#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vml s LYS 2 N 0.00 4.02 0.25 2.12 2.20 -1.26 -4.74 119.74 122.33 2vml s LYS 2 Ca 0.00 1.43 0.01 0.00 -0.36 0.00 0.00 55.97 57.05 2vml s LYS 2 Cb 0.00 -3.85 -0.04 0.00 -1.51 0.00 0.00 37.83 32.43 2vml s LYS 2 CO 0.00 -0.98 0.13 0.95 -0.36 0.00 0.00 175.35 175.09 2vml s THR 3 N 4.11 0.31 0.34 3.43 -4.23 -1.26 -1.16 115.64 117.17 2vml s THR 3 Ca 0.57 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 2vml s THR 3 Cb -0.19 -2.56 0.29 0.00 1.34 0.00 0.00 72.50 71.37 2vml s THR 3 CO 0.20 0.00 1.94 0.58 -0.54 0.00 0.00 174.62 176.80 2vml h VAL 4 N 2.42 1.04 -0.06 2.29 2.07 -1.73 -0.71 116.25 121.58 2vml h VAL 4 Ca -0.36 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 66.77 2vml h VAL 4 Cb 1.25 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2vml h VAL 4 CO 0.56 0.16 -0.29 0.40 0.02 0.00 0.00 177.57 178.41 2vml h ILE 5 N 0.88 1.44 -0.20 4.57 2.04 -1.92 -1.09 117.51 123.22 2vml h ILE 5 Ca 0.34 -1.73 -0.07 0.00 1.00 0.00 0.00 64.86 64.41 2vml h ILE 5 Cb 0.23 2.38 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 2vml h ILE 5 CO -0.12 0.49 -0.18 0.71 0.00 0.00 0.00 178.15 179.05 2vml h THR 6 N -0.22 1.22 -0.00 -0.27 1.35 -1.82 -2.32 112.91 110.85 2vml h THR 6 Ca -0.02 -1.02 -0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2vml h THR 6 Cb 0.95 1.27 -0.00 0.00 -1.73 0.00 0.00 68.15 68.65 2vml h THR 6 CO 0.06 0.32 0.00 -0.08 -0.25 0.00 0.00 175.52 175.57 2vml h GLU 7 N 0.31 0.00 -0.06 4.72 4.81 -1.02 -0.83 114.58 122.52 2vml h GLU 7 Ca 0.06 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 2vml h GLU 7 Cb 0.50 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 2vml h GLU 7 CO 0.03 0.21 -0.49 -0.39 -0.73 0.00 0.00 179.01 177.65 2vml h VAL 8 N -0.21 1.35 -0.24 0.32 -1.51 -1.12 -1.27 116.25 113.56 2vml h VAL 8 Ca 0.00 -1.70 -0.05 0.00 -1.23 0.00 0.00 66.70 63.72 2vml h VAL 8 Cb 0.21 1.85 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 2vml h VAL 8 CO -0.00 0.50 -0.03 0.40 -1.23 0.00 0.00 177.57 177.21 2vml h ILE 9 N 0.11 1.27 -0.97 7.19 2.04 -1.40 -1.83 117.51 123.93 2vml h ILE 9 Ca 0.00 -0.99 0.11 0.00 1.00 0.00 0.00 64.86 64.98 2vml h ILE 9 Cb 0.91 1.43 -0.08 0.00 -0.74 0.00 0.00 36.82 38.34 2vml h ILE 9 CO 0.07 0.31 0.60 0.00 0.00 0.00 0.00 178.15 179.13 2vml h ALA 10 N 0.78 1.43 0.22 1.87 0.00 -0.96 0.91 119.26 123.52 2vml h ALA 10 Ca 0.07 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2vml h ALA 10 Cb 0.47 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2vml h ALA 10 CO 0.02 0.22 -0.10 1.03 0.00 0.00 0.00 179.25 180.41 2vml h SER 11 N 0.97 -0.25 -0.78 0.00 0.87 -1.07 0.43 113.55 113.73 2vml h SER 11 Ca 0.47 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.91 2vml h SER 11 Cb 0.43 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 2vml h SER 11 CO -0.25 -0.02 0.49 0.00 -0.53 0.00 0.00 176.83 176.51 2vml h ALA 12 N 0.27 0.99 -0.53 6.23 0.00 -1.14 -3.06 119.26 122.02 2vml h ALA 12 Ca -0.03 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 2vml h ALA 12 Cb 0.36 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2vml h ALA 12 CO 0.05 0.44 -0.14 0.22 0.00 0.00 0.00 179.25 179.82 2vml h ASP 13 N 1.06 1.03 0.04 0.00 3.58 -0.73 -0.35 116.42 121.04 2vml h ASP 13 Ca 0.28 -0.35 -0.00 0.00 0.42 0.00 0.00 57.03 57.38 2vml h ASP 13 Cb -0.07 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.70 2vml h ASP 13 CO -0.06 1.15 -0.01 0.77 -2.88 0.00 0.00 179.24 178.22 2vml h SER 14 N 0.90 0.00 -0.53 2.28 4.64 -0.81 -1.69 113.55 118.34 2vml h SER 14 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2vml h SER 14 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2vml h SER 14 CO 0.05 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 176.02 2vml n GLN 15 N -3.52 2.60 -2.84 4.77 6.02 -0.93 -4.98 117.38 118.50 2vml n GLN 15 Ca -0.03 -2.36 -0.17 0.00 -0.01 0.00 0.00 57.00 54.43 2vml n GLN 15 Cb 0.09 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 29.91 2vml n GLN 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vml n GLY 16 N 1.31 -0.22 3.21 1.08 0.00 -0.64 -4.98 105.19 104.95 2vml n GLY 16 Ca 0.19 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 2vml n GLY 16 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2vml s ARG 17 N -5.42 1.52 0.60 1.61 3.52 -0.19 -5.02 118.95 115.56 2vml s ARG 17 Ca 0.23 -0.75 -0.19 0.00 -0.13 0.00 0.00 55.73 54.89 2vml s ARG 17 Cb -0.10 -1.50 -0.03 0.00 -1.56 0.00 0.00 34.95 31.75 2vml s ARG 17 CO 0.29 0.41 1.25 -0.06 -0.81 0.00 0.00 175.30 176.38 2vml s PHE 18 N -0.54 2.30 0.24 5.12 0.08 -1.26 -4.30 117.98 119.62 2vml s PHE 18 Ca 0.07 1.48 -0.31 0.00 0.12 0.00 0.00 56.93 58.30 2vml s PHE 18 Cb -0.08 -3.59 -0.11 0.00 -0.57 0.00 0.00 43.02 38.67 2vml s PHE 18 CO -0.00 -2.50 1.57 -0.51 -0.10 0.00 0.00 175.22 173.68 2vml s LEU 19 N -4.02 4.36 0.00 -0.37 1.43 -1.26 -4.95 118.68 113.87 2vml s LEU 19 Ca 0.78 2.79 0.00 0.00 -1.03 0.00 0.00 54.13 56.67 2vml s LEU 19 Cb -0.34 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.26 2vml s LEU 19 CO 0.37 -0.85 0.00 -0.46 0.23 0.00 0.00 176.35 175.64 2vml n ASN 20 N 2.91 1.88 0.20 2.29 0.23 -1.26 -4.98 115.26 116.52 2vml n ASN 20 Ca 0.10 -1.04 0.09 0.00 -0.53 0.00 0.00 54.58 53.20 2vml n ASN 20 Cb 0.38 0.01 0.62 0.00 -2.08 0.00 0.00 39.78 38.70 2vml n ASN 20 CO 0.00 0.00 0.00 -1.13 -0.93 0.00 0.00 177.26 175.20 2vml h ASN 21 N 0.02 0.06 -0.14 0.53 -0.73 -1.98 -1.47 115.58 111.88 2vml h ASN 21 Ca -0.01 -0.00 0.04 0.00 1.87 0.00 0.00 56.30 58.20 2vml h ASN 21 Cb 0.02 -0.02 -0.05 0.00 0.27 0.00 0.00 38.32 38.55 2vml h ASN 21 CO 0.01 0.05 -0.15 0.74 -0.37 0.00 0.00 177.43 177.71 2vml h THR 22 N 0.07 0.59 -0.00 -3.57 2.02 -2.00 -1.43 112.91 108.60 2vml h THR 22 Ca 0.05 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.03 2vml h THR 22 Cb 0.11 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 2vml h THR 22 CO -0.01 0.00 -0.88 -0.33 0.37 0.00 0.00 175.52 174.68 2vml h GLU 23 N -0.18 0.25 -0.35 6.66 3.07 -1.69 -3.11 114.58 119.23 2vml h GLU 23 Ca 0.10 -0.26 -0.11 0.00 -0.50 0.00 0.00 59.36 58.58 2vml h GLU 23 Cb 0.32 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2vml h GLU 23 CO -0.25 0.98 -0.24 -0.07 -1.40 0.00 0.00 179.01 178.03 2vml h LEU 24 N 0.14 0.70 -0.52 1.33 3.38 -1.21 -0.90 115.31 118.22 2vml h LEU 24 Ca -0.05 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 2vml h LEU 24 Cb 1.50 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2vml h LEU 24 CO 0.14 0.92 0.21 1.56 0.09 0.00 0.00 178.44 181.36 2vml h GLN 25 N 0.60 0.78 0.01 1.13 4.20 -1.29 -0.98 115.11 119.56 2vml h GLN 25 Ca 0.08 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.68 2vml h GLN 25 Cb 0.73 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 2vml h GLN 25 CO 0.06 0.68 -0.20 0.00 -0.67 0.00 0.00 178.83 178.70 2vml h ALA 26 N 1.06 -0.27 -0.96 3.87 0.00 -1.44 -2.42 119.26 119.09 2vml h ALA 26 Ca 0.18 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.17 2vml h ALA 26 Cb 0.19 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 2vml h ALA 26 CO -0.02 -0.70 0.62 0.00 0.00 0.00 0.00 179.25 179.15 2vml h ALA 27 N 0.55 1.50 -0.82 0.00 0.00 -0.92 0.25 119.26 119.82 2vml h ALA 27 Ca 0.05 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.02 2vml h ALA 27 Cb 0.40 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 2vml h ALA 27 CO -0.18 0.33 0.54 -0.97 0.00 0.00 0.00 179.25 178.97 2vml h ASN 28 N 1.05 0.80 -0.94 0.00 -1.24 -0.92 -2.07 115.58 112.26 2vml h ASN 28 Ca 0.43 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.46 2vml h ASN 28 Cb 0.29 -0.17 -0.05 0.00 0.73 0.00 0.00 38.32 39.13 2vml h ASN 28 CO -0.19 0.52 0.62 1.23 -1.29 0.00 0.00 177.43 178.31 2vml h GLY 29 N 0.91 1.33 0.78 1.57 0.00 -0.46 0.36 103.07 107.56 2vml h GLY 29 Ca 0.35 -0.50 0.03 0.00 0.00 0.00 0.00 47.33 47.20 2vml h GLY 29 CO -0.12 0.49 0.05 -0.09 0.00 0.00 0.00 176.54 176.87 2vml h ARG 30 N 1.28 0.13 -0.14 4.80 1.12 -1.16 -2.65 114.38 117.75 2vml h ARG 30 Ca 0.34 -0.01 -0.17 0.00 -1.11 0.00 0.00 59.98 59.04 2vml h ARG 30 Cb -0.14 -0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 29.79 2vml h ARG 30 CO -0.07 0.08 -0.62 0.74 -3.11 0.00 0.00 179.97 176.99 2vml h PHE 31 N 0.13 0.63 0.00 2.20 0.04 -0.93 -2.69 116.94 116.33 2vml h PHE 31 Ca 0.09 -0.24 -0.08 0.00 2.80 0.00 0.00 57.97 60.54 2vml h PHE 31 Cb 0.08 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 2vml h PHE 31 CO -0.14 0.98 -0.39 0.37 -0.60 0.00 0.00 178.31 178.53 2vml h GLN 32 N 0.36 0.00 0.00 1.51 4.15 -0.98 -3.10 115.11 117.06 2vml h GLN 32 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2vml h GLN 32 Cb 1.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.86 2vml h GLN 32 CO 0.11 0.39 -0.39 -0.09 -1.93 0.00 0.00 178.83 176.93 2vml h ARG 33 N 0.00 0.00 -0.94 1.69 9.65 -1.22 -3.38 114.38 120.18 2vml h ARG 33 Ca -0.00 0.00 0.17 0.00 -1.10 0.00 0.00 59.98 59.05 2vml h ARG 33 Cb 0.77 0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 29.25 2vml h ARG 33 CO 0.05 0.00 0.54 0.00 2.80 0.00 0.00 179.97 183.36 2vml h ALA 34 N 2.04 1.51 -0.10 2.80 0.00 -1.40 -1.56 119.26 122.55 2vml h ALA 34 Ca 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2vml h ALA 34 Cb 0.98 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2vml h ALA 34 CO 0.00 -0.06 0.05 1.15 0.00 0.00 0.00 179.25 180.39 2vml h THR 35 N 0.71 1.10 -0.64 0.00 2.02 -1.78 0.33 112.91 114.65 2vml h THR 35 Ca 0.53 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.40 2vml h THR 35 Cb 0.80 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 2vml h THR 35 CO -0.38 0.09 0.34 0.00 0.37 0.00 0.00 175.52 175.95 2vml h ALA 36 N 0.94 0.82 -0.49 6.16 0.00 -1.71 -1.95 119.26 123.02 2vml h ALA 36 Ca 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2vml h ALA 36 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2vml h ALA 36 CO -0.01 0.34 0.24 0.77 0.00 0.00 0.00 179.25 180.59 2vml h SER 37 N 0.87 0.63 0.46 0.00 0.02 -0.83 -2.11 113.55 112.59 2vml h SER 37 Ca 0.22 -0.12 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 2vml h SER 37 Cb 0.05 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 2vml h SER 37 CO -0.03 0.58 -0.53 0.24 -1.14 0.00 0.00 176.83 175.94 2vml h MET 38 N 0.64 0.08 -0.63 3.45 2.86 -0.21 -0.68 114.93 120.44 2vml h MET 38 Ca 0.17 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.69 2vml h MET 38 Cb 0.11 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 2vml h MET 38 CO -0.02 0.60 0.14 1.49 1.06 0.00 0.00 176.91 180.18 2vml h GLU 39 N 0.07 1.02 0.03 1.72 4.81 -1.25 -1.27 114.58 119.70 2vml h GLU 39 Ca -0.00 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2vml h GLU 39 Cb 0.96 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.21 2vml h GLU 39 CO 0.07 0.93 -0.01 0.00 -0.73 0.00 0.00 179.01 179.27 2vml h ALA 40 N 1.05 -0.04 -0.95 2.92 0.00 -0.99 -2.71 119.26 118.54 2vml h ALA 40 Ca 0.20 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.12 2vml h ALA 40 Cb 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2vml h ALA 40 CO 0.00 -0.48 0.62 0.00 0.00 0.00 0.00 179.25 179.39 2vml h ALA 41 N 0.86 1.43 -0.68 0.00 0.00 -1.04 -2.01 119.26 117.82 2vml h ALA 41 Ca -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2vml h ALA 41 Cb 0.10 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2vml h ALA 41 CO 0.01 0.45 0.30 -0.09 0.00 0.00 0.00 179.25 179.92 2vml h ARG 42 N 1.14 1.01 -0.04 0.00 2.43 -1.16 -0.44 114.38 117.32 2vml h ARG 42 Ca 0.39 -0.17 -0.22 0.00 -0.81 0.00 0.00 59.98 59.17 2vml h ARG 42 Cb 0.10 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 2vml h ARG 42 CO -0.14 0.82 -0.88 0.00 -1.51 0.00 0.00 179.97 178.26 2vml h ALA 43 N 1.14 0.39 -0.22 2.80 0.00 -1.12 -2.36 119.26 119.88 2vml h ALA 43 Ca 0.23 -0.67 -0.15 0.00 0.00 0.00 0.00 54.91 54.32 2vml h ALA 43 Cb 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2vml h ALA 43 CO -0.02 0.77 -0.49 -0.07 0.00 0.00 0.00 179.25 179.44 2vml h LEU 44 N 0.30 0.64 -0.27 0.00 4.07 -1.26 -2.57 115.31 116.23 2vml h LEU 44 Ca -0.07 -0.32 -0.06 0.00 0.08 0.00 0.00 57.88 57.52 2vml h LEU 44 Cb 1.50 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 43.05 2vml h LEU 44 CO 0.16 1.02 -0.05 0.74 -1.08 0.00 0.00 178.44 179.23 2vml h THR 45 N 0.47 1.28 0.00 0.22 2.02 -1.07 -2.22 112.91 113.60 2vml h THR 45 Ca 0.02 -1.05 -0.06 0.00 0.77 0.00 0.00 66.41 66.10 2vml h THR 45 Cb 1.02 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.84 2vml h THR 45 CO 0.09 0.33 -0.29 0.77 0.37 0.00 0.00 175.52 176.80 2vml h SER 46 N 0.27 0.00 -0.60 4.18 4.64 -1.46 -2.97 113.55 117.61 2vml h SER 46 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2vml h SER 46 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2vml h SER 46 CO 0.02 0.29 0.00 0.59 -0.87 0.00 0.00 176.83 176.86 2vml n ASN 47 N -3.28 4.55 -0.19 4.97 3.02 -0.97 -4.74 115.26 118.62 2vml n ASN 47 Ca 0.01 -2.44 -0.06 0.00 -0.03 0.00 0.00 54.58 52.07 2vml n ASN 47 Cb 0.56 -0.55 0.03 0.00 -0.61 0.00 0.00 39.78 39.21 2vml n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vml h ALA 48 N 3.79 0.71 -0.01 5.41 0.00 -1.23 -0.77 119.26 127.16 2vml h ALA 48 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2vml h ALA 48 Cb 1.38 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2vml h ALA 48 CO 0.21 0.14 0.01 -0.44 0.00 0.00 0.00 179.25 179.16 2vml h ASP 49 N 0.75 0.01 0.81 0.00 3.32 -1.85 -0.25 116.42 119.21 2vml h ASP 49 Ca 0.21 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.14 2vml h ASP 49 Cb -0.07 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2vml h ASP 49 CO -0.05 0.01 -0.57 0.77 -1.72 0.00 0.00 179.24 177.67 2vml h SER 50 N 0.01 0.00 -0.31 6.45 4.64 -1.88 -0.58 113.55 121.88 2vml h SER 50 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 2vml h SER 50 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2vml h SER 50 CO -0.00 0.57 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.42 2vml h LEU 51 N 0.00 0.57 -0.08 5.97 3.38 -0.91 -2.09 115.31 122.15 2vml h LEU 51 Ca -0.01 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.62 2vml h LEU 51 Cb 1.13 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 2vml h LEU 51 CO 0.07 0.77 0.01 0.58 0.09 0.00 0.00 178.44 179.96 2vml h VAL 52 N 0.36 1.23 -0.35 1.22 2.07 -0.99 -2.30 116.25 117.48 2vml h VAL 52 Ca 0.08 -0.71 0.07 0.00 0.82 0.00 0.00 66.70 66.96 2vml h VAL 52 Cb 0.50 1.54 -0.07 0.00 -1.52 0.00 0.00 31.29 31.74 2vml h VAL 52 CO 0.02 0.20 -0.09 0.50 0.02 0.00 0.00 177.57 178.23 2vml h LYS 53 N -0.11 0.00 -0.16 1.57 1.63 -1.12 -1.76 116.57 116.63 2vml h LYS 53 Ca 0.03 -0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.70 2vml h LYS 53 Cb 0.31 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.92 2vml h LYS 53 CO 0.00 0.00 -0.43 0.78 -3.45 0.00 0.00 179.45 176.35 2vml h GLY 54 N 0.00 0.40 0.89 5.01 0.00 -1.43 -2.67 103.07 105.28 2vml h GLY 54 Ca 0.17 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 2vml h GLY 54 CO -0.36 0.37 -0.07 0.00 0.00 0.00 0.00 176.54 176.47 2vml h ALA 55 N 1.24 0.42 -0.35 3.60 0.00 -1.08 -1.00 119.26 122.08 2vml h ALA 55 Ca 0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 2vml h ALA 55 Cb 0.89 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2vml h ALA 55 CO 0.07 0.24 0.21 0.28 0.00 0.00 0.00 179.25 180.05 2vml h VAL 56 N 0.35 1.12 -0.06 0.00 2.07 -1.32 -2.23 116.25 116.18 2vml h VAL 56 Ca 0.08 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.24 2vml h VAL 56 Cb 0.55 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2vml h VAL 56 CO 0.03 0.12 -0.38 -0.61 0.02 0.00 0.00 177.57 176.74 2vml h GLN 57 N 0.46 0.13 -0.27 1.57 5.75 -1.43 -2.52 115.11 118.80 2vml h GLN 57 Ca 0.13 -0.06 -0.09 0.00 -0.15 0.00 0.00 58.65 58.48 2vml h GLN 57 Cb 0.00 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 2vml h GLN 57 CO -0.02 0.50 -0.23 1.49 -2.65 0.00 0.00 178.83 177.92 2vml h GLU 58 N 0.11 0.51 -0.37 1.69 4.57 -0.95 -0.60 114.58 119.54 2vml h GLU 58 Ca 0.01 -0.19 0.02 0.00 -1.18 0.00 0.00 59.36 58.03 2vml h GLU 58 Cb 0.73 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.26 2vml h GLU 58 CO 0.06 0.70 0.19 0.28 -1.18 0.00 0.00 179.01 179.06 2vml h VAL 59 N 0.45 1.00 -0.18 0.32 2.07 -0.98 0.04 116.25 118.98 2vml h VAL 59 Ca 0.07 -0.14 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 2vml h VAL 59 Cb 0.65 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2vml h VAL 59 CO 0.05 0.07 -0.36 1.88 0.02 0.00 0.00 177.57 179.23 2vml h TYR 60 N 0.40 0.44 -0.54 1.57 0.05 -1.29 0.05 116.97 117.64 2vml h TYR 60 Ca 0.15 -0.11 -0.09 0.00 0.05 0.00 0.00 58.73 58.73 2vml h TYR 60 Cb 0.04 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 2vml h TYR 60 CO -0.09 0.69 -0.00 -0.91 -1.05 0.00 0.00 178.16 176.80 2vml h ASN 61 N 0.32 0.90 0.56 3.88 2.35 -0.75 -2.77 115.58 120.07 2vml h ASN 61 Ca 0.04 -0.24 -0.26 0.00 -0.55 0.00 0.00 56.30 55.29 2vml h ASN 61 Cb 0.78 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.92 2vml h ASN 61 CO 0.06 0.96 -1.16 0.50 -1.65 0.00 0.00 177.43 176.14 2vml h LYS 62 N 0.85 0.30 -2.40 0.81 1.63 -0.76 -3.38 116.57 113.62 2vml h LYS 62 Ca 0.16 -0.45 -0.60 0.00 -0.85 0.00 0.00 60.65 58.91 2vml h LYS 62 Cb 0.51 0.16 -0.41 0.00 -0.60 0.00 0.00 32.23 31.89 2vml h LYS 62 CO 0.03 1.19 -0.70 1.19 -3.45 0.00 0.00 179.45 177.70 2vml n PHE 63 N -3.59 2.56 0.22 1.91 3.72 -0.02 -4.98 117.46 117.29 2vml n PHE 63 Ca -0.08 -4.04 0.06 0.00 -0.05 0.00 0.00 57.45 53.35 2vml n PHE 63 Cb 0.97 -0.48 0.55 0.00 -0.94 0.00 0.00 39.48 39.59 2vml n PHE 63 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2vml h PRO 64 N 4.56 0.04 -0.16 -1.08 0.11 -1.68 -2.22 132.00 131.57 2vml h PRO 64 Ca 0.17 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.32 2vml h PRO 64 Cb 0.74 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 2vml h PRO 64 CO 0.71 0.12 0.20 0.10 -0.21 0.00 0.00 178.00 178.93 2vml h TYR 65 N 0.04 0.00 0.00 0.65 -0.00 -1.94 -2.65 116.97 113.07 2vml h TYR 65 Ca 0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.73 2vml h TYR 65 Cb 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.90 2vml h TYR 65 CO 0.00 0.00 -0.05 -0.07 -0.00 0.00 0.00 178.16 178.04 2vml h LEU 66 N 0.00 0.00 -1.20 0.10 3.38 -1.75 -2.36 115.31 113.48 2vml h LEU 66 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2vml h LEU 66 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2vml h LEU 66 CO -0.00 0.05 0.00 0.35 0.09 0.00 0.00 178.44 178.93 2vml n THR 67 N -4.45 0.28 -2.82 0.22 -2.24 -1.00 -0.56 114.28 103.71 2vml n THR 67 Ca -0.03 -0.39 -0.33 0.00 -2.27 0.00 0.00 64.05 61.03 2vml n THR 67 Cb 0.13 0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 68.66 2vml n THR 67 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2vml s GLN 68 N -1.72 4.19 0.23 -0.78 -1.52 -0.89 -4.66 119.66 114.51 2vml s GLN 68 Ca 0.31 1.06 -0.30 0.00 -1.95 0.00 0.00 55.36 54.48 2vml s GLN 68 Cb 0.17 -2.20 -0.15 0.00 -0.22 0.00 0.00 33.01 30.60 2vml s GLN 68 CO 0.24 -0.03 1.03 -2.30 -0.25 0.00 0.00 175.29 173.99 2vml n PRO 69 N -0.68 1.16 -0.21 2.91 -0.02 -1.26 -1.86 135.00 135.03 2vml n PRO 69 Ca 0.07 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2vml n PRO 69 Cb 0.54 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 2vml n PRO 69 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vml n GLY 70 N 1.62 2.01 3.99 -1.23 0.00 -1.26 -5.03 105.19 105.30 2vml n GLY 70 Ca 0.13 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 2vml n GLY 70 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vml s GLN 71 N -0.19 3.04 0.00 1.61 -1.52 -0.78 -5.02 119.66 116.80 2vml s GLN 71 Ca 0.00 -1.02 0.31 0.00 -1.95 0.00 0.00 55.36 52.71 2vml s GLN 71 Cb 0.00 -2.78 1.80 0.00 -0.22 0.00 0.00 33.01 31.81 2vml s GLN 71 CO 0.00 -0.04 2.17 -1.33 -0.25 0.00 0.00 175.29 175.83 2vml n MET 72 N -1.73 1.07 -0.41 2.91 2.81 -1.25 -2.37 117.12 118.16 2vml n MET 72 Ca 0.02 -0.12 0.08 0.00 -1.81 0.00 0.00 57.70 55.87 2vml n MET 72 Cb 0.58 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.85 2vml n MET 72 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2vml n GLY 73 N 1.02 3.36 3.67 3.03 0.00 0.27 -4.74 105.19 111.82 2vml n GLY 73 Ca 0.23 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.11 2vml n GLY 73 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vml s TYR 74 N -2.07 3.32 0.00 1.61 5.04 -1.00 -4.35 117.35 119.90 2vml s TYR 74 Ca 0.38 0.19 0.00 0.00 -2.44 0.00 0.00 57.07 55.20 2vml s TYR 74 Cb 0.27 -2.13 0.00 0.00 0.35 0.00 0.00 41.96 40.46 2vml s TYR 74 CO 0.14 0.20 0.00 0.41 -1.34 0.00 0.00 175.55 174.96 2vml n GLY 75 N 3.58 1.36 0.32 8.97 0.00 -1.26 -4.41 105.19 113.75 2vml n GLY 75 Ca -0.16 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.28 2vml n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vml h ASP 76 N 0.00 0.48 -0.04 1.61 3.32 -1.99 -2.35 116.42 117.46 2vml h ASP 76 Ca 0.00 0.14 -0.11 0.00 0.02 0.00 0.00 57.03 57.07 2vml h ASP 76 Cb 0.00 0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.63 2vml h ASP 76 CO 0.00 0.08 -0.41 0.74 -1.72 0.00 0.00 179.24 177.93 2vml h THR 77 N 0.51 1.44 -0.40 0.35 2.02 -1.99 -0.18 112.91 114.67 2vml h THR 77 Ca 0.57 -1.89 0.01 0.00 0.77 0.00 0.00 66.41 65.87 2vml h THR 77 Cb 1.02 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.90 2vml h THR 77 CO -0.48 0.54 0.24 0.78 0.37 0.00 0.00 175.52 176.98 2vml h ASN 78 N -0.18 0.40 0.18 4.18 2.35 -1.73 -1.84 115.58 118.94 2vml h ASN 78 Ca -0.04 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 2vml h ASN 78 Cb 1.10 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 2vml h ASN 78 CO 0.08 0.29 -0.43 1.56 -1.65 0.00 0.00 177.43 177.28 2vml h GLN 79 N 0.49 0.32 -0.43 0.81 4.20 -1.45 -2.18 115.11 116.87 2vml h GLN 79 Ca 0.16 -0.16 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 2vml h GLN 79 Cb -0.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2vml h GLN 79 CO -0.06 0.69 -0.29 0.00 -0.67 0.00 0.00 178.83 178.50 2vml h ALA 80 N 1.29 0.68 -0.22 3.87 0.00 -0.89 -2.67 119.26 121.32 2vml h ALA 80 Ca 0.02 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.44 2vml h ALA 80 Cb 0.87 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2vml h ALA 80 CO 0.07 0.67 -0.20 0.87 0.00 0.00 0.00 179.25 180.66 2vml h LYS 81 N 0.79 0.39 0.28 0.00 1.57 -1.23 -1.08 116.57 117.28 2vml h LYS 81 Ca 0.09 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2vml h LYS 81 Cb 0.86 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2vml h LYS 81 CO 0.08 0.57 -0.16 0.00 -0.57 0.00 0.00 179.45 179.37 2vml h ALA 83 N 0.30 0.96 -0.16 0.00 0.00 -1.35 -0.04 119.26 118.98 2vml h ALA 83 Ca -0.03 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2vml h ALA 83 Cb 0.33 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2vml h ALA 83 CO 0.04 0.40 0.06 -0.09 0.00 0.00 0.00 179.25 179.67 2vml h ARG 84 N 1.03 0.14 -0.38 0.00 2.43 -1.16 -0.77 114.38 115.66 2vml h ARG 84 Ca 0.27 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.41 2vml h ARG 84 Cb -0.08 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2vml h ARG 84 CO -0.06 0.09 0.16 -0.44 -1.51 0.00 0.00 179.97 178.21 2vml h ASP 85 N 0.14 0.52 -0.38 -3.80 5.19 -0.54 -0.60 116.42 116.94 2vml h ASP 85 Ca 0.06 -0.16 -0.05 0.00 -0.62 0.00 0.00 57.03 56.27 2vml h ASP 85 Cb 0.03 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 2vml h ASP 85 CO -0.06 0.54 0.08 0.40 -3.12 0.00 0.00 179.24 177.08 2vml h ILE 86 N 0.47 1.21 -0.37 0.35 2.04 -1.01 -2.15 117.51 118.05 2vml h ILE 86 Ca 0.13 -0.78 -0.07 0.00 1.00 0.00 0.00 64.86 65.13 2vml h ILE 86 Cb 0.18 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 2vml h ILE 86 CO -0.01 0.28 -0.06 -1.28 0.00 0.00 0.00 178.15 177.08 2vml h SER 87 N 0.68 0.60 -0.08 1.72 0.87 -0.70 -2.20 113.55 114.43 2vml h SER 87 Ca 0.15 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2vml h SER 87 Cb 0.30 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2vml h SER 87 CO 0.00 0.71 0.05 0.45 -0.53 0.00 0.00 176.83 177.51 2vml h HIS 88 N 0.58 0.10 -0.49 2.24 3.86 -0.50 0.28 115.15 121.22 2vml h HIS 88 Ca 0.11 0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.37 2vml h HIS 88 Cb 0.46 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 2vml h HIS 88 CO 0.02 0.09 0.24 1.88 0.86 0.00 0.00 177.93 181.02 2vml h TYR 89 N 0.09 0.44 -0.52 2.45 0.05 -1.18 0.30 116.97 118.60 2vml h TYR 89 Ca 0.03 0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.74 2vml h TYR 89 Cb 0.01 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.61 2vml h TYR 89 CO -0.07 0.21 -0.02 1.25 -1.05 0.00 0.00 178.16 178.49 2vml h LEU 90 N 0.47 0.91 -0.45 3.88 5.85 -1.27 -1.06 115.31 123.64 2vml h LEU 90 Ca 0.22 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.64 2vml h LEU 90 Cb 0.13 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2vml h LEU 90 CO -0.16 1.01 0.27 -0.09 -0.34 0.00 0.00 178.44 179.13 2vml h ARG 91 N 0.80 0.52 0.00 1.25 2.43 -0.49 -1.63 114.38 117.25 2vml h ARG 91 Ca 0.15 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2vml h ARG 91 Cb 0.55 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 2vml h ARG 91 CO 0.03 0.35 -0.23 0.74 -1.51 0.00 0.00 179.97 179.35 2vml h PHE 92 N 0.54 0.00 -0.26 2.20 0.04 -0.82 -1.34 116.94 117.30 2vml h PHE 92 Ca 0.18 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.86 2vml h PHE 92 Cb 0.01 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 2vml h PHE 92 CO -0.07 0.23 -0.19 0.82 -0.60 0.00 0.00 178.31 178.50 2vml h ILE 93 N 0.00 1.31 -0.29 -0.55 2.04 -0.90 -1.85 117.51 117.26 2vml h ILE 93 Ca -0.00 -1.32 -0.07 0.00 1.00 0.00 0.00 64.86 64.47 2vml h ILE 93 Cb 0.82 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 2vml h ILE 93 CO 0.03 0.41 -0.11 0.71 0.00 0.00 0.00 178.15 179.19 2vml h THR 94 N 0.31 1.23 -0.27 -0.27 1.35 -0.93 -0.80 112.91 113.53 2vml h THR 94 Ca 0.05 -0.99 -0.03 0.00 -0.55 0.00 0.00 66.41 64.89 2vml h THR 94 Cb 0.73 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 2vml h THR 94 CO 0.05 0.32 0.04 1.88 -0.25 0.00 0.00 175.52 177.57 2vml h TYR 95 N 0.46 0.48 -0.58 4.73 0.05 -1.19 -1.93 116.97 118.98 2vml h TYR 95 Ca 0.09 -0.07 -0.07 0.00 0.05 0.00 0.00 58.73 58.73 2vml h TYR 95 Cb 0.47 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.06 2vml h TYR 95 CO 0.02 0.55 0.09 0.77 -1.05 0.00 0.00 178.16 178.54 2vml h SER 96 N 0.26 0.93 -0.02 3.88 0.02 -1.04 0.22 113.55 117.79 2vml h SER 96 Ca 0.08 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 2vml h SER 96 Cb 0.34 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 2vml h SER 96 CO 0.01 0.95 -0.22 -0.07 -1.14 0.00 0.00 176.83 176.36 2vml h LEU 97 N 0.86 -0.66 -1.09 5.07 3.38 -1.12 -2.24 115.31 119.52 2vml h LEU 97 Ca 0.18 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.17 2vml h LEU 97 Cb 0.42 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2vml h LEU 97 CO 0.01 -0.29 -0.12 0.58 0.09 0.00 0.00 178.44 178.72 2vml h VAL 98 N -0.34 1.23 0.00 1.22 2.07 -1.06 -3.24 116.25 116.14 2vml h VAL 98 Ca 0.07 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.58 2vml h VAL 98 Cb 0.43 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2vml h VAL 98 CO -0.22 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.70 2vml h ALA 99 N 1.41 1.00 -0.69 1.67 0.00 -0.38 -3.48 119.26 118.79 2vml h ALA 99 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2vml h ALA 99 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2vml h ALA 99 CO 0.03 0.00 -0.05 0.41 0.00 0.00 0.00 179.25 179.64 2vml n GLY 100 N 0.90 0.48 0.00 0.00 0.00 -0.87 -4.71 105.19 101.00 2vml n GLY 100 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2vml n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vml n GLY 101 N -0.87 0.15 0.00 -0.02 0.00 -1.06 -2.23 105.19 101.16 2vml n GLY 101 Ca -0.01 -0.92 0.14 0.00 0.00 0.00 0.00 46.02 45.23 2vml n GLY 101 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vml n THR 102 N -0.15 0.09 -0.28 2.61 -2.24 -1.24 -4.40 114.28 108.67 2vml n THR 102 Ca 0.00 0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.87 2vml n THR 102 Cb 0.00 -0.55 0.17 0.00 -2.10 0.00 0.00 70.33 67.85 2vml n THR 102 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2vml h GLY 103 N 4.70 0.86 1.01 3.38 0.00 -1.48 0.37 103.07 111.90 2vml h GLY 103 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2vml h GLY 103 CO 0.00 -0.34 0.52 -2.55 0.00 0.00 0.00 176.54 174.18 2vml h PRO 104 N 0.06 1.08 -0.31 4.80 0.11 -1.81 -0.93 132.00 134.99 2vml h PRO 104 Ca 0.45 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.41 2vml h PRO 104 Cb 0.79 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 2vml h PRO 104 CO -0.76 0.73 -0.07 -0.07 -0.21 0.00 0.00 178.00 177.62 2vml h LEU 105 N 1.10 0.60 -0.31 2.35 3.38 -1.28 -2.00 115.31 119.14 2vml h LEU 105 Ca 0.30 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2vml h LEU 105 Cb -0.10 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 2vml h LEU 105 CO -0.06 0.82 0.11 0.44 0.09 0.00 0.00 178.44 179.84 2vml h ASP 106 N 0.36 0.12 0.52 -0.43 3.32 -0.83 0.97 116.42 120.46 2vml h ASP 106 Ca 0.08 0.03 -0.25 0.00 0.02 0.00 0.00 57.03 56.91 2vml h ASP 106 Cb 0.55 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2vml h ASP 106 CO 0.03 0.11 -1.09 0.44 -1.72 0.00 0.00 179.24 177.01 2vml h ASP 107 N 0.25 0.44 0.00 6.45 5.19 -1.16 -1.02 116.42 126.57 2vml h ASP 107 Ca 0.14 -0.41 -0.15 0.00 -0.62 0.00 0.00 57.03 55.99 2vml h ASP 107 Cb 0.11 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 39.45 2vml h ASP 107 CO -0.14 1.26 -1.90 -1.22 -3.12 0.00 0.00 179.24 174.12 2vml n TYR 108 N -3.63 0.00 -0.03 4.55 4.01 -0.76 -4.57 117.16 116.74 2vml n TYR 108 Ca -0.07 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.61 2vml n TYR 108 Cb 0.93 -0.57 -0.02 0.00 -0.31 0.00 0.00 39.34 39.37 2vml n TYR 108 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2vml n ILE 109 N -2.33 0.50 -0.09 -0.72 5.41 -0.33 -4.87 119.36 116.93 2vml n ILE 109 Ca -0.14 -0.03 -0.15 0.00 1.00 0.00 0.00 62.75 63.43 2vml n ILE 109 Cb 0.73 -1.62 -0.04 0.00 -0.71 0.00 0.00 39.64 38.00 2vml n ILE 109 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2vml h VAL 110 N -0.23 1.28 -2.74 1.39 2.07 -0.89 -3.32 116.25 113.82 2vml h VAL 110 Ca -0.14 -1.67 -0.56 0.00 0.82 0.00 0.00 66.70 65.16 2vml h VAL 110 Cb 1.01 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 2vml h VAL 110 CO -0.09 0.54 1.02 0.00 0.02 0.00 0.00 177.57 179.07 2vml s ALA 111 N -4.18 3.61 0.00 1.67 0.00 -0.39 -2.40 121.76 120.07 2vml s ALA 111 Ca -0.11 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.56 2vml s ALA 111 Cb 0.10 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.51 2vml s ALA 111 CO 0.88 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 175.69 2vml n GLY 112 N 3.98 0.85 0.18 0.00 0.00 -1.26 -4.86 105.19 104.08 2vml n GLY 112 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2vml n GLY 112 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2vml h LEU 113 N 0.00 -0.42 -0.31 0.99 5.85 -1.57 -1.12 115.31 118.74 2vml h LEU 113 Ca 0.00 0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 2vml h LEU 113 Cb 0.00 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2vml h LEU 113 CO 0.00 -0.18 -0.23 0.03 -0.34 0.00 0.00 178.44 177.72 2vml h ARG 114 N -0.19 0.70 -0.37 1.25 3.08 -1.91 -1.37 114.38 115.58 2vml h ARG 114 Ca 0.08 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2vml h ARG 114 Cb 0.29 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2vml h ARG 114 CO -0.20 0.95 0.23 1.49 -1.07 0.00 0.00 179.97 181.38 2vml h GLU 115 N 0.46 0.49 0.04 0.04 4.57 -1.94 -0.09 114.58 118.14 2vml h GLU 115 Ca 0.06 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2vml h GLU 115 Cb 0.78 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 2vml h GLU 115 CO 0.06 0.34 -0.02 0.28 -1.18 0.00 0.00 179.01 178.49 2vml h VAL 116 N 0.49 0.98 -0.26 0.32 2.07 -1.18 -2.35 116.25 116.33 2vml h VAL 116 Ca 0.13 -0.06 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 2vml h VAL 116 Cb -0.03 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 2vml h VAL 116 CO -0.03 0.02 -0.05 0.78 0.02 0.00 0.00 177.57 178.31 2vml h ASN 117 N -0.08 0.37 -0.32 0.57 2.35 -1.14 -2.16 115.58 115.17 2vml h ASN 117 Ca -0.01 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.61 2vml h ASN 117 Cb 0.07 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2vml h ASN 117 CO 0.01 0.48 -0.06 -0.09 -1.65 0.00 0.00 177.43 176.11 2vml h ARG 118 N 0.38 0.60 -0.46 0.81 2.43 -0.91 0.19 114.38 117.42 2vml h ARG 118 Ca 0.08 -0.22 -0.12 0.00 -0.81 0.00 0.00 59.98 58.90 2vml h ARG 118 Cb 0.33 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2vml h ARG 118 CO 0.01 0.78 -0.20 1.15 -1.51 0.00 0.00 179.97 180.20 2vml h THR 119 N 0.38 1.27 -0.48 0.20 2.02 -1.10 -3.06 112.91 112.14 2vml h THR 119 Ca 0.08 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.91 2vml h THR 119 Cb 0.54 1.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2vml h THR 119 CO 0.03 0.46 0.00 0.49 0.37 0.00 0.00 175.52 176.87 2vml n PHE 120 N -4.11 0.63 -3.63 3.16 3.72 -0.84 -4.96 117.46 111.43 2vml n PHE 120 Ca 0.00 -0.32 -0.23 0.00 -0.05 0.00 0.00 57.45 56.86 2vml n PHE 120 Cb 0.44 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.05 2vml n PHE 120 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2vml n ASN 121 N 1.15 -3.91 -4.62 4.37 3.02 -0.59 -4.99 115.26 109.69 2vml n ASN 121 Ca 0.19 -0.66 -0.38 0.00 -0.03 0.00 0.00 54.58 53.70 2vml n ASN 121 Cb 0.50 -4.67 -0.10 0.00 -0.61 0.00 0.00 39.78 34.90 2vml n ASN 121 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2vml s LEU 122 N -6.92 4.06 -0.07 3.41 1.43 0.56 -5.03 118.68 116.11 2vml s LEU 122 Ca 0.33 0.10 -0.30 0.00 -1.03 0.00 0.00 54.13 53.23 2vml s LEU 122 Cb -0.15 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.87 2vml s LEU 122 CO 0.76 -0.03 1.00 -0.44 0.23 0.00 0.00 176.35 177.87 2vml s SER 123 N 1.48 7.28 0.45 2.29 0.01 -1.26 -4.58 113.70 119.38 2vml s SER 123 Ca 0.09 1.57 0.16 0.00 1.31 0.00 0.00 55.95 59.08 2vml s SER 123 Cb -0.15 -2.56 1.11 0.00 0.21 0.00 0.00 66.02 64.63 2vml s SER 123 CO 0.09 -0.38 1.97 1.55 0.41 0.00 0.00 173.24 176.88 2vml h PRO 124 N 7.00 0.31 -0.96 12.44 0.13 -1.96 -2.58 132.00 146.39 2vml h PRO 124 Ca -0.34 -0.02 0.16 0.00 -0.87 0.00 0.00 66.00 64.93 2vml h PRO 124 Cb 1.17 -0.07 -0.10 0.00 0.13 0.00 0.00 31.00 32.13 2vml h PRO 124 CO 0.82 0.21 0.56 0.66 -0.23 0.00 0.00 178.00 180.02 2vml h SER 125 N 0.32 0.74 -0.38 1.44 4.64 -1.92 0.16 113.55 118.55 2vml h SER 125 Ca 0.28 0.09 0.01 0.00 -0.47 0.00 0.00 61.79 61.70 2vml h SER 125 Cb 0.68 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 2vml h SER 125 CO -0.07 0.30 0.23 -0.50 -0.87 0.00 0.00 176.83 175.92 2vml h TRP 126 N 0.77 0.43 -0.21 4.77 6.55 -1.87 -0.85 115.95 125.54 2vml h TRP 126 Ca 0.53 0.01 -0.19 0.00 0.95 0.00 0.00 58.89 60.19 2vml h TRP 126 Cb 0.74 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 28.90 2vml h TRP 126 CO -0.03 0.25 -0.64 1.88 -1.05 0.00 0.00 178.44 178.85 2vml h TYR 127 N 0.46 0.98 -0.51 0.49 0.05 -1.39 -1.69 116.97 115.36 2vml h TYR 127 Ca 0.15 -0.38 0.03 0.00 0.05 0.00 0.00 58.73 58.58 2vml h TYR 127 Cb -0.01 -0.17 -0.04 0.00 1.01 0.00 0.00 36.73 37.52 2vml h TYR 127 CO -0.07 1.19 0.29 0.82 -1.05 0.00 0.00 178.16 179.34 2vml h ILE 128 N 0.55 1.02 -0.44 -2.88 2.04 -0.57 -1.04 117.51 116.20 2vml h ILE 128 Ca -0.01 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 2vml h ILE 128 Cb 1.24 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 2vml h ILE 128 CO 0.13 0.11 0.13 -0.08 0.00 0.00 0.00 178.15 178.43 2vml h GLU 129 N 0.58 0.69 -0.63 2.37 4.57 -1.06 -0.32 114.58 120.78 2vml h GLU 129 Ca 0.21 -0.16 0.04 0.00 -1.18 0.00 0.00 59.36 58.28 2vml h GLU 129 Cb 0.06 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.50 2vml h GLU 129 CO -0.11 0.68 0.37 0.00 -1.18 0.00 0.00 179.01 178.76 2vml h ALA 130 N 0.98 0.83 -0.47 2.92 0.00 -1.08 -1.90 119.26 120.53 2vml h ALA 130 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 2vml h ALA 130 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2vml h ALA 130 CO -0.00 0.07 -0.21 -0.07 0.00 0.00 0.00 179.25 179.04 2vml h LEU 131 N 0.70 0.98 -0.96 0.00 3.38 -0.87 -1.53 115.31 117.01 2vml h LEU 131 Ca 0.27 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2vml h LEU 131 Cb 0.10 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 2vml h LEU 131 CO -0.14 1.15 0.37 0.11 0.09 0.00 0.00 178.44 180.02 2vml h LYS 132 N 0.83 1.12 -0.30 1.13 1.57 -0.89 -0.33 116.57 119.70 2vml h LYS 132 Ca 0.11 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2vml h LYS 132 Cb 0.78 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2vml h LYS 132 CO 0.06 0.86 0.05 1.25 -0.57 0.00 0.00 179.45 181.11 2vml h HIS 133 N 1.11 0.52 -0.80 -1.35 2.76 -1.15 -1.48 115.15 114.75 2vml h HIS 133 Ca 0.27 -0.07 0.05 0.00 -2.20 0.00 0.00 60.37 58.41 2vml h HIS 133 Cb 0.11 -0.14 -0.05 0.00 1.55 0.00 0.00 27.41 28.88 2vml h HIS 133 CO 0.01 0.57 0.50 0.82 -1.30 0.00 0.00 177.93 178.53 2vml h ILE 134 N 0.31 1.07 -0.55 6.26 2.04 -1.15 -2.38 117.51 123.11 2vml h ILE 134 Ca 0.09 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2vml h ILE 134 Cb 0.33 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 2vml h ILE 134 CO 0.00 0.17 0.35 0.50 0.00 0.00 0.00 178.15 179.18 2vml h LYS 135 N 0.94 0.73 -0.65 2.37 3.64 -0.93 0.43 116.57 123.10 2vml h LYS 135 Ca 0.34 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.74 2vml h LYS 135 Cb 0.09 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 31.69 2vml h LYS 135 CO -0.14 0.50 0.33 0.78 -2.27 0.00 0.00 179.45 178.64 2vml h GLY 136 N 0.74 0.96 1.18 5.01 0.00 -1.05 -2.36 103.07 107.55 2vml h GLY 136 Ca 0.20 -0.21 -0.22 0.00 0.00 0.00 0.00 47.33 47.10 2vml h GLY 136 CO -0.04 0.08 -0.78 0.50 0.00 0.00 0.00 176.54 176.30 2vml h LYS 137 N 0.58 0.81 -0.02 4.80 1.79 -0.96 -3.07 116.57 120.50 2vml h LYS 137 Ca 0.31 -0.65 -0.04 0.00 -2.18 0.00 0.00 60.65 58.09 2vml h LYS 137 Cb 0.29 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.07 2vml h LYS 137 CO -0.24 1.26 -0.18 0.28 -1.08 0.00 0.00 179.45 179.50 2vml h VAL 138 N 0.55 1.14 0.00 0.50 2.07 -0.89 -2.71 116.25 116.91 2vml h VAL 138 Ca -0.05 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 2vml h VAL 138 Cb 1.41 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 32.50 2vml h VAL 138 CO 0.16 0.19 -0.00 1.23 0.02 0.00 0.00 177.57 179.17 2vml h GLY 139 N 0.58 0.00 -0.16 2.17 0.00 -1.32 -1.10 103.07 103.24 2vml h GLY 139 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vml h GLY 139 CO 0.02 0.00 -0.84 1.44 0.00 0.00 0.00 176.54 177.16 2vml n SER 140 N -3.16 1.20 -0.06 0.19 7.64 -1.02 -4.48 113.62 113.93 2vml n SER 140 Ca -0.03 -1.07 -0.04 0.00 1.01 0.00 0.00 58.87 58.74 2vml n SER 140 Cb 0.08 0.83 -0.16 0.00 -1.01 0.00 0.00 64.21 63.95 2vml n SER 140 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vml n GLN 141 N -1.16 0.68 -4.31 1.43 6.02 -0.49 -4.99 117.38 114.56 2vml n GLN 141 Ca 0.05 -0.04 -0.18 0.00 -0.01 0.00 0.00 57.00 56.83 2vml n GLN 141 Cb 0.36 -1.55 -0.10 0.00 1.02 0.00 0.00 30.24 29.97 2vml n GLN 141 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2vml s LEU 142 N -5.26 2.51 0.29 1.08 1.43 -0.72 -5.08 118.68 112.93 2vml s LEU 142 Ca -0.09 -0.97 -0.02 0.00 -1.03 0.00 0.00 54.13 52.02 2vml s LEU 142 Cb 0.08 -0.60 -0.01 0.00 0.03 0.00 0.00 46.19 45.69 2vml s LEU 142 CO 0.85 -0.18 0.36 -0.94 0.23 0.00 0.00 176.35 176.66 2vml s SER 143 N -3.08 0.67 0.86 2.29 1.04 -1.26 -4.73 113.70 109.49 2vml s SER 143 Ca 0.18 -1.40 0.00 0.00 0.48 0.00 0.00 55.95 55.21 2vml s SER 143 Cb -0.01 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.67 2vml s SER 143 CO 0.05 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.76 2vml n GLY 144 N -0.47 2.50 0.17 7.32 0.00 -1.26 -3.07 105.19 110.39 2vml n GLY 144 Ca 0.02 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 2vml n GLY 144 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2vml h GLN 145 N 0.00 0.39 -0.69 1.61 1.08 -1.99 -2.01 115.11 113.50 2vml h GLN 145 Ca 0.00 -0.31 0.13 0.00 -1.45 0.00 0.00 58.65 57.02 2vml h GLN 145 Cb 0.00 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.40 2vml h GLN 145 CO 0.00 0.95 0.21 -1.35 -0.95 0.00 0.00 178.83 177.69 2vml h PRO 146 N 0.27 0.32 -0.46 1.46 0.11 -1.73 -0.37 132.00 131.61 2vml h PRO 146 Ca -0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2vml h PRO 146 Cb 1.28 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2vml h PRO 146 CO 0.12 0.21 0.29 1.25 -0.21 0.00 0.00 178.00 179.67 2vml h LEU 147 N 0.33 0.53 -0.99 2.35 5.85 -1.42 -0.94 115.31 121.02 2vml h LEU 147 Ca 0.38 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 59.09 2vml h LEU 147 Cb 0.58 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2vml h LEU 147 CO -0.43 0.40 0.65 0.74 -0.34 0.00 0.00 178.44 179.46 2vml h THR 148 N 0.61 1.21 0.38 1.05 2.02 -0.89 0.05 112.91 117.35 2vml h THR 148 Ca 0.17 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 2vml h THR 148 Cb -0.05 -0.19 0.00 0.00 -1.74 0.00 0.00 68.15 66.17 2vml h THR 148 CO -0.03 0.23 -0.18 -0.33 0.37 0.00 0.00 175.52 175.58 2vml h GLU 149 N 1.29 -0.50 -0.32 6.66 4.39 -0.87 -2.00 114.58 123.23 2vml h GLU 149 Ca 0.38 0.03 0.04 0.00 0.34 0.00 0.00 59.36 60.15 2vml h GLU 149 Cb -0.07 0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 2vml h GLU 149 CO -0.10 -0.29 0.09 0.00 -1.16 0.00 0.00 179.01 177.55 2vml h ALA 150 N 0.02 0.36 -0.57 3.43 0.00 -0.82 -2.26 119.26 119.42 2vml h ALA 150 Ca -0.05 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2vml h ALA 150 Cb 0.43 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2vml h ALA 150 CO 0.09 -0.31 0.35 -0.91 0.00 0.00 0.00 179.25 178.46 2vml h ASN 151 N 0.22 0.68 -0.13 0.00 2.35 -1.01 -1.74 115.58 115.96 2vml h ASN 151 Ca 0.15 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2vml h ASN 151 Cb 0.13 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 2vml h ASN 151 CO -0.17 0.52 0.07 0.00 -1.65 0.00 0.00 177.43 176.21 2vml h ALA 152 N 1.60 0.16 -0.04 -0.83 0.00 -0.76 0.02 119.26 119.41 2vml h ALA 152 Ca 0.21 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 2vml h ALA 152 Cb -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2vml h ALA 152 CO -0.04 -0.31 -0.68 1.88 0.00 0.00 0.00 179.25 180.11 2vml h TYR 153 N 0.11 0.23 -0.25 0.00 0.05 -1.33 -0.26 116.97 115.53 2vml h TYR 153 Ca 0.04 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.69 2vml h TYR 153 Cb 0.06 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2vml h TYR 153 CO -0.05 0.79 0.00 0.82 -1.05 0.00 0.00 178.16 178.68 2vml h ILE 154 N 0.12 1.25 -0.34 -2.88 2.04 -1.24 -2.75 117.51 113.71 2vml h ILE 154 Ca -0.01 -0.89 -0.07 0.00 1.00 0.00 0.00 64.86 64.88 2vml h ILE 154 Cb 1.21 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 2vml h ILE 154 CO 0.10 0.28 -0.08 0.44 0.00 0.00 0.00 178.15 178.89 2vml h ASP 155 N 0.21 0.56 -0.44 1.72 3.32 -0.91 -2.16 116.42 118.71 2vml h ASP 155 Ca 0.07 -0.14 0.07 0.00 0.02 0.00 0.00 57.03 57.05 2vml h ASP 155 Cb 0.41 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.75 2vml h ASP 155 CO 0.01 0.69 0.11 0.22 -1.72 0.00 0.00 179.24 178.55 2vml h TYR 156 N 0.54 0.18 -0.08 4.55 3.20 -0.94 -0.44 116.97 123.98 2vml h TYR 156 Ca 0.10 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2vml h TYR 156 Cb 0.47 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 2vml h TYR 156 CO 0.02 0.03 0.04 0.00 -1.64 0.00 0.00 178.16 176.61 2vml h ILE 158 N 0.00 0.83 -0.60 0.00 2.04 -1.10 -1.33 117.51 117.35 2vml h ILE 158 Ca 0.03 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 2vml h ILE 158 Cb 0.12 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 2vml h ILE 158 CO -0.00 0.09 0.00 0.78 0.00 0.00 0.00 178.15 179.02 2vml h ASN 159 N 0.52 1.02 0.20 1.72 2.35 -0.92 -2.74 115.58 117.73 2vml h ASN 159 Ca 0.32 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2vml h ASN 159 Cb 0.35 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 2vml h ASN 159 CO -0.27 1.07 -0.08 0.00 -1.65 0.00 0.00 177.43 176.50 2vml h ALA 160 N 1.04 1.42 -0.01 -0.83 0.00 -0.48 -2.40 119.26 118.00 2vml h ALA 160 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2vml h ALA 160 Cb 0.55 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2vml h ALA 160 CO 0.03 0.10 -0.30 1.28 0.00 0.00 0.00 179.25 180.35 2vml n LEU 161 N -3.79 0.93 -0.83 0.00 4.77 -0.56 -4.98 117.00 112.55 2vml n LEU 161 Ca -0.02 -0.22 0.10 0.00 -0.03 0.00 0.00 56.01 55.84 2vml n LEU 161 Cb 0.17 -0.14 0.09 0.00 -2.33 0.00 0.00 43.42 41.21 2vml n LEU 161 CO 0.30 0.18 0.58 -1.20 -1.33 0.00 0.00 177.39 175.91