#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ya7 h ARG 5 N 0.00 -0.08 -0.62 -1.58 3.08 -2.06 -0.52 114.38 112.60 1ya7 h ARG 5 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1ya7 h ARG 5 Cb 0.00 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1ya7 h ARG 5 CO 0.00 0.28 0.35 0.00 -1.07 0.00 0.00 179.97 179.53 1ya7 h ALA 6 N 0.44 1.44 -0.61 0.04 0.00 -2.05 -2.37 119.26 116.16 1ya7 h ALA 6 Ca -0.01 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1ya7 h ALA 6 Cb 0.40 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ya7 h ALA 6 CO 0.01 0.47 -0.01 0.00 0.00 0.00 0.00 179.25 179.72 1ya7 h ALA 7 N 1.52 0.83 -0.58 0.00 0.00 -1.90 0.29 119.26 119.42 1ya7 h ALA 7 Ca 0.22 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ya7 h ALA 7 Cb 0.01 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1ya7 h ALA 7 CO -0.04 0.68 0.33 -0.07 0.00 0.00 0.00 179.25 180.15 1ya7 h LEU 8 N 0.99 0.51 -0.15 0.00 3.38 -0.73 0.11 115.31 119.40 1ya7 h LEU 8 Ca 0.17 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 1ya7 h LEU 8 Cb 0.57 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1ya7 h LEU 8 CO 0.03 0.35 -0.08 0.40 0.09 0.00 0.00 178.44 179.23 1ya7 h ILE 9 N 0.64 1.32 -0.97 1.22 2.04 -1.02 -2.54 117.51 118.19 1ya7 h ILE 9 Ca 0.25 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 65.00 1ya7 h ILE 9 Cb 0.09 1.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.86 1ya7 h ILE 9 CO -0.14 0.33 0.64 -0.61 0.00 0.00 0.00 178.15 178.38 1ya7 h GLN 10 N -0.02 1.24 -0.40 2.37 5.75 -0.27 -0.47 115.11 123.32 1ya7 h GLN 10 Ca 0.03 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1ya7 h GLN 10 Cb 0.55 -0.28 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 1ya7 h GLN 10 CO 0.02 0.82 0.14 -0.91 -2.65 0.00 0.00 178.83 176.26 1ya7 h ASN 11 N 1.28 0.58 -0.44 -0.69 2.35 -0.75 0.23 115.58 118.14 1ya7 h ASN 11 Ca 0.37 -0.19 0.09 0.00 -0.55 0.00 0.00 56.30 56.02 1ya7 h ASN 11 Cb -0.08 -0.15 -0.09 0.00 0.05 0.00 0.00 38.32 38.05 1ya7 h ASN 11 CO -0.10 0.61 -0.13 0.25 -1.65 0.00 0.00 177.43 176.41 1ya7 h LEU 12 N 0.51 -0.47 -0.14 1.61 5.85 -1.07 -1.32 115.31 120.28 1ya7 h LEU 12 Ca 0.13 0.14 -0.20 0.00 0.84 0.00 0.00 57.88 58.79 1ya7 h LEU 12 Cb 0.23 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1ya7 h LEU 12 CO -0.01 -0.17 -0.96 0.03 -0.34 0.00 0.00 178.44 177.00 1ya7 h ARG 13 N -0.03 0.07 -0.09 1.25 3.08 -0.82 -2.81 114.38 115.03 1ya7 h ARG 13 Ca 0.21 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1ya7 h ARG 13 Cb 0.35 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1ya7 h ARG 13 CO -0.47 0.97 -0.27 -0.44 -1.07 0.00 0.00 179.97 178.69 1ya7 h ASP 14 N 0.03 0.15 1.67 7.04 3.32 -0.40 -3.17 116.42 125.06 1ya7 h ASP 14 Ca -0.03 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1ya7 h ASP 14 Cb 1.66 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 41.17 1ya7 h ASP 14 CO 0.13 0.42 -0.33 0.77 -1.72 0.00 0.00 179.24 178.52 1ya7 h SER 15 N 0.14 0.00 -3.27 6.45 4.64 -1.11 -3.40 113.55 117.00 1ya7 h SER 15 Ca 0.02 -0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.74 1ya7 h SER 15 Cb 0.55 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.24 1ya7 h SER 15 CO 0.04 0.00 -0.76 -0.31 -0.87 0.00 0.00 176.83 174.93 1ya7 s TYR 16 N -3.26 1.68 0.51 4.77 1.51 -1.07 -5.03 117.35 116.46 1ya7 s TYR 16 Ca 0.05 -2.15 0.07 0.00 -1.01 0.00 0.00 57.07 54.02 1ya7 s TYR 16 Cb 0.07 -1.67 0.03 0.00 -0.11 0.00 0.00 41.96 40.28 1ya7 s TYR 16 CO 0.71 -0.81 0.49 0.95 -1.11 0.00 0.00 175.55 175.78 1ya7 s THR 17 N 0.70 2.12 0.55 -0.71 -4.23 -1.25 -4.70 115.64 108.13 1ya7 s THR 17 Ca 0.16 -1.31 0.26 0.00 -1.18 0.00 0.00 61.69 59.62 1ya7 s THR 17 Cb -0.23 -2.44 0.39 0.00 1.34 0.00 0.00 72.50 71.56 1ya7 s THR 17 CO -0.03 0.00 1.99 -0.08 -0.54 0.00 0.00 174.62 175.96 1ya7 h GLU 18 N 0.70 0.00 -0.34 3.99 4.22 -1.96 -1.95 114.58 119.25 1ya7 h GLU 18 Ca -0.37 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 58.92 1ya7 h GLU 18 Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1ya7 h GLU 18 CO 0.53 0.00 -0.40 1.15 -2.18 0.00 0.00 179.01 178.11 1ya7 h THR 19 N 0.00 1.28 -0.76 0.32 2.02 -1.98 0.48 112.91 114.27 1ya7 h THR 19 Ca 0.22 -1.58 0.06 0.00 0.77 0.00 0.00 66.41 65.88 1ya7 h THR 19 Cb 0.97 1.45 -0.06 0.00 -1.74 0.00 0.00 68.15 68.77 1ya7 h THR 19 CO -0.00 0.52 0.45 0.28 0.37 0.00 0.00 175.52 177.14 1ya7 h SER 20 N 0.67 0.68 0.25 4.18 0.02 -1.73 0.12 113.55 117.74 1ya7 h SER 20 Ca 0.05 0.03 -0.32 0.00 -0.84 0.00 0.00 61.79 60.71 1ya7 h SER 20 Cb 0.97 -0.11 0.03 0.00 0.14 0.00 0.00 62.40 63.43 1ya7 h SER 20 CO 0.09 0.44 -1.38 0.77 -1.14 0.00 0.00 176.83 175.61 1ya7 h SER 21 N 0.82 0.82 -0.84 3.07 4.64 -1.41 -3.07 113.55 117.57 1ya7 h SER 21 Ca 0.34 -0.83 -0.03 0.00 -0.47 0.00 0.00 61.79 60.80 1ya7 h SER 21 Cb 0.19 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 61.98 1ya7 h SER 21 CO -0.18 1.64 0.41 0.15 -0.87 0.00 0.00 176.83 177.98 1ya7 h PHE 22 N 0.19 1.21 -0.52 4.77 3.57 -0.85 -2.13 116.94 123.19 1ya7 h PHE 22 Ca -0.22 -0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.30 1ya7 h PHE 22 Cb 2.06 -0.38 -0.06 0.00 2.79 0.00 0.00 35.95 40.36 1ya7 h PHE 22 CO 0.12 0.87 0.15 0.00 -2.23 0.00 0.00 178.31 177.22 1ya7 h ALA 23 N 1.22 0.62 -0.48 2.41 0.00 -0.81 -0.16 119.26 122.07 1ya7 h ALA 23 Ca 0.29 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.34 1ya7 h ALA 23 Cb 0.11 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 1ya7 h ALA 23 CO -0.04 -0.25 0.19 0.28 0.00 0.00 0.00 179.25 179.43 1ya7 h VAL 24 N 0.31 0.87 -0.39 0.00 2.07 -1.37 -0.73 116.25 117.02 1ya7 h VAL 24 Ca 0.26 -0.13 -0.05 0.00 0.82 0.00 0.00 66.70 67.59 1ya7 h VAL 24 Cb 0.31 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1ya7 h VAL 24 CO -0.29 0.07 0.03 0.40 0.02 0.00 0.00 177.57 177.80 1ya7 h ILE 25 N 0.38 1.25 -0.67 4.57 1.08 -0.74 0.14 117.51 123.51 1ya7 h ILE 25 Ca 0.22 -0.93 0.06 0.00 -0.39 0.00 0.00 64.86 63.82 1ya7 h ILE 25 Cb 0.21 1.10 -0.05 0.00 -3.07 0.00 0.00 36.82 35.00 1ya7 h ILE 25 CO -0.21 0.31 0.37 -0.33 -0.69 0.00 0.00 178.15 177.61 1ya7 h GLU 26 N 0.50 0.67 -0.31 2.37 5.08 -0.89 0.12 114.58 122.11 1ya7 h GLU 26 Ca 0.11 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1ya7 h GLU 26 Cb 0.42 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1ya7 h GLU 26 CO 0.01 0.45 0.11 1.49 -1.00 0.00 0.00 179.01 180.07 1ya7 h GLU 27 N 0.69 0.47 -0.80 2.33 4.57 -0.59 -2.86 114.58 118.39 1ya7 h GLU 27 Ca 0.30 -0.09 0.01 0.00 -1.18 0.00 0.00 59.36 58.40 1ya7 h GLU 27 Cb 0.18 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 1ya7 h GLU 27 CO -0.18 0.50 0.53 -1.49 -1.18 0.00 0.00 179.01 177.19 1ya7 h TRP 28 N 0.35 1.01 0.00 0.92 4.06 -0.41 -2.24 115.95 119.63 1ya7 h TRP 28 Ca 0.10 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 61.06 1ya7 h TRP 28 Cb 0.22 -0.34 -0.00 0.00 -1.00 0.00 0.00 29.16 28.04 1ya7 h TRP 28 CO 0.00 0.63 -0.07 0.00 -3.56 0.00 0.00 178.44 175.44 1ya7 h ALA 29 N 1.30 1.57 -3.00 1.49 0.00 -0.68 -3.12 119.26 116.82 1ya7 h ALA 29 Ca 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ya7 h ALA 29 Cb -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ya7 h ALA 29 CO -0.07 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.27 1ya7 n ALA 30 N -2.39 0.57 -0.34 0.00 0.00 -0.89 -4.74 120.51 112.72 1ya7 n ALA 30 Ca -0.03 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.57 1ya7 n ALA 30 Cb 0.16 0.00 0.37 0.00 0.00 0.00 0.00 19.45 19.98 1ya7 n ALA 30 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ya7 h GLY 31 N 0.00 1.67 0.81 0.00 0.00 -1.68 -2.24 103.07 101.63 1ya7 h GLY 31 Ca 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 1ya7 h GLY 31 CO 0.00 -0.10 -0.03 -0.84 0.00 0.00 0.00 176.54 175.58 1ya7 h THR 32 N 0.66 1.27 -0.24 4.70 2.02 -1.59 -0.04 112.91 119.70 1ya7 h THR 32 Ca 0.58 -0.96 -0.09 0.00 0.77 0.00 0.00 66.41 66.71 1ya7 h THR 32 Cb 1.05 1.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 1ya7 h THR 32 CO -0.37 0.29 -0.24 -0.07 0.37 0.00 0.00 175.52 175.50 1ya7 h LEU 33 N 0.12 0.45 -0.37 2.58 3.38 -1.40 -1.62 115.31 118.45 1ya7 h LEU 33 Ca 0.05 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 1ya7 h LEU 33 Cb 0.45 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1ya7 h LEU 33 CO 0.02 0.70 0.01 1.56 0.09 0.00 0.00 178.44 180.81 1ya7 h GLN 34 N 0.40 0.64 -0.80 1.13 4.20 -1.28 -2.33 115.11 117.07 1ya7 h GLN 34 Ca 0.06 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1ya7 h GLN 34 Cb 0.65 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.33 1ya7 h GLN 34 CO 0.05 0.74 0.45 1.49 -0.67 0.00 0.00 178.83 180.89 1ya7 h GLU 35 N 0.46 1.11 -0.69 1.46 4.57 -0.70 -0.73 114.58 120.06 1ya7 h GLU 35 Ca 0.10 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1ya7 h GLU 35 Cb 0.45 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 1ya7 h GLU 35 CO 0.02 0.81 0.42 0.82 -1.18 0.00 0.00 179.01 179.89 1ya7 h ILE 36 N 1.11 1.20 -0.73 2.32 2.04 -1.28 -1.06 117.51 121.10 1ya7 h ILE 36 Ca 0.28 -0.44 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 1ya7 h ILE 36 Cb 0.02 0.24 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 1ya7 h ILE 36 CO -0.05 0.21 0.20 -0.08 0.00 0.00 0.00 178.15 178.43 1ya7 h GLU 37 N 0.94 1.16 -0.01 2.37 4.22 -1.02 0.27 114.58 122.51 1ya7 h GLU 37 Ca 0.25 -0.27 -0.00 0.00 0.08 0.00 0.00 59.36 59.42 1ya7 h GLU 37 Cb -0.03 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 1ya7 h GLU 37 CO -0.05 1.00 0.00 0.78 -2.18 0.00 0.00 179.01 178.57 1ya7 h GLY 38 N 1.10 0.01 0.37 1.92 0.00 -0.74 -1.68 103.07 104.06 1ya7 h GLY 38 Ca 0.23 -0.01 0.07 0.00 0.00 0.00 0.00 47.33 47.63 1ya7 h GLY 38 CO -0.00 0.01 0.02 -2.22 0.00 0.00 0.00 176.54 174.34 1ya7 h ILE 39 N -0.07 0.71 -0.66 2.60 2.04 -1.04 0.02 117.51 121.10 1ya7 h ILE 39 Ca 0.00 -0.04 0.08 0.00 1.00 0.00 0.00 64.86 65.90 1ya7 h ILE 39 Cb 0.09 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.67 1ya7 h ILE 39 CO -0.00 0.02 0.34 0.00 0.00 0.00 0.00 178.15 178.51 1ya7 h ALA 40 N 1.35 0.89 -0.31 1.87 0.00 -0.75 0.59 119.26 122.90 1ya7 h ALA 40 Ca 0.20 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1ya7 h ALA 40 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1ya7 h ALA 40 CO -0.32 -0.04 0.03 0.87 0.00 0.00 0.00 179.25 179.79 1ya7 h LYS 41 N 0.60 0.52 -0.63 0.00 1.57 -0.81 -1.92 116.57 115.90 1ya7 h LYS 41 Ca 0.31 -0.15 0.04 0.00 -1.87 0.00 0.00 60.65 58.98 1ya7 h LYS 41 Cb 0.28 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.49 1ya7 h LYS 41 CO -0.23 0.64 0.37 0.00 -0.57 0.00 0.00 179.45 179.65 1ya7 h ALA 42 N 0.86 0.83 -0.67 3.86 0.00 -0.56 -0.63 119.26 122.95 1ya7 h ALA 42 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1ya7 h ALA 42 Cb 0.39 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ya7 h ALA 42 CO 0.01 0.07 0.24 0.00 0.00 0.00 0.00 179.25 179.57 1ya7 h ALA 43 N 1.30 0.87 -0.66 0.00 0.00 -0.76 -0.99 119.26 119.03 1ya7 h ALA 43 Ca 0.27 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1ya7 h ALA 43 Cb 0.10 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1ya7 h ALA 43 CO -0.14 0.52 0.16 0.00 0.00 0.00 0.00 179.25 179.79 1ya7 h ALA 44 N 1.10 0.87 0.50 0.00 0.00 -1.05 -0.68 119.26 120.00 1ya7 h ALA 44 Ca 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1ya7 h ALA 44 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ya7 h ALA 44 CO -0.01 0.58 -0.38 1.49 0.00 0.00 0.00 179.25 180.93 1ya7 h GLU 45 N 0.98 -0.83 -0.86 0.00 4.81 -0.85 0.27 114.58 118.10 1ya7 h GLU 45 Ca 0.21 0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.60 1ya7 h GLU 45 Cb 0.36 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.87 1ya7 h GLU 45 CO 0.00 -0.56 0.56 0.00 -0.73 0.00 0.00 179.01 178.28 1ya7 h ALA 46 N -0.51 1.70 -0.22 2.92 0.00 -1.09 -2.52 119.26 119.53 1ya7 h ALA 46 Ca -0.05 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1ya7 h ALA 46 Cb 0.73 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1ya7 h ALA 46 CO 0.01 0.11 -0.25 1.25 0.00 0.00 0.00 179.25 180.37 1ya7 h HIS 47 N 0.81 0.68 -0.50 0.00 -0.00 -0.70 -2.42 115.15 113.01 1ya7 h HIS 47 Ca 0.40 -0.21 0.06 0.00 -0.00 0.00 0.00 60.37 60.62 1ya7 h HIS 47 Cb 0.47 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 27.71 1ya7 h HIS 47 CO -0.00 0.92 0.34 0.78 -0.00 0.00 0.00 177.93 179.96 1ya7 h GLY 48 N 0.25 0.54 1.49 5.26 0.00 -0.54 -2.06 103.07 108.00 1ya7 h GLY 48 Ca 0.03 -0.17 -0.22 0.00 0.00 0.00 0.00 47.33 46.97 1ya7 h GLY 48 CO 0.06 0.13 -0.87 -2.08 0.00 0.00 0.00 176.54 173.78 1ya7 h VAL 49 N 0.43 1.37 -0.28 4.60 2.07 -1.20 -3.07 116.25 120.18 1ya7 h VAL 49 Ca 0.22 -2.29 -0.15 0.00 0.82 0.00 0.00 66.70 65.30 1ya7 h VAL 49 Cb 0.32 2.28 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1ya7 h VAL 49 CO -0.06 0.69 -0.41 0.40 0.02 0.00 0.00 177.57 178.22 1ya7 h ILE 50 N 0.29 1.30 -0.51 4.57 2.04 -1.13 -3.32 117.51 120.75 1ya7 h ILE 50 Ca -0.07 -1.60 -0.02 0.00 1.00 0.00 0.00 64.86 64.17 1ya7 h ILE 50 Cb 1.49 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 39.20 1ya7 h ILE 50 CO 0.16 0.51 0.23 -0.09 0.00 0.00 0.00 178.15 178.96 1ya7 h ARG 51 N 0.52 0.71 -2.04 2.37 2.43 -1.39 -2.74 114.38 114.24 1ya7 h ARG 51 Ca 0.03 -0.09 -0.74 0.00 -0.81 0.00 0.00 59.98 58.36 1ya7 h ARG 51 Cb 1.00 -0.14 -0.30 0.00 -0.42 0.00 0.00 29.97 30.11 1ya7 h ARG 51 CO 0.09 0.57 0.68 0.27 -1.51 0.00 0.00 179.97 180.08 1ya7 n ASN 52 N -4.37 6.86 -3.79 -3.80 0.23 -1.16 -4.94 115.26 104.29 1ya7 n ASN 52 Ca 0.04 -3.76 -0.13 0.00 -0.53 0.00 0.00 54.58 50.20 1ya7 n ASN 52 Cb 0.13 -0.98 -0.10 0.00 -2.08 0.00 0.00 39.78 36.75 1ya7 n ASN 52 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1ya7 s SER 53 N -1.68 -0.20 -0.05 0.53 1.04 -1.03 -4.98 113.70 107.32 1ya7 s SER 53 Ca 0.47 0.28 -0.07 0.00 0.48 0.00 0.00 55.95 57.11 1ya7 s SER 53 Cb 0.34 0.42 -0.04 0.00 0.10 0.00 0.00 66.02 66.84 1ya7 s SER 53 CO -0.28 -0.24 0.21 -0.89 0.98 0.00 0.00 173.24 173.03 1ya7 s THR 54 N -0.53 5.39 -0.05 2.02 2.01 -1.26 -5.00 115.64 118.21 1ya7 s THR 54 Ca -0.06 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.15 1ya7 s THR 54 Cb -0.04 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1ya7 s THR 54 CO 0.02 0.50 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.10 1ya7 s TYR 55 N -1.16 3.04 0.00 4.92 1.51 -1.26 -5.04 117.35 119.36 1ya7 s TYR 55 Ca 0.21 0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.37 1ya7 s TYR 55 Cb -0.13 -1.72 0.00 0.00 -0.11 0.00 0.00 41.96 40.00 1ya7 s TYR 55 CO 0.11 0.41 0.00 0.41 -1.11 0.00 0.00 175.55 175.37 1ya7 n GLY 56 N 1.96 4.90 0.36 0.71 0.00 -1.26 -5.00 105.19 106.86 1ya7 n GLY 56 Ca -0.17 -1.74 0.10 0.00 0.00 0.00 0.00 46.02 44.20 1ya7 n GLY 56 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ya7 h ARG 57 N 0.00 0.85 -0.58 1.61 2.43 -1.99 -2.44 114.38 114.26 1ya7 h ARG 57 Ca 0.00 -0.05 0.17 0.00 -0.81 0.00 0.00 59.98 59.29 1ya7 h ARG 57 Cb 0.00 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 1ya7 h ARG 57 CO 0.00 0.56 0.41 0.00 -1.51 0.00 0.00 179.97 179.44 1ya7 h ALA 58 N 1.58 2.54 0.00 2.80 0.00 -2.00 0.04 119.26 124.22 1ya7 h ALA 58 Ca 0.51 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 1ya7 h ALA 58 Cb 0.65 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ya7 h ALA 58 CO -0.29 -0.71 -0.14 1.96 0.00 0.00 0.00 179.25 180.08 1ya7 h GLN 59 N 0.00 0.00 0.00 0.00 7.50 -1.76 -2.85 115.11 118.01 1ya7 h GLN 59 Ca 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.41 1ya7 h GLN 59 Cb 1.10 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.62 1ya7 h GLN 59 CO -0.00 0.14 -0.05 0.00 -1.50 0.00 0.00 178.83 177.41 1ya7 h ALA 60 N 1.86 0.97 0.00 3.87 0.00 -1.11 -3.32 119.26 121.53 1ya7 h ALA 60 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ya7 h ALA 60 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1ya7 h ALA 60 CO 0.02 0.07 -0.51 0.93 0.00 0.00 0.00 179.25 179.75 1ya7 h GLU 61 N 0.00 0.00 -4.15 0.00 5.08 -1.43 -3.45 114.58 110.63 1ya7 h GLU 61 Ca -0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 57.94 1ya7 h GLU 61 Cb 0.93 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.85 1ya7 h GLU 61 CO 0.01 0.00 -0.78 0.21 -1.00 0.00 0.00 179.01 177.45 1ya7 s LYS 62 N -3.18 0.92 -0.09 2.33 2.47 -1.22 -5.13 119.74 115.84 1ya7 s LYS 62 Ca 0.06 -0.16 -0.30 0.00 -1.56 0.00 0.00 55.97 54.01 1ya7 s LYS 62 Cb 0.12 -0.88 -0.02 0.00 -1.46 0.00 0.00 37.83 35.60 1ya7 s LYS 62 CO 0.70 -0.04 1.07 -1.12 0.16 0.00 0.00 175.35 176.13 1ya7 s SER 63 N 0.75 7.17 -0.33 1.43 0.01 -1.26 -4.84 113.70 116.63 1ya7 s SER 63 Ca -0.11 1.62 -0.29 0.00 1.31 0.00 0.00 55.95 58.49 1ya7 s SER 63 Cb -0.14 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.53 1ya7 s SER 63 CO 0.01 -0.50 1.61 -2.84 0.41 0.00 0.00 173.24 171.92 1ya7 s PRO 64 N 2.14 3.55 0.45 12.44 0.02 -1.26 -4.89 135.00 147.44 1ya7 s PRO 64 Ca 0.51 1.31 0.16 0.00 0.02 0.00 0.00 61.00 63.00 1ya7 s PRO 64 Cb -0.20 -4.09 1.11 0.00 0.02 0.00 0.00 34.50 31.34 1ya7 s PRO 64 CO 0.19 -1.60 1.97 0.93 -0.33 0.00 0.00 177.00 178.16 1ya7 h GLU 65 N 11.50 0.32 -0.10 5.54 5.08 -1.99 -2.59 114.58 132.33 1ya7 h GLU 65 Ca -0.31 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1ya7 h GLU 65 Cb 1.14 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1ya7 h GLU 65 CO 1.04 0.21 0.04 0.37 -1.00 0.00 0.00 179.01 179.67 1ya7 h GLN 66 N 0.33 0.15 -0.57 2.33 4.15 -1.99 -0.71 115.11 118.80 1ya7 h GLN 66 Ca 0.29 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.63 1ya7 h GLN 66 Cb 0.68 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.32 1ya7 h GLN 66 CO -0.07 0.28 0.18 -0.07 -1.93 0.00 0.00 178.83 177.21 1ya7 h LEU 67 N 0.00 0.83 -0.76 -2.39 3.38 -1.88 -2.02 115.31 112.48 1ya7 h LEU 67 Ca 0.03 -0.21 0.11 0.00 0.09 0.00 0.00 57.88 57.90 1ya7 h LEU 67 Cb 0.18 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1ya7 h LEU 67 CO -0.00 0.82 0.38 -0.07 0.09 0.00 0.00 178.44 179.66 1ya7 h LEU 68 N 0.80 0.49 -0.06 1.67 3.38 -1.42 -1.15 115.31 119.02 1ya7 h LEU 68 Ca 0.18 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.24 1ya7 h LEU 68 Cb 0.29 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1ya7 h LEU 68 CO -0.01 0.26 -0.02 1.23 0.09 0.00 0.00 178.44 180.00 1ya7 h GLY 69 N 0.62 0.05 0.91 0.83 0.00 -0.50 -0.04 103.07 104.93 1ya7 h GLY 69 Ca 0.38 0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.75 1ya7 h GLY 69 CO -0.29 -0.03 0.23 -2.08 0.00 0.00 0.00 176.54 174.37 1ya7 h VAL 70 N -0.00 1.04 -0.33 4.60 2.07 -1.04 -0.27 116.25 122.32 1ya7 h VAL 70 Ca 0.03 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 1ya7 h VAL 70 Cb 0.05 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1ya7 h VAL 70 CO -0.07 0.09 -0.22 -0.07 0.02 0.00 0.00 177.57 177.31 1ya7 h LEU 71 N 0.47 0.64 -0.12 2.57 3.38 -1.02 -0.56 115.31 120.67 1ya7 h LEU 71 Ca 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1ya7 h LEU 71 Cb 0.01 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1ya7 h LEU 71 CO -0.07 0.86 0.04 -0.61 0.09 0.00 0.00 178.44 178.74 1ya7 h GLN 72 N 0.56 0.18 -0.84 1.13 5.75 -0.86 -1.26 115.11 119.77 1ya7 h GLN 72 Ca 0.08 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.55 1ya7 h GLN 72 Cb 0.69 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.17 1ya7 h GLN 72 CO 0.05 0.32 0.54 -0.09 -2.65 0.00 0.00 178.83 177.00 1ya7 h ARG 73 N 0.00 1.12 -0.33 1.69 2.43 -0.76 -1.95 114.38 116.58 1ya7 h ARG 73 Ca 0.04 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1ya7 h ARG 73 Cb 0.22 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1ya7 h ARG 73 CO -0.00 0.76 0.13 -0.92 -1.51 0.00 0.00 179.97 178.43 1ya7 h TYR 74 N 1.15 0.51 -0.89 2.20 3.20 -1.00 -2.78 116.97 119.36 1ya7 h TYR 74 Ca 0.31 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.19 1ya7 h TYR 74 Cb -0.10 -0.15 -0.06 0.00 1.54 0.00 0.00 36.73 37.96 1ya7 h TYR 74 CO -0.01 0.48 0.57 0.37 -1.64 0.00 0.00 178.16 177.93 1ya7 h GLN 75 N 0.39 1.03 -0.03 1.82 4.15 -0.79 -0.26 115.11 121.43 1ya7 h GLN 75 Ca 0.11 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 1ya7 h GLN 75 Cb 0.19 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 27.64 1ya7 h GLN 75 CO -0.01 0.68 0.01 -0.44 -1.93 0.00 0.00 178.83 177.14 1ya7 h ASP 76 N 1.06 0.04 -0.22 -0.69 3.32 -1.33 0.48 116.42 119.08 1ya7 h ASP 76 Ca 0.37 -0.20 0.05 0.00 0.02 0.00 0.00 57.03 57.28 1ya7 h ASP 76 Cb 0.10 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.59 1ya7 h ASP 76 CO -0.15 0.23 -0.10 0.25 -1.72 0.00 0.00 179.24 177.74 1ya7 h LEU 77 N -0.15 -0.34 -0.86 1.55 7.12 -1.33 -1.07 115.31 120.23 1ya7 h LEU 77 Ca 0.01 0.08 0.06 0.00 0.13 0.00 0.00 57.88 58.16 1ya7 h LEU 77 Cb 0.20 0.19 -0.06 0.00 -0.53 0.00 0.00 40.66 40.46 1ya7 h LEU 77 CO -0.00 -0.13 0.54 0.00 -0.13 0.00 0.00 178.44 178.71 1ya7 h HIS 79 N 0.99 0.59 -0.22 0.00 -0.00 -0.44 -1.38 115.15 114.68 1ya7 h HIS 79 Ca 0.37 0.03 -0.17 0.00 -0.00 0.00 0.00 60.37 60.60 1ya7 h HIS 79 Cb 0.15 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.40 1ya7 h HIS 79 CO -0.03 0.25 -0.52 -0.91 -0.00 0.00 0.00 177.93 176.72 1ya7 h ASN 80 N 0.59 0.84 -0.19 3.26 2.35 -0.15 -2.73 115.58 119.55 1ya7 h ASN 80 Ca 0.30 -0.56 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1ya7 h ASN 80 Cb 0.24 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1ya7 h ASN 80 CO -0.21 1.25 0.11 0.58 -1.65 0.00 0.00 177.43 177.51 1ya7 h VAL 81 N 0.46 1.08 -0.66 2.81 2.07 -1.09 -1.60 116.25 119.32 1ya7 h VAL 81 Ca -0.00 -0.20 0.12 0.00 0.82 0.00 0.00 66.70 67.44 1ya7 h VAL 81 Cb 1.13 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 31.69 1ya7 h VAL 81 CO 0.11 0.08 0.19 0.22 0.02 0.00 0.00 177.57 178.19 1ya7 h TYR 82 N 0.22 0.31 -0.22 1.57 3.20 -1.24 0.44 116.97 121.25 1ya7 h TYR 82 Ca 0.07 0.04 -0.18 0.00 3.14 0.00 0.00 58.73 61.80 1ya7 h TYR 82 Cb 0.03 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 1ya7 h TYR 82 CO -0.05 -0.00 -0.57 0.00 -1.64 0.00 0.00 178.16 175.90 1ya7 h GLN 84 N 0.53 0.70 -0.96 0.00 4.20 -0.86 -2.82 115.11 115.90 1ya7 h GLN 84 Ca 0.01 -0.27 0.07 0.00 0.06 0.00 0.00 58.65 58.52 1ya7 h GLN 84 Cb 1.15 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.82 1ya7 h GLN 84 CO 0.12 0.86 0.62 0.00 -0.67 0.00 0.00 178.83 179.75 1ya7 h ALA 85 N 0.82 1.47 0.00 3.87 0.00 0.03 -2.16 119.26 123.29 1ya7 h ALA 85 Ca 0.09 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1ya7 h ALA 85 Cb 0.60 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1ya7 h ALA 85 CO 0.04 0.37 -0.32 0.93 0.00 0.00 0.00 179.25 180.27 1ya7 h GLU 86 N 1.08 0.00 0.28 0.00 4.39 -1.23 0.20 114.58 119.31 1ya7 h GLU 86 Ca 0.42 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.11 1ya7 h GLU 86 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1ya7 h GLU 86 CO -0.17 0.32 -0.13 1.15 -1.16 0.00 0.00 179.01 179.02 1ya7 h THR 87 N 0.00 0.76 -0.45 1.13 2.02 -1.15 -1.03 112.91 114.20 1ya7 h THR 87 Ca -0.00 -0.36 0.08 0.00 0.77 0.00 0.00 66.41 66.89 1ya7 h THR 87 Cb 0.61 0.97 -0.06 0.00 -1.74 0.00 0.00 68.15 67.93 1ya7 h THR 87 CO 0.04 0.08 0.07 0.40 0.37 0.00 0.00 175.52 176.48 1ya7 h ILE 88 N -0.56 0.73 -0.93 3.11 2.04 -1.11 -1.20 117.51 119.59 1ya7 h ILE 88 Ca -0.04 -0.07 0.05 0.00 1.00 0.00 0.00 64.86 65.80 1ya7 h ILE 88 Cb 0.41 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 36.96 1ya7 h ILE 88 CO 0.06 0.04 0.61 0.03 0.00 0.00 0.00 178.15 178.89 1ya7 h ARG 89 N 0.20 1.10 -0.20 2.37 3.08 -0.92 -1.95 114.38 118.05 1ya7 h ARG 89 Ca 0.22 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1ya7 h ARG 89 Cb 0.29 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1ya7 h ARG 89 CO -0.31 0.73 0.08 1.15 -1.07 0.00 0.00 179.97 180.55 1ya7 h THR 90 N 1.13 1.16 -0.47 2.04 2.02 -0.31 -0.34 112.91 118.15 1ya7 h THR 90 Ca 0.38 -0.48 0.03 0.00 0.77 0.00 0.00 66.41 67.11 1ya7 h THR 90 Cb 0.09 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1ya7 h THR 90 CO -0.13 0.16 0.26 0.58 0.37 0.00 0.00 175.52 176.75 1ya7 h VAL 91 N 0.18 1.01 0.33 3.16 2.07 -0.68 -1.98 116.25 120.34 1ya7 h VAL 91 Ca 0.07 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1ya7 h VAL 91 Cb 0.17 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1ya7 h VAL 91 CO -0.01 0.09 -0.16 0.40 0.02 0.00 0.00 177.57 177.92 1ya7 h ILE 92 N 0.51 0.69 0.00 4.57 2.04 -1.33 -3.31 117.51 120.69 1ya7 h ILE 92 Ca 0.20 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.65 1ya7 h ILE 92 Cb 0.06 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1ya7 h ILE 92 CO -0.11 0.07 -0.32 0.00 0.00 0.00 0.00 178.15 177.78 1ya7 h ALA 93 N -0.02 1.33 -0.00 1.87 0.00 -0.79 -0.19 119.26 121.46 1ya7 h ALA 93 Ca -0.05 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ya7 h ALA 93 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1ya7 h ALA 93 CO 0.07 0.40 -0.02 0.44 0.00 0.00 0.00 179.25 180.15 1ya7 n ILE 94 N -3.96 0.00 -0.22 0.00 -5.35 -0.77 -3.19 119.36 105.87 1ya7 n ILE 94 Ca -0.02 -0.02 0.04 0.00 -0.27 0.00 0.00 62.75 62.48 1ya7 n ILE 94 Cb 0.39 -0.40 0.10 0.00 -1.74 0.00 0.00 39.64 37.98 1ya7 n ILE 94 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1ya7 n ARG 95 N -1.10 2.83 -2.00 6.28 1.74 -0.09 -4.93 116.66 119.38 1ya7 n ARG 95 Ca 0.17 -1.92 -0.42 0.00 -0.77 0.00 0.00 57.85 54.91 1ya7 n ARG 95 Cb 0.21 -1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 30.41 1ya7 n ARG 95 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ya7 s ILE 96 N -1.26 3.56 1.00 0.55 1.01 -1.14 -4.80 121.20 120.13 1ya7 s ILE 96 Ca 0.16 0.67 -0.16 0.00 0.00 0.00 0.00 60.65 61.32 1ya7 s ILE 96 Cb 0.10 -3.47 0.20 0.00 0.01 0.00 0.00 42.46 39.30 1ya7 s ILE 96 CO 0.08 -0.10 1.22 -2.16 0.00 0.00 0.00 174.94 173.98 1ya7 s PRO 97 N 4.25 0.36 0.08 2.79 0.04 -1.26 -4.95 135.00 136.32 1ya7 s PRO 97 Ca 0.75 -0.15 -0.36 0.00 0.04 0.00 0.00 61.00 61.28 1ya7 s PRO 97 Cb -0.32 -1.79 -0.19 0.00 0.04 0.00 0.00 34.50 32.24 1ya7 s PRO 97 CO 0.30 -2.64 0.92 -1.91 0.04 0.00 0.00 177.00 173.71 1ya7 n GLU 98 N -3.99 0.15 -2.22 4.56 2.13 -1.26 -4.85 120.64 115.16 1ya7 n GLU 98 Ca 0.13 0.05 -0.43 0.00 0.66 0.00 0.00 57.16 57.57 1ya7 n GLU 98 Cb 0.60 -1.40 -0.02 0.00 0.27 0.00 0.00 31.44 30.88 1ya7 n GLU 98 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1ya7 s HIS 99 N -0.31 2.49 0.18 4.31 5.65 -1.26 -5.01 115.29 121.33 1ya7 s HIS 99 Ca 0.81 0.64 0.02 0.00 0.25 0.00 0.00 55.06 56.77 1ya7 s HIS 99 Cb -1.12 -3.70 -0.05 0.00 -1.18 0.00 0.00 32.58 26.54 1ya7 s HIS 99 CO 0.56 -2.72 0.02 0.15 -0.65 0.00 0.00 174.74 172.10 1ya7 s LYS 100 N 3.53 1.13 -0.21 2.88 1.02 -1.26 -5.04 119.74 121.78 1ya7 s LYS 100 Ca 0.64 -1.55 0.05 0.00 0.02 0.00 0.00 55.97 55.13 1ya7 s LYS 100 Cb -0.28 -0.23 0.43 0.00 -0.52 0.00 0.00 37.83 37.22 1ya7 s LYS 100 CO 0.23 -0.16 1.42 0.39 -0.92 0.00 0.00 175.35 176.31 1ya7 n GLU 101 N -0.25 2.34 -3.51 1.68 -0.58 -1.26 -4.93 120.64 114.14 1ya7 n GLU 101 Ca -0.06 -1.79 -0.09 0.00 -0.42 0.00 0.00 57.16 54.80 1ya7 n GLU 101 Cb 0.64 -1.79 -0.03 0.00 -0.57 0.00 0.00 31.44 29.69 1ya7 n GLU 101 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 1ya7 s GLU 102 N -1.96 0.83 -1.13 3.49 -1.05 -1.26 -4.98 118.70 112.64 1ya7 s GLU 102 Ca 0.33 -0.23 -0.05 0.00 -0.15 0.00 0.00 54.97 54.87 1ya7 s GLU 102 Cb 0.27 0.39 0.01 0.00 -0.44 0.00 0.00 34.13 34.35 1ya7 s GLU 102 CO 0.08 -0.35 0.97 -3.47 0.95 0.00 0.00 175.26 173.44 1ya7 n ASP 103 N -0.08 -4.30 -0.81 0.83 2.03 -1.26 -4.92 116.55 108.02 1ya7 n ASP 103 Ca -0.10 -0.50 0.05 0.00 0.52 0.00 0.00 54.79 54.76 1ya7 n ASP 103 Cb 0.61 -4.49 0.22 0.00 -0.72 0.00 0.00 41.12 36.74 1ya7 n ASP 103 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ya7 n ASN 104 N -2.61 3.14 0.03 1.67 3.02 -1.26 -4.65 115.26 114.60 1ya7 n ASN 104 Ca -0.10 -3.28 -0.11 0.00 -0.03 0.00 0.00 54.58 51.06 1ya7 n ASN 104 Cb 0.59 -0.55 0.01 0.00 -0.61 0.00 0.00 39.78 39.22 1ya7 n ASN 104 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1ya7 h LEU 105 N 1.22 0.60 -0.06 3.41 3.38 -1.91 -0.87 115.31 121.07 1ya7 h LEU 105 Ca 0.06 -0.38 -0.25 0.00 0.09 0.00 0.00 57.88 57.40 1ya7 h LEU 105 Cb 1.41 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 42.00 1ya7 h LEU 105 CO 0.22 1.13 -1.01 1.23 0.09 0.00 0.00 178.44 180.11 1ya7 h GLY 106 N 1.10 0.69 0.78 0.83 0.00 -1.82 -3.07 103.07 101.58 1ya7 h GLY 106 Ca -0.03 -1.20 0.07 0.00 0.00 0.00 0.00 47.33 46.17 1ya7 h GLY 106 CO 0.13 1.06 0.62 -2.08 0.00 0.00 0.00 176.54 176.27 1ya7 h VAL 107 N 0.35 1.07 -0.44 4.60 2.07 -1.74 -0.58 116.25 121.58 1ya7 h VAL 107 Ca -0.11 -0.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.97 1ya7 h VAL 107 Cb 1.65 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1ya7 h VAL 107 CO 0.19 0.20 0.02 0.00 0.02 0.00 0.00 177.57 178.00 1ya7 h ALA 108 N 1.48 1.21 -0.29 1.67 0.00 -1.14 -0.73 119.26 121.46 1ya7 h ALA 108 Ca 0.42 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ya7 h ALA 108 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ya7 h ALA 108 CO -0.16 0.53 0.15 0.28 0.00 0.00 0.00 179.25 180.04 1ya7 h VAL 109 N 0.67 1.15 -0.24 0.00 2.07 -1.22 -1.10 116.25 117.59 1ya7 h VAL 109 Ca 0.14 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.30 1ya7 h VAL 109 Cb 0.39 0.88 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1ya7 h VAL 109 CO 0.01 0.15 -0.05 1.56 0.02 0.00 0.00 177.57 179.26 1ya7 h GLN 110 N 0.35 0.01 -0.62 1.57 4.20 -0.57 -1.55 115.11 118.50 1ya7 h GLN 110 Ca 0.10 -0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 1ya7 h GLN 110 Cb 0.10 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 1ya7 h GLN 110 CO -0.01 0.01 0.18 0.45 -0.67 0.00 0.00 178.83 178.78 1ya7 h HIS 111 N 0.01 0.97 -0.21 2.96 3.86 -1.07 -1.63 115.15 120.04 1ya7 h HIS 111 Ca 0.11 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1ya7 h HIS 111 Cb 0.17 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1ya7 h HIS 111 CO -0.23 0.79 0.06 0.00 0.86 0.00 0.00 177.93 179.41 1ya7 h ALA 112 N 1.28 0.28 -0.50 2.45 0.00 -0.88 -1.88 119.26 120.01 1ya7 h ALA 112 Ca 0.20 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1ya7 h ALA 112 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1ya7 h ALA 112 CO -0.01 -0.10 -0.18 0.28 0.00 0.00 0.00 179.25 179.25 1ya7 h VAL 113 N 0.17 1.27 -0.73 0.00 2.07 -1.17 -2.46 116.25 115.40 1ya7 h VAL 113 Ca 0.07 -1.33 0.05 0.00 0.82 0.00 0.00 66.70 66.30 1ya7 h VAL 113 Cb 0.24 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1ya7 h VAL 113 CO -0.00 0.46 0.48 -0.07 0.02 0.00 0.00 177.57 178.46 1ya7 h LEU 114 N 0.86 0.72 -0.38 2.57 3.38 -1.25 -1.79 115.31 119.43 1ya7 h LEU 114 Ca 0.12 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1ya7 h LEU 114 Cb 0.75 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1ya7 h LEU 114 CO 0.06 0.48 0.01 0.50 0.09 0.00 0.00 178.44 179.58 1ya7 h LYS 115 N 0.83 0.66 -0.36 1.13 3.64 -1.01 0.14 116.57 121.60 1ya7 h LYS 115 Ca 0.30 -0.21 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1ya7 h LYS 115 Cb 0.15 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1ya7 h LYS 115 CO -0.09 0.76 -0.15 0.97 -2.27 0.00 0.00 179.45 178.67 1ya7 h ILE 116 N 0.48 1.25 -0.37 2.00 2.10 -1.03 -0.62 117.51 121.32 1ya7 h ILE 116 Ca 0.11 -1.16 -0.15 0.00 1.08 0.00 0.00 64.86 64.74 1ya7 h ILE 116 Cb 0.46 1.14 -0.01 0.00 -1.09 0.00 0.00 36.82 37.32 1ya7 h ILE 116 CO 0.02 0.38 -0.35 0.40 -1.08 0.00 0.00 178.15 177.53 1ya7 h ILE 117 N 0.58 1.28 -0.59 2.19 2.04 -1.15 -1.20 117.51 120.66 1ya7 h ILE 117 Ca 0.10 -1.51 0.04 0.00 1.00 0.00 0.00 64.86 64.49 1ya7 h ILE 117 Cb 0.59 1.36 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1ya7 h ILE 117 CO 0.04 0.50 0.33 0.44 0.00 0.00 0.00 178.15 179.46 1ya7 h ASP 118 N 0.71 0.50 -0.40 1.72 3.32 -0.55 -0.52 116.42 121.19 1ya7 h ASP 118 Ca 0.07 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.19 1ya7 h ASP 118 Cb 0.91 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.33 1ya7 h ASP 118 CO 0.08 0.34 0.12 -0.08 -1.72 0.00 0.00 179.24 177.98 1ya7 h GLU 119 N 0.63 0.27 -0.39 3.56 4.81 -0.77 0.32 114.58 123.00 1ya7 h GLU 119 Ca 0.25 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 1ya7 h GLU 119 Cb 0.12 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1ya7 h GLU 119 CO -0.15 0.18 0.19 1.25 -0.73 0.00 0.00 179.01 179.75 1ya7 h LEU 120 N 0.28 0.28 -0.00 1.64 5.85 -0.78 0.13 115.31 122.71 1ya7 h LEU 120 Ca 0.19 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1ya7 h LEU 120 Cb 0.19 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1ya7 h LEU 120 CO -0.21 0.21 -0.01 -0.33 -0.34 0.00 0.00 178.44 177.75 1ya7 h GLU 121 N 0.40 0.01 0.01 1.25 5.08 -0.86 -1.64 114.58 118.82 1ya7 h GLU 121 Ca 0.17 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1ya7 h GLU 121 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1ya7 h GLU 121 CO -0.12 0.70 -0.00 0.82 -1.00 0.00 0.00 179.01 179.41 1ya7 h ILE 122 N -0.67 0.90 0.00 3.13 1.08 -0.35 -3.23 117.51 118.37 1ya7 h ILE 122 Ca -0.00 -1.65 -0.08 0.00 -0.39 0.00 0.00 64.86 62.74 1ya7 h ILE 122 Cb 0.70 1.68 -0.01 0.00 -3.07 0.00 0.00 36.82 36.13 1ya7 h ILE 122 CO 0.00 0.30 -0.54 0.11 -0.69 0.00 0.00 178.15 177.34 1ya7 h LYS 123 N -0.99 0.00 -0.38 2.37 1.57 -0.93 -2.95 116.57 115.26 1ya7 h LYS 123 Ca -0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1ya7 h LYS 123 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1ya7 h LYS 123 CO 0.00 0.69 -0.02 1.15 -0.57 0.00 0.00 179.45 180.70 1ya7 h THR 124 N -1.00 1.26 -0.00 -0.16 2.02 -1.16 -3.14 112.91 110.73 1ya7 h THR 124 Ca -0.13 -1.03 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1ya7 h THR 124 Cb 0.88 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 1ya7 h THR 124 CO -0.08 0.34 -0.50 0.18 0.37 0.00 0.00 175.52 175.83 1ya7 n LEU 125 N -4.45 0.85 -3.91 2.58 4.77 -0.62 -4.83 117.00 111.39 1ya7 n LEU 125 Ca -0.01 -0.21 -0.26 0.00 -0.03 0.00 0.00 56.01 55.50 1ya7 n LEU 125 Cb 0.30 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1ya7 n LEU 125 CO 0.41 0.18 -0.15 0.61 -1.33 0.00 0.00 177.39 177.11 1ya7 n GLY 126 N 1.45 -0.28 0.19 -0.72 0.00 -1.11 -0.38 105.19 104.33 1ya7 n GLY 126 Ca 0.07 0.14 0.08 0.00 0.00 0.00 0.00 46.02 46.31 1ya7 n GLY 126 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ya7 h SER 127 N -1.84 0.00 -4.31 1.61 4.64 -1.64 -3.27 113.55 108.75 1ya7 h SER 127 Ca -0.62 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.20 1ya7 h SER 127 Cb 1.37 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.52 1ya7 h SER 127 CO 0.63 0.26 0.40 -0.83 -0.87 0.00 0.00 176.83 176.42 1ya7 s GLY 128 N -4.33 1.79 0.19 -0.77 0.00 -1.26 -4.99 107.32 97.94 1ya7 s GLY 128 Ca 0.04 0.04 -0.04 0.00 0.00 0.00 0.00 44.72 44.77 1ya7 s GLY 128 CO 0.69 0.32 1.51 0.83 0.00 0.00 0.00 173.10 176.46 1ya7 h GLU 129 N -0.06 0.59 -4.49 2.90 5.08 -2.01 -3.43 114.58 113.16 1ya7 h GLU 129 Ca -0.45 -0.36 -0.46 0.00 -1.00 0.00 0.00 59.36 57.10 1ya7 h GLU 129 Cb 1.19 0.04 -0.32 0.00 0.50 0.00 0.00 28.75 30.16 1ya7 h GLU 129 CO 0.61 0.96 -0.80 0.15 -1.00 0.00 0.00 179.01 178.93 1ya7 s LYS 130 N -4.05 1.23 0.41 2.33 1.02 -1.26 -5.15 119.74 114.27 1ya7 s LYS 130 Ca -0.08 -0.31 -0.21 0.00 0.02 0.00 0.00 55.97 55.39 1ya7 s LYS 130 Cb 0.11 -1.10 -0.11 0.00 -0.52 0.00 0.00 37.83 36.22 1ya7 s LYS 130 CO 0.84 0.05 0.93 -1.54 -0.92 0.00 0.00 175.35 174.71 1ya7 s SER 131 N 0.51 6.97 0.40 2.83 1.04 -1.26 -5.08 113.70 119.11 1ya7 s SER 131 Ca -0.09 1.66 0.00 0.00 0.48 0.00 0.00 55.95 58.00 1ya7 s SER 131 Cb -0.13 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.47 1ya7 s SER 131 CO 0.02 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1ya7 n GLY 132 N -0.46 -0.48 0.15 7.32 0.00 -1.26 -4.87 105.19 105.59 1ya7 n GLY 132 Ca 0.06 -1.72 0.12 0.00 0.00 0.00 0.00 46.02 44.48 1ya7 n GLY 132 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ya7 n SER 133 N -1.43 0.65 0.00 1.61 3.41 -1.26 -1.02 113.62 115.57 1ya7 n SER 133 Ca 0.00 0.73 0.10 0.00 -0.26 0.00 0.00 58.87 59.44 1ya7 n SER 133 Cb 0.00 -0.84 0.59 0.00 -0.26 0.00 0.00 64.21 63.70 1ya7 n SER 133 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ya7 n GLY 134 N -0.65 -0.67 7.00 5.00 0.00 -1.26 -5.01 105.19 109.60 1ya7 n GLY 134 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1ya7 n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ya7 n GLY 135 N 0.28 0.02 2.66 -0.02 0.00 -0.19 -4.61 105.19 103.33 1ya7 n GLY 135 Ca 0.14 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 1ya7 n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ya7 s ALA 136 N -1.43 1.59 -0.38 4.61 0.00 -1.26 -4.24 121.76 120.64 1ya7 s ALA 136 Ca 0.00 -2.02 0.27 0.00 0.00 0.00 0.00 51.96 50.21 1ya7 s ALA 136 Cb 0.00 -1.70 0.92 0.00 0.00 0.00 0.00 23.12 22.33 1ya7 s ALA 136 CO 0.00 -1.90 1.78 -1.00 0.00 0.00 0.00 175.76 174.64 1ya7 h PRO 137 N 7.39 0.00 -6.93 0.00 0.13 -1.84 -3.45 132.00 127.31 1ya7 h PRO 137 Ca -0.05 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.58 1ya7 h PRO 137 Cb 0.97 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.13 1ya7 h PRO 137 CO 0.43 0.00 0.44 -0.08 -0.23 0.00 0.00 178.00 178.56 1ya7 s THR 138 N -3.33 3.57 0.28 1.56 -1.32 -1.26 -4.95 115.64 110.20 1ya7 s THR 138 Ca 0.06 1.30 -0.02 0.00 -1.21 0.00 0.00 61.69 61.81 1ya7 s THR 138 Cb 0.09 -3.72 0.27 0.00 -1.51 0.00 0.00 72.50 67.63 1ya7 s THR 138 CO 0.54 0.10 1.93 -0.65 -2.21 0.00 0.00 174.62 174.32 1ya7 h PRO 139 N 2.79 1.13 -2.68 7.08 0.11 -1.88 -3.44 132.00 135.11 1ya7 h PRO 139 Ca -0.48 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 65.45 1ya7 h PRO 139 Cb 1.22 -0.25 -0.23 0.00 0.11 0.00 0.00 31.00 31.85 1ya7 h PRO 139 CO 0.63 0.75 -0.18 -1.50 -0.21 0.00 0.00 178.00 177.49 1ya7 s ILE 140 N -5.98 0.01 0.00 4.15 2.07 -1.26 -4.92 121.20 115.27 1ya7 s ILE 140 Ca -0.12 -0.09 0.00 0.00 -1.41 0.00 0.00 60.65 59.03 1ya7 s ILE 140 Cb 0.19 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 42.13 1ya7 s ILE 140 CO 0.80 -0.05 0.00 0.61 -1.91 0.00 0.00 174.94 174.39 1ya7 n GLY 141 N 2.40 0.69 0.31 1.50 0.00 -1.26 -4.84 105.19 103.98 1ya7 n GLY 141 Ca -0.15 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 43.98 1ya7 n GLY 141 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1ya7 h MET 142 N 0.00 0.46 -1.92 1.61 1.85 -0.76 -3.18 114.93 112.99 1ya7 h MET 142 Ca 0.00 -0.03 -0.73 0.00 -0.61 0.00 0.00 59.70 58.33 1ya7 h MET 142 Cb 0.00 -0.10 -0.31 0.00 0.43 0.00 0.00 31.60 31.62 1ya7 h MET 142 CO 0.00 0.30 0.62 0.66 -0.40 0.00 0.00 176.91 178.10 1ya7 n TYR 143 N -4.48 3.09 0.05 1.39 4.02 -1.26 -4.69 117.16 115.28 1ya7 n TYR 143 Ca 0.04 -2.56 -0.10 0.00 -0.01 0.00 0.00 57.90 55.27 1ya7 n TYR 143 Cb 0.11 -0.92 -0.13 0.00 -0.02 0.00 0.00 39.34 38.38 1ya7 n TYR 143 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1ya7 h ALA 144 N 3.00 0.40 -0.02 -0.72 0.00 -1.91 -2.25 119.26 117.76 1ya7 h ALA 144 Ca 0.50 -1.05 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1ya7 h ALA 144 Cb 0.26 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ya7 h ALA 144 CO 1.27 1.27 0.01 1.25 0.00 0.00 0.00 179.25 183.06 1ya7 h LEU 145 N 0.02 0.02 -1.06 0.00 5.85 -1.83 -1.49 115.31 116.81 1ya7 h LEU 145 Ca -0.11 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.57 1ya7 h LEU 145 Cb 1.88 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.87 1ya7 h LEU 145 CO 0.13 0.02 0.29 -0.09 -0.34 0.00 0.00 178.44 178.45 1ya7 h ARG 146 N 0.01 0.96 -0.13 1.25 2.43 -1.93 -1.83 114.38 115.15 1ya7 h ARG 146 Ca 0.01 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.05 1ya7 h ARG 146 Cb 0.00 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1ya7 h ARG 146 CO -0.00 0.76 0.04 0.93 -1.51 0.00 0.00 179.97 180.19 1ya7 h GLU 147 N 0.95 0.10 0.47 0.20 5.08 -1.26 -1.71 114.58 118.42 1ya7 h GLU 147 Ca 0.23 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1ya7 h GLU 147 Cb 0.14 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1ya7 h GLU 147 CO -0.03 0.07 -0.22 -0.92 -1.00 0.00 0.00 179.01 176.91 1ya7 h TYR 148 N 0.11 -0.58 -0.86 4.33 3.20 -1.11 -1.60 116.97 120.45 1ya7 h TYR 148 Ca 0.05 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1ya7 h TYR 148 Cb 0.03 0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 1ya7 h TYR 148 CO -0.10 -0.36 0.57 -0.07 -1.64 0.00 0.00 178.16 176.55 1ya7 h LEU 149 N -0.64 0.95 -0.37 2.82 3.38 -1.34 0.14 115.31 120.26 1ya7 h LEU 149 Ca -0.06 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1ya7 h LEU 149 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ya7 h LEU 149 CO 0.11 0.67 -0.00 -1.28 0.09 0.00 0.00 178.44 178.03 1ya7 h SER 150 N 1.12 0.65 -0.43 -0.43 0.87 -1.26 -0.47 113.55 113.59 1ya7 h SER 150 Ca 0.33 -0.31 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1ya7 h SER 150 Cb -0.05 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.71 1ya7 h SER 150 CO -0.08 0.80 0.17 0.00 -0.53 0.00 0.00 176.83 177.18 1ya7 h ALA 151 N 0.87 0.55 -0.21 6.23 0.00 -0.65 -2.97 119.26 123.09 1ya7 h ALA 151 Ca 0.11 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1ya7 h ALA 151 Cb 0.47 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ya7 h ALA 151 CO 0.02 0.16 -0.10 -0.09 0.00 0.00 0.00 179.25 179.24 1ya7 h ARG 152 N 0.54 0.44 -0.25 0.00 2.43 -0.71 -3.11 114.38 113.72 1ya7 h ARG 152 Ca 0.14 -0.19 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1ya7 h ARG 152 Cb 0.19 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1ya7 h ARG 152 CO -0.01 0.72 0.17 0.66 -1.51 0.00 0.00 179.97 180.00 1ya7 h SER 153 N 0.14 0.23 -0.44 -3.80 4.64 -1.09 0.27 113.55 113.51 1ya7 h SER 153 Ca 0.05 -0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.24 1ya7 h SER 153 Cb 0.59 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 1ya7 h SER 153 CO 0.03 0.16 -0.20 0.74 -0.87 0.00 0.00 176.83 176.70 1ya7 h THR 154 N 0.27 1.27 -0.10 2.95 2.02 -1.45 -1.28 112.91 116.60 1ya7 h THR 154 Ca 0.10 -1.34 -0.16 0.00 0.77 0.00 0.00 66.41 65.78 1ya7 h THR 154 Cb 0.06 1.20 0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1ya7 h THR 154 CO -0.02 0.46 -0.55 0.58 0.37 0.00 0.00 175.52 176.36 1ya7 h VAL 155 N 0.74 1.36 -0.82 3.16 2.07 -1.27 -2.88 116.25 118.61 1ya7 h VAL 155 Ca 0.10 -1.87 0.01 0.00 0.82 0.00 0.00 66.70 65.76 1ya7 h VAL 155 Cb 0.76 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.71 1ya7 h VAL 155 CO 0.06 0.56 0.55 -0.33 0.02 0.00 0.00 177.57 178.43 1ya7 h GLU 156 N 0.15 1.08 -0.48 1.57 5.08 -0.45 -1.63 114.58 119.90 1ya7 h GLU 156 Ca -0.04 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1ya7 h GLU 156 Cb 1.20 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 1ya7 h GLU 156 CO 0.11 0.71 0.21 0.22 -1.00 0.00 0.00 179.01 179.27 1ya7 h ASP 157 N 1.11 0.64 -0.17 1.42 3.58 -1.24 -0.22 116.42 121.54 1ya7 h ASP 157 Ca 0.30 -0.15 -0.06 0.00 0.42 0.00 0.00 57.03 57.54 1ya7 h ASP 157 Cb -0.12 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 1ya7 h ASP 157 CO -0.07 0.61 -0.08 0.11 -2.88 0.00 0.00 179.24 176.93 1ya7 h LYS 158 N 0.63 0.50 -0.15 0.28 1.57 -1.27 -1.81 116.57 116.32 1ya7 h LYS 158 Ca 0.16 -0.13 -0.21 0.00 -1.87 0.00 0.00 60.65 58.60 1ya7 h LYS 158 Cb 0.15 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.41 1ya7 h LYS 158 CO -0.02 0.59 -0.74 -0.07 -0.57 0.00 0.00 179.45 178.65 1ya7 h LEU 159 N 0.47 0.85 0.06 2.94 3.38 -0.95 0.43 115.31 122.50 1ya7 h LEU 159 Ca 0.09 -0.54 -0.27 0.00 0.09 0.00 0.00 57.88 57.25 1ya7 h LEU 159 Cb 0.44 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1ya7 h LEU 159 CO 0.02 1.33 -1.36 -0.07 0.09 0.00 0.00 178.44 178.45 1ya7 h LEU 160 N 0.50 0.21 0.00 1.67 3.38 -0.98 -3.33 115.31 116.77 1ya7 h LEU 160 Ca -0.04 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1ya7 h LEU 160 Cb 1.35 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1ya7 h LEU 160 CO 0.15 1.23 0.00 0.61 0.09 0.00 0.00 178.44 180.52 1ya7 n GLY 161 N 1.53 -0.25 0.00 0.83 0.00 -0.69 -4.03 105.19 102.59 1ya7 n GLY 161 Ca -0.10 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1ya7 n GLY 161 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ya7 n GLY 172 N 0.00 0.00 3.76 -0.02 0.00 -1.26 -5.07 105.19 102.59 1ya7 n GLY 172 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1ya7 n GLY 172 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ya7 s GLY 173 N 0.00 2.83 0.34 -0.02 0.00 -1.26 -4.93 107.32 104.29 1ya7 s GLY 173 Ca 0.00 1.16 -0.28 0.00 0.00 0.00 0.00 44.72 45.60 1ya7 s GLY 173 CO 0.00 1.63 1.30 -1.26 0.00 0.00 0.00 173.10 174.78 1ya7 n SER 174 N -0.98 2.83 -1.32 1.64 2.88 0.15 -4.92 113.62 113.90 1ya7 n SER 174 Ca 0.10 1.21 0.11 0.00 -1.33 0.00 0.00 58.87 58.97 1ya7 n SER 174 Cb 0.47 -1.49 0.31 0.00 -0.75 0.00 0.00 64.21 62.75 1ya7 n SER 174 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ya7 n GLN 175 N 0.55 2.74 -1.65 -1.46 1.13 -1.26 -4.81 117.38 112.62 1ya7 n GLN 175 Ca 0.04 -2.63 -0.43 0.00 -1.94 0.00 0.00 57.00 52.04 1ya7 n GLN 175 Cb 0.36 -1.55 -0.03 0.00 0.11 0.00 0.00 30.24 29.13 1ya7 n GLN 175 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1ya7 n SER 176 N 1.59 3.94 0.04 1.08 2.88 -1.26 -4.89 113.62 117.00 1ya7 n SER 176 Ca 0.24 0.78 -0.02 0.00 -1.33 0.00 0.00 58.87 58.55 1ya7 n SER 176 Cb 0.61 -1.52 0.25 0.00 -0.75 0.00 0.00 64.21 62.80 1ya7 n SER 176 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1ya7 h PRO 177 N 11.26 0.42 0.00 -1.46 0.13 -2.01 -3.15 132.00 137.20 1ya7 h PRO 177 Ca -0.48 -0.14 -0.12 0.00 -0.87 0.00 0.00 66.00 64.39 1ya7 h PRO 177 Cb 1.24 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1ya7 h PRO 177 CO 0.95 0.62 -0.56 0.77 -0.23 0.00 0.00 178.00 179.54 1ya7 h SER 178 N 0.38 0.00 -0.14 1.44 0.02 -1.99 -2.49 113.55 110.77 1ya7 h SER 178 Ca 0.06 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.92 1ya7 h SER 178 Cb 0.59 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 1ya7 h SER 178 CO 0.04 0.56 -0.20 0.25 -1.14 0.00 0.00 176.83 176.34 1ya7 h LEU 179 N 0.00 0.56 -0.30 5.07 5.85 -1.95 0.27 115.31 124.81 1ya7 h LEU 179 Ca -0.01 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 1ya7 h LEU 179 Cb 1.11 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 1ya7 h LEU 179 CO 0.07 0.77 -0.19 0.25 -0.34 0.00 0.00 178.44 179.01 1ya7 h LEU 180 N 0.51 0.69 -1.23 2.25 5.85 -1.47 -2.82 115.31 119.08 1ya7 h LEU 180 Ca 0.08 -0.43 -0.07 0.00 0.84 0.00 0.00 57.88 58.30 1ya7 h LEU 180 Cb 0.63 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1ya7 h LEU 180 CO 0.04 0.97 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.77 1ya7 h LEU 181 N 0.41 0.18 -1.18 2.25 3.38 -1.22 -2.73 115.31 116.39 1ya7 h LEU 181 Ca 0.06 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1ya7 h LEU 181 Cb 0.73 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1ya7 h LEU 181 CO 0.05 0.45 0.10 -0.08 0.09 0.00 0.00 178.44 179.05 1ya7 h GLU 182 N 0.16 0.67 -0.21 1.13 4.81 -0.36 -1.35 114.58 119.43 1ya7 h GLU 182 Ca 0.03 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1ya7 h GLU 182 Cb 0.57 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 1ya7 h GLU 182 CO 0.04 0.62 -0.02 1.25 -0.73 0.00 0.00 179.01 180.17 1ya7 h LEU 183 N 0.65 -0.12 -1.31 1.64 5.85 -1.23 0.29 115.31 121.08 1ya7 h LEU 183 Ca 0.15 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.92 1ya7 h LEU 183 Cb 0.26 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1ya7 h LEU 183 CO -0.00 -0.03 0.47 -0.09 -0.34 0.00 0.00 178.44 178.44 1ya7 h ARG 184 N 0.04 0.93 -0.27 1.25 2.43 -1.57 -2.70 114.38 114.50 1ya7 h ARG 184 Ca 0.10 -0.06 -0.17 0.00 -0.81 0.00 0.00 59.98 59.04 1ya7 h ARG 184 Cb 0.13 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1ya7 h ARG 184 CO -0.18 0.62 -0.51 0.37 -1.51 0.00 0.00 179.97 178.76 1ya7 h GLN 185 N 0.96 0.76 -0.22 0.20 5.75 -0.15 -0.16 115.11 122.26 1ya7 h GLN 185 Ca 0.26 -0.46 0.02 0.00 -0.15 0.00 0.00 58.65 58.32 1ya7 h GLN 185 Cb -0.11 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 1ya7 h GLN 185 CO -0.06 1.09 0.08 0.82 -2.65 0.00 0.00 178.83 178.11 1ya7 h ILE 186 N 0.59 0.96 0.05 2.39 2.04 -0.41 0.13 117.51 123.26 1ya7 h ILE 186 Ca 0.02 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1ya7 h ILE 186 Cb 1.08 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1ya7 h ILE 186 CO 0.11 0.03 -0.15 0.44 0.00 0.00 0.00 178.15 178.58 1ya7 h ASP 187 N 0.19 -0.44 0.05 1.72 3.32 -1.23 -2.01 116.42 118.02 1ya7 h ASP 187 Ca 0.09 0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1ya7 h ASP 187 Cb 0.05 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1ya7 h ASP 187 CO -0.09 -0.22 -0.03 0.00 -1.72 0.00 0.00 179.24 177.19 1ya7 h ALA 188 N 0.62 -0.07 -0.53 3.45 0.00 -0.97 -3.08 119.26 118.68 1ya7 h ALA 188 Ca 0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ya7 h ALA 188 Cb 0.32 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1ya7 h ALA 188 CO -0.11 -0.53 0.26 -0.44 0.00 0.00 0.00 179.25 178.43 1ya7 h ASP 189 N -0.10 0.67 -0.20 0.00 5.19 -0.66 -0.55 116.42 120.77 1ya7 h ASP 189 Ca -0.01 -0.06 -0.14 0.00 -0.62 0.00 0.00 57.03 56.20 1ya7 h ASP 189 Cb 0.08 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 1ya7 h ASP 189 CO 0.01 0.57 -0.38 -0.26 -3.12 0.00 0.00 179.24 176.06 1ya7 h PHE 190 N 0.74 0.87 -0.70 4.55 -1.00 -1.39 0.26 116.94 120.29 1ya7 h PHE 190 Ca 0.19 -0.25 -0.08 0.00 2.81 0.00 0.00 57.97 60.64 1ya7 h PHE 190 Cb 0.08 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.42 1ya7 h PHE 190 CO 0.01 1.00 0.14 0.52 -1.61 0.00 0.00 178.31 178.36 1ya7 h MET 191 N 0.61 1.13 0.29 1.51 2.86 -1.36 -0.79 114.93 119.18 1ya7 h MET 191 Ca 0.05 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.39 1ya7 h MET 191 Cb 0.92 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.44 1ya7 h MET 191 CO 0.08 1.01 -0.14 1.25 1.06 0.00 0.00 176.91 180.18 1ya7 h LEU 192 N 1.06 -0.32 -0.84 1.22 5.85 -0.82 -1.77 115.31 119.69 1ya7 h LEU 192 Ca 0.21 -0.02 0.14 0.00 0.84 0.00 0.00 57.88 59.05 1ya7 h LEU 192 Cb 0.41 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.43 1ya7 h LEU 192 CO 0.01 -0.19 0.44 0.11 -0.34 0.00 0.00 178.44 178.46 1ya7 h LYS 193 N -0.43 0.62 -0.47 1.25 1.57 -0.41 -0.76 116.57 117.94 1ya7 h LYS 193 Ca -0.04 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1ya7 h LYS 193 Cb 0.33 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1ya7 h LYS 193 CO 0.06 0.41 0.30 0.28 -0.57 0.00 0.00 179.45 179.94 1ya7 h VAL 194 N 0.64 1.09 -0.56 0.50 2.07 -0.92 0.57 116.25 119.64 1ya7 h VAL 194 Ca 0.45 -0.21 0.07 0.00 0.82 0.00 0.00 66.70 67.83 1ya7 h VAL 194 Cb 0.61 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 1ya7 h VAL 194 CO -0.35 0.11 0.25 -0.33 0.02 0.00 0.00 177.57 177.27 1ya7 h GLU 195 N 0.61 0.46 -0.15 1.57 5.08 -0.39 -1.23 114.58 120.52 1ya7 h GLU 195 Ca 0.18 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1ya7 h GLU 195 Cb -0.04 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1ya7 h GLU 195 CO -0.06 0.30 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.08 1ya7 h LEU 196 N 0.47 0.36 -0.24 1.33 3.38 -1.08 -2.87 115.31 116.66 1ya7 h LEU 196 Ca 0.26 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1ya7 h LEU 196 Cb 0.24 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1ya7 h LEU 196 CO -0.22 0.72 0.14 0.00 0.09 0.00 0.00 178.44 179.17 1ya7 h ALA 197 N 0.65 0.30 -0.82 1.53 0.00 -0.79 0.53 119.26 120.65 1ya7 h ALA 197 Ca 0.03 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1ya7 h ALA 197 Cb 0.60 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 1ya7 h ALA 197 CO 0.03 -0.20 0.52 1.79 0.00 0.00 0.00 179.25 181.39 1ya7 h THR 198 N 0.30 1.08 0.04 0.00 1.35 -1.31 0.88 112.91 115.24 1ya7 h THR 198 Ca 0.08 -0.33 0.01 0.00 -0.55 0.00 0.00 66.41 65.62 1ya7 h THR 198 Cb 0.01 0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 66.45 1ya7 h THR 198 CO -0.02 0.18 -0.06 0.74 -0.25 0.00 0.00 175.52 176.11 1ya7 h THR 199 N 0.97 0.86 -0.81 6.82 2.02 -1.24 -0.76 112.91 120.76 1ya7 h THR 199 Ca 0.34 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.52 1ya7 h THR 199 Cb 0.09 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 1ya7 h THR 199 CO -0.14 0.00 0.48 -0.74 0.37 0.00 0.00 175.52 175.49 1ya7 h HIS 200 N -0.12 1.08 -0.56 3.16 6.17 -0.23 -2.86 115.15 121.80 1ya7 h HIS 200 Ca 0.01 -0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.03 1ya7 h HIS 200 Cb 0.13 -0.35 -0.02 0.00 2.52 0.00 0.00 27.41 29.68 1ya7 h HIS 200 CO -0.11 0.73 0.11 1.25 0.71 0.00 0.00 177.93 180.62 1ya7 h LEU 201 N 1.12 0.82 -0.61 0.26 5.85 0.10 -2.83 115.31 120.02 1ya7 h LEU 201 Ca 0.29 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1ya7 h LEU 201 Cb -0.03 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.76 1ya7 h LEU 201 CO -0.05 0.82 0.29 0.28 -0.34 0.00 0.00 178.44 179.43 1ya7 h SER 202 N 0.83 0.80 -0.44 1.25 0.02 -0.92 -1.07 113.55 114.02 1ya7 h SER 202 Ca 0.18 -0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1ya7 h SER 202 Cb 0.33 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.63 1ya7 h SER 202 CO 0.00 0.71 0.23 0.74 -1.14 0.00 0.00 176.83 177.38 1ya7 h THR 203 N 0.84 0.99 -0.09 -2.27 2.02 -1.38 -0.35 112.91 112.67 1ya7 h THR 203 Ca 0.21 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 1ya7 h THR 203 Cb 0.12 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1ya7 h THR 203 CO -0.03 0.09 0.04 -0.03 0.37 0.00 0.00 175.52 175.96 1ya7 h MET 204 N 0.47 0.13 -0.15 6.66 -1.53 -1.25 -0.55 114.93 118.72 1ya7 h MET 204 Ca 0.19 -0.02 0.02 0.00 -3.44 0.00 0.00 59.70 56.44 1ya7 h MET 204 Cb 0.07 -0.02 -0.02 0.00 -0.55 0.00 0.00 31.60 31.08 1ya7 h MET 204 CO -0.12 0.23 0.03 0.28 0.14 0.00 0.00 176.91 177.48 1ya7 h VAL 205 N 0.01 0.94 -0.53 -5.77 2.07 -1.09 0.15 116.25 112.03 1ya7 h VAL 205 Ca 0.03 -0.03 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1ya7 h VAL 205 Cb 0.15 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1ya7 h VAL 205 CO -0.00 0.02 0.32 0.03 0.02 0.00 0.00 177.57 177.96 1ya7 h ARG 206 N 0.10 0.62 -0.88 1.57 3.08 -0.95 -0.66 114.38 117.26 1ya7 h ARG 206 Ca 0.06 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1ya7 h ARG 206 Cb 0.05 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 1ya7 h ARG 206 CO -0.08 0.41 0.50 0.00 -1.07 0.00 0.00 179.97 179.73 1ya7 h ALA 207 N 1.23 1.24 -0.49 0.04 0.00 -0.75 -2.08 119.26 118.46 1ya7 h ALA 207 Ca 0.21 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1ya7 h ALA 207 Cb 0.02 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1ya7 h ALA 207 CO -0.09 0.64 -0.02 0.28 0.00 0.00 0.00 179.25 180.05 1ya7 h VAL 208 N 1.22 1.27 -0.05 0.00 2.07 -0.08 -1.57 116.25 119.11 1ya7 h VAL 208 Ca 0.31 -1.11 0.03 0.00 0.82 0.00 0.00 66.70 66.75 1ya7 h VAL 208 Cb -0.01 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1ya7 h VAL 208 CO -0.05 0.39 -0.15 0.40 0.02 0.00 0.00 177.57 178.17 1ya7 h ILE 209 N 0.73 0.62 -0.23 4.57 2.04 -0.96 0.13 117.51 124.41 1ya7 h ILE 209 Ca 0.14 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.00 1ya7 h ILE 209 Cb 0.55 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1ya7 h ILE 209 CO 0.03 0.00 0.13 -1.13 0.00 0.00 0.00 178.15 177.18 1ya7 h ASN 210 N -0.23 0.21 -0.82 1.72 -1.24 -1.40 -1.69 115.58 112.13 1ya7 h ASN 210 Ca 0.07 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.08 1ya7 h ASN 210 Cb 0.32 -0.04 -0.04 0.00 0.73 0.00 0.00 38.32 39.29 1ya7 h ASN 210 CO -0.18 0.15 0.53 0.00 -1.29 0.00 0.00 177.43 176.65 1ya7 h ALA 211 N 1.10 1.04 -0.07 1.57 0.00 -0.88 -2.38 119.26 119.64 1ya7 h ALA 211 Ca 0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1ya7 h ALA 211 Cb -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1ya7 h ALA 211 CO -0.05 0.46 -0.08 -0.92 0.00 0.00 0.00 179.25 178.66 1ya7 h TYR 212 N 1.11 0.20 -0.02 0.00 3.20 -0.56 -2.65 116.97 118.25 1ya7 h TYR 212 Ca 0.30 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 1ya7 h TYR 212 Cb -0.11 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 1ya7 h TYR 212 CO -0.01 0.63 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.84 1ya7 h LEU 213 N -0.28 0.04 0.00 2.82 3.38 -1.25 0.21 115.31 120.22 1ya7 h LEU 213 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ya7 h LEU 213 Cb 0.61 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1ya7 h LEU 213 CO 0.02 0.27 -0.32 -0.07 0.09 0.00 0.00 178.44 178.43 1ya7 h LEU 214 N 0.04 0.00 -1.29 1.67 3.38 -1.42 -3.37 115.31 114.32 1ya7 h LEU 214 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ya7 h LEU 214 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1ya7 h LEU 214 CO 0.03 0.02 0.00 0.59 0.09 0.00 0.00 178.44 179.17 1ya7 n ASN 215 N -2.67 1.12 0.12 -0.43 3.02 -0.77 -4.84 115.26 110.80 1ya7 n ASN 215 Ca 0.03 -1.16 0.06 0.00 -0.03 0.00 0.00 54.58 53.48 1ya7 n ASN 215 Cb 0.50 0.00 0.52 0.00 -0.61 0.00 0.00 39.78 40.19 1ya7 n ASN 215 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1ya7 h TRP 216 N 0.00 0.29 -0.40 3.10 5.08 -1.15 -2.39 115.95 120.48 1ya7 h TRP 216 Ca 0.00 0.01 -0.05 0.00 1.08 0.00 0.00 58.89 59.93 1ya7 h TRP 216 Cb 0.11 -0.10 -0.02 0.00 -3.00 0.00 0.00 29.16 26.15 1ya7 h TRP 216 CO 0.00 0.18 0.07 0.87 -1.28 0.00 0.00 178.44 178.28 1ya7 h LYS 217 N 0.31 0.66 -0.06 0.12 1.57 -1.88 -1.59 116.57 115.70 1ya7 h LYS 217 Ca 0.08 -0.18 -0.13 0.00 -1.87 0.00 0.00 60.65 58.56 1ya7 h LYS 217 Cb -0.03 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1ya7 h LYS 217 CO -0.02 0.71 -0.54 0.87 -0.57 0.00 0.00 179.45 179.90 1ya7 h LYS 218 N 0.51 0.16 -0.75 3.15 1.79 -1.68 0.66 116.57 120.41 1ya7 h LYS 218 Ca 0.12 -0.10 0.03 0.00 -2.18 0.00 0.00 60.65 58.52 1ya7 h LYS 218 Cb 0.36 0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.98 1ya7 h LYS 218 CO 0.01 0.66 0.47 -0.07 -1.08 0.00 0.00 179.45 179.44 1ya7 h LEU 219 N 0.12 0.78 0.13 2.94 3.38 -0.91 -1.54 115.31 120.21 1ya7 h LEU 219 Ca 0.00 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1ya7 h LEU 219 Cb 0.99 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.58 1ya7 h LEU 219 CO 0.08 0.54 -1.11 0.40 0.09 0.00 0.00 178.44 178.44 1ya7 h ILE 220 N 0.93 1.27 -2.83 1.22 1.08 -1.17 -3.42 117.51 114.60 1ya7 h ILE 220 Ca 0.30 -2.47 -0.61 0.00 -0.39 0.00 0.00 64.86 61.69 1ya7 h ILE 220 Cb 0.01 2.95 -0.40 0.00 -3.07 0.00 0.00 36.82 36.30 1ya7 h ILE 220 CO -0.11 0.70 -0.73 -1.58 -0.69 0.00 0.00 178.15 175.74 1ya7 s GLN 221 N -2.45 1.77 0.20 2.37 0.74 0.21 -4.98 119.66 117.52 1ya7 s GLN 221 Ca -0.17 -2.75 0.23 0.00 0.05 0.00 0.00 55.36 52.72 1ya7 s GLN 221 Cb 0.03 -2.59 0.91 0.00 1.10 0.00 0.00 33.01 32.46 1ya7 s GLN 221 CO 0.80 -1.30 1.69 -0.35 -0.55 0.00 0.00 175.29 175.57 1ya7 n PRO 222 N 2.48 0.17 -4.28 1.67 -0.04 -0.58 -4.32 135.00 130.10 1ya7 n PRO 222 Ca 0.22 0.35 -0.21 0.00 -0.04 0.00 0.00 63.50 63.82 1ya7 n PRO 222 Cb 0.39 -1.79 -0.16 0.00 -0.04 0.00 0.00 33.50 31.90 1ya7 n PRO 222 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1ya7 s ARG 223 N -3.22 1.01 -0.70 0.54 0.52 -1.26 -3.35 118.95 112.48 1ya7 s ARG 223 Ca 0.06 -0.19 -0.03 0.00 -0.52 0.00 0.00 55.73 55.05 1ya7 s ARG 223 Cb 0.10 -0.94 0.18 0.00 0.52 0.00 0.00 34.95 34.81 1ya7 s ARG 223 CO 0.41 -0.03 0.54 0.99 0.02 0.00 0.00 175.30 177.23 1ya7 s THR 224 N 0.74 3.98 -1.14 0.02 2.01 -1.26 -5.05 115.64 114.95 1ya7 s THR 224 Ca -0.11 -3.17 -0.10 0.00 0.31 0.00 0.00 61.69 58.61 1ya7 s THR 224 Cb -0.14 -3.55 0.25 0.00 0.01 0.00 0.00 72.50 69.07 1ya7 s THR 224 CO 0.01 -0.94 1.20 -0.83 -0.69 0.00 0.00 174.62 173.37 1ya7 s GLY 225 N 0.54 3.01 -0.19 4.40 0.00 -1.26 -4.96 107.32 108.85 1ya7 s GLY 225 Ca 0.20 -3.72 -0.02 0.00 0.00 0.00 0.00 44.72 41.18 1ya7 s GLY 225 CO -0.06 1.53 0.01 -1.35 0.00 0.00 0.00 173.10 173.23 1ya7 s SER 226 N 1.73 2.99 -0.43 1.64 1.04 -1.26 -5.13 113.70 114.29 1ya7 s SER 226 Ca 0.34 -0.83 -0.21 0.00 0.48 0.00 0.00 55.95 55.73 1ya7 s SER 226 Cb -0.08 -0.70 0.02 0.00 0.10 0.00 0.00 66.02 65.36 1ya7 s SER 226 CO -0.06 -0.28 0.65 -0.62 0.98 0.00 0.00 173.24 173.91 1ya7 s ASP 227 N 1.77 6.34 0.00 7.02 -1.08 -1.26 -4.91 116.67 124.56 1ya7 s ASP 227 Ca -0.01 -0.26 0.27 0.00 -0.52 0.00 0.00 52.55 52.02 1ya7 s ASP 227 Cb -0.17 -2.33 0.81 0.00 -1.46 0.00 0.00 42.92 39.77 1ya7 s ASP 227 CO -0.07 -0.77 1.61 1.41 0.52 0.00 0.00 175.17 177.87 1ya7 n HIS 228 N 6.27 0.00 0.11 -5.34 8.25 -1.26 -4.00 115.22 119.25 1ya7 n HIS 228 Ca -0.01 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.46 1ya7 n HIS 228 Cb 0.48 -0.24 -0.01 0.00 1.12 0.00 0.00 29.99 31.35 1ya7 n HIS 228 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1ya7 h MET 229 N 0.42 0.00 -6.01 -0.41 2.86 -2.08 -3.46 114.93 106.26 1ya7 h MET 229 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 1ya7 h MET 229 Cb 0.47 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.10 1ya7 h MET 229 CO 0.00 0.49 -0.48 0.08 1.06 0.00 0.00 176.91 178.06 1ya7 s VAL 230 N -2.94 5.34 0.00 -2.22 1.01 -1.26 -5.35 120.40 114.99 1ya7 s VAL 230 Ca 0.02 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.41 1ya7 s VAL 230 Cb 0.08 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1ya7 s VAL 230 CO 0.76 -0.02 0.00 -0.24 0.00 0.00 0.00 175.10 175.60