#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 0.71 -0.25 1.64 3.08 -2.06 -1.73 114.38 115.78 1ya7 h ARG 5 Ca 0.00 -0.48 -0.11 0.00 0.07 0.00 0.00 59.98 59.46 1ya7 h ARG 5 Cb 0.00 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1ya7 h ARG 5 CO 0.00 1.10 -0.29 0.00 -1.07 0.00 0.00 179.97 179.71 1ya7 h ALA 6 N 0.61 1.03 -0.57 0.04 0.00 -2.05 -1.57 119.26 116.75 1ya7 h ALA 6 Ca -0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1ya7 h ALA 6 Cb 1.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1ya7 h ALA 6 CO 0.11 0.58 0.13 0.00 0.00 0.00 0.00 179.25 180.07 1ya7 h ALA 7 N 1.25 0.75 -0.87 0.00 0.00 -1.95 0.01 119.26 118.47 1ya7 h ALA 7 Ca 0.06 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ya7 h ALA 7 Cb 0.73 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1ya7 h ALA 7 CO 0.06 0.47 0.54 -0.07 0.00 0.00 0.00 179.25 180.24 1ya7 h LEU 8 N 0.82 1.03 -0.15 0.00 3.38 -1.03 0.72 115.31 120.09 1ya7 h LEU 8 Ca 0.18 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1ya7 h LEU 8 Cb 0.36 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ya7 h LEU 8 CO 0.00 0.78 -0.04 0.40 0.09 0.00 0.00 178.44 179.67 1ya7 h ILE 9 N 1.19 1.29 -0.61 1.22 1.08 -1.12 -2.43 117.51 118.14 1ya7 h ILE 9 Ca 0.31 -1.01 0.08 0.00 -0.39 0.00 0.00 64.86 63.85 1ya7 h ILE 9 Cb -0.07 1.66 -0.06 0.00 -3.07 0.00 0.00 36.82 35.28 1ya7 h ILE 9 CO -0.06 0.30 0.27 -0.61 -0.69 0.00 0.00 178.15 177.35 1ya7 h GLN 10 N -0.02 0.47 -0.80 2.37 4.15 -0.84 -1.50 115.11 118.94 1ya7 h GLN 10 Ca 0.04 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 1ya7 h GLN 10 Cb 0.48 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 28.02 1ya7 h GLN 10 CO 0.02 0.31 0.44 -0.91 -1.93 0.00 0.00 178.83 176.76 1ya7 h ASN 11 N 0.49 0.99 0.06 -0.69 2.35 -0.84 -0.34 115.58 117.60 1ya7 h ASN 11 Ca 0.30 -0.09 0.01 0.00 -0.55 0.00 0.00 56.30 55.97 1ya7 h ASN 11 Cb 0.31 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1ya7 h ASN 11 CO -0.26 0.80 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.11 1ya7 h LEU 12 N 1.11 -0.39 -0.28 1.61 3.38 -0.96 -2.72 115.31 117.05 1ya7 h LEU 12 Ca 0.28 0.05 -0.21 0.00 0.09 0.00 0.00 57.88 58.10 1ya7 h LEU 12 Cb 0.02 0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ya7 h LEU 12 CO -0.05 -0.20 -0.80 0.03 0.09 0.00 0.00 178.44 177.51 1ya7 h ARG 13 N -0.27 0.50 0.00 1.13 3.08 -1.12 -2.46 114.38 115.25 1ya7 h ARG 13 Ca 0.03 -0.44 -0.06 0.00 0.07 0.00 0.00 59.98 59.57 1ya7 h ARG 13 Cb 0.30 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1ya7 h ARG 13 CO -0.10 1.08 -0.29 -0.44 -1.07 0.00 0.00 179.97 179.15 1ya7 h ASP 14 N 0.33 0.00 0.88 7.04 3.32 -1.13 -3.02 116.42 123.84 1ya7 h ASP 14 Ca -0.05 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 1ya7 h ASP 14 Cb 1.41 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 1ya7 h ASP 14 CO 0.15 0.29 -0.27 0.77 -1.72 0.00 0.00 179.24 178.46 1ya7 h SER 15 N 0.00 0.00 -2.64 6.45 4.64 -1.11 -3.40 113.55 117.50 1ya7 h SER 15 Ca -0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.81 1ya7 h SER 15 Cb 0.54 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.25 1ya7 h SER 15 CO 0.04 0.27 -0.77 -0.31 -0.87 0.00 0.00 176.83 175.19 1ya7 s TYR 16 N -3.65 0.25 0.53 4.77 1.51 -1.14 -5.05 117.35 114.57 1ya7 s TYR 16 Ca 0.00 -0.90 0.05 0.00 -1.01 0.00 0.00 57.07 55.21 1ya7 s TYR 16 Cb 0.11 -0.82 0.02 0.00 -0.11 0.00 0.00 41.96 41.16 1ya7 s TYR 16 CO 0.65 -0.85 0.31 0.95 -1.11 0.00 0.00 175.55 175.50 1ya7 s THR 17 N 1.95 1.58 0.36 -0.71 -4.23 -1.24 -4.68 115.64 108.67 1ya7 s THR 17 Ca 0.11 -1.61 0.09 0.00 -1.18 0.00 0.00 61.69 59.09 1ya7 s THR 17 Cb -0.17 -2.19 0.32 0.00 1.34 0.00 0.00 72.50 71.80 1ya7 s THR 17 CO -0.29 0.00 1.88 -0.08 -0.54 0.00 0.00 174.62 175.59 1ya7 h GLU 18 N 0.91 0.68 -0.90 3.99 4.22 -1.95 -1.52 114.58 120.01 1ya7 h GLU 18 Ca -0.39 -0.04 0.09 0.00 0.08 0.00 0.00 59.36 59.10 1ya7 h GLU 18 Cb 1.30 -0.15 -0.07 0.00 0.50 0.00 0.00 28.75 30.33 1ya7 h GLU 18 CO 0.61 0.45 0.55 1.15 -2.18 0.00 0.00 179.01 179.59 1ya7 h THR 19 N 0.70 0.96 -0.81 0.32 2.02 -1.98 0.21 112.91 114.34 1ya7 h THR 19 Ca 0.43 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 1ya7 h THR 19 Cb 0.65 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1ya7 h THR 19 CO -0.19 0.17 0.39 0.28 0.37 0.00 0.00 175.52 176.54 1ya7 h SER 20 N 0.93 1.06 0.45 4.18 0.02 -1.66 -0.95 113.55 117.58 1ya7 h SER 20 Ca 0.42 -0.12 -0.31 0.00 -0.84 0.00 0.00 61.79 60.94 1ya7 h SER 20 Cb 0.33 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 1ya7 h SER 20 CO -0.23 0.89 -1.53 0.77 -1.14 0.00 0.00 176.83 175.59 1ya7 h SER 21 N 1.15 0.40 -0.80 3.07 4.64 -1.39 -3.06 113.55 117.57 1ya7 h SER 21 Ca 0.28 -0.55 0.06 0.00 -0.47 0.00 0.00 61.79 61.12 1ya7 h SER 21 Cb 0.11 -0.13 -0.06 0.00 -0.31 0.00 0.00 62.40 62.01 1ya7 h SER 21 CO -0.04 1.46 0.48 0.15 -0.87 0.00 0.00 176.83 178.01 1ya7 h PHE 22 N 0.07 0.88 -0.39 4.77 3.57 -0.54 -1.96 116.94 123.35 1ya7 h PHE 22 Ca -0.24 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.25 1ya7 h PHE 22 Cb 2.02 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.46 1ya7 h PHE 22 CO 0.06 0.43 0.11 0.00 -2.23 0.00 0.00 178.31 176.68 1ya7 h ALA 23 N 1.39 1.47 -0.42 2.41 0.00 -1.16 -0.83 119.26 122.13 1ya7 h ALA 23 Ca 0.35 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1ya7 h ALA 23 Cb 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ya7 h ALA 23 CO -0.18 0.39 0.09 0.28 0.00 0.00 0.00 179.25 179.83 1ya7 h VAL 24 N 0.55 1.24 -0.55 0.00 2.07 -1.32 -1.93 116.25 116.31 1ya7 h VAL 24 Ca 0.13 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.78 1ya7 h VAL 24 Cb 0.19 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1ya7 h VAL 24 CO -0.01 0.29 0.19 0.40 0.02 0.00 0.00 177.57 178.47 1ya7 h ILE 25 N 0.55 1.23 -0.53 4.57 1.08 -0.47 0.65 117.51 124.58 1ya7 h ILE 25 Ca 0.13 -0.75 0.01 0.00 -0.39 0.00 0.00 64.86 63.86 1ya7 h ILE 25 Cb 0.34 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 1ya7 h ILE 25 CO 0.00 0.28 0.35 -0.33 -0.69 0.00 0.00 178.15 177.76 1ya7 h GLU 26 N 0.75 0.68 -0.43 2.37 5.08 -1.20 -0.50 114.58 121.34 1ya7 h GLU 26 Ca 0.18 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1ya7 h GLU 26 Cb 0.25 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1ya7 h GLU 26 CO -0.01 0.45 0.18 1.49 -1.00 0.00 0.00 179.01 180.12 1ya7 h GLU 27 N 0.71 0.63 -0.89 2.33 4.57 -0.82 -2.88 114.58 118.23 1ya7 h GLU 27 Ca 0.20 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1ya7 h GLU 27 Cb -0.06 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.38 1ya7 h GLU 27 CO -0.05 0.58 0.52 -1.49 -1.18 0.00 0.00 179.01 177.39 1ya7 h TRP 28 N 0.55 1.18 0.00 0.92 6.55 -0.55 -1.93 115.95 122.67 1ya7 h TRP 28 Ca 0.14 -0.01 -0.01 0.00 0.95 0.00 0.00 58.89 59.96 1ya7 h TRP 28 Cb 0.18 -0.38 -0.00 0.00 -0.86 0.00 0.00 29.16 28.09 1ya7 h TRP 28 CO -0.00 0.79 -0.04 0.00 -1.05 0.00 0.00 178.44 178.14 1ya7 h ALA 29 N 1.35 1.01 -3.00 1.49 0.00 -0.97 -3.16 119.26 115.99 1ya7 h ALA 29 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ya7 h ALA 29 Cb -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ya7 h ALA 29 CO -0.06 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1ya7 n ALA 30 N -2.12 1.11 -0.21 0.00 0.00 -1.02 -4.81 120.51 113.46 1ya7 n ALA 30 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 1ya7 n ALA 30 Cb 0.32 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.24 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 0.87 0.29 0.00 0.00 -1.68 -2.70 103.07 99.85 1ya7 h GLY 31 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 1ya7 h GLY 31 CO 0.00 0.06 -0.02 -0.84 0.00 0.00 0.00 176.54 175.74 1ya7 h THR 32 N 0.49 1.35 -0.95 4.70 2.02 -1.52 -2.14 112.91 116.86 1ya7 h THR 32 Ca 0.41 -1.53 0.13 0.00 0.77 0.00 0.00 66.41 66.18 1ya7 h THR 32 Cb 0.86 2.32 -0.08 0.00 -1.74 0.00 0.00 68.15 69.52 1ya7 h THR 32 CO -0.15 0.37 0.60 -0.07 0.37 0.00 0.00 175.52 176.64 1ya7 h LEU 33 N -0.77 0.81 -0.35 2.58 3.38 -1.51 -0.60 115.31 118.85 1ya7 h LEU 33 Ca -0.01 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1ya7 h LEU 33 Cb 0.65 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1ya7 h LEU 33 CO 0.01 0.43 0.11 1.56 0.09 0.00 0.00 178.44 180.64 1ya7 h GLN 34 N 0.87 0.53 -0.34 1.13 4.20 -1.50 -0.83 115.11 119.18 1ya7 h GLN 34 Ca 0.47 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 59.06 1ya7 h GLN 34 Cb 0.57 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1ya7 h GLN 34 CO -0.23 0.55 0.16 1.49 -0.67 0.00 0.00 178.83 180.13 1ya7 h GLU 35 N 0.41 0.49 -0.41 1.46 4.57 -0.95 0.10 114.58 120.25 1ya7 h GLU 35 Ca 0.11 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 58.27 1ya7 h GLU 35 Cb 0.24 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.70 1ya7 h GLU 35 CO -0.00 0.45 0.15 0.82 -1.18 0.00 0.00 179.01 179.25 1ya7 h ILE 36 N 0.41 0.89 -0.60 2.32 2.04 -1.05 -0.33 117.51 121.19 1ya7 h ILE 36 Ca 0.12 -0.11 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1ya7 h ILE 36 Cb 0.13 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 1ya7 h ILE 36 CO -0.01 0.06 0.33 -0.08 0.00 0.00 0.00 178.15 178.45 1ya7 h GLU 37 N 0.32 0.62 -0.56 2.37 4.57 -0.80 0.83 114.58 121.94 1ya7 h GLU 37 Ca 0.19 -0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 1ya7 h GLU 37 Cb 0.16 -0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 1ya7 h GLU 37 CO -0.18 0.41 0.26 0.78 -1.18 0.00 0.00 179.01 179.10 1ya7 h GLY 38 N 0.64 0.78 0.91 1.92 0.00 -0.12 -1.86 103.07 105.34 1ya7 h GLY 38 Ca 0.26 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1ya7 h GLY 38 CO -0.15 0.08 0.08 -2.22 0.00 0.00 0.00 176.54 174.32 1ya7 h ILE 39 N 0.49 1.22 -0.51 2.60 2.04 -0.51 -2.19 117.51 120.65 1ya7 h ILE 39 Ca 0.26 -0.74 0.10 0.00 1.00 0.00 0.00 64.86 65.48 1ya7 h ILE 39 Cb 0.22 1.07 -0.09 0.00 -0.74 0.00 0.00 36.82 37.28 1ya7 h ILE 39 CO -0.21 0.25 -0.02 0.00 0.00 0.00 0.00 178.15 178.17 1ya7 h ALA 40 N 0.92 0.46 -0.32 1.87 0.00 -0.56 -0.36 119.26 121.27 1ya7 h ALA 40 Ca 0.10 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.19 1ya7 h ALA 40 Cb 0.30 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ya7 h ALA 40 CO 0.00 -0.40 0.19 0.87 0.00 0.00 0.00 179.25 179.91 1ya7 h LYS 41 N 0.09 0.38 -0.62 0.00 1.57 -1.27 -1.48 116.57 115.23 1ya7 h LYS 41 Ca 0.26 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.95 1ya7 h LYS 41 Cb 0.39 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1ya7 h LYS 41 CO -0.45 0.25 0.15 0.00 -0.57 0.00 0.00 179.45 178.83 1ya7 h ALA 42 N 1.14 1.09 -0.49 3.86 0.00 -0.90 -0.50 119.26 123.46 1ya7 h ALA 42 Ca 0.12 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1ya7 h ALA 42 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1ya7 h ALA 42 CO -0.05 0.61 0.15 0.00 0.00 0.00 0.00 179.25 179.95 1ya7 h ALA 43 N 1.23 0.64 -0.55 0.00 0.00 -0.86 -0.98 119.26 118.74 1ya7 h ALA 43 Ca 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ya7 h ALA 43 Cb 0.33 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1ya7 h ALA 43 CO -0.00 0.30 0.29 0.00 0.00 0.00 0.00 179.25 179.84 1ya7 h ALA 44 N 1.01 0.71 0.04 0.00 0.00 -0.92 0.20 119.26 120.30 1ya7 h ALA 44 Ca 0.16 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ya7 h ALA 44 Cb 0.28 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ya7 h ALA 44 CO -0.00 0.25 -0.08 0.93 0.00 0.00 0.00 179.25 180.34 1ya7 h GLU 45 N 0.74 -0.16 -0.96 0.00 5.08 -0.99 -0.56 114.58 117.74 1ya7 h GLU 45 Ca 0.19 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1ya7 h GLU 45 Cb 0.07 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 1ya7 h GLU 45 CO -0.03 -0.11 0.64 0.00 -1.00 0.00 0.00 179.01 178.51 1ya7 h ALA 46 N 0.78 1.22 -0.66 3.43 0.00 -1.00 -2.37 119.26 120.65 1ya7 h ALA 46 Ca 0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ya7 h ALA 46 Cb 0.18 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1ya7 h ALA 46 CO -0.05 0.61 0.36 1.25 0.00 0.00 0.00 179.25 181.42 1ya7 h HIS 47 N 1.30 0.92 -0.61 0.00 -0.00 -0.65 -2.54 115.15 113.57 1ya7 h HIS 47 Ca 0.35 -0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.72 1ya7 h HIS 47 Cb -0.15 -0.29 -0.04 0.00 -0.00 0.00 0.00 27.41 26.93 1ya7 h HIS 47 CO -0.00 0.66 0.38 0.78 -0.00 0.00 0.00 177.93 179.75 1ya7 h GLY 48 N 0.91 0.87 1.06 5.26 0.00 -0.65 -1.33 103.07 109.19 1ya7 h GLY 48 Ca 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1ya7 h GLY 48 CO -0.04 0.26 0.55 -2.08 0.00 0.00 0.00 176.54 175.23 1ya7 h VAL 49 N 0.76 1.25 -0.23 4.60 2.07 -1.21 -2.60 116.25 120.90 1ya7 h VAL 49 Ca 0.24 -0.55 -0.18 0.00 0.82 0.00 0.00 66.70 67.02 1ya7 h VAL 49 Cb -0.01 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.73 1ya7 h VAL 49 CO -0.09 0.27 -0.58 0.40 0.02 0.00 0.00 177.57 177.59 1ya7 h ILE 50 N 1.26 1.29 -0.36 4.57 2.04 -1.09 -3.18 117.51 122.04 1ya7 h ILE 50 Ca 0.33 -1.78 -0.04 0.00 1.00 0.00 0.00 64.86 64.37 1ya7 h ILE 50 Cb -0.05 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1ya7 h ILE 50 CO -0.06 0.57 0.06 -0.09 0.00 0.00 0.00 178.15 178.63 1ya7 h ARG 51 N 0.54 0.53 -1.19 2.37 2.43 -1.12 -1.83 114.38 116.11 1ya7 h ARG 51 Ca -0.01 -0.09 -0.18 0.00 -0.81 0.00 0.00 59.98 58.88 1ya7 h ARG 51 Cb 1.20 -0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 30.56 1ya7 h ARG 51 CO 0.13 0.51 0.24 0.09 -1.51 0.00 0.00 179.97 179.42 1ya7 n ASN 52 N -4.32 4.07 -4.15 -3.80 3.02 -0.99 -4.90 115.26 104.19 1ya7 n ASN 52 Ca 0.02 -2.62 -0.22 0.00 -0.03 0.00 0.00 54.58 51.72 1ya7 n ASN 52 Cb 0.20 -0.75 -0.14 0.00 -0.61 0.00 0.00 39.78 38.49 1ya7 n ASN 52 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1ya7 s SER 53 N 0.39 1.84 -0.16 6.41 0.01 -0.69 -5.01 113.70 116.50 1ya7 s SER 53 Ca 0.19 -0.37 -0.07 0.00 1.31 0.00 0.00 55.95 57.02 1ya7 s SER 53 Cb 0.16 -0.17 -0.04 0.00 0.21 0.00 0.00 66.02 66.18 1ya7 s SER 53 CO 0.02 0.13 0.07 -0.89 0.41 0.00 0.00 173.24 172.99 1ya7 s THR 54 N -0.58 4.90 -0.15 1.44 2.01 -1.26 -5.04 115.64 116.97 1ya7 s THR 54 Ca 0.05 -0.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.98 1ya7 s THR 54 Cb -0.07 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 1ya7 s THR 54 CO 0.00 0.51 0.08 -0.31 -0.69 0.00 0.00 174.62 174.21 1ya7 s TYR 55 N -0.07 3.35 0.05 4.92 1.51 -1.26 -5.07 117.35 120.78 1ya7 s TYR 55 Ca 0.07 0.25 0.00 0.00 -1.01 0.00 0.00 57.07 56.38 1ya7 s TYR 55 Cb -0.12 -1.99 0.00 0.00 -0.11 0.00 0.00 41.96 39.74 1ya7 s TYR 55 CO 0.01 0.40 0.01 0.41 -1.11 0.00 0.00 175.55 175.26 1ya7 n GLY 56 N 2.81 3.92 0.20 0.71 0.00 -1.26 -4.98 105.19 106.60 1ya7 n GLY 56 Ca -0.18 -2.22 0.15 0.00 0.00 0.00 0.00 46.02 43.77 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 0.00 0.00 1.61 2.43 -1.98 -2.21 114.38 114.23 1ya7 h ARG 57 Ca -0.04 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 1ya7 h ARG 57 Cb 0.13 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1ya7 h ARG 57 CO 0.07 0.00 -0.14 0.00 -1.51 0.00 0.00 179.97 178.39 1ya7 h ALA 58 N 2.12 1.45 0.00 2.80 0.00 -2.00 -2.39 119.26 121.24 1ya7 h ALA 58 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ya7 h ALA 58 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ya7 h ALA 58 CO 0.00 0.17 0.00 1.96 0.00 0.00 0.00 179.25 181.38 1ya7 h GLN 59 N 0.00 0.00 -0.00 0.00 7.50 -1.71 -2.44 115.11 118.46 1ya7 h GLN 59 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1ya7 h GLN 59 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.84 1ya7 h GLN 59 CO 0.02 0.00 -0.34 0.00 -1.50 0.00 0.00 178.83 177.01 1ya7 n ALA 60 N -1.88 3.17 -0.02 3.87 0.00 -0.90 -4.13 120.51 120.62 1ya7 n ALA 60 Ca 0.03 -0.28 0.07 0.00 0.00 0.00 0.00 53.44 53.26 1ya7 n ALA 60 Cb 0.36 -1.22 -0.16 0.00 0.00 0.00 0.00 19.45 18.43 1ya7 n ALA 60 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ya7 n GLU 61 N -1.45 0.66 -4.71 0.00 1.02 -0.92 -4.87 120.64 110.36 1ya7 n GLU 61 Ca 0.06 -0.14 -0.30 0.00 -0.02 0.00 0.00 57.16 56.77 1ya7 n GLU 61 Cb 0.33 -1.55 -0.14 0.00 -0.02 0.00 0.00 31.44 30.07 1ya7 n GLU 61 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ya7 s LYS 62 N -3.32 1.64 -0.18 3.49 1.02 -1.19 -5.13 119.74 116.07 1ya7 s LYS 62 Ca -0.08 -1.19 -0.16 0.00 0.02 0.00 0.00 55.97 54.56 1ya7 s LYS 62 Cb 0.12 -1.93 -0.04 0.00 -0.52 0.00 0.00 37.83 35.46 1ya7 s LYS 62 CO 0.89 0.48 0.40 0.45 -0.92 0.00 0.00 175.35 176.65 1ya7 s SER 63 N -1.54 6.49 -0.24 2.83 0.15 -1.26 -4.81 113.70 115.31 1ya7 s SER 63 Ca 0.12 0.57 -0.29 0.00 0.70 0.00 0.00 55.95 57.06 1ya7 s SER 63 Cb -0.10 -2.24 -0.02 0.00 -1.71 0.00 0.00 66.02 61.95 1ya7 s SER 63 CO 0.03 -0.04 1.62 -2.16 1.20 0.00 0.00 173.24 173.89 1ya7 s PRO 64 N 1.07 3.75 0.34 5.44 0.04 -1.26 -4.89 135.00 139.49 1ya7 s PRO 64 Ca 0.20 1.60 0.02 0.00 0.04 0.00 0.00 61.00 62.86 1ya7 s PRO 64 Cb -0.15 -4.04 0.61 0.00 0.04 0.00 0.00 34.50 30.96 1ya7 s PRO 64 CO 0.08 -1.35 2.00 0.93 0.04 0.00 0.00 177.00 178.70 1ya7 h GLU 65 N 10.87 0.85 -0.77 4.56 3.07 -1.99 -2.53 114.58 128.63 1ya7 h GLU 65 Ca -0.33 -0.06 0.01 0.00 -0.50 0.00 0.00 59.36 58.48 1ya7 h GLU 65 Cb 1.15 -0.19 -0.04 0.00 -0.84 0.00 0.00 28.75 28.83 1ya7 h GLU 65 CO 1.01 0.58 0.51 0.37 -1.40 0.00 0.00 179.01 180.07 1ya7 h GLN 66 N 0.87 1.01 -0.05 2.33 4.15 -1.99 -0.44 115.11 120.99 1ya7 h GLN 66 Ca 0.23 -0.06 -0.15 0.00 0.77 0.00 0.00 58.65 59.45 1ya7 h GLN 66 Cb -0.08 -0.23 0.01 0.00 0.21 0.00 0.00 27.48 27.39 1ya7 h GLN 66 CO -0.05 0.67 -0.54 -0.07 -1.93 0.00 0.00 178.83 176.91 1ya7 h LEU 67 N 1.04 0.57 -0.76 -2.39 3.38 -1.92 -2.02 115.31 113.22 1ya7 h LEU 67 Ca 0.29 -0.70 0.13 0.00 0.09 0.00 0.00 57.88 57.69 1ya7 h LEU 67 Cb -0.11 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 40.38 1ya7 h LEU 67 CO -0.07 1.18 0.33 -0.07 0.09 0.00 0.00 178.44 179.90 1ya7 h LEU 68 N 0.00 0.34 -0.92 1.67 3.38 -1.31 -0.88 115.31 117.59 1ya7 h LEU 68 Ca -0.05 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1ya7 h LEU 68 Cb 1.21 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 1ya7 h LEU 68 CO 0.11 0.15 -0.04 1.23 0.09 0.00 0.00 178.44 179.98 1ya7 h GLY 69 N 0.49 0.81 1.04 0.83 0.00 -1.00 0.05 103.07 105.28 1ya7 h GLY 69 Ca 0.41 -0.56 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 1ya7 h GLY 69 CO -0.37 0.51 0.04 -2.08 0.00 0.00 0.00 176.54 174.64 1ya7 h VAL 70 N 0.70 1.26 -0.35 4.60 2.07 -0.54 -1.90 116.25 122.09 1ya7 h VAL 70 Ca 0.13 -1.06 -0.11 0.00 0.82 0.00 0.00 66.70 66.48 1ya7 h VAL 70 Cb 0.48 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1ya7 h VAL 70 CO 0.02 0.38 -0.22 -0.07 0.02 0.00 0.00 177.57 177.71 1ya7 h LEU 71 N 0.86 0.80 -0.27 2.57 3.38 -1.02 -1.06 115.31 120.58 1ya7 h LEU 71 Ca 0.17 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.74 1ya7 h LEU 71 Cb 0.49 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1ya7 h LEU 71 CO 0.02 1.06 0.09 -0.61 0.09 0.00 0.00 178.44 179.09 1ya7 h GLN 72 N 0.56 0.21 -0.69 1.13 5.75 -0.97 -0.47 115.11 120.62 1ya7 h GLN 72 Ca 0.07 -0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.61 1ya7 h GLN 72 Cb 0.78 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.23 1ya7 h GLN 72 CO 0.06 0.14 0.41 -0.09 -2.65 0.00 0.00 178.83 176.70 1ya7 h ARG 73 N 0.22 0.76 -0.28 1.69 2.43 -1.25 -0.48 114.38 117.47 1ya7 h ARG 73 Ca 0.12 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1ya7 h ARG 73 Cb 0.08 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1ya7 h ARG 73 CO -0.12 0.50 0.13 -0.92 -1.51 0.00 0.00 179.97 178.06 1ya7 h TYR 74 N 0.78 0.25 -0.54 2.20 3.20 -0.80 -2.39 116.97 119.67 1ya7 h TYR 74 Ca 0.30 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.17 1ya7 h TYR 74 Cb 0.11 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 1ya7 h TYR 74 CO -0.06 0.13 0.31 0.37 -1.64 0.00 0.00 178.16 177.28 1ya7 h GLN 75 N 0.28 0.74 -0.75 1.82 4.15 -0.65 -1.11 115.11 119.59 1ya7 h GLN 75 Ca 0.12 -0.08 0.03 0.00 0.77 0.00 0.00 58.65 59.48 1ya7 h GLN 75 Cb 0.04 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.54 1ya7 h GLN 75 CO -0.08 0.55 0.48 -0.44 -1.93 0.00 0.00 178.83 177.41 1ya7 h ASP 76 N 0.72 0.80 -0.53 -0.69 3.32 -0.99 -0.45 116.42 118.59 1ya7 h ASP 76 Ca 0.19 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 1ya7 h ASP 76 Cb 0.02 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.36 1ya7 h ASP 76 CO -0.03 0.56 0.24 0.25 -1.72 0.00 0.00 179.24 178.53 1ya7 h LEU 77 N 0.94 0.71 -0.62 1.55 6.46 -1.02 -1.48 115.31 121.84 1ya7 h LEU 77 Ca 0.30 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.90 1ya7 h LEU 77 Cb -0.01 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 39.71 1ya7 h LEU 77 CO -0.10 0.65 0.35 0.00 -0.62 0.00 0.00 178.44 178.72 1ya7 h HIS 79 N 0.85 -0.56 -0.65 0.00 -0.00 -0.88 0.79 115.15 114.70 1ya7 h HIS 79 Ca 0.22 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.57 1ya7 h HIS 79 Cb 0.04 0.28 -0.03 0.00 -0.00 0.00 0.00 27.41 27.70 1ya7 h HIS 79 CO -0.01 -0.29 0.21 -0.91 -0.00 0.00 0.00 177.93 176.93 1ya7 h ASN 80 N -0.23 0.94 -0.26 3.26 2.35 -0.70 -2.43 115.58 118.51 1ya7 h ASN 80 Ca 0.13 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 1ya7 h ASN 80 Cb 0.42 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 1ya7 h ASN 80 CO -0.35 0.90 0.12 0.58 -1.65 0.00 0.00 177.43 177.03 1ya7 h VAL 81 N 0.94 1.16 -0.59 2.81 2.07 -0.85 -1.96 116.25 119.82 1ya7 h VAL 81 Ca 0.21 -0.45 0.11 0.00 0.82 0.00 0.00 66.70 67.38 1ya7 h VAL 81 Cb 0.29 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 30.95 1ya7 h VAL 81 CO -0.01 0.16 0.15 0.22 0.02 0.00 0.00 177.57 178.10 1ya7 h TYR 82 N 0.29 0.24 -0.40 1.57 3.20 -0.66 0.23 116.97 121.43 1ya7 h TYR 82 Ca 0.09 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.85 1ya7 h TYR 82 Cb 0.14 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1ya7 h TYR 82 CO -0.02 -0.00 -0.30 0.00 -1.64 0.00 0.00 178.16 176.20 1ya7 h GLN 84 N 0.74 0.28 -0.78 0.00 4.20 -1.06 -2.42 115.11 116.07 1ya7 h GLN 84 Ca 0.08 -0.08 0.11 0.00 0.06 0.00 0.00 58.65 58.82 1ya7 h GLN 84 Cb 0.87 -0.03 -0.08 0.00 0.30 0.00 0.00 27.48 28.54 1ya7 h GLN 84 CO 0.08 0.45 0.41 0.00 -0.67 0.00 0.00 178.83 179.10 1ya7 h ALA 85 N 0.82 1.12 -0.53 3.87 0.00 -0.34 -1.64 119.26 122.56 1ya7 h ALA 85 Ca 0.05 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1ya7 h ALA 85 Cb 0.31 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1ya7 h ALA 85 CO 0.00 -0.02 0.35 0.93 0.00 0.00 0.00 179.25 180.51 1ya7 h GLU 86 N 0.65 0.58 0.06 0.00 4.39 -0.90 -1.38 114.58 117.98 1ya7 h GLU 86 Ca 0.40 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.06 1ya7 h GLU 86 Cb 0.45 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1ya7 h GLU 86 CO -0.29 0.38 -0.05 1.15 -1.16 0.00 0.00 179.01 179.03 1ya7 h THR 87 N 0.60 0.88 -0.85 1.13 2.02 -0.81 -0.49 112.91 115.39 1ya7 h THR 87 Ca 0.21 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.42 1ya7 h THR 87 Cb 0.11 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 1ya7 h THR 87 CO -0.06 0.00 0.55 0.40 0.37 0.00 0.00 175.52 176.79 1ya7 h ILE 88 N -0.12 1.16 -0.20 3.11 2.04 -1.19 -1.34 117.51 120.96 1ya7 h ILE 88 Ca 0.00 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1ya7 h ILE 88 Cb 0.12 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1ya7 h ILE 88 CO -0.01 0.20 0.08 -0.09 0.00 0.00 0.00 178.15 178.33 1ya7 h ARG 89 N 1.09 0.29 -0.38 2.37 2.43 -1.19 -2.12 114.38 116.87 1ya7 h ARG 89 Ca 0.33 -0.05 0.08 0.00 -0.81 0.00 0.00 59.98 59.53 1ya7 h ARG 89 Cb -0.04 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.38 1ya7 h ARG 89 CO -0.10 0.34 -0.17 1.15 -1.51 0.00 0.00 179.97 179.68 1ya7 h THR 90 N 0.17 0.47 -0.98 0.20 2.02 -0.81 0.47 112.91 114.46 1ya7 h THR 90 Ca 0.07 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.35 1ya7 h THR 90 Cb 0.16 0.47 -0.08 0.00 -1.74 0.00 0.00 68.15 66.96 1ya7 h THR 90 CO -0.01 0.00 0.61 0.58 0.37 0.00 0.00 175.52 177.08 1ya7 h VAL 91 N -0.10 0.96 0.02 3.16 2.07 -0.97 -1.38 116.25 120.01 1ya7 h VAL 91 Ca 0.19 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1ya7 h VAL 91 Cb 0.39 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1ya7 h VAL 91 CO -0.45 0.18 -0.01 0.40 0.02 0.00 0.00 177.57 177.72 1ya7 h ILE 92 N 1.01 1.35 -0.42 4.57 2.04 -1.15 -3.34 117.51 121.57 1ya7 h ILE 92 Ca 0.47 -1.88 0.06 0.00 1.00 0.00 0.00 64.86 64.51 1ya7 h ILE 92 Cb 0.40 2.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.94 1ya7 h ILE 92 CO -0.24 0.43 0.28 0.00 0.00 0.00 0.00 178.15 178.63 1ya7 h ALA 93 N -0.16 1.97 -0.06 1.87 0.00 -0.69 0.45 119.26 122.63 1ya7 h ALA 93 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ya7 h ALA 93 Cb 0.73 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1ya7 h ALA 93 CO 0.00 -0.04 0.00 0.44 0.00 0.00 0.00 179.25 179.65 1ya7 n ILE 94 N -4.48 0.08 -0.00 0.00 -5.35 -0.54 -3.22 119.36 105.85 1ya7 n ILE 94 Ca 0.05 -0.15 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 1ya7 n ILE 94 Cb 0.24 -0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.15 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 -0.33 2.16 -1.76 6.28 1.74 0.13 -4.90 116.66 119.99 1ya7 n ARG 95 Ca 0.16 -1.33 -0.42 0.00 -0.77 0.00 0.00 57.85 55.49 1ya7 n ARG 95 Cb 0.19 -1.02 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 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 -0.80 2.99 0.78 0.55 1.01 -1.12 -4.82 121.20 119.80 1ya7 s ILE 96 Ca 0.02 0.18 -0.08 0.00 0.00 0.00 0.00 60.65 60.76 1ya7 s ILE 96 Cb 0.01 -3.11 0.12 0.00 0.01 0.00 0.00 42.46 39.48 1ya7 s ILE 96 CO 0.01 -0.01 1.10 -2.16 0.00 0.00 0.00 174.94 173.88 1ya7 s PRO 97 N 3.81 1.62 0.03 2.79 0.04 -1.26 -4.96 135.00 137.08 1ya7 s PRO 97 Ca 0.83 -0.50 -0.26 0.00 0.04 0.00 0.00 61.00 61.11 1ya7 s PRO 97 Cb -0.42 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 31.88 1ya7 s PRO 97 CO 0.38 -1.63 0.66 -1.91 0.04 0.00 0.00 177.00 174.53 1ya7 n GLU 98 N -3.15 0.00 -2.06 4.56 2.13 -1.26 -4.85 120.64 116.01 1ya7 n GLU 98 Ca 0.12 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.51 1ya7 n GLU 98 Cb 0.60 -0.96 -0.03 0.00 0.27 0.00 0.00 31.44 31.32 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 -0.16 2.08 0.20 4.31 5.65 -1.26 -5.00 115.29 121.11 1ya7 s HIS 99 Ca 0.59 0.31 0.01 0.00 0.25 0.00 0.00 55.06 56.21 1ya7 s HIS 99 Cb -0.83 -3.87 -0.05 0.00 -1.18 0.00 0.00 32.58 26.65 1ya7 s HIS 99 CO 0.40 -3.56 0.06 0.15 -0.65 0.00 0.00 174.74 171.14 1ya7 s LYS 100 N 4.01 1.20 -0.19 2.88 1.02 -1.26 -5.05 119.74 122.36 1ya7 s LYS 100 Ca 0.71 -1.61 0.12 0.00 0.02 0.00 0.00 55.97 55.21 1ya7 s LYS 100 Cb -0.32 -0.12 0.69 0.00 -0.52 0.00 0.00 37.83 37.56 1ya7 s LYS 100 CO 0.28 -0.24 1.55 0.39 -0.92 0.00 0.00 175.35 176.41 1ya7 n GLU 101 N -0.30 4.19 -3.85 1.68 -0.58 -1.26 -4.93 120.64 115.59 1ya7 n GLU 101 Ca -0.03 -2.65 -0.09 0.00 -0.42 0.00 0.00 57.16 53.97 1ya7 n GLU 101 Cb 0.65 -2.11 -0.04 0.00 -0.57 0.00 0.00 31.44 29.36 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 -2.40 1.43 -1.45 3.49 -1.05 -1.26 -4.94 118.70 112.51 1ya7 s GLU 102 Ca 0.46 -1.02 -0.07 0.00 -0.15 0.00 0.00 54.97 54.19 1ya7 s GLU 102 Cb 0.34 0.50 0.01 0.00 -0.44 0.00 0.00 34.13 34.54 1ya7 s GLU 102 CO 0.15 -0.60 0.88 -3.47 0.95 0.00 0.00 175.26 173.16 1ya7 n ASP 103 N -0.35 -6.24 -1.53 0.83 2.03 -1.26 -4.91 116.55 105.12 1ya7 n ASP 103 Ca -0.07 -0.40 0.08 0.00 0.52 0.00 0.00 54.79 54.91 1ya7 n ASP 103 Cb 0.62 -4.97 0.35 0.00 -0.72 0.00 0.00 41.12 36.40 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 -2.72 5.02 -0.09 1.67 3.02 -1.26 -4.66 115.26 116.23 1ya7 n ASN 104 Ca -0.05 -2.88 -0.11 0.00 -0.03 0.00 0.00 54.58 51.51 1ya7 n ASN 104 Cb 0.59 -0.62 -0.04 0.00 -0.61 0.00 0.00 39.78 39.10 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 3.32 0.45 -0.48 3.41 3.38 -1.91 -1.10 115.31 122.38 1ya7 h LEU 105 Ca 0.00 -0.29 -0.17 0.00 0.09 0.00 0.00 57.88 57.51 1ya7 h LEU 105 Cb 1.73 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.35 1ya7 h LEU 105 CO 0.37 0.62 -0.69 1.23 0.09 0.00 0.00 178.44 180.06 1ya7 h GLY 106 N 0.26 0.38 1.12 0.83 0.00 -1.82 -3.08 103.07 100.76 1ya7 h GLY 106 Ca 0.08 -0.51 0.02 0.00 0.00 0.00 0.00 47.33 46.91 1ya7 h GLY 106 CO 0.01 0.46 0.55 -2.08 0.00 0.00 0.00 176.54 175.48 1ya7 h VAL 107 N 0.24 1.18 0.00 4.60 2.07 -1.72 -1.59 116.25 121.03 1ya7 h VAL 107 Ca -0.02 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 1ya7 h VAL 107 Cb 1.24 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 1ya7 h VAL 107 CO 0.11 0.20 -0.32 0.00 0.02 0.00 0.00 177.57 177.58 1ya7 h ALA 108 N 1.49 1.35 -0.00 1.67 0.00 -1.11 -0.48 119.26 122.18 1ya7 h ALA 108 Ca 0.32 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ya7 h ALA 108 Cb -0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ya7 h ALA 108 CO -0.08 0.40 0.00 0.28 0.00 0.00 0.00 179.25 179.85 1ya7 h VAL 109 N 0.00 1.22 -0.53 0.00 2.07 -1.35 -1.31 116.25 116.36 1ya7 h VAL 109 Ca -0.00 -0.65 0.10 0.00 0.82 0.00 0.00 66.70 66.97 1ya7 h VAL 109 Cb 0.62 1.66 -0.08 0.00 -1.52 0.00 0.00 31.29 31.96 1ya7 h VAL 109 CO 0.04 0.17 0.03 1.56 0.02 0.00 0.00 177.57 179.39 1ya7 h GLN 110 N -0.27 0.14 -0.22 1.57 4.20 -0.81 0.39 115.11 120.11 1ya7 h GLN 110 Ca 0.00 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 1ya7 h GLN 110 Cb 0.28 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1ya7 h GLN 110 CO 0.00 0.09 -0.33 0.45 -0.67 0.00 0.00 178.83 178.37 1ya7 h HIS 111 N 0.15 0.54 -0.21 2.96 3.86 -1.01 -0.78 115.15 120.66 1ya7 h HIS 111 Ca 0.27 -0.13 -0.17 0.00 -1.16 0.00 0.00 60.37 59.17 1ya7 h HIS 111 Cb 0.41 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.75 1ya7 h HIS 111 CO -0.30 0.74 -0.56 0.00 0.86 0.00 0.00 177.93 178.67 1ya7 h ALA 112 N 1.25 0.60 -0.18 2.45 0.00 -0.61 -1.33 119.26 121.44 1ya7 h ALA 112 Ca 0.05 -0.52 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 1ya7 h ALA 112 Cb 0.77 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.49 1ya7 h ALA 112 CO 0.06 0.69 -0.71 0.28 0.00 0.00 0.00 179.25 179.57 1ya7 h VAL 113 N 0.51 1.28 -0.68 0.00 2.07 -0.80 -2.93 116.25 115.69 1ya7 h VAL 113 Ca 0.01 -1.91 0.04 0.00 0.82 0.00 0.00 66.70 65.66 1ya7 h VAL 113 Cb 1.13 1.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.77 1ya7 h VAL 113 CO 0.11 0.61 0.45 -0.07 0.02 0.00 0.00 177.57 178.69 1ya7 h LEU 114 N 0.56 0.67 -0.34 2.57 3.38 -1.03 -2.10 115.31 119.02 1ya7 h LEU 114 Ca -0.04 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.74 1ya7 h LEU 114 Cb 1.34 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1ya7 h LEU 114 CO 0.15 0.46 -0.82 0.50 0.09 0.00 0.00 178.44 178.81 1ya7 h LYS 115 N 0.78 0.27 -0.44 1.13 3.64 -1.20 -0.43 116.57 120.31 1ya7 h LYS 115 Ca 0.28 -0.26 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1ya7 h LYS 115 Cb 0.13 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1ya7 h LYS 115 CO -0.08 0.95 -0.16 0.97 -2.27 0.00 0.00 179.45 178.85 1ya7 h ILE 116 N 0.16 1.27 -0.58 2.00 2.10 -1.28 -1.65 117.51 119.53 1ya7 h ILE 116 Ca -0.04 -1.27 -0.02 0.00 1.08 0.00 0.00 64.86 64.60 1ya7 h ILE 116 Cb 1.42 1.10 -0.03 0.00 -1.09 0.00 0.00 36.82 38.22 1ya7 h ILE 116 CO 0.13 0.44 0.28 0.40 -1.08 0.00 0.00 178.15 178.31 1ya7 h ILE 117 N 0.75 1.21 -0.28 2.19 1.08 -1.26 -0.85 117.51 120.36 1ya7 h ILE 117 Ca 0.11 -0.60 0.06 0.00 -0.39 0.00 0.00 64.86 64.04 1ya7 h ILE 117 Cb 0.68 0.53 -0.06 0.00 -3.07 0.00 0.00 36.82 34.91 1ya7 h ILE 117 CO 0.05 0.24 -0.09 0.44 -0.69 0.00 0.00 178.15 178.10 1ya7 h ASP 118 N 0.79 -0.33 -0.22 1.72 3.32 -0.97 0.44 116.42 121.18 1ya7 h ASP 118 Ca 0.20 0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.40 1ya7 h ASP 118 Cb 0.13 0.20 -0.06 0.00 0.22 0.00 0.00 39.33 39.81 1ya7 h ASP 118 CO -0.02 -0.12 -0.19 -0.08 -1.72 0.00 0.00 179.24 177.10 1ya7 h GLU 119 N -0.04 -0.19 -0.32 3.56 4.81 -0.98 0.37 114.58 121.78 1ya7 h GLU 119 Ca 0.14 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.45 1ya7 h GLU 119 Cb 0.25 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.59 1ya7 h GLU 119 CO -0.31 -0.13 -0.21 1.25 -0.73 0.00 0.00 179.01 178.89 1ya7 h LEU 120 N -0.20 -0.68 -0.16 1.64 5.85 -0.77 0.16 115.31 121.14 1ya7 h LEU 120 Ca 0.13 0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.89 1ya7 h LEU 120 Cb 0.39 0.35 0.00 0.00 0.37 0.00 0.00 40.66 41.77 1ya7 h LEU 120 CO -0.34 -0.24 -0.30 -0.33 -0.34 0.00 0.00 178.44 176.89 1ya7 h GLU 121 N -0.17 0.49 0.04 1.25 5.08 -0.43 -1.34 114.58 119.50 1ya7 h GLU 121 Ca 0.17 -0.31 -0.22 0.00 -1.00 0.00 0.00 59.36 58.00 1ya7 h GLU 121 Cb 0.42 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1ya7 h GLU 121 CO -0.43 0.91 -1.17 0.82 -1.00 0.00 0.00 179.01 178.15 1ya7 h ILE 122 N 0.13 1.05 0.00 3.13 1.08 -0.24 -3.20 117.51 119.46 1ya7 h ILE 122 Ca 0.01 -2.27 0.00 0.00 -0.39 0.00 0.00 64.86 62.21 1ya7 h ILE 122 Cb 0.89 2.53 0.00 0.00 -3.07 0.00 0.00 36.82 37.17 1ya7 h ILE 122 CO 0.07 0.49 -0.37 0.11 -0.69 0.00 0.00 178.15 177.76 1ya7 h LYS 123 N -0.76 0.00 -0.84 2.37 1.79 -0.88 -3.13 116.57 115.13 1ya7 h LYS 123 Ca -0.29 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.18 1ya7 h LYS 123 Cb 1.42 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.03 1ya7 h LYS 123 CO -0.09 0.00 0.55 1.15 -1.08 0.00 0.00 179.45 179.97 1ya7 h THR 124 N -0.91 1.22 -0.00 -0.16 2.02 -1.15 -2.55 112.91 111.38 1ya7 h THR 124 Ca 0.00 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1ya7 h THR 124 Cb 0.37 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1ya7 h THR 124 CO 0.00 0.22 -0.70 0.18 0.37 0.00 0.00 175.52 175.59 1ya7 n LEU 125 N -4.49 0.93 -3.75 2.58 4.77 -0.51 -4.82 117.00 111.71 1ya7 n LEU 125 Ca 0.09 -0.32 -0.28 0.00 -0.03 0.00 0.00 56.01 55.47 1ya7 n LEU 125 Cb 0.02 -0.10 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1ya7 n LEU 125 CO 0.37 0.21 -0.12 0.61 -1.33 0.00 0.00 177.39 177.13 1ya7 n GLY 126 N 1.48 -0.66 0.10 -0.72 0.00 -0.96 -1.31 105.19 103.13 1ya7 n GLY 126 Ca 0.06 0.32 0.09 0.00 0.00 0.00 0.00 46.02 46.49 1ya7 n GLY 126 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ya7 n SER 127 N -2.84 0.78 -4.78 1.61 3.41 -1.21 -3.33 113.62 107.26 1ya7 n SER 127 Ca -0.19 0.31 -0.33 0.00 -0.26 0.00 0.00 58.87 58.40 1ya7 n SER 127 Cb 0.63 0.53 0.03 0.00 -0.26 0.00 0.00 64.21 65.14 1ya7 n SER 127 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1ya7 s GLY 128 N -4.46 2.20 0.36 5.00 0.00 -1.26 -4.96 107.32 104.20 1ya7 s GLY 128 Ca -0.02 0.53 0.19 0.00 0.00 0.00 0.00 44.72 45.42 1ya7 s GLY 128 CO 0.80 0.87 1.60 1.05 0.00 0.00 0.00 173.10 177.42 1ya7 h GLU 129 N 0.31 0.00 -3.58 2.90 4.11 -2.01 -3.43 114.58 112.89 1ya7 h GLU 129 Ca -0.47 0.00 -0.39 0.00 0.07 0.00 0.00 59.36 58.56 1ya7 h GLU 129 Cb 1.24 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 30.11 1ya7 h GLU 129 CO 0.56 0.32 -0.75 0.15 0.07 0.00 0.00 179.01 179.35 1ya7 s LYS 130 N -3.22 0.31 0.51 1.06 1.02 -1.26 -5.15 119.74 113.01 1ya7 s LYS 130 Ca 0.03 0.19 -0.19 0.00 0.02 0.00 0.00 55.97 56.02 1ya7 s LYS 130 Cb 0.08 -0.71 -0.08 0.00 -0.52 0.00 0.00 37.83 36.61 1ya7 s LYS 130 CO 0.70 -0.27 1.05 -1.54 -0.92 0.00 0.00 175.35 174.36 1ya7 s SER 131 N 1.81 6.22 0.31 2.83 1.04 -1.26 -5.06 113.70 119.59 1ya7 s SER 131 Ca 0.01 1.92 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1ya7 s SER 131 Cb -0.12 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1ya7 s SER 131 CO -0.04 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 173.93 1ya7 n GLY 132 N -0.37 -0.74 0.29 7.32 0.00 -1.26 -4.86 105.19 105.57 1ya7 n GLY 132 Ca 0.09 -1.66 0.15 0.00 0.00 0.00 0.00 46.02 44.60 1ya7 n GLY 132 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ya7 h SER 133 N 0.00 0.00 -0.23 1.61 4.64 -2.08 -2.57 113.55 114.91 1ya7 h SER 133 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1ya7 h SER 133 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 1ya7 h SER 133 CO 0.00 0.06 0.10 0.61 -0.87 0.00 0.00 176.83 176.73 1ya7 n GLY 134 N -0.88 2.34 7.00 -0.77 0.00 -1.26 -5.03 105.19 106.59 1ya7 n GLY 134 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 0.10 0.75 3.01 -0.02 0.00 -0.97 -4.51 105.19 103.55 1ya7 n GLY 135 Ca 0.13 -0.84 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.74 3.04 -0.58 4.61 0.00 -1.26 -4.21 121.76 121.61 1ya7 s ALA 136 Ca 0.00 -2.74 0.26 0.00 0.00 0.00 0.00 51.96 49.48 1ya7 s ALA 136 Cb 0.00 -2.07 0.85 0.00 0.00 0.00 0.00 23.12 21.90 1ya7 s ALA 136 CO 0.00 -1.79 1.75 -1.35 0.00 0.00 0.00 175.76 174.38 1ya7 h PRO 137 N 7.36 0.00 -6.87 0.00 0.11 -1.85 -3.45 132.00 127.31 1ya7 h PRO 137 Ca -0.06 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.57 1ya7 h PRO 137 Cb 0.99 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.11 1ya7 h PRO 137 CO 0.58 0.00 0.41 -0.08 -0.21 0.00 0.00 178.00 178.70 1ya7 s THR 138 N -3.21 3.79 0.39 -1.15 -1.32 -1.26 -4.95 115.64 107.93 1ya7 s THR 138 Ca 0.08 1.57 0.09 0.00 -1.21 0.00 0.00 61.69 62.21 1ya7 s THR 138 Cb 0.10 -3.91 0.30 0.00 -1.51 0.00 0.00 72.50 67.49 1ya7 s THR 138 CO 0.54 0.20 1.97 -0.65 -2.21 0.00 0.00 174.62 174.48 1ya7 h PRO 139 N 3.24 0.60 -2.38 7.08 0.11 -1.87 -3.44 132.00 135.34 1ya7 h PRO 139 Ca -0.47 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 1ya7 h PRO 139 Cb 1.21 -0.14 -0.20 0.00 0.11 0.00 0.00 31.00 31.98 1ya7 h PRO 139 CO 0.65 0.40 0.00 -1.50 -0.21 0.00 0.00 178.00 177.34 1ya7 s ILE 140 N -5.56 0.02 0.00 4.15 2.07 -1.26 -4.94 121.20 115.68 1ya7 s ILE 140 Ca -0.09 -0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.01 1ya7 s ILE 140 Cb 0.19 -0.84 0.00 0.00 0.13 0.00 0.00 42.46 41.94 1ya7 s ILE 140 CO 0.76 -0.08 0.00 0.61 -1.91 0.00 0.00 174.94 174.32 1ya7 n GLY 141 N 1.39 2.36 0.28 1.50 0.00 -1.26 -4.81 105.19 104.64 1ya7 n GLY 141 Ca -0.19 -2.06 0.03 0.00 0.00 0.00 0.00 46.02 43.81 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 0.37 -1.19 1.61 1.85 -1.19 -3.13 114.93 113.25 1ya7 h MET 142 Ca 0.00 -0.05 -0.66 0.00 -0.61 0.00 0.00 59.70 58.38 1ya7 h MET 142 Cb 0.00 -0.07 -0.32 0.00 0.43 0.00 0.00 31.60 31.64 1ya7 h MET 142 CO 0.00 0.34 0.45 0.66 -0.40 0.00 0.00 176.91 177.96 1ya7 n TYR 143 N -4.40 3.10 -0.11 1.39 4.02 -1.26 -4.70 117.16 115.21 1ya7 n TYR 143 Ca 0.01 -2.74 -0.13 0.00 -0.01 0.00 0.00 57.90 55.03 1ya7 n TYR 143 Cb 0.15 -1.07 -0.03 0.00 -0.02 0.00 0.00 39.34 38.37 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 2.28 0.53 -0.05 -0.72 0.00 -1.93 -2.13 119.26 117.25 1ya7 h ALA 144 Ca 0.53 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1ya7 h ALA 144 Cb 0.81 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 1ya7 h ALA 144 CO 1.34 0.62 -0.17 1.25 0.00 0.00 0.00 179.25 182.29 1ya7 h LEU 145 N 0.69 -0.50 -1.15 0.00 5.85 -1.86 0.48 115.31 118.82 1ya7 h LEU 145 Ca 0.06 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1ya7 h LEU 145 Cb 0.96 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 1ya7 h LEU 145 CO 0.09 -0.22 0.58 -0.09 -0.34 0.00 0.00 178.44 178.46 1ya7 h ARG 146 N -0.25 1.06 -0.02 1.25 2.43 -1.92 -0.00 114.38 116.92 1ya7 h ARG 146 Ca 0.07 -0.06 -0.17 0.00 -0.81 0.00 0.00 59.98 59.00 1ya7 h ARG 146 Cb 0.34 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1ya7 h ARG 146 CO -0.19 0.70 -0.76 1.05 -1.51 0.00 0.00 179.97 179.26 1ya7 h GLU 147 N 1.09 0.15 0.44 0.20 4.11 -0.67 0.09 114.58 119.99 1ya7 h GLU 147 Ca 0.36 -0.14 -0.02 0.00 0.07 0.00 0.00 59.36 59.62 1ya7 h GLU 147 Cb 0.06 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1ya7 h GLU 147 CO -0.11 0.84 -0.21 -0.92 0.07 0.00 0.00 179.01 178.67 1ya7 h TYR 148 N 0.10 -0.55 -0.94 2.06 3.20 0.24 -1.95 116.97 119.13 1ya7 h TYR 148 Ca -0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.83 1ya7 h TYR 148 Cb 1.33 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 39.74 1ya7 h TYR 148 CO 0.02 -0.30 0.59 -0.07 -1.64 0.00 0.00 178.16 176.76 1ya7 h LEU 149 N -0.67 1.11 -0.05 2.82 3.38 -0.99 0.14 115.31 121.04 1ya7 h LEU 149 Ca -0.06 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1ya7 h LEU 149 Cb 0.50 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1ya7 h LEU 149 CO 0.10 0.83 0.02 -1.28 0.09 0.00 0.00 178.44 178.20 1ya7 h SER 150 N 1.29 0.08 0.18 -0.43 0.87 -0.98 -0.47 113.55 114.09 1ya7 h SER 150 Ca 0.34 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1ya7 h SER 150 Cb -0.09 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 61.85 1ya7 h SER 150 CO -0.07 0.23 -0.09 0.00 -0.53 0.00 0.00 176.83 176.37 1ya7 h ALA 151 N 0.85 -0.25 -0.72 6.23 0.00 -1.13 -2.73 119.26 121.51 1ya7 h ALA 151 Ca 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ya7 h ALA 151 Cb 0.18 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1ya7 h ALA 151 CO -0.00 -0.64 0.43 -0.09 0.00 0.00 0.00 179.25 178.95 1ya7 h ARG 152 N -0.25 0.97 -0.50 0.00 2.43 -0.70 -2.99 114.38 113.34 1ya7 h ARG 152 Ca -0.03 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 58.98 1ya7 h ARG 152 Cb 0.19 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1ya7 h ARG 152 CO 0.04 0.69 0.02 1.03 -1.51 0.00 0.00 179.97 180.24 1ya7 h SER 153 N 0.99 0.85 -0.46 -3.80 0.87 -0.97 0.24 113.55 111.27 1ya7 h SER 153 Ca 0.26 -0.30 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1ya7 h SER 153 Cb -0.03 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.68 1ya7 h SER 153 CO -0.05 0.94 0.28 0.74 -0.53 0.00 0.00 176.83 178.22 1ya7 h THR 154 N 0.74 1.14 -0.08 2.23 2.02 -1.34 -1.32 112.91 116.30 1ya7 h THR 154 Ca 0.14 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1ya7 h THR 154 Cb 0.50 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1ya7 h THR 154 CO 0.02 0.14 0.02 0.58 0.37 0.00 0.00 175.52 176.65 1ya7 h VAL 155 N 0.62 1.21 -0.74 3.16 2.07 -1.44 -2.75 116.25 118.37 1ya7 h VAL 155 Ca 0.17 -0.63 0.17 0.00 0.82 0.00 0.00 66.70 67.22 1ya7 h VAL 155 Cb -0.02 1.48 -0.11 0.00 -1.52 0.00 0.00 31.29 31.12 1ya7 h VAL 155 CO -0.03 0.18 0.16 -0.33 0.02 0.00 0.00 177.57 177.56 1ya7 h GLU 156 N -0.10 0.23 -0.29 1.57 5.08 -0.78 -0.10 114.58 120.20 1ya7 h GLU 156 Ca 0.02 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1ya7 h GLU 156 Cb 0.27 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1ya7 h GLU 156 CO 0.00 0.16 0.15 0.22 -1.00 0.00 0.00 179.01 178.53 1ya7 h ASP 157 N 0.24 0.37 -0.92 1.42 1.82 -1.15 0.13 116.42 118.33 1ya7 h ASP 157 Ca 0.42 -0.11 -0.00 0.00 -0.39 0.00 0.00 57.03 56.95 1ya7 h ASP 157 Cb 0.73 -0.09 -0.04 0.00 0.68 0.00 0.00 39.33 40.60 1ya7 h ASP 157 CO -0.54 0.37 0.56 0.11 -1.61 0.00 0.00 179.24 178.13 1ya7 h LYS 158 N 0.34 1.24 -0.01 0.28 1.57 -1.11 -3.16 116.57 115.72 1ya7 h LYS 158 Ca 0.10 -0.11 -0.21 0.00 -1.87 0.00 0.00 60.65 58.56 1ya7 h LYS 158 Cb 0.09 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 1ya7 h LYS 158 CO -0.01 0.86 -0.88 -0.07 -0.57 0.00 0.00 179.45 178.78 1ya7 h LEU 159 N 1.26 0.42-10.40 2.94 3.38 -0.70 0.80 115.31 113.01 1ya7 h LEU 159 Ca 0.33 -0.33 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 1ya7 h LEU 159 Cb -0.07 -0.13 0.05 0.00 0.09 0.00 0.00 40.66 40.61 1ya7 h LEU 159 CO -0.06 1.12 0.17 -0.76 0.09 0.00 0.00 178.44 178.99 1ya7 s LEU 160 N -7.67 3.32 0.34 1.67 1.43 0.44 -3.91 118.68 114.31 1ya7 s LEU 160 Ca -0.05 0.78 -0.22 0.00 -1.03 0.00 0.00 54.13 53.61 1ya7 s LEU 160 Cb 0.10 -3.64 -0.15 0.00 0.03 0.00 0.00 46.19 42.52 1ya7 s LEU 160 CO 0.85 -0.95 0.18 0.61 0.23 0.00 0.00 176.35 177.26 1ya7 n GLY 161 N -2.52 -2.43 3.08 -3.19 0.00 -1.26 -4.14 105.19 94.73 1ya7 n GLY 161 Ca 0.04 0.07 -0.53 0.00 0.00 0.00 0.00 46.02 45.60 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 2.19 -0.14 3.51 -0.02 0.00 -1.26 -5.04 105.19 104.43 1ya7 n GLY 172 Ca 0.12 0.71 -0.29 0.00 0.00 0.00 0.00 46.02 46.57 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 0.64 1.53 0.34 -0.02 0.00 -1.26 -4.97 107.32 103.57 1ya7 s GLY 173 Ca 0.82 -0.43 -0.29 0.00 0.00 0.00 0.00 44.72 44.82 1ya7 s GLY 173 CO 0.55 0.35 1.39 -0.45 0.00 0.00 0.00 173.10 174.93 1ya7 s SER 174 N -3.02 6.61 0.00 1.64 0.15 0.27 -4.93 113.70 114.42 1ya7 s SER 174 Ca 0.68 2.81 0.23 0.00 0.70 0.00 0.00 55.95 60.37 1ya7 s SER 174 Cb -0.20 -2.65 0.54 0.00 -1.71 0.00 0.00 66.02 62.00 1ya7 s SER 174 CO 0.61 -0.67 1.45 0.00 1.20 0.00 0.00 173.24 175.83 1ya7 n GLN 175 N 0.90 2.18 -1.64 5.44 1.13 -1.26 -4.86 117.38 119.27 1ya7 n GLN 175 Ca 0.01 -1.76 -0.43 0.00 -1.94 0.00 0.00 57.00 52.88 1ya7 n GLN 175 Cb 0.41 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.26 1ya7 n GLN 175 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1ya7 s SER 176 N -1.62 5.85 0.21 1.08 0.15 -1.26 -4.91 113.70 113.20 1ya7 s SER 176 Ca 0.35 2.20 -0.08 0.00 0.70 0.00 0.00 55.95 59.12 1ya7 s SER 176 Cb 0.21 -2.52 0.14 0.00 -1.71 0.00 0.00 66.02 62.14 1ya7 s SER 176 CO 0.30 -1.60 1.75 1.55 1.20 0.00 0.00 173.24 176.43 1ya7 h PRO 177 N 13.28 1.17 0.00 5.44 0.13 -2.01 -2.93 132.00 147.08 1ya7 h PRO 177 Ca -0.44 -0.25 -0.05 0.00 -0.87 0.00 0.00 66.00 64.39 1ya7 h PRO 177 Cb 1.24 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1ya7 h PRO 177 CO 0.95 0.99 -0.21 0.77 -0.23 0.00 0.00 178.00 180.27 1ya7 h SER 178 N 1.12 0.00 -0.58 1.44 0.02 -1.99 -2.43 113.55 111.14 1ya7 h SER 178 Ca 0.24 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.15 1ya7 h SER 178 Cb 0.30 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1ya7 h SER 178 CO -0.01 0.21 0.20 0.25 -1.14 0.00 0.00 176.83 176.35 1ya7 h LEU 179 N 0.00 0.83 -0.61 5.07 5.85 -1.92 0.16 115.31 124.69 1ya7 h LEU 179 Ca -0.00 -0.19 -0.10 0.00 0.84 0.00 0.00 57.88 58.43 1ya7 h LEU 179 Cb 0.39 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1ya7 h LEU 179 CO 0.03 0.80 -0.01 0.25 -0.34 0.00 0.00 178.44 179.17 1ya7 h LEU 180 N 0.81 1.06 -1.03 2.25 5.85 -1.44 -2.52 115.31 120.29 1ya7 h LEU 180 Ca 0.19 -0.31 -0.09 0.00 0.84 0.00 0.00 57.88 58.51 1ya7 h LEU 180 Cb 0.25 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1ya7 h LEU 180 CO -0.01 1.11 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.85 1ya7 h LEU 181 N 0.98 0.34 -0.91 2.25 3.38 -1.28 -3.08 115.31 116.99 1ya7 h LEU 181 Ca 0.17 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ya7 h LEU 181 Cb 0.57 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1ya7 h LEU 181 CO 0.03 0.62 0.53 -0.08 0.09 0.00 0.00 178.44 179.64 1ya7 h GLU 182 N 0.30 1.24 -0.53 1.13 4.81 -0.45 -0.03 114.58 121.06 1ya7 h GLU 182 Ca 0.04 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1ya7 h GLU 182 Cb 0.66 -0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.75 1ya7 h GLU 182 CO 0.05 0.88 0.31 1.25 -0.73 0.00 0.00 179.01 180.76 1ya7 h LEU 183 N 1.26 0.48 -0.69 1.64 5.85 -1.37 0.16 115.31 122.64 1ya7 h LEU 183 Ca 0.32 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.03 1ya7 h LEU 183 Cb -0.03 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1ya7 h LEU 183 CO -0.06 0.34 0.35 -0.09 -0.34 0.00 0.00 178.44 178.64 1ya7 h ARG 184 N 0.60 0.99 -0.54 1.25 2.43 -1.47 -2.52 114.38 115.12 1ya7 h ARG 184 Ca 0.22 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1ya7 h ARG 184 Cb 0.05 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 1ya7 h ARG 184 CO -0.11 0.77 0.26 0.37 -1.51 0.00 0.00 179.97 179.75 1ya7 h GLN 185 N 0.96 0.75 -0.05 0.20 5.75 -0.06 -0.46 115.11 122.19 1ya7 h GLN 185 Ca 0.24 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 1ya7 h GLN 185 Cb 0.09 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.49 1ya7 h GLN 185 CO -0.03 0.58 0.00 0.82 -2.65 0.00 0.00 178.83 177.55 1ya7 h ILE 186 N 0.76 1.24 -0.32 2.39 2.04 -0.51 0.11 117.51 123.21 1ya7 h ILE 186 Ca 0.19 -0.73 0.07 0.00 1.00 0.00 0.00 64.86 65.39 1ya7 h ILE 186 Cb 0.07 1.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.71 1ya7 h ILE 186 CO -0.03 0.20 -0.13 0.44 0.00 0.00 0.00 178.15 178.63 1ya7 h ASP 187 N -0.18 -0.45 -0.23 1.72 3.32 -1.23 -2.15 116.42 117.20 1ya7 h ASP 187 Ca 0.02 0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 1ya7 h ASP 187 Cb 0.32 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1ya7 h ASP 187 CO 0.00 -0.17 0.04 0.00 -1.72 0.00 0.00 179.24 177.40 1ya7 h ALA 188 N 1.20 0.30 -0.65 3.45 0.00 -0.95 -3.11 119.26 119.50 1ya7 h ALA 188 Ca 0.16 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ya7 h ALA 188 Cb 0.32 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ya7 h ALA 188 CO -0.37 -0.02 0.28 -0.44 0.00 0.00 0.00 179.25 178.69 1ya7 h ASP 189 N 0.19 0.86 -0.09 0.00 5.19 -0.69 -0.11 116.42 121.77 1ya7 h ASP 189 Ca 0.07 -0.11 -0.11 0.00 -0.62 0.00 0.00 57.03 56.26 1ya7 h ASP 189 Cb 0.31 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 1ya7 h ASP 189 CO 0.00 0.75 -0.30 -0.26 -3.12 0.00 0.00 179.24 176.32 1ya7 h PHE 190 N 0.93 0.64 -0.43 4.55 -1.00 -1.42 0.37 116.94 120.59 1ya7 h PHE 190 Ca 0.22 -0.16 -0.05 0.00 2.81 0.00 0.00 57.97 60.80 1ya7 h PHE 190 Cb 0.15 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1ya7 h PHE 190 CO 0.01 0.80 0.07 0.52 -1.61 0.00 0.00 178.31 178.11 1ya7 h MET 191 N 0.48 0.72 -0.21 1.51 2.86 -1.40 -2.00 114.93 116.89 1ya7 h MET 191 Ca 0.06 -0.19 0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1ya7 h MET 191 Cb 0.77 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 1ya7 h MET 191 CO 0.06 0.75 -0.00 1.25 1.06 0.00 0.00 176.91 180.03 1ya7 h LEU 192 N 0.58 -0.09 -0.78 1.22 5.85 -0.52 -1.94 115.31 119.62 1ya7 h LEU 192 Ca 0.13 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1ya7 h LEU 192 Cb 0.38 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1ya7 h LEU 192 CO 0.01 -0.02 0.49 0.11 -0.34 0.00 0.00 178.44 178.69 1ya7 h LYS 193 N 0.06 0.90 -0.55 1.25 1.57 -0.18 0.15 116.57 119.78 1ya7 h LYS 193 Ca 0.10 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1ya7 h LYS 193 Cb 0.13 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1ya7 h LYS 193 CO -0.17 0.59 0.35 0.28 -0.57 0.00 0.00 179.45 179.93 1ya7 h VAL 194 N 0.92 1.11 -0.77 0.50 2.07 -1.09 0.33 116.25 119.32 1ya7 h VAL 194 Ca 0.33 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.64 1ya7 h VAL 194 Cb 0.09 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 1ya7 h VAL 194 CO -0.14 0.13 0.48 -0.33 0.02 0.00 0.00 177.57 177.73 1ya7 h GLU 195 N 0.71 0.90 -0.07 1.57 5.08 -0.50 -0.58 114.58 121.70 1ya7 h GLU 195 Ca 0.21 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1ya7 h GLU 195 Cb -0.04 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.01 1ya7 h GLU 195 CO -0.07 0.60 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.20 1ya7 h LEU 196 N 0.93 0.35 -1.49 1.33 3.38 -0.74 -3.03 115.31 116.05 1ya7 h LEU 196 Ca 0.31 -0.64 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1ya7 h LEU 196 Cb 0.05 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1ya7 h LEU 196 CO -0.12 0.93 0.13 0.00 0.09 0.00 0.00 178.44 179.47 1ya7 h ALA 197 N 0.43 1.60 -0.15 1.53 0.00 -0.27 -1.58 119.26 120.82 1ya7 h ALA 197 Ca -0.02 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 1ya7 h ALA 197 Cb 0.92 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1ya7 h ALA 197 CO 0.06 0.32 -0.54 1.79 0.00 0.00 0.00 179.25 180.87 1ya7 h THR 198 N 0.48 1.33 -0.25 0.00 1.35 -1.15 0.57 112.91 115.25 1ya7 h THR 198 Ca 0.12 -1.81 -0.17 0.00 -0.55 0.00 0.00 66.41 64.00 1ya7 h THR 198 Cb 0.10 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.33 1ya7 h THR 198 CO -0.01 0.55 -0.52 0.74 -0.25 0.00 0.00 175.52 176.03 1ya7 h THR 199 N 0.35 1.29 -0.52 6.82 2.02 -1.29 -1.83 112.91 119.76 1ya7 h THR 199 Ca 0.01 -1.72 -0.10 0.00 0.77 0.00 0.00 66.41 65.36 1ya7 h THR 199 Cb 1.07 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 69.20 1ya7 h THR 199 CO 0.10 0.55 -0.08 -0.74 0.37 0.00 0.00 175.52 175.72 1ya7 h HIS 200 N 0.54 1.04 -0.49 3.16 6.17 -1.22 -2.65 115.15 121.70 1ya7 h HIS 200 Ca 0.00 -0.20 -0.10 0.00 0.71 0.00 0.00 60.37 60.78 1ya7 h HIS 200 Cb 1.14 -0.26 -0.02 0.00 2.52 0.00 0.00 27.41 30.78 1ya7 h HIS 200 CO 0.08 0.97 -0.11 1.25 0.71 0.00 0.00 177.93 180.83 1ya7 h LEU 201 N 0.85 0.90 -0.83 0.26 5.85 -0.80 -2.57 115.31 118.97 1ya7 h LEU 201 Ca 0.14 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 1ya7 h LEU 201 Cb 0.62 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1ya7 h LEU 201 CO 0.04 1.02 0.38 0.28 -0.34 0.00 0.00 178.44 179.82 1ya7 h SER 202 N 0.81 1.11 0.03 1.25 0.02 -1.16 0.49 113.55 116.11 1ya7 h SER 202 Ca 0.13 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1ya7 h SER 202 Cb 0.64 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1ya7 h SER 202 CO 0.04 0.95 -0.07 0.74 -1.14 0.00 0.00 176.83 177.35 1ya7 h THR 203 N 1.19 0.84 -0.26 -2.27 2.02 -1.34 -0.78 112.91 112.31 1ya7 h THR 203 Ca 0.28 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.46 1ya7 h THR 203 Cb 0.15 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 1ya7 h THR 203 CO -0.03 0.00 0.15 -0.03 0.37 0.00 0.00 175.52 175.98 1ya7 h MET 204 N -0.13 0.35 -0.11 6.66 -1.53 -1.01 -0.53 114.93 118.62 1ya7 h MET 204 Ca 0.02 -0.03 0.03 0.00 -3.44 0.00 0.00 59.70 56.28 1ya7 h MET 204 Cb 0.15 -0.07 -0.04 0.00 -0.55 0.00 0.00 31.60 31.09 1ya7 h MET 204 CO -0.05 0.28 -0.10 0.28 0.14 0.00 0.00 176.91 177.46 1ya7 h VAL 205 N 0.32 0.71 -0.65 -5.77 2.07 -0.90 -0.54 116.25 111.49 1ya7 h VAL 205 Ca 0.09 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.67 1ya7 h VAL 205 Cb 0.02 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 1ya7 h VAL 205 CO -0.02 0.00 0.37 0.03 0.02 0.00 0.00 177.57 177.97 1ya7 h ARG 206 N -0.12 0.66 -0.53 1.57 3.08 -0.95 -0.78 114.38 117.32 1ya7 h ARG 206 Ca 0.08 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.12 1ya7 h ARG 206 Cb 0.23 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.09 1ya7 h ARG 206 CO -0.18 0.44 0.30 0.00 -1.07 0.00 0.00 179.97 179.46 1ya7 h ALA 207 N 1.33 0.68 -0.67 0.04 0.00 -0.72 -1.99 119.26 117.93 1ya7 h ALA 207 Ca 0.29 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1ya7 h ALA 207 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1ya7 h ALA 207 CO -0.17 -0.01 0.16 0.28 0.00 0.00 0.00 179.25 179.50 1ya7 h VAL 208 N 0.59 1.26 -0.43 0.00 2.07 -0.48 -1.52 116.25 117.74 1ya7 h VAL 208 Ca 0.22 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1ya7 h VAL 208 Cb 0.07 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1ya7 h VAL 208 CO -0.12 0.36 0.28 0.40 0.02 0.00 0.00 177.57 178.51 1ya7 h ILE 209 N 1.02 1.11 0.01 4.57 2.04 -0.74 0.15 117.51 125.68 1ya7 h ILE 209 Ca 0.21 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1ya7 h ILE 209 Cb 0.37 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1ya7 h ILE 209 CO 0.00 0.11 -0.00 -1.13 0.00 0.00 0.00 178.15 177.13 1ya7 h ASN 210 N 0.58 -0.01 -0.40 1.72 -1.24 -1.29 -2.51 115.58 112.42 1ya7 h ASN 210 Ca 0.16 -0.27 0.04 0.00 0.71 0.00 0.00 56.30 56.94 1ya7 h ASN 210 Cb -0.06 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 38.95 1ya7 h ASN 210 CO -0.03 0.26 0.15 0.00 -1.29 0.00 0.00 177.43 176.52 1ya7 h ALA 211 N 0.71 0.48 0.15 1.57 0.00 -0.92 -1.43 119.26 119.81 1ya7 h ALA 211 Ca -0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ya7 h ALA 211 Cb 0.28 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1ya7 h ALA 211 CO 0.00 -0.23 -0.25 -0.92 0.00 0.00 0.00 179.25 177.85 1ya7 h TYR 212 N 0.32 -0.66 0.00 0.00 3.20 -0.74 -2.40 116.97 116.69 1ya7 h TYR 212 Ca 0.18 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.01 1ya7 h TYR 212 Cb 0.15 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1ya7 h TYR 212 CO -0.14 -0.35 -0.27 -0.07 -1.64 0.00 0.00 178.16 175.69 1ya7 h LEU 213 N -0.47 0.00 0.00 2.82 3.38 -1.25 0.51 115.31 120.30 1ya7 h LEU 213 Ca 0.02 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.81 1ya7 h LEU 213 Cb 0.48 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1ya7 h LEU 213 CO -0.12 0.27 -0.88 -0.07 0.09 0.00 0.00 178.44 177.73 1ya7 h LEU 214 N 0.00 0.00 -1.62 1.67 3.38 -1.19 -3.37 115.31 114.17 1ya7 h LEU 214 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ya7 h LEU 214 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1ya7 h LEU 214 CO 0.04 0.83 0.00 0.59 0.09 0.00 0.00 178.44 179.99 1ya7 n ASN 215 N -3.29 1.77 0.01 -0.43 3.02 -0.80 -4.83 115.26 110.71 1ya7 n ASN 215 Ca -0.00 -1.44 0.08 0.00 -0.03 0.00 0.00 54.58 53.19 1ya7 n ASN 215 Cb 0.88 -0.03 0.49 0.00 -0.61 0.00 0.00 39.78 40.51 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 1.28 0.39 -0.18 3.10 5.08 -1.09 -2.56 115.95 121.96 1ya7 h TRP 216 Ca 0.00 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.97 1ya7 h TRP 216 Cb 0.36 -0.13 -0.01 0.00 -3.00 0.00 0.00 29.16 26.38 1ya7 h TRP 216 CO 0.03 0.22 0.08 0.87 -1.28 0.00 0.00 178.44 178.36 1ya7 h LYS 217 N 0.40 0.27 0.00 0.12 1.57 -1.88 -1.99 116.57 115.07 1ya7 h LYS 217 Ca 0.18 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 1ya7 h LYS 217 Cb 0.21 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1ya7 h LYS 217 CO -0.04 0.33 -0.44 0.87 -0.57 0.00 0.00 179.45 179.60 1ya7 h LYS 218 N 0.15 0.00 -0.94 3.15 1.79 -1.69 0.24 116.57 119.28 1ya7 h LYS 218 Ca 0.06 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.58 1ya7 h LYS 218 Cb 0.16 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.75 1ya7 h LYS 218 CO -0.01 0.44 0.60 -0.07 -1.08 0.00 0.00 179.45 179.33 1ya7 h LEU 219 N 0.00 0.98 0.07 2.94 3.38 -1.17 -2.41 115.31 119.10 1ya7 h LEU 219 Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 1ya7 h LEU 219 Cb 0.84 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1ya7 h LEU 219 CO 0.06 0.65 -1.11 0.40 0.09 0.00 0.00 178.44 178.52 1ya7 h ILE 220 N 1.13 1.16 -3.03 1.22 1.08 -1.10 -3.43 117.51 114.55 1ya7 h ILE 220 Ca 0.39 -2.35 -0.62 0.00 -0.39 0.00 0.00 64.86 61.89 1ya7 h ILE 220 Cb 0.08 2.75 -0.41 0.00 -3.07 0.00 0.00 36.82 36.17 1ya7 h ILE 220 CO -0.15 0.60 -0.65 -1.10 -0.69 0.00 0.00 178.15 176.17 1ya7 s GLN 221 N -2.41 2.07 0.40 2.37 1.11 0.82 -4.97 119.66 119.04 1ya7 s GLN 221 Ca -0.21 -2.94 0.28 0.00 0.01 0.00 0.00 55.36 52.49 1ya7 s GLN 221 Cb 0.03 -3.04 0.96 0.00 -1.01 0.00 0.00 33.01 29.96 1ya7 s GLN 221 CO 0.72 -1.26 1.80 -1.00 0.01 0.00 0.00 175.29 175.56 1ya7 h PRO 222 N 5.73 0.00 -5.46 2.91 0.13 -1.65 -3.38 132.00 130.28 1ya7 h PRO 222 Ca 0.11 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.66 1ya7 h PRO 222 Cb 0.81 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.63 1ya7 h PRO 222 CO 0.64 0.00 -0.85 1.03 -0.23 0.00 0.00 178.00 178.60 1ya7 s ARG 223 N -3.39 1.90 0.35 0.86 0.52 -1.26 -3.23 118.95 114.70 1ya7 s ARG 223 Ca 0.05 -0.66 0.07 0.00 -0.52 0.00 0.00 55.73 54.66 1ya7 s ARG 223 Cb 0.09 -1.65 -0.03 0.00 0.52 0.00 0.00 34.95 33.88 1ya7 s ARG 223 CO 0.54 0.28 0.26 0.95 0.02 0.00 0.00 175.30 177.35 1ya7 s THR 224 N -0.03 0.08 0.00 0.02 -4.23 -1.26 -5.14 115.64 105.08 1ya7 s THR 224 Ca -0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 1ya7 s THR 224 Cb -0.12 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.26 1ya7 s THR 224 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1ya7 n GLY 225 N -0.68 -1.41 3.93 3.99 0.00 -1.26 -5.03 105.19 104.73 1ya7 n GLY 225 Ca 0.05 -1.38 -0.25 0.00 0.00 0.00 0.00 46.02 44.44 1ya7 n GLY 225 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ya7 s SER 226 N -1.90 5.38 -0.96 1.61 0.01 -1.26 -5.04 113.70 111.54 1ya7 s SER 226 Ca 0.00 0.51 -0.16 0.00 1.31 0.00 0.00 55.95 57.60 1ya7 s SER 226 Cb 0.00 -1.42 0.16 0.00 0.21 0.00 0.00 66.02 64.97 1ya7 s SER 226 CO 0.00 -1.17 1.10 -0.62 0.41 0.00 0.00 173.24 172.96 1ya7 s ASP 227 N -4.37 6.76 0.50 2.44 -1.08 -1.26 -4.87 116.67 114.80 1ya7 s ASP 227 Ca 0.55 -2.41 0.30 0.00 -0.52 0.00 0.00 52.55 50.47 1ya7 s ASP 227 Cb -0.10 -2.35 1.03 0.00 -1.46 0.00 0.00 42.92 40.04 1ya7 s ASP 227 CO 0.43 -0.87 1.86 0.45 0.52 0.00 0.00 175.17 177.56 1ya7 h HIS 228 N 8.24 0.00 0.00 -5.34 3.86 -2.04 -3.20 115.15 116.68 1ya7 h HIS 228 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 1ya7 h HIS 228 Cb 1.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.47 1ya7 h HIS 228 CO 1.11 0.00 0.00 0.52 0.86 0.00 0.00 177.93 180.42 1ya7 h MET 229 N 0.00 0.00 -6.42 2.45 2.86 -2.06 -3.44 114.93 108.31 1ya7 h MET 229 Ca 0.00 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.96 1ya7 h MET 229 Cb 0.66 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.12 1ya7 h MET 229 CO 0.00 0.00 -0.76 0.08 1.06 0.00 0.00 176.91 177.29 1ya7 s VAL 230 N -3.27 3.19 0.00 -2.22 1.01 -1.21 -5.34 120.40 112.56 1ya7 s VAL 230 Ca 0.07 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1ya7 s VAL 230 Cb 0.10 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1ya7 s VAL 230 CO 0.54 0.39 0.00 -1.54 0.00 0.00 0.00 175.10 174.49