#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 3.99 0.27 2.12 2.20 -1.26 -4.75 119.74 122.32 2vml s LYS 2 Ca 0.00 1.56 0.02 0.00 -0.36 0.00 0.00 55.97 57.19 2vml s LYS 2 Cb 0.00 -3.90 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 2vml s LYS 2 CO 0.00 -1.03 0.16 0.95 -0.36 0.00 0.00 175.35 175.07 2vml s THR 3 N 4.34 0.23 0.29 3.43 -4.23 -1.26 -1.27 115.64 117.17 2vml s THR 3 Ca 0.61 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 59.11 2vml s THR 3 Cb -0.22 -2.52 0.27 0.00 1.34 0.00 0.00 72.50 71.36 2vml s THR 3 CO 0.23 0.00 1.95 0.58 -0.54 0.00 0.00 174.62 176.84 2vml h VAL 4 N 2.33 1.18 -0.07 2.29 2.07 -1.72 -1.08 116.25 121.25 2vml h VAL 4 Ca -0.34 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 66.72 2vml h VAL 4 Cb 1.25 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2vml h VAL 4 CO 0.51 0.21 -0.27 0.40 0.02 0.00 0.00 177.57 178.44 2vml h ILE 5 N 1.13 1.43 -0.08 4.57 2.04 -1.91 -1.04 117.51 123.65 2vml h ILE 5 Ca 0.33 -1.67 -0.07 0.00 1.00 0.00 0.00 64.86 64.45 2vml h ILE 5 Cb -0.05 2.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 2vml h ILE 5 CO -0.09 0.48 -0.27 0.71 0.00 0.00 0.00 178.15 178.98 2vml h THR 6 N -0.20 1.23 -0.20 -0.27 1.35 -1.84 -2.37 112.91 110.60 2vml h THR 6 Ca -0.01 -1.08 -0.19 0.00 -0.55 0.00 0.00 66.41 64.58 2vml h THR 6 Cb 0.91 1.48 0.01 0.00 -1.73 0.00 0.00 68.15 68.82 2vml h THR 6 CO 0.06 0.32 -0.60 -0.08 -0.25 0.00 0.00 175.52 174.96 2vml h GLU 7 N 0.12 0.76 -0.12 4.72 4.81 -1.02 -0.26 114.58 123.59 2vml h GLU 7 Ca 0.02 -0.55 -0.13 0.00 -0.13 0.00 0.00 59.36 58.57 2vml h GLU 7 Cb 0.55 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2vml h GLU 7 CO 0.04 1.17 -0.49 -0.39 -0.73 0.00 0.00 179.01 178.61 2vml h VAL 8 N 0.49 1.34 -0.18 0.32 -1.51 -1.16 -1.97 116.25 113.58 2vml h VAL 8 Ca -0.02 -1.72 -0.03 0.00 -1.23 0.00 0.00 66.70 63.71 2vml h VAL 8 Cb 1.22 1.78 -0.01 0.00 -2.13 0.00 0.00 31.29 32.16 2vml h VAL 8 CO 0.13 0.52 0.01 0.40 -1.23 0.00 0.00 177.57 177.40 2vml h ILE 9 N 0.25 1.24 -0.94 7.19 2.04 -1.37 -1.73 117.51 124.19 2vml h ILE 9 Ca 0.01 -0.80 0.09 0.00 1.00 0.00 0.00 64.86 65.17 2vml h ILE 9 Cb 0.96 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 38.38 2vml h ILE 9 CO 0.08 0.24 0.60 0.00 0.00 0.00 0.00 178.15 179.07 2vml h ALA 10 N 0.80 1.56 0.39 1.87 0.00 -0.99 0.79 119.26 123.67 2vml h ALA 10 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2vml h ALA 10 Cb 0.35 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2vml h ALA 10 CO 0.01 0.26 -0.19 1.03 0.00 0.00 0.00 179.25 180.36 2vml h SER 11 N 0.98 -0.44 -0.85 0.00 0.87 -1.19 0.03 113.55 112.94 2vml h SER 11 Ca 0.43 -0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.93 2vml h SER 11 Cb 0.35 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.38 2vml h SER 11 CO -0.19 -0.18 0.56 0.00 -0.53 0.00 0.00 176.83 176.49 2vml h ALA 12 N -0.17 1.10 -0.50 6.23 0.00 -1.11 -3.01 119.26 121.80 2vml h ALA 12 Ca -0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 2vml h ALA 12 Cb 0.50 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2vml h ALA 12 CO 0.09 0.44 0.07 0.22 0.00 0.00 0.00 179.25 180.07 2vml h ASP 13 N 1.11 0.80 0.04 0.00 3.58 -0.77 -0.61 116.42 120.58 2vml h ASP 13 Ca 0.32 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.51 2vml h ASP 13 Cb -0.07 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.77 2vml h ASP 13 CO -0.09 0.86 -0.01 0.77 -2.88 0.00 0.00 179.24 177.90 2vml h SER 14 N 0.70 0.00 -0.59 2.28 4.64 -0.85 -0.95 113.55 118.78 2vml h SER 14 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2vml h SER 14 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2vml h SER 14 CO 0.01 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 2vml n GLN 15 N -3.50 2.74 -3.21 4.77 6.02 -1.00 -4.98 117.38 118.21 2vml n GLN 15 Ca -0.03 -2.45 -0.17 0.00 -0.01 0.00 0.00 57.00 54.35 2vml n GLN 15 Cb 0.09 -1.47 0.05 0.00 1.02 0.00 0.00 30.24 29.93 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 1.29 -0.10 3.11 1.08 0.00 -0.36 -4.98 105.19 105.23 2vml n GLY 16 Ca 0.20 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 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 -5.85 1.16 0.47 1.61 3.52 -0.28 -5.02 118.95 114.55 2vml s ARG 17 Ca 0.39 -0.51 -0.24 0.00 -0.13 0.00 0.00 55.73 55.24 2vml s ARG 17 Cb -0.17 -1.12 -0.07 0.00 -1.56 0.00 0.00 34.95 32.03 2vml s ARG 17 CO 0.48 0.30 1.28 -0.06 -0.81 0.00 0.00 175.30 176.50 2vml s PHE 18 N -0.32 2.65 0.32 5.12 0.08 -1.26 -4.31 117.98 120.26 2vml s PHE 18 Ca 0.05 1.43 -0.29 0.00 0.12 0.00 0.00 56.93 58.24 2vml s PHE 18 Cb -0.06 -3.64 -0.12 0.00 -0.57 0.00 0.00 43.02 38.64 2vml s PHE 18 CO -0.01 -2.20 1.55 1.28 -0.10 0.00 0.00 175.22 175.74 2vml n LEU 19 N -0.42 4.44 0.00 -0.37 4.77 -1.26 -4.98 117.00 119.18 2vml n LEU 19 Ca 0.07 1.18 -0.02 0.00 -0.03 0.00 0.00 56.01 57.20 2vml n LEU 19 Cb 0.45 -1.59 -0.01 0.00 -2.33 0.00 0.00 43.42 39.94 2vml n LEU 19 CO 0.53 0.12 -0.02 -0.46 -1.33 0.00 0.00 177.39 176.23 2vml n ASN 20 N 1.56 1.61 0.27 -1.43 0.23 -1.26 -5.00 115.26 111.24 2vml n ASN 20 Ca 0.06 -1.16 0.12 0.00 -0.53 0.00 0.00 54.58 53.07 2vml n ASN 20 Cb 0.37 0.05 0.78 0.00 -2.08 0.00 0.00 39.78 38.90 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 0.10 0.00 0.02 0.53 -0.73 -1.98 -1.09 115.58 112.42 2vml h ASN 21 Ca -0.03 0.00 0.02 0.00 1.87 0.00 0.00 56.30 58.16 2vml h ASN 21 Cb 0.09 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.66 2vml h ASN 21 CO 0.05 0.00 -0.13 0.74 -0.37 0.00 0.00 177.43 177.72 2vml h THR 22 N 0.00 0.68 -0.03 -3.57 2.02 -2.00 -1.98 112.91 108.03 2vml h THR 22 Ca 0.01 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 67.00 2vml h THR 22 Cb 0.06 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2vml h THR 22 CO -0.00 0.00 -0.80 -0.33 0.37 0.00 0.00 175.52 174.76 2vml h GLU 23 N -0.23 0.30 -0.34 6.66 3.07 -1.62 -3.09 114.58 119.33 2vml h GLU 23 Ca 0.04 -0.28 -0.12 0.00 -0.50 0.00 0.00 59.36 58.50 2vml h GLU 23 Cb 0.27 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 2vml h GLU 23 CO -0.12 0.95 -0.28 -0.07 -1.40 0.00 0.00 179.01 178.10 2vml h LEU 24 N 0.19 0.74 -0.49 1.33 3.38 -1.34 -1.33 115.31 117.78 2vml h LEU 24 Ca -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 2vml h LEU 24 Cb 1.40 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 2vml h LEU 24 CO 0.13 0.98 0.26 1.56 0.09 0.00 0.00 178.44 181.46 2vml h GLN 25 N 0.61 0.70 -0.09 1.13 4.20 -1.39 -1.38 115.11 118.90 2vml h GLN 25 Ca 0.08 -0.09 0.03 0.00 0.06 0.00 0.00 58.65 58.73 2vml h GLN 25 Cb 0.79 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 28.40 2vml h GLN 25 CO 0.07 0.56 -0.13 0.00 -0.67 0.00 0.00 178.83 178.65 2vml h ALA 26 N 1.10 -0.08 -0.98 3.87 0.00 -1.42 -2.49 119.26 119.25 2vml h ALA 26 Ca 0.17 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.21 2vml h ALA 26 Cb 0.07 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 18.05 2vml h ALA 26 CO -0.03 -0.60 0.62 0.00 0.00 0.00 0.00 179.25 179.25 2vml h ALA 27 N 0.85 1.42 -0.86 0.00 0.00 -1.10 -0.15 119.26 119.42 2vml h ALA 27 Ca 0.08 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2vml h ALA 27 Cb 0.29 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2vml h ALA 27 CO -0.20 0.31 0.56 -0.97 0.00 0.00 0.00 179.25 178.96 2vml h ASN 28 N 1.06 0.86 -0.96 0.00 -1.24 -0.99 -2.01 115.58 112.29 2vml h ASN 28 Ca 0.46 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.47 2vml h ASN 28 Cb 0.32 -0.18 -0.05 0.00 0.73 0.00 0.00 38.32 39.15 2vml h ASN 28 CO -0.22 0.56 0.60 1.23 -1.29 0.00 0.00 177.43 178.30 2vml h GLY 29 N 0.98 1.38 0.73 1.57 0.00 -0.58 0.47 103.07 107.62 2vml h GLY 29 Ca 0.36 -0.56 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2vml h GLY 29 CO -0.13 0.55 -0.01 -0.09 0.00 0.00 0.00 176.54 176.86 2vml h ARG 30 N 1.32 0.04 -0.20 4.80 1.12 -1.17 -2.60 114.38 117.69 2vml h ARG 30 Ca 0.35 -0.00 -0.17 0.00 -1.11 0.00 0.00 59.98 59.05 2vml h ARG 30 Cb -0.08 -0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 29.86 2vml h ARG 30 CO -0.07 0.03 -0.56 0.74 -3.11 0.00 0.00 179.97 177.00 2vml h PHE 31 N 0.04 0.77 -0.04 2.20 0.04 -0.90 -2.52 116.94 116.52 2vml h PHE 31 Ca 0.08 -0.28 -0.09 0.00 2.80 0.00 0.00 57.97 60.48 2vml h PHE 31 Cb 0.10 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2vml h PHE 31 CO -0.17 1.03 -0.41 0.37 -0.60 0.00 0.00 178.31 178.53 2vml h GLN 32 N 0.46 0.09 0.00 1.51 4.15 -0.95 -3.06 115.11 117.31 2vml h GLN 32 Ca 0.01 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.38 2vml h GLN 32 Cb 1.12 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.81 2vml h GLN 32 CO 0.11 0.49 -0.13 -0.09 -1.93 0.00 0.00 178.83 177.28 2vml h ARG 33 N 0.08 0.00 -0.97 1.69 9.65 -1.19 -3.37 114.38 120.27 2vml h ARG 33 Ca 0.01 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.01 2vml h ARG 33 Cb 0.76 0.00 -0.08 0.00 -1.39 0.00 0.00 29.97 29.26 2vml h ARG 33 CO 0.06 0.00 0.61 0.00 2.80 0.00 0.00 179.97 183.44 2vml h ALA 34 N 2.32 1.61 0.12 2.80 0.00 -1.35 -2.01 119.26 122.75 2vml h ALA 34 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2vml h ALA 34 Cb 0.84 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2vml h ALA 34 CO 0.00 0.15 -0.06 1.15 0.00 0.00 0.00 179.25 180.49 2vml h THR 35 N 0.91 0.92 -0.71 0.00 2.02 -1.78 0.10 112.91 114.38 2vml h THR 35 Ca 0.48 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.51 2vml h THR 35 Cb 0.54 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 2vml h THR 35 CO -0.24 0.04 0.45 0.00 0.37 0.00 0.00 175.52 176.13 2vml h ALA 36 N 0.64 0.90 -0.77 6.16 0.00 -1.76 -2.00 119.26 122.43 2vml h ALA 36 Ca -0.02 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2vml h ALA 36 Cb 0.19 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2vml h ALA 36 CO 0.03 0.35 0.38 0.77 0.00 0.00 0.00 179.25 180.77 2vml h SER 37 N 0.97 0.99 0.46 0.00 0.02 -1.11 -1.94 113.55 112.94 2vml h SER 37 Ca 0.26 -0.13 -0.17 0.00 -0.84 0.00 0.00 61.79 60.92 2vml h SER 37 Cb -0.08 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.20 2vml h SER 37 CO -0.05 0.84 -0.71 0.24 -1.14 0.00 0.00 176.83 176.01 2vml h MET 38 N 1.08 0.21 -0.58 3.45 2.86 -0.59 -0.95 114.93 120.41 2vml h MET 38 Ca 0.26 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 2vml h MET 38 Cb 0.10 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 2vml h MET 38 CO -0.04 0.84 0.14 1.49 1.06 0.00 0.00 176.91 180.41 2vml h GLU 39 N 0.14 0.93 -0.02 1.72 4.81 -1.18 -0.96 114.58 120.02 2vml h GLU 39 Ca -0.02 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2vml h GLU 39 Cb 1.27 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 2vml h GLU 39 CO 0.11 0.86 0.01 0.00 -0.73 0.00 0.00 179.01 179.26 2vml h ALA 40 N 1.03 0.02 -0.68 2.92 0.00 -1.19 -2.78 119.26 118.58 2vml h ALA 40 Ca 0.18 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.11 2vml h ALA 40 Cb 0.34 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2vml h ALA 40 CO 0.00 -0.47 0.42 0.00 0.00 0.00 0.00 179.25 179.21 2vml h ALA 41 N 0.98 0.89 -0.73 0.00 0.00 -0.97 -2.08 119.26 117.36 2vml h ALA 41 Ca 0.01 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2vml h ALA 41 Cb 0.02 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2vml h ALA 41 CO -0.00 0.18 0.47 0.00 0.00 0.00 0.00 179.25 179.90 2vml h ARG 42 N 0.82 0.91 -0.37 0.00 3.08 -1.14 -0.24 114.38 117.45 2vml h ARG 42 Ca 0.28 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 2vml h ARG 42 Cb 0.04 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 2vml h ARG 42 CO -0.11 0.60 -0.23 0.00 -1.07 0.00 0.00 179.97 179.16 2vml h ALA 43 N 1.29 0.52 -0.29 0.04 0.00 -1.17 -1.03 119.26 118.63 2vml h ALA 43 Ca 0.28 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 2vml h ALA 43 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2vml h ALA 43 CO -0.09 0.50 -0.28 -0.07 0.00 0.00 0.00 179.25 179.31 2vml h LEU 44 N 0.60 0.59 -0.15 0.00 4.07 -1.21 -2.00 115.31 117.22 2vml h LEU 44 Ca 0.08 -0.22 -0.04 0.00 0.08 0.00 0.00 57.88 57.77 2vml h LEU 44 Cb 0.79 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.36 2vml h LEU 44 CO 0.06 0.85 -0.06 0.74 -1.08 0.00 0.00 178.44 178.95 2vml h THR 45 N 0.50 1.31 0.00 0.22 2.02 -0.95 -2.56 112.91 113.45 2vml h THR 45 Ca 0.07 -1.09 -0.12 0.00 0.77 0.00 0.00 66.41 66.04 2vml h THR 45 Cb 0.75 1.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 2vml h THR 45 CO 0.06 0.32 -0.55 0.77 0.37 0.00 0.00 175.52 176.49 2vml h SER 46 N -0.02 0.00 -0.55 4.18 4.64 -1.14 -2.82 113.55 117.85 2vml h SER 46 Ca 0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2vml h SER 46 Cb 0.53 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2vml h SER 46 CO 0.02 0.55 0.01 -3.20 -0.87 0.00 0.00 176.83 173.34 2vml n ASN 47 N -3.64 5.49 -0.11 4.97 5.15 -0.76 -4.70 115.26 121.67 2vml n ASN 47 Ca -0.01 -2.89 -0.09 0.00 -0.60 0.00 0.00 54.58 50.99 2vml n ASN 47 Cb 0.61 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.16 2vml n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vml h ALA 48 N 3.88 0.44 -0.30 5.20 0.00 -1.18 -1.23 119.26 126.07 2vml h ALA 48 Ca 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2vml h ALA 48 Cb 1.92 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 2vml h ALA 48 CO 0.48 0.01 0.18 -0.44 0.00 0.00 0.00 179.25 179.47 2vml h ASP 49 N 0.41 0.30 0.77 0.00 3.32 -1.84 -0.36 116.42 119.02 2vml h ASP 49 Ca 0.12 -0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.99 2vml h ASP 49 Cb 0.13 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2vml h ASP 49 CO -0.01 0.22 -0.81 0.77 -1.72 0.00 0.00 179.24 177.68 2vml h SER 50 N 0.37 0.04 -0.21 6.45 4.64 -1.90 -1.75 113.55 121.19 2vml h SER 50 Ca 0.11 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 2vml h SER 50 Cb -0.02 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 2vml h SER 50 CO -0.04 0.83 0.03 -0.07 -0.87 0.00 0.00 176.83 176.71 2vml h LEU 51 N 0.02 0.34 0.13 5.97 3.38 -1.01 -1.95 115.31 122.18 2vml h LEU 51 Ca -0.01 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 2vml h LEU 51 Cb 1.43 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 2vml h LEU 51 CO 0.11 0.52 -0.08 0.58 0.09 0.00 0.00 178.44 179.66 2vml h VAL 52 N 0.15 0.82 -0.41 1.22 2.07 -1.07 -2.30 116.25 116.73 2vml h VAL 52 Ca 0.06 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.65 2vml h VAL 52 Cb 0.33 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 2vml h VAL 52 CO 0.00 0.00 0.07 0.50 0.02 0.00 0.00 177.57 178.17 2vml h LYS 53 N -0.21 0.19 -0.12 1.57 3.64 -1.31 -1.25 116.57 119.08 2vml h LYS 53 Ca -0.01 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 2vml h LYS 53 Cb 0.18 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2vml h LYS 53 CO 0.01 0.13 -0.40 0.78 -2.27 0.00 0.00 179.45 177.70 2vml h GLY 54 N 0.20 0.30 0.69 5.01 0.00 -1.39 -2.47 103.07 105.41 2vml h GLY 54 Ca 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2vml h GLY 54 CO -0.27 0.25 -0.02 0.00 0.00 0.00 0.00 176.54 176.50 2vml h ALA 55 N 1.36 0.10 -0.66 3.60 0.00 -0.91 -1.66 119.26 121.10 2vml h ALA 55 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2vml h ALA 55 Cb 0.81 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 2vml h ALA 55 CO 0.06 -0.18 0.41 0.28 0.00 0.00 0.00 179.25 179.83 2vml h VAL 56 N -0.20 1.09 -0.15 0.00 2.07 -1.24 -1.85 116.25 115.98 2vml h VAL 56 Ca 0.02 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 2vml h VAL 56 Cb 0.42 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2vml h VAL 56 CO 0.01 0.15 -0.31 -0.61 0.02 0.00 0.00 177.57 176.83 2vml h GLN 57 N 0.81 0.29 -0.08 1.57 5.75 -1.43 -2.51 115.11 119.51 2vml h GLN 57 Ca 0.26 -0.11 -0.10 0.00 -0.15 0.00 0.00 58.65 58.55 2vml h GLN 57 Cb 0.01 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2vml h GLN 57 CO -0.10 0.58 -0.42 1.49 -2.65 0.00 0.00 178.83 177.72 2vml h GLU 58 N 0.26 0.18 -0.29 1.69 4.57 -0.73 -0.56 114.58 119.69 2vml h GLU 58 Ca 0.04 -0.09 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2vml h GLU 58 Cb 0.68 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.25 2vml h GLU 58 CO 0.05 0.58 0.18 0.28 -1.18 0.00 0.00 179.01 178.92 2vml h VAL 59 N 0.15 1.06 -0.04 0.32 2.07 -0.92 -1.28 116.25 117.62 2vml h VAL 59 Ca 0.01 -0.13 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 2vml h VAL 59 Cb 0.81 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 2vml h VAL 59 CO 0.06 0.07 -0.38 1.88 0.02 0.00 0.00 177.57 179.22 2vml h TYR 60 N 0.38 0.08 -0.13 1.57 0.05 -1.21 -0.09 116.97 117.61 2vml h TYR 60 Ca 0.11 -0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.72 2vml h TYR 60 Cb -0.03 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 2vml h TYR 60 CO -0.06 0.45 -0.55 -0.91 -1.05 0.00 0.00 178.16 176.04 2vml h ASN 61 N 0.06 0.44 0.71 3.88 2.35 -0.92 -2.85 115.58 119.25 2vml h ASN 61 Ca 0.00 -0.23 -0.26 0.00 -0.55 0.00 0.00 56.30 55.26 2vml h ASN 61 Cb 0.71 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 2vml h ASN 61 CO 0.05 0.90 -1.22 0.50 -1.65 0.00 0.00 177.43 176.02 2vml h LYS 62 N 0.30 0.19 -2.21 0.81 1.63 -0.95 -3.38 116.57 112.96 2vml h LYS 62 Ca 0.00 -0.33 -0.59 0.00 -0.85 0.00 0.00 60.65 58.89 2vml h LYS 62 Cb 1.06 0.12 -0.41 0.00 -0.60 0.00 0.00 32.23 32.40 2vml h LYS 62 CO 0.09 1.14 -0.75 1.19 -3.45 0.00 0.00 179.45 177.67 2vml n PHE 63 N -3.47 2.32 0.26 1.91 3.72 -0.07 -4.98 117.46 117.16 2vml n PHE 63 Ca -0.07 -3.97 0.11 0.00 -0.05 0.00 0.00 57.45 53.46 2vml n PHE 63 Cb 1.00 -0.47 0.72 0.00 -0.94 0.00 0.00 39.48 39.79 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 -0.01 -1.08 0.11 -1.70 -2.00 132.00 131.59 2vml h PRO 64 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2vml h PRO 64 Cb 0.74 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.85 2vml h PRO 64 CO 0.71 0.07 0.06 0.10 -0.21 0.00 0.00 178.00 178.73 2vml h TYR 65 N 0.00 0.00 -0.04 0.65 -0.00 -1.94 -3.00 116.97 112.65 2vml h TYR 65 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.73 58.69 2vml h TYR 65 Cb 0.14 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.87 2vml h TYR 65 CO 0.00 0.00 -0.17 -0.07 -0.00 0.00 0.00 178.16 177.92 2vml h LEU 66 N 0.00 0.05 -0.81 0.10 3.38 -1.71 -2.67 115.31 113.65 2vml h LEU 66 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vml h LEU 66 Cb 0.13 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2vml h LEU 66 CO -0.00 0.23 0.00 0.35 0.09 0.00 0.00 178.44 179.11 2vml n THR 67 N -4.31 0.08 -2.80 0.22 -2.24 -1.13 -0.60 114.28 103.50 2vml n THR 67 Ca -0.02 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.19 2vml n THR 67 Cb 0.25 0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.67 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 -1.92 4.25 0.21 -0.78 -1.52 -1.01 -4.61 119.66 114.29 2vml s GLN 68 Ca 0.36 1.16 -0.31 0.00 -1.95 0.00 0.00 55.36 54.62 2vml s GLN 68 Cb 0.19 -2.26 -0.15 0.00 -0.22 0.00 0.00 33.01 30.57 2vml s GLN 68 CO 0.30 -0.01 1.05 -2.30 -0.25 0.00 0.00 175.29 174.08 2vml n PRO 69 N -0.50 1.11 -0.29 2.91 -0.02 -1.26 -1.49 135.00 135.47 2vml n PRO 69 Ca 0.06 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2vml n PRO 69 Cb 0.53 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 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 1.73 1.75 3.97 -1.23 0.00 -1.26 -5.04 105.19 105.11 2vml n GLY 70 Ca 0.13 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 -0.24 2.92 0.00 1.61 -1.52 -0.55 -5.02 119.66 116.85 2vml s GLN 71 Ca 0.00 -1.17 0.30 0.00 -1.95 0.00 0.00 55.36 52.54 2vml s GLN 71 Cb 0.00 -2.72 1.50 0.00 -0.22 0.00 0.00 33.01 31.57 2vml s GLN 71 CO 0.00 -0.08 2.01 -1.33 -0.25 0.00 0.00 175.29 175.64 2vml n MET 72 N -1.68 0.92 -0.42 2.91 2.81 -1.24 -2.54 117.12 117.87 2vml n MET 72 Ca 0.03 -0.22 0.08 0.00 -1.81 0.00 0.00 57.70 55.78 2vml n MET 72 Cb 0.59 -1.50 0.28 0.00 -0.71 0.00 0.00 33.22 31.88 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 1.16 2.94 3.72 3.03 0.00 0.23 -4.71 105.19 111.55 2vml n GLY 73 Ca 0.19 -0.73 -0.36 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 -1.64 3.43 0.00 1.61 5.04 -1.05 -4.36 117.35 120.38 2vml s TYR 74 Ca 0.41 0.49 0.00 0.00 -2.44 0.00 0.00 57.07 55.53 2vml s TYR 74 Cb 0.26 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 40.28 2vml s TYR 74 CO 0.21 0.23 0.00 0.41 -1.34 0.00 0.00 175.55 175.06 2vml n GLY 75 N 3.51 2.15 0.34 8.97 0.00 -1.26 -4.36 105.19 114.55 2vml n GLY 75 Ca -0.13 -1.79 0.05 0.00 0.00 0.00 0.00 46.02 44.15 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 0.67 0.07 1.61 3.32 -1.98 -2.28 116.42 117.83 2vml h ASP 76 Ca 0.00 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2vml h ASP 76 Cb 0.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 2vml h ASP 76 CO 0.00 0.46 -0.03 0.74 -1.72 0.00 0.00 179.24 178.69 2vml h THR 77 N 0.78 1.19 -0.69 0.35 2.02 -1.99 -0.02 112.91 114.55 2vml h THR 77 Ca 0.27 -0.96 0.06 0.00 0.77 0.00 0.00 66.41 66.55 2vml h THR 77 Cb 0.11 1.80 -0.05 0.00 -1.74 0.00 0.00 68.15 68.27 2vml h THR 77 CO -0.08 0.23 0.40 0.78 0.37 0.00 0.00 175.52 177.22 2vml h ASN 78 N -0.53 0.60 0.59 4.18 2.35 -1.75 -1.23 115.58 119.80 2vml h ASN 78 Ca -0.01 0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.64 2vml h ASN 78 Cb 0.46 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 2vml h ASN 78 CO 0.02 0.39 -0.58 1.56 -1.65 0.00 0.00 177.43 177.17 2vml h GLN 79 N 0.74 0.00 -0.26 0.81 4.20 -1.39 -2.45 115.11 116.76 2vml h GLN 79 Ca 0.31 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.83 2vml h GLN 79 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 2vml h GLN 79 CO -0.17 0.58 -0.57 0.00 -0.67 0.00 0.00 178.83 177.99 2vml h ALA 80 N 1.42 0.50 -0.13 3.87 0.00 -0.60 -2.69 119.26 121.64 2vml h ALA 80 Ca -0.01 -0.52 -0.07 0.00 0.00 0.00 0.00 54.91 54.31 2vml h ALA 80 Cb 1.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2vml h ALA 80 CO 0.07 0.68 -0.24 0.87 0.00 0.00 0.00 179.25 180.64 2vml h LYS 81 N 0.62 0.22 -0.06 0.00 1.57 -1.19 -1.70 116.57 116.03 2vml h LYS 81 Ca 0.01 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2vml h LYS 81 Cb 1.17 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 2vml h LYS 81 CO 0.12 0.46 0.02 0.00 -0.57 0.00 0.00 179.45 179.48 2vml h ALA 83 N 0.86 1.07 0.07 0.00 0.00 -1.36 -1.04 119.26 118.85 2vml h ALA 83 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2vml h ALA 83 Cb 0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2vml h ALA 83 CO -0.00 0.63 -0.06 -0.09 0.00 0.00 0.00 179.25 179.73 2vml h ARG 84 N 1.01 -0.14 -0.45 0.00 2.43 -1.30 -1.57 114.38 114.36 2vml h ARG 84 Ca 0.22 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 2vml h ARG 84 Cb 0.31 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2vml h ARG 84 CO -0.01 -0.09 0.23 -0.44 -1.51 0.00 0.00 179.97 178.16 2vml h ASP 85 N -0.14 0.58 -0.32 -3.80 5.19 -0.93 0.27 116.42 117.27 2vml h ASP 85 Ca 0.00 -0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.25 2vml h ASP 85 Cb 0.13 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.48 2vml h ASP 85 CO -0.01 0.52 0.03 0.40 -3.12 0.00 0.00 179.24 177.05 2vml h ILE 86 N 0.59 1.21 -0.53 0.35 2.04 -1.21 -2.31 117.51 117.65 2vml h ILE 86 Ca 0.16 -0.84 -0.12 0.00 1.00 0.00 0.00 64.86 65.06 2vml h ILE 86 Cb 0.08 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2vml h ILE 86 CO -0.02 0.30 -0.13 -1.28 0.00 0.00 0.00 178.15 177.01 2vml h SER 87 N 0.62 1.02 -0.28 1.72 0.87 -0.89 -2.05 113.55 114.56 2vml h SER 87 Ca 0.13 -0.35 0.06 0.00 -1.23 0.00 0.00 61.79 60.40 2vml h SER 87 Cb 0.35 -0.28 -0.08 0.00 -0.44 0.00 0.00 62.40 61.95 2vml h SER 87 CO 0.01 1.14 -0.44 0.45 -0.53 0.00 0.00 176.83 177.46 2vml h HIS 88 N 0.90 -1.29 -0.57 2.24 3.86 -0.50 0.16 115.15 119.96 2vml h HIS 88 Ca 0.13 0.06 0.07 0.00 -1.16 0.00 0.00 60.37 59.48 2vml h HIS 88 Cb 0.70 0.60 -0.06 0.00 1.06 0.00 0.00 27.41 29.71 2vml h HIS 88 CO 0.05 -0.47 0.24 1.88 0.86 0.00 0.00 177.93 180.49 2vml h TYR 89 N -0.41 0.43 -0.49 2.45 0.05 -1.25 0.69 116.97 118.45 2vml h TYR 89 Ca 0.10 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.84 2vml h TYR 89 Cb 0.61 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2vml h TYR 89 CO -0.58 0.16 0.02 1.25 -1.05 0.00 0.00 178.16 177.96 2vml h LEU 90 N 0.45 0.83 -0.39 3.88 5.85 -1.10 -1.46 115.31 123.36 2vml h LEU 90 Ca 0.27 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2vml h LEU 90 Cb 0.27 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2vml h LEU 90 CO -0.24 0.92 0.24 -0.09 -0.34 0.00 0.00 178.44 178.93 2vml h ARG 91 N 0.71 0.53 0.00 1.25 2.43 -0.03 -1.59 114.38 117.68 2vml h ARG 91 Ca 0.14 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2vml h ARG 91 Cb 0.48 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2vml h ARG 91 CO 0.02 0.39 -0.13 0.74 -1.51 0.00 0.00 179.97 179.48 2vml h PHE 92 N 0.52 0.00 -0.24 2.20 0.04 -0.76 -1.58 116.94 117.11 2vml h PHE 92 Ca 0.14 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.82 2vml h PHE 92 Cb -0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.14 2vml h PHE 92 CO -0.04 0.13 -0.22 0.82 -0.60 0.00 0.00 178.31 178.41 2vml h ILE 93 N 0.00 1.31 -0.29 -0.55 2.04 -0.99 -1.95 117.51 117.08 2vml h ILE 93 Ca -0.00 -1.37 -0.07 0.00 1.00 0.00 0.00 64.86 64.42 2vml h ILE 93 Cb 0.66 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.38 2vml h ILE 93 CO 0.02 0.43 -0.11 0.71 0.00 0.00 0.00 178.15 179.20 2vml h THR 94 N 0.29 1.22 -0.31 -0.27 1.35 -0.95 -1.29 112.91 112.96 2vml h THR 94 Ca 0.04 -0.97 -0.06 0.00 -0.55 0.00 0.00 66.41 64.87 2vml h THR 94 Cb 0.77 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 2vml h THR 94 CO 0.06 0.32 -0.05 1.88 -0.25 0.00 0.00 175.52 177.47 2vml h TYR 95 N 0.45 0.65 -0.48 4.73 0.05 -1.28 -1.60 116.97 119.50 2vml h TYR 95 Ca 0.09 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 2vml h TYR 95 Cb 0.46 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 2vml h TYR 95 CO 0.01 0.75 0.27 0.77 -1.05 0.00 0.00 178.16 178.92 2vml h SER 96 N 0.36 0.58 0.01 3.88 0.02 -1.18 0.15 113.55 117.37 2vml h SER 96 Ca 0.08 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2vml h SER 96 Cb 0.53 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.87 2vml h SER 96 CO 0.03 0.49 -0.26 -0.07 -1.14 0.00 0.00 176.83 175.87 2vml h LEU 97 N 0.63 -0.78 -1.27 5.07 3.38 -1.16 -2.23 115.31 118.95 2vml h LEU 97 Ca 0.17 0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.17 2vml h LEU 97 Cb 0.02 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2vml h LEU 97 CO -0.03 -0.33 -0.37 0.58 0.09 0.00 0.00 178.44 178.38 2vml h VAL 98 N -0.41 1.26 0.00 1.22 2.07 -1.09 -3.20 116.25 116.11 2vml h VAL 98 Ca 0.06 -1.26 0.00 0.00 0.82 0.00 0.00 66.70 66.32 2vml h VAL 98 Cb 0.49 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2vml h VAL 98 CO -0.23 0.36 -0.13 0.00 0.02 0.00 0.00 177.57 177.59 2vml h ALA 99 N 1.63 0.92 -0.96 1.67 0.00 -0.34 -3.48 119.26 118.70 2vml h ALA 99 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2vml h ALA 99 Cb 0.65 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.44 2vml h ALA 99 CO 0.05 0.00 -0.10 0.41 0.00 0.00 0.00 179.25 179.61 2vml n GLY 100 N 1.22 0.40 0.00 0.00 0.00 -0.87 -4.68 105.19 101.26 2vml n GLY 100 Ca 0.04 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.92 0.24 0.06 -0.02 0.00 -1.11 -2.26 105.19 101.19 2vml n GLY 101 Ca -0.03 -0.94 0.14 0.00 0.00 0.00 0.00 46.02 45.20 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 0.00 -0.31 2.61 -2.24 -1.24 -4.42 114.28 108.47 2vml n THR 102 Ca 0.00 -0.03 0.04 0.00 -2.27 0.00 0.00 64.05 61.79 2vml n THR 102 Cb 0.00 -0.21 0.13 0.00 -2.10 0.00 0.00 70.33 68.14 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 4.98 0.67 0.85 3.38 0.00 -1.53 0.13 103.07 111.55 2vml h GLY 103 Ca 0.00 0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.64 2vml h GLY 103 CO 0.00 -0.34 0.44 -2.55 0.00 0.00 0.00 176.54 174.09 2vml h PRO 104 N 0.01 0.83 -0.35 4.80 0.11 -1.81 -0.30 132.00 135.28 2vml h PRO 104 Ca 0.43 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.42 2vml h PRO 104 Cb 0.67 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 2vml h PRO 104 CO -0.89 0.55 -0.05 -0.07 -0.21 0.00 0.00 178.00 177.33 2vml h LEU 105 N 0.86 0.65 -0.60 2.35 3.38 -1.38 -2.30 115.31 118.26 2vml h LEU 105 Ca 0.29 -0.34 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2vml h LEU 105 Cb 0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2vml h LEU 105 CO -0.12 0.84 0.37 0.44 0.09 0.00 0.00 178.44 180.06 2vml h ASP 106 N 0.44 0.59 0.92 -0.43 3.32 -0.78 -0.04 116.42 120.45 2vml h ASP 106 Ca 0.09 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.93 2vml h ASP 106 Cb 0.54 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 2vml h ASP 106 CO 0.03 0.41 -1.11 0.44 -1.72 0.00 0.00 179.24 177.29 2vml h ASP 107 N 0.72 0.00 0.00 6.45 5.19 -1.05 -1.36 116.42 126.37 2vml h ASP 107 Ca 0.25 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.54 2vml h ASP 107 Cb 0.03 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 2vml h ASP 107 CO -0.11 0.98 -1.63 -1.22 -3.12 0.00 0.00 179.24 174.14 2vml n TYR 108 N -3.29 0.00 -0.03 4.55 4.01 -0.87 -4.65 117.16 116.88 2vml n TYR 108 Ca -0.03 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.63 2vml n TYR 108 Cb 0.95 -0.40 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 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 0.70 -0.07 -0.72 5.41 -0.47 -4.88 119.36 117.17 2vml n ILE 109 Ca -0.11 -0.02 -0.15 0.00 1.00 0.00 0.00 62.75 63.47 2vml n ILE 109 Cb 0.61 -1.68 -0.05 0.00 -0.71 0.00 0.00 39.64 37.81 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 -0.33 1.30 -2.71 1.39 2.07 -1.11 -3.32 116.25 113.54 2vml h VAL 110 Ca -0.18 -1.70 -0.56 0.00 0.82 0.00 0.00 66.70 65.08 2vml h VAL 110 Cb 0.99 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 2vml h VAL 110 CO -0.11 0.54 1.09 0.00 0.02 0.00 0.00 177.57 179.12 2vml s ALA 111 N -4.07 3.43 0.00 1.67 0.00 -0.51 -2.20 121.76 120.08 2vml s ALA 111 Ca -0.11 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.49 2vml s ALA 111 Cb 0.09 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.42 2vml s ALA 111 CO 0.87 -1.67 0.00 0.41 0.00 0.00 0.00 175.76 175.36 2vml n GLY 112 N 4.37 0.75 0.34 0.00 0.00 -1.26 -4.85 105.19 104.54 2vml n GLY 112 Ca 0.18 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 -0.92 -0.50 0.99 5.85 -1.54 -1.37 115.31 117.83 2vml h LEU 113 Ca 0.00 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 2vml h LEU 113 Cb 0.00 0.34 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2vml h LEU 113 CO 0.00 -0.42 -0.07 0.03 -0.34 0.00 0.00 178.44 177.64 2vml h ARG 114 N -0.56 0.92 -0.41 1.25 3.08 -1.92 -1.17 114.38 115.57 2vml h ARG 114 Ca 0.02 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 2vml h ARG 114 Cb 0.58 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2vml h ARG 114 CO -0.17 0.98 0.23 0.93 -1.07 0.00 0.00 179.97 180.87 2vml h GLU 115 N 0.78 0.57 0.19 0.04 3.07 -1.95 -0.42 114.58 116.87 2vml h GLU 115 Ca 0.13 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 2vml h GLU 115 Cb 0.61 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2vml h GLU 115 CO 0.04 0.45 -0.09 0.28 -1.40 0.00 0.00 179.01 178.28 2vml h VAL 116 N 0.53 0.87 -0.42 3.13 2.07 -1.18 -2.30 116.25 118.95 2vml h VAL 116 Ca 0.14 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2vml h VAL 116 Cb 0.04 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2vml h VAL 116 CO -0.02 0.08 0.22 0.78 0.02 0.00 0.00 177.57 178.65 2vml h ASN 117 N -0.43 0.51 -0.24 0.57 2.35 -1.15 -1.63 115.58 115.55 2vml h ASN 117 Ca -0.03 -0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 2vml h ASN 117 Cb 0.33 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2vml h ASN 117 CO 0.04 0.42 -0.10 -0.09 -1.65 0.00 0.00 177.43 176.05 2vml h ARG 118 N 0.58 0.50 -0.58 0.81 2.43 -1.04 0.17 114.38 117.25 2vml h ARG 118 Ca 0.15 -0.21 -0.11 0.00 -0.81 0.00 0.00 59.98 59.00 2vml h ARG 118 Cb 0.03 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 2vml h ARG 118 CO -0.02 0.76 -0.06 1.15 -1.51 0.00 0.00 179.97 180.28 2vml h THR 119 N 0.23 1.27 -0.40 0.20 2.02 -1.06 -3.04 112.91 112.11 2vml h THR 119 Ca 0.06 -1.22 0.00 0.00 0.77 0.00 0.00 66.41 66.01 2vml h THR 119 Cb 0.60 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 2vml h THR 119 CO 0.03 0.44 0.00 0.49 0.37 0.00 0.00 175.52 176.85 2vml n PHE 120 N -4.16 0.53 -3.59 3.16 3.72 -0.65 -4.96 117.46 111.51 2vml n PHE 120 Ca 0.02 -0.26 -0.22 0.00 -0.05 0.00 0.00 57.45 56.94 2vml n PHE 120 Cb 0.38 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.99 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 1.04 -3.71 -4.61 4.37 3.02 -0.30 -4.98 115.26 110.09 2vml n ASN 121 Ca 0.18 -0.65 -0.38 0.00 -0.03 0.00 0.00 54.58 53.71 2vml n ASN 121 Cb 0.48 -4.77 -0.11 0.00 -0.61 0.00 0.00 39.78 34.77 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 -6.85 4.05 -0.09 3.41 1.43 0.44 -5.03 118.68 116.03 2vml s LEU 122 Ca 0.28 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.12 2vml s LEU 122 Cb -0.13 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 2vml s LEU 122 CO 0.76 -0.03 1.04 -0.44 0.23 0.00 0.00 176.35 177.91 2vml s SER 123 N 1.58 7.22 0.57 2.29 0.01 -1.26 -4.59 113.70 119.51 2vml s SER 123 Ca 0.08 1.58 0.28 0.00 1.31 0.00 0.00 55.95 59.20 2vml s SER 123 Cb -0.15 -2.56 1.52 0.00 0.21 0.00 0.00 66.02 65.03 2vml s SER 123 CO 0.09 -0.46 2.00 1.55 0.41 0.00 0.00 173.24 176.83 2vml h PRO 124 N 7.14 0.00 -0.44 12.44 0.13 -1.96 -2.48 132.00 146.83 2vml h PRO 124 Ca -0.32 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 2vml h PRO 124 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2vml h PRO 124 CO 0.86 0.00 0.11 0.66 -0.23 0.00 0.00 178.00 179.40 2vml h SER 125 N 0.00 0.61 -0.08 1.44 4.64 -1.91 0.34 113.55 118.58 2vml h SER 125 Ca 0.18 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2vml h SER 125 Cb 0.89 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2vml h SER 125 CO -0.00 0.60 0.05 -0.50 -0.87 0.00 0.00 176.83 176.11 2vml h TRP 126 N 0.64 0.10 -0.36 4.77 6.55 -1.86 -1.72 115.95 124.09 2vml h TRP 126 Ca 0.15 0.00 -0.14 0.00 0.95 0.00 0.00 58.89 59.85 2vml h TRP 126 Cb 0.23 -0.03 -0.01 0.00 -0.86 0.00 0.00 29.16 28.49 2vml h TRP 126 CO 0.01 0.08 -0.33 1.88 -1.05 0.00 0.00 178.44 179.02 2vml h TYR 127 N 0.10 0.95 -0.70 0.49 0.05 -1.51 -1.17 116.97 115.17 2vml h TYR 127 Ca 0.03 -0.26 -0.00 0.00 0.05 0.00 0.00 58.73 58.55 2vml h TYR 127 Cb -0.00 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.50 2vml h TYR 127 CO -0.07 1.03 0.42 0.82 -1.05 0.00 0.00 178.16 179.31 2vml h ILE 128 N 0.67 1.20 -0.47 -2.88 2.04 -0.90 -0.76 117.51 116.42 2vml h ILE 128 Ca 0.07 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.41 2vml h ILE 128 Cb 0.88 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 2vml h ILE 128 CO 0.08 0.21 0.04 -0.08 0.00 0.00 0.00 178.15 178.40 2vml h GLU 129 N 0.96 0.80 -0.72 2.37 4.57 -1.11 0.04 114.58 121.49 2vml h GLU 129 Ca 0.25 -0.23 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2vml h GLU 129 Cb -0.02 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.44 2vml h GLU 129 CO -0.05 0.83 0.46 0.00 -1.18 0.00 0.00 179.01 179.07 2vml h ALA 130 N 0.94 0.93 -0.26 2.92 0.00 -1.00 -1.48 119.26 121.31 2vml h ALA 130 Ca 0.14 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 2vml h ALA 130 Cb 0.44 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2vml h ALA 130 CO 0.02 0.26 -0.55 -0.07 0.00 0.00 0.00 179.25 178.91 2vml h LEU 131 N 0.91 0.86 -0.95 0.00 3.38 -0.99 -1.70 115.31 116.82 2vml h LEU 131 Ca 0.28 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2vml h LEU 131 Cb -0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 2vml h LEU 131 CO -0.09 1.23 0.28 0.11 0.09 0.00 0.00 178.44 180.06 2vml h LYS 132 N 0.59 1.04 -0.15 1.13 1.57 -0.86 -0.98 116.57 118.91 2vml h LYS 132 Ca 0.01 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2vml h LYS 132 Cb 1.14 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 2vml h LYS 132 CO 0.12 0.85 0.04 1.25 -0.57 0.00 0.00 179.45 181.14 2vml h HIS 133 N 1.02 0.25 -0.82 -1.35 2.76 -1.14 -2.01 115.15 113.86 2vml h HIS 133 Ca 0.24 -0.03 0.10 0.00 -2.20 0.00 0.00 60.37 58.48 2vml h HIS 133 Cb 0.19 -0.07 -0.07 0.00 1.55 0.00 0.00 27.41 29.01 2vml h HIS 133 CO 0.02 0.36 0.46 0.82 -1.30 0.00 0.00 177.93 178.29 2vml h ILE 134 N 0.06 0.89 -0.73 6.26 2.04 -1.23 -2.48 117.51 122.33 2vml h ILE 134 Ca 0.05 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 2vml h ILE 134 Cb 0.23 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.34 2vml h ILE 134 CO -0.00 0.14 0.43 0.50 0.00 0.00 0.00 178.15 179.22 2vml h LYS 135 N 0.77 1.00 -0.55 2.37 3.64 -1.02 -0.07 116.57 122.70 2vml h LYS 135 Ca 0.40 -0.10 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 2vml h LYS 135 Cb 0.38 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 31.95 2vml h LYS 135 CO -0.25 0.72 0.30 0.78 -2.27 0.00 0.00 179.45 178.72 2vml h GLY 136 N 1.00 0.78 1.01 5.01 0.00 -1.04 -2.43 103.07 107.40 2vml h GLY 136 Ca 0.26 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 2vml h GLY 136 CO -0.05 0.14 -0.40 0.50 0.00 0.00 0.00 176.54 176.73 2vml h LYS 137 N 0.57 0.73 -0.11 4.80 1.79 -0.99 -2.98 116.57 120.38 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 0.12 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.80 2vml h LYS 137 CO -0.15 1.06 -0.04 0.28 -1.08 0.00 0.00 179.45 179.52 2vml h VAL 138 N 0.46 1.10 -0.09 0.50 2.07 -1.01 -2.49 116.25 116.79 2vml h VAL 138 Ca 0.02 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.16 2vml h VAL 138 Cb 0.99 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 2vml h VAL 138 CO 0.09 0.13 0.16 1.23 0.02 0.00 0.00 177.57 179.20 2vml h GLY 139 N 0.44 0.00 0.12 2.17 0.00 -1.27 -1.01 103.07 103.52 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 -1.04 1.44 0.00 0.00 0.00 176.54 176.95 2vml n SER 140 N -3.47 0.85 -0.02 0.19 7.64 -0.94 -4.44 113.62 113.43 2vml n SER 140 Ca -0.01 -0.81 0.03 0.00 1.01 0.00 0.00 58.87 59.10 2vml n SER 140 Cb 0.25 1.01 -0.14 0.00 -1.01 0.00 0.00 64.21 64.31 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 -1.58 0.66 -4.22 1.43 6.02 -0.47 -4.99 117.38 114.22 2vml n GLN 141 Ca 0.03 -0.07 -0.14 0.00 -0.01 0.00 0.00 57.00 56.82 2vml n GLN 141 Cb 0.36 -1.58 -0.10 0.00 1.02 0.00 0.00 30.24 29.94 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 -5.02 2.51 0.26 1.08 1.43 -0.70 -5.07 118.68 113.16 2vml s LEU 142 Ca -0.07 -0.98 -0.07 0.00 -1.03 0.00 0.00 54.13 51.98 2vml s LEU 142 Cb 0.11 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 46.01 2vml s LEU 142 CO 0.87 -0.34 0.37 -0.94 0.23 0.00 0.00 176.35 176.54 2vml s SER 143 N -3.02 0.24 0.90 2.29 1.04 -1.26 -4.72 113.70 109.16 2vml s SER 143 Ca 0.14 -1.21 0.00 0.00 0.48 0.00 0.00 55.95 55.36 2vml s SER 143 Cb 0.02 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2vml s SER 143 CO -0.00 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.74 2vml n GLY 144 N -0.39 1.81 0.20 7.32 0.00 -1.26 -3.19 105.19 109.67 2vml n GLY 144 Ca 0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 46.02 45.44 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 0.35 -0.80 1.61 1.08 -1.99 -1.68 115.11 113.68 2vml h GLN 145 Ca 0.00 -0.18 0.13 0.00 -1.45 0.00 0.00 58.65 57.15 2vml h GLN 145 Cb 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.35 2vml h GLN 145 CO 0.00 0.72 0.40 -1.35 -0.95 0.00 0.00 178.83 177.65 2vml h PRO 146 N 0.29 0.60 -0.16 1.46 0.11 -1.73 -0.17 132.00 132.38 2vml h PRO 146 Ca 0.02 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2vml h PRO 146 Cb 0.88 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.84 2vml h PRO 146 CO 0.07 0.39 0.11 1.25 -0.21 0.00 0.00 178.00 179.61 2vml h LEU 147 N 0.61 0.19 -0.92 2.35 5.85 -1.38 -1.40 115.31 120.62 2vml h LEU 147 Ca 0.42 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.18 2vml h LEU 147 Cb 0.55 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 2vml h LEU 147 CO -0.33 0.15 0.59 0.74 -0.34 0.00 0.00 178.44 179.24 2vml h THR 148 N 0.22 1.10 -0.04 1.05 2.02 -0.96 0.73 112.91 117.04 2vml h THR 148 Ca 0.06 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.86 2vml h THR 148 Cb -0.01 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.30 2vml h THR 148 CO -0.01 0.20 0.02 -0.33 0.37 0.00 0.00 175.52 175.77 2vml h GLU 149 N 1.10 0.05 -0.14 6.66 4.39 -0.96 -2.08 114.58 123.60 2vml h GLU 149 Ca 0.38 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.08 2vml h GLU 149 Cb 0.09 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 2vml h GLU 149 CO -0.15 0.13 0.09 0.00 -1.16 0.00 0.00 179.01 177.92 2vml h ALA 150 N 0.92 0.18 -0.98 3.43 0.00 -0.74 -2.95 119.26 119.13 2vml h ALA 150 Ca 0.01 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.95 2vml h ALA 150 Cb 0.09 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2vml h ALA 150 CO -0.00 -0.33 0.63 -0.91 0.00 0.00 0.00 179.25 178.64 2vml h ASN 151 N 0.18 1.04 -0.25 0.00 2.35 -0.90 -1.64 115.58 116.37 2vml h ASN 151 Ca 0.05 -0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 2vml h ASN 151 Cb -0.01 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.10 2vml h ASN 151 CO -0.01 0.70 0.04 0.00 -1.65 0.00 0.00 177.43 176.51 2vml h ALA 152 N 1.41 0.25 -0.01 -0.83 0.00 -1.21 0.22 119.26 119.10 2vml h ALA 152 Ca 0.40 0.05 -0.17 0.00 0.00 0.00 0.00 54.91 55.19 2vml h ALA 152 Cb 0.06 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2vml h ALA 152 CO -0.14 -0.38 -0.78 1.88 0.00 0.00 0.00 179.25 179.82 2vml h TYR 153 N 0.13 0.15 -0.31 0.00 0.05 -1.37 -0.60 116.97 115.01 2vml h TYR 153 Ca 0.12 -0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 2vml h TYR 153 Cb 0.13 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 2vml h TYR 153 CO -0.17 0.84 0.05 0.82 -1.05 0.00 0.00 178.16 178.66 2vml h ILE 154 N 0.06 1.23 -0.44 -2.88 2.04 -1.15 -2.91 117.51 113.47 2vml h ILE 154 Ca -0.02 -0.80 -0.07 0.00 1.00 0.00 0.00 64.86 64.96 2vml h ILE 154 Cb 1.38 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 2vml h ILE 154 CO 0.11 0.26 -0.02 0.44 0.00 0.00 0.00 178.15 178.94 2vml h ASP 155 N 0.33 0.70 -0.65 1.72 3.32 -0.88 -2.21 116.42 118.75 2vml h ASP 155 Ca 0.09 -0.17 0.07 0.00 0.02 0.00 0.00 57.03 57.04 2vml h ASP 155 Cb 0.34 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 2vml h ASP 155 CO 0.01 0.78 0.33 0.22 -1.72 0.00 0.00 179.24 178.86 2vml h TYR 156 N 0.68 0.60 -0.30 4.55 3.20 -1.06 -0.34 116.97 124.30 2vml h TYR 156 Ca 0.13 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 2vml h TYR 156 Cb 0.45 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 2vml h TYR 156 CO 0.02 0.26 -0.05 0.00 -1.64 0.00 0.00 178.16 176.75 2vml h ILE 158 N 0.33 0.96 -0.45 0.00 2.04 -1.11 -2.25 117.51 117.03 2vml h ILE 158 Ca 0.08 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.62 2vml h ILE 158 Cb 0.52 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2vml h ILE 158 CO 0.03 0.13 -0.01 0.78 0.00 0.00 0.00 178.15 179.08 2vml h ASN 159 N 0.72 0.78 0.10 1.72 2.35 -0.95 -2.63 115.58 117.67 2vml h ASN 159 Ca 0.32 -0.31 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2vml h ASN 159 Cb 0.22 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 2vml h ASN 159 CO -0.20 0.90 -0.03 0.00 -1.65 0.00 0.00 177.43 176.45 2vml h ALA 160 N 0.91 1.44 -0.01 -0.83 0.00 -1.00 -2.13 119.26 117.64 2vml h ALA 160 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2vml h ALA 160 Cb 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2vml h ALA 160 CO 0.02 0.04 -0.34 1.28 0.00 0.00 0.00 179.25 180.26 2vml n LEU 161 N -3.76 0.98 -0.90 0.00 4.77 -0.87 -4.99 117.00 112.23 2vml n LEU 161 Ca -0.03 -0.24 0.11 0.00 -0.03 0.00 0.00 56.01 55.82 2vml n LEU 161 Cb 0.13 -0.14 0.09 0.00 -2.33 0.00 0.00 43.42 41.17 2vml n LEU 161 CO 0.28 0.19 0.60 -1.20 -1.33 0.00 0.00 177.39 175.93