#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 4.10 0.25 2.12 2.20 -1.26 -4.76 119.74 122.40 2vml s LYS 2 Ca 0.00 1.55 0.01 0.00 -0.36 0.00 0.00 55.97 57.18 2vml s LYS 2 Cb 0.00 -3.83 -0.04 0.00 -1.51 0.00 0.00 37.83 32.45 2vml s LYS 2 CO 0.00 -0.88 0.15 0.95 -0.36 0.00 0.00 175.35 175.21 2vml s THR 3 N 3.91 0.19 0.30 3.43 -4.23 -1.26 -1.52 115.64 116.47 2vml s THR 3 Ca 0.57 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.09 2vml s THR 3 Cb -0.21 -2.53 0.28 0.00 1.34 0.00 0.00 72.50 71.38 2vml s THR 3 CO 0.19 0.00 1.90 0.58 -0.54 0.00 0.00 174.62 176.75 2vml h VAL 4 N 2.42 1.03 -0.05 2.29 2.07 -1.70 -1.05 116.25 121.24 2vml h VAL 4 Ca -0.35 -0.34 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 2vml h VAL 4 Cb 1.25 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2vml h VAL 4 CO 0.52 0.18 -0.31 0.40 0.02 0.00 0.00 177.57 178.39 2vml h ILE 5 N 1.00 1.44 0.00 4.57 2.04 -1.92 -1.19 117.51 123.45 2vml h ILE 5 Ca 0.41 -1.75 -0.06 0.00 1.00 0.00 0.00 64.86 64.46 2vml h ILE 5 Cb 0.28 2.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.75 2vml h ILE 5 CO -0.17 0.50 -0.27 0.71 0.00 0.00 0.00 178.15 178.92 2vml h THR 6 N -0.22 1.15 -0.11 -0.27 1.35 -1.84 -2.36 112.91 110.61 2vml h THR 6 Ca -0.02 -0.95 -0.13 0.00 -0.55 0.00 0.00 66.41 64.76 2vml h THR 6 Cb 0.97 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2vml h THR 6 CO 0.06 0.27 -0.43 -0.08 -0.25 0.00 0.00 175.52 175.09 2vml h GLU 7 N 0.00 0.48 -0.26 4.72 4.81 -0.92 -1.27 114.58 122.15 2vml h GLU 7 Ca -0.00 -0.37 -0.11 0.00 -0.13 0.00 0.00 59.36 58.74 2vml h GLU 7 Cb 0.50 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2vml h GLU 7 CO 0.04 1.00 -0.31 -0.39 -0.73 0.00 0.00 179.01 178.62 2vml h VAL 8 N 0.07 1.28 -0.28 0.32 -1.51 -1.22 -1.42 116.25 113.48 2vml h VAL 8 Ca -0.02 -1.40 -0.02 0.00 -1.23 0.00 0.00 66.70 64.02 2vml h VAL 8 Cb 1.07 1.42 -0.01 0.00 -2.13 0.00 0.00 31.29 31.64 2vml h VAL 8 CO 0.09 0.44 0.08 0.40 -1.23 0.00 0.00 177.57 177.35 2vml h ILE 9 N 0.46 1.21 -0.98 7.19 2.04 -1.41 -1.62 117.51 124.40 2vml h ILE 9 Ca 0.06 -0.67 0.08 0.00 1.00 0.00 0.00 64.86 65.32 2vml h ILE 9 Cb 0.77 1.12 -0.07 0.00 -0.74 0.00 0.00 36.82 37.90 2vml h ILE 9 CO 0.06 0.22 0.63 0.00 0.00 0.00 0.00 178.15 179.06 2vml h ALA 10 N 0.91 1.47 0.20 1.87 0.00 -1.12 0.35 119.26 122.94 2vml h ALA 10 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2vml h ALA 10 Cb 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2vml h ALA 10 CO -0.00 0.37 -0.10 1.03 0.00 0.00 0.00 179.25 180.55 2vml h SER 11 N 1.09 -0.23 -0.69 0.00 0.87 -1.04 -0.03 113.55 113.51 2vml h SER 11 Ca 0.43 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.88 2vml h SER 11 Cb 0.25 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 2vml h SER 11 CO -0.18 -0.07 0.28 0.00 -0.53 0.00 0.00 176.83 176.32 2vml h ALA 12 N 0.40 0.90 -0.50 6.23 0.00 -1.08 -3.11 119.26 122.10 2vml h ALA 12 Ca -0.03 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2vml h ALA 12 Cb 0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2vml h ALA 12 CO 0.05 0.52 -0.09 0.22 0.00 0.00 0.00 179.25 179.94 2vml h ASP 13 N 0.98 0.94 0.01 0.00 3.58 -0.88 -0.69 116.42 120.37 2vml h ASP 13 Ca 0.23 -0.35 -0.00 0.00 0.42 0.00 0.00 57.03 57.33 2vml h ASP 13 Cb 0.21 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.00 2vml h ASP 13 CO -0.02 1.07 -0.00 0.77 -2.88 0.00 0.00 179.24 178.18 2vml h SER 14 N 0.80 0.00 -0.46 2.28 4.64 -0.93 -1.53 113.55 118.34 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 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2vml h SER 14 CO 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 2vml n GLN 15 N -3.57 2.50 -3.09 4.77 6.02 -1.00 -4.98 117.38 118.03 2vml n GLN 15 Ca -0.03 -2.30 -0.16 0.00 -0.01 0.00 0.00 57.00 54.50 2vml n GLN 15 Cb 0.08 -1.47 0.04 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 1.34 -0.12 3.17 1.08 0.00 -0.58 -4.99 105.19 105.09 2vml n GLY 16 Ca 0.19 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 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 -5.71 1.35 0.51 1.61 3.52 -0.30 -5.02 118.95 114.91 2vml s ARG 17 Ca 0.34 -0.65 -0.22 0.00 -0.13 0.00 0.00 55.73 55.07 2vml s ARG 17 Cb -0.15 -1.32 -0.06 0.00 -1.56 0.00 0.00 34.95 31.86 2vml s ARG 17 CO 0.42 0.36 1.28 -0.06 -0.81 0.00 0.00 175.30 176.49 2vml s PHE 18 N -0.47 2.52 0.27 5.12 0.08 -1.26 -4.30 117.98 119.94 2vml s PHE 18 Ca 0.06 1.44 -0.31 0.00 0.12 0.00 0.00 56.93 58.24 2vml s PHE 18 Cb -0.07 -3.63 -0.12 0.00 -0.57 0.00 0.00 43.02 38.63 2vml s PHE 18 CO -0.00 -2.34 1.58 1.28 -0.10 0.00 0.00 175.22 175.64 2vml n LEU 19 N -0.80 4.05 0.00 -0.37 4.77 -1.26 -4.98 117.00 118.41 2vml n LEU 19 Ca 0.09 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 2vml n LEU 19 Cb 0.46 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 2vml n LEU 19 CO 0.51 0.03 0.00 -0.46 -1.33 0.00 0.00 177.39 176.14 2vml n ASN 20 N 2.46 1.93 0.19 -1.43 0.23 -1.26 -5.00 115.26 112.38 2vml n ASN 20 Ca 0.10 -0.82 0.06 0.00 -0.53 0.00 0.00 54.58 53.39 2vml n ASN 20 Cb 0.35 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.59 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 0.00 0.12 -0.08 0.53 -0.00 -1.98 -1.77 115.58 112.40 2vml h ASN 21 Ca 0.00 -0.01 0.04 0.00 -0.00 0.00 0.00 56.30 56.33 2vml h ASN 21 Cb 0.00 -0.03 -0.05 0.00 -0.00 0.00 0.00 38.32 38.24 2vml h ASN 21 CO 0.00 0.15 -0.28 0.74 -0.00 0.00 0.00 177.43 178.04 2vml h THR 22 N 0.14 0.36 -0.01 -3.57 2.02 -2.00 -1.49 112.91 108.36 2vml h THR 22 Ca 0.03 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.04 2vml h THR 22 Cb 0.09 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 2vml h THR 22 CO 0.00 0.00 -0.77 -0.33 0.37 0.00 0.00 175.52 174.79 2vml h GLU 23 N -0.38 0.10 -0.12 6.66 3.07 -1.78 -3.10 114.58 119.04 2vml h GLU 23 Ca 0.08 -0.10 -0.14 0.00 -0.50 0.00 0.00 59.36 58.71 2vml h GLU 23 Cb 0.50 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 2vml h GLU 23 CO -0.29 0.82 -0.52 -0.07 -1.40 0.00 0.00 179.01 177.55 2vml h LEU 24 N 0.06 0.35 -0.39 1.33 3.38 -1.20 -1.32 115.31 117.52 2vml h LEU 24 Ca -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2vml h LEU 24 Cb 1.36 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2vml h LEU 24 CO 0.11 0.81 0.17 1.56 0.09 0.00 0.00 178.44 181.18 2vml h GLN 25 N 0.25 0.58 0.02 1.13 4.20 -1.31 -1.82 115.11 118.16 2vml h GLN 25 Ca 0.01 -0.10 0.03 0.00 0.06 0.00 0.00 58.65 58.65 2vml h GLN 25 Cb 1.00 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.63 2vml h GLN 25 CO 0.08 0.53 -0.30 0.00 -0.67 0.00 0.00 178.83 178.48 2vml h ALA 26 N 1.02 -0.44 -1.00 3.87 0.00 -1.45 -2.43 119.26 118.83 2vml h ALA 26 Ca 0.13 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.13 2vml h ALA 26 Cb 0.15 0.52 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 2vml h ALA 26 CO -0.01 -0.81 0.64 0.00 0.00 0.00 0.00 179.25 179.06 2vml h ALA 27 N 0.30 1.49 -0.94 0.00 0.00 -1.18 0.14 119.26 119.07 2vml h ALA 27 Ca 0.06 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.06 2vml h ALA 27 Cb 0.53 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 2vml h ALA 27 CO -0.24 0.30 0.60 -0.97 0.00 0.00 0.00 179.25 178.95 2vml h ASN 28 N 1.06 0.89 -0.95 0.00 -1.24 -1.03 -1.79 115.58 112.53 2vml h ASN 28 Ca 0.47 0.02 0.02 0.00 0.71 0.00 0.00 56.30 57.53 2vml h ASN 28 Cb 0.38 -0.16 -0.05 0.00 0.73 0.00 0.00 38.32 39.21 2vml h ASN 28 CO -0.23 0.53 0.62 1.23 -1.29 0.00 0.00 177.43 178.30 2vml h GLY 29 N 0.99 1.35 1.00 1.57 0.00 -0.49 0.88 103.07 108.37 2vml h GLY 29 Ca 0.43 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 47.28 2vml h GLY 29 CO -0.19 0.44 0.03 -0.09 0.00 0.00 0.00 176.54 176.74 2vml h ARG 30 N 1.24 0.07 -0.31 4.80 1.12 -1.25 -2.58 114.38 117.47 2vml h ARG 30 Ca 0.36 -0.00 -0.13 0.00 -1.11 0.00 0.00 59.98 59.10 2vml h ARG 30 Cb -0.07 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 29.87 2vml h ARG 30 CO -0.10 0.04 -0.34 0.74 -3.11 0.00 0.00 179.97 177.20 2vml h PHE 31 N 0.07 0.80 -0.05 2.20 0.04 -0.94 -2.58 116.94 116.48 2vml h PHE 31 Ca 0.02 -0.21 -0.09 0.00 2.80 0.00 0.00 57.97 60.48 2vml h PHE 31 Cb -0.01 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 2vml h PHE 31 CO -0.08 0.93 -0.39 0.37 -0.60 0.00 0.00 178.31 178.55 2vml h GLN 32 N 0.57 0.10 0.00 1.51 4.15 -0.88 -3.11 115.11 117.45 2vml h GLN 32 Ca 0.06 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2vml h GLN 32 Cb 0.86 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.55 2vml h GLN 32 CO 0.07 0.48 -0.24 -0.09 -1.93 0.00 0.00 178.83 177.12 2vml h ARG 33 N 0.08 0.00 -0.95 1.69 9.65 -1.21 -3.37 114.38 120.27 2vml h ARG 33 Ca 0.01 0.00 0.13 0.00 -1.10 0.00 0.00 59.98 59.02 2vml h ARG 33 Cb 0.73 0.00 -0.08 0.00 -1.39 0.00 0.00 29.97 29.23 2vml h ARG 33 CO 0.05 0.00 0.60 0.00 2.80 0.00 0.00 179.97 183.43 2vml h ALA 34 N 2.41 1.66 0.09 2.80 0.00 -1.39 -1.86 119.26 122.96 2vml h ALA 34 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2vml h ALA 34 Cb 0.80 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2vml h ALA 34 CO 0.00 0.10 -0.04 1.15 0.00 0.00 0.00 179.25 180.46 2vml h THR 35 N 0.86 0.99 -0.63 0.00 2.02 -1.79 0.73 112.91 115.10 2vml h THR 35 Ca 0.47 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 67.41 2vml h THR 35 Cb 0.58 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.11 2vml h THR 35 CO -0.24 0.06 0.40 0.00 0.37 0.00 0.00 175.52 176.12 2vml h ALA 36 N 0.67 0.81 -0.71 6.16 0.00 -1.79 -1.87 119.26 122.53 2vml h ALA 36 Ca -0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2vml h ALA 36 Cb 0.19 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2vml h ALA 36 CO 0.02 0.18 0.30 0.77 0.00 0.00 0.00 179.25 180.52 2vml h SER 37 N 0.81 0.97 0.69 0.00 0.02 -1.08 -1.83 113.55 113.13 2vml h SER 37 Ca 0.24 -0.16 -0.16 0.00 -0.84 0.00 0.00 61.79 60.87 2vml h SER 37 Cb -0.04 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 2vml h SER 37 CO -0.08 0.87 -0.73 0.24 -1.14 0.00 0.00 176.83 175.99 2vml h MET 38 N 1.02 0.03 -0.58 3.45 2.86 -0.66 -0.98 114.93 120.07 2vml h MET 38 Ca 0.24 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.79 2vml h MET 38 Cb 0.19 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 2vml h MET 38 CO -0.02 0.75 0.13 1.49 1.06 0.00 0.00 176.91 180.31 2vml h GLU 39 N 0.02 0.93 -0.12 1.72 4.81 -1.18 -1.47 114.58 119.29 2vml h GLU 39 Ca -0.01 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2vml h GLU 39 Cb 1.29 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2vml h GLU 39 CO 0.10 0.87 0.06 0.00 -0.73 0.00 0.00 179.01 179.31 2vml h ALA 40 N 1.02 0.15 -0.77 2.92 0.00 -1.12 -2.83 119.26 118.63 2vml h ALA 40 Ca 0.18 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.07 2vml h ALA 40 Cb 0.37 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2vml h ALA 40 CO 0.00 -0.30 0.47 0.00 0.00 0.00 0.00 179.25 179.43 2vml h ALA 41 N 0.94 1.03 -0.85 0.00 0.00 -1.07 -2.09 119.26 117.22 2vml h ALA 41 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2vml h ALA 41 Cb 0.10 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2vml h ALA 41 CO -0.01 0.23 0.51 0.00 0.00 0.00 0.00 179.25 179.98 2vml h ARG 42 N 0.89 1.16 -0.12 0.00 3.08 -1.21 -0.11 114.38 118.07 2vml h ARG 42 Ca 0.32 -0.10 -0.21 0.00 0.07 0.00 0.00 59.98 60.05 2vml h ARG 42 Cb 0.10 -0.24 0.01 0.00 0.08 0.00 0.00 29.97 29.91 2vml h ARG 42 CO -0.15 0.81 -0.79 0.00 -1.07 0.00 0.00 179.97 178.78 2vml h ALA 43 N 1.39 0.39 -0.24 0.04 0.00 -1.20 -1.57 119.26 118.06 2vml h ALA 43 Ca 0.31 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 2vml h ALA 43 Cb -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2vml h ALA 43 CO -0.06 0.71 -0.48 -0.07 0.00 0.00 0.00 179.25 179.36 2vml h LEU 44 N 0.44 0.70 -0.23 0.00 4.07 -1.22 -2.63 115.31 116.44 2vml h LEU 44 Ca -0.05 -0.35 -0.05 0.00 0.08 0.00 0.00 57.88 57.51 2vml h LEU 44 Cb 1.40 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.93 2vml h LEU 44 CO 0.15 1.07 -0.06 0.74 -1.08 0.00 0.00 178.44 179.26 2vml h THR 45 N 0.51 1.28 0.00 0.22 2.02 -1.00 -2.59 112.91 113.36 2vml h THR 45 Ca 0.03 -1.06 -0.09 0.00 0.77 0.00 0.00 66.41 66.07 2vml h THR 45 Cb 1.02 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 2vml h THR 45 CO 0.10 0.33 -0.40 0.77 0.37 0.00 0.00 175.52 176.68 2vml h SER 46 N 0.18 0.00 -0.47 4.18 4.64 -1.30 -2.94 113.55 117.84 2vml h SER 46 Ca 0.06 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 2vml h SER 46 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 2vml h SER 46 CO 0.02 0.40 0.01 0.59 -0.87 0.00 0.00 176.83 176.99 2vml n ASN 47 N -3.47 4.99 -0.15 4.97 3.02 -0.99 -4.70 115.26 118.93 2vml n ASN 47 Ca 0.00 -3.00 -0.08 0.00 -0.03 0.00 0.00 54.58 51.47 2vml n ASN 47 Cb 0.55 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 3.09 0.56 -0.15 5.41 0.00 -1.27 -0.37 119.26 126.53 2vml h ALA 48 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2vml h ALA 48 Cb 1.81 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2vml h ALA 48 CO 0.41 0.10 0.05 -0.44 0.00 0.00 0.00 179.25 179.37 2vml h ASP 49 N 0.57 0.05 0.52 0.00 3.32 -1.84 0.06 116.42 119.10 2vml h ASP 49 Ca 0.15 0.02 -0.16 0.00 0.02 0.00 0.00 57.03 57.06 2vml h ASP 49 Cb 0.07 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2vml h ASP 49 CO -0.02 0.05 -0.71 0.77 -1.72 0.00 0.00 179.24 177.61 2vml h SER 50 N 0.12 0.19 -0.33 6.45 4.64 -1.89 -0.85 113.55 121.88 2vml h SER 50 Ca 0.06 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.22 2vml h SER 50 Cb 0.04 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2vml h SER 50 CO -0.07 0.84 0.09 -0.07 -0.87 0.00 0.00 176.83 176.75 2vml h LEU 51 N 0.11 0.49 0.24 5.97 3.38 -0.90 -1.81 115.31 122.79 2vml h LEU 51 Ca -0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2vml h LEU 51 Cb 1.26 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2vml h LEU 51 CO 0.10 0.59 -0.11 0.58 0.09 0.00 0.00 178.44 179.69 2vml h VAL 52 N 0.38 0.81 -0.39 1.22 2.07 -0.94 -2.24 116.25 117.16 2vml h VAL 52 Ca 0.10 -0.24 0.08 0.00 0.82 0.00 0.00 66.70 67.46 2vml h VAL 52 Cb 0.28 0.95 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 2vml h VAL 52 CO -0.00 0.05 -0.21 0.11 0.02 0.00 0.00 177.57 177.55 2vml h LYS 53 N -0.44 -0.13 -0.39 1.57 1.57 -1.10 -1.66 116.57 115.98 2vml h LYS 53 Ca -0.03 0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2vml h LYS 53 Cb 0.33 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2vml h LYS 53 CO 0.05 -0.09 -0.13 0.78 -0.57 0.00 0.00 179.45 179.49 2vml h GLY 54 N -0.14 0.76 0.83 3.86 0.00 -1.36 -2.07 103.07 104.95 2vml h GLY 54 Ca 0.19 -0.57 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 2vml h GLY 54 CO -0.48 0.53 0.02 0.00 0.00 0.00 0.00 176.54 176.61 2vml h ALA 55 N 1.22 0.27 -0.44 3.60 0.00 -0.88 -0.98 119.26 122.05 2vml h ALA 55 Ca 0.11 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.84 2vml h ALA 55 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2vml h ALA 55 CO 0.04 -0.05 0.28 0.28 0.00 0.00 0.00 179.25 179.80 2vml h VAL 56 N 0.13 1.09 -0.07 0.00 2.07 -1.20 -1.92 116.25 116.35 2vml h VAL 56 Ca 0.06 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.32 2vml h VAL 56 Cb 0.34 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2vml h VAL 56 CO 0.01 0.10 -0.23 -0.61 0.02 0.00 0.00 177.57 176.86 2vml h GLN 57 N 0.57 0.12 -0.14 1.57 5.75 -1.31 -2.69 115.11 118.98 2vml h GLN 57 Ca 0.16 -0.03 -0.12 0.00 -0.15 0.00 0.00 58.65 58.51 2vml h GLN 57 Cb -0.05 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 2vml h GLN 57 CO -0.05 0.35 -0.44 1.49 -2.65 0.00 0.00 178.83 177.54 2vml h GLU 58 N 0.11 0.33 -0.28 1.69 4.57 -0.70 -0.64 114.58 119.66 2vml h GLU 58 Ca 0.02 -0.17 0.01 0.00 -1.18 0.00 0.00 59.36 58.04 2vml h GLU 58 Cb 0.47 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 2vml h GLU 58 CO 0.03 0.71 0.16 0.28 -1.18 0.00 0.00 179.01 179.02 2vml h VAL 59 N 0.27 1.04 -0.11 0.32 2.07 -1.04 -0.56 116.25 118.23 2vml h VAL 59 Ca 0.02 -0.12 -0.10 0.00 0.82 0.00 0.00 66.70 67.32 2vml h VAL 59 Cb 0.88 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2vml h VAL 59 CO 0.07 0.06 -0.40 1.88 0.02 0.00 0.00 177.57 179.21 2vml h TYR 60 N 0.34 0.29 -0.57 1.57 0.05 -1.34 0.35 116.97 117.65 2vml h TYR 60 Ca 0.11 -0.07 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 2vml h TYR 60 Cb -0.01 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 2vml h TYR 60 CO -0.07 0.61 -0.01 -0.91 -1.05 0.00 0.00 178.16 176.72 2vml h ASN 61 N 0.21 1.00 0.16 3.88 2.35 -0.89 -2.84 115.58 119.45 2vml h ASN 61 Ca 0.02 -0.31 -0.22 0.00 -0.55 0.00 0.00 56.30 55.23 2vml h ASN 61 Cb 0.79 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.90 2vml h ASN 61 CO 0.06 1.07 -0.88 0.50 -1.65 0.00 0.00 177.43 176.54 2vml h LYS 62 N 0.91 0.54 -2.35 0.81 1.63 -0.85 -3.36 116.57 113.89 2vml h LYS 62 Ca 0.16 -0.52 -0.60 0.00 -0.85 0.00 0.00 60.65 58.85 2vml h LYS 62 Cb 0.57 0.13 -0.41 0.00 -0.60 0.00 0.00 32.23 31.92 2vml h LYS 62 CO 0.03 1.15 -0.71 1.19 -3.45 0.00 0.00 179.45 177.66 2vml n PHE 63 N -3.83 2.54 0.24 1.91 3.72 0.09 -4.98 117.46 117.15 2vml n PHE 63 Ca -0.07 -4.03 0.06 0.00 -0.05 0.00 0.00 57.45 53.37 2vml n PHE 63 Cb 0.79 -0.48 0.56 0.00 -0.94 0.00 0.00 39.48 39.41 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 4.48 0.00 -0.08 -1.08 0.11 -1.67 -2.20 132.00 131.57 2vml h PRO 64 Ca 0.17 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.30 2vml h PRO 64 Cb 0.74 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 2vml h PRO 64 CO 0.71 0.11 0.15 0.10 -0.21 0.00 0.00 178.00 178.87 2vml h TYR 65 N 0.00 0.00 -0.23 0.65 -0.00 -1.94 -2.70 116.97 112.76 2vml h TYR 65 Ca -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.72 2vml h TYR 65 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.91 2vml h TYR 65 CO 0.00 0.00 0.09 -0.07 -0.00 0.00 0.00 178.16 178.18 2vml h LEU 66 N 0.00 0.29 -0.92 0.10 3.38 -1.74 -2.59 115.31 113.82 2vml h LEU 66 Ca 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2vml h LEU 66 Cb 0.34 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2vml h LEU 66 CO -0.00 0.27 0.00 0.35 0.09 0.00 0.00 178.44 179.15 2vml n THR 67 N -4.43 0.20 -2.84 0.22 -2.24 -1.02 -1.17 114.28 103.01 2vml n THR 67 Ca 0.00 -0.30 -0.33 0.00 -2.27 0.00 0.00 64.05 61.16 2vml n THR 67 Cb 0.13 0.24 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 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 -1.80 4.19 0.20 -0.78 -1.52 -0.98 -4.66 119.66 114.31 2vml s GLN 68 Ca 0.29 1.05 -0.32 0.00 -1.95 0.00 0.00 55.36 54.44 2vml s GLN 68 Cb 0.15 -2.21 -0.15 0.00 -0.22 0.00 0.00 33.01 30.58 2vml s GLN 68 CO 0.23 -0.02 1.13 -2.30 -0.25 0.00 0.00 175.29 174.08 2vml n PRO 69 N -0.66 1.22 -0.06 2.91 -0.02 -1.26 -1.74 135.00 135.39 2vml n PRO 69 Ca 0.07 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2vml n PRO 69 Cb 0.54 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 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 1.86 1.75 3.99 -1.23 0.00 -1.26 -5.04 105.19 105.27 2vml n GLY 70 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.38 3.07 0.00 1.61 -1.52 -0.71 -5.02 119.66 116.71 2vml s GLN 71 Ca 0.00 -1.01 0.31 0.00 -1.95 0.00 0.00 55.36 52.71 2vml s GLN 71 Cb 0.00 -2.79 1.71 0.00 -0.22 0.00 0.00 33.01 31.71 2vml s GLN 71 CO 0.00 -0.01 2.13 -1.33 -0.25 0.00 0.00 175.29 175.82 2vml n MET 72 N -1.70 0.97 -0.42 2.91 2.81 -1.25 -2.16 117.12 118.27 2vml n MET 72 Ca 0.01 -0.12 0.08 0.00 -1.81 0.00 0.00 57.70 55.86 2vml n MET 72 Cb 0.58 -1.50 0.26 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 1.08 3.21 3.71 3.03 0.00 -0.32 -4.73 105.19 111.17 2vml n GLY 73 Ca 0.21 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.94 3.39 0.00 1.61 5.04 -0.92 -4.34 117.35 120.19 2vml s TYR 74 Ca 0.39 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 55.31 2vml s TYR 74 Cb 0.27 -2.16 0.00 0.00 0.35 0.00 0.00 41.96 40.42 2vml s TYR 74 CO 0.16 0.26 0.00 0.41 -1.34 0.00 0.00 175.55 175.04 2vml n GLY 75 N 3.56 1.27 0.37 8.97 0.00 -1.26 -4.40 105.19 113.70 2vml n GLY 75 Ca -0.16 -1.78 0.02 0.00 0.00 0.00 0.00 46.02 44.10 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 1.03 -0.04 1.61 5.19 -1.98 -2.23 116.42 120.00 2vml h ASP 76 Ca 0.00 -0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.32 2vml h ASP 76 Cb 0.00 -0.23 0.01 0.00 0.18 0.00 0.00 39.33 39.29 2vml h ASP 76 CO 0.00 0.68 -0.34 0.74 -3.12 0.00 0.00 179.24 177.21 2vml h THR 77 N 1.18 1.45 -0.26 0.35 2.02 -1.99 0.42 112.91 116.09 2vml h THR 77 Ca 0.40 -1.82 0.03 0.00 0.77 0.00 0.00 66.41 65.79 2vml h THR 77 Cb 0.09 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.93 2vml h THR 77 CO -0.14 0.52 0.10 0.78 0.37 0.00 0.00 175.52 177.14 2vml h ASN 78 N -0.23 0.12 0.21 4.18 2.35 -1.74 -1.75 115.58 118.72 2vml h ASN 78 Ca -0.03 0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 2vml h ASN 78 Cb 1.02 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 2vml h ASN 78 CO 0.07 0.10 -0.39 1.56 -1.65 0.00 0.00 177.43 177.12 2vml h GLN 79 N 0.22 0.25 -0.44 0.81 4.20 -1.42 -2.18 115.11 116.55 2vml h GLN 79 Ca 0.11 -0.11 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 2vml h GLN 79 Cb 0.07 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2vml h GLN 79 CO -0.11 0.61 -0.27 0.00 -0.67 0.00 0.00 178.83 178.39 2vml h ALA 80 N 1.39 0.70 -0.19 3.87 0.00 -0.76 -2.64 119.26 121.62 2vml h ALA 80 Ca 0.02 -0.41 -0.09 0.00 0.00 0.00 0.00 54.91 54.44 2vml h ALA 80 Cb 0.78 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2vml h ALA 80 CO 0.06 0.67 -0.26 0.87 0.00 0.00 0.00 179.25 180.59 2vml h LYS 81 N 0.80 0.37 0.20 0.00 1.57 -1.16 -1.44 116.57 116.90 2vml h LYS 81 Ca 0.09 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2vml h LYS 81 Cb 0.84 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2vml h LYS 81 CO 0.07 0.61 -0.10 0.00 -0.57 0.00 0.00 179.45 179.46 2vml h ALA 83 N 0.52 0.83 -0.00 0.00 0.00 -1.36 -0.83 119.26 118.42 2vml h ALA 83 Ca -0.03 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2vml h ALA 83 Cb 0.22 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2vml h ALA 83 CO 0.04 0.35 -0.09 -0.09 0.00 0.00 0.00 179.25 179.46 2vml h ARG 84 N 0.88 -0.16 -0.26 0.00 2.43 -1.22 -0.44 114.38 115.62 2vml h ARG 84 Ca 0.23 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.42 2vml h ARG 84 Cb 0.06 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 2vml h ARG 84 CO -0.03 -0.10 0.14 -0.44 -1.51 0.00 0.00 179.97 178.03 2vml h ASP 85 N -0.16 0.23 -0.61 -3.80 5.19 -0.71 0.77 116.42 117.33 2vml h ASP 85 Ca 0.04 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.40 2vml h ASP 85 Cb 0.21 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.65 2vml h ASP 85 CO -0.10 0.17 0.21 0.40 -3.12 0.00 0.00 179.24 176.80 2vml h ILE 86 N 0.30 1.24 -0.57 0.35 2.04 -1.11 -1.51 117.51 118.24 2vml h ILE 86 Ca 0.10 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2vml h ILE 86 Cb 0.00 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.58 2vml h ILE 86 CO -0.05 0.31 0.29 -1.28 0.00 0.00 0.00 178.15 177.42 2vml h SER 87 N 0.94 0.70 0.21 1.72 0.87 -0.68 -2.30 113.55 115.01 2vml h SER 87 Ca 0.21 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 2vml h SER 87 Cb 0.25 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2vml h SER 87 CO -0.01 0.58 -0.19 0.45 -0.53 0.00 0.00 176.83 177.13 2vml h HIS 88 N 0.79 -0.50 -0.26 2.24 3.86 0.13 -0.63 115.15 120.79 2vml h HIS 88 Ca 0.20 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.47 2vml h HIS 88 Cb 0.05 0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.66 2vml h HIS 88 CO 0.01 -0.29 -0.10 1.88 0.86 0.00 0.00 177.93 180.28 2vml h TYR 89 N -0.43 -0.24 -0.72 2.45 0.05 -1.21 0.13 116.97 117.01 2vml h TYR 89 Ca -0.01 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.75 2vml h TYR 89 Cb 0.39 0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 2vml h TYR 89 CO -0.14 -0.16 0.25 1.25 -1.05 0.00 0.00 178.16 178.30 2vml h LEU 90 N -0.06 1.03 -0.28 3.88 5.85 -1.36 -0.90 115.31 123.47 2vml h LEU 90 Ca 0.13 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.66 2vml h LEU 90 Cb 0.26 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2vml h LEU 90 CO -0.30 0.95 0.18 -0.09 -0.34 0.00 0.00 178.44 178.84 2vml h ARG 91 N 1.05 0.37 0.00 1.25 2.43 -0.32 -1.96 114.38 117.21 2vml h ARG 91 Ca 0.23 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2vml h ARG 91 Cb 0.28 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2vml h ARG 91 CO -0.01 0.26 -0.16 0.74 -1.51 0.00 0.00 179.97 179.29 2vml h PHE 92 N 0.37 0.00 -0.25 2.20 0.04 -0.47 -1.59 116.94 117.24 2vml h PHE 92 Ca 0.10 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.79 2vml h PHE 92 Cb -0.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.12 2vml h PHE 92 CO -0.05 0.16 -0.15 0.82 -0.60 0.00 0.00 178.31 178.49 2vml h ILE 93 N 0.00 1.30 -0.38 -0.55 2.04 -0.96 -1.79 117.51 117.17 2vml h ILE 93 Ca -0.00 -1.25 -0.08 0.00 1.00 0.00 0.00 64.86 64.53 2vml h ILE 93 Cb 0.65 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 2vml h ILE 93 CO 0.02 0.39 -0.10 0.71 0.00 0.00 0.00 178.15 179.17 2vml h THR 94 N 0.26 1.25 -0.38 -0.27 1.35 -0.97 -0.93 112.91 113.22 2vml h THR 94 Ca 0.05 -1.09 -0.06 0.00 -0.55 0.00 0.00 66.41 64.77 2vml h THR 94 Cb 0.66 1.06 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 2vml h THR 94 CO 0.04 0.37 0.02 1.88 -0.25 0.00 0.00 175.52 177.58 2vml h TYR 95 N 0.61 0.71 -0.51 4.73 0.05 -1.26 -1.64 116.97 119.67 2vml h TYR 95 Ca 0.11 -0.12 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 2vml h TYR 95 Cb 0.53 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 38.06 2vml h TYR 95 CO 0.02 0.73 0.17 0.77 -1.05 0.00 0.00 178.16 178.81 2vml h SER 96 N 0.48 0.73 0.09 3.88 0.02 -1.10 0.16 113.55 117.81 2vml h SER 96 Ca 0.11 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.88 2vml h SER 96 Cb 0.44 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.74 2vml h SER 96 CO 0.02 0.73 -0.41 -0.07 -1.14 0.00 0.00 176.83 175.96 2vml h LEU 97 N 0.69 -1.22 -1.46 5.07 3.38 -1.06 -2.21 115.31 118.50 2vml h LEU 97 Ca 0.17 0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 2vml h LEU 97 Cb 0.25 0.46 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2vml h LEU 97 CO -0.01 -0.47 -0.13 0.58 0.09 0.00 0.00 178.44 178.50 2vml h VAL 98 N -0.62 1.16 0.00 1.22 2.07 -1.07 -3.09 116.25 115.92 2vml h VAL 98 Ca 0.03 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2vml h VAL 98 Cb 0.66 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2vml h VAL 98 CO -0.26 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.55 2vml h ALA 99 N 1.69 1.00 -1.47 1.67 0.00 -0.40 -3.48 119.26 118.27 2vml h ALA 99 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2vml h ALA 99 Cb 0.35 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.15 2vml h ALA 99 CO 0.02 0.00 -0.14 0.41 0.00 0.00 0.00 179.25 179.54 2vml n GLY 100 N 1.19 0.43 0.00 0.00 0.00 -0.86 -4.68 105.19 101.27 2vml n GLY 100 Ca 0.05 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.91 0.64 0.01 -0.02 0.00 -1.13 -2.13 105.19 101.65 2vml n GLY 101 Ca -0.02 -0.95 0.14 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.35 0.00 -0.36 2.61 -2.24 -1.25 -4.41 114.28 108.28 2vml n THR 102 Ca 0.00 -0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 2vml n THR 102 Cb 0.00 -0.46 0.10 0.00 -2.10 0.00 0.00 70.33 67.87 2vml n THR 102 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vml n GLY 103 N 1.37 -1.76 0.27 3.38 0.00 -0.57 -0.59 105.19 107.28 2vml n GLY 103 Ca 0.11 1.05 -0.05 0.00 0.00 0.00 0.00 46.02 47.14 2vml n GLY 103 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2vml h PRO 104 N 0.00 0.91 -0.35 1.61 0.11 -1.81 0.04 132.00 132.50 2vml h PRO 104 Ca 0.42 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.42 2vml h PRO 104 Cb 0.66 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 2vml h PRO 104 CO -0.99 0.61 0.03 -0.07 -0.21 0.00 0.00 178.00 177.37 2vml h LEU 105 N 0.94 0.58 -0.40 2.35 3.38 -1.32 -1.95 115.31 118.88 2vml h LEU 105 Ca 0.25 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2vml h LEU 105 Cb -0.10 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 2vml h LEU 105 CO -0.05 0.72 0.18 0.44 0.09 0.00 0.00 178.44 179.81 2vml h ASP 106 N 0.43 0.24 0.95 -0.43 3.32 -0.61 0.42 116.42 120.73 2vml h ASP 106 Ca 0.10 0.03 -0.22 0.00 0.02 0.00 0.00 57.03 56.96 2vml h ASP 106 Cb 0.40 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 2vml h ASP 106 CO 0.01 0.18 -1.05 0.44 -1.72 0.00 0.00 179.24 177.10 2vml h ASP 107 N 0.37 0.05 0.00 6.45 5.19 -0.97 -1.28 116.42 126.23 2vml h ASP 107 Ca 0.18 -0.05 -0.10 0.00 -0.62 0.00 0.00 57.03 56.44 2vml h ASP 107 Cb 0.11 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 2vml h ASP 107 CO -0.14 1.04 -1.72 -1.22 -3.12 0.00 0.00 179.24 174.08 2vml n TYR 108 N -3.36 0.00 -0.02 4.55 4.01 -0.74 -4.65 117.16 116.95 2vml n TYR 108 Ca -0.01 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.68 2vml n TYR 108 Cb 0.95 -0.44 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 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 -2.18 0.25 -0.07 -0.72 5.41 -0.37 -4.88 119.36 116.81 2vml n ILE 109 Ca -0.10 -0.06 -0.14 0.00 1.00 0.00 0.00 62.75 63.45 2vml n ILE 109 Cb 0.59 -1.56 -0.06 0.00 -0.71 0.00 0.00 39.64 37.90 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 -0.16 1.33 -2.83 1.39 2.07 -1.00 -3.30 116.25 113.74 2vml h VAL 110 Ca -0.11 -1.53 -0.56 0.00 0.82 0.00 0.00 66.70 65.31 2vml h VAL 110 Cb 1.10 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 32.64 2vml h VAL 110 CO -0.07 0.47 1.06 0.00 0.02 0.00 0.00 177.57 179.06 2vml s ALA 111 N -4.17 3.40 0.00 1.67 0.00 -0.48 -2.04 121.76 120.14 2vml s ALA 111 Ca -0.13 0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.31 2vml s ALA 111 Cb 0.07 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2vml s ALA 111 CO 0.82 -1.72 0.00 0.41 0.00 0.00 0.00 175.76 175.26 2vml n GLY 112 N 4.37 0.73 0.32 0.00 0.00 -1.26 -4.86 105.19 104.48 2vml n GLY 112 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.86 -0.42 0.99 5.85 -1.49 -1.10 115.31 118.27 2vml h LEU 113 Ca 0.00 0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.69 2vml h LEU 113 Cb 0.00 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2vml h LEU 113 CO 0.00 -0.39 -0.23 0.03 -0.34 0.00 0.00 178.44 177.51 2vml h ARG 114 N -0.52 0.90 -0.41 1.25 3.08 -1.91 -0.60 114.38 116.18 2vml h ARG 114 Ca 0.03 -0.41 0.04 0.00 0.07 0.00 0.00 59.98 59.72 2vml h ARG 114 Cb 0.55 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 2vml h ARG 114 CO -0.18 1.06 0.17 1.49 -1.07 0.00 0.00 179.97 181.44 2vml h GLU 115 N 0.73 0.35 0.02 0.04 4.81 -1.94 -1.11 114.58 117.47 2vml h GLU 115 Ca 0.09 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2vml h GLU 115 Cb 0.80 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.11 2vml h GLU 115 CO 0.07 0.23 -0.01 0.28 -0.73 0.00 0.00 179.01 178.85 2vml h VAL 116 N 0.36 1.19 -0.20 0.32 2.07 -1.11 -2.72 116.25 116.16 2vml h VAL 116 Ca 0.19 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 67.00 2vml h VAL 116 Cb 0.14 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2vml h VAL 116 CO -0.16 0.17 -0.07 0.78 0.02 0.00 0.00 177.57 178.31 2vml h ASN 117 N -0.32 0.28 -0.18 0.57 2.35 -1.08 -1.90 115.58 115.30 2vml h ASN 117 Ca -0.00 -0.05 -0.06 0.00 -0.55 0.00 0.00 56.30 55.64 2vml h ASN 117 Cb 0.30 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 2vml h ASN 117 CO 0.00 0.38 -0.10 -0.09 -1.65 0.00 0.00 177.43 175.98 2vml h ARG 118 N 0.29 0.39 -0.61 0.81 2.43 -1.22 0.25 114.38 116.72 2vml h ARG 118 Ca 0.06 -0.18 -0.10 0.00 -0.81 0.00 0.00 59.98 58.96 2vml h ARG 118 Cb 0.30 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 2vml h ARG 118 CO 0.01 0.70 0.01 1.15 -1.51 0.00 0.00 179.97 180.34 2vml h THR 119 N 0.07 1.27 -0.47 0.20 2.02 -1.22 -3.01 112.91 111.76 2vml h THR 119 Ca 0.04 -1.14 0.00 0.00 0.77 0.00 0.00 66.41 66.07 2vml h THR 119 Cb 0.60 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 2vml h THR 119 CO 0.03 0.42 0.00 0.49 0.37 0.00 0.00 175.52 176.83 2vml n PHE 120 N -4.19 0.62 -3.68 3.16 3.72 -0.74 -4.95 117.46 111.40 2vml n PHE 120 Ca 0.03 -0.31 -0.23 0.00 -0.05 0.00 0.00 57.45 56.89 2vml n PHE 120 Cb 0.34 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.93 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 1.03 -2.92 -4.57 4.37 3.02 -0.52 -4.98 115.26 110.70 2vml n ASN 121 Ca 0.18 -0.73 -0.38 0.00 -0.03 0.00 0.00 54.58 53.62 2vml n ASN 121 Cb 0.46 -4.38 -0.11 0.00 -0.61 0.00 0.00 39.78 35.14 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 -6.84 3.94 -0.11 3.41 1.43 0.76 -5.03 118.68 116.23 2vml s LEU 122 Ca 0.24 -0.03 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 2vml s LEU 122 Cb -0.11 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 2vml s LEU 122 CO 0.79 -0.04 1.00 -0.44 0.23 0.00 0.00 176.35 177.89 2vml s SER 123 N 1.68 7.23 0.41 2.29 0.01 -1.26 -4.61 113.70 119.45 2vml s SER 123 Ca 0.07 1.52 0.14 0.00 1.31 0.00 0.00 55.95 58.98 2vml s SER 123 Cb -0.16 -2.55 0.99 0.00 0.21 0.00 0.00 66.02 64.52 2vml s SER 123 CO 0.09 -0.45 1.92 1.55 0.41 0.00 0.00 173.24 176.76 2vml h PRO 124 N 7.12 0.46 -0.51 12.44 0.13 -1.96 -2.27 132.00 147.42 2vml h PRO 124 Ca -0.30 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 64.88 2vml h PRO 124 Cb 1.14 -0.10 -0.08 0.00 0.13 0.00 0.00 31.00 32.08 2vml h PRO 124 CO 0.86 0.31 -0.18 0.45 -0.23 0.00 0.00 178.00 179.20 2vml n SER 125 N -4.49 -0.30 -0.09 1.44 2.88 -1.26 -0.37 113.62 111.44 2vml n SER 125 Ca 0.14 0.89 -0.12 0.00 -1.33 0.00 0.00 58.87 58.45 2vml n SER 125 Cb 0.49 -0.22 -0.04 0.00 -0.75 0.00 0.00 64.21 63.69 2vml n SER 125 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 2vml h TRP 126 N 0.00 0.54 -0.35 0.66 6.55 -1.81 -2.29 115.95 119.25 2vml h TRP 126 Ca 0.19 -0.11 -0.17 0.00 0.95 0.00 0.00 58.89 59.75 2vml h TRP 126 Cb 0.32 -0.13 -0.00 0.00 -0.86 0.00 0.00 29.16 28.48 2vml h TRP 126 CO -0.44 0.69 -0.45 1.88 -1.05 0.00 0.00 178.44 179.07 2vml h TYR 127 N 0.24 1.13 -0.45 0.49 0.05 -1.42 -1.20 116.97 115.81 2vml h TYR 127 Ca 0.07 -0.36 0.05 0.00 0.05 0.00 0.00 58.73 58.53 2vml h TYR 127 Cb 0.50 -0.23 -0.05 0.00 1.01 0.00 0.00 36.73 37.97 2vml h TYR 127 CO 0.05 1.20 0.18 0.82 -1.05 0.00 0.00 178.16 179.36 2vml h ILE 128 N 0.73 0.89 -0.48 -2.88 2.04 -0.71 -1.03 117.51 116.07 2vml h ILE 128 Ca 0.04 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 2vml h ILE 128 Cb 1.06 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2vml h ILE 128 CO 0.11 0.07 0.14 -0.08 0.00 0.00 0.00 178.15 178.38 2vml h GLU 129 N 0.37 0.76 -0.87 2.37 4.57 -1.29 -0.42 114.58 120.08 2vml h GLU 129 Ca 0.21 -0.17 0.06 0.00 -1.18 0.00 0.00 59.36 58.27 2vml h GLU 129 Cb 0.18 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 28.60 2vml h GLU 129 CO -0.19 0.73 0.55 0.00 -1.18 0.00 0.00 179.01 178.92 2vml h ALA 130 N 1.00 1.20 -0.22 2.92 0.00 -0.97 -1.38 119.26 121.81 2vml h ALA 130 Ca 0.15 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 2vml h ALA 130 Cb 0.30 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2vml h ALA 130 CO -0.00 0.30 -0.64 -0.07 0.00 0.00 0.00 179.25 178.84 2vml h LEU 131 N 1.00 0.88 -0.82 0.00 3.38 -0.81 -1.88 115.31 117.07 2vml h LEU 131 Ca 0.38 -0.52 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 2vml h LEU 131 Cb 0.16 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 2vml h LEU 131 CO -0.17 1.30 0.40 0.11 0.09 0.00 0.00 178.44 180.17 2vml h LYS 132 N 0.57 1.17 -0.10 1.13 1.57 -0.88 -0.22 116.57 119.80 2vml h LYS 132 Ca -0.01 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2vml h LYS 132 Cb 1.24 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 2vml h LYS 132 CO 0.13 0.90 0.06 1.25 -0.57 0.00 0.00 179.45 181.22 2vml h HIS 133 N 1.16 0.14 -0.84 -1.35 2.76 -1.14 -1.39 115.15 114.48 2vml h HIS 133 Ca 0.28 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.52 2vml h HIS 133 Cb 0.10 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 28.95 2vml h HIS 133 CO 0.01 0.13 0.51 0.82 -1.30 0.00 0.00 177.93 178.10 2vml h ILE 134 N 0.11 1.01 -0.47 6.26 2.04 -1.16 -2.22 117.51 123.07 2vml h ILE 134 Ca 0.04 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.59 2vml h ILE 134 Cb 0.03 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.10 2vml h ILE 134 CO -0.01 0.17 0.31 0.50 0.00 0.00 0.00 178.15 179.12 2vml h LYS 135 N 0.92 0.61 -0.50 2.37 3.64 -0.84 0.15 116.57 122.92 2vml h LYS 135 Ca 0.38 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.80 2vml h LYS 135 Cb 0.22 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 31.84 2vml h LYS 135 CO -0.19 0.40 0.15 0.78 -2.27 0.00 0.00 179.45 178.32 2vml h GLY 136 N 0.63 0.64 1.02 5.01 0.00 -0.88 -2.09 103.07 107.40 2vml h GLY 136 Ca 0.18 -0.07 -0.14 0.00 0.00 0.00 0.00 47.33 47.29 2vml h GLY 136 CO -0.05 -0.02 -0.39 0.50 0.00 0.00 0.00 176.54 176.58 2vml h LYS 137 N 0.30 0.75 -0.12 4.80 1.79 -0.98 -2.99 116.57 120.13 2vml h LYS 137 Ca 0.24 -0.44 -0.02 0.00 -2.18 0.00 0.00 60.65 58.25 2vml h LYS 137 Cb 0.29 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.97 2vml h LYS 137 CO -0.28 1.07 -0.03 0.28 -1.08 0.00 0.00 179.45 179.41 2vml h VAL 138 N 0.50 1.10 -0.03 0.50 2.07 -0.90 -2.47 116.25 117.03 2vml h VAL 138 Ca 0.03 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.15 2vml h VAL 138 Cb 0.98 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2vml h VAL 138 CO 0.09 0.13 0.06 1.23 0.02 0.00 0.00 177.57 179.11 2vml h GLY 139 N 0.44 0.00 0.14 2.17 0.00 -1.22 -0.33 103.07 104.28 2vml h GLY 139 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 2vml h GLY 139 CO 0.01 0.00 -0.88 1.44 0.00 0.00 0.00 176.54 177.11 2vml n SER 140 N -3.38 0.96 -0.05 0.19 7.64 -0.93 -4.45 113.62 113.60 2vml n SER 140 Ca -0.02 -0.89 -0.10 0.00 1.01 0.00 0.00 58.87 58.87 2vml n SER 140 Cb 0.14 0.83 -0.15 0.00 -1.01 0.00 0.00 64.21 64.02 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 -1.42 0.66 -4.27 1.43 6.02 -0.24 -4.99 117.38 114.57 2vml n GLN 141 Ca 0.05 0.19 -0.17 0.00 -0.01 0.00 0.00 57.00 57.06 2vml n GLN 141 Cb 0.34 -1.69 -0.10 0.00 1.02 0.00 0.00 30.24 29.80 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 -5.93 2.49 0.31 1.08 1.43 -0.59 -5.08 118.68 112.39 2vml s LEU 142 Ca -0.08 -0.94 0.01 0.00 -1.03 0.00 0.00 54.13 52.09 2vml s LEU 142 Cb 0.07 -0.50 -0.02 0.00 0.03 0.00 0.00 46.19 45.77 2vml s LEU 142 CO 0.82 -0.22 0.34 -0.94 0.23 0.00 0.00 176.35 176.57 2vml s SER 143 N -2.94 1.02 0.98 2.29 1.04 -1.26 -4.71 113.70 110.12 2vml s SER 143 Ca 0.15 -1.54 0.00 0.00 0.48 0.00 0.00 55.95 55.04 2vml s SER 143 Cb -0.01 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2vml s SER 143 CO 0.03 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.75 2vml n GLY 144 N -0.52 2.01 0.19 7.32 0.00 -1.26 -2.67 105.19 110.26 2vml n GLY 144 Ca 0.04 -0.48 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 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 0.28 -0.75 1.61 1.08 -1.98 -1.77 115.11 113.57 2vml h GLN 145 Ca 0.00 -0.16 0.12 0.00 -1.45 0.00 0.00 58.65 57.16 2vml h GLN 145 Cb 0.00 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.36 2vml h GLN 145 CO 0.00 0.71 0.35 -1.35 -0.95 0.00 0.00 178.83 177.59 2vml h PRO 146 N 0.22 0.53 -0.37 1.46 0.11 -1.73 -0.67 132.00 131.55 2vml h PRO 146 Ca 0.01 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 2vml h PRO 146 Cb 0.95 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.92 2vml h PRO 146 CO 0.08 0.35 0.22 1.25 -0.21 0.00 0.00 178.00 179.69 2vml h LEU 147 N 0.55 0.44 -1.10 2.35 5.85 -1.20 -1.63 115.31 120.56 2vml h LEU 147 Ca 0.39 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 59.07 2vml h LEU 147 Cb 0.51 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 2vml h LEU 147 CO -0.33 0.37 0.61 0.74 -0.34 0.00 0.00 178.44 179.48 2vml h THR 148 N 0.48 1.23 0.27 1.05 2.02 -1.05 0.26 112.91 117.16 2vml h THR 148 Ca 0.13 -0.42 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 2vml h THR 148 Cb 0.01 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.30 2vml h THR 148 CO -0.02 0.23 -0.13 -0.33 0.37 0.00 0.00 175.52 175.63 2vml h GLU 149 N 1.23 -0.34 -0.13 6.66 4.39 -1.00 -2.32 114.58 123.07 2vml h GLU 149 Ca 0.34 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.08 2vml h GLU 149 Cb -0.12 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 2vml h GLU 149 CO -0.08 -0.17 0.01 0.00 -1.16 0.00 0.00 179.01 177.61 2vml h ALA 150 N 0.27 0.12 -0.86 3.43 0.00 -0.96 -2.70 119.26 118.55 2vml h ALA 150 Ca -0.04 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2vml h ALA 150 Cb 0.34 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2vml h ALA 150 CO 0.06 -0.45 0.56 -0.91 0.00 0.00 0.00 179.25 178.52 2vml h ASN 151 N 0.05 0.90 -0.22 0.00 2.35 -1.00 -1.71 115.58 115.96 2vml h ASN 151 Ca 0.06 -0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 2vml h ASN 151 Cb 0.07 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2vml h ASN 151 CO -0.10 0.60 0.10 0.00 -1.65 0.00 0.00 177.43 176.38 2vml h ALA 152 N 1.51 0.26 -0.04 -0.83 0.00 -1.09 0.26 119.26 119.33 2vml h ALA 152 Ca 0.35 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 55.08 2vml h ALA 152 Cb 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2vml h ALA 152 CO -0.12 -0.31 -0.81 1.88 0.00 0.00 0.00 179.25 179.89 2vml h TYR 153 N 0.22 0.49 -0.20 0.00 0.05 -1.31 -0.70 116.97 115.52 2vml h TYR 153 Ca 0.09 -0.24 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 2vml h TYR 153 Cb 0.03 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 2vml h TYR 153 CO -0.10 1.02 0.10 0.82 -1.05 0.00 0.00 178.16 178.95 2vml h ILE 154 N 0.22 1.12 -0.30 -2.88 2.04 -1.21 -2.62 117.51 113.87 2vml h ILE 154 Ca -0.05 -0.33 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 2vml h ILE 154 Cb 1.41 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2vml h ILE 154 CO 0.14 0.11 -0.09 0.44 0.00 0.00 0.00 178.15 178.75 2vml h ASP 155 N 0.20 0.48 -0.40 1.72 3.32 -0.91 -1.93 116.42 118.91 2vml h ASP 155 Ca 0.07 -0.12 0.06 0.00 0.02 0.00 0.00 57.03 57.07 2vml h ASP 155 Cb 0.09 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 2vml h ASP 155 CO -0.01 0.62 0.07 0.22 -1.72 0.00 0.00 179.24 178.42 2vml h TYR 156 N 0.47 0.11 -0.34 4.55 3.20 -0.97 -0.59 116.97 123.40 2vml h TYR 156 Ca 0.09 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 2vml h TYR 156 Cb 0.45 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 2vml h TYR 156 CO 0.01 0.00 0.14 0.00 -1.64 0.00 0.00 178.16 176.68 2vml h ILE 158 N 0.41 1.07 -0.67 0.00 2.04 -1.14 -1.64 117.51 117.57 2vml h ILE 158 Ca 0.11 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.63 2vml h ILE 158 Cb 0.17 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 2vml h ILE 158 CO -0.01 0.15 0.16 0.78 0.00 0.00 0.00 178.15 179.22 2vml h ASN 159 N 0.82 1.03 0.12 1.72 2.35 -0.89 -2.72 115.58 118.00 2vml h ASN 159 Ca 0.28 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 2vml h ASN 159 Cb 0.06 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.15 2vml h ASN 159 CO -0.12 1.00 -0.10 0.00 -1.65 0.00 0.00 177.43 176.56 2vml h ALA 160 N 1.07 1.72 -0.00 -0.83 0.00 -0.73 -2.51 119.26 117.98 2vml h ALA 160 Ca 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2vml h ALA 160 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2vml h ALA 160 CO 0.00 0.12 -0.27 1.28 0.00 0.00 0.00 179.25 180.39 2vml n LEU 161 N -4.25 0.68 -0.95 0.00 4.77 -0.65 -4.99 117.00 111.61 2vml n LEU 161 Ca -0.03 -0.07 0.12 0.00 -0.03 0.00 0.00 56.01 56.00 2vml n LEU 161 Cb 0.18 -0.20 0.10 0.00 -2.33 0.00 0.00 43.42 41.17 2vml n LEU 161 CO 0.34 0.13 0.62 -1.20 -1.33 0.00 0.00 177.39 175.96