#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 0.40 -0.64 1.64 3.08 -2.05 -1.72 114.38 115.08 1ya7 h ARG 5 Ca 0.00 -0.38 -0.02 0.00 0.07 0.00 0.00 59.98 59.65 1ya7 h ARG 5 Cb 0.00 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1ya7 h ARG 5 CO 0.00 1.04 0.31 0.00 -1.07 0.00 0.00 179.97 180.25 1ya7 h ALA 6 N 0.37 1.34 -0.46 0.04 0.00 -2.05 -0.68 119.26 117.82 1ya7 h ALA 6 Ca -0.05 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1ya7 h ALA 6 Cb 1.18 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1ya7 h ALA 6 CO 0.10 0.52 -0.19 0.00 0.00 0.00 0.00 179.25 179.68 1ya7 h ALA 7 N 1.44 0.79 -0.66 0.00 0.00 -1.96 0.08 119.26 118.94 1ya7 h ALA 7 Ca 0.22 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ya7 h ALA 7 Cb 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1ya7 h ALA 7 CO -0.03 0.66 0.35 -0.07 0.00 0.00 0.00 179.25 180.15 1ya7 h LEU 8 N 0.80 0.85 -0.02 0.00 3.38 -0.69 -0.03 115.31 119.59 1ya7 h LEU 8 Ca 0.11 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ya7 h LEU 8 Cb 0.74 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1ya7 h LEU 8 CO 0.06 0.72 0.01 0.40 0.09 0.00 0.00 178.44 179.71 1ya7 h ILE 9 N 0.91 1.13 -0.78 1.22 1.08 -0.82 -2.38 117.51 117.87 1ya7 h ILE 9 Ca 0.23 -0.38 0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1ya7 h ILE 9 Cb 0.07 1.35 -0.04 0.00 -3.07 0.00 0.00 36.82 35.13 1ya7 h ILE 9 CO -0.03 0.10 0.51 -0.61 -0.69 0.00 0.00 178.15 177.43 1ya7 h GLN 10 N -0.12 1.01 -0.92 2.37 5.75 -0.91 -0.73 115.11 121.56 1ya7 h GLN 10 Ca 0.01 -0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1ya7 h GLN 10 Cb 0.16 -0.23 -0.05 0.00 1.07 0.00 0.00 27.48 28.44 1ya7 h GLN 10 CO -0.00 0.67 0.61 -0.97 -2.65 0.00 0.00 178.83 176.49 1ya7 h ASN 11 N 1.04 1.06 0.37 -0.69 -1.24 -0.91 0.94 115.58 116.15 1ya7 h ASN 11 Ca 0.29 -0.03 -0.01 0.00 0.71 0.00 0.00 56.30 57.26 1ya7 h ASN 11 Cb -0.09 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.69 1ya7 h ASN 11 CO -0.07 0.77 -0.23 -0.07 -1.29 0.00 0.00 177.43 176.54 1ya7 h LEU 12 N 1.25 -0.56 -0.97 0.34 3.38 -0.92 -2.94 115.31 114.90 1ya7 h LEU 12 Ca 0.34 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.23 1ya7 h LEU 12 Cb -0.14 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1ya7 h LEU 12 CO -0.07 -0.36 -0.51 0.03 0.09 0.00 0.00 178.44 177.62 1ya7 h ARG 13 N -0.57 0.02 -0.20 1.13 3.08 -0.80 -2.60 114.38 114.44 1ya7 h ARG 13 Ca -0.04 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1ya7 h ARG 13 Cb 0.47 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1ya7 h ARG 13 CO 0.04 0.53 -0.05 -0.44 -1.07 0.00 0.00 179.97 178.97 1ya7 h ASP 14 N 0.02 0.28 0.88 7.04 3.32 -0.88 -3.21 116.42 123.87 1ya7 h ASP 14 Ca -0.00 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 56.93 1ya7 h ASP 14 Cb 0.91 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 1ya7 h ASP 14 CO 0.07 0.38 -0.32 0.28 -1.72 0.00 0.00 179.24 177.93 1ya7 h SER 15 N 0.29 0.00 -2.73 6.45 0.02 -1.27 -3.39 113.55 112.91 1ya7 h SER 15 Ca 0.07 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.48 1ya7 h SER 15 Cb 0.29 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.43 1ya7 h SER 15 CO 0.01 0.32 -0.79 -0.31 -1.14 0.00 0.00 176.83 174.93 1ya7 s TYR 16 N -3.63 0.36 0.49 3.45 1.51 -1.21 -5.04 117.35 113.29 1ya7 s TYR 16 Ca 0.00 -0.98 0.04 0.00 -1.01 0.00 0.00 57.07 55.12 1ya7 s TYR 16 Cb 0.11 -0.89 -0.01 0.00 -0.11 0.00 0.00 41.96 41.06 1ya7 s TYR 16 CO 0.67 -0.83 0.14 0.95 -1.11 0.00 0.00 175.55 175.37 1ya7 s THR 17 N 1.93 1.57 0.44 -0.71 -4.23 -1.25 -4.70 115.64 108.69 1ya7 s THR 17 Ca 0.11 -1.81 0.23 0.00 -1.18 0.00 0.00 61.69 59.04 1ya7 s THR 17 Cb -0.17 -2.38 0.43 0.00 1.34 0.00 0.00 72.50 71.72 1ya7 s THR 17 CO -0.30 0.00 1.80 -0.08 -0.54 0.00 0.00 174.62 175.50 1ya7 h GLU 18 N 1.24 0.27 -0.78 3.99 4.57 -1.95 -1.98 114.58 119.95 1ya7 h GLU 18 Ca -0.42 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 57.73 1ya7 h GLU 18 Cb 1.29 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.79 1ya7 h GLU 18 CO 0.69 0.18 0.42 1.15 -1.18 0.00 0.00 179.01 180.27 1ya7 h THR 19 N 0.28 1.24 -0.52 0.32 2.02 -1.98 0.16 112.91 114.43 1ya7 h THR 19 Ca 0.56 -0.60 0.03 0.00 0.77 0.00 0.00 66.41 67.17 1ya7 h THR 19 Cb 1.63 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 1ya7 h THR 19 CO -0.20 0.26 0.30 0.28 0.37 0.00 0.00 175.52 176.54 1ya7 h SER 20 N 1.08 0.48 0.35 4.18 0.02 -1.74 -0.48 113.55 117.43 1ya7 h SER 20 Ca 0.27 0.01 -0.30 0.00 -0.84 0.00 0.00 61.79 60.93 1ya7 h SER 20 Cb 0.05 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 62.52 1ya7 h SER 20 CO -0.04 0.34 -1.29 0.77 -1.14 0.00 0.00 176.83 175.46 1ya7 h SER 21 N 0.60 0.70 -0.39 3.07 4.64 -1.51 -2.78 113.55 117.88 1ya7 h SER 21 Ca 0.21 -0.70 0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1ya7 h SER 21 Cb 0.04 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.88 1ya7 h SER 21 CO -0.10 1.53 0.21 0.15 -0.87 0.00 0.00 176.83 177.75 1ya7 h PHE 22 N 0.17 0.39 -0.96 4.77 3.57 -0.90 -1.77 116.94 122.21 1ya7 h PHE 22 Ca -0.18 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.45 1ya7 h PHE 22 Cb 1.99 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 40.52 1ya7 h PHE 22 CO 0.10 0.21 0.59 0.00 -2.23 0.00 0.00 178.31 176.98 1ya7 h ALA 23 N 1.20 1.44 -0.22 2.41 0.00 -1.06 0.70 119.26 123.73 1ya7 h ALA 23 Ca 0.16 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ya7 h ALA 23 Cb 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ya7 h ALA 23 CO -0.10 0.17 0.14 0.28 0.00 0.00 0.00 179.25 179.74 1ya7 h VAL 24 N 0.93 1.05 -0.69 0.00 2.07 -1.14 -1.92 116.25 116.55 1ya7 h VAL 24 Ca 0.48 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.87 1ya7 h VAL 24 Cb 0.49 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1ya7 h VAL 24 CO -0.27 0.05 0.29 0.40 0.02 0.00 0.00 177.57 178.05 1ya7 h ILE 25 N 0.29 1.24 -0.64 4.57 1.08 -0.20 -0.02 117.51 123.83 1ya7 h ILE 25 Ca 0.08 -0.74 0.01 0.00 -0.39 0.00 0.00 64.86 63.82 1ya7 h ILE 25 Cb -0.03 0.44 -0.03 0.00 -3.07 0.00 0.00 36.82 34.14 1ya7 h ILE 25 CO -0.02 0.30 0.42 -0.33 -0.69 0.00 0.00 178.15 177.83 1ya7 h GLU 26 N 0.97 0.84 -0.70 2.37 5.08 -0.81 -1.18 114.58 121.15 1ya7 h GLU 26 Ca 0.23 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1ya7 h GLU 26 Cb 0.19 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1ya7 h GLU 26 CO -0.02 0.56 0.39 1.49 -1.00 0.00 0.00 179.01 180.44 1ya7 h GLU 27 N 0.87 0.97 -0.35 2.33 4.57 -0.82 -3.04 114.58 119.11 1ya7 h GLU 27 Ca 0.23 -0.11 -0.13 0.00 -1.18 0.00 0.00 59.36 58.18 1ya7 h GLU 27 Cb -0.10 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.29 1ya7 h GLU 27 CO -0.05 0.72 -0.30 -1.49 -1.18 0.00 0.00 179.01 176.71 1ya7 h TRP 28 N 0.96 0.86 0.00 0.92 4.06 -0.61 -1.10 115.95 121.05 1ya7 h TRP 28 Ca 0.25 -0.22 0.00 0.00 2.06 0.00 0.00 58.89 60.98 1ya7 h TRP 28 Cb 0.02 -0.20 0.00 0.00 -1.00 0.00 0.00 29.16 27.98 1ya7 h TRP 28 CO -0.01 0.95 0.00 0.00 -3.56 0.00 0.00 178.44 175.82 1ya7 h ALA 29 N 1.03 1.00 -3.00 1.49 0.00 -1.12 -3.12 119.26 115.55 1ya7 h ALA 29 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ya7 h ALA 29 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1ya7 h ALA 29 CO 0.07 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1ya7 n ALA 30 N -2.07 0.36 -0.31 0.00 0.00 -1.06 -4.78 120.51 112.65 1ya7 n ALA 30 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.61 1ya7 n ALA 30 Cb 0.29 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.09 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 1.60 0.71 0.00 0.00 -1.73 -2.70 103.07 100.96 1ya7 h GLY 31 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1ya7 h GLY 31 CO 0.00 -0.39 -0.03 -0.84 0.00 0.00 0.00 176.54 175.28 1ya7 h THR 32 N 0.28 1.30 -0.31 4.70 2.02 -1.37 -1.45 112.91 118.08 1ya7 h THR 32 Ca 0.61 -0.99 -0.05 0.00 0.77 0.00 0.00 66.41 66.75 1ya7 h THR 32 Cb 1.27 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 69.41 1ya7 h THR 32 CO -0.62 0.28 -0.01 -0.07 0.37 0.00 0.00 175.52 175.47 1ya7 h LEU 33 N -0.13 0.45 0.01 2.58 3.38 -1.45 -1.72 115.31 118.43 1ya7 h LEU 33 Ca 0.03 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ya7 h LEU 33 Cb 0.46 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1ya7 h LEU 33 CO 0.01 0.52 -0.01 1.56 0.09 0.00 0.00 178.44 180.62 1ya7 h GLN 34 N 0.46 -0.01 -0.78 1.13 4.20 -1.41 -2.19 115.11 116.51 1ya7 h GLN 34 Ca 0.10 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.90 1ya7 h GLN 34 Cb 0.31 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.03 1ya7 h GLN 34 CO 0.01 0.17 0.43 1.49 -0.67 0.00 0.00 178.83 180.26 1ya7 h GLU 35 N -0.20 0.70 -0.17 1.46 4.57 -1.11 -1.23 114.58 118.61 1ya7 h GLU 35 Ca -0.00 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1ya7 h GLU 35 Cb 0.19 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1ya7 h GLU 35 CO 0.00 0.46 0.08 0.82 -1.18 0.00 0.00 179.01 179.20 1ya7 h ILE 36 N 0.72 1.00 -0.38 2.32 2.04 -1.20 -0.46 117.51 121.56 1ya7 h ILE 36 Ca 0.38 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 66.18 1ya7 h ILE 36 Cb 0.35 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1ya7 h ILE 36 CO -0.25 0.03 0.25 -0.08 0.00 0.00 0.00 178.15 178.10 1ya7 h GLU 37 N 0.18 0.49 -0.61 2.37 4.81 -1.09 -0.19 114.58 120.54 1ya7 h GLU 37 Ca 0.07 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1ya7 h GLU 37 Cb 0.01 -0.11 -0.10 0.00 0.63 0.00 0.00 28.75 29.18 1ya7 h GLU 37 CO -0.05 0.33 -0.53 0.78 -0.73 0.00 0.00 179.01 178.81 1ya7 h GLY 38 N 0.51 -0.81 0.78 1.92 0.00 -0.98 0.38 103.07 104.87 1ya7 h GLY 38 Ca 0.14 0.70 0.07 0.00 0.00 0.00 0.00 47.33 48.23 1ya7 h GLY 38 CO -0.03 -0.09 0.62 -2.22 0.00 0.00 0.00 176.54 174.82 1ya7 h ILE 39 N -0.25 1.07 -0.66 2.60 2.04 -0.70 -2.01 117.51 119.59 1ya7 h ILE 39 Ca 0.13 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.62 1ya7 h ILE 39 Cb 0.54 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 1ya7 h ILE 39 CO -0.71 0.20 0.44 0.00 0.00 0.00 0.00 178.15 178.07 1ya7 h ALA 40 N 1.49 0.84 -0.07 1.87 0.00 -0.04 -2.22 119.26 121.12 1ya7 h ALA 40 Ca 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1ya7 h ALA 40 Cb 0.21 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1ya7 h ALA 40 CO -0.17 0.27 0.00 0.87 0.00 0.00 0.00 179.25 180.23 1ya7 h LYS 41 N 0.90 0.12 -0.91 0.00 1.57 -0.55 -1.90 116.57 115.80 1ya7 h LYS 41 Ca 0.24 -0.04 0.17 0.00 -1.87 0.00 0.00 60.65 59.15 1ya7 h LYS 41 Cb -0.10 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.13 1ya7 h LYS 41 CO -0.05 0.39 0.58 0.00 -0.57 0.00 0.00 179.45 179.80 1ya7 h ALA 42 N 0.73 1.93 0.03 3.86 0.00 -1.30 -0.48 119.26 124.03 1ya7 h ALA 42 Ca 0.02 0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.70 1ya7 h ALA 42 Cb 0.33 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.04 1ya7 h ALA 42 CO 0.00 -0.20 -1.06 0.00 0.00 0.00 0.00 179.25 178.00 1ya7 h ALA 43 N 1.61 0.18 -0.68 0.00 0.00 -1.25 -1.69 119.26 117.43 1ya7 h ALA 43 Ca 0.47 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ya7 h ALA 43 Cb 0.88 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1ya7 h ALA 43 CO -0.22 0.75 0.44 0.00 0.00 0.00 0.00 179.25 180.22 1ya7 h ALA 44 N 0.51 0.86 -0.33 0.00 0.00 -0.91 -0.37 119.26 119.01 1ya7 h ALA 44 Ca -0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1ya7 h ALA 44 Cb 1.72 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1ya7 h ALA 44 CO 0.20 0.30 0.15 0.93 0.00 0.00 0.00 179.25 180.82 1ya7 h GLU 45 N 0.92 0.47 0.00 0.00 5.08 -1.06 -2.06 114.58 117.93 1ya7 h GLU 45 Ca 0.25 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1ya7 h GLU 45 Cb -0.09 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1ya7 h GLU 45 CO -0.05 0.45 -0.36 0.00 -1.00 0.00 0.00 179.01 178.05 1ya7 h ALA 46 N 1.00 1.36 -0.04 3.43 0.00 -1.11 -2.38 119.26 121.53 1ya7 h ALA 46 Ca 0.11 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 1ya7 h ALA 46 Cb 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ya7 h ALA 46 CO -0.01 0.45 -0.68 1.25 0.00 0.00 0.00 179.25 180.25 1ya7 h HIS 47 N 0.00 0.27 0.18 0.00 -0.00 -0.90 -2.54 115.15 112.16 1ya7 h HIS 47 Ca -0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 60.37 60.24 1ya7 h HIS 47 Cb 0.65 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 1ya7 h HIS 47 CO 0.00 0.82 -0.09 0.78 -0.00 0.00 0.00 177.93 179.44 1ya7 h GLY 48 N 1.62 -0.25 0.26 5.26 0.00 -0.87 -1.85 103.07 107.24 1ya7 h GLY 48 Ca -0.02 0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.48 1ya7 h GLY 48 CO 0.10 -0.09 -0.11 -2.08 0.00 0.00 0.00 176.54 174.36 1ya7 h VAL 49 N -0.44 0.61 -0.71 4.60 2.07 -1.50 -1.87 116.25 119.00 1ya7 h VAL 49 Ca -0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1ya7 h VAL 49 Cb 0.34 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1ya7 h VAL 49 CO 0.04 0.00 0.43 0.40 0.02 0.00 0.00 177.57 178.46 1ya7 h ILE 50 N -0.03 1.20 -0.98 4.57 2.04 -1.44 -2.44 117.51 120.42 1ya7 h ILE 50 Ca 0.17 -0.44 0.09 0.00 1.00 0.00 0.00 64.86 65.68 1ya7 h ILE 50 Cb 0.29 0.22 -0.07 0.00 -0.74 0.00 0.00 36.82 36.52 1ya7 h ILE 50 CO -0.38 0.21 0.63 -0.09 0.00 0.00 0.00 178.15 178.52 1ya7 h ARG 51 N 0.96 1.04 -0.95 2.37 2.43 -0.57 -2.62 114.38 117.05 1ya7 h ARG 51 Ca 0.25 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.24 1ya7 h ARG 51 Cb -0.04 -0.23 -0.07 0.00 -0.42 0.00 0.00 29.97 29.21 1ya7 h ARG 51 CO -0.05 0.69 0.15 0.09 -1.51 0.00 0.00 179.97 179.34 1ya7 n ASN 52 N -4.54 3.07 -4.09 -3.80 3.02 -0.80 -4.90 115.26 103.22 1ya7 n ASN 52 Ca 0.16 -2.49 -0.23 0.00 -0.03 0.00 0.00 54.58 51.99 1ya7 n ASN 52 Cb 0.25 -0.60 -0.16 0.00 -0.61 0.00 0.00 39.78 38.66 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 0.03 1.75 -0.05 6.41 0.01 -0.99 -5.04 113.70 115.82 1ya7 s SER 53 Ca 0.20 -0.28 -0.08 0.00 1.31 0.00 0.00 55.95 57.10 1ya7 s SER 53 Cb 0.16 -0.37 -0.05 0.00 0.21 0.00 0.00 66.02 65.97 1ya7 s SER 53 CO 0.04 0.14 0.23 -0.89 0.41 0.00 0.00 173.24 173.18 1ya7 s THR 54 N -0.07 5.35 -0.12 1.44 2.01 -1.26 -5.03 115.64 117.97 1ya7 s THR 54 Ca -0.00 0.30 -0.01 0.00 0.31 0.00 0.00 61.69 62.29 1ya7 s THR 54 Cb -0.09 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 1ya7 s THR 54 CO 0.01 0.52 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.07 1ya7 s TYR 55 N -1.13 2.91 0.36 4.92 1.51 -1.26 -5.07 117.35 119.59 1ya7 s TYR 55 Ca 0.21 -0.31 0.01 0.00 -1.01 0.00 0.00 57.07 55.96 1ya7 s TYR 55 Cb -0.13 -1.84 -0.00 0.00 -0.11 0.00 0.00 41.96 39.88 1ya7 s TYR 55 CO 0.10 0.02 0.02 0.41 -1.11 0.00 0.00 175.55 174.99 1ya7 n GLY 56 N 3.10 3.69 0.09 0.71 0.00 -1.26 -4.98 105.19 106.54 1ya7 n GLY 56 Ca -0.18 -2.28 0.08 0.00 0.00 0.00 0.00 46.02 43.64 1ya7 n GLY 56 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ya7 n ARG 57 N -0.89 0.10 0.21 1.61 1.85 -1.26 -1.59 116.66 116.69 1ya7 n ARG 57 Ca -0.14 0.45 0.07 0.00 -1.00 0.00 0.00 57.85 57.23 1ya7 n ARG 57 Cb 0.47 -1.74 0.46 0.00 -1.05 0.00 0.00 32.46 30.60 1ya7 n ARG 57 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ya7 h ALA 58 N 2.20 1.23 0.00 2.89 0.00 -1.99 -1.90 119.26 121.69 1ya7 h ALA 58 Ca 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1ya7 h ALA 58 Cb 0.18 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ya7 h ALA 58 CO 0.00 0.37 -0.12 1.96 0.00 0.00 0.00 179.25 181.46 1ya7 h GLN 59 N 0.00 0.00 0.00 0.00 7.50 -1.62 -2.62 115.11 118.38 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 0.64 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.17 1ya7 h GLN 59 CO 0.04 0.12 -0.19 0.00 -1.50 0.00 0.00 178.83 177.30 1ya7 n ALA 60 N -2.15 2.77 0.30 3.87 0.00 -0.74 -3.82 120.51 120.75 1ya7 n ALA 60 Ca 0.01 -0.19 0.11 0.00 0.00 0.00 0.00 53.44 53.38 1ya7 n ALA 60 Cb 0.43 -1.34 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 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 -1.53 0.47 -4.16 0.00 1.02 -0.99 -4.87 120.64 110.58 1ya7 n GLU 61 Ca 0.06 0.02 -0.16 0.00 -0.02 0.00 0.00 57.16 57.07 1ya7 n GLU 61 Cb 0.34 -1.68 -0.14 0.00 -0.02 0.00 0.00 31.44 29.95 1ya7 n GLU 61 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1ya7 s LYS 62 N -3.31 0.48 -0.28 3.49 2.20 -1.21 -5.11 119.74 116.00 1ya7 s LYS 62 Ca 0.00 -0.33 -0.22 0.00 -0.36 0.00 0.00 55.97 55.07 1ya7 s LYS 62 Cb 0.12 -0.42 -0.01 0.00 -1.51 0.00 0.00 37.83 36.01 1ya7 s LYS 62 CO 0.81 0.11 0.69 -1.12 -0.36 0.00 0.00 175.35 175.48 1ya7 s SER 63 N -0.45 6.61 -0.14 1.43 0.01 -1.26 -4.82 113.70 115.08 1ya7 s SER 63 Ca -0.00 0.67 -0.29 0.00 1.31 0.00 0.00 55.95 57.63 1ya7 s SER 63 Cb -0.04 -2.37 -0.06 0.00 0.21 0.00 0.00 66.02 63.77 1ya7 s SER 63 CO -0.00 -0.48 1.97 -2.84 0.41 0.00 0.00 173.24 172.31 1ya7 s PRO 64 N 2.68 3.64 0.47 12.44 0.02 -1.26 -4.87 135.00 148.12 1ya7 s PRO 64 Ca 0.29 2.12 0.14 0.00 0.02 0.00 0.00 61.00 63.57 1ya7 s PRO 64 Cb -0.15 -4.21 1.09 0.00 0.02 0.00 0.00 34.50 31.25 1ya7 s PRO 64 CO 0.10 -1.51 2.05 1.49 -0.33 0.00 0.00 177.00 178.80 1ya7 h GLU 65 N 12.44 0.04 -0.35 5.54 4.81 -2.00 -2.56 114.58 132.50 1ya7 h GLU 65 Ca -0.42 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 58.68 1ya7 h GLU 65 Cb 1.22 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1ya7 h GLU 65 CO 0.97 0.13 -0.28 0.37 -0.73 0.00 0.00 179.01 179.46 1ya7 h GLN 66 N 0.04 0.72 -0.04 1.92 4.15 -2.00 -2.30 115.11 117.60 1ya7 h GLN 66 Ca 0.01 -0.32 -0.02 0.00 0.77 0.00 0.00 58.65 59.09 1ya7 h GLN 66 Cb 0.18 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 1ya7 h GLN 66 CO 0.01 0.92 -0.05 -0.07 -1.93 0.00 0.00 178.83 177.71 1ya7 h LEU 67 N 0.62 0.12 -1.48 -2.39 3.38 -1.86 -2.76 115.31 110.93 1ya7 h LEU 67 Ca 0.08 -0.51 0.20 0.00 0.09 0.00 0.00 57.88 57.75 1ya7 h LEU 67 Cb 0.79 -0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.44 1ya7 h LEU 67 CO 0.07 0.60 0.60 -0.07 0.09 0.00 0.00 178.44 179.72 1ya7 h LEU 68 N -0.36 0.43 -0.29 1.67 3.38 -1.48 -1.40 115.31 117.26 1ya7 h LEU 68 Ca 0.01 0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 1ya7 h LEU 68 Cb 0.57 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1ya7 h LEU 68 CO 0.01 0.17 -0.71 1.23 0.09 0.00 0.00 178.44 179.23 1ya7 h GLY 69 N 0.42 0.73 0.87 0.83 0.00 -1.34 -0.61 103.07 103.97 1ya7 h GLY 69 Ca 0.48 -0.98 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 1ya7 h GLY 69 CO -0.19 0.88 -0.01 -2.08 0.00 0.00 0.00 176.54 175.14 1ya7 h VAL 70 N 0.47 1.08 -0.83 4.60 2.07 -1.03 -1.83 116.25 120.78 1ya7 h VAL 70 Ca -0.03 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1ya7 h VAL 70 Cb 1.31 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 1ya7 h VAL 70 CO 0.14 0.08 0.47 -0.07 0.02 0.00 0.00 177.57 178.20 1ya7 h LEU 71 N -0.15 1.03 0.09 2.57 3.38 -1.28 -0.57 115.31 120.37 1ya7 h LEU 71 Ca -0.00 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ya7 h LEU 71 Cb 0.14 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1ya7 h LEU 71 CO 0.00 0.82 -0.05 -0.61 0.09 0.00 0.00 178.44 178.69 1ya7 h GLN 72 N 1.16 -0.12 -0.63 1.13 5.75 -1.09 -1.47 115.11 119.84 1ya7 h GLN 72 Ca 0.30 0.01 0.08 0.00 -0.15 0.00 0.00 58.65 58.89 1ya7 h GLN 72 Cb 0.01 0.03 -0.07 0.00 1.07 0.00 0.00 27.48 28.52 1ya7 h GLN 72 CO -0.05 0.05 0.29 -0.09 -2.65 0.00 0.00 178.83 176.38 1ya7 h ARG 73 N -0.27 0.50 -0.14 1.69 2.43 -1.11 -1.04 114.38 116.43 1ya7 h ARG 73 Ca -0.01 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1ya7 h ARG 73 Cb 0.23 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1ya7 h ARG 73 CO 0.02 0.33 0.08 -0.92 -1.51 0.00 0.00 179.97 177.97 1ya7 h TYR 74 N 0.51 0.14 -0.49 2.20 3.20 -1.01 -2.33 116.97 119.20 1ya7 h TYR 74 Ca 0.31 0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.24 1ya7 h TYR 74 Cb 0.32 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.49 1ya7 h TYR 74 CO -0.13 0.09 0.21 0.37 -1.64 0.00 0.00 178.16 177.06 1ya7 h GLN 75 N 0.16 0.40 -0.82 1.82 4.15 -1.00 -1.06 115.11 118.77 1ya7 h GLN 75 Ca 0.06 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1ya7 h GLN 75 Cb 0.00 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.56 1ya7 h GLN 75 CO -0.03 0.26 0.53 -0.44 -1.93 0.00 0.00 178.83 177.22 1ya7 h ASP 76 N 0.41 0.95 0.09 -0.69 3.32 -1.05 -0.56 116.42 118.89 1ya7 h ASP 76 Ca 0.23 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1ya7 h ASP 76 Cb 0.19 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1ya7 h ASP 76 CO -0.20 0.70 -0.04 0.25 -1.72 0.00 0.00 179.24 178.23 1ya7 h LEU 77 N 1.11 -0.10 -0.84 1.55 5.85 -0.96 -2.38 115.31 119.55 1ya7 h LEU 77 Ca 0.30 -0.31 0.15 0.00 0.84 0.00 0.00 57.88 58.86 1ya7 h LEU 77 Cb -0.11 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 40.85 1ya7 h LEU 77 CO -0.06 0.26 0.41 0.00 -0.34 0.00 0.00 178.44 178.71 1ya7 h HIS 79 N 0.56 0.23 -0.40 0.00 -0.00 -1.07 0.59 115.15 115.06 1ya7 h HIS 79 Ca 0.46 0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.73 1ya7 h HIS 79 Cb 0.69 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 28.02 1ya7 h HIS 79 CO -0.11 0.14 -0.20 -0.91 -0.00 0.00 0.00 177.93 176.84 1ya7 h ASN 80 N 0.26 0.80 -0.22 3.26 2.35 -0.86 -2.14 115.58 119.02 1ya7 h ASN 80 Ca 0.09 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.53 1ya7 h ASN 80 Cb 0.00 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 1ya7 h ASN 80 CO -0.05 0.99 0.02 0.58 -1.65 0.00 0.00 177.43 177.32 1ya7 h VAL 81 N 0.69 1.24 -0.30 2.81 2.07 -0.94 -1.12 116.25 120.71 1ya7 h VAL 81 Ca 0.10 -0.82 0.07 0.00 0.82 0.00 0.00 66.70 66.87 1ya7 h VAL 81 Cb 0.72 1.35 -0.08 0.00 -1.52 0.00 0.00 31.29 31.76 1ya7 h VAL 81 CO 0.06 0.26 -0.26 0.22 0.02 0.00 0.00 177.57 177.86 1ya7 h TYR 82 N 0.16 -0.69 -0.39 1.57 3.20 -0.81 0.33 116.97 120.35 1ya7 h TYR 82 Ca 0.07 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 1ya7 h TYR 82 Cb 0.36 0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1ya7 h TYR 82 CO 0.03 -0.33 0.02 0.00 -1.64 0.00 0.00 178.16 176.24 1ya7 h GLN 84 N 0.58 0.73 -0.89 0.00 4.20 -0.72 -2.94 115.11 116.07 1ya7 h GLN 84 Ca 0.12 -0.56 0.09 0.00 0.06 0.00 0.00 58.65 58.37 1ya7 h GLN 84 Cb 0.34 0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.15 1ya7 h GLN 84 CO 0.01 1.18 0.54 0.00 -0.67 0.00 0.00 178.83 179.88 1ya7 h ALA 85 N 0.55 1.28 0.00 3.87 0.00 0.06 -2.50 119.26 122.52 1ya7 h ALA 85 Ca -0.03 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1ya7 h ALA 85 Cb 1.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1ya7 h ALA 85 CO 0.14 0.19 -0.30 0.93 0.00 0.00 0.00 179.25 180.20 1ya7 h GLU 86 N 0.90 0.00 0.00 0.00 4.39 -1.29 -0.26 114.58 118.31 1ya7 h GLU 86 Ca 0.42 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.12 1ya7 h GLU 86 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1ya7 h GLU 86 CO -0.24 0.30 -0.00 1.15 -1.16 0.00 0.00 179.01 179.06 1ya7 h THR 87 N 0.00 1.10 -0.50 1.13 2.02 -1.27 -0.30 112.91 115.09 1ya7 h THR 87 Ca -0.00 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 66.90 1ya7 h THR 87 Cb 0.56 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 1ya7 h THR 87 CO 0.04 0.08 0.29 0.40 0.37 0.00 0.00 175.52 176.70 1ya7 h ILE 88 N -0.13 1.03 -0.50 3.11 2.04 -1.14 -1.51 117.51 120.41 1ya7 h ILE 88 Ca -0.00 -0.20 0.01 0.00 1.00 0.00 0.00 64.86 65.68 1ya7 h ILE 88 Cb 0.13 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 1ya7 h ILE 88 CO 0.00 0.11 0.32 0.03 0.00 0.00 0.00 178.15 178.61 1ya7 h ARG 89 N 0.58 0.63 -0.11 2.37 3.08 -0.94 -2.54 114.38 117.45 1ya7 h ARG 89 Ca 0.20 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.26 1ya7 h ARG 89 Cb 0.04 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 29.90 1ya7 h ARG 89 CO -0.10 0.42 -0.20 1.15 -1.07 0.00 0.00 179.97 180.16 1ya7 h THR 90 N 0.65 0.49 -0.69 2.04 2.02 -0.67 0.43 112.91 117.19 1ya7 h THR 90 Ca 0.19 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.51 1ya7 h THR 90 Cb -0.03 0.49 -0.09 0.00 -1.74 0.00 0.00 68.15 66.77 1ya7 h THR 90 CO -0.06 0.00 0.21 0.58 0.37 0.00 0.00 175.52 176.62 1ya7 h VAL 91 N -0.27 0.63 -0.02 3.16 2.07 -0.88 -1.75 116.25 119.18 1ya7 h VAL 91 Ca 0.09 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.41 1ya7 h VAL 91 Cb 0.41 0.26 0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1ya7 h VAL 91 CO -0.27 0.06 -0.34 0.40 0.02 0.00 0.00 177.57 177.45 1ya7 h ILE 92 N 0.34 1.49 -0.28 4.57 2.04 -1.18 -3.34 117.51 121.14 1ya7 h ILE 92 Ca 0.37 -1.90 -0.05 0.00 1.00 0.00 0.00 64.86 64.29 1ya7 h ILE 92 Cb 0.57 2.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 1ya7 h ILE 92 CO -0.42 0.53 -0.03 0.00 0.00 0.00 0.00 178.15 178.23 1ya7 h ALA 93 N 0.32 1.43 -0.01 1.87 0.00 -0.61 -0.46 119.26 121.81 1ya7 h ALA 93 Ca -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1ya7 h ALA 93 Cb 1.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1ya7 h ALA 93 CO 0.07 0.40 0.00 0.44 0.00 0.00 0.00 179.25 180.16 1ya7 n ILE 94 N -4.29 0.01 -0.06 0.00 -5.35 -0.69 -3.30 119.36 105.68 1ya7 n ILE 94 Ca 0.01 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 1ya7 n ILE 94 Cb 0.24 -0.31 0.00 0.00 -1.74 0.00 0.00 39.64 37.83 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 -0.79 0.09 -1.68 6.28 1.74 -0.22 -4.88 116.66 117.20 1ya7 n ARG 95 Ca 0.17 -0.40 -0.46 0.00 -0.77 0.00 0.00 57.85 56.39 1ya7 n ARG 95 Cb 0.09 -0.90 -0.04 0.00 -1.02 0.00 0.00 32.46 30.60 1ya7 n ARG 95 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1ya7 n ILE 96 N -0.13 0.37 -2.32 0.55 5.41 -0.94 -4.80 119.36 117.51 1ya7 n ILE 96 Ca 0.00 -0.07 -0.26 0.00 1.00 0.00 0.00 62.75 63.42 1ya7 n ILE 96 Cb 0.01 -1.88 0.14 0.00 -0.71 0.00 0.00 39.64 37.21 1ya7 n ILE 96 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1ya7 s PRO 97 N 2.84 1.21 0.01 0.38 0.04 -1.26 -4.98 135.00 133.24 1ya7 s PRO 97 Ca 0.86 -0.84 -0.39 0.00 0.04 0.00 0.00 61.00 60.67 1ya7 s PRO 97 Cb -0.61 -2.13 -0.19 0.00 0.04 0.00 0.00 34.50 31.61 1ya7 s PRO 97 CO 0.43 -1.87 1.19 -1.91 0.04 0.00 0.00 177.00 174.88 1ya7 n GLU 98 N -3.24 0.42 -1.91 4.56 2.13 -1.26 -4.83 120.64 116.52 1ya7 n GLU 98 Ca 0.15 0.15 -0.42 0.00 0.66 0.00 0.00 57.16 57.70 1ya7 n GLU 98 Cb 0.60 -1.70 -0.03 0.00 0.27 0.00 0.00 31.44 30.58 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 0.30 1.97 0.19 4.31 5.65 -1.26 -4.99 115.29 121.45 1ya7 s HIS 99 Ca 0.89 0.09 -0.01 0.00 0.25 0.00 0.00 55.06 56.29 1ya7 s HIS 99 Cb -1.16 -4.00 -0.04 0.00 -1.18 0.00 0.00 32.58 26.19 1ya7 s HIS 99 CO 0.54 -4.23 0.10 0.15 -0.65 0.00 0.00 174.74 170.65 1ya7 s LYS 100 N 3.67 1.14 -0.24 2.88 1.02 -1.26 -5.02 119.74 121.93 1ya7 s LYS 100 Ca 0.77 -1.59 0.14 0.00 0.02 0.00 0.00 55.97 55.31 1ya7 s LYS 100 Cb -0.37 0.20 0.81 0.00 -0.52 0.00 0.00 37.83 37.95 1ya7 s LYS 100 CO 0.33 -0.34 1.75 0.39 -0.92 0.00 0.00 175.35 176.56 1ya7 n GLU 101 N -0.24 4.76 -3.91 1.68 -0.58 -1.26 -4.95 120.64 116.15 1ya7 n GLU 101 Ca -0.00 -3.16 -0.09 0.00 -0.42 0.00 0.00 57.16 53.49 1ya7 n GLU 101 Cb 0.65 -2.25 -0.05 0.00 -0.57 0.00 0.00 31.44 29.22 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 -2.80 1.48 -1.38 3.49 -1.05 -1.26 -4.95 118.70 112.22 1ya7 s GLU 102 Ca 0.54 -1.11 -0.07 0.00 -0.15 0.00 0.00 54.97 54.19 1ya7 s GLU 102 Cb 0.42 0.49 0.03 0.00 -0.44 0.00 0.00 34.13 34.63 1ya7 s GLU 102 CO 0.15 -0.62 0.99 -3.47 0.95 0.00 0.00 175.26 173.26 1ya7 n ASP 103 N -0.36 -4.02 -0.84 0.83 2.03 -1.26 -4.91 116.55 108.02 1ya7 n ASP 103 Ca -0.05 -0.69 0.07 0.00 0.52 0.00 0.00 54.79 54.64 1ya7 n ASP 103 Cb 0.62 -4.47 0.22 0.00 -0.72 0.00 0.00 41.12 36.78 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 -2.99 3.57 0.07 1.67 3.02 -1.26 -4.73 115.26 114.62 1ya7 n ASN 104 Ca -0.10 -2.58 -0.13 0.00 -0.03 0.00 0.00 54.58 51.74 1ya7 n ASN 104 Cb 0.59 -0.42 -0.07 0.00 -0.61 0.00 0.00 39.78 39.27 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 2.03 -0.09 -0.77 3.41 3.38 -1.91 -0.74 115.31 120.63 1ya7 h LEU 105 Ca 0.00 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1ya7 h LEU 105 Cb 1.17 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1ya7 h LEU 105 CO 0.14 -0.03 -0.04 1.23 0.09 0.00 0.00 178.44 179.82 1ya7 h GLY 106 N -0.13 0.96 0.55 0.83 0.00 -1.84 -2.72 103.07 100.71 1ya7 h GLY 106 Ca -0.01 -0.70 0.10 0.00 0.00 0.00 0.00 47.33 46.72 1ya7 h GLY 106 CO 0.02 0.65 0.55 -2.08 0.00 0.00 0.00 176.54 175.67 1ya7 h VAL 107 N 0.82 0.95 -0.53 4.60 2.07 -1.72 0.09 116.25 122.52 1ya7 h VAL 107 Ca 0.15 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1ya7 h VAL 107 Cb 0.55 -0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 1ya7 h VAL 107 CO 0.03 0.17 0.22 0.00 0.02 0.00 0.00 177.57 178.01 1ya7 h ALA 108 N 1.48 1.39 -0.40 1.67 0.00 -0.90 -1.03 119.26 121.46 1ya7 h ALA 108 Ca 0.43 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1ya7 h ALA 108 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1ya7 h ALA 108 CO -0.24 0.47 0.26 0.28 0.00 0.00 0.00 179.25 180.02 1ya7 h VAL 109 N 0.76 1.11 -0.48 0.00 2.07 -0.82 -0.41 116.25 118.48 1ya7 h VAL 109 Ca 0.18 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.53 1ya7 h VAL 109 Cb 0.14 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 1ya7 h VAL 109 CO -0.02 0.10 0.26 1.56 0.02 0.00 0.00 177.57 179.50 1ya7 h GLN 110 N 0.54 0.50 -0.51 1.57 4.20 -0.39 -1.66 115.11 119.36 1ya7 h GLN 110 Ca 0.15 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1ya7 h GLN 110 Cb -0.05 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 1ya7 h GLN 110 CO -0.03 0.33 -0.17 0.45 -0.67 0.00 0.00 178.83 178.74 1ya7 h HIS 111 N 0.52 1.16 -0.08 2.96 3.86 -1.02 -1.07 115.15 121.47 1ya7 h HIS 111 Ca 0.20 -0.27 0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1ya7 h HIS 111 Cb 0.07 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.25 1ya7 h HIS 111 CO -0.09 1.10 -0.01 0.00 0.86 0.00 0.00 177.93 179.79 1ya7 h ALA 112 N 0.90 0.06 -0.50 2.45 0.00 -0.85 -1.43 119.26 119.88 1ya7 h ALA 112 Ca 0.12 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1ya7 h ALA 112 Cb 0.75 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1ya7 h ALA 112 CO 0.06 -0.48 -0.00 0.28 0.00 0.00 0.00 179.25 179.10 1ya7 h VAL 113 N 0.01 1.26 -0.99 0.00 2.07 -1.22 -2.63 116.25 114.75 1ya7 h VAL 113 Ca 0.04 -1.09 0.11 0.00 0.82 0.00 0.00 66.70 66.58 1ya7 h VAL 113 Cb 0.06 0.96 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 1ya7 h VAL 113 CO -0.08 0.38 0.62 -0.07 0.02 0.00 0.00 177.57 178.44 1ya7 h LEU 114 N 0.76 0.92 -0.20 2.57 3.38 -1.13 -1.94 115.31 119.67 1ya7 h LEU 114 Ca 0.14 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.17 1ya7 h LEU 114 Cb 0.53 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1ya7 h LEU 114 CO 0.03 0.51 0.10 0.50 0.09 0.00 0.00 178.44 179.67 1ya7 h LYS 115 N 1.00 0.21 -0.61 1.13 3.64 -1.01 0.99 116.57 121.92 1ya7 h LYS 115 Ca 0.48 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 1ya7 h LYS 115 Cb 0.43 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 1ya7 h LYS 115 CO -0.25 0.14 0.40 0.97 -2.27 0.00 0.00 179.45 178.44 1ya7 h ILE 116 N 0.22 1.16 -0.59 2.00 2.10 -1.16 -0.57 117.51 120.68 1ya7 h ILE 116 Ca 0.08 -0.32 -0.00 0.00 1.08 0.00 0.00 64.86 65.70 1ya7 h ILE 116 Cb 0.01 0.28 -0.03 0.00 -1.09 0.00 0.00 36.82 35.99 1ya7 h ILE 116 CO -0.05 0.16 0.36 0.40 -1.08 0.00 0.00 178.15 177.95 1ya7 h ILE 117 N 0.83 1.17 -0.73 2.19 2.04 -1.15 0.28 117.51 122.14 1ya7 h ILE 117 Ca 0.22 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1ya7 h ILE 117 Cb -0.08 0.35 -0.06 0.00 -0.74 0.00 0.00 36.82 36.29 1ya7 h ILE 117 CO -0.05 0.17 0.40 0.44 0.00 0.00 0.00 178.15 179.12 1ya7 h ASP 118 N 0.80 0.59 -0.41 1.72 3.32 -0.60 0.09 116.42 121.93 1ya7 h ASP 118 Ca 0.21 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.31 1ya7 h ASP 118 Cb -0.03 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1ya7 h ASP 118 CO -0.04 0.36 0.25 -0.08 -1.72 0.00 0.00 179.24 178.01 1ya7 h GLU 119 N 0.72 0.50 -0.05 3.56 4.81 -0.30 0.16 114.58 123.98 1ya7 h GLU 119 Ca 0.34 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 1ya7 h GLU 119 Cb 0.26 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 1ya7 h GLU 119 CO -0.21 0.33 -0.22 1.25 -0.73 0.00 0.00 179.01 179.43 1ya7 h LEU 120 N 0.52 -0.67 -0.36 1.64 5.85 -0.45 -0.10 115.31 121.73 1ya7 h LEU 120 Ca 0.15 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 1ya7 h LEU 120 Cb -0.03 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1ya7 h LEU 120 CO -0.05 -0.28 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.34 1ya7 h GLU 121 N -0.33 0.70 0.00 1.25 5.08 -0.77 -1.16 114.58 119.36 1ya7 h GLU 121 Ca 0.08 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1ya7 h GLU 121 Cb 0.43 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1ya7 h GLU 121 CO -0.24 0.86 -0.58 -0.89 -1.00 0.00 0.00 179.01 177.16 1ya7 n ILE 122 N -4.38 1.43 0.15 3.13 2.08 0.54 -3.14 119.36 119.17 1ya7 n ILE 122 Ca -0.02 0.20 -0.07 0.00 0.56 0.00 0.00 62.75 63.43 1ya7 n ILE 122 Cb 0.35 -2.38 -0.03 0.00 -0.75 0.00 0.00 39.64 36.83 1ya7 n ILE 122 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1ya7 h LYS 123 N -1.00 -0.43 -0.42 0.38 6.56 -1.20 -2.79 116.57 117.66 1ya7 h LYS 123 Ca -0.01 0.03 -0.02 0.00 -1.06 0.00 0.00 60.65 59.59 1ya7 h LYS 123 Cb 0.58 0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 32.32 1ya7 h LYS 123 CO -0.01 -0.29 0.19 1.15 -2.06 0.00 0.00 179.45 178.44 1ya7 h THR 124 N -1.07 1.19 -0.00 -0.16 2.02 -1.14 -2.79 112.91 110.95 1ya7 h THR 124 Ca -0.05 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.59 1ya7 h THR 124 Cb 0.35 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1ya7 h THR 124 CO 0.08 0.20 -0.48 0.18 0.37 0.00 0.00 175.52 175.87 1ya7 n LEU 125 N -4.66 0.76 -4.06 2.58 4.77 -0.45 -4.81 117.00 111.13 1ya7 n LEU 125 Ca 0.00 -0.15 -0.41 0.00 -0.03 0.00 0.00 56.01 55.43 1ya7 n LEU 125 Cb 0.12 -0.18 -0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1ya7 n LEU 125 CO 0.37 0.17 -0.22 0.61 -1.33 0.00 0.00 177.39 176.99 1ya7 n GLY 126 N 1.45 -0.68 0.15 -0.72 0.00 -1.05 -1.13 105.19 103.21 1ya7 n GLY 126 Ca 0.07 0.31 0.11 0.00 0.00 0.00 0.00 46.02 46.52 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 -2.34 0.00 -4.29 1.61 4.64 -1.65 -3.17 113.55 108.35 1ya7 h SER 127 Ca -0.69 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.12 1ya7 h SER 127 Cb 1.40 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.58 1ya7 h SER 127 CO 0.56 0.02 0.36 -0.83 -0.87 0.00 0.00 176.83 176.07 1ya7 s GLY 128 N -4.32 1.82 0.39 -0.77 0.00 -1.26 -4.97 107.32 98.20 1ya7 s GLY 128 Ca 0.02 0.22 0.08 0.00 0.00 0.00 0.00 44.72 45.05 1ya7 s GLY 128 CO 0.75 0.54 1.94 0.83 0.00 0.00 0.00 173.10 177.16 1ya7 h GLU 129 N -0.43 0.33 -3.42 2.90 5.08 -2.01 -3.44 114.58 113.59 1ya7 h GLU 129 Ca -0.45 -0.06 -0.29 0.00 -1.00 0.00 0.00 59.36 57.56 1ya7 h GLU 129 Cb 1.22 -0.05 -0.34 0.00 0.50 0.00 0.00 28.75 30.08 1ya7 h GLU 129 CO 0.56 0.39 -0.69 0.15 -1.00 0.00 0.00 179.01 178.42 1ya7 s LYS 130 N -4.92 -0.00 0.55 2.33 1.02 -1.26 -5.14 119.74 112.32 1ya7 s LYS 130 Ca -0.06 0.26 -0.20 0.00 0.02 0.00 0.00 55.97 55.98 1ya7 s LYS 130 Cb 0.16 -0.25 -0.05 0.00 -0.52 0.00 0.00 37.83 37.17 1ya7 s LYS 130 CO 0.74 -0.18 1.23 -1.12 -0.92 0.00 0.00 175.35 175.09 1ya7 s SER 131 N 1.20 5.45 1.14 2.83 0.01 -1.26 -5.05 113.70 118.02 1ya7 s SER 131 Ca -0.08 2.45 -0.17 0.00 1.31 0.00 0.00 55.95 59.46 1ya7 s SER 131 Cb -0.13 -2.61 0.26 0.00 0.21 0.00 0.00 66.02 63.75 1ya7 s SER 131 CO -0.04 -1.42 1.12 -0.83 0.41 0.00 0.00 173.24 172.48 1ya7 s GLY 132 N -1.39 1.59 0.66 3.44 0.00 -1.26 -4.87 107.32 105.49 1ya7 s GLY 132 Ca 0.73 -0.85 0.38 0.00 0.00 0.00 0.00 44.72 44.98 1ya7 s GLY 132 CO 0.37 -0.03 2.17 1.48 0.00 0.00 0.00 173.10 177.08 1ya7 h SER 133 N -2.36 0.00 0.37 1.64 4.64 -2.08 -0.44 113.55 115.33 1ya7 h SER 133 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1ya7 h SER 133 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1ya7 h SER 133 CO 0.40 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.97 1ya7 n GLY 134 N -1.14 -0.87 4.01 -0.77 0.00 -1.26 -5.01 105.19 100.15 1ya7 n GLY 134 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.34 -1.74 2.67 -0.02 0.00 -0.17 -4.79 105.19 100.80 1ya7 n GLY 135 Ca 0.03 -1.63 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 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 2.07 -1.61 4.61 0.00 -1.26 -4.18 121.76 119.96 1ya7 s ALA 136 Ca 0.00 -2.59 0.29 0.00 0.00 0.00 0.00 51.96 49.66 1ya7 s ALA 136 Cb 0.00 -1.85 1.36 0.00 0.00 0.00 0.00 23.12 22.63 1ya7 s ALA 136 CO 0.00 -2.06 1.94 -0.35 0.00 0.00 0.00 175.76 175.29 1ya7 n PRO 137 N 3.42 0.63 -2.92 0.00 -0.04 -1.26 -4.73 135.00 130.10 1ya7 n PRO 137 Ca 0.12 -0.15 -0.39 0.00 -0.04 0.00 0.00 63.50 63.03 1ya7 n PRO 137 Cb 0.36 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.26 1ya7 n PRO 137 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1ya7 s THR 138 N -2.47 4.28 0.41 0.52 -1.32 -1.26 -4.96 115.64 110.84 1ya7 s THR 138 Ca 0.30 1.81 0.18 0.00 -1.21 0.00 0.00 61.69 62.77 1ya7 s THR 138 Cb 0.20 -4.19 0.38 0.00 -1.51 0.00 0.00 72.50 67.39 1ya7 s THR 138 CO 0.46 0.51 1.83 -0.65 -2.21 0.00 0.00 174.62 174.56 1ya7 h PRO 139 N 4.24 0.40 -2.01 7.08 0.11 -1.86 -3.43 132.00 136.52 1ya7 h PRO 139 Ca -0.46 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1ya7 h PRO 139 Cb 1.20 -0.09 -0.21 0.00 0.11 0.00 0.00 31.00 32.02 1ya7 h PRO 139 CO 0.66 0.27 0.14 -1.50 -0.21 0.00 0.00 178.00 177.36 1ya7 s ILE 140 N -5.45 0.00 0.14 4.15 2.07 -1.26 -4.94 121.20 115.91 1ya7 s ILE 140 Ca -0.08 -0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.18 1ya7 s ILE 140 Cb 0.23 -0.99 0.02 0.00 0.13 0.00 0.00 42.46 41.85 1ya7 s ILE 140 CO 0.79 -0.00 0.20 0.61 -1.91 0.00 0.00 174.94 174.63 1ya7 n GLY 141 N 2.27 1.86 0.38 1.50 0.00 -1.26 -4.84 105.19 105.11 1ya7 n GLY 141 Ca -0.15 -2.14 0.20 0.00 0.00 0.00 0.00 46.02 43.92 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 0.49 -1.29 1.61 1.85 -1.10 -2.65 114.93 113.85 1ya7 h MET 142 Ca -0.07 -0.03 -0.69 0.00 -0.61 0.00 0.00 59.70 58.30 1ya7 h MET 142 Cb 0.30 -0.11 -0.30 0.00 0.43 0.00 0.00 31.60 31.92 1ya7 h MET 142 CO 0.09 0.32 0.72 0.66 -0.40 0.00 0.00 176.91 178.31 1ya7 n TYR 143 N -4.72 3.13 -0.10 1.39 4.02 -1.26 -4.69 117.16 114.93 1ya7 n TYR 143 Ca 0.25 -2.77 -0.08 0.00 -0.01 0.00 0.00 57.90 55.29 1ya7 n TYR 143 Cb 0.79 -1.23 -0.00 0.00 -0.02 0.00 0.00 39.34 38.87 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 2.33 0.43 -0.42 -0.72 0.00 -1.83 -1.38 119.26 117.67 1ya7 h ALA 144 Ca 0.57 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.52 1ya7 h ALA 144 Cb 0.65 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1ya7 h ALA 144 CO 1.45 -0.13 0.14 1.25 0.00 0.00 0.00 179.25 181.96 1ya7 h LEU 145 N 0.43 0.13 -0.88 0.00 5.85 -1.83 0.23 115.31 119.25 1ya7 h LEU 145 Ca 0.13 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1ya7 h LEU 145 Cb -0.02 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1ya7 h LEU 145 CO -0.05 0.11 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.01 1ya7 h ARG 146 N 0.30 0.77 -0.33 1.25 9.65 -1.90 -0.93 114.38 123.19 1ya7 h ARG 146 Ca 0.20 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1ya7 h ARG 146 Cb 0.19 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.68 1ya7 h ARG 146 CO -0.21 0.82 0.21 1.49 2.80 0.00 0.00 179.97 185.08 1ya7 h GLU 147 N 0.71 0.45 -0.11 0.20 4.81 -0.36 -0.34 114.58 119.94 1ya7 h GLU 147 Ca 0.13 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1ya7 h GLU 147 Cb 0.52 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1ya7 h GLU 147 CO 0.03 0.31 -0.02 -0.92 -0.73 0.00 0.00 179.01 177.68 1ya7 h TYR 148 N 0.45 0.23 -0.46 0.92 3.20 -0.42 -2.51 116.97 118.37 1ya7 h TYR 148 Ca 0.12 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.99 1ya7 h TYR 148 Cb -0.03 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 1ya7 h TYR 148 CO -0.05 0.51 0.21 -0.07 -1.64 0.00 0.00 178.16 177.12 1ya7 h LEU 149 N -0.12 0.28 -0.08 2.82 3.38 -1.07 0.03 115.31 120.56 1ya7 h LEU 149 Ca 0.03 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1ya7 h LEU 149 Cb 0.43 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1ya7 h LEU 149 CO 0.01 0.20 0.05 0.28 0.09 0.00 0.00 178.44 179.06 1ya7 h SER 150 N 0.42 0.09 -0.64 -0.43 0.02 -1.02 0.66 113.55 112.65 1ya7 h SER 150 Ca 0.21 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 1ya7 h SER 150 Cb 0.15 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1ya7 h SER 150 CO -0.17 0.11 0.30 0.00 -1.14 0.00 0.00 176.83 175.94 1ya7 h ALA 151 N 0.98 0.83 -0.44 3.77 0.00 -1.27 -1.83 119.26 121.30 1ya7 h ALA 151 Ca 0.03 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1ya7 h ALA 151 Cb 0.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1ya7 h ALA 151 CO -0.01 0.40 -0.16 -0.09 0.00 0.00 0.00 179.25 179.40 1ya7 h ARG 152 N 0.89 0.89 -0.70 0.00 2.43 -0.90 -3.22 114.38 113.77 1ya7 h ARG 152 Ca 0.22 -0.37 0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1ya7 h ARG 152 Cb 0.13 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.58 1ya7 h ARG 152 CO -0.03 1.01 0.37 1.03 -1.51 0.00 0.00 179.97 180.85 1ya7 h SER 153 N 0.73 0.52 -0.26 -3.80 0.87 -0.59 0.42 113.55 111.44 1ya7 h SER 153 Ca 0.11 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.73 1ya7 h SER 153 Cb 0.72 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.60 1ya7 h SER 153 CO 0.05 0.32 0.11 0.74 -0.53 0.00 0.00 176.83 177.52 1ya7 h THR 154 N 0.66 0.97 -0.16 2.23 2.02 -1.35 -1.90 112.91 115.37 1ya7 h THR 154 Ca 0.33 -0.08 -0.19 0.00 0.77 0.00 0.00 66.41 67.23 1ya7 h THR 154 Cb 0.28 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1ya7 h THR 154 CO -0.22 0.04 -0.68 0.58 0.37 0.00 0.00 175.52 175.61 1ya7 h VAL 155 N 0.24 1.31 -0.49 3.16 2.07 -1.49 -2.86 116.25 118.20 1ya7 h VAL 155 Ca 0.11 -1.95 0.05 0.00 0.82 0.00 0.00 66.70 65.73 1ya7 h VAL 155 Cb 0.05 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 1ya7 h VAL 155 CO -0.09 0.61 0.23 -0.33 0.02 0.00 0.00 177.57 178.01 1ya7 h GLU 156 N 0.47 0.44 -0.29 1.57 5.08 -0.86 -1.07 114.58 119.91 1ya7 h GLU 156 Ca -0.02 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1ya7 h GLU 156 Cb 1.28 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.38 1ya7 h GLU 156 CO 0.13 0.29 -0.07 -0.44 -1.00 0.00 0.00 179.01 177.93 1ya7 h ASP 157 N 0.45 -0.26 0.14 1.42 3.32 -1.27 -0.72 116.42 119.50 1ya7 h ASP 157 Ca 0.22 0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.29 1ya7 h ASP 157 Cb 0.15 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1ya7 h ASP 157 CO -0.17 -0.09 -0.24 0.11 -1.72 0.00 0.00 179.24 177.13 1ya7 h LYS 158 N 0.01 0.18 0.11 3.56 1.57 -1.20 -0.25 116.57 120.54 1ya7 h LYS 158 Ca 0.14 -0.05 -0.28 0.00 -1.87 0.00 0.00 60.65 58.59 1ya7 h LYS 158 Cb 0.21 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 1ya7 h LYS 158 CO -0.30 0.41 -1.33 -0.07 -0.57 0.00 0.00 179.45 177.60 1ya7 h LEU 159 N 0.16 0.36 0.02 2.94 3.38 -0.96 0.11 115.31 121.32 1ya7 h LEU 159 Ca 0.03 -0.42 -0.27 0.00 0.09 0.00 0.00 57.88 57.31 1ya7 h LEU 159 Cb 0.51 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1ya7 h LEU 159 CO 0.04 1.34 -1.44 -0.07 0.09 0.00 0.00 178.44 178.39 1ya7 h LEU 160 N 0.06 0.08 0.00 1.67 3.38 -1.06 -3.34 115.31 116.10 1ya7 h LEU 160 Ca -0.16 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1ya7 h LEU 160 Cb 1.97 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.69 1ya7 h LEU 160 CO 0.18 1.11 0.00 0.61 0.09 0.00 0.00 178.44 180.42 1ya7 n GLY 161 N 1.52 3.25 3.61 0.83 0.00 -0.11 -3.75 105.19 110.53 1ya7 n GLY 161 Ca -0.11 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.51 3.73 -0.02 0.00 -1.26 -5.11 105.19 102.03 1ya7 n GLY 172 Ca 0.00 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.68 2.58 0.45 -0.02 0.00 -1.25 -4.97 107.32 102.42 1ya7 s GLY 173 Ca 0.72 1.00 -0.25 0.00 0.00 0.00 0.00 44.72 46.20 1ya7 s GLY 173 CO 0.51 1.41 1.35 -0.45 0.00 0.00 0.00 173.10 175.93 1ya7 s SER 174 N -1.76 5.98 0.00 1.64 0.15 0.37 -4.96 113.70 115.13 1ya7 s SER 174 Ca 0.77 2.75 0.22 0.00 0.70 0.00 0.00 55.95 60.39 1ya7 s SER 174 Cb -0.32 -2.64 0.44 0.00 -1.71 0.00 0.00 66.02 61.79 1ya7 s SER 174 CO 0.41 -1.08 1.39 0.00 1.20 0.00 0.00 173.24 175.16 1ya7 n GLN 175 N -0.21 2.49 -1.74 5.44 1.13 -1.26 -4.83 117.38 118.40 1ya7 n GLN 175 Ca 0.05 -2.30 -0.42 0.00 -1.94 0.00 0.00 57.00 52.39 1ya7 n GLN 175 Cb 0.43 -1.50 -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 -1.35 6.45 0.28 1.08 0.15 -1.26 -4.93 113.70 114.12 1ya7 s SER 176 Ca 0.39 2.71 0.06 0.00 0.70 0.00 0.00 55.95 59.80 1ya7 s SER 176 Cb 0.22 -2.56 0.40 0.00 -1.71 0.00 0.00 66.02 62.37 1ya7 s SER 176 CO 0.30 -0.99 1.66 1.55 1.20 0.00 0.00 173.24 176.96 1ya7 h PRO 177 N 8.79 0.23 -0.14 5.44 0.13 -2.01 -3.23 132.00 141.21 1ya7 h PRO 177 Ca -0.46 -0.12 -0.16 0.00 -0.87 0.00 0.00 66.00 64.39 1ya7 h PRO 177 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1ya7 h PRO 177 CO 0.95 0.65 -0.59 0.77 -0.23 0.00 0.00 178.00 179.54 1ya7 h SER 178 N 0.19 0.51 -0.94 1.44 0.02 -1.99 -2.77 113.55 110.02 1ya7 h SER 178 Ca 0.01 -0.29 0.07 0.00 -0.84 0.00 0.00 61.79 60.75 1ya7 h SER 178 Cb 0.89 -0.15 -0.07 0.00 0.14 0.00 0.00 62.40 63.22 1ya7 h SER 178 CO 0.07 0.99 0.59 0.25 -1.14 0.00 0.00 176.83 177.59 1ya7 h LEU 179 N 0.34 0.93 -0.69 5.07 5.85 -1.97 0.51 115.31 125.34 1ya7 h LEU 179 Ca -0.00 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.65 1ya7 h LEU 179 Cb 1.13 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 1ya7 h LEU 179 CO 0.11 0.57 0.04 0.25 -0.34 0.00 0.00 178.44 179.07 1ya7 h LEU 180 N 1.05 1.02 -0.59 2.25 5.85 -1.53 -2.36 115.31 121.00 1ya7 h LEU 180 Ca 0.42 -0.27 -0.14 0.00 0.84 0.00 0.00 57.88 58.73 1ya7 h LEU 180 Cb 0.22 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1ya7 h LEU 180 CO -0.19 1.05 -0.40 -0.07 -0.34 0.00 0.00 178.44 178.49 1ya7 h LEU 181 N 0.97 0.72 -1.29 2.25 3.38 -1.11 -2.91 115.31 117.32 1ya7 h LEU 181 Ca 0.18 -0.32 0.05 0.00 0.09 0.00 0.00 57.88 57.88 1ya7 h LEU 181 Cb 0.50 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1ya7 h LEU 181 CO 0.02 1.03 0.51 -0.08 0.09 0.00 0.00 178.44 180.01 1ya7 h GLU 182 N 0.55 0.88 -0.49 1.13 4.81 0.28 0.13 114.58 121.86 1ya7 h GLU 182 Ca 0.05 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1ya7 h GLU 182 Cb 0.93 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.08 1ya7 h GLU 182 CO 0.08 0.58 0.31 1.25 -0.73 0.00 0.00 179.01 180.50 1ya7 h LEU 183 N 0.90 0.52 -1.03 1.64 5.85 -1.23 0.77 115.31 122.73 1ya7 h LEU 183 Ca 0.32 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 1ya7 h LEU 183 Cb 0.13 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 1ya7 h LEU 183 CO -0.10 0.37 0.10 -0.09 -0.34 0.00 0.00 178.44 178.38 1ya7 h ARG 184 N 0.63 0.79 -0.16 1.25 2.43 -1.27 -2.92 114.38 115.14 1ya7 h ARG 184 Ca 0.19 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 59.07 1ya7 h ARG 184 Cb -0.03 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1ya7 h ARG 184 CO -0.06 0.74 -0.41 0.37 -1.51 0.00 0.00 179.97 179.09 1ya7 h GLN 185 N 0.76 0.36 -0.50 0.20 5.75 0.01 -0.42 115.11 121.28 1ya7 h GLN 185 Ca 0.16 -0.18 -0.02 0.00 -0.15 0.00 0.00 58.65 58.47 1ya7 h GLN 185 Cb 0.32 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 1ya7 h GLN 185 CO 0.00 0.71 0.25 0.82 -2.65 0.00 0.00 178.83 177.96 1ya7 h ILE 186 N 0.30 1.19 -0.29 2.39 2.04 -0.83 0.63 117.51 122.94 1ya7 h ILE 186 Ca 0.03 -0.52 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1ya7 h ILE 186 Cb 0.86 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1ya7 h ILE 186 CO 0.07 0.21 0.12 0.44 0.00 0.00 0.00 178.15 178.99 1ya7 h ASP 187 N 0.66 0.40 -0.07 1.72 3.32 -1.28 -1.98 116.42 119.21 1ya7 h ASP 187 Ca 0.17 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1ya7 h ASP 187 Cb 0.10 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1ya7 h ASP 187 CO -0.02 0.45 -0.03 0.00 -1.72 0.00 0.00 179.24 177.91 1ya7 h ALA 188 N 0.96 0.09 -0.91 3.45 0.00 -1.03 -2.99 119.26 118.82 1ya7 h ALA 188 Ca 0.10 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.79 1ya7 h ALA 188 Cb 0.18 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1ya7 h ALA 188 CO -0.01 -0.16 0.60 -0.44 0.00 0.00 0.00 179.25 179.25 1ya7 h ASP 189 N -0.25 1.03 -0.23 0.00 3.32 -0.89 0.16 116.42 119.57 1ya7 h ASP 189 Ca 0.01 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 1ya7 h ASP 189 Cb 0.48 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1ya7 h ASP 189 CO 0.01 0.73 -0.00 -0.26 -1.72 0.00 0.00 179.24 178.00 1ya7 h PHE 190 N 1.21 0.55 -0.43 4.55 -1.00 -1.41 0.31 116.94 120.72 1ya7 h PHE 190 Ca 0.35 -0.05 -0.10 0.00 2.81 0.00 0.00 57.97 60.97 1ya7 h PHE 190 Cb -0.09 -0.16 -0.01 0.00 3.61 0.00 0.00 35.95 39.30 1ya7 h PHE 190 CO -0.01 0.54 -0.11 0.52 -1.61 0.00 0.00 178.31 177.64 1ya7 h MET 191 N 0.51 0.83 -0.46 1.51 2.86 -1.22 -2.70 114.93 116.26 1ya7 h MET 191 Ca 0.11 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1ya7 h MET 191 Cb 0.33 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1ya7 h MET 191 CO 0.01 0.95 0.30 1.25 1.06 0.00 0.00 176.91 180.48 1ya7 h LEU 192 N 0.66 0.54 -0.82 1.22 5.85 0.18 -2.24 115.31 120.69 1ya7 h LEU 192 Ca 0.11 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1ya7 h LEU 192 Cb 0.64 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 1ya7 h LEU 192 CO 0.04 0.40 0.41 0.11 -0.34 0.00 0.00 178.44 179.07 1ya7 h LYS 193 N 0.62 1.17 -0.40 1.25 1.57 -0.43 0.19 116.57 120.54 1ya7 h LYS 193 Ca 0.17 -0.16 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1ya7 h LYS 193 Cb -0.05 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.02 1ya7 h LYS 193 CO -0.03 0.89 0.10 0.28 -0.57 0.00 0.00 179.45 180.11 1ya7 h VAL 194 N 1.16 1.18 -0.37 0.50 2.07 -1.34 0.22 116.25 119.67 1ya7 h VAL 194 Ca 0.29 -0.65 -0.08 0.00 0.82 0.00 0.00 66.70 67.07 1ya7 h VAL 194 Cb 0.09 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1ya7 h VAL 194 CO -0.04 0.24 -0.09 -0.33 0.02 0.00 0.00 177.57 177.36 1ya7 h GLU 195 N 0.58 0.72 -0.12 1.57 5.08 -0.59 -1.68 114.58 120.14 1ya7 h GLU 195 Ca 0.13 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1ya7 h GLU 195 Cb 0.23 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1ya7 h GLU 195 CO -0.00 0.87 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.64 1ya7 h LEU 196 N 0.52 0.35 -0.83 1.33 3.38 -0.85 -2.99 115.31 116.22 1ya7 h LEU 196 Ca 0.09 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 1ya7 h LEU 196 Cb 0.61 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1ya7 h LEU 196 CO 0.04 0.81 0.50 0.00 0.09 0.00 0.00 178.44 179.87 1ya7 h ALA 197 N 0.55 1.05 -0.27 1.53 0.00 -0.58 -1.34 119.26 120.21 1ya7 h ALA 197 Ca 0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1ya7 h ALA 197 Cb 0.73 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1ya7 h ALA 197 CO 0.04 0.51 -0.06 1.79 0.00 0.00 0.00 179.25 181.53 1ya7 h THR 198 N 1.13 1.19 0.08 0.00 1.35 -1.34 0.24 112.91 115.57 1ya7 h THR 198 Ca 0.30 -0.80 -0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1ya7 h THR 198 Cb -0.05 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.43 1ya7 h THR 198 CO -0.06 0.27 -0.04 0.74 -0.25 0.00 0.00 175.52 176.18 1ya7 h THR 199 N 0.40 1.16 -0.38 6.82 2.02 -1.31 -1.80 112.91 119.82 1ya7 h THR 199 Ca 0.08 -0.96 0.07 0.00 0.77 0.00 0.00 66.41 66.38 1ya7 h THR 199 Cb 0.36 1.77 -0.07 0.00 -1.74 0.00 0.00 68.15 68.48 1ya7 h THR 199 CO 0.02 0.23 -0.03 -0.74 0.37 0.00 0.00 175.52 175.37 1ya7 h HIS 200 N -0.55 -0.08 -0.79 3.16 6.17 -1.03 -2.55 115.15 119.47 1ya7 h HIS 200 Ca -0.01 0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.07 1ya7 h HIS 200 Cb 0.46 0.09 -0.04 0.00 2.52 0.00 0.00 27.41 30.45 1ya7 h HIS 200 CO 0.07 -0.10 0.38 1.25 0.71 0.00 0.00 177.93 180.23 1ya7 h LEU 201 N 0.07 1.04 -0.16 0.26 5.85 -0.54 -2.65 115.31 119.17 1ya7 h LEU 201 Ca 0.19 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.83 1ya7 h LEU 201 Cb 0.27 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 1ya7 h LEU 201 CO -0.34 0.88 -0.21 0.28 -0.34 0.00 0.00 178.44 178.71 1ya7 h SER 202 N 1.13 -0.66 -0.55 1.25 0.02 -1.02 0.92 113.55 114.64 1ya7 h SER 202 Ca 0.27 0.12 0.08 0.00 -0.84 0.00 0.00 61.79 61.42 1ya7 h SER 202 Cb 0.12 0.31 -0.07 0.00 0.14 0.00 0.00 62.40 62.90 1ya7 h SER 202 CO -0.03 -0.26 0.18 0.74 -1.14 0.00 0.00 176.83 176.32 1ya7 h THR 203 N -0.25 0.78 -0.23 -2.27 2.02 -1.26 0.41 112.91 112.11 1ya7 h THR 203 Ca 0.11 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1ya7 h THR 203 Cb 0.42 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1ya7 h THR 203 CO -0.31 0.06 -0.05 -0.03 0.37 0.00 0.00 175.52 175.57 1ya7 h MET 204 N 0.36 0.44 -0.64 6.66 -1.53 -1.12 0.25 114.93 119.35 1ya7 h MET 204 Ca 0.27 -0.17 0.02 0.00 -3.44 0.00 0.00 59.70 56.39 1ya7 h MET 204 Cb 0.33 -0.03 -0.04 0.00 -0.55 0.00 0.00 31.60 31.31 1ya7 h MET 204 CO -0.29 0.67 0.40 0.28 0.14 0.00 0.00 176.91 178.11 1ya7 h VAL 205 N 0.18 1.10 -0.56 -5.77 2.07 -0.57 -0.87 116.25 111.83 1ya7 h VAL 205 Ca 0.06 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1ya7 h VAL 205 Cb 0.50 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1ya7 h VAL 205 CO 0.02 0.15 0.29 0.03 0.02 0.00 0.00 177.57 178.07 1ya7 h ARG 206 N 0.80 0.79 -0.76 1.57 3.08 -0.74 -1.13 114.38 117.99 1ya7 h ARG 206 Ca 0.25 -0.11 0.09 0.00 0.07 0.00 0.00 59.98 60.28 1ya7 h ARG 206 Cb -0.01 -0.15 -0.07 0.00 0.08 0.00 0.00 29.97 29.82 1ya7 h ARG 206 CO -0.09 0.63 0.42 0.00 -1.07 0.00 0.00 179.97 179.86 1ya7 h ALA 207 N 1.12 1.07 -0.06 0.04 0.00 0.01 -2.44 119.26 118.99 1ya7 h ALA 207 Ca 0.19 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.92 1ya7 h ALA 207 Cb 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ya7 h ALA 207 CO -0.03 0.04 -0.85 0.28 0.00 0.00 0.00 179.25 178.69 1ya7 h VAL 208 N 0.71 1.34 -0.31 0.00 2.07 -0.96 -0.76 116.25 118.35 1ya7 h VAL 208 Ca 0.37 -2.20 0.05 0.00 0.82 0.00 0.00 66.70 65.74 1ya7 h VAL 208 Cb 0.34 2.20 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1ya7 h VAL 208 CO -0.25 0.67 0.02 0.40 0.02 0.00 0.00 177.57 178.43 1ya7 h ILE 209 N 0.35 0.79 0.22 4.57 2.04 -1.08 0.19 117.51 124.59 1ya7 h ILE 209 Ca -0.06 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1ya7 h ILE 209 Cb 1.47 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 1ya7 h ILE 209 CO 0.16 0.02 -0.10 -1.13 0.00 0.00 0.00 178.15 177.09 1ya7 h ASN 210 N 0.11 -0.24 -0.48 1.72 -1.24 -1.34 -2.29 115.58 111.81 1ya7 h ASN 210 Ca 0.15 -0.14 0.09 0.00 0.71 0.00 0.00 56.30 57.11 1ya7 h ASN 210 Cb 0.19 0.06 -0.08 0.00 0.73 0.00 0.00 38.32 39.23 1ya7 h ASN 210 CO -0.24 0.00 0.03 0.00 -1.29 0.00 0.00 177.43 175.94 1ya7 h ALA 211 N 0.24 0.49 0.14 1.57 0.00 -1.02 -0.39 119.26 120.29 1ya7 h ALA 211 Ca -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ya7 h ALA 211 Cb 0.37 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1ya7 h ALA 211 CO 0.05 -0.36 -0.07 -0.92 0.00 0.00 0.00 179.25 177.95 1ya7 h TYR 212 N 0.15 -0.17 0.00 0.00 3.20 -0.59 -2.68 116.97 116.87 1ya7 h TYR 212 Ca 0.24 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.07 1ya7 h TYR 212 Cb 0.35 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1ya7 h TYR 212 CO -0.28 -0.11 -0.21 -0.07 -1.64 0.00 0.00 178.16 175.86 1ya7 h LEU 213 N -0.19 0.00 -0.21 2.82 3.38 -1.12 0.81 115.31 120.80 1ya7 h LEU 213 Ca -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1ya7 h LEU 213 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1ya7 h LEU 213 CO 0.03 0.21 -0.19 -0.07 0.09 0.00 0.00 178.44 178.51 1ya7 h LEU 214 N 0.00 0.00 -0.50 1.67 3.38 -0.99 -3.39 115.31 115.48 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 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1ya7 h LEU 214 CO 0.03 0.19 0.00 0.59 0.09 0.00 0.00 178.44 179.34 1ya7 n ASN 215 N -3.17 0.50 -0.31 -0.43 3.02 -0.86 -4.84 115.26 109.17 1ya7 n ASN 215 Ca 0.03 -0.75 0.24 0.00 -0.03 0.00 0.00 54.58 54.07 1ya7 n ASN 215 Cb 0.57 0.40 0.55 0.00 -0.61 0.00 0.00 39.78 40.69 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 0.55 -0.29 3.10 5.08 -1.06 -2.49 115.95 120.83 1ya7 h TRP 216 Ca 0.00 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 59.99 1ya7 h TRP 216 Cb 0.03 -0.16 -0.01 0.00 -3.00 0.00 0.00 29.16 26.01 1ya7 h TRP 216 CO 0.00 0.05 0.17 0.87 -1.28 0.00 0.00 178.44 178.25 1ya7 h LYS 217 N 0.33 0.39 0.00 0.12 1.57 -1.88 -1.37 116.57 115.73 1ya7 h LYS 217 Ca 0.58 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 59.19 1ya7 h LYS 217 Cb 1.60 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.81 1ya7 h LYS 217 CO -0.25 0.32 -0.61 0.87 -0.57 0.00 0.00 179.45 179.22 1ya7 h LYS 218 N 0.36 0.00 -0.87 3.15 1.79 -1.66 0.02 116.57 119.37 1ya7 h LYS 218 Ca 0.10 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.60 1ya7 h LYS 218 Cb 0.03 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.63 1ya7 h LYS 218 CO -0.02 0.61 0.56 -0.07 -1.08 0.00 0.00 179.45 179.45 1ya7 h LEU 219 N 0.00 0.95 0.10 2.94 3.38 -1.12 -2.48 115.31 119.08 1ya7 h LEU 219 Ca -0.01 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 1ya7 h LEU 219 Cb 1.11 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.64 1ya7 h LEU 219 CO 0.08 0.67 -0.79 0.40 0.09 0.00 0.00 178.44 178.88 1ya7 h ILE 220 N 1.12 1.44 -2.99 1.22 1.08 -1.16 -3.43 117.51 114.79 1ya7 h ILE 220 Ca 0.33 -2.45 -0.62 0.00 -0.39 0.00 0.00 64.86 61.74 1ya7 h ILE 220 Cb -0.05 3.09 -0.41 0.00 -3.07 0.00 0.00 36.82 36.38 1ya7 h ILE 220 CO -0.10 0.67 -0.63 -1.10 -0.69 0.00 0.00 178.15 176.30 1ya7 s GLN 221 N -2.39 2.22 0.41 2.37 -1.52 -0.02 -4.96 119.66 115.76 1ya7 s GLN 221 Ca -0.17 -3.14 0.29 0.00 -1.95 0.00 0.00 55.36 50.39 1ya7 s GLN 221 Cb 0.01 -3.12 1.20 0.00 -0.22 0.00 0.00 33.01 30.88 1ya7 s GLN 221 CO 0.78 -1.29 1.85 -1.00 -0.25 0.00 0.00 175.29 175.38 1ya7 h PRO 222 N 5.48 0.00 -5.20 2.91 0.13 -1.67 -3.39 132.00 130.26 1ya7 h PRO 222 Ca 0.15 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.79 1ya7 h PRO 222 Cb 0.78 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.61 1ya7 h PRO 222 CO 0.67 0.00 -0.81 1.03 -0.23 0.00 0.00 178.00 178.65 1ya7 s ARG 223 N -3.50 1.25 0.00 0.86 0.52 -1.26 -3.35 118.95 113.46 1ya7 s ARG 223 Ca 0.02 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 54.74 1ya7 s ARG 223 Cb 0.09 -1.17 0.00 0.00 0.52 0.00 0.00 34.95 34.39 1ya7 s ARG 223 CO 0.46 0.26 0.44 2.41 0.02 0.00 0.00 175.30 178.89 1ya7 n THR 224 N 2.90 0.08 -2.34 0.02 -1.04 -1.26 -5.05 114.28 107.59 1ya7 n THR 224 Ca -0.16 -0.42 -0.05 0.00 -2.04 0.00 0.00 64.05 61.38 1ya7 n THR 224 Cb 0.54 1.17 0.00 0.00 -1.82 0.00 0.00 70.33 70.23 1ya7 n THR 224 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ya7 n GLY 225 N -0.04 -0.15 0.95 3.41 0.00 -1.26 -4.88 105.19 103.22 1ya7 n GLY 225 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 1ya7 n GLY 225 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ya7 n SER 226 N 0.20 -0.92 0.00 1.61 3.41 -1.26 -5.03 113.62 111.63 1ya7 n SER 226 Ca -0.05 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 1ya7 n SER 226 Cb 0.12 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 1ya7 n SER 226 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ya7 n ASP 227 N 0.45 0.00 0.00 4.04 2.03 -1.26 -5.10 116.55 116.70 1ya7 n ASP 227 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1ya7 n ASP 227 Cb 0.02 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 1ya7 n ASP 227 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ya7 n HIS 228 N 0.00 0.00 0.25 -0.67 1.44 -1.26 -4.92 115.22 110.06 1ya7 n HIS 228 Ca 0.00 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 1ya7 n HIS 228 Cb 0.00 0.00 0.27 0.00 0.12 0.00 0.00 29.99 30.38 1ya7 n HIS 228 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1ya7 n MET 229 N -0.26 2.38 -4.29 -1.40 2.81 -1.26 -4.94 117.12 110.18 1ya7 n MET 229 Ca 0.00 -2.13 -0.34 0.00 -1.81 0.00 0.00 57.70 53.42 1ya7 n MET 229 Cb 0.00 -1.48 -0.11 0.00 -0.71 0.00 0.00 33.22 30.92 1ya7 n MET 229 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1ya7 s VAL 230 N -1.35 4.21 0.00 2.03 1.01 -1.26 -5.36 120.40 119.68 1ya7 s VAL 230 Ca 0.40 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1ya7 s VAL 230 Cb 0.22 -2.85 0.00 0.00 0.00 0.00 0.00 36.38 33.75 1ya7 s VAL 230 CO 0.29 0.50 0.00 -0.24 0.00 0.00 0.00 175.10 175.65