#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmg n LEU 4 N 0.00 2.51 0.00 3.14 4.32 -1.26 -0.32 117.00 125.39 1xmg n LEU 4 Ca 0.00 -4.36 -0.26 0.00 -0.02 0.00 0.00 56.01 51.37 1xmg n LEU 4 Cb 0.00 0.14 0.18 0.00 -1.62 0.00 0.00 43.42 42.12 1xmg n LEU 4 CO 0.00 1.86 0.78 0.61 -1.22 0.00 0.00 177.39 179.42 1xmg n GLY 5 N -0.17 -1.29 0.12 -0.72 0.00 -0.72 -4.94 105.19 97.47 1xmg n GLY 5 Ca 0.20 -1.73 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 1xmg n GLY 5 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1xmg h ILE 6 N -1.61 0.96 0.00 -0.61 2.04 -1.99 -3.37 117.51 112.93 1xmg h ILE 6 Ca -0.38 -1.15 0.00 0.00 1.00 0.00 0.00 64.86 64.32 1xmg h ILE 6 Cb 1.08 1.59 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1xmg h ILE 6 CO 0.28 0.24 -0.95 1.41 0.00 0.00 0.00 178.15 179.13 1xmg n HIS 7 N -4.91 0.16 -3.64 1.37 8.25 -1.26 -4.85 115.22 110.35 1xmg n HIS 7 Ca -0.08 0.05 -0.15 0.00 -0.26 0.00 0.00 57.72 57.28 1xmg n HIS 7 Cb 0.27 -0.33 -0.14 0.00 1.12 0.00 0.00 29.99 30.92 1xmg n HIS 7 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1xmg s SER 8 N -3.61 0.60 0.38 0.41 0.15 -1.26 -5.08 113.70 105.29 1xmg s SER 8 Ca 0.06 0.41 -0.09 0.00 0.70 0.00 0.00 55.95 57.03 1xmg s SER 8 Cb 0.15 0.53 0.03 0.00 -1.71 0.00 0.00 66.02 65.02 1xmg s SER 8 CO 0.80 -0.25 0.66 0.54 1.20 0.00 0.00 173.24 176.18 1xmg s ASN 9 N 2.37 0.49 0.29 5.45 2.20 -1.26 -1.75 114.94 122.73 1xmg s ASN 9 Ca 0.03 -1.35 0.06 0.00 -0.94 0.00 0.00 52.86 50.65 1xmg s ASN 9 Cb -0.12 0.78 0.44 0.00 -2.00 0.00 0.00 41.25 40.35 1xmg s ASN 9 CO -0.08 -1.55 1.70 0.44 -2.94 0.00 0.00 177.10 174.67 1xmg h ASP 10 N 2.03 0.29 -0.07 3.54 3.32 -1.04 -2.44 116.42 122.06 1xmg h ASP 10 Ca -0.31 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 56.62 1xmg h ASP 10 Cb 1.24 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.71 1xmg h ASP 10 CO 0.40 0.66 0.03 0.74 -1.72 0.00 0.00 179.24 179.36 1xmg h THR 11 N 0.24 1.12 -0.70 0.35 2.02 -1.98 -1.42 112.91 112.55 1xmg h THR 11 Ca 0.02 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1xmg h THR 11 Cb 0.80 1.25 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 1xmg h THR 11 CO 0.06 0.11 0.41 0.03 0.37 0.00 0.00 175.52 176.50 1xmg h ARG 12 N -0.03 0.95 -0.52 6.66 3.08 -1.95 -2.05 114.38 120.52 1xmg h ARG 12 Ca 0.02 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1xmg h ARG 12 Cb 0.14 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1xmg h ARG 12 CO -0.00 0.68 0.31 -0.44 -1.07 0.00 0.00 179.97 179.45 1xmg h ASP 13 N 0.95 0.63 -0.84 7.04 3.32 -1.29 -1.33 116.42 124.90 1xmg h ASP 13 Ca 0.25 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 57.27 1xmg h ASP 13 Cb -0.01 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.33 1xmg h ASP 13 CO -0.05 0.51 0.55 0.00 -1.72 0.00 0.00 179.24 178.53 1xmg h ALA 14 N 1.15 1.47 -0.00 3.45 0.00 -0.88 -1.29 119.26 123.16 1xmg h ALA 14 Ca 0.19 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1xmg h ALA 14 Cb -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1xmg h ALA 14 CO -0.03 0.45 -0.80 -1.49 0.00 0.00 0.00 179.25 177.38 1xmg h TRP 15 N 1.05 0.07 -0.68 0.00 4.06 -0.96 -1.69 115.95 117.79 1xmg h TRP 15 Ca 0.33 -0.04 -0.03 0.00 2.06 0.00 0.00 58.89 61.21 1xmg h TRP 15 Cb 0.01 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 28.13 1xmg h TRP 15 CO -0.00 0.83 0.30 0.28 -3.56 0.00 0.00 178.44 176.28 1xmg h VAL 16 N 0.03 1.24 -0.04 1.49 2.07 -0.34 0.15 116.25 120.85 1xmg h VAL 16 Ca -0.02 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1xmg h VAL 16 Cb 1.41 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 1xmg h VAL 16 CO 0.11 0.29 0.01 0.78 0.02 0.00 0.00 177.57 178.77 1xmg h ASN 17 N 0.96 0.06 -0.81 0.57 2.35 -1.15 0.35 115.58 117.91 1xmg h ASN 17 Ca 0.23 -0.25 0.12 0.00 -0.55 0.00 0.00 56.30 55.86 1xmg h ASN 17 Cb 0.17 -0.02 -0.08 0.00 0.05 0.00 0.00 38.32 38.44 1xmg h ASN 17 CO -0.02 0.29 0.42 0.50 -1.65 0.00 0.00 177.43 176.97 1xmg h LYS 18 N -0.17 0.63 -0.20 0.81 3.64 -0.98 -0.67 116.57 119.63 1xmg h LYS 18 Ca 0.01 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.23 1xmg h LYS 18 Cb 0.26 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1xmg h LYS 18 CO 0.00 0.42 -0.41 0.82 -2.27 0.00 0.00 179.45 178.00 1xmg h ILE 19 N 0.65 1.31 -0.01 2.00 2.04 -0.45 -2.69 117.51 120.36 1xmg h ILE 19 Ca 0.42 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.71 1xmg h ILE 19 Cb 0.53 1.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1xmg h ILE 19 CO -0.32 0.49 0.02 0.00 0.00 0.00 0.00 178.15 178.34 1xmg h ALA 20 N 1.18 1.27 -0.42 1.87 0.00 0.66 -1.78 119.26 122.04 1xmg h ALA 20 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xmg h ALA 20 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1xmg h ALA 20 CO 0.08 -0.03 0.00 1.04 0.00 0.00 0.00 179.25 180.34 1xmg n GLN 21 N -3.42 2.31 -3.08 0.00 1.13 -1.01 -4.68 117.38 108.62 1xmg n GLN 21 Ca -0.03 -1.99 -0.45 0.00 -1.94 0.00 0.00 57.00 52.59 1xmg n GLN 21 Cb 0.10 -1.47 -0.02 0.00 0.11 0.00 0.00 30.24 28.96 1xmg n GLN 21 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1xmg s LEU 22 N -1.33 5.65 -0.01 1.08 1.43 -0.67 -4.83 118.68 120.00 1xmg s LEU 22 Ca 0.38 -2.60 0.18 0.00 -1.03 0.00 0.00 54.13 51.06 1xmg s LEU 22 Cb 0.21 -2.33 0.52 0.00 0.03 0.00 0.00 46.19 44.63 1xmg s LEU 22 CO 0.29 -0.78 1.44 0.59 0.23 0.00 0.00 176.35 178.12 1xmg n ASN 23 N 5.23 3.20 -3.99 2.29 3.02 -1.26 -4.79 115.26 118.97 1xmg n ASN 23 Ca 0.24 -2.02 -0.18 0.00 -0.03 0.00 0.00 54.58 52.60 1xmg n ASN 23 Cb 0.46 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 39.08 1xmg n ASN 23 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xmg s THR 24 N -1.24 0.58 0.14 3.41 2.01 -1.26 -5.06 115.64 114.21 1xmg s THR 24 Ca 0.40 -0.30 -0.23 0.00 0.31 0.00 0.00 61.69 61.86 1xmg s THR 24 Cb 0.21 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 1xmg s THR 24 CO 0.26 0.17 1.64 0.25 -0.69 0.00 0.00 174.62 176.26 1xmg h LEU 25 N 6.04 -0.68 -0.46 4.42 5.85 -1.90 -0.20 115.31 128.38 1xmg h LEU 25 Ca -0.30 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.57 1xmg h LEU 25 Cb 1.18 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 42.48 1xmg h LEU 25 CO 0.50 -0.27 0.23 -0.08 -0.34 0.00 0.00 178.44 178.48 1xmg h GLU 26 N -0.28 0.45 -0.18 1.25 4.81 -1.97 0.26 114.58 118.92 1xmg h GLU 26 Ca 0.10 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1xmg h GLU 26 Cb 0.43 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1xmg h GLU 26 CO -0.29 0.30 0.07 -0.22 -0.73 0.00 0.00 179.01 178.13 1xmg h LYS 27 N 0.46 0.27 -0.11 1.92 3.64 -1.92 -1.35 116.57 119.47 1xmg h LYS 27 Ca 0.20 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1xmg h LYS 27 Cb 0.11 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1xmg h LYS 27 CO -0.14 0.35 0.05 0.00 -2.27 0.00 0.00 179.45 177.44 1xmg h ALA 28 N 0.90 0.14 -0.90 5.00 0.00 -0.66 -1.54 119.26 122.20 1xmg h ALA 28 Ca 0.06 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1xmg h ALA 28 Cb 0.19 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 1xmg h ALA 28 CO -0.00 -0.28 0.59 0.00 0.00 0.00 0.00 179.25 179.55 1xmg h ALA 29 N 0.91 1.18 -0.61 0.00 0.00 -0.49 -0.29 119.26 119.96 1xmg h ALA 29 Ca 0.04 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1xmg h ALA 29 Cb 0.14 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1xmg h ALA 29 CO -0.00 0.46 0.16 1.49 0.00 0.00 0.00 179.25 181.36 1xmg h GLU 30 N 1.15 0.96 -0.40 0.00 4.57 -1.02 -1.96 114.58 117.89 1xmg h GLU 30 Ca 0.35 -0.23 -0.08 0.00 -1.18 0.00 0.00 59.36 58.23 1xmg h GLU 30 Cb -0.03 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.42 1xmg h GLU 30 CO -0.11 0.88 -0.08 1.98 -1.18 0.00 0.00 179.01 180.49 1xmg h MET 31 N 0.88 0.69 -0.14 1.92 4.05 -0.63 -0.96 114.93 120.74 1xmg h MET 31 Ca 0.19 -0.21 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1xmg h MET 31 Cb 0.34 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 1xmg h MET 31 CO 0.00 0.76 0.04 1.25 0.23 0.00 0.00 176.91 179.19 1xmg h LEU 32 N 0.63 0.20 -0.74 3.39 5.85 -0.77 0.53 115.31 124.41 1xmg h LEU 32 Ca 0.12 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 1xmg h LEU 32 Cb 0.52 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1xmg h LEU 32 CO 0.03 0.35 0.29 0.50 -0.34 0.00 0.00 178.44 179.27 1xmg h LYS 33 N 0.04 1.11 -0.69 1.25 3.64 -1.22 -1.28 116.57 119.42 1xmg h LYS 33 Ca 0.04 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1xmg h LYS 33 Cb 0.23 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1xmg h LYS 33 CO -0.00 0.91 0.44 0.37 -2.27 0.00 0.00 179.45 178.90 1xmg h GLN 34 N 1.07 0.91 -0.43 1.90 5.75 -0.96 -2.04 115.11 121.31 1xmg h GLN 34 Ca 0.25 -0.06 0.03 0.00 -0.15 0.00 0.00 58.65 58.71 1xmg h GLN 34 Cb 0.22 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.54 1xmg h GLN 34 CO -0.02 0.62 0.22 0.35 -2.65 0.00 0.00 178.83 177.35 1xmg h PHE 35 N 0.93 0.41 -0.21 3.99 3.57 -0.25 -0.98 116.94 124.40 1xmg h PHE 35 Ca 0.25 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.73 1xmg h PHE 35 Cb -0.08 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1xmg h PHE 35 CO -0.02 0.22 -0.03 0.00 -2.23 0.00 0.00 178.31 176.25 1xmg h ARG 36 N 0.45 0.32 -0.19 1.11 3.08 -0.82 0.29 114.38 118.61 1xmg h ARG 36 Ca 0.18 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 60.02 1xmg h ARG 36 Cb 0.07 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1xmg h ARG 36 CO -0.12 0.37 -0.49 0.52 -1.07 0.00 0.00 179.97 179.18 1xmg h MET 37 N 0.31 0.66 -0.16 0.04 2.86 -0.78 -2.59 114.93 115.27 1xmg h MET 37 Ca 0.07 -0.46 -0.16 0.00 -2.06 0.00 0.00 59.70 57.09 1xmg h MET 37 Cb 0.26 0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1xmg h MET 37 CO 0.01 1.08 -0.51 -0.44 1.06 0.00 0.00 176.91 178.11 1xmg h ASP 38 N 0.35 0.73 -0.01 1.22 3.45 -0.71 -2.35 116.42 119.10 1xmg h ASP 38 Ca -0.01 -0.60 0.00 0.00 0.43 0.00 0.00 57.03 56.86 1xmg h ASP 38 Cb 1.10 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 39.66 1xmg h ASP 38 CO 0.11 1.20 0.00 1.41 -1.57 0.00 0.00 179.24 180.38 1xmg n HIS 39 N -4.17 0.00 -4.38 4.55 8.25 0.97 -1.71 115.22 118.74 1xmg n HIS 39 Ca -0.07 -0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.13 1xmg n HIS 39 Cb 0.60 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.61 1xmg n HIS 39 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1xmg s THR 40 N -0.34 2.78 0.36 1.59 -4.23 -0.98 -4.88 115.64 109.94 1xmg s THR 40 Ca 0.05 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1xmg s THR 40 Cb 0.03 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.48 1xmg s THR 40 CO 0.05 -0.20 0.00 0.35 -0.54 0.00 0.00 174.62 174.28 1xmg n THR 41 N -0.12 -0.45 0.00 3.99 -2.24 -1.26 -2.61 114.28 111.58 1xmg n THR 41 Ca -0.10 0.52 0.00 0.00 -2.27 0.00 0.00 64.05 62.20 1xmg n THR 41 Cb 0.57 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1xmg n THR 41 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1xmg n PRO 42 N -3.46 0.00 -0.36 -0.78 -0.02 -1.26 -0.91 135.00 128.22 1xmg n PRO 42 Ca -0.05 0.45 0.09 0.00 -2.02 0.00 0.00 63.50 61.97 1xmg n PRO 42 Cb 0.41 -1.53 0.27 0.00 -0.02 0.00 0.00 33.50 32.63 1xmg n PRO 42 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1xmg n PHE 43 N -1.45 0.90 -1.68 6.00 3.72 -1.26 -5.01 117.46 118.69 1xmg n PHE 43 Ca 0.00 -0.54 -0.39 0.00 -0.05 0.00 0.00 57.45 56.47 1xmg n PHE 43 Cb 0.03 -0.07 0.04 0.00 -0.94 0.00 0.00 39.48 38.54 1xmg n PHE 43 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1xmg n ARG 44 N 1.06 1.40 0.15 -1.08 1.85 -0.09 -4.84 116.66 115.10 1xmg n ARG 44 Ca 0.20 0.52 0.12 0.00 -1.00 0.00 0.00 57.85 57.69 1xmg n ARG 44 Cb 0.62 -2.34 0.54 0.00 -1.05 0.00 0.00 32.46 30.23 1xmg n ARG 44 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1xmg n ASN 45 N -0.56 0.64 -3.55 2.89 5.03 -0.69 -4.77 115.26 114.25 1xmg n ASN 45 Ca 0.11 0.71 -0.13 0.00 0.87 0.00 0.00 54.58 56.14 1xmg n ASN 45 Cb 0.44 -0.83 -0.05 0.00 -1.02 0.00 0.00 39.78 38.32 1xmg n ASN 45 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1xmg s SER 46 N -4.19 -0.47 -0.05 6.41 0.15 -0.82 -5.02 113.70 109.70 1xmg s SER 46 Ca 0.02 0.48 0.21 0.00 0.70 0.00 0.00 55.95 57.36 1xmg s SER 46 Cb 0.08 0.39 0.69 0.00 -1.71 0.00 0.00 66.02 65.47 1xmg s SER 46 CO 0.32 -0.46 1.59 -1.22 1.20 0.00 0.00 173.24 174.67 1xmg n TYR 47 N 0.72 1.22 0.11 3.44 4.02 -1.26 -4.53 117.16 120.89 1xmg n TYR 47 Ca -0.13 -0.55 0.15 0.00 -0.01 0.00 0.00 57.90 57.36 1xmg n TYR 47 Cb 0.58 -0.11 0.67 0.00 -0.02 0.00 0.00 39.34 40.46 1xmg n TYR 47 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 1xmg h GLU 48 N 4.24 0.00 -0.48 -0.72 4.11 -1.95 -1.82 114.58 117.96 1xmg h GLU 48 Ca 0.00 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.34 1xmg h GLU 48 Cb 1.21 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 1xmg h GLU 48 CO 0.11 0.00 0.08 1.28 0.07 0.00 0.00 179.01 180.55 1xmg n LEU 49 N -4.44 4.97 -0.31 3.06 4.77 -1.26 -4.74 117.00 119.05 1xmg n LEU 49 Ca 0.04 -3.17 0.15 0.00 -0.03 0.00 0.00 56.01 53.01 1xmg n LEU 49 Cb 0.38 -0.65 0.33 0.00 -2.33 0.00 0.00 43.42 41.16 1xmg n LEU 49 CO 0.36 0.78 1.02 -0.78 -1.33 0.00 0.00 177.39 177.44 1xmg h ASP 50 N 2.36 0.25 0.83 -1.43 3.58 -1.65 0.20 116.42 120.55 1xmg h ASP 50 Ca 0.12 0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.74 1xmg h ASP 50 Cb 1.86 0.18 0.00 0.00 1.72 0.00 0.00 39.33 43.09 1xmg h ASP 50 CO 0.46 -0.08 -0.08 0.59 -2.88 0.00 0.00 179.24 177.25 1xmg n ASN 51 N -5.11 0.11 0.00 2.28 3.02 -1.26 -4.30 115.26 110.00 1xmg n ASN 51 Ca 0.24 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 55.02 1xmg n ASN 51 Cb 0.73 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 1xmg n ASN 51 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xmg n ASP 52 N -1.44 0.68 -0.29 6.41 8.00 -0.49 -4.86 116.55 124.56 1xmg n ASP 52 Ca 0.08 -0.17 0.05 0.00 0.71 0.00 0.00 54.79 55.46 1xmg n ASP 52 Cb 0.32 0.48 0.19 0.00 -0.02 0.00 0.00 41.12 42.10 1xmg n ASP 52 CO 0.00 0.00 0.00 0.10 -0.39 0.00 0.00 177.20 176.91 1xmg h TYR 53 N 0.00 0.82 -0.61 1.24 -0.00 -0.85 0.14 116.97 117.71 1xmg h TYR 53 Ca 0.00 0.03 0.06 0.00 0.00 0.00 0.00 58.73 58.83 1xmg h TYR 53 Cb 0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 36.73 36.43 1xmg h TYR 53 CO 0.00 0.27 0.31 -0.07 -0.00 0.00 0.00 178.16 178.67 1xmg h LEU 54 N 0.72 0.43 -0.12 0.10 3.38 -1.85 0.76 115.31 118.73 1xmg h LEU 54 Ca 0.43 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 58.29 1xmg h LEU 54 Cb 0.50 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1xmg h LEU 54 CO -0.30 0.28 -0.51 -0.25 0.09 0.00 0.00 178.44 177.74 1xmg h TRP 55 N 0.57 0.74 -0.37 1.13 7.01 -1.70 -2.75 115.95 120.59 1xmg h TRP 55 Ca 0.28 -0.32 -0.01 0.00 2.11 0.00 0.00 58.89 60.95 1xmg h TRP 55 Cb 0.22 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.15 1xmg h TRP 55 CO -0.10 1.10 0.19 0.82 -2.79 0.00 0.00 178.44 177.65 1xmg h ILE 56 N 0.18 1.16 -0.63 2.65 1.08 -0.25 -2.49 117.51 119.22 1xmg h ILE 56 Ca -0.03 -0.45 0.08 0.00 -0.39 0.00 0.00 64.86 64.07 1xmg h ILE 56 Cb 1.15 0.78 -0.07 0.00 -3.07 0.00 0.00 36.82 35.61 1xmg h ILE 56 CO 0.11 0.17 0.28 -0.08 -0.69 0.00 0.00 178.15 177.93 1xmg h GLU 57 N 0.47 0.48 -0.82 2.37 4.81 0.51 -1.26 114.58 121.13 1xmg h GLU 57 Ca 0.13 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1xmg h GLU 57 Cb 0.10 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 1xmg h GLU 57 CO -0.02 0.32 0.54 0.00 -0.73 0.00 0.00 179.01 179.12 1xmg h ALA 58 N 1.40 1.46 -0.47 2.92 0.00 -1.17 -0.05 119.26 123.35 1xmg h ALA 58 Ca 0.31 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1xmg h ALA 58 Cb 0.33 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1xmg h ALA 58 CO -0.27 0.48 -0.15 0.87 0.00 0.00 0.00 179.25 180.19 1xmg h LYS 59 N 1.06 0.89 -0.39 0.00 1.79 -0.83 -1.85 116.57 117.24 1xmg h LYS 59 Ca 0.31 -0.33 -0.06 0.00 -2.18 0.00 0.00 60.65 58.40 1xmg h LYS 59 Cb -0.05 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.53 1xmg h LYS 59 CO -0.08 0.98 0.03 1.25 -1.08 0.00 0.00 179.45 180.54 1xmg h LEU 60 N 0.79 0.65 -0.64 2.94 5.85 -0.41 -2.57 115.31 121.91 1xmg h LEU 60 Ca 0.12 -0.29 0.08 0.00 0.84 0.00 0.00 57.88 58.63 1xmg h LEU 60 Cb 0.68 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 1xmg h LEU 60 CO 0.05 0.78 0.32 -0.33 -0.34 0.00 0.00 178.44 178.91 1xmg h GLU 61 N 0.50 0.55 -0.43 1.25 5.08 -0.83 -1.45 114.58 119.26 1xmg h GLU 61 Ca 0.11 -0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.52 1xmg h GLU 61 Cb 0.43 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.48 1xmg h GLU 61 CO 0.01 0.36 -0.04 0.93 -1.00 0.00 0.00 179.01 179.27 1xmg h GLU 62 N 0.57 0.06 -0.50 2.33 5.08 -0.94 0.13 114.58 121.31 1xmg h GLU 62 Ca 0.31 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.62 1xmg h GLU 62 Cb 0.28 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1xmg h GLU 62 CO -0.23 0.04 0.13 -0.22 -1.00 0.00 0.00 179.01 177.73 1xmg h LYS 63 N 0.06 0.79 -0.45 2.33 1.63 -1.17 -1.76 116.57 118.00 1xmg h LYS 63 Ca 0.21 -0.18 -0.00 0.00 -0.85 0.00 0.00 60.65 59.82 1xmg h LYS 63 Cb 0.31 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 1xmg h LYS 63 CO -0.39 0.76 0.26 0.28 -3.45 0.00 0.00 179.45 176.91 1xmg h VAL 64 N 0.68 1.15 0.34 2.00 2.07 -0.62 -1.73 116.25 120.14 1xmg h VAL 64 Ca 0.16 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1xmg h VAL 64 Cb 0.31 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 1xmg h VAL 64 CO -0.00 0.15 -0.16 0.00 0.02 0.00 0.00 177.57 177.58 1xmg h ALA 65 N 1.12 -0.46 -0.60 1.67 0.00 -0.63 -0.18 119.26 120.17 1xmg h ALA 65 Ca 0.16 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.05 1xmg h ALA 65 Cb 0.01 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.90 1xmg h ALA 65 CO -0.03 -0.73 0.20 0.28 0.00 0.00 0.00 179.25 178.96 1xmg h VAL 66 N -0.51 0.73 -0.49 0.00 2.07 -1.25 -0.70 116.25 116.09 1xmg h VAL 66 Ca -0.05 -0.12 -0.13 0.00 0.82 0.00 0.00 66.70 67.22 1xmg h VAL 66 Cb 0.38 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1xmg h VAL 66 CO 0.08 0.07 -0.19 -0.07 0.02 0.00 0.00 177.57 177.47 1xmg h LEU 67 N 0.36 1.02 -0.78 2.57 3.38 -1.20 -2.71 115.31 117.94 1xmg h LEU 67 Ca 0.31 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1xmg h LEU 67 Cb 0.41 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1xmg h LEU 67 CO -0.34 1.17 0.22 0.50 0.09 0.00 0.00 178.44 180.08 1xmg h LYS 68 N 0.87 1.13 -0.53 1.13 3.64 -0.36 0.17 116.57 122.61 1xmg h LYS 68 Ca 0.12 -0.25 -0.04 0.00 -1.27 0.00 0.00 60.65 59.22 1xmg h LYS 68 Cb 0.76 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 1xmg h LYS 68 CO 0.06 0.97 0.18 0.00 -2.27 0.00 0.00 179.45 178.39 1xmg h ALA 69 N 1.15 1.33 0.04 5.00 0.00 -1.05 0.10 119.26 125.83 1xmg h ALA 69 Ca 0.23 -0.16 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1xmg h ALA 69 Cb 0.32 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xmg h ALA 69 CO -0.01 0.49 -1.02 0.00 0.00 0.00 0.00 179.25 178.71 1xmg h ARG 70 N 0.77 0.27 0.11 0.00 3.08 -1.11 -3.35 114.38 114.14 1xmg h ARG 70 Ca 0.18 -0.35 -0.30 0.00 0.07 0.00 0.00 59.98 59.58 1xmg h ARG 70 Cb 0.20 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1xmg h ARG 70 CO -0.01 1.09 -1.48 0.00 -1.07 0.00 0.00 179.97 178.49 1xmg h ALA 71 N 0.78 0.26 -2.59 0.04 0.00 -0.65 -3.47 119.26 113.62 1xmg h ALA 71 Ca -0.08 -1.08 -0.54 0.00 0.00 0.00 0.00 54.91 53.20 1xmg h ALA 71 Cb 1.70 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 19.69 1xmg h ALA 71 CO 0.17 1.13 0.01 -0.06 0.00 0.00 0.00 179.25 180.50 1xmg s PHE 72 N -2.62 3.67 0.96 0.00 0.40 0.32 -5.08 117.98 115.64 1xmg s PHE 72 Ca -0.08 1.25 -0.14 0.00 -0.60 0.00 0.00 56.93 57.36 1xmg s PHE 72 Cb 0.07 -2.51 0.17 0.00 0.51 0.00 0.00 43.02 41.27 1xmg s PHE 72 CO 0.86 0.42 1.18 0.54 0.70 0.00 0.00 175.22 178.92 1xmg s ASN 73 N -1.56 3.08 0.27 1.36 2.20 -1.26 -4.75 114.94 114.27 1xmg s ASN 73 Ca 0.38 0.72 -0.04 0.00 -0.94 0.00 0.00 52.86 52.98 1xmg s ASN 73 Cb -0.17 -1.09 0.34 0.00 -2.00 0.00 0.00 41.25 38.33 1xmg s ASN 73 CO 0.20 -2.80 1.95 -0.33 -2.94 0.00 0.00 177.10 173.18 1xmg h GLU 74 N -1.67 1.22 -0.08 3.55 5.08 -1.98 -1.57 114.58 119.14 1xmg h GLU 74 Ca -0.48 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 57.80 1xmg h GLU 74 Cb 1.30 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1xmg h GLU 74 CO 0.52 0.81 0.03 0.28 -1.00 0.00 0.00 179.01 179.64 1xmg h VAL 75 N 1.26 1.16 -0.41 3.13 2.07 -2.00 -2.76 116.25 118.70 1xmg h VAL 75 Ca 0.34 -0.50 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 1xmg h VAL 75 Cb -0.14 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1xmg h VAL 75 CO -0.08 0.14 0.00 0.44 0.02 0.00 0.00 177.57 178.10 1xmg h ASP 76 N -0.05 0.63 0.06 0.57 3.32 -1.89 -0.43 116.42 118.63 1xmg h ASP 76 Ca 0.03 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 1xmg h ASP 76 Cb 0.20 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1xmg h ASP 76 CO -0.00 0.70 -0.11 0.15 -1.72 0.00 0.00 179.24 178.26 1xmg h PHE 77 N 0.63 0.14 0.09 4.55 3.04 -1.17 0.22 116.94 124.43 1xmg h PHE 77 Ca 0.13 -0.01 -0.30 0.00 3.98 0.00 0.00 57.97 61.76 1xmg h PHE 77 Cb 0.39 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 38.84 1xmg h PHE 77 CO 0.02 0.25 -1.59 0.00 -2.02 0.00 0.00 178.31 174.97 1xmg h ARG 78 N 0.13 0.19 -0.00 1.11 3.08 -1.13 -3.42 114.38 114.34 1xmg h ARG 78 Ca 0.03 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1xmg h ARG 78 Cb 0.28 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1xmg h ARG 78 CO 0.02 1.01 -0.02 0.72 -1.07 0.00 0.00 179.97 180.63 1xmg n HIS 79 N -3.38 0.00 -4.46 3.04 8.25 -0.22 -4.78 115.22 113.68 1xmg n HIS 79 Ca -0.17 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 56.99 1xmg n HIS 79 Cb 1.04 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 32.02 1xmg n HIS 79 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1xmg s LYS 80 N -0.37 1.67 0.75 -0.41 2.20 0.76 -0.36 119.74 123.98 1xmg s LYS 80 Ca 0.03 -1.21 -0.11 0.00 -0.36 0.00 0.00 55.97 54.31 1xmg s LYS 80 Cb 0.02 -2.02 0.04 0.00 -1.51 0.00 0.00 37.83 34.36 1xmg s LYS 80 CO 0.04 0.48 1.10 0.95 -0.36 0.00 0.00 175.35 177.56 1xmg s THR 81 N -1.04 3.25 0.29 3.43 -4.23 1.00 -4.53 115.64 113.81 1xmg s THR 81 Ca 0.15 0.40 0.35 0.00 -1.18 0.00 0.00 61.69 61.42 1xmg s THR 81 Cb -0.10 -3.28 0.36 0.00 1.34 0.00 0.00 72.50 70.81 1xmg s THR 81 CO 0.07 -0.53 2.08 0.00 -0.54 0.00 0.00 174.62 175.70 1xmg h ALA 82 N -0.87 1.00 -0.51 3.99 0.00 -0.70 0.99 119.26 123.16 1xmg h ALA 82 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1xmg h ALA 82 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1xmg h ALA 82 CO 0.62 0.00 0.00 1.19 0.00 0.00 0.00 179.25 181.06 1xmg n PHE 83 N -2.76 1.00 -0.96 0.00 3.01 -1.26 -4.81 117.46 111.68 1xmg n PHE 83 Ca -0.02 -0.42 0.00 0.00 1.01 0.00 0.00 57.45 58.02 1xmg n PHE 83 Cb 0.08 -0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.41 1xmg n PHE 83 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xmg n GLY 84 N 1.07 0.79 3.82 1.37 0.00 0.34 -5.01 105.19 107.58 1xmg n GLY 84 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1xmg n GLY 84 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xmg s GLU 85 N -0.12 4.03 -0.20 1.61 2.02 -1.26 -4.76 118.70 120.02 1xmg s GLU 85 Ca 0.00 1.15 -0.29 0.00 0.02 0.00 0.00 54.97 55.85 1xmg s GLU 85 Cb 0.00 -2.14 -0.01 0.00 0.10 0.00 0.00 34.13 32.07 1xmg s GLU 85 CO 0.00 -0.21 1.32 0.34 0.02 0.00 0.00 175.26 176.72 1xmg s ASP 86 N -2.33 6.81 0.18 -0.19 -1.08 -1.26 -0.00 116.67 118.80 1xmg s ASP 86 Ca 0.63 1.57 -0.14 0.00 -0.52 0.00 0.00 52.55 54.09 1xmg s ASP 86 Cb -0.11 -2.54 0.15 0.00 -1.46 0.00 0.00 42.92 38.96 1xmg s ASP 86 CO 0.19 -0.90 1.74 0.00 0.52 0.00 0.00 175.17 176.73 1xmg h ALA 87 N 8.76 0.55 -0.66 3.66 0.00 -1.01 -2.61 119.26 127.95 1xmg h ALA 87 Ca -0.27 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1xmg h ALA 87 Cb 1.11 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 1xmg h ALA 87 CO 0.99 -0.25 0.42 -0.22 0.00 0.00 0.00 179.25 180.19 1xmg h LYS 88 N 0.30 0.81 -0.48 0.00 3.64 -1.92 -1.03 116.57 117.90 1xmg h LYS 88 Ca 0.22 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 1xmg h LYS 88 Cb 0.25 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1xmg h LYS 88 CO -0.25 0.53 0.27 0.77 -2.27 0.00 0.00 179.45 178.51 1xmg h SER 89 N 0.83 0.43 -0.06 4.20 0.02 -1.87 0.11 113.55 117.21 1xmg h SER 89 Ca 0.26 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1xmg h SER 89 Cb -0.02 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.44 1xmg h SER 89 CO -0.09 0.30 0.04 0.58 -1.14 0.00 0.00 176.83 176.52 1xmg h VAL 90 N 0.54 1.03 -0.14 2.27 2.07 -1.12 0.26 116.25 121.15 1xmg h VAL 90 Ca 0.20 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.67 1xmg h VAL 90 Cb 0.05 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1xmg h VAL 90 CO -0.10 0.02 -0.01 0.25 0.02 0.00 0.00 177.57 177.75 1xmg h LEU 91 N 0.06 -0.08 -0.44 2.57 5.85 -0.68 0.21 115.31 122.81 1xmg h LEU 91 Ca 0.02 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.70 1xmg h LEU 91 Cb 0.01 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1xmg h LEU 91 CO -0.00 -0.02 -0.02 0.44 -0.34 0.00 0.00 178.44 178.49 1xmg h ASP 92 N 0.03 0.78 -0.21 1.25 3.45 -0.70 0.41 116.42 121.44 1xmg h ASP 92 Ca 0.07 -0.32 0.01 0.00 0.43 0.00 0.00 57.03 57.22 1xmg h ASP 92 Cb 0.09 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.63 1xmg h ASP 92 CO -0.12 0.91 0.10 1.23 -1.57 0.00 0.00 179.24 179.79 1xmg h GLY 93 N 0.63 0.27 0.99 2.75 0.00 -0.20 0.11 103.07 107.62 1xmg h GLY 93 Ca 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 1xmg h GLY 93 CO 0.03 0.07 0.25 -0.84 0.00 0.00 0.00 176.54 176.04 1xmg h THR 94 N 0.22 1.22 -0.40 4.70 2.02 -0.40 -1.71 112.91 118.56 1xmg h THR 94 Ca 0.08 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 1xmg h THR 94 Cb 0.02 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1xmg h THR 94 CO -0.05 0.26 0.02 0.58 0.37 0.00 0.00 175.52 176.70 1xmg h VAL 95 N 0.78 1.21 -0.56 3.16 2.07 -0.61 -1.39 116.25 120.91 1xmg h VAL 95 Ca 0.19 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1xmg h VAL 95 Cb 0.17 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1xmg h VAL 95 CO -0.02 0.29 0.28 0.00 0.02 0.00 0.00 177.57 178.13 1xmg h ALA 96 N 1.44 0.73 -0.49 1.67 0.00 -0.16 -0.57 119.26 121.86 1xmg h ALA 96 Ca 0.13 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1xmg h ALA 96 Cb 0.34 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1xmg h ALA 96 CO 0.01 0.28 -0.03 0.87 0.00 0.00 0.00 179.25 180.39 1xmg h LYS 97 N 0.76 0.84 -0.53 0.00 1.57 -0.89 -2.11 116.57 116.21 1xmg h LYS 97 Ca 0.19 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1xmg h LYS 97 Cb 0.11 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1xmg h LYS 97 CO -0.03 0.86 0.25 1.98 -0.57 0.00 0.00 179.45 181.94 1xmg h MET 98 N 0.77 0.77 0.00 3.15 4.05 -0.65 -1.17 114.93 121.85 1xmg h MET 98 Ca 0.14 -0.12 -0.05 0.00 -0.28 0.00 0.00 59.70 59.40 1xmg h MET 98 Cb 0.50 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.16 1xmg h MET 98 CO 0.03 0.64 -0.22 -0.91 0.23 0.00 0.00 176.91 176.67 1xmg h ASN 99 N 0.71 0.00 -0.03 1.39 2.35 -0.92 -1.56 115.58 117.52 1xmg h ASN 99 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 1xmg h ASN 99 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1xmg h ASN 99 CO -0.02 0.22 0.00 0.00 -1.65 0.00 0.00 177.43 175.98 1xmg n ALA 100 N -2.32 2.59 -1.93 -0.83 0.00 -0.78 -4.89 120.51 112.34 1xmg n ALA 100 Ca -0.01 -0.41 -0.42 0.00 0.00 0.00 0.00 53.44 52.59 1xmg n ALA 100 Cb 0.34 -1.21 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1xmg n ALA 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xmg s ALA 101 N -1.97 3.69 0.22 0.00 0.00 -0.51 -4.91 121.76 118.28 1xmg s ALA 101 Ca 0.38 1.22 0.07 0.00 0.00 0.00 0.00 51.96 53.64 1xmg s ALA 101 Cb 0.20 -3.69 0.16 0.00 0.00 0.00 0.00 23.12 19.80 1xmg s ALA 101 CO 0.33 -1.07 1.49 0.87 0.00 0.00 0.00 175.76 177.39 1xmg h LYS 102 N 8.15 0.07 -3.74 0.00 6.56 -1.90 -3.48 116.57 122.24 1xmg h LYS 102 Ca -0.43 -0.07 -0.07 0.00 -1.06 0.00 0.00 60.65 59.02 1xmg h LYS 102 Cb 1.20 0.02 -0.10 0.00 -0.57 0.00 0.00 32.23 32.78 1xmg h LYS 102 CO 0.93 0.78 -0.17 0.16 -2.06 0.00 0.00 179.45 179.09 1xmg s ASP 103 N -6.85 -0.07 0.61 0.86 3.84 -1.26 -5.03 116.67 108.77 1xmg s ASP 103 Ca -0.02 -0.97 0.31 0.00 -0.00 0.00 0.00 52.55 51.88 1xmg s ASP 103 Cb 0.12 0.56 1.82 0.00 -1.38 0.00 0.00 42.92 44.04 1xmg s ASP 103 CO 0.79 -1.11 2.18 0.07 -0.00 0.00 0.00 175.17 177.10 1xmg h LYS 104 N 2.29 0.00 -0.11 2.11 2.10 -1.92 -1.38 116.57 119.66 1xmg h LYS 104 Ca -0.27 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.15 1xmg h LYS 104 Cb 1.25 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.59 1xmg h LYS 104 CO 0.37 0.00 -0.83 -1.49 -2.00 0.00 0.00 179.45 175.50 1xmg h TRP 105 N 0.00 0.98 -0.18 0.07 4.06 -1.95 -2.21 115.95 116.72 1xmg h TRP 105 Ca 0.04 -0.46 -0.20 0.00 2.06 0.00 0.00 58.89 60.33 1xmg h TRP 105 Cb 0.27 -0.14 0.01 0.00 -1.00 0.00 0.00 29.16 28.30 1xmg h TRP 105 CO 0.00 1.28 -0.67 1.49 -3.56 0.00 0.00 178.44 176.98 1xmg h GLU 106 N 0.47 0.76 -0.91 0.49 4.81 -1.76 -3.18 114.58 115.26 1xmg h GLU 106 Ca -0.07 -0.59 0.02 0.00 -0.13 0.00 0.00 59.36 58.59 1xmg h GLU 106 Cb 1.46 0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.90 1xmg h GLU 106 CO 0.17 1.20 0.60 0.00 -0.73 0.00 0.00 179.01 180.25 1xmg h ALA 107 N 0.57 1.17 -0.37 2.92 0.00 -1.28 -2.13 119.26 120.13 1xmg h ALA 107 Ca -0.03 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1xmg h ALA 107 Cb 1.30 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1xmg h ALA 107 CO 0.14 0.53 -0.16 1.05 0.00 0.00 0.00 179.25 180.82 1xmg h GLU 108 N 1.22 0.67 -0.49 0.00 4.11 -1.44 -1.15 114.58 117.50 1xmg h GLU 108 Ca 0.34 -0.23 0.00 0.00 0.07 0.00 0.00 59.36 59.54 1xmg h GLU 108 Cb -0.11 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1xmg h GLU 108 CO -0.08 0.80 0.31 0.87 0.07 0.00 0.00 179.01 180.97 1xmg h LYS 109 N 0.60 0.66 0.22 1.06 1.57 -1.42 0.69 116.57 119.95 1xmg h LYS 109 Ca 0.10 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1xmg h LYS 109 Cb 0.61 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1xmg h LYS 109 CO 0.04 0.46 -0.11 0.82 -0.57 0.00 0.00 179.45 180.10 1xmg h ILE 110 N 0.66 0.84 0.40 1.86 2.04 -1.01 0.73 117.51 123.03 1xmg h ILE 110 Ca 0.18 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1xmg h ILE 110 Cb -0.04 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1xmg h ILE 110 CO -0.04 0.08 -0.19 -0.74 0.00 0.00 0.00 178.15 177.26 1xmg h HIS 111 N -0.47 -0.50 -0.69 1.37 2.76 -1.10 0.59 115.15 117.11 1xmg h HIS 111 Ca -0.03 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.17 1xmg h HIS 111 Cb 0.36 0.17 -0.05 0.00 1.55 0.00 0.00 27.41 29.43 1xmg h HIS 111 CO -0.01 -0.31 0.41 0.82 -1.30 0.00 0.00 177.93 177.53 1xmg h ILE 112 N -0.54 1.03 -0.76 6.26 2.04 -0.89 -1.84 117.51 122.81 1xmg h ILE 112 Ca -0.06 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1xmg h ILE 112 Cb 0.42 0.19 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 1xmg h ILE 112 CO 0.09 0.14 0.40 1.23 0.00 0.00 0.00 178.15 180.01 1xmg h GLY 113 N 0.78 1.15 0.92 5.37 0.00 -0.64 -1.62 103.07 109.03 1xmg h GLY 113 Ca 0.29 -0.54 0.02 0.00 0.00 0.00 0.00 47.33 47.10 1xmg h GLY 113 CO -0.14 0.51 0.36 -2.75 0.00 0.00 0.00 176.54 174.52 1xmg h PHE 114 N 1.06 0.67 -0.33 5.60 3.57 -0.14 -1.52 116.94 125.85 1xmg h PHE 114 Ca 0.27 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.75 1xmg h PHE 114 Cb 0.06 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1xmg h PHE 114 CO 0.00 0.40 0.07 0.00 -2.23 0.00 0.00 178.31 176.55 1xmg h ARG 115 N 0.72 0.53 -0.88 1.11 3.08 -1.05 0.94 114.38 118.83 1xmg h ARG 115 Ca 0.22 -0.13 0.03 0.00 0.07 0.00 0.00 59.98 60.17 1xmg h ARG 115 Cb -0.02 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 29.91 1xmg h ARG 115 CO -0.08 0.60 0.57 1.96 -1.07 0.00 0.00 179.97 181.95 1xmg h GLN 116 N 0.37 1.08 0.07 0.04 4.20 -0.94 -2.34 115.11 117.60 1xmg h GLN 116 Ca 0.10 -0.07 -0.31 0.00 0.06 0.00 0.00 58.65 58.44 1xmg h GLN 116 Cb 0.31 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1xmg h GLN 116 CO 0.00 0.72 -1.66 0.00 -0.67 0.00 0.00 178.83 177.22 1xmg h ALA 117 N 1.36 0.49 -0.01 3.87 0.00 -1.21 -3.42 119.26 120.34 1xmg h ALA 117 Ca 0.35 -1.28 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1xmg h ALA 117 Cb -0.00 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1xmg h ALA 117 CO -0.11 1.34 -0.01 0.66 0.00 0.00 0.00 179.25 181.13 1xmg n TYR 118 N -3.31 0.00 -1.62 0.00 4.02 0.32 -4.86 117.16 111.71 1xmg n TYR 118 Ca -0.19 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.25 1xmg n TYR 118 Cb 1.04 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 40.34 1xmg n TYR 118 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1xmg n LYS 119 N 0.55 1.56 -1.55 -0.72 4.81 -0.88 -1.54 118.16 120.39 1xmg n LYS 119 Ca 0.06 0.55 -0.39 0.00 -0.87 0.00 0.00 58.31 57.66 1xmg n LYS 119 Cb 0.26 -2.04 0.04 0.00 0.02 0.00 0.00 35.03 33.31 1xmg n LYS 119 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1xmg n PRO 120 N 1.18 0.80 -0.23 1.64 -0.02 -1.25 -1.75 135.00 135.38 1xmg n PRO 120 Ca 0.10 0.31 -0.04 0.00 -2.02 0.00 0.00 63.50 61.85 1xmg n PRO 120 Cb 0.31 -1.93 0.04 0.00 -0.02 0.00 0.00 33.50 31.90 1xmg n PRO 120 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1xmg n PRO 121 N -0.37 1.32 0.02 0.52 -0.04 -1.26 -4.92 135.00 130.27 1xmg n PRO 121 Ca 0.12 -0.58 -0.01 0.00 -0.04 0.00 0.00 63.50 62.99 1xmg n PRO 121 Cb 0.46 -1.29 -0.01 0.00 -0.04 0.00 0.00 33.50 32.62 1xmg n PRO 121 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1xmg h ILE 122 N 0.28 0.00 -3.11 0.52 1.08 -1.52 -3.39 117.51 111.37 1xmg h ILE 122 Ca 0.10 -0.25 -0.59 0.00 -0.39 0.00 0.00 64.86 63.73 1xmg h ILE 122 Cb 1.27 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.98 1xmg h ILE 122 CO 0.19 0.00 -0.25 -0.32 -0.69 0.00 0.00 178.15 177.08 1xmg s MET 123 N -1.75 3.75 0.45 2.37 1.75 -0.59 -0.09 119.30 125.20 1xmg s MET 123 Ca -0.01 0.16 -0.25 0.00 -1.25 0.00 0.00 55.69 54.34 1xmg s MET 123 Cb 0.00 -2.99 -0.09 0.00 2.84 0.00 0.00 34.83 34.59 1xmg s MET 123 CO 0.04 0.56 1.35 -2.30 -0.65 0.00 0.00 175.02 174.02 1xmg n PRO 124 N 0.87 2.04 -0.19 4.11 -0.02 -1.26 -3.80 135.00 136.75 1xmg n PRO 124 Ca -0.08 0.73 0.02 0.00 -2.02 0.00 0.00 63.50 62.15 1xmg n PRO 124 Cb 0.52 -2.51 0.28 0.00 -0.02 0.00 0.00 33.50 31.76 1xmg n PRO 124 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1xmg h VAL 125 N 2.09 1.16 -0.21 -1.45 -1.51 -1.94 -2.15 116.25 112.24 1xmg h VAL 125 Ca -0.50 -0.32 0.05 0.00 -1.23 0.00 0.00 66.70 64.70 1xmg h VAL 125 Cb 1.28 0.13 -0.05 0.00 -2.13 0.00 0.00 31.29 30.52 1xmg h VAL 125 CO 0.60 0.17 -0.14 0.78 -1.23 0.00 0.00 177.57 177.75 1xmg h ASN 126 N 0.94 -0.47 -0.58 4.19 2.35 -1.94 0.14 115.58 120.23 1xmg h ASN 126 Ca 0.27 0.10 -0.09 0.00 -0.55 0.00 0.00 56.30 56.03 1xmg h ASN 126 Cb -0.06 0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1xmg h ASN 126 CO -0.07 -0.18 0.01 1.88 -1.65 0.00 0.00 177.43 177.42 1xmg h TYR 127 N -0.14 1.10 -0.22 1.19 -1.99 -1.87 -2.43 116.97 112.62 1xmg h TYR 127 Ca 0.12 -0.19 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 1xmg h TYR 127 Cb 0.32 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 38.75 1xmg h TYR 127 CO -0.30 0.98 0.11 0.35 -0.00 0.00 0.00 178.16 179.31 1xmg h PHE 128 N 0.90 0.31 0.00 4.88 3.57 -0.77 0.64 116.94 126.47 1xmg h PHE 128 Ca 0.16 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.58 1xmg h PHE 128 Cb 0.54 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1xmg h PHE 128 CO 0.04 0.29 -0.33 -0.07 -2.23 0.00 0.00 178.31 176.01 1xmg h LEU 129 N 0.23 0.00 -0.52 0.59 3.38 -0.77 0.24 115.31 118.46 1xmg h LEU 129 Ca 0.08 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1xmg h LEU 129 Cb 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1xmg h LEU 129 CO -0.01 0.33 -0.13 -0.78 0.09 0.00 0.00 178.44 177.94 1xmg h ASP 130 N 0.00 1.02 -0.35 -0.43 1.82 -1.07 -1.06 116.42 116.35 1xmg h ASP 130 Ca -0.00 -0.36 -0.03 0.00 -0.39 0.00 0.00 57.03 56.24 1xmg h ASP 130 Cb 0.76 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.47 1xmg h ASP 130 CO 0.04 1.15 0.08 1.23 -1.61 0.00 0.00 179.24 180.14 1xmg h GLY 131 N 0.88 0.60 0.48 -0.78 0.00 0.56 -1.91 103.07 102.90 1xmg h GLY 131 Ca 0.13 -0.38 0.11 0.00 0.00 0.00 0.00 47.33 47.19 1xmg h GLY 131 CO 0.05 0.35 0.53 0.83 0.00 0.00 0.00 176.54 178.30 1xmg h GLU 132 N 0.41 0.83 0.37 4.80 4.39 -0.35 0.35 114.58 125.38 1xmg h GLU 132 Ca 0.11 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 1xmg h GLU 132 Cb 0.30 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1xmg h GLU 132 CO 0.00 0.55 -0.20 -0.09 -1.16 0.00 0.00 179.01 178.11 1xmg h ARG 133 N 0.85 -0.51 -0.07 2.33 2.43 -0.84 -0.63 114.38 117.93 1xmg h ARG 133 Ca 0.44 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.55 1xmg h ARG 133 Cb 0.43 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1xmg h ARG 133 CO -0.26 -0.34 -0.31 1.96 -1.51 0.00 0.00 179.97 179.50 1xmg h GLN 134 N -0.53 0.34 -0.55 0.20 4.20 -0.77 -2.99 115.11 115.01 1xmg h GLN 134 Ca -0.04 -0.27 -0.09 0.00 0.06 0.00 0.00 58.65 58.31 1xmg h GLN 134 Cb 0.42 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1xmg h GLN 134 CO 0.06 0.91 -0.02 -0.07 -0.67 0.00 0.00 178.83 179.04 1xmg h LEU 135 N -0.15 0.93 -1.04 1.46 3.38 -0.40 -2.92 115.31 116.57 1xmg h LEU 135 Ca -0.02 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 1xmg h LEU 135 Cb 0.96 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1xmg h LEU 135 CO 0.07 1.00 -0.22 1.23 0.09 0.00 0.00 178.44 180.61 1xmg h GLY 136 N 0.99 0.46 0.89 0.83 0.00 -1.19 -2.18 103.07 102.86 1xmg h GLY 136 Ca 0.16 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1xmg h GLY 136 CO 0.03 0.32 0.05 -0.84 0.00 0.00 0.00 176.54 176.10 1xmg h THR 137 N 0.38 1.23 -0.38 4.70 2.02 -1.36 -2.33 112.91 117.17 1xmg h THR 137 Ca 0.06 -0.80 -0.09 0.00 0.77 0.00 0.00 66.41 66.35 1xmg h THR 137 Cb 0.59 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 1xmg h THR 137 CO 0.04 0.26 -0.13 -0.09 0.37 0.00 0.00 175.52 175.98 1xmg h ARG 138 N 0.31 0.76 -0.36 6.66 9.65 -1.44 -2.56 114.38 127.41 1xmg h ARG 138 Ca 0.09 -0.31 0.05 0.00 -1.10 0.00 0.00 59.98 58.71 1xmg h ARG 138 Cb 0.34 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.84 1xmg h ARG 138 CO 0.01 0.92 0.10 1.25 2.80 0.00 0.00 179.97 185.05 1xmg h LEU 139 N 0.57 0.09 -0.04 3.80 5.85 -1.36 -1.65 115.31 122.56 1xmg h LEU 139 Ca 0.09 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1xmg h LEU 139 Cb 0.66 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 1xmg h LEU 139 CO 0.04 0.08 0.02 0.24 -0.34 0.00 0.00 178.44 178.49 1xmg h MET 140 N 0.24 0.06 -0.44 1.25 2.86 -1.37 -0.93 114.93 116.60 1xmg h MET 140 Ca 0.17 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.89 1xmg h MET 140 Cb 0.16 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.73 1xmg h MET 140 CO -0.19 0.16 -0.10 0.93 1.06 0.00 0.00 176.91 178.76 1xmg h GLU 141 N -0.05 0.01 -0.34 1.72 5.08 -1.21 0.56 114.58 120.35 1xmg h GLU 141 Ca 0.01 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1xmg h GLU 141 Cb 0.12 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1xmg h GLU 141 CO -0.00 0.00 0.03 -0.07 -1.00 0.00 0.00 179.01 177.97 1xmg h LEU 142 N 0.01 0.47 0.20 1.33 3.38 -1.15 -3.18 115.31 116.37 1xmg h LEU 142 Ca 0.21 -0.08 -0.31 0.00 0.09 0.00 0.00 57.88 57.79 1xmg h LEU 142 Cb 0.32 -0.12 0.02 0.00 0.09 0.00 0.00 40.66 40.97 1xmg h LEU 142 CO -0.45 0.52 -1.46 0.03 0.09 0.00 0.00 178.44 177.17 1xmg h ARG 143 N 0.49 0.42 -0.19 1.13 3.08 0.37 -3.36 114.38 116.33 1xmg h ARG 143 Ca 0.11 -0.72 0.00 0.00 0.07 0.00 0.00 59.98 59.44 1xmg h ARG 143 Cb 0.27 0.27 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1xmg h ARG 143 CO 0.00 1.34 0.00 0.09 -1.07 0.00 0.00 179.97 180.34 1xmg n ASN 144 N -3.77 0.73 -4.56 7.04 3.02 0.18 -4.41 115.26 113.49 1xmg n ASN 144 Ca -0.20 -2.01 -0.41 0.00 -0.03 0.00 0.00 54.58 51.93 1xmg n ASN 144 Cb 1.03 -0.12 -0.09 0.00 -0.61 0.00 0.00 39.78 39.99 1xmg n ASN 144 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1xmg s LEU 145 N -0.95 4.36 -1.26 3.41 2.96 -1.20 -4.12 118.68 121.88 1xmg s LEU 145 Ca 0.08 -0.12 -0.07 0.00 -0.22 0.00 0.00 54.13 53.81 1xmg s LEU 145 Cb 0.04 -2.40 0.01 0.00 0.50 0.00 0.00 46.19 44.34 1xmg s LEU 145 CO 0.05 -0.35 1.10 0.59 -1.32 0.00 0.00 176.35 176.42 1xmg n ASN 146 N 5.45 -5.23 0.19 3.68 3.02 -1.26 -4.88 115.26 116.24 1xmg n ASN 146 Ca -0.08 -0.53 0.18 0.00 -0.03 0.00 0.00 54.58 54.11 1xmg n ASN 146 Cb 0.49 -4.86 0.82 0.00 -0.61 0.00 0.00 39.78 35.62 1xmg n ASN 146 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1xmg h TYR 147 N -2.42 0.00 0.00 3.10 3.20 -1.77 -2.84 116.97 116.25 1xmg h TYR 147 Ca -0.55 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.32 1xmg h TYR 147 Cb 1.35 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.62 1xmg h TYR 147 CO 0.46 0.00 -0.85 0.66 -1.64 0.00 0.00 178.16 176.80 1xmg n TYR 148 N -3.77 0.00 -0.27 -3.82 4.02 -1.26 -4.68 117.16 107.37 1xmg n TYR 148 Ca 0.02 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.98 1xmg n TYR 148 Cb 0.36 -0.08 0.20 0.00 -0.02 0.00 0.00 39.34 39.79 1xmg n TYR 148 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1xmg h ASP 149 N 0.00 -0.22 -3.02 7.72 5.19 -1.89 -3.39 116.42 120.81 1xmg h ASP 149 Ca 0.00 0.19 -0.57 0.00 -0.62 0.00 0.00 57.03 56.04 1xmg h ASP 149 Cb 0.35 0.31 -0.04 0.00 0.18 0.00 0.00 39.33 40.13 1xmg h ASP 149 CO 0.00 -0.16 0.81 -0.89 -3.12 0.00 0.00 179.24 175.87 1xmg s THR 150 N -6.06 4.40 0.54 0.35 2.01 -1.26 -5.01 115.64 110.61 1xmg s THR 150 Ca -0.13 1.70 -0.20 0.00 0.31 0.00 0.00 61.69 63.37 1xmg s THR 150 Cb 0.23 -4.10 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 1xmg s THR 150 CO 0.76 -0.10 1.14 -2.16 -0.69 0.00 0.00 174.62 173.56 1xmg s PRO 151 N 3.01 3.38 0.28 4.92 0.04 -1.26 -4.71 135.00 140.66 1xmg s PRO 151 Ca 0.52 1.64 -0.01 0.00 0.04 0.00 0.00 61.00 63.20 1xmg s PRO 151 Cb -0.21 -2.04 0.65 0.00 0.04 0.00 0.00 34.50 32.93 1xmg s PRO 151 CO 0.15 -0.83 1.62 -0.07 0.04 0.00 0.00 177.00 177.91 1xmg h LEU 152 N 1.28 -0.22 -0.52 -3.56 3.38 -1.95 0.13 115.31 113.85 1xmg h LEU 152 Ca -0.50 0.22 0.10 0.00 0.09 0.00 0.00 57.88 57.79 1xmg h LEU 152 Cb 1.26 0.34 -0.10 0.00 0.09 0.00 0.00 40.66 42.26 1xmg h LEU 152 CO 0.57 -0.21 -0.13 -0.33 0.09 0.00 0.00 178.44 178.42 1xmg h GLU 153 N 0.12 -0.01 -0.14 1.13 3.07 -2.00 0.12 114.58 116.87 1xmg h GLU 153 Ca 0.52 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 59.19 1xmg h GLU 153 Cb 1.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.95 1xmg h GLU 153 CO -0.73 -0.00 -0.70 1.49 -1.40 0.00 0.00 179.01 177.67 1xmg h GLU 154 N -0.01 0.59 -0.67 2.33 4.57 -1.19 -3.26 114.58 116.95 1xmg h GLU 154 Ca 0.25 -0.45 -0.06 0.00 -1.18 0.00 0.00 59.36 57.92 1xmg h GLU 154 Cb 0.38 0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.03 1xmg h GLU 154 CO -0.54 1.07 0.20 1.25 -1.18 0.00 0.00 179.01 179.82 1xmg h LEU 155 N 0.42 0.98 -1.11 1.64 5.85 -0.12 -1.00 115.31 121.96 1xmg h LEU 155 Ca -0.03 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.57 1xmg h LEU 155 Cb 1.29 -0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.99 1xmg h LEU 155 CO 0.13 0.93 0.61 0.03 -0.34 0.00 0.00 178.44 179.80 1xmg h ARG 156 N 0.97 0.98 -0.20 1.25 3.08 -0.85 0.30 114.38 119.91 1xmg h ARG 156 Ca 0.21 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.99 1xmg h ARG 156 Cb 0.31 -0.22 0.01 0.00 0.08 0.00 0.00 29.97 30.15 1xmg h ARG 156 CO -0.01 0.65 -0.70 0.87 -1.07 0.00 0.00 179.97 179.72 1xmg h LYS 157 N 1.01 0.82 -0.33 0.04 1.57 -1.50 0.08 116.57 118.26 1xmg h LYS 157 Ca 0.43 -0.62 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1xmg h LYS 157 Cb 0.32 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1xmg h LYS 157 CO -0.18 1.24 0.13 1.96 -0.57 0.00 0.00 179.45 182.02 1xmg h GLN 158 N 0.58 0.49 -0.48 3.15 4.20 -0.07 -1.88 115.11 121.09 1xmg h GLN 158 Ca -0.03 -0.09 -0.06 0.00 0.06 0.00 0.00 58.65 58.53 1xmg h GLN 158 Cb 1.32 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 29.00 1xmg h GLN 158 CO 0.15 0.49 0.07 -0.09 -0.67 0.00 0.00 178.83 178.78 1xmg h ARG 159 N 0.38 0.76 -0.16 1.46 9.65 -0.44 -3.47 114.38 122.56 1xmg h ARG 159 Ca 0.11 -0.17 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1xmg h ARG 159 Cb 0.18 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1xmg h ARG 159 CO -0.01 0.72 0.00 0.41 2.80 0.00 0.00 179.97 183.89 1xmg n GLY 160 N -0.80 1.11 3.88 2.80 0.00 -0.08 -5.07 105.19 107.02 1xmg n GLY 160 Ca 0.03 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.33 1xmg n GLY 160 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xmg s VAL 161 N -2.16 4.77 -0.34 1.61 -7.23 -0.62 -5.02 120.40 111.41 1xmg s VAL 161 Ca 0.00 0.64 -0.10 0.00 -1.81 0.00 0.00 61.98 60.71 1xmg s VAL 161 Cb 0.00 -3.85 0.01 0.00 0.56 0.00 0.00 36.38 33.10 1xmg s VAL 161 CO 0.00 -0.97 0.18 -0.60 -0.31 0.00 0.00 175.10 173.40 1xmg s ARG 162 N -4.86 3.12 -0.31 4.82 3.52 -1.26 -4.80 118.95 119.18 1xmg s ARG 162 Ca 0.52 -0.87 -0.29 0.00 -0.13 0.00 0.00 55.73 54.96 1xmg s ARG 162 Cb -0.11 -3.65 -0.01 0.00 -1.56 0.00 0.00 34.95 29.63 1xmg s ARG 162 CO 0.48 -0.54 1.51 0.08 -0.81 0.00 0.00 175.30 176.02 1xmg s VAL 163 N 1.59 3.82 -0.11 7.11 1.01 -1.26 -4.87 120.40 127.69 1xmg s VAL 163 Ca 0.04 0.89 -0.11 0.00 0.00 0.00 0.00 61.98 62.80 1xmg s VAL 163 Cb -0.18 -3.95 -0.26 0.00 0.00 0.00 0.00 36.38 31.99 1xmg s VAL 163 CO 0.07 -0.50 0.43 0.58 0.00 0.00 0.00 175.10 175.68 1xmg h VAL 164 N 6.31 0.77 -1.98 2.92 2.07 -2.06 -3.48 116.25 120.80 1xmg h VAL 164 Ca -0.30 -2.36 -0.03 0.00 0.82 0.00 0.00 66.70 64.83 1xmg h VAL 164 Cb 1.13 2.55 -0.21 0.00 -1.52 0.00 0.00 31.29 33.24 1xmg h VAL 164 CO 1.04 0.80 0.13 -2.28 0.02 0.00 0.00 177.57 177.28 1xmg s HIS 165 N -2.53 -0.82 -0.12 1.57 2.46 -1.26 -5.14 115.29 109.46 1xmg s HIS 165 Ca -0.22 1.93 -0.00 0.00 0.47 0.00 0.00 55.06 57.24 1xmg s HIS 165 Cb 0.06 0.33 0.02 0.00 -0.13 0.00 0.00 32.58 32.86 1xmg s HIS 165 CO 0.76 -0.40 -0.09 -0.51 -2.47 0.00 0.00 174.74 172.04 1xmg s LEU 166 N 0.56 1.27 -0.70 8.88 1.43 -1.26 -5.06 118.68 123.81 1xmg s LEU 166 Ca -0.01 -0.33 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 1xmg s LEU 166 Cb -0.05 -0.89 0.34 0.00 0.03 0.00 0.00 46.19 45.62 1xmg s LEU 166 CO -0.02 -0.10 1.22 1.67 0.23 0.00 0.00 176.35 179.34 1xmg n GLN 167 N 4.88 3.85 0.00 1.70 7.27 -1.26 -5.31 117.38 128.51 1xmg n GLN 167 Ca -0.13 -4.77 0.13 0.00 0.07 0.00 0.00 57.00 52.30 1xmg n GLN 167 Cb 0.50 -2.30 0.34 0.00 2.41 0.00 0.00 30.24 31.19 1xmg n GLN 167 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00