#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 4.01 0.25 2.12 2.20 -1.26 -4.75 119.74 122.31 2vml s LYS 2 Ca 0.00 1.51 0.01 0.00 -0.36 0.00 0.00 55.97 57.13 2vml s LYS 2 Cb 0.00 -3.88 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2vml s LYS 2 CO 0.00 -1.00 0.14 0.95 -0.36 0.00 0.00 175.35 175.08 2vml s THR 3 N 4.22 0.22 0.27 3.43 -4.23 -1.26 -1.44 115.64 116.85 2vml s THR 3 Ca 0.59 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 59.09 2vml s THR 3 Cb -0.21 -2.54 0.27 0.00 1.34 0.00 0.00 72.50 71.36 2vml s THR 3 CO 0.22 0.00 1.86 0.58 -0.54 0.00 0.00 174.62 176.74 2vml h VAL 4 N 2.43 1.03 -0.13 2.29 2.07 -1.71 -0.92 116.25 121.32 2vml h VAL 4 Ca -0.35 -0.38 -0.14 0.00 0.82 0.00 0.00 66.70 66.65 2vml h VAL 4 Cb 1.25 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 2vml h VAL 4 CO 0.54 0.20 -0.46 0.40 0.02 0.00 0.00 177.57 178.26 2vml h ILE 5 N 1.10 1.35 -0.33 4.57 2.04 -1.91 -1.27 117.51 123.07 2vml h ILE 5 Ca 0.44 -1.75 -0.08 0.00 1.00 0.00 0.00 64.86 64.47 2vml h ILE 5 Cb 0.26 2.09 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 2vml h ILE 5 CO -0.20 0.53 -0.15 0.71 0.00 0.00 0.00 178.15 179.05 2vml h THR 6 N 0.17 1.25 -0.18 -0.27 1.35 -1.82 -2.42 112.91 110.98 2vml h THR 6 Ca -0.02 -1.12 -0.03 0.00 -0.55 0.00 0.00 66.41 64.70 2vml h THR 6 Cb 1.09 1.16 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 2vml h THR 6 CO 0.10 0.37 0.02 -0.08 -0.25 0.00 0.00 175.52 175.67 2vml h GLU 7 N 0.53 0.31 -0.17 4.72 4.81 -1.00 -0.18 114.58 123.60 2vml h GLU 7 Ca 0.09 -0.09 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2vml h GLU 7 Cb 0.56 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2vml h GLU 7 CO 0.04 0.50 -0.35 -0.39 -0.73 0.00 0.00 179.01 178.08 2vml h VAL 8 N 0.09 1.29 -0.25 0.32 -1.51 -1.21 -1.62 116.25 113.35 2vml h VAL 8 Ca 0.05 -1.41 -0.04 0.00 -1.23 0.00 0.00 66.70 64.08 2vml h VAL 8 Cb 0.35 1.55 -0.01 0.00 -2.13 0.00 0.00 31.29 31.04 2vml h VAL 8 CO 0.01 0.43 0.01 0.40 -1.23 0.00 0.00 177.57 177.18 2vml h ILE 9 N 0.30 1.25 -0.97 7.19 2.04 -1.34 -1.82 117.51 124.17 2vml h ILE 9 Ca 0.03 -0.89 0.11 0.00 1.00 0.00 0.00 64.86 65.11 2vml h ILE 9 Cb 0.76 1.34 -0.08 0.00 -0.74 0.00 0.00 36.82 38.10 2vml h ILE 9 CO 0.06 0.28 0.60 0.00 0.00 0.00 0.00 178.15 179.09 2vml h ALA 10 N 0.82 1.42 0.53 1.87 0.00 -0.87 0.78 119.26 123.81 2vml h ALA 10 Ca 0.07 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2vml h ALA 10 Cb 0.40 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.99 2vml h ALA 10 CO 0.01 0.24 -0.26 1.03 0.00 0.00 0.00 179.25 180.28 2vml h SER 11 N 0.99 -0.60 -0.67 0.00 0.87 -1.12 0.02 113.55 113.04 2vml h SER 11 Ca 0.47 -0.02 0.01 0.00 -1.23 0.00 0.00 61.79 61.01 2vml h SER 11 Cb 0.40 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 2vml h SER 11 CO -0.25 -0.36 0.44 0.00 -0.53 0.00 0.00 176.83 176.14 2vml h ALA 12 N -0.40 0.86 -0.70 6.23 0.00 -1.13 -2.97 119.26 121.15 2vml h ALA 12 Ca -0.07 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2vml h ALA 12 Cb 0.59 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2vml h ALA 12 CO 0.12 0.27 0.17 0.22 0.00 0.00 0.00 179.25 180.02 2vml h ASP 13 N 0.90 1.06 -0.00 0.00 3.58 -0.79 -0.97 116.42 120.21 2vml h ASP 13 Ca 0.25 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2vml h ASP 13 Cb -0.09 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.68 2vml h ASP 13 CO -0.06 1.02 0.00 0.77 -2.88 0.00 0.00 179.24 178.09 2vml h SER 14 N 1.05 0.00 -0.38 2.28 4.64 -0.83 -1.79 113.55 118.53 2vml h SER 14 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2vml h SER 14 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2vml h SER 14 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2vml n GLN 15 N -3.48 2.37 -3.09 4.77 6.02 -0.88 -4.98 117.38 118.11 2vml n GLN 15 Ca -0.03 -2.16 -0.17 0.00 -0.01 0.00 0.00 57.00 54.63 2vml n GLN 15 Cb 0.08 -1.44 0.04 0.00 1.02 0.00 0.00 30.24 29.94 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 1.23 -0.19 3.17 1.08 0.00 -0.67 -4.99 105.19 104.82 2vml n GLY 16 Ca 0.17 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 1.40 0.55 1.61 3.52 -0.42 -5.02 118.95 114.88 2vml s ARG 17 Ca 0.34 -0.65 -0.21 0.00 -0.13 0.00 0.00 55.73 55.08 2vml s ARG 17 Cb -0.15 -1.37 -0.05 0.00 -1.56 0.00 0.00 34.95 31.83 2vml s ARG 17 CO 0.42 0.37 1.29 -0.06 -0.81 0.00 0.00 175.30 176.51 2vml s PHE 18 N -0.45 2.37 0.25 5.12 0.08 -1.26 -4.25 117.98 119.85 2vml s PHE 18 Ca 0.07 1.44 -0.31 0.00 0.12 0.00 0.00 56.93 58.25 2vml s PHE 18 Cb -0.07 -3.66 -0.12 0.00 -0.57 0.00 0.00 43.02 38.60 2vml s PHE 18 CO -0.00 -2.54 1.63 1.28 -0.10 0.00 0.00 175.22 175.48 2vml n LEU 19 N -1.16 4.09 0.00 -0.37 4.77 -1.26 -4.97 117.00 118.11 2vml n LEU 19 Ca 0.11 1.11 -0.03 0.00 -0.03 0.00 0.00 56.01 57.18 2vml n LEU 19 Cb 0.47 -1.57 -0.01 0.00 -2.33 0.00 0.00 43.42 39.98 2vml n LEU 19 CO 0.50 0.10 -0.02 -0.46 -1.33 0.00 0.00 177.39 176.17 2vml n ASN 20 N 2.83 1.84 0.24 -1.43 0.23 -1.26 -4.99 115.26 112.73 2vml n ASN 20 Ca 0.12 -1.20 0.13 0.00 -0.53 0.00 0.00 54.58 53.10 2vml n ASN 20 Cb 0.35 0.05 0.77 0.00 -2.08 0.00 0.00 39.78 38.87 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 0.12 0.00 -0.04 0.53 -0.73 -1.99 -0.89 115.58 112.58 2vml h ASN 21 Ca -0.04 0.00 0.03 0.00 1.87 0.00 0.00 56.30 58.17 2vml h ASN 21 Cb 0.11 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.66 2vml h ASN 21 CO 0.06 0.00 -0.19 0.74 -0.37 0.00 0.00 177.43 177.67 2vml h THR 22 N 0.00 0.55 0.02 -3.57 2.02 -2.00 -2.04 112.91 107.88 2vml h THR 22 Ca 0.04 0.00 -0.21 0.00 0.77 0.00 0.00 66.41 67.01 2vml h THR 22 Cb 0.17 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 2vml h THR 22 CO -0.00 0.00 -0.93 -0.33 0.37 0.00 0.00 175.52 174.63 2vml h GLU 23 N -0.28 0.18 -0.38 6.66 3.07 -1.58 -3.05 114.58 119.19 2vml h GLU 23 Ca 0.07 -0.22 -0.12 0.00 -0.50 0.00 0.00 59.36 58.59 2vml h GLU 23 Cb 0.38 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 2vml h GLU 23 CO -0.20 0.98 -0.23 -0.07 -1.40 0.00 0.00 179.01 178.09 2vml h LEU 24 N 0.09 0.78 -0.45 1.33 3.38 -1.28 -1.16 115.31 118.01 2vml h LEU 24 Ca -0.05 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2vml h LEU 24 Cb 1.58 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 2vml h LEU 24 CO 0.14 0.99 0.22 1.56 0.09 0.00 0.00 178.44 181.44 2vml h GLN 25 N 0.67 0.65 -0.11 1.13 4.20 -1.40 -0.47 115.11 119.78 2vml h GLN 25 Ca 0.09 -0.09 0.04 0.00 0.06 0.00 0.00 58.65 58.75 2vml h GLN 25 Cb 0.74 -0.12 -0.06 0.00 0.30 0.00 0.00 27.48 28.35 2vml h GLN 25 CO 0.06 0.55 -0.25 0.00 -0.67 0.00 0.00 178.83 178.52 2vml h ALA 26 N 1.06 -0.24 -0.83 3.87 0.00 -1.41 -2.38 119.26 119.34 2vml h ALA 26 Ca 0.16 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.20 2vml h ALA 26 Cb 0.11 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.30 2vml h ALA 26 CO -0.02 -0.71 0.46 0.00 0.00 0.00 0.00 179.25 178.98 2vml h ALA 27 N 0.61 1.20 -0.98 0.00 0.00 -0.98 -0.25 119.26 118.86 2vml h ALA 27 Ca 0.10 0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.16 2vml h ALA 27 Cb 0.46 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.07 2vml h ALA 27 CO -0.30 0.05 0.62 -0.97 0.00 0.00 0.00 179.25 178.65 2vml h ASN 28 N 0.75 0.89 -0.94 0.00 -1.24 -0.78 -1.95 115.58 112.32 2vml h ASN 28 Ca 0.41 0.04 0.02 0.00 0.71 0.00 0.00 56.30 57.49 2vml h ASN 28 Cb 0.43 -0.14 -0.05 0.00 0.73 0.00 0.00 38.32 39.29 2vml h ASN 28 CO -0.27 0.49 0.62 1.23 -1.29 0.00 0.00 177.43 178.20 2vml h GLY 29 N 0.97 1.35 0.83 1.57 0.00 -0.53 0.21 103.07 107.46 2vml h GLY 29 Ca 0.47 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 47.34 2vml h GLY 29 CO -0.24 0.44 -0.04 -0.09 0.00 0.00 0.00 176.54 176.61 2vml h ARG 30 N 1.22 -0.04 -0.33 4.80 1.12 -1.23 -2.48 114.38 117.44 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 29.89 2vml h ARG 30 CO -0.10 -0.03 -0.33 0.74 -3.11 0.00 0.00 179.97 177.15 2vml h PHE 31 N -0.04 0.85 -0.05 2.20 0.04 -0.85 -2.48 116.94 116.61 2vml h PHE 31 Ca 0.03 -0.23 -0.09 0.00 2.80 0.00 0.00 57.97 60.49 2vml h PHE 31 Cb 0.09 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 2vml h PHE 31 CO -0.14 0.96 -0.40 0.37 -0.60 0.00 0.00 178.31 178.50 2vml h GLN 32 N 0.61 0.10 0.00 1.51 4.15 -1.00 -3.02 115.11 117.46 2vml h GLN 32 Ca 0.07 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2vml h GLN 32 Cb 0.85 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.54 2vml h GLN 32 CO 0.07 0.48 -0.24 -0.09 -1.93 0.00 0.00 178.83 177.13 2vml h ARG 33 N 0.08 0.00 -0.97 1.69 9.65 -1.17 -3.38 114.38 120.28 2vml h ARG 33 Ca 0.01 0.00 0.19 0.00 -1.10 0.00 0.00 59.98 59.07 2vml h ARG 33 Cb 0.74 0.00 -0.11 0.00 -1.39 0.00 0.00 29.97 29.22 2vml h ARG 33 CO 0.06 0.00 0.57 0.00 2.80 0.00 0.00 179.97 183.40 2vml h ALA 34 N 2.15 1.60 -0.11 2.80 0.00 -1.32 -1.84 119.26 122.54 2vml h ALA 34 Ca 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2vml h ALA 34 Cb 0.93 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2vml h ALA 34 CO 0.00 -0.07 0.05 1.15 0.00 0.00 0.00 179.25 180.38 2vml h THR 35 N 0.72 1.12 -0.71 0.00 2.02 -1.78 0.20 112.91 114.47 2vml h THR 35 Ca 0.56 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 2vml h THR 35 Cb 0.87 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 2vml h THR 35 CO -0.39 0.11 0.41 0.00 0.37 0.00 0.00 175.52 176.02 2vml h ALA 36 N 0.92 0.91 -0.67 6.16 0.00 -1.75 -2.18 119.26 122.66 2vml h ALA 36 Ca 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2vml h ALA 36 Cb 0.13 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2vml h ALA 36 CO -0.00 0.41 0.28 0.77 0.00 0.00 0.00 179.25 180.70 2vml h SER 37 N 0.98 0.91 0.41 0.00 0.02 -1.05 -2.24 113.55 112.57 2vml h SER 37 Ca 0.25 -0.16 -0.17 0.00 -0.84 0.00 0.00 61.79 60.88 2vml h SER 37 Cb 0.00 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2vml h SER 37 CO -0.04 0.82 -0.70 0.24 -1.14 0.00 0.00 176.83 176.01 2vml h MET 38 N 0.94 0.25 -0.74 3.45 2.86 -0.48 -1.33 114.93 119.87 2vml h MET 38 Ca 0.22 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 2vml h MET 38 Cb 0.18 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 2vml h MET 38 CO -0.02 0.85 0.32 1.49 1.06 0.00 0.00 176.91 180.61 2vml h GLU 39 N 0.17 1.09 -0.13 1.72 4.81 -1.33 -0.79 114.58 120.11 2vml h GLU 39 Ca -0.02 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 2vml h GLU 39 Cb 1.25 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2vml h GLU 39 CO 0.11 0.87 0.05 0.00 -0.73 0.00 0.00 179.01 179.31 2vml h ALA 40 N 1.16 0.17 -0.53 2.92 0.00 -1.17 -2.83 119.26 118.98 2vml h ALA 40 Ca 0.25 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.10 2vml h ALA 40 Cb 0.17 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2vml h ALA 40 CO -0.03 -0.24 0.28 0.00 0.00 0.00 0.00 179.25 179.26 2vml h ALA 41 N 0.89 0.68 -1.01 0.00 0.00 -1.05 -1.84 119.26 116.93 2vml h ALA 41 Ca 0.04 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2vml h ALA 41 Cb 0.17 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 2vml h ALA 41 CO -0.00 -0.05 0.66 0.00 0.00 0.00 0.00 179.25 179.86 2vml h ARG 42 N 0.54 1.27 -0.18 0.00 3.08 -1.14 0.04 114.38 117.99 2vml h ARG 42 Ca 0.23 -0.08 -0.20 0.00 0.07 0.00 0.00 59.98 60.01 2vml h ARG 42 Cb 0.12 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2vml h ARG 42 CO -0.15 0.84 -0.68 0.00 -1.07 0.00 0.00 179.97 178.91 2vml h ALA 43 N 1.40 0.46 -0.17 0.04 0.00 -1.19 -1.94 119.26 117.86 2vml h ALA 43 Ca 0.39 -0.57 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 2vml h ALA 43 Cb -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2vml h ALA 43 CO -0.11 0.70 -0.51 -0.07 0.00 0.00 0.00 179.25 179.25 2vml h LEU 44 N 0.51 0.51 -0.15 0.00 4.07 -1.08 -2.56 115.31 116.61 2vml h LEU 44 Ca -0.02 -0.26 -0.04 0.00 0.08 0.00 0.00 57.88 57.64 2vml h LEU 44 Cb 1.28 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 42.87 2vml h LEU 44 CO 0.14 0.93 -0.05 0.74 -1.08 0.00 0.00 178.44 179.12 2vml h THR 45 N 0.36 1.30 0.00 0.22 2.02 -0.99 -2.67 112.91 113.16 2vml h THR 45 Ca 0.01 -1.04 -0.08 0.00 0.77 0.00 0.00 66.41 66.07 2vml h THR 45 Cb 1.02 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 2vml h THR 45 CO 0.09 0.30 -0.40 0.77 0.37 0.00 0.00 175.52 176.65 2vml h SER 46 N -0.01 0.00 -0.62 4.18 4.64 -1.37 -2.92 113.55 117.45 2vml h SER 46 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2vml h SER 46 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2vml h SER 46 CO 0.02 0.40 0.00 0.59 -0.87 0.00 0.00 176.83 176.97 2vml n ASN 47 N -3.50 4.63 -0.08 4.97 5.03 -0.97 -4.70 115.26 120.64 2vml n ASN 47 Ca -0.00 -2.46 -0.10 0.00 0.87 0.00 0.00 54.58 52.89 2vml n ASN 47 Cb 0.54 -0.58 -0.03 0.00 -1.02 0.00 0.00 39.78 38.70 2vml n ASN 47 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vml h ALA 48 N 4.07 0.35 -0.20 5.41 0.00 -1.27 -0.09 119.26 127.53 2vml h ALA 48 Ca 0.00 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.88 2vml h ALA 48 Cb 1.44 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 2vml h ALA 48 CO 0.24 -0.13 0.03 -0.44 0.00 0.00 0.00 179.25 178.95 2vml h ASP 49 N 0.33 -0.02 0.72 0.00 3.32 -1.84 -0.13 116.42 118.81 2vml h ASP 49 Ca 0.10 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.04 2vml h ASP 49 Cb 0.04 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2vml h ASP 49 CO -0.02 0.02 -0.68 0.77 -1.72 0.00 0.00 179.24 177.62 2vml h SER 50 N 0.10 0.00 -0.33 6.45 4.64 -1.87 -0.89 113.55 121.65 2vml h SER 50 Ca 0.09 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.35 2vml h SER 50 Cb 0.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2vml h SER 50 CO -0.13 0.68 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.39 2vml h LEU 51 N 0.00 0.61 0.23 5.97 3.38 -0.72 -2.14 115.31 122.64 2vml h LEU 51 Ca -0.01 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 2vml h LEU 51 Cb 1.22 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vml h LEU 51 CO 0.09 0.81 -0.11 0.58 0.09 0.00 0.00 178.44 179.90 2vml h VAL 52 N 0.40 0.84 -0.46 1.22 2.07 -0.95 -2.33 116.25 117.03 2vml h VAL 52 Ca 0.09 -0.39 0.09 0.00 0.82 0.00 0.00 66.70 67.30 2vml h VAL 52 Cb 0.53 1.07 -0.07 0.00 -1.52 0.00 0.00 31.29 31.29 2vml h VAL 52 CO 0.03 0.09 0.03 0.11 0.02 0.00 0.00 177.57 177.84 2vml h LYS 53 N -0.50 0.14 -0.37 1.57 1.57 -1.18 -1.77 116.57 116.03 2vml h LYS 53 Ca -0.03 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2vml h LYS 53 Cb 0.38 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2vml h LYS 53 CO 0.05 0.09 -0.16 0.78 -0.57 0.00 0.00 179.45 179.64 2vml h GLY 54 N 0.14 0.73 0.85 3.86 0.00 -1.45 -2.23 103.07 104.98 2vml h GLY 54 Ca 0.23 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2vml h GLY 54 CO -0.36 0.52 0.01 0.00 0.00 0.00 0.00 176.54 176.71 2vml h ALA 55 N 1.21 0.33 -0.20 3.60 0.00 -0.96 -0.84 119.26 122.40 2vml h ALA 55 Ca 0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2vml h ALA 55 Cb 0.62 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2vml h ALA 55 CO 0.04 0.05 0.12 0.28 0.00 0.00 0.00 179.25 179.74 2vml h VAL 56 N 0.21 1.09 -0.09 0.00 2.07 -1.31 -2.10 116.25 116.12 2vml h VAL 56 Ca 0.07 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 2vml h VAL 56 Cb 0.40 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 2vml h VAL 56 CO 0.01 0.08 -0.07 -0.61 0.02 0.00 0.00 177.57 177.01 2vml h GLN 57 N 0.24 0.14 -0.07 1.57 5.75 -1.35 -2.65 115.11 118.73 2vml h GLN 57 Ca 0.07 -0.02 -0.13 0.00 -0.15 0.00 0.00 58.65 58.42 2vml h GLN 57 Cb 0.03 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 2vml h GLN 57 CO -0.01 0.22 -0.53 1.49 -2.65 0.00 0.00 178.83 177.35 2vml h GLU 58 N 0.13 0.21 -0.22 1.69 4.57 -0.78 -1.17 114.58 119.01 2vml h GLU 58 Ca 0.03 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2vml h GLU 58 Cb 0.21 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 2vml h GLU 58 CO 0.01 0.69 0.13 0.28 -1.18 0.00 0.00 179.01 178.94 2vml h VAL 59 N 0.16 1.03 -0.00 0.32 2.07 -1.04 -0.62 116.25 118.17 2vml h VAL 59 Ca 0.00 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 2vml h VAL 59 Cb 0.99 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 2vml h VAL 59 CO 0.08 0.05 -0.39 1.88 0.02 0.00 0.00 177.57 179.21 2vml h TYR 60 N 0.28 0.01 -0.41 1.57 0.05 -1.39 0.39 116.97 117.46 2vml h TYR 60 Ca 0.09 -0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.75 2vml h TYR 60 Cb -0.01 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 2vml h TYR 60 CO -0.07 0.40 -0.18 -0.91 -1.05 0.00 0.00 178.16 176.34 2vml h ASN 61 N 0.01 0.87 0.17 3.88 2.35 -0.98 -2.81 115.58 119.07 2vml h ASN 61 Ca -0.00 -0.40 -0.24 0.00 -0.55 0.00 0.00 56.30 55.11 2vml h ASN 61 Cb 0.69 -0.24 0.01 0.00 0.05 0.00 0.00 38.32 38.83 2vml h ASN 61 CO 0.05 1.07 -0.96 0.50 -1.65 0.00 0.00 177.43 176.44 2vml h LYS 62 N 0.66 0.55 -2.23 0.81 1.63 -0.86 -3.37 116.57 113.77 2vml h LYS 62 Ca 0.09 -0.57 -0.59 0.00 -0.85 0.00 0.00 60.65 58.73 2vml h LYS 62 Cb 0.73 0.16 -0.41 0.00 -0.60 0.00 0.00 32.23 32.11 2vml h LYS 62 CO 0.06 1.19 -0.70 1.19 -3.45 0.00 0.00 179.45 177.74 2vml n PHE 63 N -3.80 2.74 0.26 1.91 3.72 0.10 -4.97 117.46 117.42 2vml n PHE 63 Ca -0.08 -4.04 0.09 0.00 -0.05 0.00 0.00 57.45 53.37 2vml n PHE 63 Cb 0.84 -0.51 0.65 0.00 -0.94 0.00 0.00 39.48 39.53 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 4.27 0.00 -0.04 -1.08 0.11 -1.66 -2.19 132.00 131.40 2vml h PRO 64 Ca 0.17 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.29 2vml h PRO 64 Cb 0.72 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.82 2vml h PRO 64 CO 0.74 0.04 0.08 0.10 -0.21 0.00 0.00 178.00 178.75 2vml h TYR 65 N 0.00 0.00 0.00 0.65 -0.00 -1.93 -2.84 116.97 112.84 2vml h TYR 65 Ca -0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.71 2vml h TYR 65 Cb 0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.80 2vml h TYR 65 CO 0.00 0.00 -0.09 -0.07 -0.00 0.00 0.00 178.16 178.00 2vml h LEU 66 N 0.00 0.00 -1.09 0.10 3.38 -1.74 -2.54 115.31 113.42 2vml h LEU 66 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2vml h LEU 66 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2vml h LEU 66 CO -0.00 0.09 0.00 0.35 0.09 0.00 0.00 178.44 178.97 2vml n THR 67 N -4.43 0.20 -2.81 0.22 -2.24 -1.07 -0.63 114.28 103.52 2vml n THR 67 Ca -0.03 -0.34 -0.33 0.00 -2.27 0.00 0.00 64.05 61.08 2vml n THR 67 Cb 0.16 0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 68.69 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 4.25 0.25 -0.78 -1.52 -0.96 -4.65 119.66 114.44 2vml s GLN 68 Ca 0.32 1.15 -0.29 0.00 -1.95 0.00 0.00 55.36 54.59 2vml s GLN 68 Cb 0.17 -2.23 -0.15 0.00 -0.22 0.00 0.00 33.01 30.58 2vml s GLN 68 CO 0.26 -0.02 1.00 -2.30 -0.25 0.00 0.00 175.29 173.99 2vml n PRO 69 N -0.54 1.18 0.00 2.91 -0.02 -1.26 -1.85 135.00 135.42 2vml n PRO 69 Ca 0.07 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2vml n PRO 69 Cb 0.54 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 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 1.50 2.27 3.99 -1.23 0.00 -1.26 -5.03 105.19 105.43 2vml n GLY 70 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.30 2.83 0.00 1.61 -1.52 -0.77 -5.01 119.66 116.49 2vml s GLN 71 Ca 0.00 -1.05 0.30 0.00 -1.95 0.00 0.00 55.36 52.67 2vml s GLN 71 Cb 0.00 -2.70 1.55 0.00 -0.22 0.00 0.00 33.01 31.64 2vml s GLN 71 CO 0.00 -0.31 2.02 -1.33 -0.25 0.00 0.00 175.29 175.43 2vml n MET 72 N -1.94 1.27 -0.44 2.91 2.81 -1.25 -2.63 117.12 117.85 2vml n MET 72 Ca 0.06 -0.40 0.08 0.00 -1.81 0.00 0.00 57.70 55.62 2vml n MET 72 Cb 0.59 -1.49 0.26 0.00 -0.71 0.00 0.00 33.22 31.87 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 3.42 3.69 3.03 0.00 0.20 -4.73 105.19 111.87 2vml n GLY 73 Ca 0.22 -0.83 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.20 3.34 0.00 1.61 5.04 -1.04 -4.33 117.35 119.78 2vml s TYR 74 Ca 0.40 0.22 0.00 0.00 -2.44 0.00 0.00 57.07 55.25 2vml s TYR 74 Cb 0.29 -2.11 0.00 0.00 0.35 0.00 0.00 41.96 40.49 2vml s TYR 74 CO 0.14 0.24 0.00 0.41 -1.34 0.00 0.00 175.55 175.00 2vml n GLY 75 N 3.47 1.01 0.31 8.97 0.00 -1.26 -4.42 105.19 113.27 2vml n GLY 75 Ca -0.16 -1.75 -0.01 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 0.69 -0.11 1.61 3.32 -1.98 -2.10 116.42 117.85 2vml h ASP 76 Ca 0.00 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.84 2vml h ASP 76 Cb 0.00 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2vml h ASP 76 CO 0.00 0.63 -0.40 0.74 -1.72 0.00 0.00 179.24 178.49 2vml h THR 77 N 0.74 1.38 -0.32 0.35 2.02 -1.99 -0.21 112.91 114.89 2vml h THR 77 Ca 0.18 -1.73 0.02 0.00 0.77 0.00 0.00 66.41 65.64 2vml h THR 77 Cb 0.17 2.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.74 2vml h THR 77 CO -0.01 0.51 0.18 0.78 0.37 0.00 0.00 175.52 177.35 2vml h ASN 78 N 0.04 0.28 0.29 4.18 2.35 -1.75 -1.78 115.58 119.20 2vml h ASN 78 Ca -0.02 0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.62 2vml h ASN 78 Cb 1.04 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 2vml h ASN 78 CO 0.08 0.20 -0.46 1.56 -1.65 0.00 0.00 177.43 177.17 2vml h GLN 79 N 0.36 0.21 -0.30 0.81 4.20 -1.39 -2.23 115.11 116.77 2vml h GLN 79 Ca 0.13 -0.11 -0.16 0.00 0.06 0.00 0.00 58.65 58.57 2vml h GLN 79 Cb 0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2vml h GLN 79 CO -0.07 0.63 -0.46 0.00 -0.67 0.00 0.00 178.83 178.26 2vml h ALA 80 N 1.36 0.63 -0.21 3.87 0.00 -0.93 -2.75 119.26 121.23 2vml h ALA 80 Ca 0.01 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 2vml h ALA 80 Cb 0.88 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2vml h ALA 80 CO 0.07 0.67 -0.22 0.87 0.00 0.00 0.00 179.25 180.65 2vml h LYS 81 N 0.62 0.37 0.10 0.00 1.57 -1.23 -1.36 116.57 116.64 2vml h LYS 81 Ca 0.04 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2vml h LYS 81 Cb 1.02 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2vml h LYS 81 CO 0.10 0.58 -0.05 0.00 -0.57 0.00 0.00 179.45 179.51 2vml h ALA 83 N 0.68 1.02 -0.09 0.00 0.00 -1.39 -1.20 119.26 118.28 2vml h ALA 83 Ca -0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 2vml h ALA 83 Cb 0.17 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2vml h ALA 83 CO 0.02 0.49 0.05 -0.09 0.00 0.00 0.00 179.25 179.73 2vml h ARG 84 N 1.09 0.12 -0.24 0.00 2.43 -1.20 -0.09 114.38 116.49 2vml h ARG 84 Ca 0.28 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.45 2vml h ARG 84 Cb -0.02 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2vml h ARG 84 CO -0.05 0.13 0.13 -0.44 -1.51 0.00 0.00 179.97 178.23 2vml h ASP 85 N 0.07 0.20 -0.18 -3.80 3.32 -0.68 -0.03 116.42 115.32 2vml h ASP 85 Ca 0.03 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.02 2vml h ASP 85 Cb 0.04 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2vml h ASP 85 CO -0.01 0.15 -0.08 0.40 -1.72 0.00 0.00 179.24 177.99 2vml h ILE 86 N 0.27 1.22 -0.69 0.35 2.04 -1.19 -1.80 117.51 117.70 2vml h ILE 86 Ca 0.09 -0.93 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 2vml h ILE 86 Cb 0.01 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2vml h ILE 86 CO -0.05 0.31 0.21 -1.28 0.00 0.00 0.00 178.15 177.33 2vml h SER 87 N 0.49 1.00 -0.08 1.72 0.87 -0.62 -2.23 113.55 114.70 2vml h SER 87 Ca 0.10 -0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.50 2vml h SER 87 Cb 0.43 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.09 2vml h SER 87 CO 0.02 0.94 -0.13 0.45 -0.53 0.00 0.00 176.83 177.58 2vml h HIS 88 N 1.03 -0.34 -0.13 2.24 3.86 -0.20 0.30 115.15 121.91 2vml h HIS 88 Ca 0.22 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.48 2vml h HIS 88 Cb 0.30 0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 2vml h HIS 88 CO 0.02 -0.20 -0.03 1.88 0.86 0.00 0.00 177.93 180.47 2vml h TYR 89 N -0.18 -0.06 -0.77 2.45 0.05 -1.28 -0.01 116.97 117.16 2vml h TYR 89 Ca 0.07 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.85 2vml h TYR 89 Cb 0.29 0.05 -0.04 0.00 1.01 0.00 0.00 36.73 38.04 2vml h TYR 89 CO -0.23 -0.05 0.41 1.25 -1.05 0.00 0.00 178.16 178.49 2vml h LEU 90 N 0.00 0.97 -0.26 3.88 5.85 -1.24 -1.02 115.31 123.49 2vml h LEU 90 Ca 0.06 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2vml h LEU 90 Cb 0.10 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2vml h LEU 90 CO -0.13 0.80 0.14 -0.09 -0.34 0.00 0.00 178.44 178.82 2vml h ARG 91 N 1.07 0.29 0.00 1.25 2.43 -0.57 -1.74 114.38 117.11 2vml h ARG 91 Ca 0.27 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 2vml h ARG 91 Cb 0.05 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2vml h ARG 91 CO -0.04 0.19 -0.12 0.74 -1.51 0.00 0.00 179.97 179.24 2vml h PHE 92 N 0.30 0.00 -0.18 2.20 0.04 -0.70 -1.30 116.94 117.29 2vml h PHE 92 Ca 0.10 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.78 2vml h PHE 92 Cb 0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 2vml h PHE 92 CO -0.08 0.12 -0.24 0.82 -0.60 0.00 0.00 178.31 178.32 2vml h ILE 93 N 0.00 1.34 -0.56 -0.55 2.04 -0.96 -2.18 117.51 116.64 2vml h ILE 93 Ca -0.00 -1.45 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 2vml h ILE 93 Cb 0.62 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 2vml h ILE 93 CO 0.02 0.44 0.14 0.71 0.00 0.00 0.00 178.15 179.46 2vml h THR 94 N 0.15 1.23 -0.28 -0.27 1.35 -0.77 -1.50 112.91 112.81 2vml h THR 94 Ca 0.02 -0.81 -0.02 0.00 -0.55 0.00 0.00 66.41 65.05 2vml h THR 94 Cb 0.81 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 2vml h THR 94 CO 0.06 0.30 0.09 1.88 -0.25 0.00 0.00 175.52 177.60 2vml h TYR 95 N 0.82 0.45 -0.38 4.73 0.05 -1.25 -1.44 116.97 119.96 2vml h TYR 95 Ca 0.18 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 2vml h TYR 95 Cb 0.29 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 2vml h TYR 95 CO 0.02 0.48 0.21 0.77 -1.05 0.00 0.00 178.16 178.59 2vml h SER 96 N 0.29 0.48 0.05 3.88 0.02 -1.22 0.17 113.55 117.22 2vml h SER 96 Ca 0.09 -0.09 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2vml h SER 96 Cb 0.24 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 2vml h SER 96 CO -0.00 0.43 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.61 2vml h LEU 97 N 0.49 -1.32 -1.46 5.07 3.38 -1.18 -2.17 115.31 118.12 2vml h LEU 97 Ca 0.13 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2vml h LEU 97 Cb 0.06 0.51 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 2vml h LEU 97 CO -0.02 -0.48 0.05 0.58 0.09 0.00 0.00 178.44 178.66 2vml h VAL 98 N -0.63 1.14 0.00 1.22 2.07 -0.99 -3.17 116.25 115.90 2vml h VAL 98 Ca 0.03 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 2vml h VAL 98 Cb 0.68 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2vml h VAL 98 CO -0.29 0.18 -0.07 0.00 0.02 0.00 0.00 177.57 177.41 2vml h ALA 99 N 1.66 0.96 -0.79 1.67 0.00 -0.37 -3.48 119.26 118.91 2vml h ALA 99 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2vml h ALA 99 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2vml h ALA 99 CO -0.00 0.09 -0.06 0.41 0.00 0.00 0.00 179.25 179.68 2vml n GLY 100 N 0.96 0.49 0.00 0.00 0.00 -0.84 -4.68 105.19 101.11 2vml n GLY 100 Ca 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 0.45 0.00 -0.02 0.00 -1.09 -2.16 105.19 101.50 2vml n GLY 101 Ca -0.02 -0.91 0.13 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.22 0.12 -0.34 2.61 -2.24 -1.24 -4.42 114.28 108.56 2vml n THR 102 Ca 0.00 0.03 0.02 0.00 -2.27 0.00 0.00 64.05 61.83 2vml n THR 102 Cb 0.00 -0.56 0.09 0.00 -2.10 0.00 0.00 70.33 67.75 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 4.66 0.42 0.77 3.38 0.00 -1.60 0.06 103.07 110.76 2vml h GLY 103 Ca 0.00 0.38 0.05 0.00 0.00 0.00 0.00 47.33 47.76 2vml h GLY 103 CO 0.00 -0.29 0.40 -2.55 0.00 0.00 0.00 176.54 174.09 2vml h PRO 104 N -0.02 0.73 -0.36 4.80 0.11 -1.82 0.49 132.00 135.94 2vml h PRO 104 Ca 0.40 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.43 2vml h PRO 104 Cb 0.64 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 2vml h PRO 104 CO -0.94 0.49 0.09 -0.07 -0.21 0.00 0.00 178.00 177.35 2vml h LEU 105 N 0.76 0.54 -0.42 2.35 3.38 -1.39 -2.04 115.31 118.48 2vml h LEU 105 Ca 0.29 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2vml h LEU 105 Cb 0.11 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2vml h LEU 105 CO -0.15 0.62 0.15 0.44 0.09 0.00 0.00 178.44 179.59 2vml h ASP 106 N 0.42 0.16 0.94 -0.43 3.32 -0.67 0.27 116.42 120.45 2vml h ASP 106 Ca 0.11 0.05 -0.22 0.00 0.02 0.00 0.00 57.03 56.99 2vml h ASP 106 Cb 0.29 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.84 2vml h ASP 106 CO -0.00 0.13 -1.08 0.44 -1.72 0.00 0.00 179.24 177.01 2vml h ASP 107 N 0.32 0.00 0.00 6.45 5.19 -0.89 -0.80 116.42 126.69 2vml h ASP 107 Ca 0.19 -0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.50 2vml h ASP 107 Cb 0.18 -0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.66 2vml h ASP 107 CO -0.19 1.00 -1.69 -1.22 -3.12 0.00 0.00 179.24 174.02 2vml n TYR 108 N -3.32 0.00 -0.02 4.55 4.01 -0.77 -4.68 117.16 116.93 2vml n TYR 108 Ca -0.02 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.66 2vml n TYR 108 Cb 0.95 -0.43 -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 0.50 -0.06 -0.72 5.41 -0.15 -4.89 119.36 117.27 2vml n ILE 109 Ca -0.11 -0.02 -0.16 0.00 1.00 0.00 0.00 62.75 63.47 2vml n ILE 109 Cb 0.60 -1.61 -0.06 0.00 -0.71 0.00 0.00 39.64 37.86 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 1.29 -2.76 1.39 2.07 -1.04 -3.31 116.25 113.66 2vml h VAL 110 Ca -0.14 -1.79 -0.56 0.00 0.82 0.00 0.00 66.70 65.03 2vml h VAL 110 Cb 1.00 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 2vml h VAL 110 CO -0.08 0.57 1.09 0.00 0.02 0.00 0.00 177.57 179.17 2vml s ALA 111 N -3.97 3.39 0.00 1.67 0.00 -0.31 -2.44 121.76 120.10 2vml s ALA 111 Ca -0.11 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.40 2vml s ALA 111 Cb 0.09 -3.80 0.00 0.00 0.00 0.00 0.00 23.12 19.41 2vml s ALA 111 CO 0.88 -1.74 0.00 0.41 0.00 0.00 0.00 175.76 175.31 2vml n GLY 112 N 4.42 0.75 0.27 0.00 0.00 -1.26 -4.86 105.19 104.50 2vml n GLY 112 Ca 0.18 0.00 -0.11 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 -0.70 -0.30 0.99 5.85 -1.57 -1.40 115.31 118.18 2vml h LEU 113 Ca 0.00 0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.67 2vml h LEU 113 Cb 0.00 0.29 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2vml h LEU 113 CO 0.00 -0.31 -0.37 0.03 -0.34 0.00 0.00 178.44 177.45 2vml h ARG 114 N -0.38 0.78 0.03 1.25 3.08 -1.91 -1.49 114.38 115.74 2vml h ARG 114 Ca 0.06 -0.44 0.03 0.00 0.07 0.00 0.00 59.98 59.70 2vml h ARG 114 Cb 0.45 0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 2vml h ARG 114 CO -0.21 1.07 -0.41 1.49 -1.07 0.00 0.00 179.97 180.84 2vml h GLU 115 N 0.55 -0.57 0.10 0.04 4.81 -1.94 -1.22 114.58 116.36 2vml h GLU 115 Ca 0.04 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2vml h GLU 115 Cb 0.96 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 2vml h GLU 115 CO 0.09 -0.38 -0.15 0.28 -0.73 0.00 0.00 179.01 178.12 2vml h VAL 116 N -0.59 0.65 -0.29 0.32 2.07 -1.21 -2.15 116.25 115.06 2vml h VAL 116 Ca 0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 2vml h VAL 116 Cb 0.65 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2vml h VAL 116 CO -0.29 0.00 0.16 0.78 0.02 0.00 0.00 177.57 178.24 2vml h ASN 117 N -0.31 0.34 -0.25 0.57 2.35 -1.25 -1.74 115.58 115.30 2vml h ASN 117 Ca 0.02 -0.02 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 2vml h ASN 117 Cb 0.32 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2vml h ASN 117 CO -0.08 0.28 -0.14 -0.09 -1.65 0.00 0.00 177.43 175.76 2vml h ARG 118 N 0.40 0.53 -0.43 0.81 2.43 -0.87 0.25 114.38 117.50 2vml h ARG 118 Ca 0.10 -0.24 -0.14 0.00 -0.81 0.00 0.00 59.98 58.89 2vml h ARG 118 Cb 0.01 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2vml h ARG 118 CO -0.02 0.80 -0.30 1.15 -1.51 0.00 0.00 179.97 180.10 2vml h THR 119 N 0.25 1.27 -0.53 0.20 2.02 -1.01 -3.07 112.91 112.04 2vml h THR 119 Ca 0.05 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.77 2vml h THR 119 Cb 0.65 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 2vml h THR 119 CO 0.04 0.50 0.00 0.49 0.37 0.00 0.00 175.52 176.92 2vml n PHE 120 N -4.08 0.70 -3.62 3.16 3.72 -0.69 -4.96 117.46 111.69 2vml n PHE 120 Ca -0.01 -0.35 -0.22 0.00 -0.05 0.00 0.00 57.45 56.82 2vml n PHE 120 Cb 0.50 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.10 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 1.13 -3.27 -4.60 4.37 3.02 -0.43 -4.98 115.26 110.52 2vml n ASN 121 Ca 0.19 -0.68 -0.38 0.00 -0.03 0.00 0.00 54.58 53.68 2vml n ASN 121 Cb 0.48 -4.63 -0.11 0.00 -0.61 0.00 0.00 39.78 34.91 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 -6.81 4.02 -0.07 3.41 1.43 0.75 -5.03 118.68 116.38 2vml s LEU 122 Ca 0.24 0.00 -0.30 0.00 -1.03 0.00 0.00 54.13 53.05 2vml s LEU 122 Cb -0.11 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.97 2vml s LEU 122 CO 0.77 -0.03 1.07 -0.44 0.23 0.00 0.00 176.35 177.94 2vml s SER 123 N 1.66 7.20 0.48 2.29 0.01 -1.26 -4.62 113.70 119.46 2vml s SER 123 Ca 0.07 1.66 0.20 0.00 1.31 0.00 0.00 55.95 59.19 2vml s SER 123 Cb -0.16 -2.56 1.23 0.00 0.21 0.00 0.00 66.02 64.75 2vml s SER 123 CO 0.10 -0.46 1.97 1.55 0.41 0.00 0.00 173.24 176.82 2vml h PRO 124 N 7.13 0.18 -0.73 12.44 0.13 -1.96 -2.35 132.00 146.85 2vml h PRO 124 Ca -0.34 -0.01 0.11 0.00 -0.87 0.00 0.00 66.00 64.89 2vml h PRO 124 Cb 1.17 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 2vml h PRO 124 CO 0.84 0.12 0.48 0.66 -0.23 0.00 0.00 178.00 179.88 2vml h SER 125 N 0.19 0.52 -0.26 1.44 4.64 -1.92 0.84 113.55 119.00 2vml h SER 125 Ca 0.28 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.61 2vml h SER 125 Cb 0.86 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.85 2vml h SER 125 CO -0.05 0.30 0.14 -0.50 -0.87 0.00 0.00 176.83 175.85 2vml h TRP 126 N 0.57 0.37 -0.16 4.77 6.55 -1.83 -2.18 115.95 124.05 2vml h TRP 126 Ca 0.34 -0.01 -0.19 0.00 0.95 0.00 0.00 58.89 59.98 2vml h TRP 126 Cb 0.55 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 2vml h TRP 126 CO -0.00 0.32 -0.68 1.88 -1.05 0.00 0.00 178.44 178.92 2vml h TYR 127 N 0.30 0.83 -0.45 0.49 0.05 -1.45 -1.46 116.97 115.28 2vml h TYR 127 Ca 0.09 -0.34 0.02 0.00 0.05 0.00 0.00 58.73 58.56 2vml h TYR 127 Cb 0.08 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 2vml h TYR 127 CO -0.03 1.12 0.26 0.82 -1.05 0.00 0.00 178.16 179.28 2vml h ILE 128 N 0.45 1.03 -0.59 -2.88 2.04 -0.88 -0.83 117.51 115.85 2vml h ILE 128 Ca -0.02 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 2vml h ILE 128 Cb 1.27 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 2vml h ILE 128 CO 0.13 0.09 0.14 -0.08 0.00 0.00 0.00 178.15 178.44 2vml h GLU 129 N 0.52 0.95 -0.61 2.37 4.57 -1.25 -0.19 114.58 120.95 2vml h GLU 129 Ca 0.18 -0.23 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 2vml h GLU 129 Cb 0.03 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.45 2vml h GLU 129 CO -0.09 0.88 0.36 0.00 -1.18 0.00 0.00 179.01 178.97 2vml h ALA 130 N 1.03 0.79 -0.30 2.92 0.00 -1.07 -1.82 119.26 120.82 2vml h ALA 130 Ca 0.19 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 2vml h ALA 130 Cb 0.36 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2vml h ALA 130 CO 0.00 0.08 -0.54 -0.07 0.00 0.00 0.00 179.25 178.72 2vml h LEU 131 N 0.70 0.99 -1.10 0.00 3.38 -0.83 -1.27 115.31 117.18 2vml h LEU 131 Ca 0.25 -0.53 0.01 0.00 0.09 0.00 0.00 57.88 57.71 2vml h LEU 131 Cb 0.07 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 2vml h LEU 131 CO -0.12 1.33 0.61 0.11 0.09 0.00 0.00 178.44 180.46 2vml h LYS 132 N 0.68 1.20 -0.14 1.13 1.57 -0.97 0.28 116.57 120.32 2vml h LYS 132 Ca 0.02 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 2vml h LYS 132 Cb 1.15 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 33.19 2vml h LYS 132 CO 0.12 0.79 -0.01 1.25 -0.57 0.00 0.00 179.45 181.03 2vml h HIS 133 N 1.23 0.28 -0.85 -1.35 2.76 -1.11 -1.49 115.15 114.62 2vml h HIS 133 Ca 0.34 -0.05 0.11 0.00 -2.20 0.00 0.00 60.37 58.57 2vml h HIS 133 Cb -0.12 -0.07 -0.08 0.00 1.55 0.00 0.00 27.41 28.69 2vml h HIS 133 CO -0.00 0.50 0.48 0.82 -1.30 0.00 0.00 177.93 178.44 2vml h ILE 134 N -0.02 0.87 -0.42 6.26 2.04 -1.03 -2.27 117.51 122.93 2vml h ILE 134 Ca 0.04 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.65 2vml h ILE 134 Cb 0.40 0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 2vml h ILE 134 CO 0.01 0.14 0.26 0.50 0.00 0.00 0.00 178.15 179.06 2vml h LYS 135 N 0.78 0.52 -0.54 2.37 3.64 -0.76 0.25 116.57 122.82 2vml h LYS 135 Ca 0.43 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.85 2vml h LYS 135 Cb 0.45 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 2vml h LYS 135 CO -0.28 0.34 0.21 0.78 -2.27 0.00 0.00 179.45 178.23 2vml h GLY 136 N 0.53 0.74 1.12 5.01 0.00 -0.84 -2.15 103.07 107.48 2vml h GLY 136 Ca 0.16 -0.12 -0.18 0.00 0.00 0.00 0.00 47.33 47.19 2vml h GLY 136 CO -0.06 0.01 -0.54 0.50 0.00 0.00 0.00 176.54 176.45 2vml h LYS 137 N 0.40 0.84 -0.13 4.80 1.79 -1.05 -3.00 116.57 120.22 2vml h LYS 137 Ca 0.26 -0.54 -0.03 0.00 -2.18 0.00 0.00 60.65 58.16 2vml h LYS 137 Cb 0.28 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.99 2vml h LYS 137 CO -0.26 1.17 -0.06 0.28 -1.08 0.00 0.00 179.45 179.51 2vml h VAL 138 N 0.61 1.13 -0.02 0.50 2.07 -0.89 -2.60 116.25 117.05 2vml h VAL 138 Ca 0.01 -0.52 0.01 0.00 0.82 0.00 0.00 66.70 67.01 2vml h VAL 138 Cb 1.15 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2vml h VAL 138 CO 0.12 0.17 0.06 1.23 0.02 0.00 0.00 177.57 179.17 2vml h GLY 139 N 0.54 0.00 0.20 2.17 0.00 -1.23 -0.44 103.07 104.31 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 -1.24 1.44 0.00 0.00 0.00 176.54 176.75 2vml n SER 140 N -3.26 0.63 0.03 0.19 7.64 -0.98 -4.48 113.62 113.38 2vml n SER 140 Ca -0.02 -0.51 0.05 0.00 1.01 0.00 0.00 58.87 59.40 2vml n SER 140 Cb 0.14 1.17 -0.09 0.00 -1.01 0.00 0.00 64.21 64.41 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 -1.82 0.63 -4.22 1.43 6.02 -0.27 -4.97 117.38 114.19 2vml n GLN 141 Ca 0.01 0.07 -0.14 0.00 -0.01 0.00 0.00 57.00 56.93 2vml n GLN 141 Cb 0.42 -1.71 -0.10 0.00 1.02 0.00 0.00 30.24 29.87 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 -5.33 2.49 0.31 1.08 1.43 -0.65 -5.06 118.68 112.95 2vml s LEU 142 Ca -0.04 -0.94 0.02 0.00 -1.03 0.00 0.00 54.13 52.13 2vml s LEU 142 Cb 0.10 -0.32 -0.02 0.00 0.03 0.00 0.00 46.19 45.98 2vml s LEU 142 CO 0.83 -0.32 0.33 -0.94 0.23 0.00 0.00 176.35 176.48 2vml s SER 143 N -2.91 1.08 0.96 2.29 1.04 -1.26 -4.72 113.70 110.18 2vml s SER 143 Ca 0.13 -1.57 0.00 0.00 0.48 0.00 0.00 55.95 54.99 2vml s SER 143 Cb 0.01 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.69 2vml s SER 143 CO -0.00 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.72 2vml n GLY 144 N -0.53 2.67 0.22 7.32 0.00 -1.26 -2.64 105.19 110.97 2vml n GLY 144 Ca 0.04 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 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 0.55 -0.80 1.61 1.08 -1.99 -1.68 115.11 113.88 2vml h GLN 145 Ca 0.00 -0.32 0.14 0.00 -1.45 0.00 0.00 58.65 57.02 2vml h GLN 145 Cb 0.00 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.37 2vml h GLN 145 CO 0.00 0.93 0.37 -1.35 -0.95 0.00 0.00 178.83 177.83 2vml h PRO 146 N 0.43 0.52 -0.37 1.46 0.11 -1.72 -0.13 132.00 132.31 2vml h PRO 146 Ca 0.02 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 2vml h PRO 146 Cb 1.04 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 2vml h PRO 146 CO 0.10 0.35 0.19 1.25 -0.21 0.00 0.00 178.00 179.67 2vml h LEU 147 N 0.54 0.47 -0.71 2.35 5.85 -1.24 -1.64 115.31 120.92 2vml h LEU 147 Ca 0.44 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 59.11 2vml h LEU 147 Cb 0.63 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.49 2vml h LEU 147 CO -0.38 0.44 0.40 0.74 -0.34 0.00 0.00 178.44 179.30 2vml h THR 148 N 0.46 0.98 0.39 1.05 2.02 -0.77 0.62 112.91 117.66 2vml h THR 148 Ca 0.13 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 2vml h THR 148 Cb 0.08 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 2vml h THR 148 CO -0.02 0.13 -0.19 -0.33 0.37 0.00 0.00 175.52 175.49 2vml h GLU 149 N 0.74 -0.50 -0.18 6.66 4.39 -0.93 -1.87 114.58 122.89 2vml h GLU 149 Ca 0.32 0.03 0.05 0.00 0.34 0.00 0.00 59.36 60.10 2vml h GLU 149 Cb 0.20 0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.91 2vml h GLU 149 CO -0.19 -0.31 -0.15 0.00 -1.16 0.00 0.00 179.01 177.20 2vml h ALA 150 N 0.04 -0.03 -0.91 3.43 0.00 -1.06 -2.63 119.26 118.09 2vml h ALA 150 Ca -0.05 0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2vml h ALA 150 Cb 0.43 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 2vml h ALA 150 CO 0.09 -0.59 0.60 -0.91 0.00 0.00 0.00 179.25 178.44 2vml h ASN 151 N -0.17 0.96 -0.22 0.00 2.35 -0.84 -1.42 115.58 116.25 2vml h ASN 151 Ca 0.11 -0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.89 2vml h ASN 151 Cb 0.33 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 2vml h ASN 151 CO -0.28 0.65 0.02 0.00 -1.65 0.00 0.00 177.43 176.17 2vml h ALA 152 N 1.48 0.21 -0.08 -0.83 0.00 -0.97 0.54 119.26 119.61 2vml h ALA 152 Ca 0.37 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 55.15 2vml h ALA 152 Cb 0.08 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2vml h ALA 152 CO -0.12 -0.41 -0.73 1.88 0.00 0.00 0.00 179.25 179.87 2vml h TYR 153 N 0.10 0.54 -0.33 0.00 0.05 -1.28 -0.44 116.97 115.61 2vml h TYR 153 Ca 0.10 -0.24 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 2vml h TYR 153 Cb 0.11 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2vml h TYR 153 CO -0.17 1.00 0.11 0.82 -1.05 0.00 0.00 178.16 178.87 2vml h ILE 154 N 0.27 1.20 -0.33 -2.88 2.04 -1.13 -2.71 117.51 113.97 2vml h ILE 154 Ca -0.03 -0.65 -0.08 0.00 1.00 0.00 0.00 64.86 65.11 2vml h ILE 154 Cb 1.31 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 2vml h ILE 154 CO 0.13 0.22 -0.12 0.44 0.00 0.00 0.00 178.15 178.82 2vml h ASP 155 N 0.38 0.56 -0.53 1.72 3.32 -0.85 -2.25 116.42 118.77 2vml h ASP 155 Ca 0.11 -0.15 0.06 0.00 0.02 0.00 0.00 57.03 57.07 2vml h ASP 155 Cb 0.24 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 2vml h ASP 155 CO -0.00 0.71 0.23 0.22 -1.72 0.00 0.00 179.24 178.67 2vml h TYR 156 N 0.53 0.41 -0.06 4.55 3.20 -0.89 -1.32 116.97 123.39 2vml h TYR 156 Ca 0.09 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2vml h TYR 156 Cb 0.52 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 2vml h TYR 156 CO 0.02 0.16 0.03 0.00 -1.64 0.00 0.00 178.16 176.73 2vml h ILE 158 N -0.04 0.91 -0.43 0.00 2.04 -1.16 -1.06 117.51 117.77 2vml h ILE 158 Ca 0.02 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 2vml h ILE 158 Cb 0.13 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.18 2vml h ILE 158 CO -0.00 0.16 0.02 0.78 0.00 0.00 0.00 178.15 179.10 2vml h ASN 159 N 0.85 0.72 -0.02 1.72 2.35 -1.11 -2.86 115.58 117.23 2vml h ASN 159 Ca 0.43 -0.29 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2vml h ASN 159 Cb 0.41 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.58 2vml h ASN 159 CO -0.26 0.84 0.02 0.00 -1.65 0.00 0.00 177.43 176.38 2vml h ALA 160 N 0.91 1.89 -0.01 -0.83 0.00 -0.39 -2.16 119.26 118.67 2vml h ALA 160 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2vml h ALA 160 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2vml h ALA 160 CO 0.02 -0.03 -0.20 1.28 0.00 0.00 0.00 179.25 180.33 2vml n LEU 161 N -4.34 0.97 -0.71 0.00 4.77 -0.48 -4.99 117.00 112.23 2vml n LEU 161 Ca -0.03 -0.24 0.09 0.00 -0.03 0.00 0.00 56.01 55.80 2vml n LEU 161 Cb 0.11 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 2vml n LEU 161 CO 0.32 0.18 0.53 -1.20 -1.33 0.00 0.00 177.39 175.89