#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ixo s GLU 3 N 0.00 3.10 0.22 0.00 -1.05 -1.26 -5.04 118.70 114.66 1ixo s GLU 3 Ca 0.00 -1.54 -0.32 0.00 -0.15 0.00 0.00 54.97 52.96 1ixo s GLU 3 Cb 0.00 -4.32 -0.12 0.00 -0.44 0.00 0.00 34.13 29.25 1ixo s GLU 3 CO 0.00 -1.48 1.71 -0.11 0.95 0.00 0.00 175.26 176.33 1ixo n LEU 4 N 5.86 4.02 -4.89 1.83 0.00 -1.26 -5.00 117.00 117.56 1ixo n LEU 4 Ca -0.07 1.07 -0.24 0.00 0.00 0.00 0.00 56.01 56.77 1ixo n LEU 4 Cb 0.42 -1.57 -0.04 0.00 0.00 0.00 0.00 43.42 42.23 1ixo n LEU 4 CO 0.55 0.17 -0.12 -0.76 0.00 0.00 0.00 177.39 177.23 1ixo s LEU 5 N 1.00 4.11 -0.10 -1.96 1.43 -0.98 -4.97 118.68 117.21 1ixo s LEU 5 Ca 0.74 -0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1ixo s LEU 5 Cb -0.51 -2.68 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 1ixo s LEU 5 CO 0.34 0.01 -0.18 -0.22 0.23 0.00 0.00 176.35 176.53 1ixo s LEU 6 N -3.51 2.47 -0.22 1.79 0.20 -1.26 -2.41 118.68 115.73 1ixo s LEU 6 Ca 0.33 -0.39 0.02 0.00 0.69 0.00 0.00 54.13 54.78 1ixo s LEU 6 Cb -0.10 -1.52 0.04 0.00 -0.43 0.00 0.00 46.19 44.18 1ixo s LEU 6 CO 0.27 0.21 -0.15 -0.83 -0.29 0.00 0.00 176.35 175.55 1ixo s GLY 7 N 0.09 1.52 -0.14 7.98 0.00 -0.50 0.46 107.32 116.73 1ixo s GLY 7 Ca -0.08 -1.47 -0.19 0.00 0.00 0.00 0.00 44.72 42.97 1ixo s GLY 7 CO 0.05 0.44 0.54 0.14 0.00 0.00 0.00 173.10 174.27 1ixo s VAL 8 N 1.21 5.13 -0.34 1.40 1.01 -0.76 -0.58 120.40 127.46 1ixo s VAL 8 Ca -0.01 1.05 -0.18 0.00 0.00 0.00 0.00 61.98 62.84 1ixo s VAL 8 Cb -0.16 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.34 1ixo s VAL 8 CO -0.09 0.25 0.51 0.21 0.00 0.00 0.00 175.10 175.98 1ixo s ASN 9 N 0.86 6.32 -0.08 3.32 3.84 0.27 -0.84 114.94 128.64 1ixo s ASN 9 Ca 0.27 0.00 0.14 0.00 0.21 0.00 0.00 52.86 53.48 1ixo s ASN 9 Cb -0.16 -2.27 0.54 0.00 -0.55 0.00 0.00 41.25 38.81 1ixo s ASN 9 CO 0.11 -0.47 1.41 2.30 -2.79 0.00 0.00 177.10 177.66 1ixo n ILE 10 N 5.41 1.34 -0.19 -5.21 -5.35 -0.81 -4.41 119.36 110.14 1ixo n ILE 10 Ca -0.05 -0.87 -0.03 0.00 -0.27 0.00 0.00 62.75 61.53 1ixo n ILE 10 Cb 0.49 0.03 0.03 0.00 -1.74 0.00 0.00 39.64 38.45 1ixo n ILE 10 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1ixo h ASP 11 N 3.06 -0.88 0.24 7.28 3.32 -1.92 -1.41 116.42 126.10 1ixo h ASP 11 Ca 0.00 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1ixo h ASP 11 Cb 1.14 0.48 0.00 0.00 0.22 0.00 0.00 39.33 41.17 1ixo h ASP 11 CO 0.17 -0.27 0.00 1.41 -1.72 0.00 0.00 179.24 178.84 1ixo n HIS 12 N -5.43 0.00 -0.05 4.55 8.25 -1.26 -1.10 115.22 120.18 1ixo n HIS 12 Ca 0.05 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.38 1ixo n HIS 12 Cb 0.34 -0.29 -0.08 0.00 1.12 0.00 0.00 29.99 31.08 1ixo n HIS 12 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1ixo h ILE 13 N 0.00 1.37 -0.17 1.59 1.08 -1.60 -2.82 117.51 116.96 1ixo h ILE 13 Ca 0.00 -1.42 -0.08 0.00 -0.39 0.00 0.00 64.86 62.97 1ixo h ILE 13 Cb 0.12 2.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.86 1ixo h ILE 13 CO 0.00 0.41 -0.24 0.00 -0.69 0.00 0.00 178.15 177.64 1ixo h ALA 14 N 0.56 1.28 -0.60 1.87 0.00 -1.17 -2.39 119.26 118.81 1ixo h ALA 14 Ca 0.01 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1ixo h ALA 14 Cb 0.75 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1ixo h ALA 14 CO 0.04 0.48 0.02 1.79 0.00 0.00 0.00 179.25 181.59 1ixo h THR 15 N 0.28 1.26 -0.80 0.00 1.35 -1.40 0.61 112.91 114.21 1ixo h THR 15 Ca 0.05 -1.11 -0.02 0.00 -0.55 0.00 0.00 66.41 64.78 1ixo h THR 15 Cb 0.58 0.77 -0.04 0.00 -1.73 0.00 0.00 68.15 67.73 1ixo h THR 15 CO 0.04 0.41 0.43 0.25 -0.25 0.00 0.00 175.52 176.40 1ixo h LEU 16 N 0.96 1.00 -0.11 3.87 5.85 -1.22 -2.70 115.31 122.97 1ixo h LEU 16 Ca 0.18 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1ixo h LEU 16 Cb 0.52 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1ixo h LEU 16 CO 0.03 0.81 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.77 1ixo h ARG 17 N 1.12 0.25 0.00 1.25 2.43 -0.89 -3.12 114.38 115.42 1ixo h ARG 17 Ca 0.28 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1ixo h ARG 17 Cb 0.04 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1ixo h ARG 17 CO -0.04 0.62 0.00 0.09 -1.51 0.00 0.00 179.97 179.13 1ixo n ASN 18 N -4.68 0.00 -0.03 -3.80 4.13 0.14 -1.47 115.26 109.55 1ixo n ASN 18 Ca -0.07 -0.12 0.15 0.00 1.68 0.00 0.00 54.58 56.23 1ixo n ASN 18 Cb 0.30 -0.15 0.74 0.00 -1.54 0.00 0.00 39.78 39.13 1ixo n ASN 18 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ixo n ALA 19 N -1.15 2.58 0.00 5.41 0.00 -1.03 -4.18 120.51 122.13 1ixo n ALA 19 Ca 0.07 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ixo n ALA 19 Cb 0.07 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1ixo n ALA 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1ixo n ARG 20 N -1.18 1.53 -0.58 0.00 3.00 -0.54 -5.04 116.66 113.85 1ixo n ARG 20 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 1ixo n ARG 20 Cb 0.24 -0.67 0.00 0.00 0.00 0.00 0.00 32.46 32.02 1ixo n ARG 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ixo n GLY 21 N 1.35 0.76 3.09 5.14 0.00 -1.01 -5.06 105.19 109.45 1ixo n GLY 21 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1ixo n GLY 21 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ixo n THR 22 N -2.25 0.00 0.15 2.61 -2.24 -1.26 -5.02 114.28 106.26 1ixo n THR 22 Ca 0.00 -1.21 0.09 0.00 -2.27 0.00 0.00 64.05 60.66 1ixo n THR 22 Cb 0.00 -1.05 0.06 0.00 -2.10 0.00 0.00 70.33 67.24 1ixo n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ixo h ALA 23 N -0.70 0.73 -2.98 6.98 0.00 -1.97 -3.45 119.26 117.88 1ixo h ALA 23 Ca -0.27 -0.17 -0.62 0.00 0.00 0.00 0.00 54.91 53.85 1ixo h ALA 23 Cb 0.97 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1ixo h ALA 23 CO 0.28 0.20 -0.53 1.52 0.00 0.00 0.00 179.25 180.72 1ixo s TYR 24 N -3.20 3.44 0.35 0.00 -0.85 -1.26 -3.57 117.35 112.26 1ixo s TYR 24 Ca 0.03 0.21 -0.25 0.00 -0.52 0.00 0.00 57.07 56.53 1ixo s TYR 24 Cb 0.07 -1.72 -0.10 0.00 0.38 0.00 0.00 41.96 40.59 1ixo s TYR 24 CO 0.74 0.57 0.99 -1.25 -1.52 0.00 0.00 175.55 175.09 1ixo s PRO 25 N -2.49 4.43 -0.25 -3.49 0.04 -1.26 -4.42 135.00 127.56 1ixo s PRO 25 Ca 0.34 1.43 -0.17 0.00 0.04 0.00 0.00 61.00 62.63 1ixo s PRO 25 Cb -0.13 -2.72 -0.03 0.00 0.04 0.00 0.00 34.50 31.66 1ixo s PRO 25 CO 0.26 0.11 0.46 0.34 0.04 0.00 0.00 177.00 178.22 1ixo s ASP 26 N -1.56 6.40 0.45 6.66 -1.08 -1.23 -4.57 116.67 121.74 1ixo s ASP 26 Ca 0.53 0.47 0.21 0.00 -0.52 0.00 0.00 52.55 53.24 1ixo s ASP 26 Cb -0.21 -2.26 1.19 0.00 -1.46 0.00 0.00 42.92 40.19 1ixo s ASP 26 CO 0.26 -0.22 1.88 -0.65 0.52 0.00 0.00 175.17 176.96 1ixo h PRO 27 N 7.91 0.28 -0.36 4.34 0.11 -1.90 0.54 132.00 142.92 1ixo h PRO 27 Ca -0.31 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 1ixo h PRO 27 Cb 1.15 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1ixo h PRO 27 CO 0.70 0.19 0.20 0.28 -0.21 0.00 0.00 178.00 179.15 1ixo h VAL 28 N 0.29 1.12 -0.05 3.15 2.07 -1.94 -0.80 116.25 120.09 1ixo h VAL 28 Ca 0.44 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 1ixo h VAL 28 Cb 1.26 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1ixo h VAL 28 CO -0.13 0.13 -0.16 -0.61 0.02 0.00 0.00 177.57 176.82 1ixo h GLN 29 N 0.50 0.21 -0.92 1.57 4.15 -1.31 -3.07 115.11 116.24 1ixo h GLN 29 Ca 0.13 -0.15 0.17 0.00 0.77 0.00 0.00 58.65 59.57 1ixo h GLN 29 Cb 0.02 0.03 -0.08 0.00 0.21 0.00 0.00 27.48 27.66 1ixo h GLN 29 CO -0.02 0.77 0.59 0.00 -1.93 0.00 0.00 178.83 178.24 1ixo h ALA 30 N 0.44 1.89 -0.19 3.38 0.00 -1.14 -1.98 119.26 121.65 1ixo h ALA 30 Ca -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ixo h ALA 30 Cb 0.78 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ixo h ALA 30 CO 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 179.25 179.11 1ixo h ALA 31 N 1.61 0.25 -0.81 0.00 0.00 -1.16 -1.71 119.26 117.44 1ixo h ALA 31 Ca 0.48 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 55.28 1ixo h ALA 31 Cb 0.86 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 1ixo h ALA 31 CO -0.23 -0.03 0.46 0.74 0.00 0.00 0.00 179.25 180.19 1ixo h PHE 32 N 0.08 0.83 0.16 0.00 -1.00 -1.28 -0.51 116.94 115.22 1ixo h PHE 32 Ca 0.05 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.85 1ixo h PHE 32 Cb 0.40 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 39.71 1ixo h PHE 32 CO 0.04 0.33 -0.07 0.82 -1.61 0.00 0.00 178.31 177.82 1ixo h ILE 33 N 0.77 0.95 -0.22 -0.55 2.04 -1.31 -3.02 117.51 116.17 1ixo h ILE 33 Ca 0.39 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.77 1ixo h ILE 33 Cb 0.36 1.25 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1ixo h ILE 33 CO -0.25 0.12 0.10 0.00 0.00 0.00 0.00 178.15 178.12 1ixo h ALA 34 N 0.36 0.26 -0.08 1.87 0.00 -1.06 -2.10 119.26 118.50 1ixo h ALA 34 Ca -0.02 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1ixo h ALA 34 Cb 0.35 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ixo h ALA 34 CO 0.04 -0.31 0.14 0.93 0.00 0.00 0.00 179.25 180.05 1ixo h GLU 35 N 0.23 0.00 -0.34 0.00 5.08 -1.13 -0.35 114.58 118.07 1ixo h GLU 35 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1ixo h GLU 35 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ixo h GLU 35 CO -0.06 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 178.99 1ixo n GLN 36 N -3.51 2.28 -0.06 2.33 6.02 -0.85 -4.37 117.38 119.22 1ixo n GLN 36 Ca -0.01 -2.09 0.03 0.00 -0.01 0.00 0.00 57.00 54.92 1ixo n GLN 36 Cb 0.23 -1.43 0.04 0.00 1.02 0.00 0.00 30.24 30.10 1ixo n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ixo n ALA 37 N 1.20 1.92 0.00 -1.58 0.00 -0.26 -4.97 120.51 116.82 1ixo n ALA 37 Ca 0.16 -1.38 0.00 0.00 0.00 0.00 0.00 53.44 52.23 1ixo n ALA 37 Cb 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1ixo n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ixo n GLY 38 N -0.64 0.74 3.76 0.00 0.00 -1.11 -2.50 105.19 105.44 1ixo n GLY 38 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1ixo n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ixo s ALA 39 N -1.16 3.41 -1.17 4.61 0.00 -0.49 -4.47 121.76 122.49 1ixo s ALA 39 Ca 0.00 0.29 0.20 0.00 0.00 0.00 0.00 51.96 52.45 1ixo s ALA 39 Cb 0.00 -2.96 -0.17 0.00 0.00 0.00 0.00 23.12 20.00 1ixo s ALA 39 CO 0.00 0.16 0.89 -0.25 0.00 0.00 0.00 175.76 176.56 1ixo n ASP 40 N 2.35 1.18 -3.51 0.00 8.00 0.17 -4.49 116.55 120.25 1ixo n ASP 40 Ca -0.04 -1.09 -0.09 0.00 0.71 0.00 0.00 54.79 54.27 1ixo n ASP 40 Cb 0.50 0.88 -0.02 0.00 -0.02 0.00 0.00 41.12 42.45 1ixo n ASP 40 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1ixo s GLY 41 N -2.76 -0.49 -0.07 0.44 0.00 -1.12 -4.33 107.32 98.99 1ixo s GLY 41 Ca 0.10 0.61 0.05 0.00 0.00 0.00 0.00 44.72 45.47 1ixo s GLY 41 CO 0.75 0.20 -0.22 -0.42 0.00 0.00 0.00 173.10 173.42 1ixo s ILE 42 N -3.48 1.83 -0.07 0.90 -1.09 -0.95 -1.82 121.20 116.52 1ixo s ILE 42 Ca 0.04 -0.91 0.02 0.00 -2.23 0.00 0.00 60.65 57.57 1ixo s ILE 42 Cb -0.01 -1.58 -0.02 0.00 -1.58 0.00 0.00 42.46 39.27 1ixo s ILE 42 CO -0.09 0.51 -0.12 -0.89 -1.23 0.00 0.00 174.94 173.12 1ixo s THR 43 N 0.17 3.21 -0.01 2.92 2.01 -0.02 -1.42 115.64 122.50 1ixo s THR 43 Ca -0.11 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.25 1ixo s THR 43 Cb -0.15 -2.29 0.00 0.00 0.01 0.00 0.00 72.50 70.07 1ixo s THR 43 CO 0.05 0.58 -0.02 0.68 -0.69 0.00 0.00 174.62 175.22 1ixo s VAL 44 N -0.49 0.23 -0.28 3.82 -7.23 -0.98 -1.93 120.40 113.54 1ixo s VAL 44 Ca 0.07 -0.08 -0.08 0.00 -1.81 0.00 0.00 61.98 60.07 1ixo s VAL 44 Cb -0.12 -0.22 -0.01 0.00 0.56 0.00 0.00 36.38 36.58 1ixo s VAL 44 CO 0.02 0.09 0.10 -2.28 -0.31 0.00 0.00 175.10 172.71 1ixo s HIS 45 N 0.17 3.13 -0.60 2.82 2.46 -1.26 -0.50 115.29 121.51 1ixo s HIS 45 Ca -0.01 -0.58 -0.20 0.00 0.47 0.00 0.00 55.06 54.74 1ixo s HIS 45 Cb -0.04 -2.28 0.09 0.00 -0.13 0.00 0.00 32.58 30.22 1ixo s HIS 45 CO -0.00 -0.43 0.76 -1.17 -2.47 0.00 0.00 174.74 171.42 1ixo s LEU 46 N 1.59 5.11 0.25 8.88 1.98 -0.47 -4.43 118.68 131.59 1ixo s LEU 46 Ca 0.05 -1.27 -0.19 0.00 -2.89 0.00 0.00 54.13 49.83 1ixo s LEU 46 Cb -0.16 -2.35 -0.09 0.00 0.66 0.00 0.00 46.19 44.25 1ixo s LEU 46 CO 0.04 -1.17 0.74 -0.13 -1.89 0.00 0.00 176.35 173.94 1ixo s ARG 47 N 3.01 4.21 0.28 1.98 0.52 -1.26 -4.72 118.95 122.97 1ixo s ARG 47 Ca 0.14 0.84 0.02 0.00 -0.52 0.00 0.00 55.73 56.22 1ixo s ARG 47 Cb -0.22 -2.76 0.60 0.00 0.52 0.00 0.00 34.95 33.09 1ixo s ARG 47 CO 0.08 0.32 1.79 1.49 0.02 0.00 0.00 175.30 179.00 1ixo h GLU 48 N 3.10 0.77 0.00 3.54 4.81 -1.97 0.60 114.58 125.44 1ixo h GLU 48 Ca -0.48 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1ixo h GLU 48 Cb 1.19 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1ixo h GLU 48 CO 0.65 0.51 0.00 -0.40 -0.73 0.00 0.00 179.01 179.04 1ixo n ASP 49 N -4.75 0.00 0.00 1.04 5.75 -1.26 -4.88 116.55 112.45 1ixo n ASP 49 Ca 0.20 0.04 0.00 0.00 -0.01 0.00 0.00 54.79 55.01 1ixo n ASP 49 Cb 0.44 -0.32 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1ixo n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ixo n ARG 50 N -1.32 0.00 -0.04 0.11 5.12 0.21 -4.86 116.66 115.89 1ixo n ARG 50 Ca 0.10 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 56.01 1ixo n ARG 50 Cb 0.20 -2.97 -0.01 0.00 -1.16 0.00 0.00 32.46 28.53 1ixo n ARG 50 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 1ixo n ARG 51 N -2.00 -0.04 0.00 5.56 -4.01 -1.26 -4.23 116.66 110.68 1ixo n ARG 51 Ca 0.00 0.55 0.00 0.00 -1.04 0.00 0.00 57.85 57.36 1ixo n ARG 51 Cb 0.00 -0.82 0.00 0.00 -3.04 0.00 0.00 32.46 28.60 1ixo n ARG 51 CO 0.00 0.00 0.00 -2.39 -3.04 0.00 0.00 177.63 172.20 1ixo n HIS 52 N -2.88 0.00 -1.88 2.89 1.44 -1.26 -4.86 115.22 108.68 1ixo n HIS 52 Ca 0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.30 1ixo n HIS 52 Cb 0.02 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.11 1ixo n HIS 52 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1ixo s ILE 53 N 0.00 2.37 0.43 0.61 -1.09 -1.26 -4.76 121.20 117.51 1ixo s ILE 53 Ca 0.00 0.29 0.06 0.00 -2.23 0.00 0.00 60.65 58.78 1ixo s ILE 53 Cb 0.00 -3.19 -0.05 0.00 -1.58 0.00 0.00 42.46 37.65 1ixo s ILE 53 CO 0.00 0.04 0.14 0.42 -1.23 0.00 0.00 174.94 174.31 1ixo s THR 54 N 0.47 2.06 0.24 2.92 -4.23 -1.26 -4.55 115.64 111.29 1ixo s THR 54 Ca 0.66 -1.77 -0.05 0.00 -1.18 0.00 0.00 61.69 59.34 1ixo s THR 54 Cb -0.45 -2.84 0.21 0.00 1.34 0.00 0.00 72.50 70.76 1ixo s THR 54 CO 0.40 0.00 1.83 0.44 -0.54 0.00 0.00 174.62 176.75 1ixo h ASP 55 N 1.43 0.75 -0.27 3.99 3.32 -1.95 -0.63 116.42 123.06 1ixo h ASP 55 Ca -0.43 0.03 0.03 0.00 0.02 0.00 0.00 57.03 56.68 1ixo h ASP 55 Cb 1.26 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 1ixo h ASP 55 CO 0.72 0.46 0.09 -0.09 -1.72 0.00 0.00 179.24 178.70 1ixo h ARG 56 N 0.87 0.21 0.07 3.56 2.43 -1.99 0.95 114.38 120.49 1ixo h ARG 56 Ca 0.38 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.56 1ixo h ARG 56 Cb 0.26 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.71 1ixo h ARG 56 CO -0.21 0.14 -0.42 -0.44 -1.51 0.00 0.00 179.97 177.53 1ixo h ASP 57 N 0.22 -1.27 -0.99 -3.80 3.45 -1.57 0.33 116.42 112.80 1ixo h ASP 57 Ca 0.12 0.15 0.06 0.00 0.43 0.00 0.00 57.03 57.79 1ixo h ASP 57 Cb 0.08 0.48 -0.07 0.00 -0.56 0.00 0.00 39.33 39.27 1ixo h ASP 57 CO -0.12 -0.48 0.64 0.58 -1.57 0.00 0.00 179.24 178.29 1ixo h VAL 58 N -0.63 1.09 -0.28 -1.35 2.07 -0.88 0.22 116.25 116.50 1ixo h VAL 58 Ca 0.03 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1ixo h VAL 58 Cb 0.67 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1ixo h VAL 58 CO -0.27 0.21 0.04 -0.09 0.02 0.00 0.00 177.57 177.48 1ixo h ARG 59 N 1.17 0.47 -0.07 1.57 2.43 -0.07 -1.90 114.38 117.98 1ixo h ARG 59 Ca 0.42 -0.13 -0.16 0.00 -0.81 0.00 0.00 59.98 59.30 1ixo h ARG 59 Cb 0.15 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1ixo h ARG 59 CO -0.17 0.59 -0.59 0.82 -1.51 0.00 0.00 179.97 179.11 1ixo h ILE 60 N 0.28 1.37 -0.79 1.20 2.04 -0.65 -3.22 117.51 117.73 1ixo h ILE 60 Ca 0.08 -1.93 0.14 0.00 1.00 0.00 0.00 64.86 64.15 1ixo h ILE 60 Cb 0.35 2.29 -0.09 0.00 -0.74 0.00 0.00 36.82 38.62 1ixo h ILE 60 CO 0.01 0.58 0.37 -0.07 0.00 0.00 0.00 178.15 179.04 1ixo h LEU 61 N 0.12 0.42 -2.32 1.44 4.07 -0.58 0.25 115.31 118.72 1ixo h LEU 61 Ca -0.05 0.09 0.03 0.00 0.08 0.00 0.00 57.88 58.03 1ixo h LEU 61 Cb 1.25 0.04 -0.00 0.00 1.08 0.00 0.00 40.66 43.02 1ixo h LEU 61 CO 0.12 0.18 0.10 -0.09 -1.08 0.00 0.00 178.44 177.67 1ixo h ARG 62 N 0.55 0.00 0.00 1.13 9.65 -1.35 0.49 114.38 124.84 1ixo h ARG 62 Ca 0.43 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.31 1ixo h ARG 62 Cb 0.60 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 1ixo h ARG 62 CO -0.37 0.00 -1.75 1.04 2.80 0.00 0.00 179.97 181.70 1ixo n GLN 63 N -3.88 0.56 -0.07 0.20 6.02 0.67 -4.54 117.38 116.34 1ixo n GLN 63 Ca -0.01 -0.14 -0.06 0.00 -0.01 0.00 0.00 57.00 56.79 1ixo n GLN 63 Cb 0.21 -1.55 -0.15 0.00 1.02 0.00 0.00 30.24 29.76 1ixo n GLN 63 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1ixo n THR 64 N -2.20 1.17 -1.70 5.09 -2.24 0.04 -4.98 114.28 109.45 1ixo n THR 64 Ca -0.02 -0.78 -0.43 0.00 -2.27 0.00 0.00 64.05 60.54 1ixo n THR 64 Cb 0.54 -0.45 -0.01 0.00 -2.10 0.00 0.00 70.33 68.30 1ixo n THR 64 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ixo n LEU 65 N -2.70 3.63 -0.00 3.22 4.77 0.08 -4.90 117.00 121.09 1ixo n LEU 65 Ca -0.25 1.20 0.10 0.00 -0.03 0.00 0.00 56.01 57.02 1ixo n LEU 65 Cb 1.03 -1.49 -0.13 0.00 -2.33 0.00 0.00 43.42 40.50 1ixo n LEU 65 CO 0.44 -0.40 -0.32 -0.67 -1.33 0.00 0.00 177.39 175.11 1ixo n ASP 66 N 1.03 0.69 0.00 -1.43 2.03 -1.26 -4.88 116.55 112.73 1ixo n ASP 66 Ca 0.06 -0.58 0.00 0.00 0.52 0.00 0.00 54.79 54.78 1ixo n ASP 66 Cb 0.36 1.37 0.00 0.00 -0.72 0.00 0.00 41.12 42.13 1ixo n ASP 66 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1ixo n THR 67 N -1.76 0.00 -3.75 5.18 -2.24 -1.26 -5.14 114.28 105.30 1ixo n THR 67 Ca 0.01 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 1ixo n THR 67 Cb 0.40 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.56 1ixo n THR 67 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ixo s ARG 68 N 2.44 0.83 0.10 -0.78 1.04 -1.26 -5.06 118.95 116.26 1ixo s ARG 68 Ca 0.00 -0.52 -0.18 0.00 -1.04 0.00 0.00 55.73 53.99 1ixo s ARG 68 Cb 0.00 0.36 -0.07 0.00 -2.04 0.00 0.00 34.95 33.20 1ixo s ARG 68 CO 0.00 -0.27 0.57 1.41 -0.04 0.00 0.00 175.30 176.97 1ixo s MET 69 N -2.65 4.14 -0.34 3.89 -2.45 -1.26 -2.23 119.30 118.39 1ixo s MET 69 Ca -0.04 0.68 0.03 0.00 -1.25 0.00 0.00 55.69 55.10 1ixo s MET 69 Cb -0.00 -3.13 0.10 0.00 1.25 0.00 0.00 34.83 33.05 1ixo s MET 69 CO -0.04 0.58 0.07 1.21 1.05 0.00 0.00 175.02 177.89 1ixo s ASN 70 N -1.31 4.55 -0.33 1.11 2.47 -0.50 -1.26 114.94 119.67 1ixo s ASN 70 Ca 0.32 -2.08 -0.28 0.00 0.42 0.00 0.00 52.86 51.25 1ixo s ASN 70 Cb -0.18 -1.43 0.02 0.00 -1.45 0.00 0.00 41.25 38.20 1ixo s ASN 70 CO 0.19 -0.38 1.02 -0.22 -3.72 0.00 0.00 177.10 173.99 1ixo s LEU 71 N 1.02 3.95 -0.17 3.21 0.20 -0.96 -2.33 118.68 123.60 1ixo s LEU 71 Ca 0.11 0.91 -0.18 0.00 0.69 0.00 0.00 54.13 55.65 1ixo s LEU 71 Cb -0.19 -3.44 -0.04 0.00 -0.43 0.00 0.00 46.19 42.09 1ixo s LEU 71 CO -0.12 -0.86 0.50 -0.70 -0.29 0.00 0.00 176.35 174.88 1ixo s GLU 72 N 3.58 4.24 0.22 1.98 2.12 0.34 -0.72 118.70 130.46 1ixo s GLU 72 Ca 0.43 0.43 -0.20 0.00 0.36 0.00 0.00 54.97 55.99 1ixo s GLU 72 Cb -0.12 -3.52 0.03 0.00 0.26 0.00 0.00 34.13 30.79 1ixo s GLU 72 CO 0.16 -0.04 0.60 0.00 -0.54 0.00 0.00 175.26 175.45 1ixo s MET 73 N 1.27 1.50 0.40 4.30 0.23 -1.06 -1.37 119.30 124.57 1ixo s MET 73 Ca 0.25 -0.84 -0.03 0.00 -1.03 0.00 0.00 55.69 54.04 1ixo s MET 73 Cb -0.15 0.56 -0.04 0.00 -1.53 0.00 0.00 34.83 33.67 1ixo s MET 73 CO 0.10 -0.66 0.66 0.00 -2.03 0.00 0.00 175.02 173.09 1ixo s ALA 74 N -3.87 3.55 -0.79 3.16 0.00 -1.23 -0.36 121.76 122.22 1ixo s ALA 74 Ca 0.09 -0.67 -0.22 0.00 0.00 0.00 0.00 51.96 51.16 1ixo s ALA 74 Cb -0.03 -2.36 0.09 0.00 0.00 0.00 0.00 23.12 20.82 1ixo s ALA 74 CO -0.01 -0.13 1.09 0.08 0.00 0.00 0.00 175.76 176.78 1ixo s VAL 75 N -2.48 4.38 0.20 0.00 1.01 -1.26 -4.67 120.40 117.59 1ixo s VAL 75 Ca 0.44 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1ixo s VAL 75 Cb -0.10 -4.77 -0.04 0.00 0.00 0.00 0.00 36.38 31.47 1ixo s VAL 75 CO 0.39 -1.55 0.12 0.42 0.00 0.00 0.00 175.10 174.48 1ixo s THR 76 N 3.79 0.03 0.10 3.92 -4.23 -1.26 -5.05 115.64 112.94 1ixo s THR 76 Ca 0.29 -1.99 -0.13 0.00 -1.18 0.00 0.00 61.69 58.67 1ixo s THR 76 Cb -0.10 -2.46 -0.12 0.00 1.34 0.00 0.00 72.50 71.15 1ixo s THR 76 CO 0.02 -0.04 1.35 -0.08 -0.54 0.00 0.00 174.62 175.33 1ixo h GLU 77 N 2.63 0.78 0.28 3.99 4.57 -1.98 -1.71 114.58 123.14 1ixo h GLU 77 Ca -0.36 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 57.29 1ixo h GLU 77 Cb 1.25 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.88 1ixo h GLU 77 CO 0.54 1.16 -0.40 1.49 -1.18 0.00 0.00 179.01 180.62 1ixo h GLU 78 N 0.52 -0.71 -0.12 1.92 4.81 -1.97 0.15 114.58 119.17 1ixo h GLU 78 Ca -0.01 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1ixo h GLU 78 Cb 1.17 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 1ixo h GLU 78 CO 0.12 -0.47 0.06 0.52 -0.73 0.00 0.00 179.01 178.51 1ixo h MET 79 N -0.74 0.13 -0.68 1.92 2.86 -1.86 -0.73 114.93 115.83 1ixo h MET 79 Ca -0.01 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1ixo h MET 79 Cb 0.70 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.29 1ixo h MET 79 CO -0.13 0.09 0.45 -0.07 1.06 0.00 0.00 176.91 178.30 1ixo h LEU 80 N 0.14 0.74 0.44 1.22 3.38 -1.18 0.96 115.31 121.01 1ixo h LEU 80 Ca 0.05 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1ixo h LEU 80 Cb 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1ixo h LEU 80 CO -0.03 0.52 -0.21 0.00 0.09 0.00 0.00 178.44 178.81 1ixo h ALA 81 N 1.59 -0.59 -0.24 1.53 0.00 -0.08 -2.33 119.26 119.14 1ixo h ALA 81 Ca 0.26 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1ixo h ALA 81 Cb -0.01 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1ixo h ALA 81 CO -0.07 -0.82 -0.03 0.82 0.00 0.00 0.00 179.25 179.15 1ixo h ILE 82 N -0.62 0.79 -0.54 0.00 2.04 -0.40 -2.06 117.51 116.73 1ixo h ILE 82 Ca -0.06 -0.01 0.10 0.00 1.00 0.00 0.00 64.86 65.89 1ixo h ILE 82 Cb 0.47 0.76 -0.09 0.00 -0.74 0.00 0.00 36.82 37.22 1ixo h ILE 82 CO 0.10 0.01 0.03 0.00 0.00 0.00 0.00 178.15 178.28 1ixo h ALA 83 N 1.22 0.54 -0.05 1.87 0.00 -0.74 0.39 119.26 122.49 1ixo h ALA 83 Ca 0.11 0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1ixo h ALA 83 Cb 0.16 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ixo h ALA 83 CO -0.22 -0.37 -0.19 0.28 0.00 0.00 0.00 179.25 178.74 1ixo h VAL 84 N 0.15 1.17 -0.04 0.00 2.07 -1.07 0.35 116.25 118.87 1ixo h VAL 84 Ca 0.28 -0.78 -0.14 0.00 0.82 0.00 0.00 66.70 66.88 1ixo h VAL 84 Cb 0.42 1.35 0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1ixo h VAL 84 CO -0.43 0.23 -0.52 -0.08 0.02 0.00 0.00 177.57 176.79 1ixo h GLU 85 N 0.08 0.43 -0.00 1.57 4.22 -0.30 -3.32 114.58 117.25 1ixo h GLU 85 Ca 0.01 -0.40 -0.17 0.00 0.08 0.00 0.00 59.36 58.88 1ixo h GLU 85 Cb 0.39 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1ixo h GLU 85 CO 0.03 1.05 -0.79 1.15 -2.18 0.00 0.00 179.01 178.27 1ixo h THR 86 N -0.05 1.54 -5.83 0.32 2.02 0.09 -3.48 112.91 107.51 1ixo h THR 86 Ca -0.05 -2.62 -0.37 0.00 0.77 0.00 0.00 66.41 64.14 1ixo h THR 86 Cb 1.20 2.42 0.12 0.00 -1.74 0.00 0.00 68.15 70.15 1ixo h THR 86 CO 0.10 0.75 -0.79 0.29 0.37 0.00 0.00 175.52 176.25 1ixo n LYS 87 N -3.64 -6.08 -2.13 6.66 4.01 0.12 -4.94 118.16 112.16 1ixo n LYS 87 Ca -0.01 0.76 -0.36 0.00 -0.51 0.00 0.00 58.31 58.19 1ixo n LYS 87 Cb 0.75 -5.62 0.01 0.00 -0.51 0.00 0.00 35.03 29.66 1ixo n LYS 87 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1ixo s PRO 88 N -5.66 3.35 0.17 1.97 0.04 -1.26 -4.91 135.00 128.71 1ixo s PRO 88 Ca 0.05 1.81 -0.14 0.00 0.04 0.00 0.00 61.00 62.76 1ixo s PRO 88 Cb -0.02 -2.15 0.13 0.00 0.04 0.00 0.00 34.50 32.50 1ixo s PRO 88 CO 0.76 -0.90 1.75 1.25 0.04 0.00 0.00 177.00 179.91 1ixo h HIS 89 N 1.43 0.28 -2.47 0.56 2.76 -1.86 -3.42 115.15 112.42 1ixo h HIS 89 Ca -0.50 0.02 -0.60 0.00 -2.20 0.00 0.00 60.37 57.09 1ixo h HIS 89 Cb 1.27 -0.06 -0.15 0.00 1.55 0.00 0.00 27.41 30.02 1ixo h HIS 89 CO 0.50 0.10 -0.77 -0.06 -1.30 0.00 0.00 177.93 176.40 1ixo s PHE 90 N -6.14 2.23 -0.04 5.26 0.40 -0.39 -1.61 117.98 117.70 1ixo s PHE 90 Ca -0.13 -0.36 -0.01 0.00 -0.60 0.00 0.00 56.93 55.83 1ixo s PHE 90 Cb 0.14 -1.00 0.03 0.00 0.51 0.00 0.00 43.02 42.70 1ixo s PHE 90 CO 0.72 0.64 0.06 0.00 0.70 0.00 0.00 175.22 177.35 1ixo s LEU 93 N 1.20 4.29 0.06 0.00 1.43 0.12 -2.57 118.68 123.22 1ixo s LEU 93 Ca -0.03 1.96 0.03 0.00 -1.03 0.00 0.00 54.13 55.05 1ixo s LEU 93 Cb -0.20 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.43 1ixo s LEU 93 CO -0.02 -0.66 -0.08 -0.69 0.23 0.00 0.00 176.35 175.13 1ixo s VAL 94 N 2.35 0.66 0.77 -1.59 1.01 0.52 -1.47 120.40 122.66 1ixo s VAL 94 Ca 0.60 -1.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.13 1ixo s VAL 94 Cb -0.28 -0.94 0.06 0.00 0.00 0.00 0.00 36.38 35.22 1ixo s VAL 94 CO 0.24 -0.48 1.15 -2.84 0.00 0.00 0.00 175.10 173.17 1ixo s PRO 95 N -2.16 2.27 -0.32 2.72 0.02 -1.26 -3.57 135.00 132.70 1ixo s PRO 95 Ca -0.03 0.25 0.17 0.00 0.02 0.00 0.00 61.00 61.41 1ixo s PRO 95 Cb -0.06 -1.97 0.46 0.00 0.02 0.00 0.00 34.50 32.94 1ixo s PRO 95 CO -0.00 -1.41 1.12 0.39 -0.33 0.00 0.00 177.00 176.77 1ixo n GLU 96 N -3.22 1.32 0.00 5.54 1.02 -1.26 -4.83 120.64 119.21 1ixo n GLU 96 Ca 0.08 -2.88 0.00 0.00 -0.02 0.00 0.00 57.16 54.34 1ixo n GLU 96 Cb 0.60 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 31.05 1ixo n GLU 96 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1ixo n GLU 104 N -0.43 0.00 0.00 3.49 2.13 -1.26 -5.13 120.64 119.45 1ixo n GLU 104 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 1ixo n GLU 104 Cb 0.83 -0.27 0.00 0.00 0.27 0.00 0.00 31.44 32.27 1ixo n GLU 104 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ixo n GLY 105 N 0.00 1.16 3.87 8.31 0.00 -1.26 -4.93 105.19 112.34 1ixo n GLY 105 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ixo n GLY 105 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ixo s GLY 106 N -1.52 1.63 0.59 -0.02 0.00 -1.26 -4.68 107.32 102.07 1ixo s GLY 106 Ca 0.00 -0.26 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 1ixo s GLY 106 CO 0.00 0.10 1.32 1.04 0.00 0.00 0.00 173.10 175.56 1ixo n LEU 107 N -3.04 5.72 -4.34 0.66 4.77 0.17 -4.80 117.00 116.13 1ixo n LEU 107 Ca 0.07 0.91 -0.47 0.00 -0.03 0.00 0.00 56.01 56.49 1ixo n LEU 107 Cb 0.56 -1.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.07 1ixo n LEU 107 CO 0.57 -0.81 0.52 -0.62 -1.33 0.00 0.00 177.39 175.73 1ixo s ASP 108 N -1.13 6.83 -0.03 -1.43 3.68 -1.26 -4.71 116.67 118.61 1ixo s ASP 108 Ca 0.77 -2.76 -0.15 0.00 2.13 0.00 0.00 52.55 52.53 1ixo s ASP 108 Cb -0.40 -2.23 -0.32 0.00 -1.45 0.00 0.00 42.92 38.52 1ixo s ASP 108 CO 0.45 -0.57 0.82 0.58 0.13 0.00 0.00 175.17 176.57 1ixo h VAL 109 N 4.72 1.17 -0.77 1.11 2.07 -1.92 -3.29 116.25 119.34 1ixo h VAL 109 Ca 0.12 -2.57 -0.00 0.00 0.82 0.00 0.00 66.70 65.07 1ixo h VAL 109 Cb 1.02 2.94 -0.04 0.00 -1.52 0.00 0.00 31.29 33.69 1ixo h VAL 109 CO 0.81 0.80 0.47 0.00 0.02 0.00 0.00 177.57 179.67 1ixo h ALA 110 N 0.10 1.38 -0.09 1.67 0.00 -1.87 -1.72 119.26 118.73 1ixo h ALA 110 Ca -0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ixo h ALA 110 Cb 2.01 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1ixo h ALA 110 CO 0.20 0.54 0.00 0.41 0.00 0.00 0.00 179.25 180.40 1ixo n GLY 111 N -1.32 -0.50 2.50 0.00 0.00 -1.25 -3.83 105.19 100.79 1ixo n GLY 111 Ca 0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1ixo n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ixo n GLN 112 N -0.26 1.27 -0.48 1.61 6.02 -0.80 -5.00 117.38 119.74 1ixo n GLN 112 Ca 0.08 -1.95 0.42 0.00 -0.01 0.00 0.00 57.00 55.54 1ixo n GLN 112 Cb 0.12 -0.22 0.76 0.00 1.02 0.00 0.00 30.24 31.92 1ixo n GLN 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ixo h ARG 113 N 1.40 0.03 0.11 -1.09 3.08 -1.44 -1.76 114.38 114.71 1ixo h ARG 113 Ca -0.35 -0.00 -0.22 0.00 0.07 0.00 0.00 59.98 59.47 1ixo h ARG 113 Cb 1.33 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.38 1ixo h ARG 113 CO -0.07 0.02 -1.08 -0.44 -1.07 0.00 0.00 179.97 177.33 1ixo h ASP 114 N 0.03 0.37 -0.37 7.04 3.32 -1.94 -1.90 116.42 122.97 1ixo h ASP 114 Ca 0.74 -0.88 0.03 0.00 0.02 0.00 0.00 57.03 56.93 1ixo h ASP 114 Cb 2.83 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 42.23 1ixo h ASP 114 CO -0.07 1.48 0.18 0.50 -1.72 0.00 0.00 179.24 179.62 1ixo h LYS 115 N -0.42 0.36 -0.42 3.56 3.64 -1.76 -0.61 116.57 120.93 1ixo h LYS 115 Ca -0.22 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.05 1ixo h LYS 115 Cb 1.64 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.36 1ixo h LYS 115 CO 0.08 0.24 -0.10 0.52 -2.27 0.00 0.00 179.45 177.92 1ixo h MET 116 N 0.37 0.74 -0.20 1.90 2.86 -1.49 -0.42 114.93 118.69 1ixo h MET 116 Ca 0.16 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1ixo h MET 116 Cb 0.07 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1ixo h MET 116 CO -0.11 0.82 0.13 -0.09 1.06 0.00 0.00 176.91 178.71 1ixo h ARG 117 N 0.68 0.27 -0.42 1.72 2.43 -0.73 -0.47 114.38 117.85 1ixo h ARG 117 Ca 0.12 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.12 1ixo h ARG 117 Cb 0.56 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1ixo h ARG 117 CO 0.03 0.21 -0.33 -0.44 -1.51 0.00 0.00 179.97 177.94 1ixo h ASP 118 N 0.26 1.02 -0.21 -3.80 3.45 -0.97 -2.47 116.42 113.69 1ixo h ASP 118 Ca 0.07 -0.44 0.05 0.00 0.43 0.00 0.00 57.03 57.14 1ixo h ASP 118 Cb 0.00 -0.28 -0.05 0.00 -0.56 0.00 0.00 39.33 38.44 1ixo h ASP 118 CO -0.01 1.24 -0.08 0.00 -1.57 0.00 0.00 179.24 178.81 1ixo h ALA 119 N 0.81 0.10 0.53 3.45 0.00 -0.81 -0.24 119.26 123.09 1ixo h ALA 119 Ca 0.08 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ixo h ALA 119 Cb 0.92 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.93 1ixo h ALA 119 CO 0.09 -0.50 -0.25 0.00 0.00 0.00 0.00 179.25 178.58 1ixo h LYS 121 N -0.75 0.19 0.46 0.00 3.64 -1.27 0.82 116.57 119.65 1ixo h LYS 121 Ca -0.07 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1ixo h LYS 121 Cb 0.56 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1ixo h LYS 121 CO 0.12 0.12 -0.32 -0.09 -2.27 0.00 0.00 179.45 177.01 1ixo h ARG 122 N 0.19 -0.73 -0.62 1.90 2.43 -0.92 0.29 114.38 116.92 1ixo h ARG 122 Ca 0.32 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.50 1ixo h ARG 122 Cb 0.50 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1ixo h ARG 122 CO -0.46 -0.49 0.21 -0.07 -1.51 0.00 0.00 179.97 177.66 1ixo h LEU 123 N -0.76 0.86 -1.39 3.80 3.38 -0.70 -1.83 115.31 118.67 1ixo h LEU 123 Ca -0.05 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1ixo h LEU 123 Cb 0.64 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1ixo h LEU 123 CO 0.02 0.80 -0.13 0.00 0.09 0.00 0.00 178.44 179.22 1ixo h ALA 124 N 1.33 1.50 0.00 1.53 0.00 1.00 -0.69 119.26 123.92 1ixo h ALA 124 Ca 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ixo h ALA 124 Cb 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ixo h ALA 124 CO -0.01 0.36 0.00 -0.25 0.00 0.00 0.00 179.25 179.35 1ixo n ASP 125 N -4.27 0.65 -0.40 0.00 8.00 0.10 -2.08 116.55 118.55 1ixo n ASP 125 Ca -0.01 0.61 0.13 0.00 0.71 0.00 0.00 54.79 56.23 1ixo n ASP 125 Cb 0.27 -0.77 0.28 0.00 -0.02 0.00 0.00 41.12 40.89 1ixo n ASP 125 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ixo n ALA 126 N -1.75 3.08 -0.88 2.24 0.00 -0.39 -4.92 120.51 117.89 1ixo n ALA 126 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1ixo n ALA 126 Cb 0.32 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1ixo n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ixo n GLY 127 N 1.34 0.80 3.63 0.00 0.00 -0.88 -4.93 105.19 105.13 1ixo n GLY 127 Ca 0.13 -0.61 -0.35 0.00 0.00 0.00 0.00 46.02 45.18 1ixo n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ixo s ILE 128 N -2.00 4.91 -0.28 -0.61 1.01 -0.48 -4.86 121.20 118.88 1ixo s ILE 128 Ca 0.00 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.40 1ixo s ILE 128 Cb 0.00 -3.24 0.01 0.00 0.01 0.00 0.00 42.46 39.24 1ixo s ILE 128 CO 0.00 0.42 0.95 -1.10 0.00 0.00 0.00 174.94 175.21 1ixo s GLN 129 N 0.65 4.10 -0.03 2.79 -0.21 -0.63 -3.86 119.66 122.47 1ixo s GLN 129 Ca 0.05 0.98 -0.15 0.00 0.02 0.00 0.00 55.36 56.26 1ixo s GLN 129 Cb -0.13 -3.70 -0.05 0.00 1.00 0.00 0.00 33.01 30.13 1ixo s GLN 129 CO 0.01 -0.72 0.40 0.08 -2.12 0.00 0.00 175.29 172.95 1ixo s VAL 130 N 3.23 5.09 -0.05 1.09 1.01 -1.26 -1.18 120.40 128.31 1ixo s VAL 130 Ca 0.40 0.81 0.03 0.00 0.00 0.00 0.00 61.98 63.22 1ixo s VAL 130 Cb -0.14 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.54 1ixo s VAL 130 CO 0.11 0.53 -0.15 -0.55 0.00 0.00 0.00 175.10 175.04 1ixo s SER 131 N -0.70 1.99 -0.31 3.32 0.15 0.12 -1.57 113.70 116.70 1ixo s SER 131 Ca 0.23 -0.33 -0.10 0.00 0.70 0.00 0.00 55.95 56.45 1ixo s SER 131 Cb -0.16 -0.73 -0.01 0.00 -1.71 0.00 0.00 66.02 63.41 1ixo s SER 131 CO 0.12 0.10 0.16 -0.76 1.20 0.00 0.00 173.24 174.06 1ixo s LEU 132 N 0.33 4.12 -0.45 3.45 1.43 -0.48 0.14 118.68 127.22 1ixo s LEU 132 Ca -0.09 -0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 1ixo s LEU 132 Cb -0.13 -2.02 0.01 0.00 0.03 0.00 0.00 46.19 44.07 1ixo s LEU 132 CO 0.03 -0.18 1.43 0.12 0.23 0.00 0.00 176.35 177.98 1ixo s PHE 133 N 1.64 2.35 0.24 0.29 2.19 -0.54 -1.00 117.98 123.15 1ixo s PHE 133 Ca 0.05 0.63 0.02 0.00 0.33 0.00 0.00 56.93 57.96 1ixo s PHE 133 Cb -0.17 -4.33 -0.05 0.00 -1.31 0.00 0.00 43.02 37.16 1ixo s PHE 133 CO 0.07 -1.99 0.05 0.96 1.83 0.00 0.00 175.22 176.14 1ixo s ILE 134 N 5.66 0.74 0.54 3.12 -4.36 -0.80 0.42 121.20 126.53 1ixo s ILE 134 Ca 0.60 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.89 1ixo s ILE 134 Cb -0.13 -2.50 -0.05 0.00 1.25 0.00 0.00 42.46 41.03 1ixo s ILE 134 CO 0.31 -0.15 0.92 -1.81 0.24 0.00 0.00 174.94 174.45 1ixo s ASP 135 N -3.30 6.31 -0.91 4.36 1.01 -1.26 -0.94 116.67 121.94 1ixo s ASP 135 Ca 0.33 1.25 -0.07 0.00 0.71 0.00 0.00 52.55 54.78 1ixo s ASP 135 Cb 0.07 -2.39 -0.06 0.00 1.01 0.00 0.00 42.92 41.56 1ixo s ASP 135 CO 0.11 -0.70 2.09 0.00 0.21 0.00 0.00 175.17 176.88 1ixo n ALA 136 N -2.34 4.61 -3.73 5.23 0.00 -1.26 -4.78 120.51 118.24 1ixo n ALA 136 Ca 0.04 -2.05 -0.30 0.00 0.00 0.00 0.00 53.44 51.13 1ixo n ALA 136 Cb 0.54 -3.03 -0.17 0.00 0.00 0.00 0.00 19.45 16.80 1ixo n ALA 136 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ixo s ASP 137 N 3.50 2.64 0.38 0.00 2.15 -1.26 -4.85 116.67 119.23 1ixo s ASP 137 Ca 0.40 -0.48 0.07 0.00 0.43 0.00 0.00 52.55 52.97 1ixo s ASP 137 Cb 0.10 -1.19 0.80 0.00 -0.30 0.00 0.00 42.92 42.34 1ixo s ASP 137 CO -0.03 0.02 1.98 -0.33 -0.17 0.00 0.00 175.17 176.64 1ixo h GLU 138 N 7.52 0.65 -0.34 4.34 5.08 -1.97 -1.83 114.58 128.04 1ixo h GLU 138 Ca -0.33 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.02 1ixo h GLU 138 Cb 1.17 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1ixo h GLU 138 CO 0.51 0.43 0.17 1.49 -1.00 0.00 0.00 179.01 180.61 1ixo h GLU 139 N 0.67 0.34 -0.44 2.33 4.81 -1.96 -0.17 114.58 120.16 1ixo h GLU 139 Ca 0.28 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.41 1ixo h GLU 139 Cb 0.25 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1ixo h GLU 139 CO -0.09 0.23 -0.04 1.96 -0.73 0.00 0.00 179.01 180.33 1ixo h GLN 140 N 0.35 0.81 -0.51 1.92 1.08 -1.80 -1.63 115.11 115.33 1ixo h GLN 140 Ca 0.14 -0.28 0.02 0.00 -1.45 0.00 0.00 58.65 57.08 1ixo h GLN 140 Cb 0.05 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.39 1ixo h GLN 140 CO -0.10 0.90 0.31 0.82 -0.95 0.00 0.00 178.83 179.80 1ixo h ILE 141 N 0.65 1.06 -0.93 2.54 2.04 -1.10 0.10 117.51 121.87 1ixo h ILE 141 Ca 0.12 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1ixo h ILE 141 Cb 0.56 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 1ixo h ILE 141 CO 0.03 0.11 0.54 0.11 0.00 0.00 0.00 178.15 178.95 1ixo h LYS 142 N 0.61 1.28 -0.06 2.37 1.57 -0.87 -1.98 116.57 119.49 1ixo h LYS 142 Ca 0.20 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1ixo h LYS 142 Cb 0.01 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.06 1ixo h LYS 142 CO -0.09 0.91 0.04 0.00 -0.57 0.00 0.00 179.45 179.74 1ixo h ALA 143 N 1.30 0.08 -0.65 3.86 0.00 -0.35 -0.93 119.26 122.57 1ixo h ALA 143 Ca 0.33 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.25 1ixo h ALA 143 Cb -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1ixo h ALA 143 CO -0.06 -0.42 0.43 0.00 0.00 0.00 0.00 179.25 179.21 1ixo h ALA 144 N 0.99 1.60 -0.12 0.00 0.00 -0.50 0.50 119.26 121.74 1ixo h ALA 144 Ca 0.02 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1ixo h ALA 144 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1ixo h ALA 144 CO -0.00 0.34 -0.42 0.00 0.00 0.00 0.00 179.25 179.17 1ixo h ALA 145 N 1.61 0.21 -0.77 0.00 0.00 -1.14 -2.74 119.26 116.43 1ixo h ALA 145 Ca 0.25 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1ixo h ALA 145 Cb 0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1ixo h ALA 145 CO -0.06 0.33 0.45 1.49 0.00 0.00 0.00 179.25 181.45 1ixo h GLU 146 N 0.09 1.06 0.00 0.00 4.22 -0.58 -2.52 114.58 116.85 1ixo h GLU 146 Ca -0.02 -0.11 0.00 0.00 0.08 0.00 0.00 59.36 59.31 1ixo h GLU 146 Cb 1.05 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1ixo h GLU 146 CO 0.09 0.77 0.00 0.28 -2.18 0.00 0.00 179.01 177.97 1ixo n VAL 147 N -4.46 0.79 -0.08 0.32 0.31 0.17 -4.93 118.33 110.45 1ixo n VAL 147 Ca 0.07 0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 1ixo n VAL 147 Cb 0.07 -1.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 1ixo n VAL 147 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ixo n GLY 148 N 0.23 0.50 3.75 2.92 0.00 -0.95 -4.65 105.19 106.99 1ixo n GLY 148 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1ixo n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ixo s ALA 149 N -2.18 3.73 0.18 4.61 0.00 -1.06 -4.92 121.76 122.13 1ixo s ALA 149 Ca 0.00 1.50 -0.03 0.00 0.00 0.00 0.00 51.96 53.43 1ixo s ALA 149 Cb 0.00 -3.63 0.09 0.00 0.00 0.00 0.00 23.12 19.58 1ixo s ALA 149 CO 0.00 -0.91 1.48 -1.35 0.00 0.00 0.00 175.76 174.99 1ixo h PRO 150 N 5.11 0.55 -5.90 0.00 0.11 -1.88 -3.45 132.00 126.55 1ixo h PRO 150 Ca -0.46 -0.36 -0.54 0.00 0.11 0.00 0.00 66.00 64.74 1ixo h PRO 150 Cb 1.22 0.05 -0.14 0.00 0.11 0.00 0.00 31.00 32.24 1ixo h PRO 150 CO 0.81 0.98 -0.74 -0.06 -0.21 0.00 0.00 178.00 178.77 1ixo s PHE 151 N -3.93 2.04 0.09 0.65 0.40 -0.61 -2.03 117.98 114.60 1ixo s PHE 151 Ca -0.07 -0.45 0.01 0.00 -0.60 0.00 0.00 56.93 55.82 1ixo s PHE 151 Cb 0.11 -0.93 -0.04 0.00 0.51 0.00 0.00 43.02 42.66 1ixo s PHE 151 CO 0.84 0.55 -0.06 0.96 0.70 0.00 0.00 175.22 178.21 1ixo s ILE 152 N -2.73 0.62 -0.26 0.64 -4.36 -1.06 -1.38 121.20 112.67 1ixo s ILE 152 Ca 0.27 -1.89 -0.02 0.00 -0.26 0.00 0.00 60.65 58.75 1ixo s ILE 152 Cb -0.03 -1.63 0.08 0.00 1.25 0.00 0.00 42.46 42.14 1ixo s ILE 152 CO 0.12 -0.88 0.07 -0.70 0.24 0.00 0.00 174.94 173.79 1ixo s GLU 153 N -3.78 0.70 0.01 0.37 2.12 -0.17 -1.48 118.70 116.48 1ixo s GLU 153 Ca 0.10 -0.76 -0.30 0.00 0.36 0.00 0.00 54.97 54.37 1ixo s GLU 153 Cb 0.05 -2.00 -0.06 0.00 0.26 0.00 0.00 34.13 32.38 1ixo s GLU 153 CO -0.05 -0.83 1.54 0.42 -0.54 0.00 0.00 175.26 175.80 1ixo s ILE 154 N 1.74 3.46 -0.07 -3.70 1.01 0.23 -1.89 121.20 121.98 1ixo s ILE 154 Ca 0.04 0.81 -0.29 0.00 0.00 0.00 0.00 60.65 61.21 1ixo s ILE 154 Cb -0.17 -3.52 -0.06 0.00 0.01 0.00 0.00 42.46 38.72 1ixo s ILE 154 CO -0.18 -0.02 1.79 -2.28 0.00 0.00 0.00 174.94 174.25 1ixo s HIS 155 N 2.85 1.71 -1.91 3.97 5.65 -0.11 -2.54 115.29 124.90 1ixo s HIS 155 Ca 0.69 0.09 0.21 0.00 0.25 0.00 0.00 55.06 56.30 1ixo s HIS 155 Cb -0.34 -4.03 0.58 0.00 -1.18 0.00 0.00 32.58 27.61 1ixo s HIS 155 CO 0.29 -4.24 1.49 0.25 -0.65 0.00 0.00 174.74 171.88 1ixo n THR 156 N 5.87 0.93 -0.16 0.89 -2.24 -0.97 -4.58 114.28 114.02 1ixo n THR 156 Ca 0.19 -0.96 -0.05 0.00 -2.27 0.00 0.00 64.05 60.96 1ixo n THR 156 Cb 0.43 0.57 0.04 0.00 -2.10 0.00 0.00 70.33 69.27 1ixo n THR 156 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1ixo h GLY 157 N 4.06 0.67 1.91 3.38 0.00 -1.48 -0.52 103.07 111.08 1ixo h GLY 157 Ca 0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 1ixo h GLY 157 CO 0.00 0.12 -0.28 0.00 0.00 0.00 0.00 176.54 176.37 1ixo h TYR 159 N 0.10 0.84 -0.11 0.00 5.03 -1.75 -1.15 116.97 119.92 1ixo h TYR 159 Ca 0.01 -0.33 -0.13 0.00 2.58 0.00 0.00 58.73 60.87 1ixo h TYR 159 Cb 0.56 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 38.68 1ixo h TYR 159 CO 0.00 1.11 -0.51 0.00 -1.32 0.00 0.00 178.16 177.44 1ixo h ALA 160 N 0.82 0.92 -0.00 1.82 0.00 -0.55 -3.12 119.26 119.15 1ixo h ALA 160 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1ixo h ALA 160 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ixo h ALA 160 CO 0.12 0.67 -0.31 -0.25 0.00 0.00 0.00 179.25 179.48 1ixo n ASP 161 N -3.95 0.75 -4.70 0.00 8.00 0.19 -4.91 116.55 111.93 1ixo n ASP 161 Ca -0.02 -0.59 -0.54 0.00 0.71 0.00 0.00 54.79 54.35 1ixo n ASP 161 Cb 0.56 0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.72 1ixo n ASP 161 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ixo n ALA 162 N -1.00 0.26 0.16 2.24 0.00 -0.45 -4.87 120.51 116.85 1ixo n ALA 162 Ca 0.10 0.34 -0.13 0.00 0.00 0.00 0.00 53.44 53.75 1ixo n ALA 162 Cb 0.34 -2.34 -0.08 0.00 0.00 0.00 0.00 19.45 17.37 1ixo n ALA 162 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1ixo h LYS 163 N 8.07 -0.40 -6.72 0.00 1.57 -1.90 -3.45 116.57 113.74 1ixo h LYS 163 Ca -0.47 0.03 -0.49 0.00 -1.87 0.00 0.00 60.65 57.84 1ixo h LYS 163 Cb 1.30 0.09 0.02 0.00 0.08 0.00 0.00 32.23 33.72 1ixo h LYS 163 CO 0.96 -0.08 -0.03 0.95 -0.57 0.00 0.00 179.45 180.68 1ixo s THR 164 N -4.64 4.98 0.50 -0.16 -4.23 -1.26 -4.97 115.64 105.86 1ixo s THR 164 Ca -0.14 0.02 0.26 0.00 -1.18 0.00 0.00 61.69 60.64 1ixo s THR 164 Cb 0.02 -3.83 0.30 0.00 1.34 0.00 0.00 72.50 70.34 1ixo s THR 164 CO 0.54 -0.63 2.15 0.44 -0.54 0.00 0.00 174.62 176.58 1ixo h ASP 165 N 0.77 0.00 0.01 3.99 3.32 -1.99 -1.39 116.42 121.13 1ixo h ASP 165 Ca -0.48 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 1ixo h ASP 165 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1ixo h ASP 165 CO 0.63 0.07 -0.09 0.00 -1.72 0.00 0.00 179.24 178.13 1ixo h ALA 166 N 1.93 -0.01 -0.03 3.45 0.00 -1.97 -2.46 119.26 120.17 1ixo h ALA 166 Ca -0.00 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.41 1ixo h ALA 166 Cb 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ixo h ALA 166 CO 0.01 0.03 0.08 1.49 0.00 0.00 0.00 179.25 180.86 1ixo h GLU 167 N -0.91 0.00 0.00 0.00 4.81 -1.84 -1.61 114.58 115.03 1ixo h GLU 167 Ca -0.01 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1ixo h GLU 167 Cb 1.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1ixo h GLU 167 CO 0.02 0.00 -0.13 0.37 -0.73 0.00 0.00 179.01 178.54 1ixo h GLN 168 N 0.00 0.00 -0.01 1.92 4.15 -1.25 -2.68 115.11 117.24 1ixo h GLN 168 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1ixo h GLN 168 Cb 0.18 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.87 1ixo h GLN 168 CO -0.00 0.86 0.01 0.00 -1.93 0.00 0.00 178.83 177.78 1ixo h ALA 169 N -0.18 1.54 0.22 3.38 0.00 -1.12 0.38 119.26 123.47 1ixo h ALA 169 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ixo h ALA 169 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ixo h ALA 169 CO -0.02 -0.02 -0.11 0.37 0.00 0.00 0.00 179.25 179.47 1ixo h GLN 170 N 0.00 -0.29 -0.04 0.00 4.15 -1.32 -2.34 115.11 115.27 1ixo h GLN 170 Ca 0.01 0.02 -0.08 0.00 0.77 0.00 0.00 58.65 59.36 1ixo h GLN 170 Cb 0.03 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1ixo h GLN 170 CO -0.00 0.02 -0.37 0.93 -1.93 0.00 0.00 178.83 177.49 1ixo h GLU 171 N -0.61 0.08 0.17 1.69 4.39 -0.94 -2.63 114.58 116.73 1ixo h GLU 171 Ca -0.03 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1ixo h GLU 171 Cb 0.44 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1ixo h GLU 171 CO 0.05 0.44 -0.08 1.25 -1.16 0.00 0.00 179.01 179.51 1ixo h LEU 172 N 0.07 -0.19 -0.94 1.33 6.46 -0.90 -1.72 115.31 119.42 1ixo h LEU 172 Ca 0.01 -0.06 0.09 0.00 -0.12 0.00 0.00 57.88 57.80 1ixo h LEU 172 Cb 0.68 0.05 -0.07 0.00 -0.73 0.00 0.00 40.66 40.59 1ixo h LEU 172 CO 0.05 -0.06 0.58 0.00 -0.62 0.00 0.00 178.44 178.39 1ixo h ALA 173 N 0.51 1.36 -0.64 1.25 0.00 -1.26 0.17 119.26 120.65 1ixo h ALA 173 Ca -0.02 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ixo h ALA 173 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1ixo h ALA 173 CO 0.04 0.25 0.23 -0.09 0.00 0.00 0.00 179.25 179.68 1ixo h ARG 174 N 0.98 0.97 -0.36 0.00 2.43 -1.16 -0.64 114.38 116.59 1ixo h ARG 174 Ca 0.44 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 59.29 1ixo h ARG 174 Cb 0.35 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1ixo h ARG 174 CO -0.23 0.83 -0.31 0.82 -1.51 0.00 0.00 179.97 179.58 1ixo h ILE 175 N 0.91 1.28 -0.44 1.20 2.04 -0.36 -1.01 117.51 121.13 1ixo h ILE 175 Ca 0.21 -1.45 -0.10 0.00 1.00 0.00 0.00 64.86 64.51 1ixo h ILE 175 Cb 0.24 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1ixo h ILE 175 CO -0.01 0.48 -0.15 0.00 0.00 0.00 0.00 178.15 178.47 1ixo h ALA 176 N 0.99 0.91 -0.23 1.87 0.00 -0.37 -0.45 119.26 121.97 1ixo h ALA 176 Ca 0.07 -0.34 -0.20 0.00 0.00 0.00 0.00 54.91 54.44 1ixo h ALA 176 Cb 0.84 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1ixo h ALA 176 CO 0.07 0.62 -0.63 0.87 0.00 0.00 0.00 179.25 180.19 1ixo h LYS 177 N 0.73 0.84 -0.04 0.00 1.57 -1.01 -2.64 116.57 116.01 1ixo h LYS 177 Ca 0.11 -0.59 -0.06 0.00 -1.87 0.00 0.00 60.65 58.25 1ixo h LYS 177 Cb 0.66 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 1ixo h LYS 177 CO 0.05 1.21 -0.24 0.00 -0.57 0.00 0.00 179.45 179.90 1ixo h ALA 178 N 0.62 1.53 -0.02 3.86 0.00 -1.02 0.03 119.26 124.26 1ixo h ALA 178 Ca -0.01 -0.24 -0.21 0.00 0.00 0.00 0.00 54.91 54.45 1ixo h ALA 178 Cb 1.25 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 19.00 1ixo h ALA 178 CO 0.14 0.35 -0.80 0.00 0.00 0.00 0.00 179.25 178.93 1ixo h ALA 179 N 1.70 0.13 -0.43 0.00 0.00 -0.97 -1.29 119.26 118.40 1ixo h ALA 179 Ca 0.01 -0.62 -0.09 0.00 0.00 0.00 0.00 54.91 54.21 1ixo h ALA 179 Cb 0.46 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1ixo h ALA 179 CO 0.03 0.53 -0.11 1.15 0.00 0.00 0.00 179.25 180.85 1ixo h THR 180 N 0.19 1.26 -0.08 0.00 2.02 -1.27 -0.75 112.91 114.27 1ixo h THR 180 Ca -0.09 -1.16 -0.01 0.00 0.77 0.00 0.00 66.41 65.92 1ixo h THR 180 Cb 1.47 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1ixo h THR 180 CO 0.16 0.40 0.02 0.15 0.37 0.00 0.00 175.52 176.62 1ixo h PHE 181 N 0.70 0.12 -0.42 3.16 3.57 -1.00 -1.49 116.94 121.58 1ixo h PHE 181 Ca 0.12 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1ixo h PHE 181 Cb 0.58 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 1ixo h PHE 181 CO 0.03 0.28 0.22 0.00 -2.23 0.00 0.00 178.31 176.61 1ixo h ALA 182 N 0.82 0.53 -0.61 2.41 0.00 -1.01 -1.94 119.26 119.46 1ixo h ALA 182 Ca 0.02 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ixo h ALA 182 Cb 0.22 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1ixo h ALA 182 CO -0.00 -0.13 0.40 0.00 0.00 0.00 0.00 179.25 179.52 1ixo h ALA 183 N 1.22 1.58 0.00 0.00 0.00 -1.00 -1.30 119.26 119.75 1ixo h ALA 183 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ixo h ALA 183 Cb 0.07 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1ixo h ALA 183 CO -0.12 0.38 -0.03 0.66 0.00 0.00 0.00 179.25 180.15 1ixo h SER 184 N 0.81 0.00 -0.41 0.00 4.64 -0.47 -2.11 113.55 116.01 1ixo h SER 184 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1ixo h SER 184 Cb -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1ixo h SER 184 CO -0.05 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.12 1ixo n LEU 185 N -3.17 2.44 0.00 5.97 4.32 -0.54 -4.91 117.00 121.12 1ixo n LEU 185 Ca -0.00 -1.18 0.00 0.00 -0.02 0.00 0.00 56.01 54.81 1ixo n LEU 185 Cb 0.26 -0.27 0.00 0.00 -1.62 0.00 0.00 43.42 41.79 1ixo n LEU 185 CO 0.27 0.59 0.00 0.61 -1.22 0.00 0.00 177.39 177.63 1ixo n GLY 186 N 1.25 0.70 3.82 -0.72 0.00 -0.79 -4.96 105.19 104.48 1ixo n GLY 186 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1ixo n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ixo s LEU 187 N 0.00 4.27 -0.01 0.99 1.43 -0.92 -5.01 118.68 119.42 1ixo s LEU 187 Ca 0.00 1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 54.41 1ixo s LEU 187 Cb 0.00 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.41 1ixo s LEU 187 CO 0.00 -0.04 0.34 -0.54 0.23 0.00 0.00 176.35 176.34 1ixo s LYS 188 N -2.25 3.75 -0.06 1.70 1.02 -0.86 -3.92 119.74 119.13 1ixo s LYS 188 Ca 0.47 0.21 0.04 0.00 0.02 0.00 0.00 55.97 56.71 1ixo s LYS 188 Cb -0.15 -3.16 -0.00 0.00 -0.52 0.00 0.00 37.83 34.00 1ixo s LYS 188 CO 0.20 0.68 -0.20 0.54 -0.92 0.00 0.00 175.35 175.66 1ixo s VAL 189 N -1.15 1.66 0.36 3.17 0.11 -1.26 -2.58 120.40 120.72 1ixo s VAL 189 Ca 0.24 -0.83 0.08 0.00 -2.93 0.00 0.00 61.98 58.55 1ixo s VAL 189 Cb -0.15 -1.43 -0.06 0.00 -1.53 0.00 0.00 36.38 33.21 1ixo s VAL 189 CO 0.12 0.47 0.02 0.20 -3.33 0.00 0.00 175.10 172.59 1ixo s ASN 190 N 0.13 4.09 -0.03 3.54 0.01 -0.55 0.12 114.94 122.25 1ixo s ASN 190 Ca -0.08 -1.10 -0.11 0.00 -0.71 0.00 0.00 52.86 50.85 1ixo s ASN 190 Cb -0.14 -0.47 0.02 0.00 0.41 0.00 0.00 41.25 41.07 1ixo s ASN 190 CO 0.04 -0.32 0.26 0.00 -1.51 0.00 0.00 177.10 175.57 1ixo s ALA 191 N -2.58 -0.64 -0.08 0.60 0.00 -0.97 0.76 121.76 118.85 1ixo s ALA 191 Ca 0.35 0.33 -0.32 0.00 0.00 0.00 0.00 51.96 52.33 1ixo s ALA 191 Cb 0.03 -0.06 0.12 0.00 0.00 0.00 0.00 23.12 23.21 1ixo s ALA 191 CO 0.19 -0.21 1.16 0.20 0.00 0.00 0.00 175.76 177.10 1ixo s GLY 192 N -0.94 -0.35 0.00 0.00 0.00 -1.05 -1.00 107.32 103.98 1ixo s GLY 192 Ca -0.10 1.14 0.00 0.00 0.00 0.00 0.00 44.72 45.76 1ixo s GLY 192 CO 0.02 0.35 0.00 1.57 0.00 0.00 0.00 173.10 175.04 1ixo n HIS 193 N -0.25 0.00 0.00 1.90 -0.00 -1.23 -2.30 115.22 113.34 1ixo n HIS 193 Ca -0.04 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.14 1ixo n HIS 193 Cb 0.60 -0.76 0.00 0.00 -0.12 0.00 0.00 29.99 29.72 1ixo n HIS 193 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1ixo n GLY 194 N 1.16 0.11 3.74 1.57 0.00 -1.26 -1.48 105.19 109.03 1ixo n GLY 194 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ixo n GLY 194 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ixo s LEU 195 N 0.00 4.36 0.44 0.99 1.43 -1.26 -4.80 118.68 119.84 1ixo s LEU 195 Ca 0.00 2.83 0.03 0.00 -1.03 0.00 0.00 54.13 55.96 1ixo s LEU 195 Cb 0.00 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.57 1ixo s LEU 195 CO 0.00 -0.87 0.06 0.42 0.23 0.00 0.00 176.35 176.20 1ixo s THR 196 N 0.32 0.97 0.45 5.49 -4.23 -1.26 -4.50 115.64 112.87 1ixo s THR 196 Ca 0.65 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.29 1ixo s THR 196 Cb -0.46 -2.36 0.21 0.00 1.34 0.00 0.00 72.50 71.23 1ixo s THR 196 CO 0.42 0.00 2.02 1.88 -0.54 0.00 0.00 174.62 178.41 1ixo h TYR 197 N 1.64 0.10 0.00 3.99 -1.99 -1.94 -2.01 116.97 116.77 1ixo h TYR 197 Ca -0.40 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.33 1ixo h TYR 197 Cb 1.29 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1ixo h TYR 197 CO 1.38 0.19 -0.75 0.45 -0.00 0.00 0.00 178.16 179.43 1ixo h HIS 198 N 0.10 0.00 -0.01 4.88 3.86 -1.99 -3.38 115.15 118.62 1ixo h HIS 198 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1ixo h HIS 198 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 1ixo h HIS 198 CO 0.00 0.00 -0.16 0.27 0.86 0.00 0.00 177.93 178.90 1ixo n ASN 199 N -2.58 1.08 -0.22 2.45 2.04 -1.14 -4.76 115.26 112.13 1ixo n ASN 199 Ca 0.01 -1.04 -0.06 0.00 -0.44 0.00 0.00 54.58 53.05 1ixo n ASN 199 Cb 0.52 0.45 0.04 0.00 -2.53 0.00 0.00 39.78 38.26 1ixo n ASN 199 CO 0.00 0.00 0.00 1.62 -0.44 0.00 0.00 177.26 178.44 1ixo h VAL 200 N 0.89 1.16 -0.65 3.53 3.04 -1.55 -3.31 116.25 119.36 1ixo h VAL 200 Ca 0.00 -0.30 0.10 0.00 -1.01 0.00 0.00 66.70 65.49 1ixo h VAL 200 Cb 0.27 0.25 -0.07 0.00 -2.01 0.00 0.00 31.29 29.72 1ixo h VAL 200 CO 0.00 0.16 0.27 0.11 -1.01 0.00 0.00 177.57 177.10 1ixo h LYS 201 N 0.85 0.45 -0.69 4.17 1.57 -1.85 0.13 116.57 121.20 1ixo h LYS 201 Ca 0.23 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1ixo h LYS 201 Cb -0.09 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 1ixo h LYS 201 CO -0.05 0.30 0.45 0.00 -0.57 0.00 0.00 179.45 179.59 1ixo h ALA 202 N 1.43 1.57 -0.04 3.86 0.00 -1.93 0.84 119.26 124.99 1ixo h ALA 202 Ca 0.33 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.95 1ixo h ALA 202 Cb 0.40 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ixo h ALA 202 CO -0.30 0.37 -0.95 0.82 0.00 0.00 0.00 179.25 179.18 1ixo h ILE 203 N 0.87 1.31 -0.06 0.00 1.08 -1.30 -3.21 117.51 116.20 1ixo h ILE 203 Ca 0.27 -2.22 -0.07 0.00 -0.39 0.00 0.00 64.86 62.45 1ixo h ILE 203 Cb -0.00 2.29 -0.01 0.00 -3.07 0.00 0.00 36.82 36.03 1ixo h ILE 203 CO -0.07 0.68 -0.29 0.00 -0.69 0.00 0.00 178.15 177.79 1ixo h ALA 204 N 0.53 1.42 0.00 1.87 0.00 0.06 -2.59 119.26 120.55 1ixo h ALA 204 Ca -0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1ixo h ALA 204 Cb 1.59 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 1ixo h ALA 204 CO 0.18 0.42 -0.05 0.00 0.00 0.00 0.00 179.25 179.80 1ixo h ALA 205 N 1.62 1.06 -2.04 0.00 0.00 -0.87 -3.42 119.26 115.61 1ixo h ALA 205 Ca 0.01 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 54.30 1ixo h ALA 205 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ixo h ALA 205 CO 0.04 0.06 1.42 0.42 0.00 0.00 0.00 179.25 181.20 1ixo s ILE 206 N -3.88 3.06 0.21 0.00 1.01 -0.98 -4.88 121.20 115.75 1ixo s ILE 206 Ca -0.01 0.07 -0.14 0.00 0.00 0.00 0.00 60.65 60.57 1ixo s ILE 206 Cb 0.11 -3.07 0.24 0.00 0.01 0.00 0.00 42.46 39.74 1ixo s ILE 206 CO 0.53 -0.04 1.62 -0.65 0.00 0.00 0.00 174.94 176.40 1ixo h PRO 207 N 14.01 -0.02 0.00 2.79 0.11 -1.89 -2.34 132.00 144.65 1ixo h PRO 207 Ca -0.42 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 1ixo h PRO 207 Cb 1.23 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ixo h PRO 207 CO 0.96 -0.02 -0.00 0.93 -0.21 0.00 0.00 178.00 179.67 1ixo h GLU 208 N -0.02 0.00 -6.50 1.05 3.07 -1.90 -3.44 114.58 106.84 1ixo h GLU 208 Ca 0.31 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.64 1ixo h GLU 208 Cb 0.49 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.44 1ixo h GLU 208 CO -0.68 0.00 1.12 -1.33 -1.40 0.00 0.00 179.01 176.72 1ixo n MET 209 N -3.21 2.80 -0.11 2.33 2.81 -0.88 -4.23 117.12 116.62 1ixo n MET 209 Ca -0.03 1.02 -0.24 0.00 -1.81 0.00 0.00 57.70 56.64 1ixo n MET 209 Cb 0.07 -2.92 -0.11 0.00 -0.71 0.00 0.00 33.22 29.56 1ixo n MET 209 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1ixo n HIS 210 N 5.72 0.73 -3.73 2.03 -0.00 0.33 -4.76 115.22 115.53 1ixo n HIS 210 Ca 0.18 0.31 -0.13 0.00 0.46 0.00 0.00 57.72 58.55 1ixo n HIS 210 Cb 0.37 -1.07 -0.10 0.00 -0.12 0.00 0.00 29.99 29.07 1ixo n HIS 210 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 1ixo s GLU 211 N -2.41 0.45 -0.19 1.57 2.12 -1.25 -2.32 118.70 116.68 1ixo s GLU 211 Ca -0.32 0.59 -0.07 0.00 0.36 0.00 0.00 54.97 55.54 1ixo s GLU 211 Cb 0.08 0.18 -0.04 0.00 0.26 0.00 0.00 34.13 34.61 1ixo s GLU 211 CO 0.56 -0.08 0.06 -0.51 -0.54 0.00 0.00 175.26 174.75 1ixo s LEU 212 N 0.44 3.76 -0.23 2.70 1.43 -1.01 -2.30 118.68 123.46 1ixo s LEU 212 Ca -0.02 0.05 -0.12 0.00 -1.03 0.00 0.00 54.13 53.01 1ixo s LEU 212 Cb -0.04 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 1ixo s LEU 212 CO -0.02 0.16 0.21 0.20 0.23 0.00 0.00 176.35 177.13 1ixo s ASN 213 N 0.46 6.20 -0.01 2.29 0.01 -0.17 -1.40 114.94 122.31 1ixo s ASN 213 Ca 0.03 0.21 0.00 0.00 -0.71 0.00 0.00 52.86 52.40 1ixo s ASN 213 Cb -0.13 -2.13 0.01 0.00 0.41 0.00 0.00 41.25 39.41 1ixo s ASN 213 CO 0.01 0.05 -0.01 -0.63 -1.51 0.00 0.00 177.10 175.01 1ixo s ILE 214 N 1.04 0.13 0.00 0.60 1.01 0.25 -3.47 121.20 120.76 1ixo s ILE 214 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.77 1ixo s ILE 214 Cb -0.14 -0.17 0.00 0.00 0.01 0.00 0.00 42.46 42.16 1ixo s ILE 214 CO 0.05 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.68 1ixo n GLY 215 N 3.56 0.00 0.27 6.18 0.00 -1.26 -0.56 105.19 113.38 1ixo n GLY 215 Ca -0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.86 1ixo n GLY 215 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1ixo h HIS 216 N 0.00 -0.18 -0.63 1.61 -0.00 -1.92 -1.34 115.15 112.69 1ixo h HIS 216 Ca 0.00 0.06 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 1ixo h HIS 216 Cb 0.00 0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.58 1ixo h HIS 216 CO 0.00 -0.27 0.28 0.00 -0.00 0.00 0.00 177.93 177.94 1ixo h ALA 217 N 1.70 1.31 -0.08 5.26 0.00 -1.94 0.81 119.26 126.33 1ixo h ALA 217 Ca 0.38 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1ixo h ALA 217 Cb 0.64 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ixo h ALA 217 CO -0.69 0.53 -0.01 0.82 0.00 0.00 0.00 179.25 179.89 1ixo h ILE 218 N 0.90 1.28 -0.82 0.00 2.04 -1.60 -0.51 117.51 118.81 1ixo h ILE 218 Ca 0.22 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 1ixo h ILE 218 Cb 0.13 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.90 1ixo h ILE 218 CO -0.03 0.25 0.46 0.40 0.00 0.00 0.00 178.15 179.24 1ixo h ILE 219 N -0.17 1.24 -0.61 -0.67 1.08 -1.13 0.24 117.51 117.48 1ixo h ILE 219 Ca 0.02 -0.57 -0.02 0.00 -0.39 0.00 0.00 64.86 63.90 1ixo h ILE 219 Cb 0.40 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 34.25 1ixo h ILE 219 CO 0.01 0.26 0.30 1.23 -0.69 0.00 0.00 178.15 179.25 1ixo h GLY 220 N 1.13 0.92 1.70 5.37 0.00 -0.65 -1.50 103.07 110.03 1ixo h GLY 220 Ca 0.29 -0.43 -0.21 0.00 0.00 0.00 0.00 47.33 46.99 1ixo h GLY 220 CO -0.05 0.41 -0.89 -0.09 0.00 0.00 0.00 176.54 175.92 1ixo h ARG 221 N 0.86 0.27 -0.87 4.80 9.65 -0.44 -3.33 114.38 125.32 1ixo h ARG 221 Ca 0.21 -0.29 0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1ixo h ARG 221 Cb 0.08 0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.70 1ixo h ARG 221 CO -0.03 1.00 0.57 0.00 2.80 0.00 0.00 179.97 184.31 1ixo h ALA 222 N 0.90 1.45 0.00 2.80 0.00 0.49 -0.69 119.26 124.20 1ixo h ALA 222 Ca -0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ixo h ALA 222 Cb 1.52 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ixo h ALA 222 CO 0.14 0.46 -0.03 -0.39 0.00 0.00 0.00 179.25 179.44 1ixo h VAL 223 N 1.09 0.12 0.00 0.00 -1.51 -1.55 0.94 116.25 115.33 1ixo h VAL 223 Ca 0.34 -0.39 -0.00 0.00 -1.23 0.00 0.00 66.70 65.42 1ixo h VAL 223 Cb 0.01 1.34 -0.00 0.00 -2.13 0.00 0.00 31.29 30.52 1ixo h VAL 223 CO -0.10 0.03 -0.43 0.24 -1.23 0.00 0.00 177.57 176.08 1ixo h MET 224 N 0.00 0.00 -0.01 5.19 2.07 -1.47 -3.42 114.93 117.28 1ixo h MET 224 Ca -0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1ixo h MET 224 Cb 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.07 1ixo h MET 224 CO 0.00 0.01 -0.54 0.25 1.07 0.00 0.00 176.91 177.70 1ixo n THR 225 N -4.64 0.00 0.00 2.22 -2.24 -0.36 -5.08 114.28 104.18 1ixo n THR 225 Ca -0.06 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1ixo n THR 225 Cb 0.23 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 1ixo n THR 225 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ixo n GLY 226 N 1.43 0.42 0.32 3.38 0.00 0.32 -4.60 105.19 106.46 1ixo n GLY 226 Ca 0.09 -1.41 0.10 0.00 0.00 0.00 0.00 46.02 44.80 1ixo n GLY 226 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ixo h LEU 227 N 0.00 0.51 0.50 0.99 6.46 -1.92 -2.18 115.31 119.67 1ixo h LEU 227 Ca 0.00 0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1ixo h LEU 227 Cb 0.00 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.96 1ixo h LEU 227 CO 0.00 0.15 -0.36 0.50 -0.62 0.00 0.00 178.44 178.11 1ixo h LYS 228 N 0.57 -0.80 0.00 1.25 3.64 -1.88 -0.32 116.57 119.03 1ixo h LYS 228 Ca 0.52 0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.90 1ixo h LYS 228 Cb 0.85 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 1ixo h LYS 228 CO -0.42 -0.53 -0.26 -0.44 -2.27 0.00 0.00 179.45 175.52 1ixo h ASP 229 N -0.83 0.00 -0.59 4.20 3.32 -1.78 -1.22 116.42 119.53 1ixo h ASP 229 Ca -0.05 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1ixo h ASP 229 Cb 0.70 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 1ixo h ASP 229 CO 0.02 0.26 -0.02 0.00 -1.72 0.00 0.00 179.24 177.78 1ixo h ALA 230 N 1.74 0.84 -0.04 3.45 0.00 -0.92 0.13 119.26 124.46 1ixo h ALA 230 Ca -0.00 -0.32 -0.19 0.00 0.00 0.00 0.00 54.91 54.40 1ixo h ALA 230 Cb 0.52 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1ixo h ALA 230 CO 0.03 0.67 -0.73 0.28 0.00 0.00 0.00 179.25 179.50 1ixo h VAL 231 N 0.96 1.36 -0.62 0.00 2.07 -0.73 -2.93 116.25 116.36 1ixo h VAL 231 Ca 0.17 -2.07 -0.02 0.00 0.82 0.00 0.00 66.70 65.59 1ixo h VAL 231 Cb 0.58 2.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.72 1ixo h VAL 231 CO 0.03 0.62 0.29 0.00 0.02 0.00 0.00 177.57 178.54 1ixo h ALA 232 N 0.39 0.80 -0.66 1.67 0.00 -0.92 -1.84 119.26 118.71 1ixo h ALA 232 Ca -0.08 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1ixo h ALA 232 Cb 1.40 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 1ixo h ALA 232 CO 0.15 0.37 0.42 0.93 0.00 0.00 0.00 179.25 181.12 1ixo h GLU 233 N 0.86 0.82 -0.64 0.00 5.08 -0.99 -0.87 114.58 118.83 1ixo h GLU 233 Ca 0.21 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 1ixo h GLU 233 Cb 0.13 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1ixo h GLU 233 CO -0.03 0.55 0.31 1.98 -1.00 0.00 0.00 179.01 180.82 1ixo h MET 234 N 0.85 0.92 -0.43 2.33 4.05 -1.26 -1.06 114.93 120.33 1ixo h MET 234 Ca 0.26 -0.13 -0.05 0.00 -0.28 0.00 0.00 59.70 59.49 1ixo h MET 234 Cb -0.04 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 30.58 1ixo h MET 234 CO -0.08 0.73 0.07 -0.22 0.23 0.00 0.00 176.91 177.63 1ixo h LYS 235 N 0.88 0.71 -0.32 0.39 1.63 -1.03 -1.43 116.57 117.40 1ixo h LYS 235 Ca 0.22 -0.19 0.03 0.00 -0.85 0.00 0.00 60.65 59.86 1ixo h LYS 235 Cb 0.11 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1ixo h LYS 235 CO -0.03 0.75 0.12 -0.09 -3.45 0.00 0.00 179.45 176.75 1ixo h ARG 236 N 0.57 0.25 -0.09 1.90 2.43 -0.86 -0.80 114.38 117.78 1ixo h ARG 236 Ca 0.13 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 1ixo h ARG 236 Cb 0.38 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1ixo h ARG 236 CO 0.01 0.17 -0.05 -0.07 -1.51 0.00 0.00 179.97 178.52 1ixo h LEU 237 N 0.26 -0.17 -0.53 3.80 3.38 -0.91 -1.07 115.31 120.08 1ixo h LEU 237 Ca 0.14 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.25 1ixo h LEU 237 Cb 0.11 0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1ixo h LEU 237 CO -0.14 -0.07 0.11 0.24 0.09 0.00 0.00 178.44 178.67 1ixo h MET 238 N -0.05 0.24 -0.07 1.13 2.86 -0.72 -1.32 114.93 117.01 1ixo h MET 238 Ca 0.06 -0.01 -0.13 0.00 -2.06 0.00 0.00 59.70 57.55 1ixo h MET 238 Cb 0.13 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1ixo h MET 238 CO -0.12 0.16 -0.54 -0.07 1.06 0.00 0.00 176.91 177.39 1ixo h LEU 239 N 0.25 0.22 -0.77 1.22 3.38 -0.89 -2.79 115.31 115.92 1ixo h LEU 239 Ca 0.27 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1ixo h LEU 239 Cb 0.37 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1ixo h LEU 239 CO -0.34 0.72 0.33 -0.33 0.09 0.00 0.00 178.44 178.91 1ixo h GLU 240 N 0.15 1.14 -0.56 1.13 5.08 -0.47 -1.04 114.58 120.02 1ixo h GLU 240 Ca 0.00 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 1ixo h GLU 240 Cb 1.01 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 1ixo h GLU 240 CO 0.08 0.92 0.22 0.00 -1.00 0.00 0.00 179.01 179.23 1ixo h ALA 241 N 1.17 1.33 -0.00 3.43 0.00 -1.02 -2.40 119.26 121.78 1ixo h ALA 241 Ca 0.26 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 1ixo h ALA 241 Cb 0.18 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ixo h ALA 241 CO -0.03 0.50 -0.79 0.00 0.00 0.00 0.00 179.25 178.93 1ixo h ARG 242 N 0.80 0.02 0.00 0.00 2.47 -1.20 -3.40 114.38 113.07 1ixo h ARG 242 Ca 0.19 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 1ixo h ARG 242 Cb 0.17 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1ixo h ARG 242 CO -0.02 0.80 0.00 0.41 0.56 0.00 0.00 179.97 181.72