#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g2o s PHE 4 N 0.00 2.20 0.24 3.69 -0.12 -1.26 -0.56 117.98 122.17 2g2o s PHE 4 Ca 0.00 -0.37 0.11 0.00 -0.05 0.00 0.00 56.93 56.62 2g2o s PHE 4 Cb 0.00 -1.02 -0.05 0.00 -0.63 0.00 0.00 43.02 41.32 2g2o s PHE 4 CO 0.00 0.58 -0.20 0.00 -0.05 0.00 0.00 175.22 175.55 2g2o s ALA 5 N -2.19 2.52 -0.16 1.99 0.00 -0.28 -0.98 121.76 122.65 2g2o s ALA 5 Ca 0.25 -1.75 -0.07 0.00 0.00 0.00 0.00 51.96 50.39 2g2o s ALA 5 Cb -0.06 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 2g2o s ALA 5 CO 0.12 0.28 0.06 -0.06 0.00 0.00 0.00 175.76 176.16 2g2o s PHE 6 N -2.34 3.28 0.09 0.00 0.40 -0.88 -1.07 117.98 117.46 2g2o s PHE 6 Ca 0.25 0.15 0.10 0.00 -0.60 0.00 0.00 56.93 56.83 2g2o s PHE 6 Cb -0.05 -2.02 -0.03 0.00 0.51 0.00 0.00 43.02 41.42 2g2o s PHE 6 CO 0.12 0.27 -0.27 0.14 0.70 0.00 0.00 175.22 176.18 2g2o s VAL 7 N 0.03 2.22 -0.13 -0.44 -7.23 0.17 -2.23 120.40 112.79 2g2o s VAL 7 Ca 0.06 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 2g2o s VAL 7 Cb -0.12 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.91 2g2o s VAL 7 CO 0.01 0.22 -0.13 -0.36 -0.31 0.00 0.00 175.10 174.53 2g2o s PHE 8 N -0.94 1.99 0.67 2.82 0.40 -0.68 -0.48 117.98 121.75 2g2o s PHE 8 Ca 0.13 -1.06 -0.11 0.00 -0.60 0.00 0.00 56.93 55.29 2g2o s PHE 8 Cb -0.10 -1.48 -0.01 0.00 0.51 0.00 0.00 43.02 41.94 2g2o s PHE 8 CO 0.04 -0.60 1.06 -1.25 0.70 0.00 0.00 175.22 175.18 2g2o s PRO 9 N 1.41 3.17 0.00 0.24 0.04 -1.26 -0.57 135.00 138.04 2g2o s PRO 9 Ca 0.02 0.69 0.00 0.00 0.04 0.00 0.00 61.00 61.76 2g2o s PRO 9 Cb -0.13 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.37 2g2o s PRO 9 CO -0.08 -0.86 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2g2o n GLY 10 N -2.65 6.66 3.57 0.56 0.00 -1.21 -3.69 105.19 108.42 2g2o n GLY 10 Ca 0.07 -2.00 -0.46 0.00 0.00 0.00 0.00 46.02 43.63 2g2o n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2g2o n GLN 11 N 0.00 1.17 0.00 1.61 -0.06 -1.26 -2.58 117.38 116.25 2g2o n GLN 11 Ca 0.00 0.41 0.00 0.00 -2.00 0.00 0.00 57.00 55.41 2g2o n GLN 11 Cb 0.00 -1.78 0.00 0.00 -4.06 0.00 0.00 30.24 24.40 2g2o n GLN 11 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2g2o n GLY 12 N 1.53 2.66 0.01 1.69 0.00 -1.26 -4.93 105.19 104.89 2g2o n GLY 12 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2g2o n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2g2o n SER 13 N 0.00 0.58 -4.78 1.61 7.64 -1.07 -4.90 113.62 112.71 2g2o n SER 13 Ca 0.00 -0.36 -0.37 0.00 1.01 0.00 0.00 58.87 59.15 2g2o n SER 13 Cb 0.00 0.33 -0.03 0.00 -1.01 0.00 0.00 64.21 63.50 2g2o n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2g2o s GLN 14 N -2.98 4.05 -0.02 1.43 0.00 -1.26 -4.19 119.66 116.69 2g2o s GLN 14 Ca 0.11 1.61 -0.12 0.00 -0.00 0.00 0.00 55.36 56.96 2g2o s GLN 14 Cb 0.17 -2.52 0.02 0.00 0.00 0.00 0.00 33.01 30.68 2g2o s GLN 14 CO 0.71 -0.26 0.25 0.95 0.00 0.00 0.00 175.29 176.93 2g2o s THR 15 N -1.61 0.06 0.22 3.63 -4.23 -1.26 -5.09 115.64 107.36 2g2o s THR 15 Ca 0.59 -0.49 -0.32 0.00 -1.18 0.00 0.00 61.69 60.30 2g2o s THR 15 Cb -0.24 -0.52 -0.12 0.00 1.34 0.00 0.00 72.50 72.95 2g2o s THR 15 CO 0.30 -0.27 1.71 0.52 -0.54 0.00 0.00 174.62 176.34 2g2o n VAL 16 N 1.55 0.13 -0.45 2.29 0.31 -1.26 -1.73 118.33 119.17 2g2o n VAL 16 Ca -0.21 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2g2o n VAL 16 Cb 0.56 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 2g2o n VAL 16 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g2o n GLY 17 N 3.73 0.73 3.77 2.92 0.00 0.12 -4.98 105.19 111.48 2g2o n GLY 17 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2g2o n GLY 17 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2g2o s MET 18 N -0.55 3.91 0.00 1.61 0.00 -0.70 -2.25 119.30 121.32 2g2o s MET 18 Ca 0.00 2.48 0.00 0.00 0.00 0.00 0.00 55.69 58.17 2g2o s MET 18 Cb 0.00 -2.82 0.00 0.00 0.00 0.00 0.00 34.83 32.01 2g2o s MET 18 CO 0.00 -0.66 0.00 1.28 0.00 0.00 0.00 175.02 175.64 2g2o n LEU 19 N 0.15 0.30 -0.03 0.18 7.99 -1.26 -4.90 117.00 119.44 2g2o n LEU 19 Ca 0.03 0.00 -0.08 0.00 -0.01 0.00 0.00 56.01 55.95 2g2o n LEU 19 Cb 0.41 -0.90 -0.02 0.00 -0.11 0.00 0.00 43.42 42.80 2g2o n LEU 19 CO 0.61 -0.25 0.79 0.00 -1.51 0.00 0.00 177.39 177.03 2g2o h ALA 20 N 0.00 0.05 -0.63 -1.18 0.00 -1.81 -0.71 119.26 114.98 2g2o h ALA 20 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2g2o h ALA 20 Cb 0.20 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2g2o h ALA 20 CO 0.00 -0.53 0.31 -0.44 0.00 0.00 0.00 179.25 178.59 2g2o h ASP 21 N -0.09 0.81 -0.68 0.00 3.32 -1.90 -2.24 116.42 115.63 2g2o h ASP 21 Ca 0.10 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 2g2o h ASP 21 Cb 0.24 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 2g2o h ASP 21 CO -0.24 0.70 0.18 -0.03 -1.72 0.00 0.00 179.24 178.13 2g2o h MET 22 N 0.86 1.10 -0.42 3.56 4.05 -1.71 -2.48 114.93 119.89 2g2o h MET 22 Ca 0.22 -0.25 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 2g2o h MET 22 Cb 0.10 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.73 2g2o h MET 22 CO -0.03 0.96 -0.09 0.00 0.23 0.00 0.00 176.91 177.98 2g2o h ALA 23 N 1.15 1.06 0.00 0.39 0.00 -0.78 0.14 119.26 121.22 2g2o h ALA 23 Ca 0.22 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2g2o h ALA 23 Cb 0.34 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2g2o h ALA 23 CO -0.00 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.69 2g2o h ALA 24 N 1.23 1.13 0.00 0.00 0.00 -1.06 -2.87 119.26 117.69 2g2o h ALA 24 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g2o h ALA 24 Cb 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2g2o h ALA 24 CO 0.03 0.17 -1.52 0.43 0.00 0.00 0.00 179.25 178.36 2g2o n SER 25 N -3.44 0.39 -3.47 0.00 7.64 -0.62 -4.86 113.62 109.25 2g2o n SER 25 Ca -0.01 0.02 -0.24 0.00 1.01 0.00 0.00 58.87 59.65 2g2o n SER 25 Cb 0.30 1.32 -0.12 0.00 -1.01 0.00 0.00 64.21 64.70 2g2o n SER 25 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2g2o s TYR 26 N -3.40 0.02 0.59 1.43 2.02 0.38 -5.00 117.35 113.38 2g2o s TYR 26 Ca -0.03 -0.66 0.29 0.00 -0.37 0.00 0.00 57.07 56.30 2g2o s TYR 26 Cb 0.13 -0.71 1.44 0.00 -0.40 0.00 0.00 41.96 42.42 2g2o s TYR 26 CO 0.86 -0.87 1.86 -1.35 -1.57 0.00 0.00 175.55 174.47 2g2o h PRO 27 N 8.20 0.00 0.00 -1.71 0.11 -1.85 -1.23 132.00 135.52 2g2o h PRO 27 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2g2o h PRO 27 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2g2o h PRO 27 CO 0.38 0.00 0.00 0.97 -0.21 0.00 0.00 178.00 179.14 2g2o h ILE 28 N 0.00 0.00 0.41 4.15 2.10 -1.94 -2.58 117.51 119.65 2g2o h ILE 28 Ca 0.25 -0.18 -0.02 0.00 1.08 0.00 0.00 64.86 65.98 2g2o h ILE 28 Cb 1.33 1.13 0.00 0.00 -1.09 0.00 0.00 36.82 38.20 2g2o h ILE 28 CO -0.00 0.00 -0.20 0.58 -1.08 0.00 0.00 178.15 177.45 2g2o h VAL 29 N 0.00 0.52 0.00 2.19 2.07 -1.53 -0.62 116.25 118.89 2g2o h VAL 29 Ca 0.00 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 2g2o h VAL 29 Cb 0.19 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2g2o h VAL 29 CO 0.00 0.08 -0.35 -0.33 0.02 0.00 0.00 177.57 176.99 2g2o h GLU 30 N -0.86 0.00 -0.87 1.57 5.08 -1.71 -1.45 114.58 116.34 2g2o h GLU 30 Ca -0.06 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2g2o h GLU 30 Cb 0.55 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.76 2g2o h GLU 30 CO 0.09 0.35 0.46 0.93 -1.00 0.00 0.00 179.01 179.85 2g2o h GLU 31 N 0.00 1.23 -0.32 2.33 5.08 -1.37 0.95 114.58 122.48 2g2o h GLU 31 Ca -0.00 -0.16 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2g2o h GLU 31 Cb 0.73 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2g2o h GLU 31 CO 0.05 0.91 -0.06 1.15 -1.00 0.00 0.00 179.01 180.06 2g2o h THR 32 N 1.23 1.28 -0.08 1.13 2.02 -0.35 -2.50 112.91 115.65 2g2o h THR 32 Ca 0.31 -1.09 -0.05 0.00 0.77 0.00 0.00 66.41 66.34 2g2o h THR 32 Cb 0.06 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 2g2o h THR 32 CO -0.05 0.35 -0.20 -0.26 0.37 0.00 0.00 175.52 175.74 2g2o h PHE 33 N 0.39 0.13 -0.42 3.16 -1.00 -1.01 -2.31 116.94 115.88 2g2o h PHE 33 Ca 0.08 -0.02 -0.09 0.00 2.81 0.00 0.00 57.97 60.76 2g2o h PHE 33 Cb 0.54 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.05 2g2o h PHE 33 CO 0.05 0.32 -0.11 0.00 -1.61 0.00 0.00 178.31 176.95 2g2o h ALA 34 N 1.69 1.01 -0.30 2.45 0.00 -0.55 0.38 119.26 123.93 2g2o h ALA 34 Ca 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2g2o h ALA 34 Cb 0.42 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2g2o h ALA 34 CO 0.03 0.60 0.16 0.93 0.00 0.00 0.00 179.25 180.96 2g2o h GLU 35 N 0.69 0.42 -0.51 0.00 5.08 -1.01 -2.25 114.58 116.99 2g2o h GLU 35 Ca 0.12 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2g2o h GLU 35 Cb 0.59 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2g2o h GLU 35 CO 0.04 0.37 0.27 0.00 -1.00 0.00 0.00 179.01 178.69 2g2o h ALA 36 N 1.03 0.66 -0.54 3.43 0.00 -1.06 -2.88 119.26 119.89 2g2o h ALA 36 Ca 0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2g2o h ALA 36 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2g2o h ALA 36 CO -0.02 0.19 0.27 0.77 0.00 0.00 0.00 179.25 180.47 2g2o h SER 37 N 0.68 0.67 -0.57 0.00 0.02 -0.82 -0.26 113.55 113.27 2g2o h SER 37 Ca 0.18 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 2g2o h SER 37 Cb 0.07 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 2g2o h SER 37 CO -0.03 0.56 0.27 0.00 -1.14 0.00 0.00 176.83 176.50 2g2o h ALA 38 N 1.55 1.35 -0.06 3.77 0.00 -1.20 0.18 119.26 124.86 2g2o h ALA 38 Ca 0.19 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 2g2o h ALA 38 Cb 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2g2o h ALA 38 CO -0.03 0.50 -0.66 0.00 0.00 0.00 0.00 179.25 179.06 2g2o h ALA 39 N 1.45 0.77 0.00 0.00 0.00 -0.94 -3.32 119.26 117.23 2g2o h ALA 39 Ca 0.21 -0.58 -0.27 0.00 0.00 0.00 0.00 54.91 54.27 2g2o h ALA 39 Cb 0.11 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2g2o h ALA 39 CO -0.03 0.77 -1.58 -0.07 0.00 0.00 0.00 179.25 178.34 2g2o h LEU 40 N 0.17 0.00 0.00 0.00 3.38 -0.68 -3.47 115.31 114.71 2g2o h LEU 40 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2g2o h LEU 40 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2g2o h LEU 40 CO 0.10 0.97 0.00 0.61 0.09 0.00 0.00 178.44 180.22 2g2o n GLY 41 N 1.51 0.49 3.59 0.83 0.00 0.00 -5.06 105.19 106.56 2g2o n GLY 41 Ca -0.14 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 2g2o n GLY 41 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2g2o s TYR 42 N -2.00 0.20 -0.77 1.61 -0.85 -1.19 -5.08 117.35 109.27 2g2o s TYR 42 Ca 0.00 -0.58 -0.24 0.00 -0.52 0.00 0.00 57.07 55.73 2g2o s TYR 42 Cb 0.00 0.27 0.06 0.00 0.38 0.00 0.00 41.96 42.67 2g2o s TYR 42 CO 0.00 -0.99 1.18 0.34 -1.52 0.00 0.00 175.55 174.56 2g2o s ASP 43 N -2.97 6.26 0.21 -0.18 -1.08 -1.26 -4.35 116.67 113.29 2g2o s ASP 43 Ca 0.18 -0.93 -0.05 0.00 -0.52 0.00 0.00 52.55 51.23 2g2o s ASP 43 Cb -0.01 -2.50 0.17 0.00 -1.46 0.00 0.00 42.92 39.12 2g2o s ASP 43 CO 0.06 -1.58 1.63 0.25 0.52 0.00 0.00 175.17 176.04 2g2o h LEU 44 N 12.17 0.83 -0.31 -1.34 5.85 -1.90 -2.33 115.31 128.28 2g2o h LEU 44 Ca -0.17 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 2g2o h LEU 44 Cb 1.05 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 2g2o h LEU 44 CO 1.25 1.01 0.19 -0.25 -0.34 0.00 0.00 178.44 180.29 2g2o h TRP 45 N 0.72 0.40 -0.67 1.25 2.91 -1.89 -1.40 115.95 117.27 2g2o h TRP 45 Ca 0.10 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.13 2g2o h TRP 45 Cb 0.71 -0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 29.20 2g2o h TRP 45 CO 0.04 0.29 0.44 0.00 -1.03 0.00 0.00 178.44 178.18 2g2o h ALA 46 N 1.08 0.85 -0.38 2.65 0.00 -1.94 -1.07 119.26 120.45 2g2o h ALA 46 Ca 0.11 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2g2o h ALA 46 Cb 0.01 -0.27 -0.07 0.00 0.00 0.00 0.00 17.79 17.46 2g2o h ALA 46 CO -0.02 0.28 -0.05 1.25 0.00 0.00 0.00 179.25 180.71 2g2o h LEU 47 N 0.91 -0.27 -1.52 0.00 5.85 -1.10 0.97 115.31 120.16 2g2o h LEU 47 Ca 0.24 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 59.02 2g2o h LEU 47 Cb -0.10 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 2g2o h LEU 47 CO -0.05 -0.09 -0.23 0.71 -0.34 0.00 0.00 178.44 178.43 2g2o h THR 48 N 0.04 0.84 0.00 1.05 1.35 -0.25 0.11 112.91 116.06 2g2o h THR 48 Ca 0.18 -0.91 -0.26 0.00 -0.55 0.00 0.00 66.41 64.87 2g2o h THR 48 Cb 0.27 1.54 -0.05 0.00 -1.73 0.00 0.00 68.15 68.19 2g2o h THR 48 CO -0.35 0.23 -1.98 0.00 -0.25 0.00 0.00 175.52 173.17 2g2o n GLN 49 N -3.79 0.66 -0.01 4.72 1.13 -0.50 0.15 117.38 119.74 2g2o n GLN 49 Ca -0.02 0.08 0.01 0.00 -1.94 0.00 0.00 57.00 55.14 2g2o n GLN 49 Cb 0.33 -1.64 -0.05 0.00 0.11 0.00 0.00 30.24 28.99 2g2o n GLN 49 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2g2o n GLN 50 N -2.78 1.08 0.00 -1.09 6.02 0.29 -4.08 117.38 116.82 2g2o n GLN 50 Ca -0.21 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.74 2g2o n GLN 50 Cb 0.99 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 31.08 2g2o n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g2o n GLY 51 N 2.26 1.22 3.69 1.08 0.00 0.02 -4.79 105.19 108.68 2g2o n GLY 51 Ca -0.04 -0.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 2g2o n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g2o s PRO 52 N 0.00 0.43 0.32 1.61 0.04 -1.26 -4.75 135.00 131.39 2g2o s PRO 52 Ca 0.00 0.45 0.06 0.00 0.04 0.00 0.00 61.00 61.55 2g2o s PRO 52 Cb 0.00 -1.74 0.72 0.00 0.04 0.00 0.00 34.50 33.52 2g2o s PRO 52 CO 0.00 -2.71 1.84 0.00 0.04 0.00 0.00 177.00 176.17 2g2o h ALA 53 N -1.88 1.71 -0.40 8.56 0.00 -1.94 -1.68 119.26 123.63 2g2o h ALA 53 Ca -0.54 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.33 2g2o h ALA 53 Cb 1.33 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2g2o h ALA 53 CO 0.58 0.02 -0.03 1.49 0.00 0.00 0.00 179.25 181.32 2g2o h GLU 54 N 0.81 0.65 -0.18 0.00 4.81 -1.98 -0.46 114.58 118.23 2g2o h GLU 54 Ca 0.49 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.49 2g2o h GLU 54 Cb 0.68 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 2g2o h GLU 54 CO -0.26 0.69 -0.13 0.93 -0.73 0.00 0.00 179.01 179.51 2g2o h GLU 55 N 0.61 0.41 0.00 1.92 4.39 -1.69 -3.08 114.58 117.14 2g2o h GLU 55 Ca 0.12 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 2g2o h GLU 55 Cb 0.43 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2g2o h GLU 55 CO 0.02 0.74 -0.02 1.25 -1.16 0.00 0.00 179.01 179.85 2g2o h LEU 56 N 0.08 0.00 -0.50 1.33 5.85 -0.74 -2.70 115.31 118.63 2g2o h LEU 56 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2g2o h LEU 56 Cb 0.65 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.68 2g2o h LEU 56 CO 0.04 0.02 -0.68 0.59 -0.34 0.00 0.00 178.44 178.06 2g2o n ASN 57 N -3.59 1.46 -4.69 1.25 3.02 -0.28 -3.27 115.26 109.17 2g2o n ASN 57 Ca -0.03 -1.20 -0.42 0.00 -0.03 0.00 0.00 54.58 52.90 2g2o n ASN 57 Cb 0.11 0.66 -0.03 0.00 -0.61 0.00 0.00 39.78 39.91 2g2o n ASN 57 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2g2o s LYS 58 N -2.72 4.29 0.33 3.52 1.02 -1.02 -4.81 119.74 120.35 2g2o s LYS 58 Ca 0.14 1.94 0.07 0.00 0.02 0.00 0.00 55.97 58.15 2g2o s LYS 58 Cb 0.17 -3.57 0.59 0.00 -0.52 0.00 0.00 37.83 34.51 2g2o s LYS 58 CO 0.70 -0.56 1.80 0.00 -0.92 0.00 0.00 175.35 176.37 2g2o h THR 59 N 4.92 1.25 0.00 2.17 1.03 -1.89 0.37 112.91 120.76 2g2o h THR 59 Ca -0.38 -1.16 0.00 0.00 -0.01 0.00 0.00 66.41 64.87 2g2o h THR 59 Cb 1.18 1.42 0.00 0.00 -1.07 0.00 0.00 68.15 69.68 2g2o h THR 59 CO 0.90 0.35 0.00 -2.67 -0.01 0.00 0.00 175.52 174.09 2g2o n TRP 60 N -4.15 0.00 -0.08 0.00 2.14 -1.26 -1.25 117.44 112.84 2g2o n TRP 60 Ca -0.01 0.00 -0.10 0.00 2.07 0.00 0.00 57.50 59.46 2g2o n TRP 60 Cb 0.37 -0.43 -0.09 0.00 -0.81 0.00 0.00 31.31 30.35 2g2o n TRP 60 CO 0.00 0.00 0.00 1.04 2.07 0.00 0.00 177.69 180.80 2g2o n GLN 61 N -1.43 0.94 -0.19 -2.67 6.02 0.89 -4.50 117.38 116.44 2g2o n GLN 61 Ca 0.06 0.06 -0.02 0.00 -0.01 0.00 0.00 57.00 57.10 2g2o n GLN 61 Cb 0.21 -1.34 0.09 0.00 1.02 0.00 0.00 30.24 30.21 2g2o n GLN 61 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2g2o h THR 62 N 0.00 0.84 0.20 5.09 2.02 -0.27 -2.27 112.91 118.52 2g2o h THR 62 Ca -0.38 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 2g2o h THR 62 Cb 1.68 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 2g2o h THR 62 CO -0.03 0.08 -0.10 1.56 0.37 0.00 0.00 175.52 177.40 2g2o h GLN 63 N 0.44 -0.26 -0.42 6.66 4.20 -1.42 0.62 115.11 124.93 2g2o h GLN 63 Ca 0.27 0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.01 2g2o h GLN 63 Cb 0.28 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2g2o h GLN 63 CO -0.25 -0.00 0.28 -1.00 -0.67 0.00 0.00 178.83 177.19 2g2o h PRO 64 N -0.50 0.55 -0.72 1.46 0.13 -1.78 -0.87 132.00 130.28 2g2o h PRO 64 Ca -0.03 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 65.03 2g2o h PRO 64 Cb 0.38 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.35 2g2o h PRO 64 CO 0.05 0.37 0.28 0.00 -0.23 0.00 0.00 178.00 178.47 2g2o h ALA 65 N 1.74 0.93 -0.03 -0.56 0.00 -0.75 -1.42 119.26 119.18 2g2o h ALA 65 Ca 0.16 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 2g2o h ALA 65 Cb -0.06 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.46 2g2o h ALA 65 CO -0.03 0.55 -0.64 -0.07 0.00 0.00 0.00 179.25 179.06 2g2o h LEU 66 N 1.03 0.61 -0.80 0.00 3.38 -0.25 -1.53 115.31 117.75 2g2o h LEU 66 Ca 0.24 -0.73 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 2g2o h LEU 66 Cb 0.21 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2g2o h LEU 66 CO -0.02 1.26 0.48 0.25 0.09 0.00 0.00 178.44 180.50 2g2o h LEU 67 N 0.03 0.96 -0.28 1.67 5.85 -1.14 -0.99 115.31 121.41 2g2o h LEU 67 Ca -0.07 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 2g2o h LEU 67 Cb 1.33 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 2g2o h LEU 67 CO 0.13 0.75 -0.16 0.74 -0.34 0.00 0.00 178.44 179.55 2g2o h THR 68 N 1.10 1.30 -0.52 1.05 2.02 -1.25 -1.16 112.91 115.44 2g2o h THR 68 Ca 0.29 -1.27 0.06 0.00 0.77 0.00 0.00 66.41 66.26 2g2o h THR 68 Cb -0.04 1.52 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 2g2o h THR 68 CO -0.05 0.40 0.23 0.00 0.37 0.00 0.00 175.52 176.47 2g2o h ALA 69 N 0.73 0.66 -0.38 6.16 0.00 -1.02 0.87 119.26 126.29 2g2o h ALA 69 Ca 0.06 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2g2o h ALA 69 Cb 0.68 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2g2o h ALA 69 CO 0.05 -0.14 0.07 0.77 0.00 0.00 0.00 179.25 180.00 2g2o h SER 70 N 0.45 0.60 -0.36 0.00 0.02 -1.08 -1.91 113.55 111.27 2g2o h SER 70 Ca 0.24 -0.25 -0.11 0.00 -0.84 0.00 0.00 61.79 60.83 2g2o h SER 70 Cb 0.21 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 2g2o h SER 70 CO -0.20 0.70 -0.15 0.58 -1.14 0.00 0.00 176.83 176.62 2g2o h VAL 71 N 0.48 1.26 -0.43 2.27 2.07 -0.91 -1.05 116.25 119.95 2g2o h VAL 71 Ca 0.12 -1.25 0.03 0.00 0.82 0.00 0.00 66.70 66.42 2g2o h VAL 71 Cb 0.35 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2g2o h VAL 71 CO 0.01 0.43 0.21 0.00 0.02 0.00 0.00 177.57 178.24 2g2o h ALA 72 N 1.09 0.54 -0.66 1.67 0.00 -0.66 -0.06 119.26 121.17 2g2o h ALA 72 Ca 0.11 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2g2o h ALA 72 Cb 0.66 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 2g2o h ALA 72 CO 0.05 -0.14 0.08 -0.07 0.00 0.00 0.00 179.25 179.16 2g2o h LEU 73 N 0.43 1.07 -0.89 0.00 3.38 -0.93 -0.95 115.31 117.42 2g2o h LEU 73 Ca 0.18 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2g2o h LEU 73 Cb 0.09 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 2g2o h LEU 73 CO -0.13 1.08 0.58 0.22 0.09 0.00 0.00 178.44 180.28 2g2o h TYR 74 N 1.03 1.10 -0.40 1.13 3.20 -0.90 -1.20 116.97 120.93 2g2o h TYR 74 Ca 0.20 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.99 2g2o h TYR 74 Cb 0.48 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 2g2o h TYR 74 CO 0.04 0.65 -0.19 0.00 -1.64 0.00 0.00 178.16 177.02 2g2o h ARG 75 N 1.15 0.76 0.14 1.82 3.08 -0.48 -0.49 114.38 120.37 2g2o h ARG 75 Ca 0.35 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2g2o h ARG 75 Cb -0.05 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2g2o h ARG 75 CO -0.10 0.90 -0.07 0.28 -1.07 0.00 0.00 179.97 179.91 2g2o h VAL 76 N 0.67 0.88 -0.46 2.04 2.07 -0.86 0.88 116.25 121.47 2g2o h VAL 76 Ca 0.10 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.66 2g2o h VAL 76 Cb 0.69 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.27 2g2o h VAL 76 CO 0.05 0.01 -0.20 -0.25 0.02 0.00 0.00 177.57 177.21 2g2o h TRP 77 N -0.22 -0.50 -0.32 1.57 2.91 -0.88 -0.96 115.95 117.56 2g2o h TRP 77 Ca -0.02 0.05 -0.12 0.00 1.13 0.00 0.00 58.89 59.93 2g2o h TRP 77 Cb 0.17 0.29 -0.01 0.00 -0.51 0.00 0.00 29.16 29.10 2g2o h TRP 77 CO -0.06 -0.28 -0.26 1.96 -1.03 0.00 0.00 178.44 178.77 2g2o h GLN 78 N -0.10 0.73 -0.64 2.65 4.20 -0.92 0.16 115.11 121.19 2g2o h GLN 78 Ca 0.22 -0.36 0.02 0.00 0.06 0.00 0.00 58.65 58.59 2g2o h GLN 78 Cb 0.44 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 2g2o h GLN 78 CO -0.53 0.98 0.42 0.37 -0.67 0.00 0.00 178.83 179.41 2g2o h GLN 79 N 0.49 0.78 -0.38 1.46 4.15 -0.39 -1.83 115.11 119.38 2g2o h GLN 79 Ca 0.06 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2g2o h GLN 79 Cb 0.82 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.33 2g2o h GLN 79 CO 0.07 0.52 0.00 1.04 -1.93 0.00 0.00 178.83 178.52 2g2o n GLN 80 N -4.45 1.96 -0.06 1.69 1.13 -0.40 -4.89 117.38 112.35 2g2o n GLN 80 Ca 0.07 -1.49 0.00 0.00 -1.94 0.00 0.00 57.00 53.65 2g2o n GLN 80 Cb 0.10 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.10 2g2o n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g2o n GLY 81 N 1.18 0.94 3.76 1.08 0.00 -0.69 -5.06 105.19 106.40 2g2o n GLY 81 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2g2o n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2g2o s GLY 82 N -1.93 2.88 0.43 -0.02 0.00 0.03 -5.00 107.32 103.71 2g2o s GLY 82 Ca 0.00 1.20 -0.19 0.00 0.00 0.00 0.00 44.72 45.73 2g2o s GLY 82 CO 0.00 1.74 0.93 0.54 0.00 0.00 0.00 173.10 176.31 2g2o s LYS 83 N -2.48 4.14 0.50 2.90 1.02 -1.26 -4.58 119.74 119.98 2g2o s LYS 83 Ca 0.61 1.02 -0.23 0.00 0.02 0.00 0.00 55.97 57.39 2g2o s LYS 83 Cb -0.37 -2.21 -0.07 0.00 -0.52 0.00 0.00 37.83 34.67 2g2o s LYS 83 CO 0.46 -0.05 1.34 0.00 -0.92 0.00 0.00 175.35 176.18 2g2o n ALA 84 N -0.79 1.59 -1.30 5.17 0.00 -1.26 -4.99 120.51 118.93 2g2o n ALA 84 Ca 0.06 0.18 -0.31 0.00 0.00 0.00 0.00 53.44 53.38 2g2o n ALA 84 Cb 0.54 -2.34 0.10 0.00 0.00 0.00 0.00 19.45 17.75 2g2o n ALA 84 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2g2o s PRO 85 N -2.61 1.99 0.33 0.00 0.04 -1.26 -4.95 135.00 128.54 2g2o s PRO 85 Ca 0.67 0.99 0.14 0.00 0.04 0.00 0.00 61.00 62.84 2g2o s PRO 85 Cb -0.44 -1.88 0.56 0.00 0.04 0.00 0.00 34.50 32.78 2g2o s PRO 85 CO 0.53 -1.78 1.70 0.00 0.04 0.00 0.00 177.00 177.50 2g2o h ALA 86 N -1.22 1.05 -2.84 8.56 0.00 -1.44 -3.46 119.26 119.90 2g2o h ALA 86 Ca -0.46 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 53.99 2g2o h ALA 86 Cb 1.25 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 18.83 2g2o h ALA 86 CO 0.54 0.59 0.15 -1.64 0.00 0.00 0.00 179.25 178.89 2g2o s MET 87 N -3.71 1.21 0.12 0.00 -1.94 -1.26 -4.31 119.30 109.40 2g2o s MET 87 Ca -0.01 -0.43 0.04 0.00 -1.71 0.00 0.00 55.69 53.58 2g2o s MET 87 Cb 0.12 0.55 -0.04 0.00 2.01 0.00 0.00 34.83 37.48 2g2o s MET 87 CO 0.72 -0.50 -0.11 -1.64 -0.01 0.00 0.00 175.02 173.48 2g2o s MET 88 N -3.46 0.94 0.05 2.03 1.00 0.39 -2.08 119.30 118.17 2g2o s MET 88 Ca -0.00 -1.27 -0.18 0.00 0.00 0.00 0.00 55.69 54.24 2g2o s MET 88 Cb -0.00 -0.61 0.04 0.00 0.00 0.00 0.00 34.83 34.26 2g2o s MET 88 CO -0.10 0.09 0.42 0.00 0.00 0.00 0.00 175.02 175.43 2g2o s ALA 89 N -2.70 -1.03 0.02 3.03 0.00 -0.95 -1.07 121.76 119.05 2g2o s ALA 89 Ca 0.10 0.30 -0.05 0.00 0.00 0.00 0.00 51.96 52.31 2g2o s ALA 89 Cb -0.01 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.48 2g2o s ALA 89 CO 0.00 -0.48 0.07 0.20 0.00 0.00 0.00 175.76 175.56 2g2o s GLY 90 N -2.07 0.14 -0.57 0.00 0.00 -1.26 -1.69 107.32 101.87 2g2o s GLY 90 Ca -0.05 -0.39 -0.22 0.00 0.00 0.00 0.00 44.72 44.07 2g2o s GLY 90 CO -0.03 -0.50 0.83 -1.58 0.00 0.00 0.00 173.10 171.82 2g2o s HIS 91 N -1.72 2.85 0.00 1.90 2.46 0.27 -3.17 115.29 117.88 2g2o s HIS 91 Ca -0.13 -0.42 0.00 0.00 0.47 0.00 0.00 55.06 54.99 2g2o s HIS 91 Cb -0.07 -3.98 0.00 0.00 -0.13 0.00 0.00 32.58 28.41 2g2o s HIS 91 CO -0.01 -1.34 0.00 0.45 -2.47 0.00 0.00 174.74 171.37 2g2o n SER 92 N 7.04 0.00 -0.34 9.88 2.88 -1.26 -1.65 113.62 130.17 2g2o n SER 92 Ca -0.03 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.65 2g2o n SER 92 Cb 0.46 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 64.26 2g2o n SER 92 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2g2o h LEU 93 N 0.00 0.66 -1.99 2.46 7.12 -1.88 -0.57 115.31 121.11 2g2o h LEU 93 Ca 0.00 0.12 0.13 0.00 0.13 0.00 0.00 57.88 58.27 2g2o h LEU 93 Cb 0.00 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.13 2g2o h LEU 93 CO 0.00 0.15 0.45 1.23 -0.13 0.00 0.00 178.44 180.14 2g2o h GLY 94 N 0.62 0.00 1.30 3.75 0.00 -1.39 -0.70 103.07 106.66 2g2o h GLY 94 Ca 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.89 2g2o h GLY 94 CO -0.45 0.00 0.21 -2.09 0.00 0.00 0.00 176.54 174.21 2g2o h GLU 95 N 0.00 0.89 -0.66 4.80 4.81 -1.05 -1.13 114.58 122.24 2g2o h GLU 95 Ca 0.22 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 2g2o h GLU 95 Cb 1.12 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.33 2g2o h GLU 95 CO -0.00 0.75 0.09 1.88 -0.73 0.00 0.00 179.01 181.00 2g2o h TYR 96 N 0.87 1.17 -0.24 0.92 -1.99 -1.27 -1.16 116.97 115.28 2g2o h TYR 96 Ca 0.20 -0.17 -0.00 0.00 2.00 0.00 0.00 58.73 60.76 2g2o h TYR 96 Cb 0.22 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 2g2o h TYR 96 CO 0.01 0.99 0.14 0.77 -0.00 0.00 0.00 178.16 180.07 2g2o h SER 97 N 1.02 0.29 -0.64 3.88 0.02 -1.39 -0.56 113.55 116.17 2g2o h SER 97 Ca 0.20 -0.06 0.06 0.00 -0.84 0.00 0.00 61.79 61.14 2g2o h SER 97 Cb 0.46 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.87 2g2o h SER 97 CO 0.02 0.27 0.35 0.00 -1.14 0.00 0.00 176.83 176.33 2g2o h ALA 98 N 1.04 0.85 -0.22 3.77 0.00 -1.00 -1.42 119.26 122.28 2g2o h ALA 98 Ca 0.09 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2g2o h ALA 98 Cb 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2g2o h ALA 98 CO -0.02 0.03 -0.25 -0.07 0.00 0.00 0.00 179.25 178.95 2g2o h LEU 99 N 0.66 0.41 -0.23 0.00 3.38 -0.62 0.73 115.31 119.64 2g2o h LEU 99 Ca 0.28 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2g2o h LEU 99 Cb 0.17 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2g2o h LEU 99 CO -0.18 0.66 0.03 0.58 0.09 0.00 0.00 178.44 179.62 2g2o h VAL 100 N 0.37 1.24 0.00 1.22 2.07 -0.72 0.12 116.25 120.55 2g2o h VAL 100 Ca 0.06 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 2g2o h VAL 100 Cb 0.63 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 2g2o h VAL 100 CO 0.05 0.25 -0.22 0.00 0.02 0.00 0.00 177.57 177.67 2g2o n ALA 102 N -2.25 2.52 -0.93 0.00 0.00 0.20 -4.93 120.51 115.11 2g2o n ALA 102 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2g2o n ALA 102 Cb 0.38 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2g2o n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g2o n GLY 103 N 1.14 0.48 0.11 0.00 0.00 -0.43 -0.89 105.19 105.60 2g2o n GLY 103 Ca 0.16 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 2g2o n GLY 103 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2g2o h VAL 104 N 0.00 1.49 -3.79 1.61 2.07 -0.96 -3.41 116.25 113.26 2g2o h VAL 104 Ca 0.00 -2.53 -0.68 0.00 0.82 0.00 0.00 66.70 64.30 2g2o h VAL 104 Cb 0.00 3.18 -0.30 0.00 -1.52 0.00 0.00 31.29 32.66 2g2o h VAL 104 CO 0.00 0.72 -0.85 -0.63 0.02 0.00 0.00 177.57 176.83 2g2o s ILE 105 N -2.43 2.38 0.39 4.57 1.01 -1.15 -0.78 121.20 125.18 2g2o s ILE 105 Ca -0.14 -0.94 -0.27 0.00 0.00 0.00 0.00 60.65 59.30 2g2o s ILE 105 Cb 0.01 -1.91 -0.11 0.00 0.01 0.00 0.00 42.46 40.46 2g2o s ILE 105 CO 0.83 0.56 1.34 -0.67 0.00 0.00 0.00 174.94 177.00 2g2o n ASP 106 N 3.04 2.98 0.14 3.58 2.03 -1.26 -4.35 116.55 122.71 2g2o n ASP 106 Ca -0.18 1.17 -0.13 0.00 0.52 0.00 0.00 54.79 56.17 2g2o n ASP 106 Cb 0.52 -1.53 -0.07 0.00 -0.72 0.00 0.00 41.12 39.32 2g2o n ASP 106 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2g2o h PHE 107 N 2.46 -0.38 -0.71 -0.67 3.57 -1.99 -0.69 116.94 118.53 2g2o h PHE 107 Ca -0.48 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 60.98 2g2o h PHE 107 Cb 1.28 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.13 2g2o h PHE 107 CO 0.50 -0.23 0.31 0.00 -2.23 0.00 0.00 178.31 176.66 2g2o h ALA 108 N 0.44 0.92 -0.72 2.41 0.00 -1.93 -0.30 119.26 120.08 2g2o h ALA 108 Ca -0.01 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.85 2g2o h ALA 108 Cb 0.31 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 2g2o h ALA 108 CO -0.01 0.51 0.32 -0.44 0.00 0.00 0.00 179.25 179.63 2g2o h ASP 109 N 1.00 0.36 -0.25 0.00 3.32 -1.88 -2.15 116.42 116.82 2g2o h ASP 109 Ca 0.24 0.08 -0.14 0.00 0.02 0.00 0.00 57.03 57.23 2g2o h ASP 109 Cb 0.17 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2g2o h ASP 109 CO -0.02 0.18 -0.35 0.00 -1.72 0.00 0.00 179.24 177.33 2g2o h ALA 110 N 1.48 0.74 -0.25 3.45 0.00 0.11 0.30 119.26 125.10 2g2o h ALA 110 Ca 0.37 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2g2o h ALA 110 Cb 0.49 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2g2o h ALA 110 CO -0.33 0.66 0.11 0.28 0.00 0.00 0.00 179.25 179.97 2g2o h VAL 111 N 0.65 0.98 -0.62 0.00 2.07 -0.76 -0.27 116.25 118.30 2g2o h VAL 111 Ca 0.06 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 2g2o h VAL 111 Cb 0.89 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2g2o h VAL 111 CO 0.08 0.04 0.06 0.03 0.02 0.00 0.00 177.57 177.81 2g2o h ARG 112 N 0.24 1.06 -0.22 1.57 3.08 -1.22 -2.34 114.38 116.55 2g2o h ARG 112 Ca 0.10 -0.31 0.03 0.00 0.07 0.00 0.00 59.98 59.88 2g2o h ARG 112 Cb 0.04 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 2g2o h ARG 112 CO -0.08 1.00 0.03 1.25 -1.07 0.00 0.00 179.97 181.10 2g2o h LEU 113 N 0.96 -0.03 -0.32 3.04 5.85 -0.52 -1.79 115.31 122.50 2g2o h LEU 113 Ca 0.18 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 2g2o h LEU 113 Cb 0.49 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2g2o h LEU 113 CO 0.02 0.02 -0.51 -0.37 -0.34 0.00 0.00 178.44 177.26 2g2o h VAL 114 N 0.11 0.95 -0.04 1.05 -1.51 -0.99 0.18 116.25 116.00 2g2o h VAL 114 Ca 0.10 -2.10 0.00 0.00 -1.23 0.00 0.00 66.70 63.47 2g2o h VAL 114 Cb 0.11 2.30 -0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2g2o h VAL 114 CO -0.15 0.50 0.02 -0.08 -1.23 0.00 0.00 177.57 176.62 2g2o h GLU 115 N 0.00 0.04 -0.73 5.19 4.81 -1.26 -1.23 114.58 121.39 2g2o h GLU 115 Ca -0.01 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2g2o h GLU 115 Cb 1.26 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 2g2o h GLU 115 CO 0.07 0.02 0.24 0.52 -0.73 0.00 0.00 179.01 179.13 2g2o h MET 116 N 0.04 1.13 -0.47 1.92 2.86 -0.84 -1.99 114.93 117.57 2g2o h MET 116 Ca 0.02 -0.24 0.09 0.00 -2.06 0.00 0.00 59.70 57.52 2g2o h MET 116 Cb 0.00 -0.17 -0.09 0.00 0.06 0.00 0.00 31.60 31.41 2g2o h MET 116 CO -0.01 0.96 -0.08 -0.09 1.06 0.00 0.00 176.91 178.74 2g2o h ARG 117 N 1.08 0.03 -0.71 1.72 2.43 -0.50 0.26 114.38 118.69 2g2o h ARG 117 Ca 0.24 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.35 2g2o h ARG 117 Cb 0.29 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.80 2g2o h ARG 117 CO -0.01 0.02 0.24 0.78 -1.51 0.00 0.00 179.97 179.49 2g2o h GLY 118 N 0.04 1.16 0.88 2.80 0.00 -0.81 0.17 103.07 107.31 2g2o h GLY 118 Ca 0.23 -0.66 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 2g2o h GLY 118 CO -0.46 0.62 0.06 0.50 0.00 0.00 0.00 176.54 177.26 2g2o h LYS 119 N 1.04 0.46 -0.92 4.80 1.57 -0.80 0.78 116.57 123.51 2g2o h LYS 119 Ca 0.23 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.91 2g2o h LYS 119 Cb 0.27 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.47 2g2o h LYS 119 CO -0.01 0.56 0.61 0.74 -0.57 0.00 0.00 179.45 180.77 2g2o h PHE 120 N 0.29 1.14 -0.30 -1.35 0.04 -0.67 -1.90 116.94 114.20 2g2o h PHE 120 Ca 0.09 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 2g2o h PHE 120 Cb 0.31 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 2g2o h PHE 120 CO 0.02 0.71 0.12 0.52 -0.60 0.00 0.00 178.31 179.08 2g2o h MET 121 N 1.22 0.45 -0.51 1.51 2.86 -0.77 -2.91 114.93 116.78 2g2o h MET 121 Ca 0.34 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.89 2g2o h MET 121 Cb -0.11 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.45 2g2o h MET 121 CO -0.08 0.46 0.25 0.37 1.06 0.00 0.00 176.91 178.97 2g2o h GLN 122 N 0.34 0.71 -0.01 1.72 5.75 -0.30 -2.59 115.11 120.73 2g2o h GLN 122 Ca 0.10 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2g2o h GLN 122 Cb 0.18 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.59 2g2o h GLN 122 CO -0.01 0.54 -0.17 -0.85 -2.65 0.00 0.00 178.83 175.70 2g2o n GLU 123 N -4.39 1.02 0.02 1.69 0.28 -0.76 -4.45 120.64 114.06 2g2o n GLU 123 Ca 0.04 -0.56 -0.11 0.00 -0.16 0.00 0.00 57.16 56.38 2g2o n GLU 123 Cb 0.12 -1.49 -0.05 0.00 1.43 0.00 0.00 31.44 31.45 2g2o n GLU 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2g2o h ALA 124 N 3.84 -0.01 -2.61 -1.84 0.00 -1.26 -3.43 119.26 113.96 2g2o h ALA 124 Ca 0.00 0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 2g2o h ALA 124 Cb 0.47 0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.20 2g2o h ALA 124 CO 0.00 -0.53 -0.73 0.14 0.00 0.00 0.00 179.25 178.14 2g2o s VAL 125 N -6.18 0.95 0.28 0.00 -7.23 -1.26 -5.01 120.40 101.95 2g2o s VAL 125 Ca -0.14 -1.73 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 2g2o s VAL 125 Cb 0.08 -1.47 -0.13 0.00 0.56 0.00 0.00 36.38 35.42 2g2o s VAL 125 CO 0.67 -0.62 1.33 -2.65 -0.31 0.00 0.00 175.10 173.52 2g2o n PRO 126 N 0.38 2.03 -1.50 4.82 -0.02 -1.26 -4.89 135.00 134.56 2g2o n PRO 126 Ca -0.15 0.72 -0.56 0.00 -2.02 0.00 0.00 63.50 61.49 2g2o n PRO 126 Cb 0.58 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.67 2g2o n PRO 126 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2g2o n GLU 127 N 1.35 0.18 -0.07 -0.52 -0.58 -1.26 -1.31 120.64 118.43 2g2o n GLU 127 Ca 0.09 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.89 2g2o n GLU 127 Cb 0.33 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 2g2o n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g2o n GLY 128 N 1.71 0.51 0.14 0.62 0.00 -1.26 -4.90 105.19 102.00 2g2o n GLY 128 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 2g2o n GLY 128 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2g2o h THR 129 N 0.00 0.74 -1.67 2.61 2.02 -1.55 -3.46 112.91 111.61 2g2o h THR 129 Ca 0.00 -2.39 -0.45 0.00 0.77 0.00 0.00 66.41 64.34 2g2o h THR 129 Cb 0.00 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.00 2g2o h THR 129 CO 0.00 0.87 -0.34 -0.83 0.37 0.00 0.00 175.52 175.60 2g2o s GLY 130 N -5.40 1.79 0.07 2.16 0.00 -1.26 -1.01 107.32 103.67 2g2o s GLY 130 Ca -0.20 -1.60 -0.20 0.00 0.00 0.00 0.00 44.72 42.72 2g2o s GLY 130 CO 0.79 -1.48 0.46 0.00 0.00 0.00 0.00 173.10 172.88 2g2o s ALA 131 N -2.28 -1.14 0.21 3.20 0.00 -0.22 -4.52 121.76 117.01 2g2o s ALA 131 Ca 0.48 0.36 0.11 0.00 0.00 0.00 0.00 51.96 52.91 2g2o s ALA 131 Cb -0.08 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 2g2o s ALA 131 CO 0.31 -0.53 -0.22 -1.64 0.00 0.00 0.00 175.76 173.68 2g2o s MET 132 N -2.79 1.60 -0.02 0.00 -1.94 -1.26 -2.11 119.30 112.78 2g2o s MET 132 Ca -0.03 -1.54 -0.02 0.00 -1.71 0.00 0.00 55.69 52.39 2g2o s MET 132 Cb -0.00 -1.87 0.01 0.00 2.01 0.00 0.00 34.83 34.98 2g2o s MET 132 CO -0.05 0.39 0.06 0.00 -0.01 0.00 0.00 175.02 175.41 2g2o s ALA 133 N -1.80 -0.14 -0.25 3.03 0.00 0.39 -2.20 121.76 120.78 2g2o s ALA 133 Ca 0.23 0.16 -0.25 0.00 0.00 0.00 0.00 51.96 52.09 2g2o s ALA 133 Cb -0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 23.12 22.95 2g2o s ALA 133 CO 0.11 -0.03 0.86 0.00 0.00 0.00 0.00 175.76 176.71 2g2o s ALA 134 N 0.03 3.63 -0.31 0.00 0.00 0.03 -0.35 121.76 124.79 2g2o s ALA 134 Ca -0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 51.96 51.67 2g2o s ALA 134 Cb -0.00 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 2g2o s ALA 134 CO 0.00 -1.01 0.41 0.42 0.00 0.00 0.00 175.76 175.58 2g2o s ILE 135 N 2.95 5.13 -0.19 0.00 -1.09 0.22 -0.92 121.20 127.31 2g2o s ILE 135 Ca 0.36 0.37 -0.03 0.00 -2.23 0.00 0.00 60.65 59.12 2g2o s ILE 135 Cb -0.15 -3.80 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 2g2o s ILE 135 CO 0.08 -0.00 -0.07 -0.63 -1.23 0.00 0.00 174.94 173.09 2g2o s ILE 136 N 2.13 3.33 0.00 2.92 1.01 -0.44 -1.91 121.20 128.24 2g2o s ILE 136 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 60.65 60.27 2g2o s ILE 136 Cb -0.16 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.83 2g2o s ILE 136 CO 0.11 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.12 2g2o n GLY 137 N 4.34 1.02 3.07 6.18 0.00 -0.56 0.12 105.19 119.36 2g2o n GLY 137 Ca -0.18 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.14 2g2o n GLY 137 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2g2o s LEU 138 N 0.00 2.10 0.64 0.99 0.20 -1.26 -4.23 118.68 117.12 2g2o s LEU 138 Ca 0.00 -0.31 -0.15 0.00 0.69 0.00 0.00 54.13 54.35 2g2o s LEU 138 Cb 0.00 -0.49 -0.01 0.00 -0.43 0.00 0.00 46.19 45.26 2g2o s LEU 138 CO 0.00 0.05 1.10 1.51 -0.29 0.00 0.00 176.35 178.72 2g2o s ASP 139 N -0.70 5.28 0.24 3.68 -4.77 -1.26 -4.32 116.67 114.83 2g2o s ASP 139 Ca 0.01 1.97 -0.05 0.00 -3.30 0.00 0.00 52.55 51.18 2g2o s ASP 139 Cb -0.06 -2.55 0.43 0.00 -1.09 0.00 0.00 42.92 39.66 2g2o s ASP 139 CO 0.00 -1.51 1.73 0.44 0.70 0.00 0.00 175.17 176.53 2g2o h ASP 140 N 0.17 0.25 -0.28 2.11 3.32 -2.00 -2.52 116.42 117.47 2g2o h ASP 140 Ca -0.47 0.11 -0.12 0.00 0.02 0.00 0.00 57.03 56.57 2g2o h ASP 140 Cb 1.24 0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.88 2g2o h ASP 140 CO 0.55 0.10 -0.29 0.00 -1.72 0.00 0.00 179.24 177.87 2g2o h ALA 141 N 1.54 0.41 -0.34 3.45 0.00 -2.00 -2.32 119.26 120.00 2g2o h ALA 141 Ca 0.40 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2g2o h ALA 141 Cb 0.60 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2g2o h ALA 141 CO -0.40 0.43 0.10 0.77 0.00 0.00 0.00 179.25 180.15 2g2o h SER 142 N 0.43 0.44 -0.07 0.00 0.02 -1.83 -1.96 113.55 110.58 2g2o h SER 142 Ca 0.04 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2g2o h SER 142 Cb 0.86 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2g2o h SER 142 CO 0.07 0.44 -0.14 0.40 -1.14 0.00 0.00 176.83 176.46 2g2o h ILE 143 N 0.48 1.40 -0.98 3.27 2.04 -1.19 -1.05 117.51 121.49 2g2o h ILE 143 Ca 0.12 -1.42 0.13 0.00 1.00 0.00 0.00 64.86 64.68 2g2o h ILE 143 Cb 0.16 2.16 -0.08 0.00 -0.74 0.00 0.00 36.82 38.32 2g2o h ILE 143 CO -0.01 0.40 0.62 0.00 0.00 0.00 0.00 178.15 179.16 2g2o h ALA 144 N 0.50 1.60 -0.24 1.87 0.00 -1.18 -0.43 119.26 121.38 2g2o h ALA 144 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2g2o h ALA 144 Cb 0.71 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2g2o h ALA 144 CO 0.03 0.15 -0.20 -0.22 0.00 0.00 0.00 179.25 179.01 2g2o h LYS 145 N 0.92 0.56 -0.95 0.00 3.64 -1.25 -1.63 116.57 117.86 2g2o h LYS 145 Ca 0.49 -0.28 0.09 0.00 -1.27 0.00 0.00 60.65 59.68 2g2o h LYS 145 Cb 0.56 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.31 2g2o h LYS 145 CO -0.26 0.86 0.61 0.00 -2.27 0.00 0.00 179.45 178.39 2g2o h ALA 146 N 0.69 1.54 -0.22 5.00 0.00 -0.46 -1.31 119.26 124.50 2g2o h ALA 146 Ca 0.04 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 2g2o h ALA 146 Cb 0.74 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2g2o h ALA 146 CO 0.05 0.27 -0.36 0.00 0.00 0.00 0.00 179.25 179.21 2g2o h GLU 148 N 0.34 -0.24 -0.04 0.00 5.08 -0.82 -1.53 114.58 117.37 2g2o h GLU 148 Ca 0.02 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2g2o h GLU 148 Cb 0.95 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 2g2o h GLU 148 CO 0.08 -0.16 -0.14 0.93 -1.00 0.00 0.00 179.01 178.73 2g2o h GLU 149 N -0.24 0.05 0.00 2.33 5.08 -1.17 -2.94 114.58 117.69 2g2o h GLU 149 Ca 0.12 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2g2o h GLU 149 Cb 0.42 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2g2o h GLU 149 CO -0.32 0.20 -0.81 0.00 -1.00 0.00 0.00 179.01 177.08 2g2o h ALA 150 N 1.81 0.64 0.27 3.43 0.00 -0.80 -3.38 119.26 121.23 2g2o h ALA 150 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2g2o h ALA 150 Cb 0.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2g2o h ALA 150 CO 0.02 0.18 -0.13 0.00 0.00 0.00 0.00 179.25 179.32 2g2o h ALA 151 N 1.88 -0.36 -6.45 0.00 0.00 -1.11 -3.45 119.26 109.78 2g2o h ALA 151 Ca -0.02 -0.09 -0.50 0.00 0.00 0.00 0.00 54.91 54.30 2g2o h ALA 151 Cb 1.11 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 2g2o h ALA 151 CO 0.01 -0.68 -0.83 0.39 0.00 0.00 0.00 179.25 178.14 2g2o n GLU 152 N -5.22 -4.13 -0.27 0.00 -0.58 -1.26 -0.91 120.64 108.26 2g2o n GLU 152 Ca -0.10 0.48 0.00 0.00 -0.42 0.00 0.00 57.16 57.13 2g2o n GLU 152 Cb 0.18 -5.05 0.00 0.00 -0.57 0.00 0.00 31.44 26.00 2g2o n GLU 152 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2g2o n GLY 153 N -1.69 1.88 2.00 0.62 0.00 -1.26 -5.01 105.19 101.73 2g2o n GLY 153 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2g2o n GLY 153 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2g2o n GLN 154 N -2.00 0.03 -4.33 1.61 6.02 -0.09 -5.11 117.38 113.51 2g2o n GLN 154 Ca 0.00 -1.32 -0.34 0.00 -0.01 0.00 0.00 57.00 55.33 2g2o n GLN 154 Cb 0.00 -0.43 -0.13 0.00 1.02 0.00 0.00 30.24 30.70 2g2o n GLN 154 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2g2o s VAL 155 N -1.72 3.51 -0.18 5.09 1.01 -1.26 -4.76 120.40 122.08 2g2o s VAL 155 Ca 0.35 -0.48 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 2g2o s VAL 155 Cb -0.02 -2.54 0.05 0.00 0.00 0.00 0.00 36.38 33.87 2g2o s VAL 155 CO 0.24 0.47 0.48 0.54 0.00 0.00 0.00 175.10 176.83 2g2o s VAL 156 N 0.75 -0.01 0.18 2.92 0.11 -1.26 -1.02 120.40 122.08 2g2o s VAL 156 Ca -0.03 0.02 -0.22 0.00 -2.93 0.00 0.00 61.98 58.82 2g2o s VAL 156 Cb -0.15 -0.68 0.06 0.00 -1.53 0.00 0.00 36.38 34.08 2g2o s VAL 156 CO 0.02 0.01 0.60 -0.94 -3.33 0.00 0.00 175.10 171.46 2g2o s SER 157 N 0.57 -0.48 0.27 3.54 1.04 -0.83 -4.63 113.70 113.18 2g2o s SER 157 Ca -0.03 -0.14 -0.31 0.00 0.48 0.00 0.00 55.95 55.95 2g2o s SER 157 Cb -0.04 0.61 -0.12 0.00 0.10 0.00 0.00 66.02 66.57 2g2o s SER 157 CO -0.03 -1.03 1.65 -2.84 0.98 0.00 0.00 173.24 171.96 2g2o s PRO 158 N -3.79 4.11 0.00 4.02 0.02 -1.26 -1.81 135.00 136.29 2g2o s PRO 158 Ca 0.03 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.66 2g2o s PRO 158 Cb -0.02 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.47 2g2o s PRO 158 CO -0.09 -0.69 0.00 1.33 -0.33 0.00 0.00 177.00 177.22 2g2o n VAL 159 N 2.71 0.00 -3.85 3.83 0.24 0.13 -4.45 118.33 116.94 2g2o n VAL 159 Ca 0.11 0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.15 2g2o n VAL 159 Cb 0.36 0.08 -0.17 0.00 -1.47 0.00 0.00 33.84 32.64 2g2o n VAL 159 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2g2o s ASN 160 N -1.95 2.13 -0.62 -1.34 -0.87 -0.90 -0.76 114.94 110.63 2g2o s ASN 160 Ca 0.00 -0.32 -0.18 0.00 -1.57 0.00 0.00 52.86 50.79 2g2o s ASN 160 Cb 0.00 -0.71 0.12 0.00 -0.02 0.00 0.00 41.25 40.64 2g2o s ASN 160 CO 0.00 -0.16 0.70 -0.36 -2.57 0.00 0.00 177.10 174.71 2g2o s PHE 161 N 1.79 3.08 -0.23 2.20 0.08 -0.34 -0.93 117.98 123.63 2g2o s PHE 161 Ca 0.04 -1.09 -0.02 0.00 0.12 0.00 0.00 56.93 55.98 2g2o s PHE 161 Cb -0.13 -3.99 -0.18 0.00 -0.57 0.00 0.00 43.02 38.14 2g2o s PHE 161 CO -0.07 -1.25 -0.11 0.09 -0.10 0.00 0.00 175.22 173.78 2g2o n ASN 162 N 6.06 2.01 -3.64 1.36 3.02 -0.78 -0.77 115.26 122.53 2g2o n ASN 162 Ca -0.07 -0.01 -0.10 0.00 -0.03 0.00 0.00 54.58 54.37 2g2o n ASN 162 Cb 0.43 -0.56 -0.03 0.00 -0.61 0.00 0.00 39.78 39.01 2g2o n ASN 162 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2g2o s SER 163 N -6.73 -0.39 -0.40 6.41 1.04 -0.94 -4.12 113.70 108.56 2g2o s SER 163 Ca -0.33 -0.31 -0.39 0.00 0.48 0.00 0.00 55.95 55.40 2g2o s SER 163 Cb 0.09 0.62 -0.15 0.00 0.10 0.00 0.00 66.02 66.69 2g2o s SER 163 CO 0.62 -1.09 2.11 -2.65 0.98 0.00 0.00 173.24 173.22 2g2o n PRO 164 N -0.38 0.65 -0.18 4.02 -0.02 -1.26 -0.33 135.00 137.50 2g2o n PRO 164 Ca -0.12 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2g2o n PRO 164 Cb 0.63 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2g2o n PRO 164 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2g2o n GLY 165 N 6.62 0.78 2.61 -1.23 0.00 -1.26 -4.97 105.19 107.74 2g2o n GLY 165 Ca 0.45 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.21 2g2o n GLY 165 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2g2o s GLN 166 N -0.82 0.19 -0.02 1.61 -0.21 0.55 -1.50 119.66 119.46 2g2o s GLN 166 Ca 0.00 -0.31 0.01 0.00 0.02 0.00 0.00 55.36 55.08 2g2o s GLN 166 Cb 0.00 -1.20 0.01 0.00 1.00 0.00 0.00 33.01 32.82 2g2o s GLN 166 CO 0.00 -0.92 -0.02 0.08 -2.12 0.00 0.00 175.29 172.31 2g2o s VAL 167 N 2.17 0.26 -0.15 1.09 1.01 -0.80 -1.86 120.40 122.12 2g2o s VAL 167 Ca 0.08 -0.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2g2o s VAL 167 Cb -0.16 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 2g2o s VAL 167 CO -0.29 0.12 0.14 -0.69 0.00 0.00 0.00 175.10 174.38 2g2o s VAL 168 N 0.50 5.47 0.28 2.92 1.01 -0.11 0.71 120.40 131.19 2g2o s VAL 168 Ca -0.05 0.20 0.09 0.00 0.00 0.00 0.00 61.98 62.22 2g2o s VAL 168 Cb -0.08 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 2g2o s VAL 168 CO -0.01 0.56 0.01 0.27 0.00 0.00 0.00 175.10 175.93 2g2o s ILE 169 N -0.54 3.32 0.23 2.22 -4.36 0.52 0.20 121.20 122.79 2g2o s ILE 169 Ca 0.13 -1.90 -0.23 0.00 -0.26 0.00 0.00 60.65 58.39 2g2o s ILE 169 Cb -0.12 -2.85 0.04 0.00 1.25 0.00 0.00 42.46 40.78 2g2o s ILE 169 CO 0.02 -0.34 0.79 0.00 0.24 0.00 0.00 174.94 175.65 2g2o s ALA 170 N -2.35 -1.39 0.00 2.27 0.00 -0.75 -0.46 121.76 119.07 2g2o s ALA 170 Ca 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2g2o s ALA 170 Cb -0.05 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.84 2g2o s ALA 170 CO 0.20 -1.01 0.00 0.41 0.00 0.00 0.00 175.76 175.36 2g2o n GLY 171 N -0.45 0.36 3.76 0.00 0.00 -0.90 -1.96 105.19 106.00 2g2o n GLY 171 Ca -0.06 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 2g2o n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g2o s HIS 172 N -2.93 2.77 0.23 1.61 3.76 -0.19 -1.05 115.29 119.50 2g2o s HIS 172 Ca 0.00 0.95 -0.07 0.00 -0.15 0.00 0.00 55.06 55.80 2g2o s HIS 172 Cb 0.00 -3.99 0.35 0.00 1.11 0.00 0.00 32.58 30.05 2g2o s HIS 172 CO 0.00 -3.19 1.77 1.57 -0.85 0.00 0.00 174.74 174.04 2g2o h LYS 173 N 4.35 0.55 -0.70 1.40 2.10 -1.31 -0.97 116.57 121.99 2g2o h LYS 173 Ca -0.48 -0.03 -0.04 0.00 -2.00 0.00 0.00 60.65 58.10 2g2o h LYS 173 Cb 1.22 -0.12 -0.03 0.00 -0.90 0.00 0.00 32.23 32.40 2g2o h LYS 173 CO 0.75 0.36 0.28 0.93 -2.00 0.00 0.00 179.45 179.77 2g2o h GLU 174 N 0.57 1.04 -0.28 0.07 3.07 -1.91 -1.58 114.58 115.55 2g2o h GLU 174 Ca 0.36 -0.19 -0.13 0.00 -0.50 0.00 0.00 59.36 58.90 2g2o h GLU 174 Cb 0.41 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 2g2o h GLU 174 CO -0.29 0.86 -0.36 0.00 -1.40 0.00 0.00 179.01 177.82 2g2o h ALA 175 N 1.13 0.83 -0.48 3.43 0.00 -1.62 -1.72 119.26 120.84 2g2o h ALA 175 Ca 0.23 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 2g2o h ALA 175 Cb 0.21 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2g2o h ALA 175 CO -0.02 0.64 0.00 0.28 0.00 0.00 0.00 179.25 180.16 2g2o h VAL 176 N 0.53 1.24 -0.25 0.00 2.07 -0.95 0.12 116.25 119.01 2g2o h VAL 176 Ca 0.05 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 2g2o h VAL 176 Cb 0.87 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2g2o h VAL 176 CO 0.08 0.35 0.12 -0.33 0.02 0.00 0.00 177.57 177.80 2g2o h GLU 177 N 0.73 0.35 -0.69 1.57 5.08 -0.95 0.85 114.58 121.53 2g2o h GLU 177 Ca 0.14 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2g2o h GLU 177 Cb 0.44 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 2g2o h GLU 177 CO 0.02 0.35 0.30 0.00 -1.00 0.00 0.00 179.01 178.68 2g2o h ARG 178 N 0.27 1.01 -0.20 2.33 3.08 -1.02 -1.94 114.38 117.91 2g2o h ARG 178 Ca 0.08 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 2g2o h ARG 178 Cb 0.11 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2g2o h ARG 178 CO -0.01 0.82 -0.01 0.00 -1.07 0.00 0.00 179.97 179.69 2g2o h ALA 179 N 1.14 0.27 -0.47 0.04 0.00 -0.61 -1.37 119.26 118.26 2g2o h ALA 179 Ca 0.23 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.01 2g2o h ALA 179 Cb 0.16 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.78 2g2o h ALA 179 CO -0.02 0.00 -0.33 0.78 0.00 0.00 0.00 179.25 179.68 2g2o h GLY 180 N 0.11 -0.20 0.87 0.00 0.00 -0.72 0.96 103.07 104.08 2g2o h GLY 180 Ca 0.05 0.42 0.03 0.00 0.00 0.00 0.00 47.33 47.84 2g2o h GLY 180 CO 0.01 -0.21 0.52 0.00 0.00 0.00 0.00 176.54 176.87 2g2o h ALA 181 N 0.84 1.08 -0.60 3.60 0.00 -1.15 -1.77 119.26 121.26 2g2o h ALA 181 Ca 0.19 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2g2o h ALA 181 Cb 0.54 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2g2o h ALA 181 CO -0.59 0.34 0.25 0.00 0.00 0.00 0.00 179.25 179.26 2g2o h ALA 182 N 1.34 0.78 -0.43 0.00 0.00 -0.33 -1.23 119.26 119.39 2g2o h ALA 182 Ca 0.33 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2g2o h ALA 182 Cb 0.02 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2g2o h ALA 182 CO -0.12 0.38 0.26 0.00 0.00 0.00 0.00 179.25 179.77 2g2o h LYS 184 N 0.57 0.28 -0.05 0.00 1.79 -1.10 -0.10 116.57 117.96 2g2o h LYS 184 Ca 0.16 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 2g2o h LYS 184 Cb -0.01 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.57 2g2o h LYS 184 CO -0.03 0.18 -0.06 0.00 -1.08 0.00 0.00 179.45 178.46 2g2o h ALA 185 N 1.36 1.81 -0.00 3.86 0.00 -0.27 -1.17 119.26 124.85 2g2o h ALA 185 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2g2o h ALA 185 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2g2o h ALA 185 CO -0.28 0.14 -0.27 0.00 0.00 0.00 0.00 179.25 178.84 2g2o n ALA 186 N -2.52 3.06 0.00 0.00 0.00 0.01 -4.90 120.51 116.16 2g2o n ALA 186 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2g2o n ALA 186 Cb 0.17 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.38 2g2o n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g2o n GLY 187 N 1.42 1.52 3.76 0.00 0.00 -0.42 -5.06 105.19 106.42 2g2o n GLY 187 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 2g2o n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g2o s ALA 188 N -1.88 3.19 0.07 4.61 0.00 -0.18 -4.79 121.76 122.78 2g2o s ALA 188 Ca 0.00 1.39 -0.12 0.00 0.00 0.00 0.00 51.96 53.22 2g2o s ALA 188 Cb 0.00 -3.56 -0.25 0.00 0.00 0.00 0.00 23.12 19.31 2g2o s ALA 188 CO 0.00 -1.12 1.15 -0.22 0.00 0.00 0.00 175.76 175.57 2g2o h LYS 189 N 2.29 0.58 -3.98 0.00 3.64 -0.50 -3.42 116.57 115.18 2g2o h LYS 189 Ca -0.51 -0.74 -0.15 0.00 -1.27 0.00 0.00 60.65 57.99 2g2o h LYS 189 Cb 1.26 0.24 -0.19 0.00 -0.41 0.00 0.00 32.23 33.14 2g2o h LYS 189 CO 0.61 1.32 -0.64 1.03 -2.27 0.00 0.00 179.45 179.50 2g2o s ARG 190 N -3.05 0.46 -0.40 1.90 0.52 -1.00 -5.00 118.95 112.38 2g2o s ARG 190 Ca -0.08 -0.80 0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2g2o s ARG 190 Cb 0.06 0.17 0.13 0.00 0.52 0.00 0.00 34.95 35.83 2g2o s ARG 190 CO 0.92 -0.09 0.20 0.00 0.02 0.00 0.00 175.30 176.35 2g2o s ALA 191 N -2.38 1.79 -0.25 2.13 0.00 -1.26 -1.32 121.76 120.47 2g2o s ALA 191 Ca -0.07 -2.27 -0.11 0.00 0.00 0.00 0.00 51.96 49.51 2g2o s ALA 191 Cb -0.03 -1.78 -0.05 0.00 0.00 0.00 0.00 23.12 21.26 2g2o s ALA 191 CO -0.04 -2.00 0.19 -0.51 0.00 0.00 0.00 175.76 173.40 2g2o s LEU 192 N 0.74 4.08 0.19 0.00 1.43 -0.09 -4.87 118.68 120.16 2g2o s LEU 192 Ca 0.16 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 2g2o s LEU 192 Cb -0.23 -2.14 -0.08 0.00 0.03 0.00 0.00 46.19 43.77 2g2o s LEU 192 CO -0.04 0.01 1.17 -2.84 0.23 0.00 0.00 176.35 174.88 2g2o s PRO 193 N 1.35 4.52 0.21 1.29 0.02 -1.26 -0.79 135.00 140.34 2g2o s PRO 193 Ca 0.08 1.84 0.07 0.00 0.02 0.00 0.00 61.00 63.01 2g2o s PRO 193 Cb -0.14 -3.25 -0.04 0.00 0.02 0.00 0.00 34.50 31.09 2g2o s PRO 193 CO 0.07 -0.04 0.10 -0.51 -0.33 0.00 0.00 177.00 176.29 2g2o s LEU 194 N -0.31 3.58 -0.56 -5.54 1.02 -0.94 -4.94 118.68 111.00 2g2o s LEU 194 Ca 0.52 -0.33 -0.05 0.00 0.02 0.00 0.00 54.13 54.29 2g2o s LEU 194 Cb -0.32 -2.16 -0.05 0.00 0.02 0.00 0.00 46.19 43.68 2g2o s LEU 194 CO 0.36 0.02 1.69 -0.81 0.02 0.00 0.00 176.35 177.64 2g2o n PRO 195 N -0.68 1.25 0.00 1.29 -0.04 -1.26 -4.65 135.00 130.91 2g2o n PRO 195 Ca -0.08 -1.13 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 2g2o n PRO 195 Cb 0.57 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.71 2g2o n PRO 195 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2g2o n VAL 196 N 4.67 0.00 0.00 0.52 3.14 -1.26 -4.97 118.33 120.43 2g2o n VAL 196 Ca 0.29 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.67 2g2o n VAL 196 Cb 0.11 -0.04 0.00 0.00 -1.06 0.00 0.00 33.84 32.84 2g2o n VAL 196 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2g2o n SER 197 N 0.00 0.00 -4.57 6.55 2.88 -1.26 -4.96 113.62 112.26 2g2o n SER 197 Ca 0.00 0.00 -0.48 0.00 -1.33 0.00 0.00 58.87 57.06 2g2o n SER 197 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 2g2o n SER 197 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2g2o n VAL 198 N 0.00 0.36 -2.22 2.46 0.31 -1.26 -4.09 118.33 113.90 2g2o n VAL 198 Ca 0.00 -0.25 -0.43 0.00 -0.01 0.00 0.00 64.34 63.65 2g2o n VAL 198 Cb 0.00 -1.93 0.00 0.00 -0.91 0.00 0.00 33.84 31.00 2g2o n VAL 198 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2g2o n PRO 199 N 7.73 3.14 -1.91 5.55 -0.04 -1.26 -4.84 135.00 143.36 2g2o n PRO 199 Ca 0.32 -3.09 -0.36 0.00 -0.04 0.00 0.00 63.50 60.32 2g2o n PRO 199 Cb 0.30 -3.26 0.05 0.00 -0.04 0.00 0.00 33.50 30.54 2g2o n PRO 199 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2g2o s SER 200 N 3.07 4.98 -1.35 3.54 0.01 -1.26 -3.90 113.70 118.79 2g2o s SER 200 Ca 0.47 2.46 0.00 0.00 1.31 0.00 0.00 55.95 60.20 2g2o s SER 200 Cb 0.08 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2g2o s SER 200 CO -0.01 -1.74 0.00 1.41 0.41 0.00 0.00 173.24 173.30 2g2o n HIS 201 N -1.72 -0.31 -4.64 2.43 8.25 -0.86 -4.84 115.22 113.53 2g2o n HIS 201 Ca 0.14 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.31 2g2o n HIS 201 Cb 0.49 -2.73 -0.07 0.00 1.12 0.00 0.00 29.99 28.80 2g2o n HIS 201 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2g2o h ALA 203 N 1.48 1.17 0.00 0.00 0.00 -1.90 -0.92 119.26 119.09 2g2o h ALA 203 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2g2o h ALA 203 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2g2o h ALA 203 CO 0.61 0.02 0.00 -0.07 0.00 0.00 0.00 179.25 179.81 2g2o h LEU 204 N 0.00 0.00 -1.60 0.00 3.38 -1.90 -2.00 115.31 113.18 2g2o h LEU 204 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g2o h LEU 204 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2g2o h LEU 204 CO 0.00 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.76 2g2o n MET 205 N -2.43 2.04 0.39 1.13 2.81 -0.35 -4.50 117.12 116.21 2g2o n MET 205 Ca -0.00 -1.58 -0.19 0.00 -1.81 0.00 0.00 57.70 54.12 2g2o n MET 205 Cb 0.14 -1.43 -0.10 0.00 -0.71 0.00 0.00 33.22 31.12 2g2o n MET 205 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2g2o h LYS 206 N 3.05 -1.09 -0.13 0.03 1.63 -1.54 0.67 116.57 119.19 2g2o h LYS 206 Ca 0.00 0.07 0.04 0.00 -0.85 0.00 0.00 60.65 59.91 2g2o h LYS 206 Cb 0.67 0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 32.55 2g2o h LYS 206 CO 0.00 -0.73 0.10 -1.35 -3.45 0.00 0.00 179.45 174.02 2g2o h PRO 207 N -1.13 0.00 -0.53 1.90 0.11 -1.83 0.64 132.00 131.15 2g2o h PRO 207 Ca -0.09 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.91 2g2o h PRO 207 Cb 0.93 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 2g2o h PRO 207 CO 0.06 0.00 -0.08 0.00 -0.21 0.00 0.00 178.00 177.77 2g2o h ALA 208 N 1.93 0.72 -0.52 -0.75 0.00 -1.77 -2.81 119.26 116.06 2g2o h ALA 208 Ca 0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2g2o h ALA 208 Cb 0.25 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2g2o h ALA 208 CO -0.00 0.61 0.21 0.00 0.00 0.00 0.00 179.25 180.07 2g2o h ALA 209 N 0.92 1.40 -0.29 0.00 0.00 0.26 0.21 119.26 121.77 2g2o h ALA 209 Ca 0.14 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2g2o h ALA 209 Cb 0.64 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2g2o h ALA 209 CO 0.04 0.46 -0.33 -0.44 0.00 0.00 0.00 179.25 178.98 2g2o h ASP 210 N 0.73 0.66 -0.37 0.00 3.32 -0.92 0.50 116.42 120.34 2g2o h ASP 210 Ca 0.18 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 56.89 2g2o h ASP 210 Cb 0.14 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2g2o h ASP 210 CO -0.02 0.94 -0.04 0.11 -1.72 0.00 0.00 179.24 178.51 2g2o h LYS 211 N 0.54 0.68 -0.99 3.56 1.57 -1.20 -3.17 116.57 117.56 2g2o h LYS 211 Ca 0.06 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2g2o h LYS 211 Cb 0.83 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.04 2g2o h LYS 211 CO 0.07 0.81 0.64 1.25 -0.57 0.00 0.00 179.45 181.65 2g2o h LEU 212 N 0.49 1.15 -1.25 2.94 5.85 -0.46 -2.45 115.31 121.57 2g2o h LEU 212 Ca 0.10 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.80 2g2o h LEU 212 Cb 0.53 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2g2o h LEU 212 CO 0.03 0.85 0.52 0.00 -0.34 0.00 0.00 178.44 179.50 2g2o h ALA 213 N 1.36 1.50 -0.56 1.25 0.00 -0.91 0.86 119.26 122.76 2g2o h ALA 213 Ca 0.36 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 2g2o h ALA 213 Cb -0.13 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.35 2g2o h ALA 213 CO -0.07 0.43 0.31 0.28 0.00 0.00 0.00 179.25 180.19 2g2o h VAL 214 N 1.00 1.18 -0.27 0.00 2.07 -1.42 -2.04 116.25 116.77 2g2o h VAL 214 Ca 0.31 -0.45 -0.19 0.00 0.82 0.00 0.00 66.70 67.18 2g2o h VAL 214 Cb 0.00 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2g2o h VAL 214 CO -0.08 0.20 -0.59 -0.33 0.02 0.00 0.00 177.57 176.78 2g2o h GLU 215 N 0.75 0.87 -0.37 1.57 4.39 -1.13 -3.13 114.58 117.53 2g2o h GLU 215 Ca 0.20 -0.58 -0.01 0.00 0.34 0.00 0.00 59.36 59.31 2g2o h GLU 215 Cb 0.04 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 2g2o h GLU 215 CO -0.03 1.21 0.21 -0.07 -1.16 0.00 0.00 179.01 179.17 2g2o h LEU 216 N 0.65 0.44 -1.68 1.33 3.38 -0.72 -2.07 115.31 116.64 2g2o h LEU 216 Ca 0.00 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2g2o h LEU 216 Cb 1.20 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 2g2o h LEU 216 CO 0.13 0.35 -0.19 0.00 0.09 0.00 0.00 178.44 178.83 2g2o h ALA 217 N 1.72 1.37 0.00 1.53 0.00 -1.31 -1.72 119.26 120.85 2g2o h ALA 217 Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2g2o h ALA 217 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2g2o h ALA 217 CO -0.02 0.23 0.00 1.63 0.00 0.00 0.00 179.25 181.09 2g2o n LYS 218 N -3.84 0.21 -4.20 0.00 5.02 -0.78 -4.81 118.16 109.77 2g2o n LYS 218 Ca -0.02 0.29 -0.35 0.00 -2.02 0.00 0.00 58.31 56.21 2g2o n LYS 218 Cb 0.28 -1.81 -0.10 0.00 -0.02 0.00 0.00 35.03 33.39 2g2o n LYS 218 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2g2o s ILE 219 N -3.18 4.50 0.13 -0.18 -1.09 -0.65 -5.07 121.20 115.67 2g2o s ILE 219 Ca 0.08 -0.15 -0.31 0.00 -2.23 0.00 0.00 60.65 58.04 2g2o s ILE 219 Cb 0.11 -2.97 -0.09 0.00 -1.58 0.00 0.00 42.46 37.93 2g2o s ILE 219 CO 0.50 0.53 1.56 -0.89 -1.23 0.00 0.00 174.94 175.40 2g2o s THR 220 N -0.14 2.86 -0.16 2.92 2.01 -1.26 -5.01 115.64 116.87 2g2o s THR 220 Ca 0.06 0.55 -0.02 0.00 0.31 0.00 0.00 61.69 62.58 2g2o s THR 220 Cb -0.12 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.01 2g2o s THR 220 CO 0.02 0.03 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.54 2g2o s PHE 221 N 1.56 2.93 0.35 4.92 0.40 -1.26 -4.58 117.98 122.30 2g2o s PHE 221 Ca 0.70 -0.54 0.07 0.00 -0.60 0.00 0.00 56.93 56.56 2g2o s PHE 221 Cb -0.41 -1.94 -0.02 0.00 0.51 0.00 0.00 43.02 41.16 2g2o s PHE 221 CO 0.31 -0.19 0.38 -0.80 0.70 0.00 0.00 175.22 175.61 2g2o s ASN 222 N 0.55 5.52 0.33 1.36 0.01 0.04 -4.73 114.94 118.01 2g2o s ASN 222 Ca -0.05 -0.41 -0.29 0.00 -0.71 0.00 0.00 52.86 51.40 2g2o s ASN 222 Cb -0.15 -1.01 -0.10 0.00 0.41 0.00 0.00 41.25 40.40 2g2o s ASN 222 CO 0.03 -0.43 1.35 0.00 -1.51 0.00 0.00 177.10 176.54 2g2o s ALA 223 N -2.28 3.52 0.38 0.60 0.00 -1.26 -4.41 121.76 118.31 2g2o s ALA 223 Ca 0.44 1.31 -0.26 0.00 0.00 0.00 0.00 51.96 53.45 2g2o s ALA 223 Cb -0.07 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 2g2o s ALA 223 CO 0.29 -0.71 1.19 -1.25 0.00 0.00 0.00 175.76 175.28 2g2o s PRO 224 N -1.68 4.16 0.01 0.00 0.04 -1.26 -4.50 135.00 131.77 2g2o s PRO 224 Ca 0.51 1.92 0.24 0.00 0.04 0.00 0.00 61.00 63.70 2g2o s PRO 224 Cb -0.41 -2.80 0.23 0.00 0.04 0.00 0.00 34.50 31.56 2g2o s PRO 224 CO 0.53 -0.25 1.21 0.25 0.04 0.00 0.00 177.00 178.78 2g2o n THR 225 N 0.32 0.05 -3.95 1.26 -2.24 -0.07 -4.84 114.28 104.80 2g2o n THR 225 Ca 0.03 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.62 2g2o n THR 225 Cb 0.45 0.41 -0.14 0.00 -2.10 0.00 0.00 70.33 68.95 2g2o n THR 225 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2g2o s VAL 226 N -3.05 0.12 0.24 2.28 -7.23 -1.26 -5.11 120.40 106.39 2g2o s VAL 226 Ca 0.09 -0.07 -0.31 0.00 -1.81 0.00 0.00 61.98 59.87 2g2o s VAL 226 Cb 0.16 -0.11 -0.12 0.00 0.56 0.00 0.00 36.38 36.87 2g2o s VAL 226 CO 0.76 0.03 1.62 -2.65 -0.31 0.00 0.00 175.10 174.55 2g2o n PRO 227 N 3.04 2.58 -4.03 4.82 -0.02 -1.26 -4.81 135.00 135.32 2g2o n PRO 227 Ca -0.12 0.92 -0.34 0.00 -2.02 0.00 0.00 63.50 61.95 2g2o n PRO 227 Cb 0.59 -2.72 -0.15 0.00 -0.02 0.00 0.00 33.50 31.21 2g2o n PRO 227 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2g2o s VAL 228 N 0.54 2.55 -0.27 -1.45 1.01 -1.26 -0.47 120.40 121.06 2g2o s VAL 228 Ca 0.70 -0.93 -0.27 0.00 0.00 0.00 0.00 61.98 61.49 2g2o s VAL 228 Cb -0.54 -2.19 0.01 0.00 0.00 0.00 0.00 36.38 33.66 2g2o s VAL 228 CO 0.41 0.38 0.94 -0.69 0.00 0.00 0.00 175.10 176.15 2g2o s VAL 229 N 1.32 4.71 0.44 2.92 1.01 -0.23 -4.07 120.40 126.50 2g2o s VAL 229 Ca 0.03 1.69 -0.10 0.00 0.00 0.00 0.00 61.98 63.59 2g2o s VAL 229 Cb -0.15 -4.25 -0.06 0.00 0.00 0.00 0.00 36.38 31.92 2g2o s VAL 229 CO -0.08 -0.23 0.82 0.54 0.00 0.00 0.00 175.10 176.15 2g2o s ASN 230 N 1.41 6.47 0.19 3.32 6.03 -0.25 -4.55 114.94 127.57 2g2o s ASN 230 Ca 0.40 1.17 0.01 0.00 -1.03 0.00 0.00 52.86 53.41 2g2o s ASN 230 Cb -0.14 -2.34 0.11 0.00 -3.03 0.00 0.00 41.25 35.85 2g2o s ASN 230 CO 0.09 -0.48 1.47 0.78 -2.03 0.00 0.00 177.10 176.93 2g2o h ASN 231 N 0.94 0.40 0.19 3.54 2.35 -1.90 -1.20 115.58 119.90 2g2o h ASN 231 Ca -0.47 -0.25 -0.30 0.00 -0.55 0.00 0.00 56.30 54.73 2g2o h ASN 231 Cb 1.19 -0.12 0.02 0.00 0.05 0.00 0.00 38.32 39.46 2g2o h ASN 231 CO 0.63 0.97 -1.37 1.62 -1.65 0.00 0.00 177.43 177.63 2g2o h VAL 232 N 0.24 1.22 -0.00 2.81 3.04 -1.87 -1.65 116.25 120.03 2g2o h VAL 232 Ca -0.02 -2.57 0.00 0.00 -1.01 0.00 0.00 66.70 63.10 2g2o h VAL 232 Cb 1.25 2.97 0.00 0.00 -2.01 0.00 0.00 31.29 33.50 2g2o h VAL 232 CO 0.11 0.78 -0.19 0.47 -1.01 0.00 0.00 177.57 177.73 2g2o n ASP 233 N -3.82 0.53 -3.64 3.17 8.00 -1.26 -4.87 116.55 114.67 2g2o n ASP 233 Ca -0.19 -0.77 -0.21 0.00 0.71 0.00 0.00 54.79 54.33 2g2o n ASP 233 Cb 1.00 0.77 0.04 0.00 -0.02 0.00 0.00 41.12 42.91 2g2o n ASP 233 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2g2o n VAL 234 N -0.79 -4.98 -4.40 2.53 0.31 -0.45 -5.00 118.33 105.54 2g2o n VAL 234 Ca 0.02 -0.56 -0.21 0.00 -0.01 0.00 0.00 64.34 63.57 2g2o n VAL 234 Cb 0.10 -4.11 -0.13 0.00 -0.91 0.00 0.00 33.84 28.78 2g2o n VAL 234 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2g2o s LYS 235 N -5.82 1.01 -1.02 5.55 1.02 -1.25 -4.81 119.74 114.43 2g2o s LYS 235 Ca 0.04 -0.78 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 2g2o s LYS 235 Cb -0.01 -1.03 0.20 0.00 -0.52 0.00 0.00 37.83 36.46 2g2o s LYS 235 CO 0.80 0.26 1.11 0.00 -0.92 0.00 0.00 175.35 176.60 2g2o s GLU 237 N 0.90 4.14 0.00 0.00 0.41 -1.26 -4.92 118.70 117.97 2g2o s GLU 237 Ca 0.31 1.31 0.00 0.00 -0.41 0.00 0.00 54.97 56.18 2g2o s GLU 237 Cb -0.07 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 29.97 2g2o s GLU 237 CO -0.07 -0.13 0.00 0.25 -0.49 0.00 0.00 175.26 174.82 2g2o n THR 238 N -0.45 0.00 -1.63 3.63 -2.24 -1.26 -4.77 114.28 107.56 2g2o n THR 238 Ca 0.07 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 2g2o n THR 238 Cb 0.52 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 68.35 2g2o n THR 238 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2g2o n ASN 239 N -1.66 3.70 -0.30 3.42 2.85 -1.26 -4.56 115.26 117.45 2g2o n ASN 239 Ca 0.00 0.61 0.11 0.00 -0.11 0.00 0.00 54.58 55.19 2g2o n ASN 239 Cb 0.27 -1.52 0.28 0.00 1.24 0.00 0.00 39.78 40.05 2g2o n ASN 239 CO 0.00 0.00 0.00 1.23 -2.11 0.00 0.00 177.26 176.38 2g2o h GLY 240 N 12.36 1.50 2.00 8.20 0.00 -1.85 0.52 103.07 125.80 2g2o h GLY 240 Ca -0.46 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 46.64 2g2o h GLY 240 CO 0.95 -0.18 -0.13 -0.55 0.00 0.00 0.00 176.54 176.64 2g2o h ASP 241 N 0.50 0.00 0.69 0.19 3.32 -1.88 -2.64 116.42 116.59 2g2o h ASP 241 Ca 0.53 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.38 2g2o h ASP 241 Cb 0.92 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 2g2o h ASP 241 CO -0.46 0.13 -0.90 0.00 -1.72 0.00 0.00 179.24 176.28 2g2o h ALA 242 N 1.87 0.50 0.18 3.45 0.00 -0.44 -2.27 119.26 122.55 2g2o h ALA 242 Ca -0.00 -0.76 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 2g2o h ALA 242 Cb 1.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2g2o h ALA 242 CO 0.02 0.98 -0.08 0.82 0.00 0.00 0.00 179.25 180.98 2g2o h ILE 243 N 0.07 0.94 -0.66 0.00 2.04 -0.86 -1.58 117.51 117.46 2g2o h ILE 243 Ca -0.04 -0.82 0.14 0.00 1.00 0.00 0.00 64.86 65.14 2g2o h ILE 243 Cb 1.55 1.41 -0.12 0.00 -0.74 0.00 0.00 36.82 38.93 2g2o h ILE 243 CO 0.13 0.18 -0.09 -0.09 0.00 0.00 0.00 178.15 178.29 2g2o h ARG 244 N -0.66 0.05 0.00 2.37 2.43 -1.57 0.20 114.38 117.20 2g2o h ARG 244 Ca -0.02 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2g2o h ARG 244 Cb 0.48 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2g2o h ARG 244 CO 0.04 0.03 -0.12 0.22 -1.51 0.00 0.00 179.97 178.63 2g2o h ASP 245 N 0.05 0.00 1.41 -3.80 3.58 -1.28 -2.24 116.42 114.13 2g2o h ASP 245 Ca 0.33 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.74 2g2o h ASP 245 Cb 0.54 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.58 2g2o h ASP 245 CO -0.63 0.12 -0.19 0.00 -2.88 0.00 0.00 179.24 175.66 2g2o h ALA 246 N 1.88 0.92 -0.13 -0.78 0.00 0.40 -3.11 119.26 118.45 2g2o h ALA 246 Ca -0.00 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 2g2o h ALA 246 Cb 0.21 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2g2o h ALA 246 CO 0.02 0.23 -0.67 -0.07 0.00 0.00 0.00 179.25 178.76 2g2o h LEU 247 N 0.00 0.61 0.50 0.00 3.38 -0.75 -1.25 115.31 117.80 2g2o h LEU 247 Ca -0.00 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 2g2o h LEU 247 Cb 0.94 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 2g2o h LEU 247 CO 0.02 1.11 -0.29 0.58 0.09 0.00 0.00 178.44 179.96 2g2o h VAL 248 N 0.38 0.41 0.00 1.22 2.07 -1.49 -2.91 116.25 115.93 2g2o h VAL 248 Ca -0.02 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 2g2o h VAL 248 Cb 1.24 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2g2o h VAL 248 CO 0.12 0.00 -0.22 0.03 0.02 0.00 0.00 177.57 177.52 2g2o h ARG 249 N -0.74 0.00 -1.00 1.57 3.08 -1.58 -2.11 114.38 113.60 2g2o h ARG 249 Ca -0.06 0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.20 2g2o h ARG 249 Cb 0.60 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.53 2g2o h ARG 249 CO 0.07 0.22 0.60 0.37 -1.07 0.00 0.00 179.97 180.16 2g2o h GLN 250 N 0.00 0.69 0.00 0.04 4.15 -1.02 -2.36 115.11 116.60 2g2o h GLN 250 Ca -0.00 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.29 2g2o h GLN 250 Cb 0.42 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2g2o h GLN 250 CO 0.03 0.45 -0.41 1.25 -1.93 0.00 0.00 178.83 178.22 2g2o h LEU 251 N 0.71 0.00 -3.01 -2.39 5.85 -1.33 -3.10 115.31 112.03 2g2o h LEU 251 Ca 0.60 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.32 2g2o h LEU 251 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2g2o h LEU 251 CO -0.41 0.41 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 2g2o n TYR 252 N -3.99 0.04 -4.33 1.25 4.11 -1.04 -2.02 117.16 111.20 2g2o n TYR 252 Ca -0.02 -0.81 -0.18 0.00 -0.00 0.00 0.00 57.90 56.90 2g2o n TYR 252 Cb 0.45 -0.12 -0.10 0.00 -0.00 0.00 0.00 39.34 39.57 2g2o n TYR 252 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.86 176.06 2g2o s ASN 253 N -2.13 2.46 0.47 9.48 0.01 -0.92 -3.81 114.94 120.50 2g2o s ASN 253 Ca 0.21 -0.99 -0.24 0.00 -0.71 0.00 0.00 52.86 51.13 2g2o s ASN 253 Cb 0.18 -0.12 -0.07 0.00 0.41 0.00 0.00 41.25 41.65 2g2o s ASN 253 CO 0.02 -0.17 1.27 -2.16 -1.51 0.00 0.00 177.10 174.55 2g2o s PRO 254 N -3.52 3.64 -0.28 -0.60 0.04 -1.21 -4.64 135.00 128.44 2g2o s PRO 254 Ca 0.20 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 62.99 2g2o s PRO 254 Cb -0.01 -2.47 0.01 0.00 0.04 0.00 0.00 34.50 32.06 2g2o s PRO 254 CO 0.06 -0.73 1.12 0.08 0.04 0.00 0.00 177.00 177.57 2g2o s VAL 255 N -1.38 4.48 -1.24 -0.36 1.01 0.06 -4.53 120.40 118.43 2g2o s VAL 255 Ca 0.64 1.73 -0.06 0.00 0.00 0.00 0.00 61.98 64.29 2g2o s VAL 255 Cb -0.35 -4.31 0.19 0.00 0.00 0.00 0.00 36.38 31.91 2g2o s VAL 255 CO 0.43 -0.37 1.99 0.00 0.00 0.00 0.00 175.10 177.16 2g2o n GLN 256 N 6.76 4.27 -0.04 2.72 1.13 -0.62 -1.20 117.38 130.41 2g2o n GLN 256 Ca 0.13 -3.77 -0.14 0.00 -1.94 0.00 0.00 57.00 51.27 2g2o n GLN 256 Cb 0.46 -2.71 -0.09 0.00 0.11 0.00 0.00 30.24 28.01 2g2o n GLN 256 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2g2o h TRP 257 N 5.15 0.43 -0.30 1.08 2.91 -1.61 -1.53 115.95 122.07 2g2o h TRP 257 Ca 0.49 -0.17 0.07 0.00 1.13 0.00 0.00 58.89 60.41 2g2o h TRP 257 Cb 0.48 -0.07 -0.07 0.00 -0.51 0.00 0.00 29.16 28.98 2g2o h TRP 257 CO 1.35 0.87 -0.22 1.15 -1.03 0.00 0.00 178.44 180.56 2g2o h THR 258 N -0.13 0.42 0.00 2.65 2.02 -1.10 -0.39 112.91 116.37 2g2o h THR 258 Ca -0.01 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.07 2g2o h THR 258 Cb 0.87 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 2g2o h THR 258 CO 0.05 0.00 -0.47 0.11 0.37 0.00 0.00 175.52 175.58 2g2o h LYS 259 N -0.19 0.00 -0.48 6.66 1.57 -1.84 -1.89 116.57 120.39 2g2o h LYS 259 Ca 0.16 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.85 2g2o h LYS 259 Cb 0.43 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 2g2o h LYS 259 CO -0.41 0.47 -0.02 0.77 -0.57 0.00 0.00 179.45 179.68 2g2o h SER 260 N 0.00 0.85 -0.30 0.86 0.02 -0.45 0.07 113.55 114.60 2g2o h SER 260 Ca -0.00 -0.32 -0.12 0.00 -0.84 0.00 0.00 61.79 60.51 2g2o h SER 260 Cb 0.88 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 2g2o h SER 260 CO 0.06 0.97 -0.22 0.58 -1.14 0.00 0.00 176.83 177.07 2g2o h VAL 261 N 0.72 1.27 -0.76 2.27 2.07 -0.89 -1.70 116.25 119.23 2g2o h VAL 261 Ca 0.13 -1.34 -0.00 0.00 0.82 0.00 0.00 66.70 66.31 2g2o h VAL 261 Cb 0.54 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 2g2o h VAL 261 CO 0.03 0.45 0.48 -0.33 0.02 0.00 0.00 177.57 178.21 2g2o h GLU 262 N 0.68 1.03 -0.28 1.57 5.08 -1.22 -2.31 114.58 119.13 2g2o h GLU 262 Ca 0.09 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 2g2o h GLU 262 Cb 0.74 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2g2o h GLU 262 CO 0.06 0.71 0.06 -0.92 -1.00 0.00 0.00 179.01 177.92 2g2o h TYR 263 N 1.04 0.47 -0.69 4.33 3.20 -0.63 -0.20 116.97 124.50 2g2o h TYR 263 Ca 0.28 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 62.13 2g2o h TYR 263 Cb -0.07 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.02 2g2o h TYR 263 CO -0.01 0.52 0.42 0.52 -1.64 0.00 0.00 178.16 177.98 2g2o h MET 264 N 0.28 0.79 -0.85 1.82 2.86 -1.27 -1.98 114.93 116.59 2g2o h MET 264 Ca 0.09 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2g2o h MET 264 Cb 0.29 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.73 2g2o h MET 264 CO 0.00 0.53 0.46 0.00 1.06 0.00 0.00 176.91 178.95 2g2o h ALA 265 N 1.31 1.10 0.00 6.32 0.00 -0.95 -1.83 119.26 125.20 2g2o h ALA 265 Ca 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2g2o h ALA 265 Cb 0.06 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 2g2o h ALA 265 CO -0.13 0.62 -0.06 0.00 0.00 0.00 0.00 179.25 179.68 2g2o h ALA 266 N 1.25 1.48 -0.01 0.00 0.00 -0.40 -1.04 119.26 120.53 2g2o h ALA 266 Ca 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2g2o h ALA 266 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2g2o h ALA 266 CO -0.05 0.07 -0.01 1.04 0.00 0.00 0.00 179.25 180.31 2g2o n GLN 267 N -3.85 1.49 0.00 0.00 1.13 -0.74 -4.90 117.38 110.51 2g2o n GLN 267 Ca -0.03 -0.74 0.00 0.00 -1.94 0.00 0.00 57.00 54.30 2g2o n GLN 267 Cb 0.15 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.01 2g2o n GLN 267 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g2o n GLY 268 N 1.14 0.88 3.74 1.08 0.00 -0.39 -5.07 105.19 106.57 2g2o n GLY 268 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2g2o n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g2o s VAL 269 N -2.00 2.55 -0.07 1.61 1.01 -0.91 -4.60 120.40 118.00 2g2o s VAL 269 Ca 0.00 0.44 0.10 0.00 0.00 0.00 0.00 61.98 62.52 2g2o s VAL 269 Cb 0.00 -3.28 -0.14 0.00 0.00 0.00 0.00 36.38 32.96 2g2o s VAL 269 CO 0.00 0.06 0.11 -0.62 0.00 0.00 0.00 175.10 174.65 2g2o n GLU 270 N 2.81 1.62 -3.96 2.72 1.02 0.27 -4.44 120.64 120.68 2g2o n GLU 270 Ca 0.09 -0.04 -0.14 0.00 -0.02 0.00 0.00 57.16 57.05 2g2o n GLU 270 Cb 0.39 -1.26 -0.15 0.00 -0.02 0.00 0.00 31.44 30.41 2g2o n GLU 270 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2g2o s HIS 271 N -2.43 0.21 -0.22 -0.32 5.04 -1.13 -2.56 115.29 113.88 2g2o s HIS 271 Ca -0.05 -0.01 -0.07 0.00 -1.54 0.00 0.00 55.06 53.39 2g2o s HIS 271 Cb 0.04 -0.20 -0.03 0.00 0.04 0.00 0.00 32.58 32.43 2g2o s HIS 271 CO 0.43 -0.04 0.06 -0.51 -2.34 0.00 0.00 174.74 172.34 2g2o s LEU 272 N 0.29 3.55 -0.19 8.88 1.43 -0.49 -1.13 118.68 131.03 2g2o s LEU 272 Ca -0.03 -0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 52.82 2g2o s LEU 272 Cb -0.05 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 2g2o s LEU 272 CO -0.01 0.04 0.32 -0.31 0.23 0.00 0.00 176.35 176.63 2g2o s TYR 273 N 1.14 3.41 -0.48 0.29 2.02 -0.23 -1.71 117.35 121.78 2g2o s TYR 273 Ca 0.04 0.56 -0.23 0.00 -0.37 0.00 0.00 57.07 57.07 2g2o s TYR 273 Cb -0.14 -2.41 0.03 0.00 -0.40 0.00 0.00 41.96 39.04 2g2o s TYR 273 CO 0.03 0.11 0.79 -2.00 -1.57 0.00 0.00 175.55 172.91 2g2o s GLU 274 N 0.90 3.33 -1.11 -0.62 2.12 -0.03 -0.65 118.70 122.63 2g2o s GLU 274 Ca 0.16 -0.28 -0.07 0.00 0.36 0.00 0.00 54.97 55.14 2g2o s GLU 274 Cb -0.14 -3.99 0.29 0.00 0.26 0.00 0.00 34.13 30.55 2g2o s GLU 274 CO 0.06 -1.21 1.28 0.28 -0.54 0.00 0.00 175.26 175.13 2g2o n VAL 275 N 6.05 4.85 0.00 3.70 0.31 0.36 -1.38 118.33 132.23 2g2o n VAL 275 Ca 0.01 -5.56 0.00 0.00 -0.01 0.00 0.00 64.34 58.77 2g2o n VAL 275 Cb 0.48 -2.39 0.00 0.00 -0.91 0.00 0.00 33.84 31.01 2g2o n VAL 275 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2g2o n GLY 276 N 2.21 -0.44 3.76 2.92 0.00 -1.26 -4.48 105.19 107.89 2g2o n GLY 276 Ca 0.25 -0.94 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 2g2o n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g2o s PRO 277 N -2.00 2.78 0.41 1.61 0.04 -1.26 -4.43 135.00 132.15 2g2o s PRO 277 Ca 0.00 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.52 2g2o s PRO 277 Cb 0.00 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2g2o s PRO 277 CO 0.00 -1.28 0.00 0.41 0.04 0.00 0.00 177.00 176.17 2g2o n GLY 278 N -0.28 -2.30 1.46 0.56 0.00 -1.26 -4.75 105.19 98.62 2g2o n GLY 278 Ca 0.11 -1.56 0.04 0.00 0.00 0.00 0.00 46.02 44.61 2g2o n GLY 278 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g2o n LYS 279 N -0.48 0.42 0.09 1.61 5.02 -1.26 -4.89 118.16 118.66 2g2o n LYS 279 Ca 0.00 -2.34 -0.13 0.00 -2.02 0.00 0.00 58.31 53.82 2g2o n LYS 279 Cb 0.00 -0.39 -0.08 0.00 -0.02 0.00 0.00 35.03 34.53 2g2o n LYS 279 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2g2o h VAL 280 N 5.91 0.94 -0.14 -0.18 2.07 -1.98 -1.96 116.25 120.91 2g2o h VAL 280 Ca -0.18 -0.61 -0.13 0.00 0.82 0.00 0.00 66.70 66.60 2g2o h VAL 280 Cb 1.71 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.78 2g2o h VAL 280 CO 0.10 0.14 -0.48 -0.07 0.02 0.00 0.00 177.57 177.28 2g2o h LEU 281 N -0.53 0.39 -0.49 2.57 3.38 -1.95 -2.57 115.31 116.10 2g2o h LEU 281 Ca -0.02 -0.19 0.09 0.00 0.09 0.00 0.00 57.88 57.85 2g2o h LEU 281 Cb 0.41 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.98 2g2o h LEU 281 CO 0.04 0.81 0.08 0.74 0.09 0.00 0.00 178.44 180.19 2g2o h THR 282 N 0.29 0.70 -0.07 0.22 2.02 -1.91 -2.67 112.91 111.49 2g2o h THR 282 Ca 0.02 -0.07 -0.09 0.00 0.77 0.00 0.00 66.41 67.04 2g2o h THR 282 Cb 0.95 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 2g2o h THR 282 CO 0.08 0.04 -0.35 1.23 0.37 0.00 0.00 175.52 176.89 2g2o h GLY 283 N 0.21 0.16 2.00 2.16 0.00 -0.96 -2.54 103.07 104.10 2g2o h GLY 283 Ca 0.25 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 2g2o h GLY 283 CO -0.34 0.12 -0.25 1.41 0.00 0.00 0.00 176.54 177.48 2g2o h LEU 284 N 0.13 0.00 0.15 3.11 3.38 -1.21 -3.38 115.31 117.48 2g2o h LEU 284 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2g2o h LEU 284 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 2g2o h LEU 284 CO 0.05 0.25 -0.07 0.74 0.09 0.00 0.00 178.44 179.50 2g2o h THR 285 N 0.00 0.94 0.00 0.22 2.02 -1.31 -1.90 112.91 112.89 2g2o h THR 285 Ca -0.00 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.75 2g2o h THR 285 Cb 0.60 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.18 2g2o h THR 285 CO 0.03 0.09 -0.20 0.11 0.37 0.00 0.00 175.52 175.92 2g2o h LYS 286 N -0.38 0.00 0.00 6.66 1.57 -1.74 -1.43 116.57 121.24 2g2o h LYS 286 Ca -0.02 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 2g2o h LYS 286 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2g2o h LYS 286 CO 0.03 0.20 -0.34 0.00 -0.57 0.00 0.00 179.45 178.78 2g2o h ARG 287 N 0.00 0.00 0.00 3.15 3.08 -1.56 -3.06 114.38 115.98 2g2o h ARG 287 Ca -0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 2g2o h ARG 287 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2g2o h ARG 287 CO 0.03 0.34 -0.53 0.82 -1.07 0.00 0.00 179.97 179.55 2g2o h ILE 288 N 0.00 1.32 -3.28 2.04 2.04 -0.82 -3.42 117.51 115.38 2g2o h ILE 288 Ca -0.00 -2.19 -0.53 0.00 1.00 0.00 0.00 64.86 63.14 2g2o h ILE 288 Cb 0.60 2.69 -0.40 0.00 -0.74 0.00 0.00 36.82 38.97 2g2o h ILE 288 CO 0.04 0.45 -0.77 -0.69 0.00 0.00 0.00 178.15 177.18 2g2o s VAL 289 N -2.25 0.62 -0.48 1.67 1.01 -0.63 -4.97 120.40 115.37 2g2o s VAL 289 Ca -0.22 -0.67 0.24 0.00 0.00 0.00 0.00 61.98 61.33 2g2o s VAL 289 Cb 0.01 -1.14 0.25 0.00 0.00 0.00 0.00 36.38 35.51 2g2o s VAL 289 CO 0.61 -0.24 1.72 -0.90 0.00 0.00 0.00 175.10 176.29 2g2o n ASP 290 N 5.01 0.70 -0.24 3.32 5.68 -1.16 -1.74 116.55 128.13 2g2o n ASP 290 Ca -0.09 0.67 0.11 0.00 -0.50 0.00 0.00 54.79 54.98 2g2o n ASP 290 Cb 0.46 -0.82 0.05 0.00 -1.14 0.00 0.00 41.12 39.68 2g2o n ASP 290 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2g2o n THR 291 N -2.26 0.00 -2.40 2.12 -2.24 -1.26 -4.89 114.28 103.35 2g2o n THR 291 Ca 0.02 -0.12 -0.35 0.00 -2.27 0.00 0.00 64.05 61.33 2g2o n THR 291 Cb 0.24 0.92 -0.02 0.00 -2.10 0.00 0.00 70.33 69.37 2g2o n THR 291 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2g2o s LEU 292 N -2.72 3.89 0.26 3.22 1.43 -0.71 -5.03 118.68 119.02 2g2o s LEU 292 Ca 0.15 2.10 0.10 0.00 -1.03 0.00 0.00 54.13 55.44 2g2o s LEU 292 Cb 0.17 -4.45 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 2g2o s LEU 292 CO 0.68 -0.90 -0.04 0.42 0.23 0.00 0.00 176.35 176.74 2g2o s THR 293 N -1.78 3.32 0.03 5.49 -4.23 -1.06 -4.63 115.64 112.78 2g2o s THR 293 Ca 0.67 -1.93 -0.17 0.00 -1.18 0.00 0.00 61.69 59.08 2g2o s THR 293 Cb -0.22 -2.75 0.03 0.00 1.34 0.00 0.00 72.50 70.90 2g2o s THR 293 CO 0.26 -0.34 0.37 0.00 -0.54 0.00 0.00 174.62 174.36 2g2o s ALA 294 N -2.27 -0.89 0.17 3.99 0.00 -1.26 -1.39 121.76 120.11 2g2o s ALA 294 Ca 0.30 0.24 -0.23 0.00 0.00 0.00 0.00 51.96 52.28 2g2o s ALA 294 Cb -0.07 0.28 0.06 0.00 0.00 0.00 0.00 23.12 23.40 2g2o s ALA 294 CO 0.19 -0.41 0.65 -1.54 0.00 0.00 0.00 175.76 174.65 2g2o s SER 295 N -1.89 -0.49 0.18 0.00 1.04 -0.70 -4.97 113.70 106.88 2g2o s SER 295 Ca -0.07 -0.13 0.04 0.00 0.48 0.00 0.00 55.95 56.27 2g2o s SER 295 Cb -0.01 0.61 -0.03 0.00 0.10 0.00 0.00 66.02 66.68 2g2o s SER 295 CO -0.01 -1.02 0.26 0.00 0.98 0.00 0.00 173.24 173.45 2g2o s ALA 296 N -3.73 3.85 -0.45 5.32 0.00 -1.26 -0.85 121.76 124.64 2g2o s ALA 296 Ca 0.04 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.93 2g2o s ALA 296 Cb -0.02 -1.65 0.40 0.00 0.00 0.00 0.00 23.12 21.86 2g2o s ALA 296 CO -0.08 0.45 1.03 1.28 0.00 0.00 0.00 175.76 178.44 2g2o n LEU 297 N -0.72 4.00 -0.04 0.00 4.77 -0.48 -4.74 117.00 119.78 2g2o n LEU 297 Ca -0.08 -5.10 0.00 0.00 -0.03 0.00 0.00 56.01 50.81 2g2o n LEU 297 Cb 0.55 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 41.35 2g2o n LEU 297 CO 0.46 2.17 0.37 -0.46 -1.33 0.00 0.00 177.39 178.61 2g2o n ASN 298 N -0.33 1.51 -4.37 -1.43 2.04 -1.26 -4.67 115.26 106.74 2g2o n ASN 298 Ca 0.32 -1.45 -0.32 0.00 -0.44 0.00 0.00 54.58 52.69 2g2o n ASN 298 Cb 0.62 -0.01 -0.15 0.00 -2.53 0.00 0.00 39.78 37.72 2g2o n ASN 298 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 2g2o s GLU 299 N -0.47 2.30 0.22 -3.83 0.41 -1.26 -4.58 118.70 111.49 2g2o s GLU 299 Ca 0.01 -0.84 -0.11 0.00 -0.41 0.00 0.00 54.97 53.63 2g2o s GLU 299 Cb 0.01 -2.19 0.32 0.00 -1.78 0.00 0.00 34.13 30.49 2g2o s GLU 299 CO 0.01 0.57 1.63 -1.35 -0.49 0.00 0.00 175.26 175.63 2g2o h PRO 300 N 5.49 0.05 -0.78 0.39 0.11 -1.94 -1.02 132.00 134.30 2g2o h PRO 300 Ca -0.43 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.64 2g2o h PRO 300 Cb 1.14 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 2g2o h PRO 300 CO 0.48 0.03 0.36 0.66 -0.21 0.00 0.00 178.00 179.33 2g2o h SER 301 N 0.05 1.04 -0.43 -2.05 4.64 -1.99 0.50 113.55 115.31 2g2o h SER 301 Ca 0.35 -0.14 -0.13 0.00 -0.47 0.00 0.00 61.79 61.39 2g2o h SER 301 Cb 0.57 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 2g2o h SER 301 CO -0.64 0.89 -0.24 0.00 -0.87 0.00 0.00 176.83 175.97 2g2o h ALA 302 N 1.19 0.71 -0.07 5.18 0.00 -1.69 0.64 119.26 125.22 2g2o h ALA 302 Ca 0.27 -0.40 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2g2o h ALA 302 Cb 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2g2o h ALA 302 CO -0.03 0.67 -0.05 1.98 0.00 0.00 0.00 179.25 181.82 2g2o h MET 303 N 0.81 -0.06 -0.46 0.00 -1.53 -0.73 -0.72 114.93 112.26 2g2o h MET 303 Ca 0.10 0.00 0.05 0.00 -3.44 0.00 0.00 59.70 56.42 2g2o h MET 303 Cb 0.81 0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 31.83 2g2o h MET 303 CO 0.07 -0.04 0.18 0.00 0.14 0.00 0.00 176.91 177.26 2g2o h ALA 304 N 1.00 0.56 -0.44 0.39 0.00 -0.65 -1.64 119.26 118.47 2g2o h ALA 304 Ca 0.04 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2g2o h ALA 304 Cb 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2g2o h ALA 304 CO -0.10 -0.20 0.14 0.00 0.00 0.00 0.00 179.25 179.08 2g2o h ALA 305 N 1.28 1.41 -0.05 0.00 0.00 -0.49 -1.80 119.26 119.61 2g2o h ALA 305 Ca 0.21 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 2g2o h ALA 305 Cb 0.18 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2g2o h ALA 305 CO -0.20 0.43 -0.71 0.00 0.00 0.00 0.00 179.25 178.78 2g2o h ALA 306 N 1.52 0.70 0.00 0.00 0.00 -0.80 -3.13 119.26 117.54 2g2o h ALA 306 Ca 0.15 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2g2o h ALA 306 Cb 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2g2o h ALA 306 CO -0.01 0.79 0.00 -0.07 0.00 0.00 0.00 179.25 179.96 2g2o h LEU 307 N 0.19 0.00 0.00 0.00 3.38 -0.47 -2.74 115.31 115.67 2g2o h LEU 307 Ca -0.02 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.79 2g2o h LEU 307 Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2g2o h LEU 307 CO 0.11 0.00 -0.77 -0.33 0.09 0.00 0.00 178.44 177.54 2g2o h GLU 308 N 0.00 0.00 0.00 1.13 5.08 -1.38 -3.49 114.58 115.92 2g2o h GLU 308 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2g2o h GLU 308 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2g2o h GLU 308 CO 0.00 0.74 0.00 1.28 -1.00 0.00 0.00 179.01 180.03