 0.52 -0.67 2.45 0.00 -1.26 -2.36 119.26 119.21 1rxc h ALA 241 Ca 0.31 -0.56 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1rxc h ALA 241 Cb 0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1rxc h ALA 241 CO -0.05 0.70 0.16 0.28 0.00 0.00 0.00 179.25 180.34 1rxc h VAL 242 N 0.47 1.26 -0.52 0.00 2.07 -1.31 -1.33 116.25 116.88 1rxc h VAL 242 Ca -0.02 -0.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.53 1rxc h VAL 242 Cb 1.25 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1rxc h VAL 242 CO 0.13 0.36 0.21 0.50 0.02 0.00 0.00 177.57 178.79 1rxc h LYS 243 N 1.01 0.75 -0.04 1.57 3.64 -1.21 -2.59 116.57 119.69 1rxc h LYS 243 Ca 0.21 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1rxc h LYS 243 Cb 0.36 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1rxc h LYS 243 CO 0.00 0.62 -0.17 0.82 -2.27 0.00 0.00 179.45 178.45 1rxc h ILE 244 N 0.74 1.47 -0.14 2.00 2.04 -1.03 -2.36 117.51 120.23 1rxc h ILE 244 Ca 0.18 -1.65 -0.05 0.00 1.00 0.00 0.00 64.86 64.34 1rxc h ILE 244 Cb 0.15 2.45 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 1rxc h ILE 244 CO -0.02 0.45 -0.14 1.62 0.00 0.00 0.00 178.15 180.07 1rxc h VAL 245 N -0.39 1.18 -0.11 1.67 3.04 -1.20 0.10 116.25 120.55 1rxc h VAL 245 Ca -0.01 -0.79 -0.04 0.00 -1.01 0.00 0.00 66.70 64.85 1rxc h VAL 245 Cb 0.83 1.23 -0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1rxc h VAL 245 CO 0.04 0.24 -0.09 0.58 -1.01 0.00 0.00 177.57 177.33 1rxc h VAL 246 N 0.21 1.35 -0.35 1.51 2.07 -1.51 -1.41 116.25 118.13 1rxc h VAL 246 Ca 0.04 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1rxc h VAL 246 Cb 0.38 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 1rxc h VAL 246 CO 0.02 0.34 0.10 -0.08 0.02 0.00 0.00 177.57 177.98 1rxc h GLU 247 N -0.15 0.50 -0.32 1.57 4.57 -0.97 -2.06 114.58 117.72 1rxc h GLU 247 Ca 0.02 -0.07 -0.15 0.00 -1.18 0.00 0.00 59.36 57.97 1rxc h GLU 247 Cb 0.59 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.08 1rxc h GLU 247 CO 0.02 0.45 -0.40 0.00 -1.18 0.00 0.00 179.01 177.90 1rxc h ALA 248 N 1.62 0.48 -0.61 2.92 0.00 -0.75 -2.96 119.26 119.96 1rxc h ALA 248 Ca 0.12 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.60 1rxc h ALA 248 Cb 0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1rxc h ALA 248 CO -0.01 0.59 0.40 0.00 0.00 0.00 0.00 179.25 180.24 1rxc h ALA 249 N 0.71 1.64 -0.54 0.00 0.00 -0.86 -2.29 119.26 117.93 1rxc h ALA 249 Ca 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1rxc h ALA 249 Cb 1.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1rxc h ALA 249 CO 0.10 0.30 0.21 -0.09 0.00 0.00 0.00 179.25 179.77 1rxc h ARG 250 N 0.75 0.81 0.00 0.00 2.43 -1.23 -2.50 114.38 114.65 1rxc h ARG 250 Ca 0.24 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1rxc h ARG 250 Cb 0.03 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1rxc h ARG 250 CO -0.06 0.71 0.00 0.54 -1.51 0.00 0.00 179.97 179.65 1rxc n ARG 251 N -4.51 0.17 -0.02 0.20 1.74 -0.89 -3.26 116.66 110.08 1rxc n ARG 251 Ca 0.02 0.33 0.10 0.00 -0.77 0.00 0.00 57.85 57.53 1rxc n ARG 251 Cb 0.16 -1.78 0.09 0.00 -1.02 0.00 0.00 32.46 29.92 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 -2.09 2.70 -0.40 0.55 4.77 -0.96 -5.07 117.00 116.50 1rxc n LEU 252 Ca 0.03 -1.07 0.14 0.00 -0.03 0.00 0.00 56.01 55.08 1rxc n LEU 252 Cb 0.26 -0.03 0.59 0.00 -2.33 0.00 0.00 43.42 41.92 1rxc n LEU 252 CO 0.21 0.49 0.91 0.18 -1.33 0.00 0.00 177.39 177.85