#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orn s LEU 2 N 0.00 2.78 0.61 4.03 1.43 -0.18 -5.02 118.68 122.33 1orn s LEU 2 Ca 0.00 2.03 -0.08 0.00 -1.03 0.00 0.00 54.13 55.05 1orn s LEU 2 Cb 0.00 -4.48 -0.00 0.00 0.03 0.00 0.00 46.19 41.74 1orn s LEU 2 CO 0.00 -2.83 0.95 0.42 0.23 0.00 0.00 176.35 175.12 1orn s THR 3 N -2.73 3.91 0.18 5.49 -4.23 -1.26 -4.87 115.64 112.13 1orn s THR 3 Ca 0.65 0.25 -0.13 0.00 -1.18 0.00 0.00 61.69 61.28 1orn s THR 3 Cb -0.21 -3.57 0.08 0.00 1.34 0.00 0.00 72.50 70.14 1orn s THR 3 CO 0.58 -0.64 1.77 0.07 -0.54 0.00 0.00 174.62 175.86 1orn h LYS 4 N -0.26 0.42 -1.01 3.99 -0.00 -1.99 -0.98 116.57 116.75 1orn h LYS 4 Ca -0.45 -0.03 0.08 0.00 -0.00 0.00 0.00 60.65 60.25 1orn h LYS 4 Cb 1.24 -0.10 -0.07 0.00 -0.00 0.00 0.00 32.23 33.30 1orn h LYS 4 CO 0.62 0.28 0.65 1.96 -0.00 0.00 0.00 179.45 182.95 1orn h GLN 5 N 0.44 1.09 -0.30 0.07 7.50 -1.99 -0.89 115.11 121.02 1orn h GLN 5 Ca 0.22 -0.07 -0.10 0.00 0.50 0.00 0.00 58.65 59.20 1orn h GLN 5 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 1orn h GLN 5 CO -0.18 0.72 -0.21 1.96 -1.50 0.00 0.00 178.83 179.62 1orn h GLN 6 N 1.12 0.68 -0.88 1.46 4.20 -1.69 -2.04 115.11 117.97 1orn h GLN 6 Ca 0.45 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1orn h GLN 6 Cb 0.27 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 1orn h GLN 6 CO -0.20 0.93 0.54 0.82 -0.67 0.00 0.00 178.83 180.24 1orn h ILE 7 N 0.43 1.24 -0.03 2.54 2.04 -0.59 0.09 117.51 123.23 1orn h ILE 7 Ca 0.06 -0.50 -0.06 0.00 1.00 0.00 0.00 64.86 65.35 1orn h ILE 7 Cb 0.76 -0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1orn h ILE 7 CO 0.06 0.25 -0.27 0.03 0.00 0.00 0.00 178.15 178.22 1orn h ARG 8 N 1.20 0.05 -0.40 2.37 3.08 -1.09 -1.42 114.38 118.18 1orn h ARG 8 Ca 0.32 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.24 1orn h ARG 8 Cb -0.07 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 1orn h ARG 8 CO -0.06 0.32 -0.17 -0.92 -1.07 0.00 0.00 179.97 178.07 1orn h TYR 9 N 0.05 0.94 -0.39 3.04 3.20 -0.39 -1.33 116.97 122.09 1orn h TYR 9 Ca 0.01 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 61.63 1orn h TYR 9 Cb 0.50 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 1orn h TYR 9 CO 0.00 0.98 0.16 0.00 -1.64 0.00 0.00 178.16 177.66 1orn h LEU 11 N 0.48 0.67 -1.09 0.00 3.38 -1.21 -1.84 115.31 115.71 1orn h LEU 11 Ca 0.13 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1orn h LEU 11 Cb 0.18 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1orn h LEU 11 CO -0.01 0.79 0.01 0.44 0.09 0.00 0.00 178.44 179.76 1orn h ASP 12 N 0.64 0.62 -0.16 -0.43 3.32 -1.00 -2.32 116.42 117.09 1orn h ASP 12 Ca 0.12 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.87 1orn h ASP 12 Cb 0.51 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.90 1orn h ASP 12 CO 0.03 0.68 -0.57 -0.08 -1.72 0.00 0.00 179.24 177.58 1orn h GLU 13 N 0.62 0.67 -0.39 3.56 4.57 -1.02 -2.91 114.58 119.70 1orn h GLU 13 Ca 0.13 -0.51 0.03 0.00 -1.18 0.00 0.00 59.36 57.83 1orn h GLU 13 Cb 0.38 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.04 1orn h GLU 13 CO 0.01 1.13 0.26 0.52 -1.18 0.00 0.00 179.01 179.75 1orn h MET 14 N 0.36 0.39 -0.35 1.92 2.86 -1.14 -0.14 114.93 118.82 1orn h MET 14 Ca -0.03 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.49 1orn h MET 14 Cb 1.20 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 1orn h MET 14 CO 0.12 0.26 -0.19 0.00 1.06 0.00 0.00 176.91 178.15 1orn h ALA 15 N 1.78 1.01 -0.00 6.32 0.00 -1.28 0.05 119.26 127.14 1orn h ALA 15 Ca 0.16 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1orn h ALA 15 Cb 0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1orn h ALA 15 CO -0.04 0.59 -0.69 0.87 0.00 0.00 0.00 179.25 179.99 1orn h LYS 16 N 0.58 0.01 0.16 0.00 1.57 -0.89 -2.34 116.57 115.66 1orn h LYS 16 Ca 0.09 -0.01 -0.30 0.00 -1.87 0.00 0.00 60.65 58.57 1orn h LYS 16 Cb 0.65 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.98 1orn h LYS 16 CO 0.05 0.69 -1.35 1.98 -0.57 0.00 0.00 179.45 180.25 1orn h MET 17 N 0.01 0.34 -2.10 3.15 4.05 -0.93 -3.39 114.93 116.06 1orn h MET 17 Ca -0.01 -0.59 -0.57 0.00 -0.28 0.00 0.00 59.70 58.25 1orn h MET 17 Cb 1.21 0.22 -0.41 0.00 -0.80 0.00 0.00 31.60 31.83 1orn h MET 17 CO 0.09 1.27 -0.87 1.19 0.23 0.00 0.00 176.91 178.82 1orn n PHE 18 N -3.57 1.64 0.30 1.39 3.72 -0.02 -4.93 117.46 115.99 1orn n PHE 18 Ca -0.12 -3.86 0.19 0.00 -0.05 0.00 0.00 57.45 53.61 1orn n PHE 18 Cb 1.05 -0.45 0.88 0.00 -0.94 0.00 0.00 39.48 40.02 1orn n PHE 18 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1orn h PRO 19 N 3.97 0.00 -0.38 -1.08 0.13 -1.63 -2.96 132.00 130.05 1orn h PRO 19 Ca 0.13 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.24 1orn h PRO 19 Cb 0.77 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1orn h PRO 19 CO 0.65 0.01 0.01 -0.40 -0.23 0.00 0.00 178.00 178.04 1orn n ASP 20 N -3.12 4.43 -4.72 1.44 5.75 -1.26 -5.02 116.55 114.04 1orn n ASP 20 Ca -0.01 -3.04 -0.43 0.00 -0.01 0.00 0.00 54.79 51.31 1orn n ASP 20 Cb 0.22 -0.60 -0.02 0.00 -1.03 0.00 0.00 41.12 39.69 1orn n ASP 20 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1orn n ALA 21 N -0.19 2.27 -3.25 2.12 0.00 -1.12 -4.99 120.51 115.34 1orn n ALA 21 Ca 0.25 0.39 -0.12 0.00 0.00 0.00 0.00 53.44 53.96 1orn n ALA 21 Cb 1.02 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 1orn n ALA 21 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1orn s HIS 22 N 0.20 0.61 -0.04 0.00 0.00 -1.26 -4.77 115.29 110.03 1orn s HIS 22 Ca 0.67 -1.01 -0.30 0.00 -3.00 0.00 0.00 55.06 51.42 1orn s HIS 22 Cb -0.53 0.27 -0.04 0.00 -4.00 0.00 0.00 32.58 28.27 1orn s HIS 22 CO 0.46 -1.24 1.24 0.00 -1.00 0.00 0.00 174.74 174.20 1orn n GLU 24 N 5.14 1.96 -2.91 0.00 1.02 -1.26 -4.88 120.64 119.72 1orn n GLU 24 Ca 0.11 -1.45 -0.41 0.00 -0.02 0.00 0.00 57.16 55.39 1orn n GLU 24 Cb 0.46 -1.42 -0.04 0.00 -0.02 0.00 0.00 31.44 30.41 1orn n GLU 24 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1orn s LEU 25 N -1.52 4.22 -0.03 -4.62 1.43 -1.26 -4.97 118.68 111.93 1orn s LEU 25 Ca 0.34 1.22 -0.30 0.00 -1.03 0.00 0.00 54.13 54.35 1orn s LEU 25 Cb 0.19 -3.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1orn s LEU 25 CO 0.27 -0.33 1.20 -0.69 0.23 0.00 0.00 176.35 177.04 1orn s VAL 26 N 1.77 4.21 0.03 -1.59 1.01 -1.26 -5.01 120.40 119.55 1orn s VAL 26 Ca 0.39 1.55 -0.26 0.00 0.00 0.00 0.00 61.98 63.66 1orn s VAL 26 Cb -0.17 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.28 1orn s VAL 26 CO 0.15 0.02 0.60 -1.38 0.00 0.00 0.00 175.10 174.50 1orn s HIS 27 N 1.98 -0.55 -0.25 5.22 -0.00 -1.26 -4.90 115.29 115.53 1orn s HIS 27 Ca 0.57 0.73 0.08 0.00 -0.00 0.00 0.00 55.06 56.44 1orn s HIS 27 Cb -0.26 0.41 -0.10 0.00 -0.00 0.00 0.00 32.58 32.63 1orn s HIS 27 CO 0.24 -0.67 0.29 0.54 -0.00 0.00 0.00 174.74 175.14 1orn n ARG 28 N 0.49 2.82 -3.92 -0.38 1.74 -1.26 -5.00 116.66 111.16 1orn n ARG 28 Ca -0.18 -0.03 -0.08 0.00 -0.77 0.00 0.00 57.85 56.79 1orn n ARG 28 Cb 0.60 -1.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.00 1orn n ARG 28 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1orn s ASN 29 N -2.21 -0.18 0.39 0.55 2.20 -1.26 -5.05 114.94 109.39 1orn s ASN 29 Ca 0.01 -0.76 0.10 0.00 -0.94 0.00 0.00 52.86 51.27 1orn s ASN 29 Cb 0.06 0.67 0.88 0.00 -2.00 0.00 0.00 41.25 40.86 1orn s ASN 29 CO 0.34 -1.26 1.97 -0.65 -2.94 0.00 0.00 177.10 174.55 1orn h PRO 30 N 2.11 0.57 -0.23 3.55 0.11 -1.97 -0.94 132.00 135.20 1orn h PRO 30 Ca -0.22 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.78 1orn h PRO 30 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1orn h PRO 30 CO 0.29 0.38 -0.13 0.35 -0.21 0.00 0.00 178.00 178.68 1orn h PHE 31 N 0.59 0.58 -0.44 0.65 3.57 -1.97 -0.17 116.94 119.75 1orn h PHE 31 Ca 0.30 -0.15 -0.06 0.00 3.53 0.00 0.00 57.97 61.59 1orn h PHE 31 Cb 0.40 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1orn h PHE 31 CO -0.00 0.78 0.03 0.93 -2.23 0.00 0.00 178.31 177.82 1orn h GLU 32 N 0.21 0.69 -0.20 1.11 5.08 -1.83 -1.99 114.58 117.65 1orn h GLU 32 Ca 0.05 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1orn h GLU 32 Cb 0.64 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1orn h GLU 32 CO 0.04 0.69 0.05 1.25 -1.00 0.00 0.00 179.01 180.03 1orn h LEU 33 N 0.66 0.30 -0.32 1.33 5.85 -0.94 -1.13 115.31 121.07 1orn h LEU 33 Ca 0.14 -0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.68 1orn h LEU 33 Cb 0.37 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1orn h LEU 33 CO 0.01 0.45 0.01 0.25 -0.34 0.00 0.00 178.44 178.82 1orn h LEU 34 N 0.13 -0.12 -0.41 2.25 5.85 -0.70 0.25 115.31 122.56 1orn h LEU 34 Ca 0.06 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1orn h LEU 34 Cb 0.27 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1orn h LEU 34 CO 0.00 -0.02 0.20 0.40 -0.34 0.00 0.00 178.44 178.68 1orn h ILE 35 N 0.10 1.17 -0.76 4.05 1.08 -1.28 -1.92 117.51 119.94 1orn h ILE 35 Ca 0.15 -0.48 0.03 0.00 -0.39 0.00 0.00 64.86 64.17 1orn h ILE 35 Cb 0.21 0.73 -0.05 0.00 -3.07 0.00 0.00 36.82 34.64 1orn h ILE 35 CO -0.25 0.18 0.49 0.00 -0.69 0.00 0.00 178.15 177.88 1orn h ALA 36 N 1.05 0.99 -0.25 1.87 0.00 -0.61 -1.40 119.26 120.91 1orn h ALA 36 Ca 0.14 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1orn h ALA 36 Cb 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1orn h ALA 36 CO -0.02 0.30 -0.42 0.28 0.00 0.00 0.00 179.25 179.39 1orn h VAL 37 N 0.96 1.30 -0.60 0.00 2.07 -0.82 -0.47 116.25 118.69 1orn h VAL 37 Ca 0.30 -1.61 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 1orn h VAL 37 Cb -0.01 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1orn h VAL 37 CO -0.10 0.51 0.30 0.58 0.02 0.00 0.00 177.57 178.88 1orn h VAL 38 N 0.51 1.21 0.00 2.57 2.07 -0.97 -1.98 116.25 119.66 1orn h VAL 38 Ca 0.04 -0.57 -0.07 0.00 0.82 0.00 0.00 66.70 66.91 1orn h VAL 38 Cb 0.95 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1orn h VAL 38 CO 0.09 0.24 -0.35 -0.07 0.02 0.00 0.00 177.57 177.49 1orn h LEU 39 N 0.82 0.00 -2.35 2.57 3.38 -1.00 -3.12 115.31 115.61 1orn h LEU 39 Ca 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1orn h LEU 39 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1orn h LEU 39 CO -0.03 0.35 -0.00 -1.28 0.09 0.00 0.00 178.44 177.57 1orn h SER 40 N 0.00 0.00 -2.34 -0.43 0.87 -0.28 -3.42 113.55 107.94 1orn h SER 40 Ca -0.00 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.02 1orn h SER 40 Cb 0.68 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.66 1orn h SER 40 CO 0.05 0.00 1.22 0.00 -0.53 0.00 0.00 176.83 177.56 1orn n ALA 41 N -2.09 1.58 -2.99 6.23 0.00 -1.18 -1.99 120.51 120.08 1orn n ALA 41 Ca -0.01 0.23 -0.22 0.00 0.00 0.00 0.00 53.44 53.43 1orn n ALA 41 Cb 0.17 -2.66 0.03 0.00 0.00 0.00 0.00 19.45 16.99 1orn n ALA 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1orn n GLN 42 N 7.31 -4.70 -3.86 0.00 1.13 -1.26 -4.99 117.38 111.00 1orn n GLN 42 Ca 0.20 0.91 -0.10 0.00 -1.94 0.00 0.00 57.00 56.07 1orn n GLN 42 Cb 0.40 -5.77 -0.09 0.00 0.11 0.00 0.00 30.24 24.89 1orn n GLN 42 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1orn s THR 44 N -2.48 4.39 0.20 0.00 -4.23 -1.26 -4.87 115.64 107.40 1orn s THR 44 Ca -0.06 1.50 -0.10 0.00 -1.18 0.00 0.00 61.69 61.85 1orn s THR 44 Cb -0.02 -3.74 0.13 0.00 1.34 0.00 0.00 72.50 70.22 1orn s THR 44 CO -0.04 -0.13 1.82 0.44 -0.54 0.00 0.00 174.62 176.18 1orn h ASP 45 N 2.43 0.60 -0.55 3.99 3.45 -1.96 -1.89 116.42 122.49 1orn h ASP 45 Ca -0.48 0.02 0.11 0.00 0.43 0.00 0.00 57.03 57.10 1orn h ASP 45 Cb 1.18 -0.11 -0.09 0.00 -0.56 0.00 0.00 39.33 39.76 1orn h ASP 45 CO 0.63 0.40 0.04 0.00 -1.57 0.00 0.00 179.24 178.75 1orn h ALA 46 N 1.32 0.57 -0.16 3.45 0.00 -1.93 0.12 119.26 122.63 1orn h ALA 46 Ca 0.28 0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.20 1orn h ALA 46 Cb 0.11 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1orn h ALA 46 CO -0.15 -0.36 -0.48 -0.07 0.00 0.00 0.00 179.25 178.19 1orn h LEU 47 N 0.16 0.44 -0.34 0.00 -0.00 -1.85 -1.86 115.31 111.87 1orn h LEU 47 Ca 0.28 -0.21 -0.06 0.00 -0.00 0.00 0.00 57.88 57.89 1orn h LEU 47 Cb 0.43 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 1orn h LEU 47 CO -0.42 0.86 -0.02 0.58 -0.00 0.00 0.00 178.44 179.44 1orn h VAL 48 N 0.33 1.26 -0.40 1.22 2.07 -0.49 -2.04 116.25 118.20 1orn h VAL 48 Ca 0.02 -1.00 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 1orn h VAL 48 Cb 0.97 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1orn h VAL 48 CO 0.08 0.33 -0.06 0.78 0.02 0.00 0.00 177.57 178.72 1orn h ASN 49 N 0.40 0.65 -0.56 0.57 2.35 -0.71 0.51 115.58 118.80 1orn h ASN 49 Ca 0.09 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.58 1orn h ASN 49 Cb 0.48 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1orn h ASN 49 CO 0.02 0.76 -0.03 0.07 -1.65 0.00 0.00 177.43 176.60 1orn h LYS 50 N 0.63 1.00 -0.02 0.81 -0.00 -1.24 -2.09 116.57 115.66 1orn h LYS 50 Ca 0.12 -0.34 -0.01 0.00 -0.00 0.00 0.00 60.65 60.42 1orn h LYS 50 Cb 0.48 -0.08 0.00 0.00 -0.00 0.00 0.00 32.23 32.63 1orn h LYS 50 CO 0.03 1.02 -0.04 0.28 -0.00 0.00 0.00 179.45 180.73 1orn h VAL 51 N 0.89 1.43 0.00 0.07 2.07 -1.06 -3.20 116.25 116.46 1orn h VAL 51 Ca 0.15 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.32 1orn h VAL 51 Cb 0.58 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1orn h VAL 51 CO 0.03 0.36 -0.01 0.71 0.02 0.00 0.00 177.57 178.68 1orn h THR 52 N -0.46 0.06 -0.45 2.57 1.35 -0.94 -1.49 112.91 113.55 1orn h THR 52 Ca 0.00 -0.33 0.09 0.00 -0.55 0.00 0.00 66.41 65.62 1orn h THR 52 Cb 0.61 1.31 -0.09 0.00 -1.73 0.00 0.00 68.15 68.24 1orn h THR 52 CO 0.01 0.01 -0.22 0.50 -0.25 0.00 0.00 175.52 175.58 1orn h LYS 53 N 0.00 -0.12 0.05 4.72 1.63 -1.36 0.77 116.57 122.26 1orn h LYS 53 Ca -0.00 0.01 -0.29 0.00 -0.85 0.00 0.00 60.65 59.51 1orn h LYS 53 Cb 0.31 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.94 1orn h LYS 53 CO 0.00 -0.08 -1.60 0.07 -3.45 0.00 0.00 179.45 174.40 1orn h ARG 54 N -0.13 0.11 -0.68 1.90 0.11 -1.64 -3.37 114.38 110.68 1orn h ARG 54 Ca 0.21 -0.19 0.03 0.00 0.10 0.00 0.00 59.98 60.13 1orn h ARG 54 Cb 0.46 0.07 -0.04 0.00 1.11 0.00 0.00 29.97 31.57 1orn h ARG 54 CO -0.53 0.85 0.42 1.25 0.10 0.00 0.00 179.97 182.07 1orn h LEU 55 N 0.03 0.70 0.00 0.08 5.85 -0.86 -1.57 115.31 119.54 1orn h LEU 55 Ca -0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1orn h LEU 55 Cb 1.98 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.86 1orn h LEU 55 CO 0.11 0.48 0.00 0.49 -0.34 0.00 0.00 178.44 179.18 1orn n PHE 56 N -4.68 0.00 -0.06 1.25 3.72 0.23 -0.84 117.46 117.08 1orn n PHE 56 Ca 0.07 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.34 1orn n PHE 56 Cb 0.09 -0.16 -0.14 0.00 -0.94 0.00 0.00 39.48 38.32 1orn n PHE 56 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1orn n GLU 57 N -1.16 0.68 0.13 -1.08 -0.58 -0.63 -4.38 120.64 113.60 1orn n GLU 57 Ca 0.13 0.16 -0.24 0.00 -0.42 0.00 0.00 57.16 56.80 1orn n GLU 57 Cb 0.13 -1.64 -0.16 0.00 -0.57 0.00 0.00 31.44 29.21 1orn n GLU 57 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1orn h LYS 58 N 0.01 0.51 -5.45 3.49 3.64 -1.00 -3.45 116.57 114.32 1orn h LYS 58 Ca -0.45 -0.85 -0.67 0.00 -1.27 0.00 0.00 60.65 57.41 1orn h LYS 58 Cb 2.08 0.31 -0.30 0.00 -0.41 0.00 0.00 32.23 33.91 1orn h LYS 58 CO 0.03 1.41 -0.83 0.71 -2.27 0.00 0.00 179.45 178.50 1orn s TYR 59 N -2.59 2.64 0.00 1.91 2.02 -0.02 -4.99 117.35 116.32 1orn s TYR 59 Ca -0.10 -0.83 0.00 0.00 -0.37 0.00 0.00 57.07 55.77 1orn s TYR 59 Cb 0.03 -1.74 0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1orn s TYR 59 CO 0.93 -0.30 0.00 0.54 -1.57 0.00 0.00 175.55 175.15 1orn n ARG 60 N 3.40 2.58 -4.16 -0.62 1.74 -1.26 -4.28 116.66 114.07 1orn n ARG 60 Ca -0.18 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.80 1orn n ARG 60 Cb 0.53 -0.72 -0.10 0.00 -1.02 0.00 0.00 32.46 31.14 1orn n ARG 60 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1orn s THR 61 N -1.19 0.23 0.56 0.55 -4.23 -1.26 -4.97 115.64 105.33 1orn s THR 61 Ca 0.00 -1.91 0.27 0.00 -1.18 0.00 0.00 61.69 58.87 1orn s THR 61 Cb 0.00 -1.97 0.33 0.00 1.34 0.00 0.00 72.50 72.20 1orn s THR 61 CO 0.00 -0.55 2.22 1.55 -0.54 0.00 0.00 174.62 177.30 1orn h PRO 62 N 2.88 0.00 0.00 3.99 0.13 -1.91 -1.52 132.00 135.56 1orn h PRO 62 Ca -0.35 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.69 1orn h PRO 62 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1orn h PRO 62 CO 0.61 0.01 -0.40 0.45 -0.23 0.00 0.00 178.00 178.44 1orn h HIS 63 N 0.00 0.00 -0.39 1.56 3.86 -1.96 -2.94 115.15 115.28 1orn h HIS 63 Ca -0.00 0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.06 1orn h HIS 63 Cb 0.03 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 1orn h HIS 63 CO 0.00 0.40 -0.35 -0.44 0.86 0.00 0.00 177.93 178.40 1orn h ASP 64 N 0.00 0.97 -0.13 2.45 3.32 -1.68 -2.58 116.42 118.76 1orn h ASP 64 Ca -0.00 -0.43 -0.11 0.00 0.02 0.00 0.00 57.03 56.51 1orn h ASP 64 Cb 0.77 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 1orn h ASP 64 CO 0.05 1.21 -0.29 1.88 -1.72 0.00 0.00 179.24 180.38 1orn h TYR 65 N 0.75 0.70 -0.01 4.55 0.05 -1.53 -3.00 116.97 118.48 1orn h TYR 65 Ca 0.07 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.68 1orn h TYR 65 Cb 0.94 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.51 1orn h TYR 65 CO 0.06 0.83 -0.09 0.44 -1.05 0.00 0.00 178.16 178.35 1orn n ILE 66 N -4.09 0.00 0.66 -2.88 -5.35 -1.12 -3.81 119.36 102.77 1orn n ILE 66 Ca -0.01 -0.15 0.12 0.00 -0.27 0.00 0.00 62.75 62.44 1orn n ILE 66 Cb 0.45 0.25 0.16 0.00 -1.74 0.00 0.00 39.64 38.76 1orn n ILE 66 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1orn n ALA 67 N -0.40 3.14 -2.85 -1.28 0.00 -0.98 -4.91 120.51 113.23 1orn n ALA 67 Ca 0.17 -0.30 -0.23 0.00 0.00 0.00 0.00 53.44 53.08 1orn n ALA 67 Cb 0.31 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.60 1orn n ALA 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1orn s VAL 68 N -3.14 4.67 0.56 0.00 -7.23 -1.25 -5.09 120.40 108.93 1orn s VAL 68 Ca 0.07 -1.18 -0.19 0.00 -1.81 0.00 0.00 61.98 58.86 1orn s VAL 68 Cb 0.14 -3.48 -0.05 0.00 0.56 0.00 0.00 36.38 33.56 1orn s VAL 68 CO 0.73 -0.26 1.17 -2.84 -0.31 0.00 0.00 175.10 173.59 1orn s PRO 69 N -3.60 3.22 0.26 4.82 0.02 -1.26 -4.89 135.00 133.57 1orn s PRO 69 Ca 0.33 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 63.05 1orn s PRO 69 Cb -0.09 -2.00 0.50 0.00 0.02 0.00 0.00 34.50 32.93 1orn s PRO 69 CO 0.25 -0.98 1.80 1.25 -0.33 0.00 0.00 177.00 178.99 1orn h LEU 70 N 1.13 0.68 -1.71 -5.54 5.85 -1.97 -1.08 115.31 112.66 1orn h LEU 70 Ca -0.50 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.32 1orn h LEU 70 Cb 1.28 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 1orn h LEU 70 CO 0.56 0.34 0.26 -0.33 -0.34 0.00 0.00 178.44 178.93 1orn h GLU 71 N 0.77 0.36 -0.13 1.25 3.07 -2.00 -1.09 114.58 116.82 1orn h GLU 71 Ca 0.45 -0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 59.19 1orn h GLU 71 Cb 0.53 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1orn h GLU 71 CO -0.30 0.24 -0.30 1.49 -1.40 0.00 0.00 179.01 178.74 1orn h GLU 72 N 0.38 0.44 -0.42 2.33 4.81 -1.56 -2.94 114.58 117.62 1orn h GLU 72 Ca 0.16 -0.29 -0.08 0.00 -0.13 0.00 0.00 59.36 59.02 1orn h GLU 72 Cb 0.17 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 1orn h GLU 72 CO -0.04 0.90 -0.07 1.25 -0.73 0.00 0.00 179.01 180.33 1orn h LEU 73 N 0.04 0.69 -0.51 1.64 5.85 -1.26 -2.44 115.31 119.33 1orn h LEU 73 Ca 0.00 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.61 1orn h LEU 73 Cb 0.90 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 1orn h LEU 73 CO 0.07 0.80 0.18 -0.33 -0.34 0.00 0.00 178.44 178.82 1orn h GLU 74 N 0.66 0.35 -0.52 1.25 5.08 -1.18 -1.78 114.58 118.44 1orn h GLU 74 Ca 0.12 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 1orn h GLU 74 Cb 0.51 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1orn h GLU 74 CO 0.03 0.23 -0.02 1.96 -1.00 0.00 0.00 179.01 180.20 1orn h GLN 75 N 0.36 0.89 0.00 2.33 1.08 -1.31 -0.34 115.11 118.12 1orn h GLN 75 Ca 0.24 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1orn h GLN 75 Cb 0.26 -0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1orn h GLN 75 CO -0.25 0.90 -0.06 -0.44 -0.95 0.00 0.00 178.83 178.04 1orn h ASP 76 N 0.82 0.00 -0.02 1.46 3.45 -0.86 -2.70 116.42 118.57 1orn h ASP 76 Ca 0.15 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.61 1orn h ASP 76 Cb 0.52 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.29 1orn h ASP 76 CO 0.03 0.06 0.00 2.30 -1.57 0.00 0.00 179.24 180.05 1orn n ILE 77 N -3.98 1.42 -0.34 0.35 -5.35 -0.92 -4.81 119.36 105.73 1orn n ILE 77 Ca -0.03 -1.57 0.14 0.00 -0.27 0.00 0.00 62.75 61.03 1orn n ILE 77 Cb 0.15 0.16 0.35 0.00 -1.74 0.00 0.00 39.64 38.56 1orn n ILE 77 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1orn h ARG 78 N 0.13 0.69 0.00 6.28 2.43 -0.71 -1.49 114.38 121.71 1orn h ARG 78 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1orn h ARG 78 Cb 0.75 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1orn h ARG 78 CO 0.01 0.46 0.00 0.43 -1.51 0.00 0.00 179.97 179.35 1orn n SER 79 N -4.75 0.15 0.08 -3.80 7.64 -1.26 -2.33 113.62 109.34 1orn n SER 79 Ca 0.24 0.55 -0.08 0.00 1.01 0.00 0.00 58.87 60.58 1orn n SER 79 Cb 0.61 -0.57 -0.05 0.00 -1.01 0.00 0.00 64.21 63.19 1orn n SER 79 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1orn h ILE 80 N 0.00 1.58 0.00 0.44 1.08 -1.62 -3.50 117.51 115.50 1orn h ILE 80 Ca 0.00 -2.94 0.00 0.00 -0.39 0.00 0.00 64.86 61.53 1orn h ILE 80 Cb 0.18 2.64 0.00 0.00 -3.07 0.00 0.00 36.82 36.57 1orn h ILE 80 CO 0.00 0.85 0.00 0.61 -0.69 0.00 0.00 178.15 178.92 1orn n GLY 81 N 1.06 0.08 2.41 5.37 0.00 -0.99 -4.83 105.19 108.30 1orn n GLY 81 Ca -0.02 -1.78 -0.05 0.00 0.00 0.00 0.00 46.02 44.16 1orn n GLY 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1orn n LEU 82 N -0.96 -0.50 0.24 0.99 4.77 -1.26 -4.79 117.00 115.50 1orn n LEU 82 Ca 0.00 0.35 0.10 0.00 -0.03 0.00 0.00 56.01 56.43 1orn n LEU 82 Cb 0.00 -1.48 0.58 0.00 -2.33 0.00 0.00 43.42 40.19 1orn n LEU 82 CO 0.00 -0.07 0.88 0.10 -1.33 0.00 0.00 177.39 176.97 1orn h TYR 83 N 0.00 0.00 -0.00 -1.77 -0.00 -1.85 -1.93 116.97 111.41 1orn h TYR 83 Ca -0.13 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.60 1orn h TYR 83 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.78 1orn h TYR 83 CO 0.78 0.20 -0.00 0.00 -0.00 0.00 0.00 178.16 179.14 1orn h ARG 84 N 0.00 0.00 -0.55 0.10 3.08 -1.91 -1.43 114.38 113.66 1orn h ARG 84 Ca -0.00 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1orn h ARG 84 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1orn h ARG 84 CO 0.03 0.60 -0.07 -0.91 -1.07 0.00 0.00 179.97 178.55 1orn h ASN 85 N -0.60 1.01 -0.35 7.04 2.35 -1.95 -2.37 115.58 120.71 1orn h ASN 85 Ca -0.00 -0.34 -0.04 0.00 -0.55 0.00 0.00 56.30 55.37 1orn h ASN 85 Cb 0.60 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 1orn h ASN 85 CO 0.00 1.10 0.05 0.11 -1.65 0.00 0.00 177.43 177.05 1orn h LYS 86 N 0.89 0.58 -0.61 0.81 1.57 -1.40 0.40 116.57 118.81 1orn h LYS 86 Ca 0.15 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1orn h LYS 86 Cb 0.63 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1orn h LYS 86 CO 0.04 0.66 0.40 0.00 -0.57 0.00 0.00 179.45 179.99 1orn h ALA 87 N 0.90 0.78 -0.44 3.86 0.00 -1.23 0.21 119.26 123.34 1orn h ALA 87 Ca 0.11 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1orn h ALA 87 Cb 0.36 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1orn h ALA 87 CO 0.01 0.21 0.11 0.07 0.00 0.00 0.00 179.25 179.64 1orn h ARG 88 N 0.83 0.70 -0.73 0.00 -0.00 -1.25 -2.18 114.38 111.75 1orn h ARG 88 Ca 0.22 -0.17 -0.04 0.00 -0.00 0.00 0.00 59.98 59.99 1orn h ARG 88 Cb -0.09 -0.09 -0.03 0.00 -0.00 0.00 0.00 29.97 29.75 1orn h ARG 88 CO -0.05 0.71 0.29 -0.91 -0.00 0.00 0.00 179.97 180.01 1orn h ASN 89 N 0.57 1.01 -0.49 0.08 -0.26 -0.47 -2.19 115.58 113.84 1orn h ASN 89 Ca 0.14 -0.17 -0.01 0.00 -0.56 0.00 0.00 56.30 55.69 1orn h ASN 89 Cb 0.32 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.29 1orn h ASN 89 CO 0.00 0.91 0.26 0.40 -1.06 0.00 0.00 177.43 177.95 1orn h ILE 90 N 1.06 1.18 -0.75 2.81 2.04 -0.38 0.33 117.51 123.79 1orn h ILE 90 Ca 0.24 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1orn h ILE 90 Cb 0.21 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1orn h ILE 90 CO -0.02 0.19 0.27 1.56 0.00 0.00 0.00 178.15 180.15 1orn h GLN 91 N 0.65 1.14 -0.30 2.37 4.20 -1.23 -0.16 115.11 121.78 1orn h GLN 91 Ca 0.17 -0.23 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 1orn h GLN 91 Cb 0.07 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1orn h GLN 91 CO -0.03 0.95 -0.34 -0.22 -0.67 0.00 0.00 178.83 178.52 1orn h LYS 92 N 1.10 0.67 -0.44 1.46 1.63 -1.05 -2.04 116.57 117.90 1orn h LYS 92 Ca 0.25 -0.32 -0.04 0.00 -0.85 0.00 0.00 60.65 59.69 1orn h LYS 92 Cb 0.26 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 1orn h LYS 92 CO -0.01 0.92 0.11 1.25 -3.45 0.00 0.00 179.45 178.26 1orn h LEU 93 N 0.56 0.67 -0.85 5.20 6.46 0.04 -1.89 115.31 125.50 1orn h LEU 93 Ca 0.06 -0.23 -0.09 0.00 -0.12 0.00 0.00 57.88 57.50 1orn h LEU 93 Cb 0.86 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 1orn h LEU 93 CO 0.07 0.73 -0.07 0.00 -0.62 0.00 0.00 178.44 178.55 1orn h ALA 95 N 1.20 1.14 -0.16 0.00 0.00 -1.19 -2.73 119.26 117.51 1orn h ALA 95 Ca 0.13 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1orn h ALA 95 Cb 0.54 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1orn h ALA 95 CO 0.03 0.55 -0.57 1.98 0.00 0.00 0.00 179.25 181.24 1orn h MET 96 N 0.66 0.51 -0.67 0.00 -1.53 -0.89 -1.06 114.93 111.95 1orn h MET 96 Ca 0.13 -0.33 -0.01 0.00 -3.44 0.00 0.00 59.70 56.05 1orn h MET 96 Cb 0.47 0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.53 1orn h MET 96 CO 0.02 0.94 0.40 -0.07 0.14 0.00 0.00 176.91 178.34 1orn h LEU 97 N 0.39 0.81 -0.05 3.39 3.38 -1.09 0.34 115.31 122.48 1orn h LEU 97 Ca 0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1orn h LEU 97 Cb 1.11 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1orn h LEU 97 CO 0.10 0.64 -0.01 0.40 0.09 0.00 0.00 178.44 179.67 1orn h ILE 98 N 0.91 1.28 0.00 1.22 2.04 -1.35 0.25 117.51 121.87 1orn h ILE 98 Ca 0.24 -0.87 -0.22 0.00 1.00 0.00 0.00 64.86 65.01 1orn h ILE 98 Cb -0.01 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1orn h ILE 98 CO -0.04 0.24 -0.92 0.44 0.00 0.00 0.00 178.15 177.86 1orn h ASP 99 N -0.23 0.44 0.00 1.72 3.32 -1.04 -3.35 116.42 117.28 1orn h ASP 99 Ca 0.01 -0.36 -0.11 0.00 0.02 0.00 0.00 57.03 56.59 1orn h ASP 99 Cb 0.38 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1orn h ASP 99 CO 0.00 1.16 -1.58 0.29 -1.72 0.00 0.00 179.24 177.39 1orn n LYS 100 N -3.72 1.76 -1.26 3.56 4.01 0.12 -4.78 118.16 117.86 1orn n LYS 100 Ca -0.06 -0.03 -0.09 0.00 -0.51 0.00 0.00 58.31 57.62 1orn n LYS 100 Cb 0.83 -1.24 0.12 0.00 -0.51 0.00 0.00 35.03 34.23 1orn n LYS 100 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 1orn n TYR 101 N -2.18 1.35 -3.83 2.13 4.01 -0.51 -4.97 117.16 113.17 1orn n TYR 101 Ca -0.11 -1.86 -0.30 0.00 -0.16 0.00 0.00 57.90 55.48 1orn n TYR 101 Cb 0.63 -0.33 0.01 0.00 -0.31 0.00 0.00 39.34 39.33 1orn n TYR 101 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1orn n ASN 102 N -0.94 -4.31 -0.50 7.72 5.15 -1.09 -1.49 115.26 119.81 1orn n ASN 102 Ca 0.32 -0.72 -0.07 0.00 -0.60 0.00 0.00 54.58 53.51 1orn n ASN 102 Cb 0.84 -3.48 -0.03 0.00 -0.53 0.00 0.00 39.78 36.58 1orn n ASN 102 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1orn n GLY 103 N -1.50 0.70 3.34 8.20 0.00 0.77 -4.96 105.19 111.75 1orn n GLY 103 Ca 0.03 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1orn n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1orn s GLU 104 N -2.34 1.29 -0.04 1.61 2.02 -0.56 -4.84 118.70 115.85 1orn s GLU 104 Ca 0.00 -1.41 -0.30 0.00 0.02 0.00 0.00 54.97 53.28 1orn s GLU 104 Cb 0.00 -1.37 -0.05 0.00 0.10 0.00 0.00 34.13 32.81 1orn s GLU 104 CO 0.00 0.28 1.55 0.08 0.02 0.00 0.00 175.26 177.19 1orn s VAL 105 N -2.00 3.62 0.50 2.63 1.01 -1.26 -4.77 120.40 120.13 1orn s VAL 105 Ca 0.16 0.86 -0.22 0.00 0.00 0.00 0.00 61.98 62.78 1orn s VAL 105 Cb -0.06 -3.55 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 1orn s VAL 105 CO 0.07 -0.05 1.18 -2.16 0.00 0.00 0.00 175.10 174.14 1orn s PRO 106 N 3.42 3.52 0.00 2.72 0.04 -1.26 -4.93 135.00 138.51 1orn s PRO 106 Ca 0.69 1.79 0.27 0.00 0.04 0.00 0.00 61.00 63.79 1orn s PRO 106 Cb -0.32 -2.25 0.82 0.00 0.04 0.00 0.00 34.50 32.79 1orn s PRO 106 CO 0.27 -0.75 1.61 0.54 0.04 0.00 0.00 177.00 178.71 1orn n ARG 107 N -0.84 1.35 -3.34 4.56 1.74 -1.26 -4.80 116.66 114.07 1orn n ARG 107 Ca 0.09 -0.84 -0.38 0.00 -0.77 0.00 0.00 57.85 55.96 1orn n ARG 107 Cb 0.49 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.38 1orn n ARG 107 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1orn s ASP 108 N -2.23 6.71 0.10 0.55 2.15 -1.26 -4.89 116.67 117.80 1orn s ASP 108 Ca 0.31 0.84 -0.21 0.00 0.43 0.00 0.00 52.55 53.92 1orn s ASP 108 Cb 0.20 -2.28 -0.10 0.00 -0.30 0.00 0.00 42.92 40.44 1orn s ASP 108 CO 0.42 0.05 1.74 -0.09 -0.17 0.00 0.00 175.17 177.11 1orn h ARG 109 N 6.42 0.17 0.00 4.34 1.12 -1.89 -0.91 114.38 123.63 1orn h ARG 109 Ca -0.42 -0.01 -0.06 0.00 -1.11 0.00 0.00 59.98 58.38 1orn h ARG 109 Cb 1.18 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.10 1orn h ARG 109 CO 0.74 0.14 -0.27 -0.44 -3.11 0.00 0.00 179.97 177.03 1orn h ASP 110 N 0.15 0.00 -0.08 -3.80 5.19 -1.97 -1.98 116.42 113.94 1orn h ASP 110 Ca 0.05 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.25 1orn h ASP 110 Cb 0.01 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.53 1orn h ASP 110 CO -0.01 0.27 -0.73 -0.33 -3.12 0.00 0.00 179.24 175.32 1orn h GLU 111 N 0.00 0.72 -0.74 3.56 4.39 -1.89 -3.10 114.58 117.52 1orn h GLU 111 Ca -0.00 -0.56 -0.01 0.00 0.34 0.00 0.00 59.36 59.13 1orn h GLU 111 Cb 0.48 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 1orn h GLU 111 CO 0.04 1.18 0.42 -0.07 -1.16 0.00 0.00 179.01 179.41 1orn h LEU 112 N 0.50 0.90 -0.71 1.33 3.38 -0.62 -1.71 115.31 118.38 1orn h LEU 112 Ca -0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1orn h LEU 112 Cb 1.34 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1orn h LEU 112 CO 0.15 0.72 0.00 0.23 0.09 0.00 0.00 178.44 179.62 1orn n MET 113 N -4.37 0.11 0.13 1.13 2.81 -0.80 -1.44 117.12 114.69 1orn n MET 113 Ca 0.08 0.48 0.13 0.00 -1.81 0.00 0.00 57.70 56.58 1orn n MET 113 Cb 0.09 -1.78 0.39 0.00 -0.71 0.00 0.00 33.22 31.21 1orn n MET 113 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1orn h LYS 114 N 0.00 0.00 -6.80 0.03 1.57 -1.33 -3.45 116.57 106.59 1orn h LYS 114 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 1orn h LYS 114 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1orn h LYS 114 CO 0.00 0.00 0.43 -0.51 -0.57 0.00 0.00 179.45 178.80 1orn s LEU 115 N -4.83 4.56 0.18 2.94 1.43 -0.52 -4.99 118.68 117.43 1orn s LEU 115 Ca 0.09 2.14 -0.31 0.00 -1.03 0.00 0.00 54.13 55.02 1orn s LEU 115 Cb 0.11 -3.67 -0.09 0.00 0.03 0.00 0.00 46.19 42.57 1orn s LEU 115 CO 0.57 -0.06 1.43 -2.84 0.23 0.00 0.00 176.35 175.68 1orn s PRO 116 N -1.44 4.30 0.00 1.29 0.02 -1.26 -2.37 135.00 135.54 1orn s PRO 116 Ca 0.44 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1orn s PRO 116 Cb -0.29 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.05 1orn s PRO 116 CO 0.37 -0.43 0.00 0.41 -0.33 0.00 0.00 177.00 177.01 1orn n GLY 117 N 2.99 0.88 3.34 0.52 0.00 -1.26 -4.66 105.19 107.01 1orn n GLY 117 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1orn n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orn s VAL 118 N -2.34 3.97 0.00 1.61 1.01 -1.00 -4.88 120.40 118.78 1orn s VAL 118 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1orn s VAL 118 Cb 0.00 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.31 1orn s VAL 118 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.76 1orn n GLY 119 N 4.87 3.27 0.34 4.51 0.00 -1.26 -4.52 105.19 112.40 1orn n GLY 119 Ca -0.14 -2.11 -0.05 0.00 0.00 0.00 0.00 46.02 43.72 1orn n GLY 119 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1orn h ARG 120 N 0.00 1.18 -0.10 1.61 2.43 -1.97 -1.39 114.38 116.15 1orn h ARG 120 Ca 0.00 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1orn h ARG 120 Cb 0.00 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.33 1orn h ARG 120 CO 0.00 0.91 0.06 -0.22 -1.51 0.00 0.00 179.97 179.21 1orn h LYS 121 N 1.17 0.14 -0.27 0.20 3.11 -1.95 -0.94 116.57 118.02 1orn h LYS 121 Ca 0.28 -0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 58.11 1orn h LYS 121 Cb 0.12 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.30 1orn h LYS 121 CO -0.04 0.15 0.16 1.15 -2.81 0.00 0.00 179.45 178.07 1orn h THR 122 N 0.08 1.10 -0.78 1.00 2.02 -1.90 -1.90 112.91 112.54 1orn h THR 122 Ca 0.04 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.95 1orn h THR 122 Cb 0.05 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 1orn h THR 122 CO -0.01 0.10 0.44 0.00 0.37 0.00 0.00 175.52 176.43 1orn h ALA 123 N 1.05 0.99 -0.73 6.16 0.00 -1.15 -2.10 119.26 123.49 1orn h ALA 123 Ca 0.10 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1orn h ALA 123 Cb 0.02 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1orn h ALA 123 CO -0.02 0.48 0.26 -0.91 0.00 0.00 0.00 179.25 179.06 1orn h ASN 124 N 1.07 1.04 -0.29 0.00 2.35 -0.93 -1.45 115.58 117.37 1orn h ASN 124 Ca 0.28 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.82 1orn h ASN 124 Cb 0.00 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 1orn h ASN 124 CO -0.05 0.95 0.14 0.58 -1.65 0.00 0.00 177.43 177.40 1orn h VAL 125 N 1.06 1.15 0.04 2.81 2.07 -1.05 -2.04 116.25 120.31 1orn h VAL 125 Ca 0.24 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1orn h VAL 125 Cb 0.26 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1orn h VAL 125 CO -0.01 0.16 -0.02 0.58 0.02 0.00 0.00 177.57 178.30 1orn h VAL 126 N 0.33 1.01 -0.14 2.57 2.07 -1.18 0.57 116.25 121.47 1orn h VAL 126 Ca 0.10 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 1orn h VAL 126 Cb 0.13 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1orn h VAL 126 CO -0.01 0.04 -0.18 -0.37 0.02 0.00 0.00 177.57 177.07 1orn h VAL 127 N -0.12 1.20 0.11 2.57 -1.51 -1.26 -0.32 116.25 116.92 1orn h VAL 127 Ca -0.01 -0.91 -0.01 0.00 -1.23 0.00 0.00 66.70 64.55 1orn h VAL 127 Cb 0.10 1.29 0.00 0.00 -2.13 0.00 0.00 31.29 30.56 1orn h VAL 127 CO 0.01 0.28 -0.05 -1.28 -1.23 0.00 0.00 177.57 175.29 1orn h SER 128 N 0.22 -0.13 -0.04 4.19 0.87 -1.17 -0.23 113.55 117.26 1orn h SER 128 Ca 0.04 -0.44 -0.06 0.00 -1.23 0.00 0.00 61.79 60.10 1orn h SER 128 Cb 0.45 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1orn h SER 128 CO 0.03 0.48 -0.22 0.58 -0.53 0.00 0.00 176.83 177.17 1orn h VAL 129 N -0.85 1.47 0.05 2.23 2.07 -0.89 -2.35 116.25 117.97 1orn h VAL 129 Ca -0.02 -1.71 -0.26 0.00 0.82 0.00 0.00 66.70 65.54 1orn h VAL 129 Cb 0.56 2.46 0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1orn h VAL 129 CO 0.03 0.47 -1.04 0.00 0.02 0.00 0.00 177.57 177.05 1orn h ALA 130 N 0.38 0.06 -0.18 1.67 0.00 -1.22 -3.38 119.26 116.59 1orn h ALA 130 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1orn h ALA 130 Cb 0.89 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1orn h ALA 130 CO 0.05 0.63 0.00 1.19 0.00 0.00 0.00 179.25 181.11 1orn n PHE 131 N -3.90 0.25 -1.44 0.00 3.72 -0.94 -4.98 117.46 110.17 1orn n PHE 131 Ca -0.12 -0.51 -0.15 0.00 -0.05 0.00 0.00 57.45 56.62 1orn n PHE 131 Cb 0.89 -0.04 -0.06 0.00 -0.94 0.00 0.00 39.48 39.32 1orn n PHE 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1orn n GLY 132 N 0.02 1.47 3.69 1.37 0.00 -0.89 -4.93 105.19 105.92 1orn n GLY 132 Ca 0.06 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1orn n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1orn s VAL 133 N -2.36 4.81 0.22 1.61 1.01 -0.14 -4.93 120.40 120.62 1orn s VAL 133 Ca 0.00 2.00 -0.32 0.00 0.00 0.00 0.00 61.98 63.66 1orn s VAL 133 Cb 0.00 -4.29 -0.12 0.00 0.00 0.00 0.00 36.38 31.97 1orn s VAL 133 CO 0.00 0.04 1.70 -2.16 0.00 0.00 0.00 175.10 174.68 1orn s PRO 134 N 1.83 4.12 -0.07 2.72 0.04 -1.26 -3.40 135.00 138.99 1orn s PRO 134 Ca 0.48 2.61 -0.29 0.00 0.04 0.00 0.00 61.00 63.83 1orn s PRO 134 Cb -0.19 -3.06 0.11 0.00 0.04 0.00 0.00 34.50 31.40 1orn s PRO 134 CO 0.19 -0.74 0.91 0.00 0.04 0.00 0.00 177.00 177.40 1orn s ALA 135 N 0.98 -1.86 -0.27 8.56 0.00 -1.26 -4.96 121.76 122.96 1orn s ALA 135 Ca 0.73 1.26 0.03 0.00 0.00 0.00 0.00 51.96 53.97 1orn s ALA 135 Cb -0.49 -0.04 0.06 0.00 0.00 0.00 0.00 23.12 22.65 1orn s ALA 135 CO 0.35 -0.52 -0.08 0.42 0.00 0.00 0.00 175.76 175.93 1orn s ILE 136 N -2.19 2.08 -0.21 0.00 1.01 -1.26 -3.88 121.20 116.74 1orn s ILE 136 Ca 0.01 -1.66 -0.24 0.00 0.00 0.00 0.00 60.65 58.76 1orn s ILE 136 Cb -0.01 -2.25 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 1orn s ILE 136 CO -0.03 -0.11 0.80 0.00 0.00 0.00 0.00 174.94 175.60 1orn s ALA 137 N 1.12 3.59 -0.41 9.38 0.00 -1.26 -4.92 121.76 129.27 1orn s ALA 137 Ca -0.06 -0.11 -0.14 0.00 0.00 0.00 0.00 51.96 51.65 1orn s ALA 137 Cb -0.20 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.74 1orn s ALA 137 CO -0.06 -0.79 0.29 0.08 0.00 0.00 0.00 175.76 175.28 1orn s VAL 138 N 2.50 5.03 0.00 0.00 1.01 -1.26 -4.90 120.40 122.78 1orn s VAL 138 Ca 0.35 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1orn s VAL 138 Cb -0.16 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1orn s VAL 138 CO 0.09 -0.33 0.00 -0.90 0.00 0.00 0.00 175.10 173.96 1orn n ASP 139 N 5.11 1.09 -0.26 3.32 5.75 -1.26 -4.79 116.55 125.51 1orn n ASP 139 Ca -0.11 -0.67 -0.04 0.00 -0.01 0.00 0.00 54.79 53.96 1orn n ASP 139 Cb 0.46 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.62 1orn n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1orn h THR 140 N 0.37 1.14 -0.06 2.12 1.03 -1.99 -1.68 112.91 113.84 1orn h THR 140 Ca 0.00 -0.32 -0.01 0.00 -0.01 0.00 0.00 66.41 66.06 1orn h THR 140 Cb 0.00 0.11 -0.00 0.00 -1.07 0.00 0.00 68.15 67.19 1orn h THR 140 CO 0.00 0.17 -0.02 0.45 -0.01 0.00 0.00 175.52 176.12 1orn h HIS 141 N 0.95 0.12 -0.55 0.00 3.86 -1.95 -1.05 115.15 116.53 1orn h HIS 141 Ca 0.28 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 1orn h HIS 141 Cb -0.04 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.37 1orn h HIS 141 CO -0.03 0.46 0.36 0.28 0.86 0.00 0.00 177.93 179.86 1orn h VAL 142 N -0.25 1.14 -0.00 2.45 2.07 -1.81 -0.28 116.25 119.57 1orn h VAL 142 Ca 0.01 -0.26 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 1orn h VAL 142 Cb 0.42 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1orn h VAL 142 CO 0.01 0.14 0.00 -0.08 0.02 0.00 0.00 177.57 177.66 1orn h GLU 143 N 0.75 0.00 -0.30 1.57 4.81 -1.29 -1.10 114.58 119.02 1orn h GLU 143 Ca 0.20 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1orn h GLU 143 Cb -0.08 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 1orn h GLU 143 CO -0.04 0.15 0.15 -0.09 -0.73 0.00 0.00 179.01 178.44 1orn h ARG 144 N -0.14 0.30 -0.61 1.92 2.43 -0.98 -1.14 114.38 116.17 1orn h ARG 144 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1orn h ARG 144 Cb 0.14 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1orn h ARG 144 CO -0.00 0.20 0.32 0.28 -1.51 0.00 0.00 179.97 179.26 1orn h VAL 145 N 0.31 1.20 -0.48 0.20 2.07 -1.00 -0.59 116.25 117.96 1orn h VAL 145 Ca 0.13 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1orn h VAL 145 Cb 0.05 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1orn h VAL 145 CO -0.09 0.22 0.29 0.28 0.02 0.00 0.00 177.57 178.29 1orn h SER 146 N 0.82 0.57 0.14 0.57 0.02 -0.87 -1.97 113.55 112.82 1orn h SER 146 Ca 0.21 -0.05 -0.18 0.00 -0.84 0.00 0.00 61.79 60.93 1orn h SER 146 Cb 0.06 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 1orn h SER 146 CO -0.03 0.44 -0.70 0.11 -1.14 0.00 0.00 176.83 175.52 1orn h LYS 147 N 0.64 0.50 -0.30 3.45 1.57 -1.03 0.13 116.57 121.52 1orn h LYS 147 Ca 0.17 -0.39 -0.07 0.00 -1.87 0.00 0.00 60.65 58.49 1orn h LYS 147 Cb -0.02 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1orn h LYS 147 CO -0.03 1.01 -0.09 0.00 -0.57 0.00 0.00 179.45 179.77 1orn h ARG 148 N 0.35 0.60 0.00 3.15 3.08 -1.01 -3.11 114.38 117.44 1orn h ARG 148 Ca -0.03 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.75 1orn h ARG 148 Cb 1.27 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 1orn h ARG 148 CO 0.13 0.80 -0.17 -0.07 -1.07 0.00 0.00 179.97 179.58 1orn h LEU 149 N 0.36 0.00 0.00 3.04 4.07 -1.40 -3.18 115.31 118.20 1orn h LEU 149 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1orn h LEU 149 Cb 0.59 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.33 1orn h LEU 149 CO 0.03 0.17 0.00 0.61 -1.08 0.00 0.00 178.44 178.18 1orn n GLY 150 N 0.28 1.14 0.23 0.83 0.00 -0.82 -4.57 105.19 102.28 1orn n GLY 150 Ca 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.79 1orn n GLY 150 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1orn h PHE 151 N 0.00 0.41 -3.89 1.61 -1.00 -1.05 -0.46 116.94 112.55 1orn h PHE 151 Ca 0.00 -0.08 -0.28 0.00 2.81 0.00 0.00 57.97 60.43 1orn h PHE 151 Cb 0.07 -0.10 -0.07 0.00 3.61 0.00 0.00 35.95 39.46 1orn h PHE 151 CO 0.00 0.59 -0.18 0.00 -1.61 0.00 0.00 178.31 177.11 1orn s ARG 153 N -2.78 4.03 0.59 0.00 0.52 -1.26 -4.68 118.95 115.37 1orn s ARG 153 Ca 0.27 0.74 0.29 0.00 -0.52 0.00 0.00 55.73 56.51 1orn s ARG 153 Cb -0.00 -2.38 1.72 0.00 0.52 0.00 0.00 34.95 34.80 1orn s ARG 153 CO 0.19 0.11 2.14 -1.49 0.02 0.00 0.00 175.30 176.27 1orn h TRP 154 N 2.13 0.00 -0.01 -0.53 4.06 -1.97 -1.62 115.95 118.00 1orn h TRP 154 Ca -0.48 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.47 1orn h TRP 154 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1orn h TRP 154 CO 0.62 0.00 -0.11 -0.40 -3.56 0.00 0.00 178.44 174.99 1orn n ASP 155 N -3.79 1.54 -4.75 -3.49 5.68 -1.26 -4.96 116.55 105.52 1orn n ASP 155 Ca 0.00 -1.36 -0.37 0.00 -0.50 0.00 0.00 54.79 52.56 1orn n ASP 155 Cb 0.26 0.07 0.03 0.00 -1.14 0.00 0.00 41.12 40.34 1orn n ASP 155 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1orn s ASP 156 N -2.18 5.39 0.84 -1.12 1.01 -0.61 -5.02 116.67 114.98 1orn s ASP 156 Ca 0.32 2.55 -0.12 0.00 0.71 0.00 0.00 52.55 56.01 1orn s ASP 156 Cb 0.20 -2.62 0.09 0.00 1.01 0.00 0.00 42.92 41.61 1orn s ASP 156 CO 0.40 -1.47 1.15 -0.94 0.21 0.00 0.00 175.17 174.52 1orn s SER 157 N -1.24 4.22 0.38 0.27 1.04 -1.26 -4.87 113.70 112.24 1orn s SER 157 Ca 0.72 0.93 0.15 0.00 0.48 0.00 0.00 55.95 58.23 1orn s SER 157 Cb -0.35 -1.50 0.78 0.00 0.10 0.00 0.00 66.02 65.06 1orn s SER 157 CO 0.40 -2.10 1.83 -0.37 0.98 0.00 0.00 173.24 173.98 1orn h VAL 158 N -1.19 1.12 -0.45 5.02 -1.51 -1.96 -1.72 116.25 115.57 1orn h VAL 158 Ca -0.48 -1.28 -0.12 0.00 -1.23 0.00 0.00 66.70 63.59 1orn h VAL 158 Cb 1.32 1.72 -0.01 0.00 -2.13 0.00 0.00 31.29 32.18 1orn h VAL 158 CO 0.64 0.35 -0.20 0.25 -1.23 0.00 0.00 177.57 177.38 1orn h LEU 159 N 0.00 0.92 -0.66 4.19 6.46 -1.97 -1.26 115.31 122.99 1orn h LEU 159 Ca -0.00 -0.33 -0.03 0.00 -0.12 0.00 0.00 57.88 57.39 1orn h LEU 159 Cb 0.69 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.34 1orn h LEU 159 CO 0.05 1.09 0.29 -0.33 -0.62 0.00 0.00 178.44 178.91 1orn h GLU 160 N 0.79 0.98 -0.29 1.25 5.08 -1.76 -0.48 114.58 120.15 1orn h GLU 160 Ca 0.11 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1orn h GLU 160 Cb 0.75 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1orn h GLU 160 CO 0.06 0.80 0.17 0.28 -1.00 0.00 0.00 179.01 179.33 1orn h VAL 161 N 0.93 1.10 -0.33 3.13 2.07 -1.02 -1.60 116.25 120.52 1orn h VAL 161 Ca 0.22 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1orn h VAL 161 Cb 0.17 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1orn h VAL 161 CO -0.02 0.10 0.17 -0.08 0.02 0.00 0.00 177.57 177.76 1orn h GLU 162 N 0.37 0.35 -0.52 1.57 4.81 -0.79 -2.22 114.58 118.14 1orn h GLU 162 Ca 0.10 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1orn h GLU 162 Cb 0.01 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1orn h GLU 162 CO -0.02 0.23 0.09 0.87 -0.73 0.00 0.00 179.01 179.45 1orn h LYS 163 N 0.36 0.81 -0.34 1.92 1.57 -0.93 -1.22 116.57 118.74 1orn h LYS 163 Ca 0.14 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1orn h LYS 163 Cb 0.04 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1orn h LYS 163 CO -0.09 0.76 0.19 1.15 -0.57 0.00 0.00 179.45 180.89 1orn h THR 164 N 0.78 1.13 -0.52 -0.16 2.02 -0.96 -2.44 112.91 112.75 1orn h THR 164 Ca 0.17 -0.34 -0.11 0.00 0.77 0.00 0.00 66.41 66.89 1orn h THR 164 Cb 0.34 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1orn h THR 164 CO 0.00 0.14 -0.10 -0.07 0.37 0.00 0.00 175.52 175.86 1orn h LEU 165 N 0.43 0.97 -1.64 2.58 3.38 -1.15 -2.75 115.31 117.13 1orn h LEU 165 Ca 0.12 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1orn h LEU 165 Cb 0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1orn h LEU 165 CO -0.02 1.08 0.02 0.24 0.09 0.00 0.00 178.44 179.85 1orn h MET 166 N 0.87 0.24 0.00 1.13 2.86 -1.00 -0.16 114.93 118.88 1orn h MET 166 Ca 0.14 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1orn h MET 166 Cb 0.64 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1orn h MET 166 CO 0.04 0.25 -0.47 0.87 1.06 0.00 0.00 176.91 178.67 1orn h LYS 167 N 0.24 0.00 0.00 1.72 1.57 -1.26 -3.34 116.57 115.50 1orn h LYS 167 Ca 0.06 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.56 1orn h LYS 167 Cb 0.14 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 1orn h LYS 167 CO 0.00 0.28 -1.87 -0.89 -0.57 0.00 0.00 179.45 176.41 1orn n ILE 168 N -3.11 1.41 -4.30 1.86 2.08 -0.92 -4.93 119.36 111.45 1orn n ILE 168 Ca 0.01 -0.79 -0.35 0.00 0.56 0.00 0.00 62.75 62.19 1orn n ILE 168 Cb 0.67 -0.78 -0.10 0.00 -0.75 0.00 0.00 39.64 38.68 1orn n ILE 168 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1orn s ILE 169 N -2.66 4.37 0.25 1.39 1.01 -0.12 -4.98 121.20 120.46 1orn s ILE 169 Ca -0.06 -0.21 -0.31 0.00 0.00 0.00 0.00 60.65 60.07 1orn s ILE 169 Cb 0.08 -2.87 -0.11 0.00 0.01 0.00 0.00 42.46 39.56 1orn s ILE 169 CO 0.83 0.56 1.58 -2.84 0.00 0.00 0.00 174.94 175.07 1orn s PRO 170 N -0.48 4.17 0.43 2.79 0.02 -1.26 -4.76 135.00 135.90 1orn s PRO 170 Ca 0.09 2.49 0.26 0.00 0.02 0.00 0.00 61.00 63.86 1orn s PRO 170 Cb -0.12 -3.07 1.31 0.00 0.02 0.00 0.00 34.50 32.64 1orn s PRO 170 CO 0.02 -0.60 1.68 -0.22 -0.33 0.00 0.00 177.00 177.55 1orn h LYS 171 N 5.53 0.19 0.00 5.54 3.64 -1.97 0.59 116.57 130.09 1orn h LYS 171 Ca -0.45 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1orn h LYS 171 Cb 1.21 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1orn h LYS 171 CO 0.84 0.13 0.00 0.93 -2.27 0.00 0.00 179.45 179.07 1orn h GLU 172 N 0.20 0.00 -0.18 1.90 3.07 -2.01 -2.75 114.58 114.81 1orn h GLU 172 Ca 0.73 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.59 1orn h GLU 172 Cb 2.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.08 1orn h GLU 172 CO -0.36 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 177.64 1orn n GLU 173 N -3.07 1.67 0.09 2.33 1.02 0.21 -4.72 120.64 118.16 1orn n GLU 173 Ca -0.01 -1.65 -0.12 0.00 -0.02 0.00 0.00 57.16 55.36 1orn n GLU 173 Cb 0.18 -1.28 -0.05 0.00 -0.02 0.00 0.00 31.44 30.27 1orn n GLU 173 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 1orn h TRP 174 N 2.54 -0.53 -0.19 -0.32 6.55 -1.33 -1.97 115.95 120.70 1orn h TRP 174 Ca 0.00 0.01 0.02 0.00 0.95 0.00 0.00 58.89 59.87 1orn h TRP 174 Cb 0.65 0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 29.15 1orn h TRP 174 CO 0.11 -0.29 0.06 0.77 -1.05 0.00 0.00 178.44 178.04 1orn h SER 175 N -0.36 0.06 0.26 -3.49 0.02 -1.81 -1.83 113.55 106.40 1orn h SER 175 Ca 0.04 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.87 1orn h SER 175 Cb 0.40 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1orn h SER 175 CO -0.14 0.06 -0.53 -0.29 -1.14 0.00 0.00 176.83 174.79 1orn h ILE 176 N 0.15 1.35 -0.54 3.27 6.09 -1.88 -2.71 117.51 123.24 1orn h ILE 176 Ca 0.08 -1.80 -0.08 0.00 -1.37 0.00 0.00 64.86 61.68 1orn h ILE 176 Cb 0.06 1.86 -0.02 0.00 0.47 0.00 0.00 36.82 39.18 1orn h ILE 176 CO -0.09 0.54 -0.00 0.74 -3.07 0.00 0.00 178.15 176.27 1orn h THR 177 N 0.23 1.25 -0.08 2.19 2.02 -1.22 -0.56 112.91 116.75 1orn h THR 177 Ca 0.01 -1.08 0.02 0.00 0.77 0.00 0.00 66.41 66.13 1orn h THR 177 Cb 1.01 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 1orn h THR 177 CO 0.09 0.38 -0.05 -0.74 0.37 0.00 0.00 175.52 175.57 1orn h HIS 178 N 0.84 -0.11 -0.73 3.16 -0.00 -1.15 0.16 115.15 117.33 1orn h HIS 178 Ca 0.16 0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.49 1orn h HIS 178 Cb 0.50 0.06 -0.03 0.00 -0.00 0.00 0.00 27.41 27.94 1orn h HIS 178 CO 0.03 -0.07 0.27 0.45 -0.00 0.00 0.00 177.93 178.61 1orn h HIS 179 N -0.04 1.12 -0.61 5.26 -0.00 -1.18 -1.44 115.15 118.26 1orn h HIS 179 Ca 0.05 -0.09 -0.06 0.00 -0.00 0.00 0.00 60.37 60.27 1orn h HIS 179 Cb 0.12 -0.33 -0.03 0.00 -0.00 0.00 0.00 27.41 27.17 1orn h HIS 179 CO -0.16 0.86 0.13 0.00 -0.00 0.00 0.00 177.93 178.77 1orn h ARG 180 N 1.07 0.96 -0.45 2.45 3.08 -0.68 -1.41 114.38 119.40 1orn h ARG 180 Ca 0.24 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 1orn h ARG 180 Cb 0.24 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1orn h ARG 180 CO -0.02 0.87 -0.21 0.52 -1.07 0.00 0.00 179.97 180.06 1orn h MET 181 N 0.91 0.89 -0.51 0.04 2.86 -0.56 -0.88 114.93 117.69 1orn h MET 181 Ca 0.19 -0.37 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 1orn h MET 181 Cb 0.35 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 1orn h MET 181 CO 0.00 1.02 0.13 0.82 1.06 0.00 0.00 176.91 179.94 1orn h ILE 182 N 0.78 1.24 -0.55 -1.22 2.04 -0.94 -1.35 117.51 117.52 1orn h ILE 182 Ca 0.11 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.05 1orn h ILE 182 Cb 0.75 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1orn h ILE 182 CO 0.06 0.31 0.07 -0.26 0.00 0.00 0.00 178.15 178.32 1orn h PHE 183 N 0.71 0.99 -0.48 1.37 -1.00 -1.15 0.20 116.94 117.58 1orn h PHE 183 Ca 0.16 -0.15 0.04 0.00 2.81 0.00 0.00 57.97 60.84 1orn h PHE 183 Cb 0.32 -0.27 -0.04 0.00 3.61 0.00 0.00 35.95 39.58 1orn h PHE 183 CO 0.02 0.88 0.24 0.35 -1.61 0.00 0.00 178.31 178.19 1orn h PHE 184 N 0.81 0.45 -0.08 -0.55 3.57 -0.88 0.82 116.94 121.08 1orn h PHE 184 Ca 0.16 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.47 1orn h PHE 184 Cb 0.44 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1orn h PHE 184 CO 0.03 0.22 -0.82 0.78 -2.23 0.00 0.00 178.31 176.29 1orn h GLY 185 N 0.48 0.61 1.00 2.40 0.00 -1.05 0.59 103.07 107.10 1orn h GLY 185 Ca 0.21 -0.93 -0.12 0.00 0.00 0.00 0.00 47.33 46.49 1orn h GLY 185 CO -0.15 0.82 -0.28 -0.09 0.00 0.00 0.00 176.54 176.85 1orn h ARG 186 N 0.36 0.76 0.00 4.80 2.43 -0.24 -2.94 114.38 119.54 1orn h ARG 186 Ca -0.06 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1orn h ARG 186 Cb 1.44 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1orn h ARG 186 CO 0.15 1.01 -0.88 0.66 -1.51 0.00 0.00 179.97 179.40 1orn n TYR 187 N -4.23 0.00 0.03 2.20 4.01 0.25 -4.74 117.16 114.67 1orn n TYR 187 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1orn n TYR 187 Cb 0.47 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 1orn n TYR 187 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1orn n HIS 188 N -1.48 -0.25 -1.45 -0.72 -0.00 -0.08 -4.84 115.22 106.40 1orn n HIS 188 Ca 0.01 0.04 -0.32 0.00 0.46 0.00 0.00 57.72 57.92 1orn n HIS 188 Cb 0.25 0.16 -0.06 0.00 -0.12 0.00 0.00 29.99 30.22 1orn n HIS 188 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1orn s LYS 190 N 0.59 2.18 0.10 0.00 1.02 -1.11 -4.59 119.74 117.93 1orn s LYS 190 Ca 0.64 1.81 -0.22 0.00 0.02 0.00 0.00 55.97 58.22 1orn s LYS 190 Cb 0.23 -1.83 -0.13 0.00 -0.52 0.00 0.00 37.83 35.58 1orn s LYS 190 CO -0.08 -1.82 1.74 0.00 -0.92 0.00 0.00 175.35 174.28 1orn h ALA 191 N -0.18 0.06 0.11 5.17 0.00 -1.93 -3.11 119.26 119.38 1orn h ALA 191 Ca -0.48 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.07 1orn h ALA 191 Cb 1.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1orn h ALA 191 CO 0.50 -0.44 -1.94 1.04 0.00 0.00 0.00 179.25 178.41 1orn n GLN 192 N -5.05 0.74 -3.37 0.00 3.00 -1.26 -4.72 117.38 106.72 1orn n GLN 192 Ca -0.06 0.27 -0.26 0.00 -0.01 0.00 0.00 57.00 56.94 1orn n GLN 192 Cb 0.03 -1.73 -0.08 0.00 0.00 0.00 0.00 30.24 28.47 1orn n GLN 192 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1orn n SER 193 N -3.41 2.45 -4.77 1.08 7.64 -1.25 -5.10 113.62 110.27 1orn n SER 193 Ca -0.29 -3.16 -0.40 0.00 1.01 0.00 0.00 58.87 56.03 1orn n SER 193 Cb 1.05 -0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 63.58 1orn n SER 193 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1orn s PRO 194 N -1.94 4.07 -0.40 1.43 0.04 -1.17 -4.32 135.00 132.70 1orn s PRO 194 Ca 0.37 2.26 -0.04 0.00 0.04 0.00 0.00 61.00 63.63 1orn s PRO 194 Cb 0.14 -2.86 0.01 0.00 0.04 0.00 0.00 34.50 31.82 1orn s PRO 194 CO -0.06 -0.45 2.91 1.04 0.04 0.00 0.00 177.00 180.49 1orn n GLN 195 N 0.33 2.39 -0.11 4.56 6.02 -0.68 -4.76 117.38 125.13 1orn n GLN 195 Ca 0.02 -2.14 -0.06 0.00 -0.01 0.00 0.00 57.00 54.81 1orn n GLN 195 Cb 0.42 -2.13 0.01 0.00 1.02 0.00 0.00 30.24 29.55 1orn n GLN 195 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1orn h PRO 197 N -0.12 0.22 -0.31 0.00 0.11 -1.95 0.13 132.00 130.07 1orn h PRO 197 Ca 0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1orn h PRO 197 Cb 0.41 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1orn h PRO 197 CO -0.45 0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 176.35 1orn n SER 198 N -4.81 3.73 -4.70 -2.05 3.41 -1.02 -5.01 113.62 103.18 1orn n SER 198 Ca 0.33 -2.70 -0.41 0.00 -0.26 0.00 0.00 58.87 55.82 1orn n SER 198 Cb 1.15 -0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 1orn n SER 198 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1orn n PRO 200 N 4.41 0.02 -0.05 0.00 -0.02 -1.26 -2.08 135.00 136.02 1orn n PRO 200 Ca 0.05 0.30 0.06 0.00 -2.02 0.00 0.00 63.50 61.89 1orn n PRO 200 Cb 0.50 -1.50 0.08 0.00 -0.02 0.00 0.00 33.50 32.56 1orn n PRO 200 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1orn n LEU 201 N -1.47 2.21 -0.26 2.45 4.77 -1.26 -4.59 117.00 118.86 1orn n LEU 201 Ca 0.03 -1.27 0.14 0.00 -0.03 0.00 0.00 56.01 54.88 1orn n LEU 201 Cb 0.12 -0.06 0.42 0.00 -2.33 0.00 0.00 43.42 41.56 1orn n LEU 201 CO 0.09 0.47 1.22 0.25 -1.33 0.00 0.00 177.39 178.09 1orn h LEU 202 N 2.19 0.58 0.00 2.23 6.46 -1.72 -1.28 115.31 123.77 1orn h LEU 202 Ca 0.00 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1orn h LEU 202 Cb 0.54 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.41 1orn h LEU 202 CO 0.00 0.27 0.00 0.00 -0.62 0.00 0.00 178.44 178.09 1orn n HIS 203 N -4.56 0.00 -0.87 1.25 1.44 -1.26 -2.49 115.22 108.72 1orn n HIS 203 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 1orn n HIS 203 Cb 0.55 -0.44 0.00 0.00 0.12 0.00 0.00 29.99 30.22 1orn n HIS 203 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1orn n LEU 204 N -1.44 0.19 -4.62 2.39 -0.00 -0.54 -5.07 117.00 107.91 1orn n LEU 204 Ca 0.01 -0.19 -0.40 0.00 -0.00 0.00 0.00 56.01 55.43 1orn n LEU 204 Cb 0.03 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.37 1orn n LEU 204 CO 0.03 0.05 0.22 0.00 -0.00 0.00 0.00 177.39 177.68 1orn h ARG 206 N 8.04 1.12 -0.18 0.00 -0.00 -1.81 -1.79 114.38 119.75 1orn h ARG 206 Ca -0.29 -0.25 -0.08 0.00 -0.50 0.00 0.00 59.98 58.86 1orn h ARG 206 Cb 1.14 -0.16 -0.00 0.00 0.00 0.00 0.00 29.97 30.95 1orn h ARG 206 CO 0.70 0.97 -0.19 1.49 0.00 0.00 0.00 179.97 182.94 1orn h GLU 207 N 1.07 0.45 0.02 0.04 4.57 -1.92 -2.50 114.58 116.32 1orn h GLU 207 Ca 0.23 -0.24 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1orn h GLU 207 Cb 0.33 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1orn h GLU 207 CO -0.00 0.82 -0.01 0.78 -1.18 0.00 0.00 179.01 179.41 1orn h GLY 208 N 0.11 -0.03 1.62 1.92 0.00 -1.82 -1.15 103.07 103.72 1orn h GLY 208 Ca 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1orn h GLY 208 CO 0.05 -0.01 0.18 0.50 0.00 0.00 0.00 176.54 177.26 1orn h LYS 209 N -0.06 0.50 -0.19 4.80 1.57 -1.40 0.73 116.57 122.52 1orn h LYS 209 Ca -0.00 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 1orn h LYS 209 Cb 0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1orn h LYS 209 CO 0.01 0.39 -0.38 -0.22 -0.57 0.00 0.00 179.45 178.68 1orn h LYS 210 N 0.51 0.42 0.21 3.15 3.11 -1.06 -2.04 116.57 120.87 1orn h LYS 210 Ca 0.13 -0.20 -0.31 0.00 -2.81 0.00 0.00 60.65 57.47 1orn h LYS 210 Cb 0.04 -0.01 0.03 0.00 -1.00 0.00 0.00 32.23 31.30 1orn h LYS 210 CO -0.02 0.74 -1.33 0.00 -2.81 0.00 0.00 179.45 176.03 1orn h ARG 211 N 0.35 0.53 -0.83 1.90 3.08 -0.40 -3.27 114.38 115.75 1orn h ARG 211 Ca 0.04 -0.85 -0.01 0.00 0.07 0.00 0.00 59.98 59.22 1orn h ARG 211 Cb 0.82 0.31 -0.04 0.00 0.08 0.00 0.00 29.97 31.14 1orn h ARG 211 CO 0.07 1.40 0.48 0.52 -1.07 0.00 0.00 179.97 181.36 1orn h MET 212 N 0.10 1.15 0.00 0.04 2.86 -0.85 0.63 114.93 118.85 1orn h MET 212 Ca -0.23 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 1orn h MET 212 Cb 2.04 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 33.47 1orn h MET 212 CO 0.25 0.82 0.00 0.00 1.06 0.00 0.00 176.91 179.04 1orn h ARG 213 N 1.16 0.00 -0.00 1.72 -0.00 -1.45 -3.51 114.38 112.29 1orn h ARG 213 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.78 1orn h ARG 213 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.96 1orn h ARG 213 CO -0.05 0.00 0.00 0.36 0.00 0.00 0.00 179.97 180.28