#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 3.44 0.09 0.00 2.56 -1.26 -5.01 118.70 118.52 1ixo s GLU 3 Ca 0.00 -0.16 -0.33 0.00 0.00 0.00 0.00 54.97 54.48 1ixo s GLU 3 Cb 0.00 -2.54 -0.12 0.00 2.00 0.00 0.00 34.13 33.47 1ixo s GLU 3 CO 0.00 -0.04 1.74 -0.11 -0.56 0.00 0.00 175.26 176.29 1ixo n LEU 4 N -2.00 3.51 -4.90 2.70 0.00 -1.26 -4.98 117.00 110.06 1ixo n LEU 4 Ca -0.02 1.03 -0.29 0.00 0.00 0.00 0.00 56.01 56.73 1ixo n LEU 4 Cb 0.56 -1.45 -0.03 0.00 0.00 0.00 0.00 43.42 42.49 1ixo n LEU 4 CO 0.50 -0.07 0.20 -0.76 0.00 0.00 0.00 177.39 177.27 1ixo s LEU 5 N 2.26 4.07 -0.16 -1.96 1.43 -0.77 -4.96 118.68 118.60 1ixo s LEU 5 Ca 0.83 0.73 0.01 0.00 -1.03 0.00 0.00 54.13 54.67 1ixo s LEU 5 Cb -0.62 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 42.08 1ixo s LEU 5 CO 0.41 -0.19 -0.20 -0.22 0.23 0.00 0.00 176.35 176.39 1ixo s LEU 6 N -3.49 2.21 -0.21 1.79 0.20 -1.26 -1.08 118.68 116.84 1ixo s LEU 6 Ca 0.44 -0.58 -0.04 0.00 0.69 0.00 0.00 54.13 54.64 1ixo s LEU 6 Cb -0.11 -1.49 -0.01 0.00 -0.43 0.00 0.00 46.19 44.15 1ixo s LEU 6 CO 0.29 0.06 -0.04 -0.83 -0.29 0.00 0.00 176.35 175.54 1ixo s GLY 7 N 0.95 1.64 -0.24 7.98 0.00 0.20 0.68 107.32 118.53 1ixo s GLY 7 Ca -0.03 -1.09 -0.12 0.00 0.00 0.00 0.00 44.72 43.48 1ixo s GLY 7 CO -0.04 0.31 0.24 0.14 0.00 0.00 0.00 173.10 173.75 1ixo s VAL 8 N 1.23 5.29 -0.27 1.40 1.01 -0.81 -0.94 120.40 127.32 1ixo s VAL 8 Ca 0.03 0.33 -0.21 0.00 0.00 0.00 0.00 61.98 62.13 1ixo s VAL 8 Cb -0.14 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1ixo s VAL 8 CO -0.01 0.28 0.68 0.21 0.00 0.00 0.00 175.10 176.27 1ixo s ASN 9 N 1.26 6.61 -0.07 3.32 3.84 0.47 -0.78 114.94 129.59 1ixo s ASN 9 Ca 0.11 0.69 0.20 0.00 0.21 0.00 0.00 52.86 54.06 1ixo s ASN 9 Cb -0.14 -2.36 0.69 0.00 -0.55 0.00 0.00 41.25 38.88 1ixo s ASN 9 CO 0.07 -0.45 1.59 2.30 -2.79 0.00 0.00 177.10 177.82 1ixo n ILE 10 N 5.30 1.54 -0.26 -5.21 -5.35 -0.82 -4.38 119.36 110.18 1ixo n ILE 10 Ca 0.01 -1.14 0.05 0.00 -0.27 0.00 0.00 62.75 61.40 1ixo n ILE 10 Cb 0.49 0.26 0.15 0.00 -1.74 0.00 0.00 39.64 38.80 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 4.10 -0.36 0.31 7.28 3.32 -1.92 -0.41 116.42 128.74 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 1.28 0.35 0.00 0.00 0.22 0.00 0.00 39.33 41.18 1ixo h ASP 11 CO 0.15 -0.18 0.00 1.41 -1.72 0.00 0.00 179.24 178.90 1ixo n HIS 12 N -5.35 0.75 -0.08 4.55 8.25 -1.26 -0.61 115.22 121.47 1ixo n HIS 12 Ca 0.13 0.35 -0.11 0.00 -0.26 0.00 0.00 57.72 57.83 1ixo n HIS 12 Cb 0.47 -1.06 -0.04 0.00 1.12 0.00 0.00 29.99 30.48 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 1.25 0.00 1.59 1.08 -1.41 -2.87 117.51 117.14 1ixo h ILE 13 Ca 0.00 -0.87 -0.07 0.00 -0.39 0.00 0.00 64.86 63.53 1ixo h ILE 13 Cb 0.15 1.33 -0.01 0.00 -3.07 0.00 0.00 36.82 35.23 1ixo h ILE 13 CO 0.00 0.27 -0.32 0.00 -0.69 0.00 0.00 178.15 177.41 1ixo h ALA 14 N 0.82 1.36 0.00 1.87 0.00 -0.93 -1.96 119.26 120.43 1ixo h ALA 14 Ca 0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ixo h ALA 14 Cb 0.39 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ixo h ALA 14 CO 0.01 0.41 -0.15 1.79 0.00 0.00 0.00 179.25 181.31 1ixo h THR 15 N 0.00 0.39 0.03 0.00 1.35 -1.31 0.30 112.91 113.66 1ixo h THR 15 Ca -0.00 -0.90 -0.12 0.00 -0.55 0.00 0.00 66.41 64.83 1ixo h THR 15 Cb 0.61 1.67 0.01 0.00 -1.73 0.00 0.00 68.15 68.71 1ixo h THR 15 CO 0.04 0.15 -0.50 0.25 -0.25 0.00 0.00 175.52 175.21 1ixo h LEU 16 N 0.00 0.39 0.59 3.87 5.85 -1.16 -3.19 115.31 121.66 1ixo h LEU 16 Ca -0.00 -0.82 -0.03 0.00 0.84 0.00 0.00 57.88 57.87 1ixo h LEU 16 Cb 0.66 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.57 1ixo h LEU 16 CO 0.02 1.16 -0.28 -0.09 -0.34 0.00 0.00 178.44 178.91 1ixo h ARG 17 N -0.33 -0.76 0.00 1.25 2.43 -0.93 -3.06 114.38 112.99 1ixo h ARG 17 Ca -0.07 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1ixo h ARG 17 Cb 1.26 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.98 1ixo h ARG 17 CO 0.10 -0.49 0.00 0.09 -1.51 0.00 0.00 179.97 178.16 1ixo n ASN 18 N -5.41 0.00 -0.13 -3.80 4.13 1.00 -1.61 115.26 109.43 1ixo n ASN 18 Ca -0.13 0.32 0.14 0.00 1.68 0.00 0.00 54.58 56.59 1ixo n ASN 18 Cb 0.33 -0.33 0.74 0.00 -1.54 0.00 0.00 39.78 38.98 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 -1.33 2.64 -0.24 5.41 0.00 -1.15 -4.11 120.51 121.73 1ixo n ALA 19 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ixo n ALA 19 Cb 0.01 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.09 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 -0.64 0.62 -1.07 0.00 3.00 -0.63 -5.04 116.66 112.91 1ixo n ARG 20 Ca 0.20 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 58.03 1ixo n ARG 20 Cb 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 32.46 32.56 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 0.00 0.48 2.07 5.14 0.00 -1.14 -5.01 105.19 106.74 1ixo n GLY 21 Ca 0.00 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.61 0.00 0.48 2.61 -2.24 -1.26 -5.02 114.28 106.23 1ixo n THR 22 Ca -0.02 -0.79 0.11 0.00 -2.27 0.00 0.00 64.05 61.08 1ixo n THR 22 Cb 0.24 -1.23 -0.06 0.00 -2.10 0.00 0.00 70.33 67.18 1ixo n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ixo n ALA 23 N -3.04 3.48 -2.81 6.98 0.00 -1.26 -4.82 120.51 119.04 1ixo n ALA 23 Ca -0.09 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 1ixo n ALA 23 Cb 0.31 -0.88 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 1ixo n ALA 23 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1ixo s TYR 24 N -3.25 3.33 0.48 0.00 -0.85 -1.26 -3.62 117.35 112.17 1ixo s TYR 24 Ca 0.01 0.22 -0.14 0.00 -0.52 0.00 0.00 57.07 56.64 1ixo s TYR 24 Cb 0.14 -1.74 -0.07 0.00 0.38 0.00 0.00 41.96 40.67 1ixo s TYR 24 CO 0.84 0.57 0.91 -1.25 -1.52 0.00 0.00 175.55 175.10 1ixo s PRO 25 N -1.87 3.89 -0.22 -3.49 0.04 -1.26 -4.31 135.00 127.77 1ixo s PRO 25 Ca 0.25 0.79 -0.11 0.00 0.04 0.00 0.00 61.00 61.97 1ixo s PRO 25 Cb -0.12 -2.22 -0.05 0.00 0.04 0.00 0.00 34.50 32.15 1ixo s PRO 25 CO 0.16 -0.19 0.17 0.34 0.04 0.00 0.00 177.00 177.52 1ixo s ASP 26 N -3.11 6.18 0.56 6.66 -1.08 -1.24 -4.52 116.67 120.11 1ixo s ASP 26 Ca 0.56 0.19 0.24 0.00 -0.52 0.00 0.00 52.55 53.02 1ixo s ASP 26 Cb -0.10 -2.11 1.57 0.00 -1.46 0.00 0.00 42.92 40.82 1ixo s ASP 26 CO 0.32 0.09 2.20 -0.65 0.52 0.00 0.00 175.17 177.64 1ixo h PRO 27 N 7.23 0.00 -0.44 4.34 0.11 -1.91 -1.63 132.00 139.70 1ixo h PRO 27 Ca -0.39 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 1ixo h PRO 27 Cb 1.16 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1ixo h PRO 27 CO 0.69 0.01 0.08 0.28 -0.21 0.00 0.00 178.00 178.86 1ixo h VAL 28 N 0.00 1.21 -0.04 3.15 2.07 -1.93 -1.15 116.25 119.56 1ixo h VAL 28 Ca -0.00 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 1ixo h VAL 28 Cb 0.03 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1ixo h VAL 28 CO 0.00 0.28 -0.14 -0.61 0.02 0.00 0.00 177.57 177.12 1ixo h GLN 29 N 0.65 0.16 -0.80 1.57 4.15 -1.73 -3.07 115.11 116.06 1ixo h GLN 29 Ca 0.14 -0.12 0.10 0.00 0.77 0.00 0.00 58.65 59.54 1ixo h GLN 29 Cb 0.29 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.95 1ixo h GLN 29 CO 0.00 0.76 0.52 0.00 -1.93 0.00 0.00 178.83 178.19 1ixo h ALA 30 N 0.40 1.79 -0.58 3.38 0.00 -1.25 -1.89 119.26 121.10 1ixo h ALA 30 Ca -0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1ixo h ALA 30 Cb 0.78 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1ixo h ALA 30 CO 0.03 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1ixo h ALA 31 N 1.60 0.78 -0.34 0.00 0.00 -1.22 0.54 119.26 120.62 1ixo h ALA 31 Ca 0.37 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ixo h ALA 31 Cb 0.49 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1ixo h ALA 31 CO -0.14 0.61 0.18 0.74 0.00 0.00 0.00 179.25 180.63 1ixo h PHE 32 N 0.91 0.48 0.45 0.00 -1.00 -1.26 -1.22 116.94 115.30 1ixo h PHE 32 Ca 0.16 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.91 1ixo h PHE 32 Cb 0.54 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 39.96 1ixo h PHE 32 CO 0.04 0.40 -0.22 0.82 -1.61 0.00 0.00 178.31 177.73 1ixo h ILE 33 N 0.42 0.54 -0.38 -0.55 2.04 -1.10 -2.46 117.51 116.02 1ixo h ILE 33 Ca 0.12 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.02 1ixo h ILE 33 Cb 0.09 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 1ixo h ILE 33 CO -0.02 0.00 0.15 0.00 0.00 0.00 0.00 178.15 178.28 1ixo h ALA 34 N -0.07 0.45 -0.18 1.87 0.00 -0.87 -1.55 119.26 118.90 1ixo h ALA 34 Ca -0.06 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.94 1ixo h ALA 34 Cb 0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1ixo h ALA 34 CO 0.10 -0.24 0.16 0.93 0.00 0.00 0.00 179.25 180.20 1ixo h GLU 35 N 0.31 0.00 -0.16 0.00 5.08 -1.11 0.09 114.58 118.79 1ixo h GLU 35 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1ixo h GLU 35 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1ixo h GLU 35 CO -0.16 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 178.89 1ixo n GLN 36 N -4.14 2.32 -0.02 2.33 6.02 -0.67 -4.35 117.38 118.87 1ixo n GLN 36 Ca 0.01 -1.95 0.01 0.00 -0.01 0.00 0.00 57.00 55.06 1ixo n GLN 36 Cb 0.29 -1.48 0.02 0.00 1.02 0.00 0.00 30.24 30.09 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 1.28 2.11 0.00 -1.58 0.00 -0.10 -4.97 120.51 117.25 1ixo n ALA 37 Ca 0.16 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1ixo n ALA 37 Cb 0.57 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.26 0.74 3.73 0.00 0.00 -1.07 -2.40 105.19 105.93 1ixo n GLY 38 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.36 3.31 -0.93 4.61 0.00 -0.51 -4.58 121.76 123.30 1ixo s ALA 39 Ca 0.00 0.70 0.20 0.00 0.00 0.00 0.00 51.96 52.85 1ixo s ALA 39 Cb 0.00 -3.32 -0.22 0.00 0.00 0.00 0.00 23.12 19.58 1ixo s ALA 39 CO 0.00 -0.13 0.84 -0.25 0.00 0.00 0.00 175.76 176.23 1ixo n ASP 40 N 2.66 0.93 -3.57 0.00 8.00 0.21 -4.52 116.55 120.26 1ixo n ASP 40 Ca 0.03 -0.95 -0.09 0.00 0.71 0.00 0.00 54.79 54.48 1ixo n ASP 40 Cb 0.48 1.02 -0.02 0.00 -0.02 0.00 0.00 41.12 42.58 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 -2.93 -0.43 -0.07 0.44 0.00 -1.13 -4.29 107.32 98.92 1ixo s GLY 41 Ca 0.07 0.37 0.04 0.00 0.00 0.00 0.00 44.72 45.20 1ixo s GLY 41 CO 0.82 0.12 -0.21 -0.42 0.00 0.00 0.00 173.10 173.42 1ixo s ILE 42 N -3.63 1.74 -0.12 0.90 -1.09 -0.62 -1.92 121.20 116.47 1ixo s ILE 42 Ca 0.05 -0.87 -0.01 0.00 -2.23 0.00 0.00 60.65 57.59 1ixo s ILE 42 Cb -0.02 -1.50 -0.02 0.00 -1.58 0.00 0.00 42.46 39.33 1ixo s ILE 42 CO -0.06 0.49 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.17 1ixo s THR 43 N 0.16 3.56 0.03 2.92 2.01 0.04 -0.21 115.64 124.15 1ixo s THR 43 Ca -0.10 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.45 1ixo s THR 43 Cb -0.15 -2.51 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 1ixo s THR 43 CO 0.05 0.53 -0.10 0.68 -0.69 0.00 0.00 174.62 175.08 1ixo s VAL 44 N 0.06 0.80 -0.28 3.82 -7.23 -0.61 -1.95 120.40 115.02 1ixo s VAL 44 Ca -0.02 -0.82 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 1ixo s VAL 44 Cb -0.14 -0.75 0.06 0.00 0.56 0.00 0.00 36.38 36.11 1ixo s VAL 44 CO 0.03 -0.05 -0.07 -2.28 -0.31 0.00 0.00 175.10 172.43 1ixo s HIS 45 N -0.79 3.28 -0.49 2.82 2.46 -1.26 0.62 115.29 121.94 1ixo s HIS 45 Ca -0.01 -2.19 -0.26 0.00 0.47 0.00 0.00 55.06 53.07 1ixo s HIS 45 Cb -0.07 -2.02 0.03 0.00 -0.13 0.00 0.00 32.58 30.39 1ixo s HIS 45 CO 0.01 -0.86 1.00 -1.17 -2.47 0.00 0.00 174.74 171.25 1ixo s LEU 46 N 1.15 3.89 0.18 8.88 0.20 -0.63 -4.51 118.68 127.84 1ixo s LEU 46 Ca -0.07 0.10 -0.05 0.00 0.69 0.00 0.00 54.13 54.80 1ixo s LEU 46 Cb -0.20 -3.20 -0.06 0.00 -0.43 0.00 0.00 46.19 42.30 1ixo s LEU 46 CO -0.04 -1.17 0.43 -0.13 -0.29 0.00 0.00 176.35 175.15 1ixo s ARG 47 N 4.05 3.65 0.27 1.98 0.52 -1.26 -4.62 118.95 123.55 1ixo s ARG 47 Ca 0.39 -0.02 -0.01 0.00 -0.52 0.00 0.00 55.73 55.57 1ixo s ARG 47 Cb -0.10 -2.79 0.47 0.00 0.52 0.00 0.00 34.95 33.06 1ixo s ARG 47 CO 0.26 0.41 1.87 1.49 0.02 0.00 0.00 175.30 179.35 1ixo h GLU 48 N 2.60 1.07 0.00 3.54 4.81 -1.98 -0.36 114.58 124.28 1ixo h GLU 48 Ca -0.46 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 1ixo h GLU 48 Cb 1.17 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.31 1ixo h GLU 48 CO 0.71 0.71 0.00 -0.40 -0.73 0.00 0.00 179.01 179.30 1ixo n ASP 49 N -4.54 0.00 -4.13 1.04 5.75 -1.26 -4.89 116.55 108.52 1ixo n ASP 49 Ca 0.17 -0.88 -0.31 0.00 -0.01 0.00 0.00 54.79 53.76 1ixo n ASP 49 Cb 0.25 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 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 -0.98 -2.92 0.21 0.11 5.12 -0.14 -4.85 116.66 113.20 1ixo n ARG 50 Ca 0.20 0.35 -0.15 0.00 -1.93 0.00 0.00 57.85 56.32 1ixo n ARG 50 Cb 0.09 -4.70 -0.07 0.00 -1.16 0.00 0.00 32.46 26.62 1ixo n ARG 50 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 1ixo h ARG 51 N -1.65 -0.60 0.00 5.56 2.43 -1.90 -3.43 114.38 114.79 1ixo h ARG 51 Ca -0.61 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.60 1ixo h ARG 51 Cb 1.38 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.07 1ixo h ARG 51 CO 0.71 -0.40 0.00 -2.39 -1.51 0.00 0.00 179.97 176.39 1ixo n HIS 52 N -5.40 0.00 -2.26 2.20 1.44 -1.26 -4.84 115.22 105.10 1ixo n HIS 52 Ca -0.10 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.20 1ixo n HIS 52 Cb 0.30 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.38 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 -0.76 3.30 0.42 0.61 -1.09 -1.26 -4.73 121.20 117.69 1ixo s ILE 53 Ca 0.00 1.09 0.07 0.00 -2.23 0.00 0.00 60.65 59.59 1ixo s ILE 53 Cb 0.00 -3.70 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 1ixo s ILE 53 CO 0.00 0.17 0.27 0.42 -1.23 0.00 0.00 174.94 174.57 1ixo s THR 54 N -0.01 2.44 0.39 2.92 -4.23 -1.26 -4.61 115.64 111.29 1ixo s THR 54 Ca 0.55 -1.54 0.09 0.00 -1.18 0.00 0.00 61.69 59.61 1ixo s THR 54 Cb -0.35 -2.99 0.17 0.00 1.34 0.00 0.00 72.50 70.67 1ixo s THR 54 CO 0.38 0.00 1.92 0.44 -0.54 0.00 0.00 174.62 176.83 1ixo h ASP 55 N 1.25 0.25 -0.27 3.99 3.32 -1.98 -1.90 116.42 121.07 1ixo h ASP 55 Ca -0.42 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.58 1ixo h ASP 55 Cb 1.26 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1ixo h ASP 55 CO 0.64 0.38 0.15 -0.09 -1.72 0.00 0.00 179.24 178.61 1ixo h ARG 56 N 0.25 0.38 0.05 3.56 1.12 -1.99 0.32 114.38 118.07 1ixo h ARG 56 Ca 0.05 -0.04 0.01 0.00 -1.11 0.00 0.00 59.98 58.89 1ixo h ARG 56 Cb 0.34 -0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.21 1ixo h ARG 56 CO 0.02 0.33 -0.10 -0.44 -3.11 0.00 0.00 179.97 176.67 1ixo h ASP 57 N 0.33 -0.28 -0.74 -3.80 3.45 -1.82 -1.24 116.42 112.31 1ixo h ASP 57 Ca 0.10 0.04 0.06 0.00 0.43 0.00 0.00 57.03 57.65 1ixo h ASP 57 Cb 0.06 0.11 -0.06 0.00 -0.56 0.00 0.00 39.33 38.89 1ixo h ASP 57 CO -0.02 -0.15 0.44 0.58 -1.57 0.00 0.00 179.24 178.52 1ixo h VAL 58 N -0.20 1.01 -0.32 -1.35 2.07 -1.15 0.64 116.25 116.95 1ixo h VAL 58 Ca 0.02 -0.28 -0.07 0.00 0.82 0.00 0.00 66.70 67.20 1ixo h VAL 58 Cb 0.22 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1ixo h VAL 58 CO -0.07 0.15 -0.07 -0.09 0.02 0.00 0.00 177.57 177.50 1ixo h ARG 59 N 0.81 0.61 0.05 1.57 2.43 -0.66 -1.81 114.38 117.38 1ixo h ARG 59 Ca 0.33 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1ixo h ARG 59 Cb 0.17 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1ixo h ARG 59 CO -0.17 0.79 -0.03 0.82 -1.51 0.00 0.00 179.97 179.88 1ixo h ILE 60 N 0.39 1.23 -1.01 1.20 2.04 -0.84 -3.12 117.51 117.40 1ixo h ILE 60 Ca 0.08 -0.97 0.23 0.00 1.00 0.00 0.00 64.86 65.20 1ixo h ILE 60 Cb 0.56 1.86 -0.11 0.00 -0.74 0.00 0.00 36.82 38.39 1ixo h ILE 60 CO 0.03 0.24 0.61 -0.07 0.00 0.00 0.00 178.15 178.97 1ixo h LEU 61 N -0.50 0.67 -2.01 1.44 4.07 0.26 0.55 115.31 119.78 1ixo h LEU 61 Ca -0.01 0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.05 1ixo h LEU 61 Cb 0.45 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.19 1ixo h LEU 61 CO 0.01 0.16 -0.09 -0.09 -1.08 0.00 0.00 178.44 177.35 1ixo h ARG 62 N 0.60 0.00 0.00 1.13 9.65 -1.26 -0.18 114.38 124.33 1ixo h ARG 62 Ca 0.61 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.49 1ixo h ARG 62 Cb 1.17 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.75 1ixo h ARG 62 CO -0.41 0.09 -1.64 1.04 2.80 0.00 0.00 179.97 181.85 1ixo n GLN 63 N -3.56 0.54 -0.04 0.20 6.02 0.18 -4.59 117.38 116.13 1ixo n GLN 63 Ca -0.02 -0.11 0.02 0.00 -0.01 0.00 0.00 57.00 56.88 1ixo n GLN 63 Cb 0.22 -1.57 -0.13 0.00 1.02 0.00 0.00 30.24 29.77 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 -2.21 0.46 -1.75 5.09 -2.24 -0.17 -4.99 114.28 108.47 1ixo n THR 64 Ca -0.02 -0.52 -0.42 0.00 -2.27 0.00 0.00 64.05 60.83 1ixo n THR 64 Cb 0.53 -0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 68.57 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 -2.31 4.46 0.01 3.22 4.77 -0.13 -4.90 117.00 122.12 1ixo n LEU 65 Ca -0.13 1.19 0.04 0.00 -0.03 0.00 0.00 56.01 57.08 1ixo n LEU 65 Cb 0.69 -1.59 -0.11 0.00 -2.33 0.00 0.00 43.42 40.08 1ixo n LEU 65 CO 0.36 0.09 -0.52 -0.67 -1.33 0.00 0.00 177.39 175.32 1ixo n ASP 66 N 1.29 0.44 0.00 -1.43 2.03 -1.26 -4.87 116.55 112.75 1ixo n ASP 66 Ca 0.05 0.18 0.00 0.00 0.52 0.00 0.00 54.79 55.54 1ixo n ASP 66 Cb 0.37 0.95 0.00 0.00 -0.72 0.00 0.00 41.12 41.72 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 -2.62 0.00 -3.81 5.18 -2.24 -1.26 -5.13 114.28 104.40 1ixo n THR 67 Ca -0.10 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 1ixo n THR 67 Cb 0.75 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.86 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 2.16 0.27 0.21 -0.78 3.03 -1.26 -5.05 118.95 117.53 1ixo s ARG 68 Ca 0.00 0.16 -0.25 0.00 2.03 0.00 0.00 55.73 57.67 1ixo s ARG 68 Cb 0.00 0.13 -0.08 0.00 -1.03 0.00 0.00 34.95 33.96 1ixo s ARG 68 CO 0.00 -0.04 0.81 1.41 -1.13 0.00 0.00 175.30 176.35 1ixo s MET 69 N -0.15 4.55 -0.32 3.89 -2.45 -1.26 -1.58 119.30 121.97 1ixo s MET 69 Ca -0.02 1.17 0.03 0.00 -1.25 0.00 0.00 55.69 55.61 1ixo s MET 69 Cb -0.02 -3.12 0.09 0.00 1.25 0.00 0.00 34.83 33.02 1ixo s MET 69 CO 0.01 0.49 0.01 1.21 1.05 0.00 0.00 175.02 177.79 1ixo s ASN 70 N -1.32 4.72 -0.39 1.11 2.47 0.71 -2.28 114.94 119.96 1ixo s ASN 70 Ca 0.40 -1.88 -0.27 0.00 0.42 0.00 0.00 52.86 51.53 1ixo s ASN 70 Cb -0.22 -1.63 0.02 0.00 -1.45 0.00 0.00 41.25 37.98 1ixo s ASN 70 CO 0.26 -0.33 0.97 -0.22 -3.72 0.00 0.00 177.10 174.06 1ixo s LEU 71 N 1.00 3.94 -0.02 3.21 0.20 -0.63 -1.57 118.68 124.82 1ixo s LEU 71 Ca 0.04 0.56 -0.17 0.00 0.69 0.00 0.00 54.13 55.26 1ixo s LEU 71 Cb -0.20 -3.33 -0.05 0.00 -0.43 0.00 0.00 46.19 42.18 1ixo s LEU 71 CO -0.06 -0.94 0.46 -1.61 -0.29 0.00 0.00 176.35 173.91 1ixo s GLU 72 N 3.66 4.10 -0.07 1.98 2.02 0.20 -0.56 118.70 130.04 1ixo s GLU 72 Ca 0.40 0.49 -0.31 0.00 0.02 0.00 0.00 54.97 55.58 1ixo s GLU 72 Cb -0.11 -3.28 0.11 0.00 0.10 0.00 0.00 34.13 30.95 1ixo s GLU 72 CO 0.21 0.53 0.98 0.00 0.02 0.00 0.00 175.26 177.00 1ixo s MET 73 N -0.61 0.67 0.60 1.61 0.23 -0.78 -1.60 119.30 119.41 1ixo s MET 73 Ca 0.25 -0.22 -0.10 0.00 -1.03 0.00 0.00 55.69 54.60 1ixo s MET 73 Cb -0.17 0.31 -0.03 0.00 -1.53 0.00 0.00 34.83 33.40 1ixo s MET 73 CO 0.14 -0.29 0.99 0.00 -2.03 0.00 0.00 175.02 173.83 1ixo s ALA 74 N -2.79 3.15 -1.17 3.16 0.00 -1.26 -1.26 121.76 121.59 1ixo s ALA 74 Ca 0.06 -0.20 -0.15 0.00 0.00 0.00 0.00 51.96 51.67 1ixo s ALA 74 Cb -0.01 -2.97 0.15 0.00 0.00 0.00 0.00 23.12 20.29 1ixo s ALA 74 CO -0.07 -0.66 1.42 0.08 0.00 0.00 0.00 175.76 176.52 1ixo s VAL 75 N -3.11 4.87 0.08 0.00 1.01 -1.26 -4.68 120.40 117.31 1ixo s VAL 75 Ca 0.54 -2.37 0.03 0.00 0.00 0.00 0.00 61.98 60.18 1ixo s VAL 75 Cb -0.11 -4.92 -0.03 0.00 0.00 0.00 0.00 36.38 31.32 1ixo s VAL 75 CO 0.52 -1.65 -0.10 0.42 0.00 0.00 0.00 175.10 174.29 1ixo s THR 76 N 2.08 0.84 0.27 3.92 -4.23 -1.26 -5.05 115.64 112.21 1ixo s THR 76 Ca 0.42 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.49 1ixo s THR 76 Cb -0.02 -1.13 0.26 0.00 1.34 0.00 0.00 72.50 72.95 1ixo s THR 76 CO -0.01 -0.47 1.72 -0.08 -0.54 0.00 0.00 174.62 175.24 1ixo h GLU 77 N 3.90 0.47 0.28 3.99 4.57 -1.99 -0.81 114.58 124.99 1ixo h GLU 77 Ca -0.37 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.78 1ixo h GLU 77 Cb 1.19 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.66 1ixo h GLU 77 CO 0.48 0.31 -0.28 1.49 -1.18 0.00 0.00 179.01 179.83 1ixo h GLU 78 N 0.48 -0.57 -0.70 1.92 4.81 -1.97 -1.91 114.58 116.65 1ixo h GLU 78 Ca 0.49 0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.73 1ixo h GLU 78 Cb 0.82 0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.30 1ixo h GLU 78 CO -0.45 -0.38 0.31 0.52 -0.73 0.00 0.00 179.01 178.28 1ixo h MET 79 N -0.59 1.03 -0.94 1.92 2.86 -1.66 -1.61 114.93 115.93 1ixo h MET 79 Ca -0.01 -0.17 0.03 0.00 -2.06 0.00 0.00 59.70 57.48 1ixo h MET 79 Cb 0.54 -0.18 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 1ixo h MET 79 CO -0.05 0.84 0.62 -0.07 1.06 0.00 0.00 176.91 179.31 1ixo h LEU 80 N 0.99 1.04 -0.44 1.22 3.38 -1.06 0.46 115.31 120.91 1ixo h LEU 80 Ca 0.24 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 1ixo h LEU 80 Cb 0.17 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1ixo h LEU 80 CO -0.02 0.73 -0.09 0.00 0.09 0.00 0.00 178.44 179.15 1ixo h ALA 81 N 1.44 0.60 -0.23 1.53 0.00 -0.89 0.18 119.26 121.90 1ixo h ALA 81 Ca 0.37 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1ixo h ALA 81 Cb -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1ixo h ALA 81 CO -0.10 0.48 0.05 0.82 0.00 0.00 0.00 179.25 180.49 1ixo h ILE 82 N 0.67 1.21 -0.56 0.00 2.04 -0.60 -1.46 117.51 118.81 1ixo h ILE 82 Ca 0.11 -0.70 0.05 0.00 1.00 0.00 0.00 64.86 65.33 1ixo h ILE 82 Cb 0.62 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 1ixo h ILE 82 CO 0.04 0.22 0.29 0.00 0.00 0.00 0.00 178.15 178.70 1ixo h ALA 83 N 0.86 0.73 -0.85 1.87 0.00 0.09 0.23 119.26 122.19 1ixo h ALA 83 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ixo h ALA 83 Cb 0.29 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1ixo h ALA 83 CO 0.00 -0.06 0.49 0.28 0.00 0.00 0.00 179.25 179.97 1ixo h VAL 84 N 0.55 1.24 0.00 0.00 2.07 -0.47 -0.47 116.25 119.17 1ixo h VAL 84 Ca 0.25 -0.55 -0.18 0.00 0.82 0.00 0.00 66.70 67.04 1ixo h VAL 84 Cb 0.16 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.96 1ixo h VAL 84 CO -0.17 0.26 -1.03 -0.08 0.02 0.00 0.00 177.57 176.56 1ixo h GLU 85 N 1.18 0.00 0.00 1.57 4.81 -0.47 -3.30 114.58 118.36 1ixo h GLU 85 Ca 0.30 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.38 1ixo h GLU 85 Cb -0.02 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1ixo h GLU 85 CO -0.05 0.65 -0.74 1.15 -0.73 0.00 0.00 179.01 179.28 1ixo h THR 86 N 0.00 1.45 -6.22 0.32 2.02 -0.38 -3.48 112.91 106.61 1ixo h THR 86 Ca -0.08 -2.62 -0.45 0.00 0.77 0.00 0.00 66.41 64.04 1ixo h THR 86 Cb 1.66 2.44 0.01 0.00 -1.74 0.00 0.00 68.15 70.52 1ixo h THR 86 CO 0.09 0.73 -0.82 0.29 0.37 0.00 0.00 175.52 176.18 1ixo n LYS 87 N -3.53 -4.79 -1.38 6.66 4.01 -0.20 -4.94 118.16 113.98 1ixo n LYS 87 Ca -0.00 0.57 -0.32 0.00 -0.51 0.00 0.00 58.31 58.05 1ixo n LYS 87 Cb 0.75 -5.16 0.08 0.00 -0.51 0.00 0.00 35.03 30.20 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 -6.26 2.32 0.36 1.97 0.04 -1.26 -4.91 135.00 127.26 1ixo s PRO 88 Ca 0.20 1.31 0.06 0.00 0.04 0.00 0.00 61.00 62.61 1ixo s PRO 88 Cb -0.10 -1.90 0.69 0.00 0.04 0.00 0.00 34.50 33.23 1ixo s PRO 88 CO 0.83 -1.61 1.91 1.25 0.04 0.00 0.00 177.00 179.42 1ixo h HIS 89 N -0.76 0.44 -3.38 0.56 2.76 -1.91 -3.43 115.15 109.43 1ixo h HIS 89 Ca -0.45 -0.04 -0.33 0.00 -2.20 0.00 0.00 60.37 57.35 1ixo h HIS 89 Cb 1.24 -0.13 -0.15 0.00 1.55 0.00 0.00 27.41 29.93 1ixo h HIS 89 CO 0.55 0.46 -0.72 -0.06 -1.30 0.00 0.00 177.93 176.87 1ixo s PHE 90 N -4.94 1.28 -0.10 5.26 0.40 -0.97 -2.08 117.98 116.84 1ixo s PHE 90 Ca -0.07 -0.74 -0.04 0.00 -0.60 0.00 0.00 56.93 55.48 1ixo s PHE 90 Cb 0.16 -0.65 0.05 0.00 0.51 0.00 0.00 43.02 43.09 1ixo s PHE 90 CO 0.75 0.09 0.19 0.00 0.70 0.00 0.00 175.22 176.96 1ixo s LEU 93 N 1.48 4.11 0.34 0.00 1.43 0.18 -1.87 118.68 124.35 1ixo s LEU 93 Ca 0.03 0.86 0.06 0.00 -1.03 0.00 0.00 54.13 54.05 1ixo s LEU 93 Cb -0.17 -2.96 -0.07 0.00 0.03 0.00 0.00 46.19 43.03 1ixo s LEU 93 CO 0.01 -0.35 -0.01 0.68 0.23 0.00 0.00 176.35 176.91 1ixo s VAL 94 N 2.24 1.73 0.29 -1.59 -7.23 -0.39 -2.31 120.40 113.14 1ixo s VAL 94 Ca 0.30 -2.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.11 1ixo s VAL 94 Cb -0.16 -2.75 -0.10 0.00 0.56 0.00 0.00 36.38 33.93 1ixo s VAL 94 CO 0.10 -0.11 1.31 -2.84 -0.31 0.00 0.00 175.10 173.25 1ixo s PRO 95 N -3.75 4.37 0.00 4.82 0.02 -1.26 -4.01 135.00 135.19 1ixo s PRO 95 Ca 0.34 2.17 0.13 0.00 0.02 0.00 0.00 61.00 63.66 1ixo s PRO 95 Cb 0.07 -3.11 0.80 0.00 0.02 0.00 0.00 34.50 32.28 1ixo s PRO 95 CO 0.16 -0.20 1.50 -0.85 -0.33 0.00 0.00 177.00 177.27 1ixo n GLU 96 N 1.39 0.98 0.00 5.54 0.00 -1.26 -4.86 120.64 122.42 1ixo n GLU 96 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.18 1ixo n GLU 96 Cb 0.42 -1.22 0.00 0.00 0.00 0.00 0.00 31.44 30.64 1ixo n GLU 96 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1ixo n GLU 104 N -0.72 0.00 0.00 3.44 0.28 -1.26 -5.11 120.64 117.28 1ixo n GLU 104 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 1ixo n GLU 104 Cb 0.05 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.92 1ixo n GLU 104 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ixo n GLY 105 N 0.00 1.30 3.94 -1.84 0.00 -1.26 -4.89 105.19 102.43 1ixo n GLY 105 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.45 1.72 0.55 -0.02 0.00 -1.26 -4.77 107.32 102.09 1ixo s GLY 106 Ca 0.00 -1.12 -0.20 0.00 0.00 0.00 0.00 44.72 43.40 1ixo s GLY 106 CO 0.00 -0.56 1.25 1.08 0.00 0.00 0.00 173.10 174.87 1ixo s LEU 107 N -5.47 3.79 -0.77 0.66 1.43 0.88 -4.83 118.68 114.37 1ixo s LEU 107 Ca 0.66 2.50 -0.16 0.00 -1.03 0.00 0.00 54.13 56.09 1ixo s LEU 107 Cb -0.08 -4.43 0.17 0.00 0.03 0.00 0.00 46.19 41.88 1ixo s LEU 107 CO 0.48 -1.46 0.80 -0.62 0.23 0.00 0.00 176.35 175.77 1ixo s ASP 108 N -1.34 6.56 -0.13 2.29 3.68 -1.26 -4.70 116.67 121.77 1ixo s ASP 108 Ca 0.73 -2.21 -0.18 0.00 2.13 0.00 0.00 52.55 53.02 1ixo s ASP 108 Cb -0.33 -2.27 -0.25 0.00 -1.45 0.00 0.00 42.92 38.62 1ixo s ASP 108 CO 0.38 -0.81 0.49 0.58 0.13 0.00 0.00 175.17 175.94 1ixo h VAL 109 N 5.35 1.05 -0.99 1.11 2.07 -1.91 -3.28 116.25 119.65 1ixo h VAL 109 Ca -0.01 -2.35 0.13 0.00 0.82 0.00 0.00 66.70 65.30 1ixo h VAL 109 Cb 1.05 2.66 -0.09 0.00 -1.52 0.00 0.00 31.29 33.39 1ixo h VAL 109 CO 0.93 0.63 0.62 0.00 0.02 0.00 0.00 177.57 179.77 1ixo h ALA 110 N -0.13 1.58 -0.09 1.67 0.00 -1.84 -1.55 119.26 118.91 1ixo h ALA 110 Ca -0.29 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1ixo h ALA 110 Cb 1.62 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1ixo h ALA 110 CO -0.00 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.81 1ixo n GLY 111 N -1.35 0.08 2.74 0.00 0.00 -1.26 -4.21 105.19 101.19 1ixo n GLY 111 Ca 0.20 -0.42 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 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 0.18 1.43 -0.27 1.61 6.02 -0.61 -4.99 117.38 120.75 1ixo n GLN 112 Ca 0.18 -3.16 0.07 0.00 -0.01 0.00 0.00 57.00 54.07 1ixo n GLN 112 Cb 0.33 -1.24 0.21 0.00 1.02 0.00 0.00 30.24 30.56 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 2.64 0.42 -0.17 -1.09 3.08 -1.66 -1.09 114.38 116.52 1ixo h ARG 113 Ca -0.15 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 1ixo h ARG 113 Cb 1.24 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 1ixo h ARG 113 CO 0.28 0.28 -0.03 -0.44 -1.07 0.00 0.00 179.97 178.99 1ixo h ASP 114 N 0.43 0.31 -0.01 7.04 3.32 -1.94 0.02 116.42 125.59 1ixo h ASP 114 Ca 0.44 -0.36 0.03 0.00 0.02 0.00 0.00 57.03 57.17 1ixo h ASP 114 Cb 0.71 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 40.13 1ixo h ASP 114 CO -0.43 0.60 -0.28 0.50 -1.72 0.00 0.00 179.24 177.90 1ixo h LYS 115 N 0.03 -0.40 -0.39 3.56 3.64 -1.86 -1.44 116.57 119.71 1ixo h LYS 115 Ca 0.04 0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1ixo h LYS 115 Cb 0.45 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 1ixo h LYS 115 CO 0.01 -0.27 0.09 0.52 -2.27 0.00 0.00 179.45 177.54 1ixo h MET 116 N -0.41 0.58 -0.59 1.90 2.86 -1.15 -1.90 114.93 116.22 1ixo h MET 116 Ca 0.07 -0.10 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 1ixo h MET 116 Cb 0.51 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 1ixo h MET 116 CO -0.25 0.53 0.05 -0.09 1.06 0.00 0.00 176.91 178.22 1ixo h ARG 117 N 0.57 1.00 -0.21 1.72 2.43 -0.46 -1.63 114.38 117.80 1ixo h ARG 117 Ca 0.13 -0.29 -0.17 0.00 -0.81 0.00 0.00 59.98 58.84 1ixo h ARG 117 Cb 0.22 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1ixo h ARG 117 CO -0.00 0.97 -0.55 -0.44 -1.51 0.00 0.00 179.97 178.44 1ixo h ASP 118 N 0.90 0.71 -0.08 -3.80 3.32 -0.93 -1.35 116.42 115.18 1ixo h ASP 118 Ca 0.17 -0.38 -0.01 0.00 0.02 0.00 0.00 57.03 56.84 1ixo h ASP 118 Cb 0.48 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1ixo h ASP 118 CO 0.02 1.11 0.02 0.00 -1.72 0.00 0.00 179.24 178.67 1ixo h ALA 119 N 0.90 0.11 -0.84 3.45 0.00 -1.25 0.31 119.26 121.94 1ixo h ALA 119 Ca 0.01 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ixo h ALA 119 Cb 1.11 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1ixo h ALA 119 CO 0.11 -0.26 0.56 0.00 0.00 0.00 0.00 179.25 179.66 1ixo h LYS 121 N 1.14 -0.06 -0.39 0.00 3.11 -1.06 -1.68 116.57 117.63 1ixo h LYS 121 Ca 0.31 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 58.14 1ixo h LYS 121 Cb -0.13 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.09 1ixo h LYS 121 CO -0.07 -0.01 0.19 -0.09 -2.81 0.00 0.00 179.45 176.66 1ixo h ARG 122 N -0.09 0.56 -0.28 1.90 2.43 -0.57 -1.62 114.38 116.72 1ixo h ARG 122 Ca -0.01 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 58.98 1ixo h ARG 122 Cb 0.07 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ixo h ARG 122 CO 0.01 0.49 -0.27 -0.07 -1.51 0.00 0.00 179.97 178.62 1ixo h LEU 123 N 0.50 0.56 -0.93 3.80 3.38 -0.98 -2.67 115.31 118.96 1ixo h LEU 123 Ca 0.14 -0.20 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1ixo h LEU 123 Cb 0.11 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1ixo h LEU 123 CO -0.02 0.81 -0.51 0.00 0.09 0.00 0.00 178.44 178.82 1ixo h ALA 124 N 1.23 1.08 -0.32 1.53 0.00 -1.14 -0.79 119.26 120.85 1ixo h ALA 124 Ca 0.07 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1ixo h ALA 124 Cb 0.71 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ixo h ALA 124 CO 0.05 0.63 -0.12 -0.44 0.00 0.00 0.00 179.25 179.38 1ixo h ASP 125 N 0.00 0.54 -0.05 0.00 3.32 -0.96 0.33 116.42 119.60 1ixo h ASP 125 Ca -0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1ixo h ASP 125 Cb 0.94 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1ixo h ASP 125 CO 0.07 0.69 0.00 0.00 -1.72 0.00 0.00 179.24 178.27 1ixo n ALA 126 N -2.48 2.50 -1.93 3.45 0.00 -0.90 -4.87 120.51 116.28 1ixo n ALA 126 Ca 0.01 -0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.23 1ixo n ALA 126 Cb 0.33 -1.03 -0.02 0.00 0.00 0.00 0.00 19.45 18.73 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 0.61 0.34 3.77 0.00 0.00 0.11 -4.90 105.19 105.12 1ixo n GLY 127 Ca 0.03 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.52 5.30 -0.22 -0.61 1.01 -0.35 -4.95 121.20 118.86 1ixo s ILE 128 Ca 0.00 0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.54 1ixo s ILE 128 Cb 0.00 -3.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.10 1ixo s ILE 128 CO 0.00 0.52 0.87 -1.10 0.00 0.00 0.00 174.94 175.23 1ixo s GLN 129 N -0.24 4.23 -0.08 2.79 -0.21 -0.88 -3.82 119.66 121.44 1ixo s GLN 129 Ca 0.10 1.04 -0.15 0.00 0.02 0.00 0.00 55.36 56.38 1ixo s GLN 129 Cb -0.12 -3.62 -0.05 0.00 1.00 0.00 0.00 33.01 30.22 1ixo s GLN 129 CO 0.01 -0.48 0.37 0.08 -2.12 0.00 0.00 175.29 173.15 1ixo s VAL 130 N 2.69 5.18 -0.05 1.09 1.01 -1.26 -2.12 120.40 126.94 1ixo s VAL 130 Ca 0.38 0.74 0.04 0.00 0.00 0.00 0.00 61.98 63.14 1ixo s VAL 130 Cb -0.16 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.53 1ixo s VAL 130 CO 0.09 0.46 -0.18 -0.55 0.00 0.00 0.00 175.10 174.93 1ixo s SER 131 N -0.21 2.22 -0.20 3.32 0.15 0.23 -1.87 113.70 117.34 1ixo s SER 131 Ca 0.22 -0.36 -0.06 0.00 0.70 0.00 0.00 55.95 56.44 1ixo s SER 131 Cb -0.15 -0.64 -0.03 0.00 -1.71 0.00 0.00 66.02 63.50 1ixo s SER 131 CO 0.09 0.16 0.02 -0.76 1.20 0.00 0.00 173.24 173.94 1ixo s LEU 132 N 0.05 3.39 -0.38 3.45 1.43 -0.91 -0.65 118.68 125.06 1ixo s LEU 132 Ca -0.04 -0.14 -0.24 0.00 -1.03 0.00 0.00 54.13 52.68 1ixo s LEU 132 Cb -0.12 -1.86 0.01 0.00 0.03 0.00 0.00 46.19 44.26 1ixo s LEU 132 CO 0.02 0.09 0.83 0.12 0.23 0.00 0.00 176.35 177.64 1ixo s PHE 133 N 0.88 3.07 0.24 0.29 2.19 -0.98 -0.61 117.98 123.06 1ixo s PHE 133 Ca 0.02 0.55 0.00 0.00 0.33 0.00 0.00 56.93 57.83 1ixo s PHE 133 Cb -0.14 -3.55 -0.04 0.00 -1.31 0.00 0.00 43.02 37.98 1ixo s PHE 133 CO 0.02 -0.82 0.12 0.96 1.83 0.00 0.00 175.22 177.33 1ixo s ILE 134 N 3.28 0.27 0.68 3.12 -4.36 -0.70 -0.09 121.20 123.41 1ixo s ILE 134 Ca 0.33 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.61 1ixo s ILE 134 Cb -0.12 -2.56 -0.00 0.00 1.25 0.00 0.00 42.46 41.02 1ixo s ILE 134 CO 0.19 0.00 1.06 -1.81 0.24 0.00 0.00 174.94 174.62 1ixo s ASP 135 N -3.25 5.59 -1.05 4.36 1.01 -1.26 -0.43 116.67 121.63 1ixo s ASP 135 Ca 0.38 1.42 -0.20 0.00 0.71 0.00 0.00 52.55 54.87 1ixo s ASP 135 Cb 0.07 -2.33 -0.08 0.00 1.01 0.00 0.00 42.92 41.60 1ixo s ASP 135 CO 0.13 -1.28 2.00 0.00 0.21 0.00 0.00 175.17 176.23 1ixo n ALA 136 N -3.01 3.78 -3.70 5.23 0.00 -1.26 -4.76 120.51 116.79 1ixo n ALA 136 Ca 0.07 -3.48 -0.25 0.00 0.00 0.00 0.00 53.44 49.78 1ixo n ALA 136 Cb 0.55 -3.59 -0.17 0.00 0.00 0.00 0.00 19.45 16.24 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 4.61 1.87 0.37 0.00 3.68 -1.26 -4.84 116.67 121.10 1ixo s ASP 137 Ca 0.56 -0.27 0.08 0.00 2.13 0.00 0.00 52.55 55.04 1ixo s ASP 137 Cb 0.12 -0.78 0.72 0.00 -1.45 0.00 0.00 42.92 41.53 1ixo s ASP 137 CO 0.06 -0.06 1.91 -0.33 0.13 0.00 0.00 175.17 176.88 1ixo h GLU 138 N 7.62 0.35 -0.31 4.34 3.07 -1.95 0.32 114.58 128.02 1ixo h GLU 138 Ca -0.31 -0.08 -0.08 0.00 -0.50 0.00 0.00 59.36 58.40 1ixo h GLU 138 Cb 1.15 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.01 1ixo h GLU 138 CO 0.43 0.44 -0.11 1.49 -1.40 0.00 0.00 179.01 179.86 1ixo h GLU 139 N 0.34 0.62 -0.45 2.33 4.81 -1.96 0.12 114.58 120.38 1ixo h GLU 139 Ca 0.07 -0.25 -0.14 0.00 -0.13 0.00 0.00 59.36 58.91 1ixo h GLU 139 Cb 0.34 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 1ixo h GLU 139 CO 0.02 0.82 -0.26 1.96 -0.73 0.00 0.00 179.01 180.82 1ixo h GLN 140 N 0.38 0.96 -0.46 1.92 1.08 -1.81 -1.85 115.11 115.33 1ixo h GLN 140 Ca 0.07 -0.43 -0.02 0.00 -1.45 0.00 0.00 58.65 56.82 1ixo h GLN 140 Cb 0.61 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1ixo h GLN 140 CO 0.04 1.10 0.20 0.82 -0.95 0.00 0.00 178.83 180.03 1ixo h ILE 141 N 0.81 1.20 -0.62 2.54 2.04 -0.22 -0.08 117.51 123.18 1ixo h ILE 141 Ca 0.10 -0.59 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 1ixo h ILE 141 Cb 0.84 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1ixo h ILE 141 CO 0.07 0.22 0.16 0.50 0.00 0.00 0.00 178.15 179.11 1ixo h LYS 142 N 0.60 0.98 -0.56 2.37 1.63 -0.69 -2.48 116.57 118.42 1ixo h LYS 142 Ca 0.16 -0.23 -0.04 0.00 -0.85 0.00 0.00 60.65 59.69 1ixo h LYS 142 Cb 0.16 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1ixo h LYS 142 CO -0.02 0.89 0.18 0.00 -3.45 0.00 0.00 179.45 177.06 1ixo h ALA 143 N 1.05 1.27 -0.25 5.00 0.00 -1.02 -1.68 119.26 123.63 1ixo h ALA 143 Ca 0.20 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ixo h ALA 143 Cb 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ixo h ALA 143 CO -0.00 0.52 0.15 0.00 0.00 0.00 0.00 179.25 179.92 1ixo h ALA 144 N 1.39 0.33 -0.85 0.00 0.00 -0.60 -0.38 119.26 119.14 1ixo h ALA 144 Ca 0.19 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ixo h ALA 144 Cb 0.22 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1ixo h ALA 144 CO -0.01 -0.16 0.46 0.00 0.00 0.00 0.00 179.25 179.54 1ixo h ALA 145 N 1.03 1.20 -0.16 0.00 0.00 -1.12 -2.92 119.26 117.30 1ixo h ALA 145 Ca 0.09 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 1ixo h ALA 145 Cb 0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1ixo h ALA 145 CO -0.02 0.64 -0.48 0.93 0.00 0.00 0.00 179.25 180.32 1ixo h GLU 146 N 1.19 0.42 0.00 0.00 5.08 -0.73 -2.20 114.58 118.34 1ixo h GLU 146 Ca 0.30 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1ixo h GLU 146 Cb 0.04 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1ixo h GLU 146 CO -0.05 0.81 0.00 1.33 -1.00 0.00 0.00 179.01 180.10 1ixo n VAL 147 N -3.98 0.18 -0.31 3.13 0.24 -0.21 -4.89 118.33 112.48 1ixo n VAL 147 Ca -0.02 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 1ixo n VAL 147 Cb 0.55 -0.67 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 1ixo n VAL 147 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ixo n GLY 148 N 0.57 0.71 3.76 7.63 0.00 -0.83 -4.54 105.19 112.50 1ixo n GLY 148 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.45 3.48 -0.03 4.61 0.00 -1.14 -4.95 121.76 121.28 1ixo s ALA 149 Ca 0.00 1.12 0.13 0.00 0.00 0.00 0.00 51.96 53.21 1ixo s ALA 149 Cb 0.00 -3.44 0.04 0.00 0.00 0.00 0.00 23.12 19.71 1ixo s ALA 149 CO 0.00 -0.49 1.42 -1.00 0.00 0.00 0.00 175.76 175.69 1ixo h PRO 150 N 4.10 0.00 -5.65 0.00 0.13 -1.90 -3.43 132.00 125.26 1ixo h PRO 150 Ca -0.47 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.18 1ixo h PRO 150 Cb 1.22 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 1ixo h PRO 150 CO 0.69 0.65 -0.73 -0.06 -0.23 0.00 0.00 178.00 178.33 1ixo s PHE 151 N -2.95 1.83 0.03 1.56 0.40 -0.78 -1.42 117.98 116.65 1ixo s PHE 151 Ca 0.03 -0.56 -0.00 0.00 -0.60 0.00 0.00 56.93 55.80 1ixo s PHE 151 Cb 0.09 -0.87 -0.02 0.00 0.51 0.00 0.00 43.02 42.72 1ixo s PHE 151 CO 0.76 0.40 -0.03 0.96 0.70 0.00 0.00 175.22 178.01 1ixo s ILE 152 N -2.91 0.15 -0.20 0.64 -4.36 -0.80 -2.13 121.20 111.58 1ixo s ILE 152 Ca 0.25 -1.09 0.01 0.00 -0.26 0.00 0.00 60.65 59.55 1ixo s ILE 152 Cb -0.01 -0.51 0.05 0.00 1.25 0.00 0.00 42.46 43.24 1ixo s ILE 152 CO 0.09 -0.59 -0.08 -0.70 0.24 0.00 0.00 174.94 173.90 1ixo s GLU 153 N -1.94 1.81 -0.08 0.37 2.12 0.22 -0.68 118.70 120.51 1ixo s GLU 153 Ca -0.11 -0.83 -0.30 0.00 0.36 0.00 0.00 54.97 54.09 1ixo s GLU 153 Cb -0.07 -2.40 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 1ixo s GLU 153 CO -0.03 -0.48 1.20 0.42 -0.54 0.00 0.00 175.26 175.84 1ixo s ILE 154 N 1.43 4.28 -0.06 -3.70 1.01 0.12 -1.71 121.20 122.57 1ixo s ILE 154 Ca -0.02 1.59 -0.29 0.00 0.00 0.00 0.00 60.65 61.93 1ixo s ILE 154 Cb -0.17 -4.03 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 1ixo s ILE 154 CO -0.07 -0.03 2.00 -2.28 0.00 0.00 0.00 174.94 174.56 1ixo s HIS 155 N 2.47 1.34 -2.13 3.97 5.65 0.42 -3.06 115.29 123.95 1ixo s HIS 155 Ca 0.55 -0.06 0.23 0.00 0.25 0.00 0.00 55.06 56.03 1ixo s HIS 155 Cb -0.24 -4.12 0.60 0.00 -1.18 0.00 0.00 32.58 27.64 1ixo s HIS 155 CO 0.20 -4.86 1.51 0.25 -0.65 0.00 0.00 174.74 171.19 1ixo n THR 156 N 6.28 0.86 0.02 0.89 -2.24 -1.16 -4.56 114.28 114.37 1ixo n THR 156 Ca 0.23 -0.92 -0.10 0.00 -2.27 0.00 0.00 64.05 60.98 1ixo n THR 156 Cb 0.43 0.62 -0.04 0.00 -2.10 0.00 0.00 70.33 69.24 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 4.43 -0.14 2.00 3.38 0.00 -1.76 -0.48 103.07 110.50 1ixo h GLY 157 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 1ixo h GLY 157 CO 0.00 -0.16 -0.19 0.00 0.00 0.00 0.00 176.54 176.19 1ixo h TYR 159 N 0.00 0.76 -0.25 0.00 5.03 -1.76 -2.50 116.97 118.26 1ixo h TYR 159 Ca -0.00 -0.32 -0.02 0.00 2.58 0.00 0.00 58.73 60.97 1ixo h TYR 159 Cb 0.43 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 38.58 1ixo h TYR 159 CO 0.00 1.10 0.09 0.00 -1.32 0.00 0.00 178.16 178.03 1ixo h ALA 160 N 0.52 0.32 0.00 1.82 0.00 -0.40 -2.92 119.26 118.59 1ixo h ALA 160 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ixo h ALA 160 Cb 1.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ixo h ALA 160 CO 0.11 -0.08 0.00 -0.25 0.00 0.00 0.00 179.25 179.03 1ixo n ASP 161 N -4.78 0.00 -4.24 0.00 8.00 0.34 -4.90 116.55 110.98 1ixo n ASP 161 Ca -0.03 -0.11 -0.51 0.00 0.71 0.00 0.00 54.79 54.85 1ixo n ASP 161 Cb 0.13 -0.26 -0.05 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.26 -3.17 0.34 2.24 0.00 -0.94 -4.86 120.51 112.86 1ixo n ALA 162 Ca 0.12 0.50 0.11 0.00 0.00 0.00 0.00 53.44 54.17 1ixo n ALA 162 Cb 0.18 -1.61 -0.04 0.00 0.00 0.00 0.00 19.45 17.99 1ixo n ALA 162 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ixo n LYS 163 N 1.20 0.44 -4.29 0.00 4.01 -1.26 -4.90 118.16 113.35 1ixo n LYS 163 Ca 0.18 -0.02 -0.15 0.00 -0.51 0.00 0.00 58.31 57.80 1ixo n LYS 163 Cb 0.15 -1.62 -0.10 0.00 -0.51 0.00 0.00 35.03 32.95 1ixo n LYS 163 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1ixo s THR 164 N -3.31 0.48 0.34 -0.18 -4.23 -1.26 -5.05 115.64 102.44 1ixo s THR 164 Ca 0.00 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.62 1ixo s THR 164 Cb 0.13 -2.57 0.07 0.00 1.34 0.00 0.00 72.50 71.48 1ixo s THR 164 CO 0.83 -0.05 1.77 0.44 -0.54 0.00 0.00 174.62 177.08 1ixo h ASP 165 N 2.45 0.09 -0.12 3.99 5.19 -1.99 -1.93 116.42 124.10 1ixo h ASP 165 Ca -0.38 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 55.97 1ixo h ASP 165 Cb 1.24 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.73 1ixo h ASP 165 CO 0.60 0.48 -0.05 0.00 -3.12 0.00 0.00 179.24 177.14 1ixo h ALA 166 N 1.53 0.16 -0.89 3.45 0.00 -1.99 -0.53 119.26 121.00 1ixo h ALA 166 Ca 0.01 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1ixo h ALA 166 Cb 0.73 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 1ixo h ALA 166 CO 0.05 -0.06 0.58 1.49 0.00 0.00 0.00 179.25 181.31 1ixo h GLU 167 N -0.10 1.10 -0.16 0.00 4.81 -1.93 -0.58 114.58 117.72 1ixo h GLU 167 Ca 0.03 -0.07 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1ixo h GLU 167 Cb 0.50 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 1ixo h GLU 167 CO 0.02 0.73 -0.15 0.37 -0.73 0.00 0.00 179.01 179.24 1ixo h GLN 168 N 1.13 0.38 -0.33 1.92 4.15 -1.17 -1.43 115.11 119.78 1ixo h GLN 168 Ca 0.35 -0.20 -0.07 0.00 0.77 0.00 0.00 58.65 59.50 1ixo h GLN 168 Cb -0.02 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1ixo h GLN 168 CO -0.10 0.76 -0.08 0.00 -1.93 0.00 0.00 178.83 177.48 1ixo h ALA 169 N 0.62 1.26 -0.31 3.38 0.00 -0.81 0.17 119.26 123.57 1ixo h ALA 169 Ca 0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1ixo h ALA 169 Cb 0.68 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ixo h ALA 169 CO 0.04 0.49 -0.02 0.37 0.00 0.00 0.00 179.25 180.13 1ixo h GLN 170 N 0.50 0.56 -0.25 0.00 4.15 -1.07 -1.63 115.11 117.38 1ixo h GLN 170 Ca 0.10 -0.19 -0.09 0.00 0.77 0.00 0.00 58.65 59.24 1ixo h GLN 170 Cb 0.45 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 1ixo h GLN 170 CO 0.02 0.71 -0.23 0.93 -1.93 0.00 0.00 178.83 178.33 1ixo h GLU 171 N 0.35 0.46 -0.12 1.69 4.39 -0.80 -1.64 114.58 118.91 1ixo h GLU 171 Ca 0.09 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 1ixo h GLU 171 Cb 0.47 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 1ixo h GLU 171 CO 0.02 0.67 0.05 1.25 -1.16 0.00 0.00 179.01 179.83 1ixo h LEU 172 N 0.41 0.18 -0.85 1.33 6.46 -0.49 -1.51 115.31 120.84 1ixo h LEU 172 Ca 0.06 -0.18 -0.05 0.00 -0.12 0.00 0.00 57.88 57.60 1ixo h LEU 172 Cb 0.63 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.48 1ixo h LEU 172 CO 0.05 0.30 0.29 0.00 -0.62 0.00 0.00 178.44 178.46 1ixo h ALA 173 N 0.88 1.08 -0.76 1.25 0.00 -1.12 0.20 119.26 120.78 1ixo h ALA 173 Ca 0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1ixo h ALA 173 Cb 0.19 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1ixo h ALA 173 CO -0.00 0.65 0.39 -0.09 0.00 0.00 0.00 179.25 180.20 1ixo h ARG 174 N 1.10 1.08 0.08 0.00 2.43 -1.13 0.11 114.38 118.05 1ixo h ARG 174 Ca 0.25 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1ixo h ARG 174 Cb 0.23 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 1ixo h ARG 174 CO -0.02 0.83 -0.04 0.82 -1.51 0.00 0.00 179.97 180.05 1ixo h ILE 175 N 1.07 1.15 -0.26 1.20 2.04 -0.64 -0.74 117.51 121.33 1ixo h ILE 175 Ca 0.27 -0.89 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1ixo h ILE 175 Cb 0.08 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1ixo h ILE 175 CO -0.04 0.22 0.07 0.00 0.00 0.00 0.00 178.15 178.40 1ixo h ALA 176 N 0.35 0.28 -0.91 1.87 0.00 -0.53 -0.28 119.26 120.04 1ixo h ALA 176 Ca -0.01 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ixo h ALA 176 Cb 0.44 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1ixo h ALA 176 CO 0.02 -0.34 0.60 -0.22 0.00 0.00 0.00 179.25 179.31 1ixo h LYS 177 N 0.18 1.19 -0.60 0.00 3.64 -1.01 -1.88 116.57 118.09 1ixo h LYS 177 Ca 0.11 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1ixo h LYS 177 Cb 0.10 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 31.62 1ixo h LYS 177 CO -0.13 0.79 0.27 0.00 -2.27 0.00 0.00 179.45 178.10 1ixo h ALA 178 N 1.34 0.77 -0.67 5.00 0.00 -0.38 -2.21 119.26 123.11 1ixo h ALA 178 Ca 0.34 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1ixo h ALA 178 Cb -0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1ixo h ALA 178 CO -0.08 0.36 0.32 0.00 0.00 0.00 0.00 179.25 179.85 1ixo h ALA 179 N 1.11 0.87 -0.38 0.00 0.00 -0.58 -0.27 119.26 120.00 1ixo h ALA 179 Ca 0.20 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ixo h ALA 179 Cb 0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1ixo h ALA 179 CO -0.02 0.43 0.14 1.15 0.00 0.00 0.00 179.25 180.95 1ixo h THR 180 N 0.93 1.20 -0.43 0.00 2.02 -1.16 -0.65 112.91 114.82 1ixo h THR 180 Ca 0.23 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1ixo h THR 180 Cb 0.12 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1ixo h THR 180 CO -0.03 0.23 0.21 0.15 0.37 0.00 0.00 175.52 176.45 1ixo h PHE 181 N 0.47 0.61 -0.04 3.16 3.57 -1.18 -1.60 116.94 121.93 1ixo h PHE 181 Ca 0.13 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1ixo h PHE 181 Cb 0.21 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 1ixo h PHE 181 CO 0.00 0.49 0.02 0.00 -2.23 0.00 0.00 178.31 176.60 1ixo h ALA 182 N 1.06 0.05 -0.91 2.41 0.00 -0.88 -2.38 119.26 118.62 1ixo h ALA 182 Ca 0.15 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.14 1ixo h ALA 182 Cb 0.10 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.79 1ixo h ALA 182 CO -0.02 -0.40 0.52 0.00 0.00 0.00 0.00 179.25 179.35 1ixo h ALA 183 N 0.93 1.37 0.00 0.00 0.00 -0.98 -0.07 119.26 120.52 1ixo h ALA 183 Ca 0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ixo h ALA 183 Cb 0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ixo h ALA 183 CO -0.00 0.05 -0.07 0.66 0.00 0.00 0.00 179.25 179.89 1ixo h SER 184 N 0.79 0.00 -0.18 0.00 4.64 -0.79 0.29 113.55 118.31 1ixo h SER 184 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1ixo h SER 184 Cb 0.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 1ixo h SER 184 CO -0.31 0.07 0.00 0.18 -0.87 0.00 0.00 176.83 175.90 1ixo n LEU 185 N -4.07 1.08 0.00 5.97 7.99 -0.09 -4.89 117.00 122.99 1ixo n LEU 185 Ca -0.03 -0.51 0.00 0.00 -0.01 0.00 0.00 56.01 55.46 1ixo n LEU 185 Cb 0.16 -0.12 0.00 0.00 -0.11 0.00 0.00 43.42 43.35 1ixo n LEU 185 CO 0.32 0.26 0.00 0.61 -1.51 0.00 0.00 177.39 177.06 1ixo n GLY 186 N 0.88 0.68 3.84 -0.72 0.00 0.10 -4.98 105.19 104.99 1ixo n GLY 186 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 3.75 -0.10 0.99 1.43 -0.88 -4.98 118.68 118.89 1ixo s LEU 187 Ca 0.00 1.55 -0.08 0.00 -1.03 0.00 0.00 54.13 54.57 1ixo s LEU 187 Cb 0.00 -4.45 -0.04 0.00 0.03 0.00 0.00 46.19 41.72 1ixo s LEU 187 CO 0.00 -0.49 0.18 -0.54 0.23 0.00 0.00 176.35 175.73 1ixo s LYS 188 N -3.75 3.53 -0.07 1.70 1.02 -0.50 -4.03 119.74 117.63 1ixo s LYS 188 Ca 0.59 -0.05 0.04 0.00 0.02 0.00 0.00 55.97 56.57 1ixo s LYS 188 Cb -0.10 -3.20 -0.00 0.00 -0.52 0.00 0.00 37.83 34.01 1ixo s LYS 188 CO 0.25 0.76 -0.20 0.54 -0.92 0.00 0.00 175.35 175.78 1ixo s VAL 189 N -1.02 1.71 0.44 3.17 0.11 -1.26 -1.90 120.40 121.65 1ixo s VAL 189 Ca 0.16 -0.85 0.07 0.00 -2.93 0.00 0.00 61.98 58.43 1ixo s VAL 189 Cb -0.13 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.20 1ixo s VAL 189 CO 0.05 0.48 0.19 0.20 -3.33 0.00 0.00 175.10 172.69 1ixo s ASN 190 N 0.21 4.40 0.10 3.54 0.01 0.14 0.94 114.94 124.28 1ixo s ASN 190 Ca -0.11 -1.16 -0.13 0.00 -0.71 0.00 0.00 52.86 50.75 1ixo s ASN 190 Cb -0.15 -0.29 0.02 0.00 0.41 0.00 0.00 41.25 41.24 1ixo s ASN 190 CO 0.05 -0.63 0.32 0.00 -1.51 0.00 0.00 177.10 175.33 1ixo s ALA 191 N -2.65 -0.68 0.00 0.60 0.00 -0.89 0.16 121.76 118.30 1ixo s ALA 191 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1ixo s ALA 191 Cb 0.03 0.56 0.00 0.00 0.00 0.00 0.00 23.12 23.71 1ixo s ALA 191 CO 0.21 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.82 1ixo n GLY 192 N -0.03 2.57 0.00 0.00 0.00 -1.17 -0.83 105.19 105.73 1ixo n GLY 192 Ca -0.16 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1ixo n GLY 192 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ixo n HIS 193 N -0.73 0.00 -0.47 1.61 8.25 -1.23 -2.97 115.22 119.67 1ixo n HIS 193 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ixo n HIS 193 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1ixo n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ixo n GLY 194 N 0.89 1.56 3.75 -1.41 0.00 -1.26 -2.70 105.19 106.01 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 0.37 0.99 1.43 -1.26 -4.82 118.68 119.74 1ixo s LEU 195 Ca 0.00 2.87 0.04 0.00 -1.03 0.00 0.00 54.13 56.01 1ixo s LEU 195 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 1ixo s LEU 195 CO 0.00 -0.87 0.11 0.42 0.23 0.00 0.00 176.35 176.24 1ixo s THR 196 N 0.13 0.71 0.46 5.49 -4.23 -1.26 -4.42 115.64 112.52 1ixo s THR 196 Ca 0.64 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.28 1ixo s THR 196 Cb -0.47 -2.49 0.23 0.00 1.34 0.00 0.00 72.50 71.11 1ixo s THR 196 CO 0.45 0.00 2.06 1.88 -0.54 0.00 0.00 174.62 178.47 1ixo h TYR 197 N 1.95 0.12 -0.02 3.99 -1.99 -1.94 -0.88 116.97 118.21 1ixo h TYR 197 Ca -0.37 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.36 1ixo h TYR 197 Cb 1.26 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.95 1ixo h TYR 197 CO 1.16 0.16 -0.22 0.72 -0.00 0.00 0.00 178.16 179.98 1ixo n HIS 198 N -4.43 0.00 -0.25 4.88 8.25 -1.26 -4.39 115.22 118.02 1ixo n HIS 198 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1ixo n HIS 198 Cb 0.16 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1ixo n HIS 198 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1ixo n ASN 199 N 0.22 0.43 -0.15 0.41 2.04 -1.01 -4.83 115.26 112.37 1ixo n ASN 199 Ca 0.13 -0.78 -0.09 0.00 -0.44 0.00 0.00 54.58 53.40 1ixo n ASN 199 Cb 0.45 0.20 0.06 0.00 -2.53 0.00 0.00 39.78 37.96 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 0.25 1.27 -0.51 3.53 3.04 -1.37 -3.32 116.25 119.13 1ixo h VAL 200 Ca 0.00 -1.25 0.08 0.00 -1.01 0.00 0.00 66.70 64.53 1ixo h VAL 200 Cb 0.12 1.01 -0.07 0.00 -2.01 0.00 0.00 31.29 30.34 1ixo h VAL 200 CO 0.00 0.43 0.13 0.11 -1.01 0.00 0.00 177.57 177.23 1ixo h LYS 201 N 0.83 0.27 -0.07 4.17 1.57 -1.86 0.16 116.57 121.64 1ixo h LYS 201 Ca 0.13 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1ixo h LYS 201 Cb 0.66 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1ixo h LYS 201 CO 0.05 0.18 -0.00 0.00 -0.57 0.00 0.00 179.45 179.10 1ixo h ALA 202 N 1.38 1.87 0.22 3.86 0.00 -1.94 0.29 119.26 124.95 1ixo h ALA 202 Ca 0.26 -0.05 -0.33 0.00 0.00 0.00 0.00 54.91 54.79 1ixo h ALA 202 Cb 0.33 -0.03 0.04 0.00 0.00 0.00 0.00 17.79 18.12 1ixo h ALA 202 CO -0.31 0.10 -1.43 0.82 0.00 0.00 0.00 179.25 178.44 1ixo h ILE 203 N 0.09 1.29 0.00 0.00 1.08 -1.44 -3.22 117.51 115.32 1ixo h ILE 203 Ca 0.02 -2.67 -0.04 0.00 -0.39 0.00 0.00 64.86 61.79 1ixo h ILE 203 Cb 0.08 2.97 -0.01 0.00 -3.07 0.00 0.00 36.82 36.79 1ixo h ILE 203 CO 0.00 0.80 -0.17 0.00 -0.69 0.00 0.00 178.15 178.09 1ixo h ALA 204 N 0.20 1.13 0.00 1.87 0.00 0.17 -2.44 119.26 120.20 1ixo h ALA 204 Ca -0.24 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1ixo h ALA 204 Cb 2.12 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.87 1ixo h ALA 204 CO 0.27 0.21 -0.19 0.00 0.00 0.00 0.00 179.25 179.54 1ixo h ALA 205 N 1.83 1.25 -2.11 0.00 0.00 -0.46 -3.42 119.26 116.36 1ixo h ALA 205 Ca -0.00 -0.17 -0.56 0.00 0.00 0.00 0.00 54.91 54.18 1ixo h ALA 205 Cb 0.54 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ixo h ALA 205 CO 0.02 0.23 1.30 0.42 0.00 0.00 0.00 179.25 181.22 1ixo s ILE 206 N -4.09 3.23 0.27 0.00 1.01 -0.92 -4.89 121.20 115.82 1ixo s ILE 206 Ca -0.02 0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.88 1ixo s ILE 206 Cb 0.13 -3.24 0.25 0.00 0.01 0.00 0.00 42.46 39.61 1ixo s ILE 206 CO 0.62 -0.11 1.82 -0.65 0.00 0.00 0.00 174.94 176.62 1ixo h PRO 207 N 12.33 0.84 0.00 2.79 0.11 -1.89 -2.54 132.00 143.64 1ixo h PRO 207 Ca -0.41 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1ixo h PRO 207 Cb 1.21 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1ixo h PRO 207 CO 0.97 0.56 -0.11 0.93 -0.21 0.00 0.00 178.00 180.13 1ixo h GLU 208 N 0.87 0.00 -6.50 1.05 3.07 -1.91 -3.44 114.58 107.72 1ixo h GLU 208 Ca 0.46 0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.75 1ixo h GLU 208 Cb 0.48 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 28.44 1ixo h GLU 208 CO -0.27 0.11 0.89 -1.33 -1.40 0.00 0.00 179.01 177.01 1ixo n MET 209 N -3.64 2.29 -0.10 2.33 2.81 -0.96 -4.33 117.12 115.53 1ixo n MET 209 Ca -0.02 0.83 -0.22 0.00 -1.81 0.00 0.00 57.70 56.48 1ixo n MET 209 Cb 0.24 -2.63 -0.12 0.00 -0.71 0.00 0.00 33.22 30.00 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 4.05 0.42 -3.67 2.03 -0.00 0.27 -4.84 115.22 113.47 1ixo n HIS 210 Ca 0.18 0.12 -0.14 0.00 0.46 0.00 0.00 57.72 58.33 1ixo n HIS 210 Cb 0.30 -1.05 -0.08 0.00 -0.12 0.00 0.00 29.99 29.04 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 -2.51 0.70 -0.16 1.57 2.12 -1.25 -1.85 118.70 117.32 1ixo s GLU 211 Ca -0.32 0.60 -0.05 0.00 0.36 0.00 0.00 54.97 55.56 1ixo s GLU 211 Cb 0.10 0.34 -0.03 0.00 0.26 0.00 0.00 34.13 34.79 1ixo s GLU 211 CO 0.61 -0.12 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.69 1ixo s LEU 212 N -0.07 3.40 -0.28 2.70 1.43 -0.24 -2.11 118.68 123.51 1ixo s LEU 212 Ca -0.03 -0.07 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 1ixo s LEU 212 Cb -0.03 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1ixo s LEU 212 CO 0.02 0.17 0.13 0.20 0.23 0.00 0.00 176.35 177.11 1ixo s ASN 213 N 0.37 5.53 -0.03 2.29 0.01 -0.01 -0.62 114.94 122.47 1ixo s ASN 213 Ca -0.02 -0.26 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 1ixo s ASN 213 Cb -0.14 -2.01 -0.00 0.00 0.41 0.00 0.00 41.25 39.52 1ixo s ASN 213 CO 0.02 -0.10 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.77 1ixo s ILE 214 N 1.66 1.01 0.00 0.60 1.01 -0.11 -3.57 121.20 121.78 1ixo s ILE 214 Ca 0.06 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.21 1ixo s ILE 214 Cb -0.16 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.44 1ixo s ILE 214 CO 0.07 0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.92 1ixo n GLY 215 N 3.14 0.33 0.36 6.18 0.00 -1.26 -0.40 105.19 113.54 1ixo n GLY 215 Ca -0.17 0.00 0.01 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 -0.81 -0.93 1.61 -0.00 -1.92 -0.02 115.15 113.08 1ixo h HIS 216 Ca 0.00 0.09 0.08 0.00 -0.00 0.00 0.00 60.37 60.54 1ixo h HIS 216 Cb 0.00 0.49 -0.07 0.00 -0.00 0.00 0.00 27.41 27.83 1ixo h HIS 216 CO 0.00 -0.40 0.58 0.00 -0.00 0.00 0.00 177.93 178.12 1ixo h ALA 217 N 1.56 1.32 0.12 5.26 0.00 -1.93 0.10 119.26 125.69 1ixo h ALA 217 Ca 0.37 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1ixo h ALA 217 Cb 0.62 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ixo h ALA 217 CO -0.93 0.30 -0.06 0.82 0.00 0.00 0.00 179.25 179.39 1ixo h ILE 218 N 1.03 0.99 -0.77 0.00 2.04 -1.34 -1.98 117.51 117.48 1ixo h ILE 218 Ca 0.42 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1ixo h ILE 218 Cb 0.25 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 1ixo h ILE 218 CO -0.20 0.11 0.42 0.40 0.00 0.00 0.00 178.15 178.88 1ixo h ILE 219 N -0.38 1.23 0.00 -0.67 1.08 -1.02 -0.03 117.51 117.72 1ixo h ILE 219 Ca -0.02 -0.57 -0.03 0.00 -0.39 0.00 0.00 64.86 63.86 1ixo h ILE 219 Cb 0.31 0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.24 1ixo h ILE 219 CO 0.03 0.26 -0.13 1.23 -0.69 0.00 0.00 178.15 178.84 1ixo h GLY 220 N 1.11 0.00 1.20 5.37 0.00 -0.61 -2.23 103.07 107.92 1ixo h GLY 220 Ca 0.27 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.29 1ixo h GLY 220 CO -0.04 0.00 -1.55 -0.09 0.00 0.00 0.00 176.54 174.85 1ixo h ARG 221 N 0.00 0.31 -0.86 4.80 9.65 -0.57 -3.36 114.38 124.36 1ixo h ARG 221 Ca -0.00 -0.53 0.08 0.00 -1.10 0.00 0.00 59.98 58.42 1ixo h ARG 221 Cb 0.25 0.20 -0.07 0.00 -1.39 0.00 0.00 29.97 28.96 1ixo h ARG 221 CO 0.02 1.20 0.52 0.00 2.80 0.00 0.00 179.97 184.51 1ixo h ALA 222 N 0.38 1.21 -0.43 2.80 0.00 -0.44 0.11 119.26 122.89 1ixo h ALA 222 Ca -0.26 0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.77 1ixo h ALA 222 Cb 2.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 1ixo h ALA 222 CO 0.18 0.21 0.30 -0.39 0.00 0.00 0.00 179.25 179.55 1ixo h VAL 223 N 0.91 0.83 0.15 0.00 -1.51 -1.60 1.01 116.25 116.04 1ixo h VAL 223 Ca 0.39 -0.03 -0.36 0.00 -1.23 0.00 0.00 66.70 65.47 1ixo h VAL 223 Cb 0.26 0.72 -0.01 0.00 -2.13 0.00 0.00 31.29 30.14 1ixo h VAL 223 CO -0.21 0.02 -1.90 0.24 -1.23 0.00 0.00 177.57 174.49 1ixo h MET 224 N 0.10 0.31 0.00 5.19 2.07 -1.28 -3.42 114.93 117.90 1ixo h MET 224 Ca 0.20 -0.54 0.00 0.00 -2.07 0.00 0.00 59.70 57.29 1ixo h MET 224 Cb 0.68 0.20 0.00 0.00 -1.87 0.00 0.00 31.60 30.61 1ixo h MET 224 CO -0.02 1.26 -0.83 -2.37 1.07 0.00 0.00 176.91 176.02 1ixo n THR 225 N -3.53 0.00 0.00 2.22 5.66 0.23 -5.11 114.28 113.74 1ixo n THR 225 Ca -0.29 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.45 1ixo n THR 225 Cb 1.06 0.68 0.00 0.00 -1.55 0.00 0.00 70.33 70.52 1ixo n THR 225 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ixo n GLY 226 N 1.59 2.07 0.16 1.09 0.00 0.34 -4.63 105.19 105.81 1ixo n GLY 226 Ca 0.00 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.35 -0.53 0.99 6.46 -1.92 -2.23 115.31 117.73 1ixo h LEU 227 Ca 0.00 0.09 0.09 0.00 -0.12 0.00 0.00 57.88 57.93 1ixo h LEU 227 Cb 0.00 0.20 -0.10 0.00 -0.73 0.00 0.00 40.66 40.02 1ixo h LEU 227 CO 0.00 -0.13 -0.40 0.50 -0.62 0.00 0.00 178.44 177.78 1ixo h LYS 228 N -0.07 -0.23 -0.35 1.25 3.64 -1.89 0.87 116.57 119.79 1ixo h LYS 228 Ca 0.12 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.41 1ixo h LYS 228 Cb 0.25 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1ixo h LYS 228 CO -0.28 -0.15 -0.24 -0.44 -2.27 0.00 0.00 179.45 176.07 1ixo h ASP 229 N -0.24 0.70 -0.97 4.20 3.32 -1.79 -1.29 116.42 120.34 1ixo h ASP 229 Ca 0.18 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 57.02 1ixo h ASP 229 Cb 0.56 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.87 1ixo h ASP 229 CO -0.65 0.92 0.63 0.00 -1.72 0.00 0.00 179.24 178.42 1ixo h ALA 230 N 1.14 1.29 -0.05 3.45 0.00 -0.61 0.10 119.26 124.58 1ixo h ALA 230 Ca 0.08 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1ixo h ALA 230 Cb 0.73 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ixo h ALA 230 CO 0.06 0.51 -0.52 0.28 0.00 0.00 0.00 179.25 179.58 1ixo h VAL 231 N 1.22 1.41 -0.53 0.00 2.07 -0.57 -2.86 116.25 116.98 1ixo h VAL 231 Ca 0.39 -1.93 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 1ixo h VAL 231 Cb 0.02 2.41 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 1ixo h VAL 231 CO -0.13 0.57 0.26 0.00 0.02 0.00 0.00 177.57 178.29 1ixo h ALA 232 N 0.39 1.47 -0.18 1.67 0.00 -0.88 -0.94 119.26 120.79 1ixo h ALA 232 Ca -0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ixo h ALA 232 Cb 1.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1ixo h ALA 232 CO 0.10 0.43 0.03 0.93 0.00 0.00 0.00 179.25 180.75 1ixo h GLU 233 N 0.74 0.29 -0.15 0.00 4.39 -0.83 -1.56 114.58 117.46 1ixo h GLU 233 Ca 0.19 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1ixo h GLU 233 Cb 0.06 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1ixo h GLU 233 CO -0.03 0.44 0.09 1.98 -1.16 0.00 0.00 179.01 180.34 1ixo h MET 234 N 0.09 0.20 -0.89 2.33 4.05 -1.21 -1.94 114.93 117.56 1ixo h MET 234 Ca 0.05 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.50 1ixo h MET 234 Cb 0.29 -0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 30.99 1ixo h MET 234 CO 0.00 0.16 0.57 -0.22 0.23 0.00 0.00 176.91 177.65 1ixo h LYS 235 N 0.18 1.04 -0.46 0.39 1.63 -1.11 -1.20 116.57 117.03 1ixo h LYS 235 Ca 0.05 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1ixo h LYS 235 Cb 0.01 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 31.39 1ixo h LYS 235 CO -0.01 0.69 0.27 -0.09 -3.45 0.00 0.00 179.45 176.86 1ixo h ARG 236 N 1.07 0.63 -0.63 1.90 2.43 -1.04 -0.77 114.38 117.97 1ixo h ARG 236 Ca 0.37 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.42 1ixo h ARG 236 Cb 0.08 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1ixo h ARG 236 CO -0.14 0.47 0.17 -0.07 -1.51 0.00 0.00 179.97 178.89 1ixo h LEU 237 N 0.61 0.94 -0.22 3.80 3.38 -0.91 -0.32 115.31 122.59 1ixo h LEU 237 Ca 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1ixo h LEU 237 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1ixo h LEU 237 CO -0.03 0.92 0.10 0.24 0.09 0.00 0.00 178.44 179.76 1ixo h MET 238 N 0.92 0.32 -0.02 1.13 2.86 -0.88 -1.47 114.93 117.79 1ixo h MET 238 Ca 0.20 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.69 1ixo h MET 238 Cb 0.33 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 1ixo h MET 238 CO -0.00 0.36 -0.45 -0.07 1.06 0.00 0.00 176.91 177.80 1ixo h LEU 239 N 0.22 0.06 -0.36 1.22 3.38 -1.02 -2.88 115.31 115.93 1ixo h LEU 239 Ca 0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1ixo h LEU 239 Cb 0.14 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1ixo h LEU 239 CO -0.01 0.50 0.19 -0.33 0.09 0.00 0.00 178.44 178.88 1ixo h GLU 240 N 0.05 0.51 -0.80 1.13 5.08 -0.72 -2.23 114.58 117.60 1ixo h GLU 240 Ca 0.00 -0.07 0.12 0.00 -1.00 0.00 0.00 59.36 58.42 1ixo h GLU 240 Cb 0.82 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.92 1ixo h GLU 240 CO 0.06 0.44 0.52 0.00 -1.00 0.00 0.00 179.01 179.03 1ixo h ALA 241 N 1.04 1.88 -0.00 3.43 0.00 -1.06 0.22 119.26 124.77 1ixo h ALA 241 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ixo h ALA 241 Cb 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ixo h ALA 241 CO -0.02 -0.08 -0.21 0.54 0.00 0.00 0.00 179.25 179.49 1ixo n ARG 242 N -4.51 0.13 0.00 0.00 5.12 -1.01 -4.54 116.66 111.85 1ixo n ARG 242 Ca 0.14 -0.04 0.13 0.00 -1.93 0.00 0.00 57.85 56.14 1ixo n ARG 242 Cb 0.42 -1.50 0.22 0.00 -1.16 0.00 0.00 32.46 30.43 1ixo n ARG 242 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11