#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g2o s VAL 10 N 0.00 5.11 -0.84 0.52 1.01 -1.26 -5.03 120.40 119.91 3g2o s VAL 10 Ca 0.00 0.89 -0.15 0.00 0.00 0.00 0.00 61.98 62.71 3g2o s VAL 10 Cb 0.00 -3.82 0.19 0.00 0.00 0.00 0.00 36.38 32.75 3g2o s VAL 10 CO 0.00 0.16 0.85 0.00 0.00 0.00 0.00 175.10 176.11 3g2o s ARG 11 N 1.82 3.57 0.87 2.72 3.03 -1.26 -4.88 118.95 124.82 3g2o s ARG 11 Ca 0.22 -2.23 -0.11 0.00 2.03 0.00 0.00 55.73 55.64 3g2o s ARG 11 Cb -0.15 -4.54 0.11 0.00 -1.03 0.00 0.00 34.95 29.34 3g2o s ARG 11 CO 0.09 -1.42 1.10 0.95 -1.13 0.00 0.00 175.30 174.89 3g2o s THR 12 N 0.91 2.77 -0.64 4.99 -4.23 -1.26 -4.88 115.64 113.30 3g2o s THR 12 Ca 0.21 0.25 0.06 0.00 -1.18 0.00 0.00 61.69 61.03 3g2o s THR 12 Cb -0.10 -2.63 0.06 0.00 1.34 0.00 0.00 72.50 71.17 3g2o s THR 12 CO -0.08 -0.33 1.13 -0.81 -0.54 0.00 0.00 174.62 173.99 3g2o n PRO 13 N -3.87 0.04 -1.93 3.99 -0.04 -1.26 -2.45 135.00 129.47 3g2o n PRO 13 Ca 0.08 0.49 -0.39 0.00 -0.04 0.00 0.00 63.50 63.65 3g2o n PRO 13 Cb 0.54 -1.70 0.03 0.00 -0.04 0.00 0.00 33.50 32.33 3g2o n PRO 13 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3g2o n HIS 14 N -1.67 2.83 -4.61 0.54 -0.00 -1.26 -5.30 115.22 105.75 3g2o n HIS 14 Ca -0.00 -2.31 -0.28 0.00 0.46 0.00 0.00 57.72 55.59 3g2o n HIS 14 Cb 0.08 -1.21 -0.08 0.00 -0.12 0.00 0.00 29.99 28.66 3g2o n HIS 14 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3g2o s ALA 15 N -3.85 3.36 0.39 1.57 0.00 -1.02 -5.11 121.76 117.10 3g2o s ALA 15 Ca 0.52 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.53 3g2o s ALA 15 Cb 0.41 0.48 0.00 0.00 0.00 0.00 0.00 23.12 24.01 3g2o s ALA 15 CO -0.38 -0.22 0.00 0.00 0.00 0.00 0.00 175.76 175.16 3g2o s ASP 30 N -2.48 3.87 -0.01 0.00 1.01 -1.26 -1.80 116.67 116.01 3g2o s ASP 30 Ca 0.00 -0.35 0.20 0.00 0.71 0.00 0.00 52.55 53.11 3g2o s ASP 30 Cb 0.00 0.15 -0.26 0.00 1.01 0.00 0.00 42.92 43.82 3g2o s ASP 30 CO 0.00 -2.20 0.73 0.33 0.21 0.00 0.00 175.17 174.24 3g2o n PHE 31 N -3.12 0.00 -4.15 4.23 7.35 0.12 -3.99 117.46 117.91 3g2o n PHE 31 Ca 0.17 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.70 3g2o n PHE 31 Cb 0.60 -0.16 -0.11 0.00 0.35 0.00 0.00 39.48 40.15 3g2o n PHE 31 CO 0.00 0.00 0.00 0.71 -0.76 0.00 0.00 176.76 176.71 3g2o s TYR 32 N -3.11 1.06 0.00 -5.13 1.51 -1.26 -5.02 117.35 105.40 3g2o s TYR 32 Ca 0.02 -0.52 0.00 0.00 -1.01 0.00 0.00 57.07 55.56 3g2o s TYR 32 Cb 0.15 -0.59 0.00 0.00 -0.11 0.00 0.00 41.96 41.40 3g2o s TYR 32 CO 0.85 0.01 0.00 0.00 -1.11 0.00 0.00 175.55 175.30 3g2o n ALA 47 N 1.11 0.00 -1.84 3.71 0.00 -1.26 -5.16 120.51 117.07 3g2o n ALA 47 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.82 3g2o n ALA 47 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.98 3g2o n ALA 47 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3g2o s ASP 48 N 0.00 6.54 0.00 0.00 2.15 -1.26 -4.94 116.67 119.16 3g2o s ASP 48 Ca 0.00 2.76 0.17 0.00 0.43 0.00 0.00 52.55 55.91 3g2o s ASP 48 Cb 0.00 -2.62 0.56 0.00 -0.30 0.00 0.00 42.92 40.56 3g2o s ASP 48 CO 0.00 -0.81 1.43 0.61 -0.17 0.00 0.00 175.17 176.23 3g2o n GLY 49 N 2.54 0.50 0.16 2.66 0.00 -1.24 -4.45 105.19 105.36 3g2o n GLY 49 Ca 0.09 -0.42 -0.07 0.00 0.00 0.00 0.00 46.02 45.62 3g2o n GLY 49 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3g2o h THR 50 N 2.23 1.00 -0.27 2.61 2.02 -1.92 -0.48 112.91 118.10 3g2o h THR 50 Ca 0.00 -0.14 -0.08 0.00 0.77 0.00 0.00 66.41 66.96 3g2o h THR 50 Cb 0.50 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3g2o h THR 50 CO 0.00 0.07 -0.14 0.28 0.37 0.00 0.00 175.52 176.10 3g2o h SER 51 N 0.40 0.60 -0.68 4.18 0.02 -1.82 -1.00 113.55 115.25 3g2o h SER 51 Ca 0.15 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 3g2o h SER 51 Cb 0.04 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.39 3g2o h SER 51 CO -0.09 0.88 0.37 -0.08 -1.14 0.00 0.00 176.83 176.77 3g2o h GLU 52 N 0.32 0.95 -0.65 3.45 4.81 -1.64 -2.13 114.58 119.69 3g2o h GLU 52 Ca 0.06 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 3g2o h GLU 52 Cb 0.66 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 3g2o h GLU 52 CO 0.04 0.72 0.31 0.00 -0.73 0.00 0.00 179.01 179.35 3g2o h ALA 53 N 1.18 0.84 -0.37 2.92 0.00 -0.90 -2.34 119.26 120.58 3g2o h ALA 53 Ca 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3g2o h ALA 53 Cb 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3g2o h ALA 53 CO -0.04 0.41 0.05 -0.09 0.00 0.00 0.00 179.25 179.59 3g2o h ARG 54 N 0.90 0.56 -0.61 0.00 2.43 -0.91 -1.62 114.38 115.13 3g2o h ARG 54 Ca 0.22 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 3g2o h ARG 54 Cb 0.13 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 3g2o h ARG 54 CO -0.03 0.55 0.22 1.49 -1.51 0.00 0.00 179.97 180.69 3g2o h GLU 55 N 0.55 0.93 -0.61 0.20 4.57 -0.96 0.10 114.58 119.36 3g2o h GLU 55 Ca 0.12 -0.18 0.04 0.00 -1.18 0.00 0.00 59.36 58.16 3g2o h GLU 55 Cb 0.27 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.67 3g2o h GLU 55 CO 0.00 0.81 0.35 0.74 -1.18 0.00 0.00 179.01 179.73 3g2o h PHE 56 N 0.86 0.65 -0.21 0.92 0.04 -1.04 -2.89 116.94 115.27 3g2o h PHE 56 Ca 0.20 0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.92 3g2o h PHE 56 Cb 0.24 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 3g2o h PHE 56 CO 0.02 0.35 -0.16 0.00 -0.60 0.00 0.00 178.31 177.91 3g2o h ALA 57 N 1.29 1.33 -0.60 2.45 0.00 -0.80 -2.71 119.26 120.22 3g2o h ALA 57 Ca 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3g2o h ALA 57 Cb 0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3g2o h ALA 57 CO -0.13 0.45 0.34 1.15 0.00 0.00 0.00 179.25 181.05 3g2o h THR 58 N 0.33 1.19 -0.32 0.00 2.02 -0.80 -2.96 112.91 112.36 3g2o h THR 58 Ca 0.06 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.77 3g2o h THR 58 Cb 0.49 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 3g2o h THR 58 CO 0.03 0.21 0.00 0.54 0.37 0.00 0.00 175.52 176.67 3g2o n ARG 59 N -4.58 1.89 -0.06 6.66 5.12 -1.04 -3.93 116.66 120.71 3g2o n ARG 59 Ca 0.04 -1.36 -0.09 0.00 -1.93 0.00 0.00 57.85 54.51 3g2o n ARG 59 Cb 0.08 -1.35 -0.06 0.00 -1.16 0.00 0.00 32.46 29.97 3g2o n ARG 59 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 3g2o n THR 60 N 0.59 0.74 0.00 0.55 5.66 -1.11 -5.04 114.28 115.67 3g2o n THR 60 Ca 0.15 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 3g2o n THR 60 Cb 0.35 -0.95 0.00 0.00 -1.55 0.00 0.00 70.33 68.18 3g2o n THR 60 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3g2o n GLY 61 N 2.86 1.86 0.13 1.09 0.00 -1.13 -4.21 105.19 105.79 3g2o n GLY 61 Ca -0.23 -0.30 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 3g2o n GLY 61 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g2o h PRO 62 N 0.00 0.33 -5.19 1.61 0.11 -1.96 -3.49 132.00 123.41 3g2o h PRO 62 Ca 0.00 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.03 3g2o h PRO 62 Cb 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.07 3g2o h PRO 62 CO 0.00 0.45 -0.76 1.55 -0.21 0.00 0.00 178.00 179.02 3g2o n VAL 63 N -4.77 -1.55 -2.95 3.15 3.14 -1.26 -4.99 118.33 109.11 3g2o n VAL 63 Ca -0.04 0.38 -0.40 0.00 -2.96 0.00 0.00 64.34 61.33 3g2o n VAL 63 Cb 0.17 -2.34 -0.06 0.00 -1.06 0.00 0.00 33.84 30.55 3g2o n VAL 63 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 3g2o s SER 64 N -0.76 7.41 0.02 6.55 1.04 -1.26 -5.00 113.70 121.70 3g2o s SER 64 Ca 0.00 1.67 0.00 0.00 0.48 0.00 0.00 55.95 58.10 3g2o s SER 64 Cb 0.00 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.61 3g2o s SER 64 CO 0.00 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.01 3g2o n GLY 65 N 1.66 -1.76 3.72 7.32 0.00 -1.26 -4.72 105.19 110.15 3g2o n GLY 65 Ca -0.05 -1.49 -0.36 0.00 0.00 0.00 0.00 46.02 44.12 3g2o n GLY 65 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3g2o s PRO 66 N -1.74 2.29 -0.10 1.61 0.04 -1.26 -4.70 135.00 131.13 3g2o s PRO 66 Ca 0.00 1.97 0.02 0.00 0.04 0.00 0.00 61.00 63.02 3g2o s PRO 66 Cb 0.00 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.70 3g2o s PRO 66 CO 0.00 -1.77 -0.16 0.08 0.04 0.00 0.00 177.00 175.18 3g2o s VAL 67 N -1.63 2.77 -0.27 -0.36 1.01 0.68 -3.92 120.40 118.68 3g2o s VAL 67 Ca 0.80 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 3g2o s VAL 67 Cb -0.35 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3g2o s VAL 67 CO 0.43 0.55 0.37 -0.22 0.00 0.00 0.00 175.10 176.23 3g2o s LEU 68 N 0.12 4.04 -0.24 3.92 2.96 -0.59 -0.86 118.68 128.03 3g2o s LEU 68 Ca -0.08 0.29 -0.07 0.00 -0.22 0.00 0.00 54.13 54.05 3g2o s LEU 68 Cb -0.15 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 3g2o s LEU 68 CO 0.05 -0.18 0.06 -0.70 -1.32 0.00 0.00 176.35 174.25 3g2o s GLU 69 N 2.07 3.67 -0.04 1.98 2.12 -0.09 -0.29 118.70 128.12 3g2o s GLU 69 Ca 0.15 -0.48 -0.18 0.00 0.36 0.00 0.00 54.97 54.82 3g2o s GLU 69 Cb -0.16 -3.27 -0.05 0.00 0.26 0.00 0.00 34.13 30.91 3g2o s GLU 69 CO 0.10 -0.12 0.51 -0.51 -0.54 0.00 0.00 175.26 174.70 3g2o s LEU 70 N 1.42 4.39 -1.14 2.70 1.43 0.00 -1.29 118.68 126.19 3g2o s LEU 70 Ca 0.05 1.00 -0.04 0.00 -1.03 0.00 0.00 54.13 54.11 3g2o s LEU 70 Cb -0.15 -2.76 -0.03 0.00 0.03 0.00 0.00 46.19 43.28 3g2o s LEU 70 CO 0.03 0.13 0.92 0.00 0.23 0.00 0.00 176.35 177.66 3g2o n ALA 71 N 2.77 -2.28 0.44 4.21 0.00 0.51 -4.57 120.51 121.60 3g2o n ALA 71 Ca -0.09 0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.47 3g2o n ALA 71 Cb 0.51 -4.08 0.45 0.00 0.00 0.00 0.00 19.45 16.33 3g2o n ALA 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g2o n ALA 72 N -3.73 1.70 -0.74 0.00 0.00 0.22 -4.91 120.51 113.04 3g2o n ALA 72 Ca -0.17 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3g2o n ALA 72 Cb 0.64 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.74 3g2o n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3g2o n GLY 73 N 0.09 2.19 1.89 0.00 0.00 -1.26 -1.60 105.19 106.49 3g2o n GLY 73 Ca 0.03 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 3g2o n GLY 73 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3g2o n MET 74 N 12.38 2.71 -0.70 1.61 0.00 -1.26 -4.74 117.12 127.11 3g2o n MET 74 Ca 0.00 -2.49 0.00 0.00 0.00 0.00 0.00 57.70 55.21 3g2o n MET 74 Cb 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 33.22 31.20 3g2o n MET 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3g2o n GLY 75 N -0.42 0.96 0.38 3.17 0.00 -0.63 -4.68 105.19 103.97 3g2o n GLY 75 Ca 0.41 -0.47 0.15 0.00 0.00 0.00 0.00 46.02 46.10 3g2o n GLY 75 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3g2o h ARG 76 N 0.00 0.58 0.00 1.61 2.43 -1.92 -1.62 114.38 115.46 3g2o h ARG 76 Ca 0.00 -0.03 -0.37 0.00 -0.81 0.00 0.00 59.98 58.76 3g2o h ARG 76 Cb 0.23 -0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 29.58 3g2o h ARG 76 CO 0.00 0.38 -2.39 1.28 -1.51 0.00 0.00 179.97 177.73 3g2o n LEU 77 N -4.57 0.14 -0.23 3.80 4.77 -1.26 -3.72 117.00 115.93 3g2o n LEU 77 Ca 0.19 -0.01 -0.07 0.00 -0.03 0.00 0.00 56.01 56.09 3g2o n LEU 77 Cb 0.56 0.43 0.04 0.00 -2.33 0.00 0.00 43.42 42.12 3g2o n LEU 77 CO 0.29 0.52 0.99 0.74 -1.33 0.00 0.00 177.39 178.59 3g2o h THR 78 N 0.00 1.24 -0.14 -5.08 2.02 -1.75 -0.26 112.91 108.94 3g2o h THR 78 Ca -0.55 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 65.85 3g2o h THR 78 Cb 2.23 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 69.18 3g2o h THR 78 CO 0.02 0.30 0.05 -0.26 0.37 0.00 0.00 175.52 176.01 3g2o h PHE 79 N 0.91 0.22 -0.96 3.16 0.04 -1.57 0.75 116.94 119.48 3g2o h PHE 79 Ca 0.21 -0.02 0.12 0.00 2.80 0.00 0.00 57.97 61.08 3g2o h PHE 79 Cb 0.23 -0.06 -0.08 0.00 2.20 0.00 0.00 35.95 38.24 3g2o h PHE 79 CO 0.02 0.31 0.61 -1.35 -0.60 0.00 0.00 178.31 177.30 3g2o h PRO 80 N 0.06 0.90 -0.43 1.51 0.11 -1.73 -1.13 132.00 131.29 3g2o h PRO 80 Ca 0.05 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 3g2o h PRO 80 Cb 0.19 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.08 3g2o h PRO 80 CO -0.00 0.59 0.22 0.74 -0.21 0.00 0.00 178.00 179.34 3g2o h PHE 81 N 0.92 0.60 -0.75 0.65 0.04 -0.65 -2.66 116.94 115.09 3g2o h PHE 81 Ca 0.47 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.21 3g2o h PHE 81 Cb 0.52 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.44 3g2o h PHE 81 CO -0.00 0.47 0.41 -0.07 -0.60 0.00 0.00 178.31 178.52 3g2o h LEU 82 N 0.55 0.92 -1.92 1.54 3.38 -0.53 -1.83 115.31 117.42 3g2o h LEU 82 Ca 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3g2o h LEU 82 Cb 0.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3g2o h LEU 82 CO -0.02 0.74 0.00 0.44 0.09 0.00 0.00 178.44 179.68 3g2o h ASP 83 N 1.04 0.00 -0.04 -0.43 3.32 -0.88 -0.35 116.42 119.08 3g2o h ASP 83 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3g2o h ASP 83 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3g2o h ASP 83 CO -0.04 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.66 3g2o n LEU 84 N -2.74 1.14 0.00 1.55 4.77 -0.70 -4.92 117.00 116.09 3g2o n LEU 84 Ca -0.01 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 3g2o n LEU 84 Cb 0.14 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3g2o n LEU 84 CO 0.19 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 3g2o n GLY 85 N 1.10 0.90 3.76 -0.72 0.00 -0.14 -5.05 105.19 105.04 3g2o n GLY 85 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3g2o n GLY 85 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3g2o s TRP 86 N -3.02 2.34 -0.20 1.61 0.52 -1.16 -5.01 118.94 114.02 3g2o s TRP 86 Ca 0.00 1.32 -0.19 0.00 0.02 0.00 0.00 56.10 57.25 3g2o s TRP 86 Cb 0.00 -3.86 -0.03 0.00 -1.15 0.00 0.00 33.47 28.43 3g2o s TRP 86 CO 0.00 -2.96 0.57 -2.00 0.02 0.00 0.00 176.95 172.58 3g2o s GLU 87 N -2.73 4.20 -0.12 4.98 2.12 -1.26 -4.52 118.70 121.36 3g2o s GLU 87 Ca 0.67 0.50 0.01 0.00 0.36 0.00 0.00 54.97 56.52 3g2o s GLU 87 Cb -0.42 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.41 3g2o s GLU 87 CO 0.52 -0.19 -0.15 0.08 -0.54 0.00 0.00 175.26 174.97 3g2o s VAL 88 N 1.77 1.51 -0.37 3.70 1.01 -0.43 -0.23 120.40 127.37 3g2o s VAL 88 Ca 0.26 -0.64 -0.22 0.00 0.00 0.00 0.00 61.98 61.38 3g2o s VAL 88 Cb -0.16 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 34.83 3g2o s VAL 88 CO 0.10 0.45 0.72 -0.89 0.00 0.00 0.00 175.10 175.47 3g2o s THR 89 N 1.14 4.80 -0.31 3.92 2.01 -0.04 -0.88 115.64 126.26 3g2o s THR 89 Ca -0.03 0.71 -0.10 0.00 0.31 0.00 0.00 61.69 62.58 3g2o s THR 89 Cb -0.14 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 3g2o s THR 89 CO -0.04 -0.40 0.16 0.00 -0.69 0.00 0.00 174.62 173.64 3g2o s ALA 90 N 2.93 3.28 -0.17 7.40 0.00 0.46 -0.91 121.76 134.75 3g2o s ALA 90 Ca 0.28 -1.40 -0.08 0.00 0.00 0.00 0.00 51.96 50.76 3g2o s ALA 90 Cb -0.14 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 3g2o s ALA 90 CO 0.16 -0.92 0.11 -1.17 0.00 0.00 0.00 175.76 173.94 3g2o s LEU 91 N 1.61 4.12 -0.12 0.00 0.20 -0.41 -1.15 118.68 122.93 3g2o s LEU 91 Ca 0.05 0.25 -0.11 0.00 0.69 0.00 0.00 54.13 55.00 3g2o s LEU 91 Cb -0.17 -2.04 0.03 0.00 -0.43 0.00 0.00 46.19 43.58 3g2o s LEU 91 CO 0.06 0.25 0.32 -0.70 -0.29 0.00 0.00 176.35 175.99 3g2o s GLU 92 N -0.07 0.38 0.03 1.98 2.56 -0.36 -0.37 118.70 122.85 3g2o s GLU 92 Ca 0.09 0.44 -0.10 0.00 0.00 0.00 0.00 54.97 55.39 3g2o s GLU 92 Cb -0.12 0.18 -0.32 0.00 2.00 0.00 0.00 34.13 35.88 3g2o s GLU 92 CO 0.00 -0.05 0.96 1.25 -0.56 0.00 0.00 175.26 176.87 3g2o h LEU 93 N 5.61 0.64 -9.22 2.70 5.85 -1.78 -1.90 115.31 117.21 3g2o h LEU 93 Ca -0.26 -0.74 -0.57 0.00 0.84 0.00 0.00 57.88 57.14 3g2o h LEU 93 Cb 1.19 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.95 3g2o h LEU 93 CO 0.31 1.60 0.38 -0.55 -0.34 0.00 0.00 178.44 179.83 3g2o s SER 94 N -7.34 7.03 0.18 1.25 0.15 -1.26 -4.71 113.70 108.99 3g2o s SER 94 Ca -0.09 1.26 -0.13 0.00 0.70 0.00 0.00 55.95 57.69 3g2o s SER 94 Cb 0.05 -2.47 0.18 0.00 -1.71 0.00 0.00 66.02 62.07 3g2o s SER 94 CO 0.90 -0.36 1.71 0.74 1.20 0.00 0.00 173.24 177.43 3g2o h THR 95 N 5.10 0.72 -0.65 6.45 2.02 -1.99 0.96 112.91 125.52 3g2o h THR 95 Ca -0.32 -0.07 -0.08 0.00 0.77 0.00 0.00 66.41 66.71 3g2o h THR 95 Cb 1.15 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 3g2o h THR 95 CO 0.82 0.04 0.11 -1.28 0.37 0.00 0.00 175.52 175.58 3g2o h SER 96 N 0.21 1.03 -0.30 4.18 0.87 -2.00 -1.11 113.55 116.43 3g2o h SER 96 Ca 0.24 -0.26 -0.18 0.00 -1.23 0.00 0.00 61.79 60.36 3g2o h SER 96 Cb 0.33 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.01 3g2o h SER 96 CO -0.33 1.03 -0.50 0.58 -0.53 0.00 0.00 176.83 177.08 3g2o h VAL 97 N 0.99 1.28 -0.41 2.23 2.07 -1.88 -2.86 116.25 117.68 3g2o h VAL 97 Ca 0.20 -1.68 0.05 0.00 0.82 0.00 0.00 66.70 66.09 3g2o h VAL 97 Cb 0.43 1.59 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3g2o h VAL 97 CO 0.01 0.55 0.13 -0.07 0.02 0.00 0.00 177.57 178.21 3g2o h LEU 98 N 0.66 0.12 -0.72 2.57 3.38 -0.59 -1.22 115.31 119.52 3g2o h LEU 98 Ca 0.02 0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.17 3g2o h LEU 98 Cb 1.11 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.81 3g2o h LEU 98 CO 0.11 0.10 0.28 0.00 0.09 0.00 0.00 178.44 179.03 3g2o h ALA 99 N 1.27 0.99 -0.45 1.53 0.00 -1.14 0.11 119.26 121.57 3g2o h ALA 99 Ca 0.19 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 3g2o h ALA 99 Cb 0.19 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3g2o h ALA 99 CO -0.21 -0.20 0.13 0.00 0.00 0.00 0.00 179.25 178.97 3g2o h ALA 100 N 1.51 0.59 -0.40 0.00 0.00 -1.15 -1.69 119.26 118.12 3g2o h ALA 100 Ca 0.39 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3g2o h ALA 100 Cb 0.56 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3g2o h ALA 100 CO -0.38 0.26 0.25 0.35 0.00 0.00 0.00 179.25 179.73 3g2o h PHE 101 N 0.60 0.46 -0.65 0.00 -0.00 -0.84 -1.89 116.94 114.61 3g2o h PHE 101 Ca 0.14 0.01 -0.03 0.00 -0.00 0.00 0.00 57.97 58.10 3g2o h PHE 101 Cb 0.30 -0.15 -0.03 0.00 -0.00 0.00 0.00 35.95 36.07 3g2o h PHE 101 CO 0.02 0.27 0.30 -0.09 -0.00 0.00 0.00 178.31 178.81 3g2o h ARG 102 N 0.50 0.95 -0.26 1.11 2.43 -0.58 -0.63 114.38 117.90 3g2o h ARG 102 Ca 0.16 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3g2o h ARG 102 Cb -0.01 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 3g2o h ARG 102 CO -0.06 0.77 0.17 -0.22 -1.51 0.00 0.00 179.97 179.12 3g2o h LYS 103 N 0.91 0.35 -0.71 0.20 1.63 -1.20 -1.39 116.57 116.35 3g2o h LYS 103 Ca 0.22 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 60.03 3g2o h LYS 103 Cb 0.15 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.66 3g2o h LYS 103 CO -0.03 0.25 0.44 0.00 -3.45 0.00 0.00 179.45 176.67 3g2o h ARG 104 N 0.34 0.84 -0.83 1.90 3.08 -1.03 -2.50 114.38 116.18 3g2o h ARG 104 Ca 0.09 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 3g2o h ARG 104 Cb -0.01 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 3g2o h ARG 104 CO -0.02 0.56 0.51 -0.07 -1.07 0.00 0.00 179.97 179.88 3g2o h LEU 105 N 0.87 0.98 -1.57 3.04 3.38 -0.84 -2.01 115.31 119.15 3g2o h LEU 105 Ca 0.28 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 3g2o h LEU 105 Cb 0.02 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3g2o h LEU 105 CO -0.11 0.74 -0.08 0.00 0.09 0.00 0.00 178.44 179.09 3g2o h ALA 106 N 1.43 1.65 0.00 1.53 0.00 -0.87 -2.64 119.26 120.36 3g2o h ALA 106 Ca 0.30 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3g2o h ALA 106 Cb -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3g2o h ALA 106 CO -0.06 0.26 -0.03 0.93 0.00 0.00 0.00 179.25 180.35 3g2o h GLU 107 N 0.17 0.00 -7.37 0.00 5.08 -0.96 -3.47 114.58 108.04 3g2o h GLU 107 Ca 0.04 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.89 3g2o h GLU 107 Cb 0.25 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.56 3g2o h GLU 107 CO 0.01 0.03 0.42 0.00 -1.00 0.00 0.00 179.01 178.47 3g2o s ALA 108 N -3.37 3.08 0.83 3.43 0.00 -0.99 -5.04 121.76 119.70 3g2o s ALA 108 Ca 0.05 -0.12 -0.12 0.00 0.00 0.00 0.00 51.96 51.76 3g2o s ALA 108 Cb 0.07 -3.07 0.10 0.00 0.00 0.00 0.00 23.12 20.21 3g2o s ALA 108 CO 0.63 -0.74 1.17 -2.14 0.00 0.00 0.00 175.76 174.68 3g2o s PRO 109 N -5.20 1.56 0.26 0.00 0.02 -1.26 -4.73 135.00 125.65 3g2o s PRO 109 Ca 0.55 1.62 -0.02 0.00 0.02 0.00 0.00 61.00 63.18 3g2o s PRO 109 Cb -0.11 -1.78 0.45 0.00 0.02 0.00 0.00 34.50 33.08 3g2o s PRO 109 CO 0.54 -2.24 1.84 0.00 -0.33 0.00 0.00 177.00 176.80 3g2o h ALA 110 N -1.17 1.34 -0.67 -1.55 0.00 -1.95 -1.66 119.26 113.61 3g2o h ALA 110 Ca -0.45 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 3g2o h ALA 110 Cb 1.28 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 3g2o h ALA 110 CO 0.46 0.22 0.19 0.38 0.00 0.00 0.00 179.25 180.50 3g2o h ASP 111 N 0.95 0.97 0.68 0.00 2.03 -1.98 0.04 116.42 119.12 3g2o h ASP 111 Ca 0.44 -0.18 -0.03 0.00 -0.73 0.00 0.00 57.03 56.52 3g2o h ASP 111 Cb 0.36 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 38.61 3g2o h ASP 111 CO -0.23 0.92 -0.33 0.58 -1.03 0.00 0.00 179.24 179.15 3g2o h VAL 112 N 0.99 0.19 -0.85 4.15 2.07 -1.78 -3.16 116.25 117.88 3g2o h VAL 112 Ca 0.22 -0.24 0.08 0.00 0.82 0.00 0.00 66.70 67.58 3g2o h VAL 112 Cb 0.31 0.25 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 3g2o h VAL 112 CO -0.00 0.02 0.55 -0.09 0.02 0.00 0.00 177.57 178.07 3g2o h ARG 113 N -1.11 0.85 0.00 1.57 2.43 -1.26 -1.48 114.38 115.37 3g2o h ARG 113 Ca -0.09 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 3g2o h ARG 113 Cb 0.74 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3g2o h ARG 113 CO 0.15 0.56 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.66 3g2o h ASP 114 N 0.87 0.00 0.04 -3.80 5.19 -1.04 -2.64 116.42 115.05 3g2o h ASP 114 Ca 0.38 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.79 3g2o h ASP 114 Cb 0.34 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.85 3g2o h ASP 114 CO -0.15 0.07 -0.09 0.54 -3.12 0.00 0.00 179.24 176.49 3g2o n ARG 115 N -3.38 1.53 -3.90 3.56 1.74 -0.56 -4.87 116.66 110.78 3g2o n ARG 115 Ca -0.01 -1.00 -0.35 0.00 -0.77 0.00 0.00 57.85 55.72 3g2o n ARG 115 Cb 0.23 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 30.05 3g2o n ARG 115 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3g2o s THR 117 N 1.47 4.12 0.06 0.00 2.01 -0.06 -4.99 115.64 118.23 3g2o s THR 117 Ca 0.05 -0.80 -0.24 0.00 0.31 0.00 0.00 61.69 61.02 3g2o s THR 117 Cb -0.14 -3.20 -0.06 0.00 0.01 0.00 0.00 72.50 69.10 3g2o s THR 117 CO -0.02 -0.05 0.72 -0.76 -0.69 0.00 0.00 174.62 173.83 3g2o s LEU 118 N 1.50 4.47 -0.02 4.42 1.43 -1.26 -0.41 118.68 128.81 3g2o s LEU 118 Ca 0.02 1.42 0.01 0.00 -1.03 0.00 0.00 54.13 54.54 3g2o s LEU 118 Cb -0.18 -3.16 0.02 0.00 0.03 0.00 0.00 46.19 42.89 3g2o s LEU 118 CO 0.04 0.08 -0.02 -0.69 0.23 0.00 0.00 176.35 175.99 3g2o s VAL 119 N -0.33 0.24 -0.13 -1.59 1.01 -0.30 -4.94 120.40 114.36 3g2o s VAL 119 Ca 0.36 -0.01 -0.27 0.00 0.00 0.00 0.00 61.98 62.06 3g2o s VAL 119 Cb -0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 3g2o s VAL 119 CO 0.22 0.13 0.88 -1.58 0.00 0.00 0.00 175.10 174.75 3g2o s GLN 120 N 0.65 4.36 0.11 2.72 0.74 -1.26 -1.22 119.66 125.76 3g2o s GLN 120 Ca -0.07 1.14 -0.25 0.00 0.05 0.00 0.00 55.36 56.23 3g2o s GLN 120 Cb -0.10 -3.55 0.08 0.00 1.10 0.00 0.00 33.01 30.55 3g2o s GLN 120 CO -0.01 -0.28 1.09 0.20 -0.55 0.00 0.00 175.29 175.74 3g2o s GLY 121 N 1.10 -0.14 -0.30 2.59 0.00 -0.71 -4.89 107.32 104.96 3g2o s GLY 121 Ca 0.42 0.07 -0.07 0.00 0.00 0.00 0.00 44.72 45.14 3g2o s GLY 121 CO 0.15 1.43 0.10 -0.35 0.00 0.00 0.00 173.10 174.42 3g2o s ASP 122 N -3.20 5.22 0.64 1.64 -1.08 -1.26 -2.45 116.67 116.19 3g2o s ASP 122 Ca 0.18 -0.72 0.40 0.00 -0.52 0.00 0.00 52.55 51.88 3g2o s ASP 122 Cb -0.00 -1.90 2.23 0.00 -1.46 0.00 0.00 42.92 41.78 3g2o s ASP 122 CO 0.02 -0.21 2.33 0.00 0.52 0.00 0.00 175.17 177.82 3g2o h MET 123 N 8.26 0.00 -0.00 4.34 -0.00 -1.97 -0.52 114.93 125.04 3g2o h MET 123 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.39 3g2o h MET 123 Cb 1.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.73 3g2o h MET 123 CO 0.61 0.00 -0.21 -1.13 -0.00 0.00 0.00 176.91 176.18 3g2o n SER 124 N -3.32 0.33 -3.07 -0.10 3.41 -1.26 -4.04 113.62 105.57 3g2o n SER 124 Ca -0.03 -0.10 0.03 0.00 -0.26 0.00 0.00 58.87 58.51 3g2o n SER 124 Cb 0.09 -0.10 -0.00 0.00 -0.26 0.00 0.00 64.21 63.93 3g2o n SER 124 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g2o s ALA 125 N -2.83 -3.33 0.06 7.33 0.00 -0.21 -2.99 121.76 119.79 3g2o s ALA 125 Ca 0.18 0.97 -0.06 0.00 0.00 0.00 0.00 51.96 53.05 3g2o s ALA 125 Cb 0.19 -2.79 -0.02 0.00 0.00 0.00 0.00 23.12 20.51 3g2o s ALA 125 CO 0.57 -2.17 0.10 -0.59 0.00 0.00 0.00 175.76 173.67 3g2o s PHE 126 N 2.39 0.27 -0.20 0.00 -0.12 -1.18 -4.21 117.98 114.93 3g2o s PHE 126 Ca 0.17 -0.69 -0.04 0.00 -0.05 0.00 0.00 56.93 56.32 3g2o s PHE 126 Cb -0.03 -0.18 0.10 0.00 -0.63 0.00 0.00 43.02 42.28 3g2o s PHE 126 CO -0.18 -0.44 0.31 0.00 -0.05 0.00 0.00 175.22 174.86 3g2o s ALA 127 N -3.47 -0.74 -1.18 1.99 0.00 -1.26 -4.90 121.76 112.19 3g2o s ALA 127 Ca 0.02 0.83 0.12 0.00 0.00 0.00 0.00 51.96 52.93 3g2o s ALA 127 Cb 0.04 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.82 3g2o s ALA 127 CO -0.09 -1.01 0.74 1.28 0.00 0.00 0.00 175.76 176.68 3g2o n LEU 128 N 5.35 1.48 -3.56 0.00 4.32 -1.26 -5.00 117.00 118.33 3g2o n LEU 128 Ca -0.05 -0.81 -0.33 0.00 -0.02 0.00 0.00 56.01 54.80 3g2o n LEU 128 Cb 0.50 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 42.32 3g2o n LEU 128 CO 0.05 0.29 -0.24 0.47 -1.22 0.00 0.00 177.39 176.74 3g2o n ASP 129 N -0.04 -5.45 0.00 -1.43 8.00 -1.26 -4.91 116.55 111.46 3g2o n ASP 129 Ca 0.05 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.18 3g2o n ASP 129 Cb 0.26 -1.89 0.00 0.00 -0.02 0.00 0.00 41.12 39.47 3g2o n ASP 129 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3g2o n LYS 130 N -0.98 0.00 -4.35 -1.24 4.81 -1.26 -5.17 118.16 109.97 3g2o n LYS 130 Ca -0.15 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.04 3g2o n LYS 130 Cb 0.68 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 35.64 3g2o n LYS 130 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3g2o s ARG 131 N -0.94 2.00 0.06 1.64 0.52 -1.26 -4.72 118.95 116.24 3g2o s ARG 131 Ca 0.00 -1.48 0.04 0.00 -0.52 0.00 0.00 55.73 53.78 3g2o s ARG 131 Cb 0.00 -2.03 -0.03 0.00 0.52 0.00 0.00 34.95 33.41 3g2o s ARG 131 CO 0.00 0.38 -0.13 -0.06 0.02 0.00 0.00 175.30 175.51 3g2o s PHE 132 N -2.14 1.08 0.21 -0.53 0.08 0.26 -4.86 117.98 112.07 3g2o s PHE 132 Ca 0.28 -0.45 0.20 0.00 0.12 0.00 0.00 56.93 57.08 3g2o s PHE 132 Cb -0.07 -0.62 0.79 0.00 -0.57 0.00 0.00 43.02 42.55 3g2o s PHE 132 CO 0.16 0.02 1.79 0.78 -0.10 0.00 0.00 175.22 177.87 3g2o h GLY 133 N 4.47 0.00 -5.93 4.36 0.00 -1.85 -2.36 103.07 101.76 3g2o h GLY 133 Ca -0.39 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 46.70 3g2o h GLY 133 CO 0.41 0.00 -0.64 -1.59 0.00 0.00 0.00 176.54 174.72 3g2o s THR 134 N -3.73 -0.03 -0.07 4.70 2.01 -1.26 -1.28 115.64 115.99 3g2o s THR 134 Ca -0.00 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.13 3g2o s THR 134 Cb 0.11 -0.15 0.00 0.00 0.01 0.00 0.00 72.50 72.48 3g2o s THR 134 CO 0.67 0.04 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.78 3g2o s VAL 135 N 0.60 1.52 -0.03 3.82 1.01 0.16 -1.54 120.40 125.94 3g2o s VAL 135 Ca -0.05 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.26 3g2o s VAL 135 Cb -0.06 -1.33 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 3g2o s VAL 135 CO -0.02 0.44 -0.19 -0.69 0.00 0.00 0.00 175.10 174.63 3g2o s VAL 136 N 0.35 1.57 -0.04 2.92 1.01 0.60 -0.37 120.40 126.44 3g2o s VAL 136 Ca -0.12 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 3g2o s VAL 136 Cb -0.15 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 34.92 3g2o s VAL 136 CO 0.05 0.45 0.10 -0.51 0.00 0.00 0.00 175.10 175.19 3g2o s ILE 137 N -0.21 -0.02 0.53 2.22 2.07 -0.47 -0.82 121.20 124.50 3g2o s ILE 137 Ca 0.01 0.08 -0.11 0.00 -1.41 0.00 0.00 60.65 59.22 3g2o s ILE 137 Cb -0.10 -0.17 -0.05 0.00 0.13 0.00 0.00 42.46 42.27 3g2o s ILE 137 CO 0.01 0.03 0.93 -0.55 -1.91 0.00 0.00 174.94 173.45 3g2o s SER 138 N 0.52 6.40 0.18 4.50 0.15 -1.26 -1.99 113.70 122.20 3g2o s SER 138 Ca -0.04 1.32 -0.14 0.00 0.70 0.00 0.00 55.95 57.80 3g2o s SER 138 Cb -0.05 -2.42 0.15 0.00 -1.71 0.00 0.00 66.02 61.99 3g2o s SER 138 CO -0.02 -0.65 1.74 -1.28 1.20 0.00 0.00 173.24 174.23 3g2o h SER 139 N 0.42 0.12 -0.47 5.45 0.87 -1.49 -1.19 113.55 117.27 3g2o h SER 139 Ca -0.46 0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.20 3g2o h SER 139 Cb 1.19 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 63.19 3g2o h SER 139 CO 0.62 0.10 0.31 1.23 -0.53 0.00 0.00 176.83 178.56 3g2o h GLY 140 N 0.31 0.58 0.33 5.77 0.00 -1.96 -1.57 103.07 106.52 3g2o h GLY 140 Ca 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 3g2o h GLY 140 CO -0.25 0.17 -0.06 1.76 0.00 0.00 0.00 176.54 178.16 3g2o h SER 141 N 0.50 -0.14 -0.82 0.19 0.02 -1.71 -3.20 113.55 108.38 3g2o h SER 141 Ca 0.19 -0.42 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 3g2o h SER 141 Cb 0.14 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 3g2o h SER 141 CO -0.05 0.45 0.50 -0.29 -1.14 0.00 0.00 176.83 176.30 3g2o h ILE 142 N -0.84 1.23 0.00 3.27 2.10 -1.00 -0.87 117.51 121.39 3g2o h ILE 142 Ca -0.02 -0.50 0.00 0.00 1.08 0.00 0.00 64.86 65.42 3g2o h ILE 142 Cb 0.55 0.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.34 3g2o h ILE 142 CO 0.03 0.24 0.00 0.59 -1.08 0.00 0.00 178.15 177.93 3g2o n ASN 143 N -4.37 0.00 0.21 2.19 3.02 -0.61 -1.76 115.26 113.93 3g2o n ASN 143 Ca 0.09 0.13 0.10 0.00 -0.03 0.00 0.00 54.58 54.87 3g2o n ASN 143 Cb 0.06 -0.27 0.30 0.00 -0.61 0.00 0.00 39.78 39.26 3g2o n ASN 143 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3g2o h GLU 144 N 0.00 0.00 -5.70 3.52 4.39 -1.14 -3.40 114.58 112.24 3g2o h GLU 144 Ca 0.00 0.00 -0.66 0.00 0.34 0.00 0.00 59.36 59.04 3g2o h GLU 144 Cb 0.09 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.66 3g2o h GLU 144 CO 0.00 0.18 -0.49 -0.51 -1.16 0.00 0.00 179.01 177.02 3g2o s LEU 145 N -6.41 4.32 0.00 1.33 1.43 -0.72 -5.11 118.68 113.52 3g2o s LEU 145 Ca 0.04 0.42 -0.16 0.00 -1.03 0.00 0.00 54.13 53.39 3g2o s LEU 145 Cb 0.08 -2.16 0.22 0.00 0.03 0.00 0.00 46.19 44.36 3g2o s LEU 145 CO 0.66 0.38 1.27 -0.90 0.23 0.00 0.00 176.35 177.98 3g2o n ASP 146 N 1.78 0.02 -0.05 2.29 5.68 -1.26 -4.74 116.55 120.26 3g2o n ASP 146 Ca -0.18 -1.45 -0.11 0.00 -0.50 0.00 0.00 54.79 52.56 3g2o n ASP 146 Cb 0.54 -0.97 -0.04 0.00 -1.14 0.00 0.00 41.12 39.51 3g2o n ASP 146 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 3g2o h GLU 147 N 0.00 0.29 -0.49 0.11 4.81 -1.99 0.88 114.58 118.19 3g2o h GLU 147 Ca -0.41 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 3g2o h GLU 147 Cb 1.14 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 3g2o h GLU 147 CO 0.29 0.32 0.26 0.00 -0.73 0.00 0.00 179.01 179.15 3g2o h ALA 148 N 0.95 0.63 -0.34 2.92 0.00 -2.00 -2.54 119.26 118.88 3g2o h ALA 148 Ca 0.07 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 3g2o h ALA 148 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3g2o h ALA 148 CO -0.01 0.16 -0.05 -0.44 0.00 0.00 0.00 179.25 178.91 3g2o h ASP 149 N 0.65 0.52 -0.83 0.00 3.32 -1.83 -2.52 116.42 115.72 3g2o h ASP 149 Ca 0.17 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 3g2o h ASP 149 Cb 0.07 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3g2o h ASP 149 CO -0.03 0.63 0.42 0.03 -1.72 0.00 0.00 179.24 178.58 3g2o h ARG 150 N 0.52 1.19 -0.97 3.56 3.08 -0.57 -0.48 114.38 120.70 3g2o h ARG 150 Ca 0.10 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.00 3g2o h ARG 150 Cb 0.41 -0.22 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 3g2o h ARG 150 CO 0.02 0.90 0.62 0.00 -1.07 0.00 0.00 179.97 180.44 3g2o h ARG 151 N 1.19 1.29 -0.20 0.04 3.08 -1.06 0.39 114.38 119.11 3g2o h ARG 151 Ca 0.29 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.25 3g2o h ARG 151 Cb 0.08 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 3g2o h ARG 151 CO -0.04 0.87 0.12 0.78 -1.07 0.00 0.00 179.97 180.63 3g2o h GLY 152 N 1.32 0.28 -0.03 0.04 0.00 -1.06 -1.95 103.07 101.68 3g2o h GLY 152 Ca 0.35 -0.12 0.05 0.00 0.00 0.00 0.00 47.33 47.62 3g2o h GLY 152 CO -0.07 0.11 -0.40 -2.00 0.00 0.00 0.00 176.54 174.18 3g2o h LEU 153 N 0.24 -1.27 -0.57 3.11 5.85 -0.72 -0.04 115.31 121.90 3g2o h LEU 153 Ca 0.07 0.18 0.07 0.00 0.84 0.00 0.00 57.88 59.04 3g2o h LEU 153 Cb 0.02 0.53 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 3g2o h LEU 153 CO -0.01 -0.40 0.26 1.88 -0.34 0.00 0.00 178.44 179.83 3g2o h TYR 154 N -0.43 0.47 -0.35 1.25 0.05 -0.78 -0.84 116.97 116.35 3g2o h TYR 154 Ca 0.10 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.84 3g2o h TYR 154 Cb 0.60 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.20 3g2o h TYR 154 CO -0.50 0.19 -0.02 0.00 -1.05 0.00 0.00 178.16 176.78 3g2o h ALA 155 N 1.34 0.47 -0.52 3.88 0.00 -1.19 -1.51 119.26 121.73 3g2o h ALA 155 Ca 0.27 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.98 3g2o h ALA 155 Cb 0.24 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 3g2o h ALA 155 CO -0.22 0.25 0.22 0.77 0.00 0.00 0.00 179.25 180.27 3g2o h SER 156 N 0.43 0.26 -0.29 0.00 0.02 -0.65 -2.72 113.55 110.60 3g2o h SER 156 Ca 0.10 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 3g2o h SER 156 Cb 0.49 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.02 3g2o h SER 156 CO 0.02 0.18 0.18 0.58 -1.14 0.00 0.00 176.83 176.65 3g2o h VAL 157 N 0.42 1.05 -1.00 2.27 2.07 -0.95 -2.40 116.25 117.71 3g2o h VAL 157 Ca 0.25 -0.12 0.22 0.00 0.82 0.00 0.00 66.70 67.86 3g2o h VAL 157 Cb 0.23 0.66 -0.10 0.00 -1.52 0.00 0.00 31.29 30.55 3g2o h VAL 157 CO -0.22 0.07 0.62 0.03 0.02 0.00 0.00 177.57 178.08 3g2o h ARG 158 N 0.36 0.60 0.00 1.57 3.08 -0.99 0.02 114.38 119.03 3g2o h ARG 158 Ca 0.11 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3g2o h ARG 158 Cb -0.02 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.89 3g2o h ARG 158 CO -0.04 0.40 0.00 0.39 -1.07 0.00 0.00 179.97 179.65 3g2o n GLU 159 N -4.74 0.07 -0.03 0.04 -0.58 -0.92 -3.47 120.64 111.00 3g2o n GLU 159 Ca 0.24 0.11 0.01 0.00 -0.42 0.00 0.00 57.16 57.11 3g2o n GLU 159 Cb 0.68 -1.58 0.03 0.00 -0.57 0.00 0.00 31.44 30.00 3g2o n GLU 159 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3g2o n HIS 160 N -1.70 0.09 -3.62 -0.32 8.25 -0.08 -4.84 115.22 112.99 3g2o n HIS 160 Ca 0.06 -0.44 -0.36 0.00 -0.26 0.00 0.00 57.72 56.72 3g2o n HIS 160 Cb 0.32 -0.04 -0.08 0.00 1.12 0.00 0.00 29.99 31.32 3g2o n HIS 160 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g2o s LEU 161 N -0.91 4.22 0.66 2.41 1.43 -0.75 -0.58 118.68 125.16 3g2o s LEU 161 Ca 0.05 0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 53.41 3g2o s LEU 161 Cb 0.03 -2.24 -0.02 0.00 0.03 0.00 0.00 46.19 43.98 3g2o s LEU 161 CO 0.03 0.13 1.05 -1.83 0.23 0.00 0.00 176.35 175.96 3g2o s GLU 162 N 0.45 3.28 0.18 1.70 -1.05 -0.89 -4.81 118.70 117.56 3g2o s GLU 162 Ca 0.13 0.78 -0.33 0.00 -0.15 0.00 0.00 54.97 55.40 3g2o s GLU 162 Cb -0.12 -2.04 -0.13 0.00 -0.44 0.00 0.00 34.13 31.40 3g2o s GLU 162 CO 0.01 -0.81 1.68 -2.30 0.95 0.00 0.00 175.26 174.80 3g2o n PRO 163 N -2.91 2.55 -0.99 -4.83 -0.02 -1.26 -0.07 135.00 127.47 3g2o n PRO 163 Ca 0.07 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 3g2o n PRO 163 Cb 0.54 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 3g2o n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3g2o n GLY 164 N 3.80 0.50 3.79 -1.23 0.00 -1.26 -5.04 105.19 105.75 3g2o n GLY 164 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 3g2o n GLY 164 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g2o s GLY 165 N -2.00 2.07 -0.13 -0.02 0.00 0.90 -5.00 107.32 103.14 3g2o s GLY 165 Ca 0.00 0.43 -0.03 0.00 0.00 0.00 0.00 44.72 45.12 3g2o s GLY 165 CO 0.00 0.77 -0.02 0.54 0.00 0.00 0.00 173.10 174.39 3g2o s LYS 166 N -4.22 3.41 -0.31 2.90 1.02 -0.40 -4.30 119.74 117.84 3g2o s LYS 166 Ca 0.65 -0.46 -0.06 0.00 0.02 0.00 0.00 55.97 56.11 3g2o s LYS 166 Cb -0.18 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 3g2o s LYS 166 CO 0.42 0.43 0.07 0.12 -0.92 0.00 0.00 175.35 175.47 3g2o s PHE 167 N -0.14 3.18 -0.11 3.18 5.36 0.52 -0.67 117.98 129.31 3g2o s PHE 167 Ca 0.04 -1.26 0.01 0.00 -0.96 0.00 0.00 56.93 54.76 3g2o s PHE 167 Cb -0.13 -2.23 -0.02 0.00 -0.34 0.00 0.00 43.02 40.30 3g2o s PHE 167 CO 0.02 -0.66 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.49 3g2o s LEU 168 N 1.43 2.83 0.01 6.12 1.43 0.50 -0.68 118.68 130.32 3g2o s LEU 168 Ca 0.00 -0.24 0.05 0.00 -1.03 0.00 0.00 54.13 52.91 3g2o s LEU 168 Cb -0.18 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 3g2o s LEU 168 CO 0.02 0.23 -0.15 -0.76 0.23 0.00 0.00 176.35 175.92 3g2o s LEU 169 N -0.05 2.08 0.09 1.79 1.02 -0.42 -1.37 118.68 121.82 3g2o s LEU 169 Ca -0.02 -0.34 0.04 0.00 0.02 0.00 0.00 54.13 53.83 3g2o s LEU 169 Cb -0.14 -0.71 -0.04 0.00 0.02 0.00 0.00 46.19 45.32 3g2o s LEU 169 CO 0.04 0.13 0.03 -0.94 0.02 0.00 0.00 176.35 175.63 3g2o s SER 170 N -0.64 5.19 -0.13 2.29 1.04 -0.84 -0.36 113.70 120.24 3g2o s SER 170 Ca 0.04 -0.14 -0.05 0.00 0.48 0.00 0.00 55.95 56.29 3g2o s SER 170 Cb -0.06 -1.28 0.06 0.00 0.10 0.00 0.00 66.02 64.84 3g2o s SER 170 CO 0.00 0.16 0.27 -0.76 0.98 0.00 0.00 173.24 173.90 3g2o s LEU 171 N -2.40 -0.27 0.41 2.42 1.43 -0.28 -1.06 118.68 118.93 3g2o s LEU 171 Ca 0.27 0.62 -0.27 0.00 -1.03 0.00 0.00 54.13 53.73 3g2o s LEU 171 Cb -0.12 0.76 -0.09 0.00 0.03 0.00 0.00 46.19 46.77 3g2o s LEU 171 CO 0.20 -0.23 1.39 0.00 0.23 0.00 0.00 176.35 177.94 3g2o s ALA 172 N 2.33 3.36 -0.24 4.21 0.00 -1.26 -0.72 121.76 129.44 3g2o s ALA 172 Ca 0.00 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.38 3g2o s ALA 172 Cb -0.12 -3.55 0.06 0.00 0.00 0.00 0.00 23.12 19.51 3g2o s ALA 172 CO -0.09 -0.99 -0.07 1.41 0.00 0.00 0.00 175.76 176.02 3g2o s MET 173 N -2.22 1.80 1.08 0.00 1.75 -0.28 -4.49 119.30 116.94 3g2o s MET 173 Ca 0.56 -1.06 -0.17 0.00 -1.25 0.00 0.00 55.69 53.77 3g2o s MET 173 Cb -0.42 -2.65 0.24 0.00 2.84 0.00 0.00 34.83 34.84 3g2o s MET 173 CO 0.55 -0.58 1.20 -1.54 -0.65 0.00 0.00 175.02 174.01 3g2o s SER 174 N 1.32 2.02 0.16 1.11 1.04 -1.26 -4.66 113.70 113.44 3g2o s SER 174 Ca -0.06 0.49 -0.14 0.00 0.48 0.00 0.00 55.95 56.72 3g2o s SER 174 Cb -0.19 -0.67 0.05 0.00 0.10 0.00 0.00 66.02 65.31 3g2o s SER 174 CO -0.06 -3.43 1.75 -0.33 0.98 0.00 0.00 173.24 172.15 3g2o h GLU 175 N -2.11 0.74 -0.57 4.02 4.39 -1.99 -1.89 114.58 117.17 3g2o h GLU 175 Ca -0.45 -0.11 -0.11 0.00 0.34 0.00 0.00 59.36 59.03 3g2o h GLU 175 Cb 1.27 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 3g2o h GLU 175 CO 0.37 0.61 -0.07 0.00 -1.16 0.00 0.00 179.01 178.76 3g2o h ALA 176 N 1.09 0.78 -0.54 3.43 0.00 -1.94 -2.08 119.26 120.00 3g2o h ALA 176 Ca 0.18 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3g2o h ALA 176 Cb 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3g2o h ALA 176 CO -0.02 0.67 0.15 0.00 0.00 0.00 0.00 179.25 180.05 3g2o h ALA 177 N 0.95 1.25 0.00 0.00 0.00 -1.86 -3.04 119.26 116.55 3g2o h ALA 177 Ca 0.15 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 3g2o h ALA 177 Cb 0.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3g2o h ALA 177 CO 0.04 0.53 -0.83 1.05 0.00 0.00 0.00 179.25 180.05 3g2o h GLU 178 N 0.80 0.00 -7.04 0.00 4.11 -1.24 -3.48 114.58 107.73 3g2o h GLU 178 Ca 0.18 0.00 -0.50 0.00 0.07 0.00 0.00 59.36 59.11 3g2o h GLU 178 Cb 0.26 0.00 0.06 0.00 0.50 0.00 0.00 28.75 29.57 3g2o h GLU 178 CO -0.01 0.57 0.45 -1.12 0.07 0.00 0.00 179.01 178.97 3g2o s SER 179 N -6.37 6.07 0.04 3.06 0.01 -0.79 -4.99 113.70 110.73 3g2o s SER 179 Ca 0.02 2.20 -0.30 0.00 1.31 0.00 0.00 55.95 59.17 3g2o s SER 179 Cb 0.08 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 63.66 3g2o s SER 179 CO 0.78 -0.98 1.41 -0.70 0.41 0.00 0.00 173.24 174.16 3g2o s GLU 180 N -2.94 4.29 0.25 12.44 2.56 -1.26 -4.98 118.70 129.05 3g2o s GLU 180 Ca 0.67 2.02 -0.31 0.00 0.00 0.00 0.00 54.97 57.35 3g2o s GLU 180 Cb -0.25 -3.49 -0.11 0.00 2.00 0.00 0.00 34.13 32.28 3g2o s GLU 180 CO 0.30 -0.54 1.59 -2.14 -0.56 0.00 0.00 175.26 173.91 3g2o s PRO 181 N 2.05 4.16 -0.21 4.30 0.02 -1.26 -4.95 135.00 139.12 3g2o s PRO 181 Ca 0.65 2.51 -0.29 0.00 0.02 0.00 0.00 61.00 63.89 3g2o s PRO 181 Cb -0.33 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.08 3g2o s PRO 181 CO 0.28 -0.62 1.76 -1.17 -0.33 0.00 0.00 177.00 176.92 3g2o s LEU 182 N 0.13 3.84 -0.03 -5.54 2.96 -1.26 -4.96 118.68 113.82 3g2o s LEU 182 Ca 0.66 1.73 -0.26 0.00 -0.22 0.00 0.00 54.13 56.04 3g2o s LEU 182 Cb -0.47 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.66 3g2o s LEU 182 CO 0.41 -1.39 0.80 -0.70 -1.32 0.00 0.00 176.35 174.16 3g2o s GLU 183 N 5.00 4.49 -0.16 1.98 2.12 -1.26 -4.54 118.70 126.33 3g2o s GLU 183 Ca 0.78 1.09 -0.07 0.00 0.36 0.00 0.00 54.97 57.13 3g2o s GLU 183 Cb -0.28 -3.44 -0.04 0.00 0.26 0.00 0.00 34.13 30.63 3g2o s GLU 183 CO 0.32 0.05 0.10 1.03 -0.54 0.00 0.00 175.26 176.22 3g2o s ARG 184 N 0.79 3.76 -0.09 4.30 0.52 0.59 -4.94 118.95 123.88 3g2o s ARG 184 Ca 0.43 -0.24 0.04 0.00 -0.52 0.00 0.00 55.73 55.44 3g2o s ARG 184 Cb -0.19 -3.22 -0.00 0.00 0.52 0.00 0.00 34.95 32.05 3g2o s ARG 184 CO 0.22 0.49 -0.24 0.21 0.02 0.00 0.00 175.30 176.01 3g2o s LYS 185 N -0.23 2.90 -0.01 3.54 2.20 -1.26 -0.47 119.74 126.41 3g2o s LYS 185 Ca 0.10 -0.87 0.00 0.00 -0.36 0.00 0.00 55.97 54.84 3g2o s LYS 185 Cb -0.12 -2.24 0.01 0.00 -1.51 0.00 0.00 37.83 33.97 3g2o s LYS 185 CO 0.01 0.22 -0.01 -1.14 -0.36 0.00 0.00 175.35 174.07 3g2o s GLN 186 N 0.24 0.14 -0.27 4.03 0.74 -0.36 -5.00 119.66 119.19 3g2o s GLN 186 Ca -0.15 -0.01 -0.17 0.00 0.05 0.00 0.00 55.36 55.07 3g2o s GLN 186 Cb -0.17 -0.20 -0.03 0.00 1.10 0.00 0.00 33.01 33.71 3g2o s GLN 186 CO 0.08 -0.01 0.46 -1.21 -0.55 0.00 0.00 175.29 174.06 3g2o s GLU 187 N 0.24 4.04 -0.04 1.67 8.01 -1.26 -1.04 118.70 130.32 3g2o s GLU 187 Ca -0.02 0.21 0.04 0.00 0.01 0.00 0.00 54.97 55.21 3g2o s GLU 187 Cb -0.04 -3.66 -0.00 0.00 -4.31 0.00 0.00 34.13 26.12 3g2o s GLU 187 CO -0.01 -0.33 -0.15 -0.51 0.01 0.00 0.00 175.26 174.27 3g2o s LEU 188 N 2.22 1.89 0.00 1.80 1.43 0.07 -4.99 118.68 121.10 3g2o s LEU 188 Ca 0.19 -0.31 -0.01 0.00 -1.03 0.00 0.00 54.13 52.97 3g2o s LEU 188 Cb -0.16 -0.87 0.02 0.00 0.03 0.00 0.00 46.19 45.22 3g2o s LEU 188 CO 0.09 0.13 0.15 -0.81 0.23 0.00 0.00 176.35 176.15 3g2o n PRO 189 N 3.17 0.31 0.00 1.29 -0.04 -1.26 0.11 135.00 138.57 3g2o n PRO 189 Ca -0.18 -0.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.94 3g2o n PRO 189 Cb 0.53 -0.12 0.00 0.00 -0.04 0.00 0.00 33.50 33.87 3g2o n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g2o n GLY 193 N 3.93 0.08 3.76 0.55 0.00 -1.26 -4.67 105.19 107.58 3g2o n GLY 193 Ca 0.02 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3g2o n GLY 193 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3g2o s ARG 194 N 0.00 4.15 -0.11 1.61 3.52 -1.26 -4.99 118.95 121.87 3g2o s ARG 194 Ca 0.00 2.53 -0.18 0.00 -0.13 0.00 0.00 55.73 57.94 3g2o s ARG 194 Cb 0.00 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.32 3g2o s ARG 194 CO 0.00 -0.57 0.49 1.03 -0.81 0.00 0.00 175.30 175.44 3g2o s ARG 195 N -0.88 4.33 0.21 5.12 0.52 -1.26 -5.01 118.95 121.97 3g2o s ARG 195 Ca 0.60 0.48 0.10 0.00 -0.52 0.00 0.00 55.73 56.39 3g2o s ARG 195 Cb -0.46 -3.42 -0.04 0.00 0.52 0.00 0.00 34.95 31.54 3g2o s ARG 195 CO 0.51 0.18 -0.10 0.71 0.02 0.00 0.00 175.30 176.62 3g2o s TYR 196 N 0.52 2.57 -0.22 -0.53 1.51 0.12 -4.98 117.35 116.34 3g2o s TYR 196 Ca 0.27 -0.25 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 3g2o s TYR 196 Cb -0.15 -1.22 -0.01 0.00 -0.11 0.00 0.00 41.96 40.47 3g2o s TYR 196 CO 0.11 0.55 -0.04 0.08 -1.11 0.00 0.00 175.55 175.14 3g2o s VAL 197 N -1.90 3.40 -0.24 0.71 1.01 -1.26 -0.75 120.40 121.37 3g2o s VAL 197 Ca 0.26 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 3g2o s VAL 197 Cb -0.08 -2.55 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 3g2o s VAL 197 CO 0.15 0.42 0.23 -0.22 0.00 0.00 0.00 175.10 175.69 3g2o s LEU 198 N 1.48 4.11 -0.19 3.92 2.96 -0.21 -4.97 118.68 125.79 3g2o s LEU 198 Ca 0.06 0.20 -0.04 0.00 -0.22 0.00 0.00 54.13 54.12 3g2o s LEU 198 Cb -0.14 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.30 3g2o s LEU 198 CO -0.03 -0.00 -0.02 -1.00 -1.32 0.00 0.00 176.35 173.98 3g2o s HIS 199 N 1.29 3.03 -0.10 5.38 3.76 -1.26 -1.22 115.29 126.16 3g2o s HIS 199 Ca 0.11 -0.43 0.02 0.00 -0.15 0.00 0.00 55.06 54.60 3g2o s HIS 199 Cb -0.14 -2.04 0.01 0.00 1.11 0.00 0.00 32.58 31.52 3g2o s HIS 199 CO 0.06 -0.19 -0.17 0.08 -0.85 0.00 0.00 174.74 173.67 3g2o s VAL 200 N 0.81 1.61 0.08 -0.90 1.01 0.38 -4.97 120.40 118.43 3g2o s VAL 200 Ca -0.00 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.33 3g2o s VAL 200 Cb -0.14 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 3g2o s VAL 200 CO 0.02 0.46 -0.20 -0.13 0.00 0.00 0.00 175.10 175.25 3g2o s ARG 201 N 0.78 1.15 -0.26 2.72 0.52 -1.26 -0.30 118.95 122.30 3g2o s ARG 201 Ca -0.11 -1.08 -0.05 0.00 -0.52 0.00 0.00 55.73 53.97 3g2o s ARG 201 Cb -0.16 -1.36 0.00 0.00 0.52 0.00 0.00 34.95 33.96 3g2o s ARG 201 CO 0.01 0.32 0.02 -1.01 0.02 0.00 0.00 175.30 174.67 3g2o s HIS 202 N -1.07 3.08 -0.02 -0.53 3.76 -1.26 -5.08 115.29 114.16 3g2o s HIS 202 Ca 0.06 -1.00 -0.17 0.00 -0.15 0.00 0.00 55.06 53.80 3g2o s HIS 202 Cb -0.10 -2.18 -0.05 0.00 1.11 0.00 0.00 32.58 31.36 3g2o s HIS 202 CO 0.03 -0.57 0.48 -0.51 -0.85 0.00 0.00 174.74 173.33 3g2o s LEU 203 N 1.48 4.42 0.34 0.89 1.43 -1.26 -4.78 118.68 121.21 3g2o s LEU 203 Ca 0.03 1.00 -0.29 0.00 -1.03 0.00 0.00 54.13 53.85 3g2o s LEU 203 Cb -0.16 -2.72 -0.11 0.00 0.03 0.00 0.00 46.19 43.23 3g2o s LEU 203 CO -0.00 0.19 1.47 -2.84 0.23 0.00 0.00 176.35 175.40 3g2o s PRO 204 N -0.46 4.16 0.08 1.29 0.02 -1.26 -4.93 135.00 133.91 3g2o s PRO 204 Ca 0.26 2.50 0.00 0.00 0.02 0.00 0.00 61.00 63.78 3g2o s PRO 204 Cb -0.17 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3g2o s PRO 204 CO 0.14 -0.49 0.00 0.00 -0.33 0.00 0.00 177.00 176.32 3g2o n ALA 205 N 0.96 3.00 -3.22 -1.55 0.00 -1.26 -4.59 120.51 113.86 3g2o n ALA 205 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.34 3g2o n ALA 205 Cb 0.39 0.16 -0.12 0.00 0.00 0.00 0.00 19.45 19.88 3g2o n ALA 205 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3g2o s GLU 206 N -2.00 0.23 0.37 0.00 2.12 -1.26 -1.72 118.70 116.44 3g2o s GLU 206 Ca 0.00 0.33 0.04 0.00 0.36 0.00 0.00 54.97 55.69 3g2o s GLU 206 Cb 0.00 0.07 -0.05 0.00 0.26 0.00 0.00 34.13 34.41 3g2o s GLU 206 CO 0.00 -0.06 0.07 -1.21 -0.54 0.00 0.00 175.26 173.52 3g2o s GLU 207 N 0.33 1.80 -0.15 4.30 2.02 -0.43 -5.00 118.70 121.57 3g2o s GLU 207 Ca -0.02 -2.04 -0.02 0.00 0.02 0.00 0.00 54.97 52.91 3g2o s GLU 207 Cb -0.03 -0.91 -0.02 0.00 0.10 0.00 0.00 34.13 33.27 3g2o s GLU 207 CO -0.01 -0.27 -0.09 0.42 0.02 0.00 0.00 175.26 175.33 3g2o s ILE 208 N -3.19 3.32 -0.35 -1.63 -1.09 -1.26 -1.18 121.20 115.82 3g2o s ILE 208 Ca 0.30 -0.55 -0.22 0.00 -2.23 0.00 0.00 60.65 57.95 3g2o s ILE 208 Cb 0.07 -2.43 0.00 0.00 -1.58 0.00 0.00 42.46 38.52 3g2o s ILE 208 CO 0.14 0.50 0.72 -1.58 -1.23 0.00 0.00 174.94 173.49 3g2o s GLN 209 N 0.57 3.76 -0.18 2.79 0.74 0.85 -4.92 119.66 123.26 3g2o s GLN 209 Ca -0.06 0.24 -0.06 0.00 0.05 0.00 0.00 55.36 55.54 3g2o s GLN 209 Cb -0.15 -3.79 -0.03 0.00 1.10 0.00 0.00 33.01 30.13 3g2o s GLN 209 CO 0.03 -0.76 0.02 -2.00 -0.55 0.00 0.00 175.29 172.03 3g2o s GLU 210 N 2.89 3.80 -0.12 1.67 2.12 -1.26 -0.81 118.70 126.99 3g2o s GLU 210 Ca 0.28 -0.44 0.02 0.00 0.36 0.00 0.00 54.97 55.19 3g2o s GLU 210 Cb -0.14 -3.10 0.02 0.00 0.26 0.00 0.00 34.13 31.16 3g2o s GLU 210 CO 0.15 0.19 -0.16 0.42 -0.54 0.00 0.00 175.26 175.32 3g2o s ILE 211 N 0.55 1.63 -0.31 -3.70 1.01 0.27 -5.00 121.20 115.66 3g2o s ILE 211 Ca 0.01 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 59.91 3g2o s ILE 211 Cb -0.14 -1.48 0.05 0.00 0.01 0.00 0.00 42.46 40.90 3g2o s ILE 211 CO 0.02 0.47 0.03 -0.89 0.00 0.00 0.00 174.94 174.56 3g2o s THR 212 N 1.05 3.23 0.06 2.92 2.01 -1.26 0.04 115.64 123.68 3g2o s THR 212 Ca -0.04 -1.30 -0.30 0.00 0.31 0.00 0.00 61.69 60.36 3g2o s THR 212 Cb -0.15 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.48 3g2o s THR 212 CO -0.03 -0.12 0.97 0.27 -0.69 0.00 0.00 174.62 175.02 3g2o s ILE 213 N 1.30 4.67 -0.19 1.82 -0.00 -0.41 -4.92 121.20 123.48 3g2o s ILE 213 Ca -0.04 2.06 -0.03 0.00 -0.00 0.00 0.00 60.65 62.64 3g2o s ILE 213 Cb -0.20 -4.32 0.06 0.00 -0.00 0.00 0.00 42.46 38.00 3g2o s ILE 213 CO 0.00 0.24 0.03 -2.28 -0.00 0.00 0.00 174.94 172.93 3g2o s HIS 214 N 0.49 1.11 0.20 1.37 2.46 -1.26 -1.46 115.29 118.20 3g2o s HIS 214 Ca 0.49 -0.90 -0.32 0.00 0.47 0.00 0.00 55.06 54.81 3g2o s HIS 214 Cb -0.22 -1.06 -0.12 0.00 -0.13 0.00 0.00 32.58 31.05 3g2o s HIS 214 CO 0.29 -0.61 1.72 -2.14 -2.47 0.00 0.00 174.74 171.53 3g2o s PRO 215 N 1.83 4.13 0.24 2.88 0.02 -1.26 -4.93 135.00 137.91 3g2o s PRO 215 Ca -0.01 2.59 -0.02 0.00 0.02 0.00 0.00 61.00 63.58 3g2o s PRO 215 Cb -0.17 -3.11 0.28 0.00 0.02 0.00 0.00 34.50 31.52 3g2o s PRO 215 CO -0.08 -0.75 1.68 0.00 -0.33 0.00 0.00 177.00 177.52 3g2o h ALA 216 N 6.91 0.98 -0.09 -1.55 0.00 -2.06 -3.51 119.26 119.95 3g2o h ALA 216 Ca -0.43 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.00 3g2o h ALA 216 Cb 1.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3g2o h ALA 216 CO 0.96 0.60 -0.54 0.38 0.00 0.00 0.00 179.25 180.64 3g2o h ASP 217 N 0.62 0.29 -0.86 0.00 3.04 -2.07 -3.58 116.42 113.85 3g2o h ASP 217 Ca 0.10 -0.15 0.15 0.00 -3.24 0.00 0.00 57.03 53.88 3g2o h ASP 217 Cb 0.66 -0.08 -0.21 0.00 -1.04 0.00 0.00 39.33 38.65 3g2o h ASP 217 CO 0.05 0.78 -0.05 -0.69 -2.04 0.00 0.00 179.24 177.28 3g2o s VAL 225 N -3.89 -0.71 0.31 4.15 1.01 -1.26 -5.32 120.40 114.70 3g2o s VAL 225 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 61.98 61.99 3g2o s VAL 225 Cb 0.12 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 3g2o s VAL 225 CO 0.79 0.00 0.46 0.00 0.00 0.00 0.00 175.10 176.35 3g2o s THR 227 N -2.15 0.22 -0.24 0.00 2.01 -0.74 -1.28 115.64 113.45 3g2o s THR 227 Ca 0.41 -0.09 -0.20 0.00 0.31 0.00 0.00 61.69 62.13 3g2o s THR 227 Cb -0.09 -0.21 0.07 0.00 0.01 0.00 0.00 72.50 72.27 3g2o s THR 227 CO 0.31 0.08 0.63 -2.28 -0.69 0.00 0.00 174.62 172.67 3g2o s HIS 228 N 0.12 -0.77 -0.15 4.92 5.04 0.11 0.16 115.29 124.70 3g2o s HIS 228 Ca -0.01 1.77 0.00 0.00 -1.54 0.00 0.00 55.06 55.28 3g2o s HIS 228 Cb -0.03 0.33 -0.00 0.00 0.04 0.00 0.00 32.58 32.92 3g2o s HIS 228 CO -0.00 -0.38 -0.16 1.03 -2.34 0.00 0.00 174.74 172.89 3g2o s ARG 229 N 0.72 3.21 0.15 2.88 0.52 -1.26 0.95 118.95 126.13 3g2o s ARG 229 Ca -0.03 -0.75 0.07 0.00 -0.52 0.00 0.00 55.73 54.50 3g2o s ARG 229 Cb -0.05 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.77 3g2o s ARG 229 CO -0.05 0.02 -0.16 -0.98 0.02 0.00 0.00 175.30 174.15 3g2o s ARG 230 N 0.80 1.18 0.35 3.54 1.70 0.01 -4.97 118.95 121.55 3g2o s ARG 230 Ca -0.06 -1.37 -0.29 0.00 -0.47 0.00 0.00 55.73 53.55 3g2o s ARG 230 Cb -0.15 -1.12 -0.11 0.00 -0.57 0.00 0.00 34.95 33.00 3g2o s ARG 230 CO 0.00 0.21 1.40 0.50 -1.08 0.00 0.00 175.30 176.34 3g2o s ARG 231 N -2.91 4.23 -0.32 3.89 3.52 -1.26 -0.10 118.95 126.00 3g2o s ARG 231 Ca 0.14 2.39 -0.02 0.00 -0.13 0.00 0.00 55.73 58.11 3g2o s ARG 231 Cb -0.04 -3.03 0.11 0.00 -1.56 0.00 0.00 34.95 30.43 3g2o s ARG 231 CO 0.05 -0.37 0.15 -1.17 -0.81 0.00 0.00 175.30 173.15 3g2o s LEU 232 N -1.81 1.20 0.41 -0.88 2.96 -0.32 -4.75 118.68 115.49 3g2o s LEU 232 Ca 0.52 -1.67 -0.23 0.00 -0.22 0.00 0.00 54.13 52.53 3g2o s LEU 232 Cb -0.43 -0.53 -0.10 0.00 0.50 0.00 0.00 46.19 45.63 3g2o s LEU 232 CO 0.57 -0.39 0.99 -0.76 -1.32 0.00 0.00 176.35 175.43 3g2o s LEU 233 N 1.63 4.05 0.15 -0.68 1.43 -1.26 -1.32 118.68 122.67 3g2o s LEU 233 Ca 0.12 1.84 -0.30 0.00 -1.03 0.00 0.00 54.13 54.76 3g2o s LEU 233 Cb -0.18 -4.36 -0.07 0.00 0.03 0.00 0.00 46.19 41.60 3g2o s LEU 233 CO -0.23 -0.41 0.99 0.00 0.23 0.00 0.00 176.35 176.93 3g2o s ALA 234 N -1.92 3.29 0.28 4.21 0.00 -0.70 -4.81 121.76 122.12 3g2o s ALA 234 Ca 0.60 0.64 0.03 0.00 0.00 0.00 0.00 51.96 53.22 3g2o s ALA 234 Cb -0.15 -3.28 0.68 0.00 0.00 0.00 0.00 23.12 20.36 3g2o s ALA 234 CO 0.19 -0.03 1.72 -1.35 0.00 0.00 0.00 175.76 176.30 3g2o h PRO 235 N 5.25 0.48 -0.92 0.00 0.11 -1.91 -1.15 132.00 133.86 3g2o h PRO 235 Ca -0.44 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.73 3g2o h PRO 235 Cb 1.21 -0.11 -0.07 0.00 0.11 0.00 0.00 31.00 32.14 3g2o h PRO 235 CO 0.71 0.32 0.57 -0.44 -0.21 0.00 0.00 178.00 178.95 3g2o h ASP 236 N 0.49 0.88 0.15 -2.05 3.32 -1.92 -0.43 116.42 116.86 3g2o h ASP 236 Ca 0.53 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.61 3g2o h ASP 236 Cb 0.94 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.32 3g2o h ASP 236 CO -0.47 0.53 -0.12 -0.61 -1.72 0.00 0.00 179.24 176.85 3g2o h GLN 237 N 1.00 -0.28 -0.67 3.56 5.75 -1.47 -0.43 115.11 122.57 3g2o h GLN 237 Ca 0.42 0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.98 3g2o h GLN 237 Cb 0.26 0.06 -0.05 0.00 1.07 0.00 0.00 27.48 28.82 3g2o h GLN 237 CO -0.20 -0.18 0.39 0.28 -2.65 0.00 0.00 178.83 176.46 3g2o h VAL 238 N -0.29 1.01 -0.40 2.39 2.07 -1.24 -1.32 116.25 118.46 3g2o h VAL 238 Ca -0.00 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.29 3g2o h VAL 238 Cb 0.26 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 3g2o h VAL 238 CO -0.01 0.13 0.22 0.58 0.02 0.00 0.00 177.57 178.51 3g2o h VAL 239 N 0.73 1.01 -0.63 2.57 2.07 -0.83 0.62 116.25 121.78 3g2o h VAL 239 Ca 0.29 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.76 3g2o h VAL 239 Cb 0.13 0.52 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 3g2o h VAL 239 CO -0.16 0.08 0.22 0.03 0.02 0.00 0.00 177.57 177.76 3g2o h ARG 240 N 0.45 0.37 -0.83 1.57 3.08 -0.66 -1.83 114.38 116.53 3g2o h ARG 240 Ca 0.17 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.16 3g2o h ARG 240 Cb 0.04 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 3g2o h ARG 240 CO -0.10 0.25 0.37 0.93 -1.07 0.00 0.00 179.97 180.35 3g2o h GLU 241 N 0.38 1.21 -0.13 0.04 5.08 -0.55 -1.84 114.58 118.78 3g2o h GLU 241 Ca 0.33 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 3g2o h GLU 241 Cb 0.44 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3g2o h GLU 241 CO -0.34 0.95 0.06 -0.07 -1.00 0.00 0.00 179.01 178.61 3g2o h LEU 242 N 1.19 0.17 -0.22 1.33 3.38 -0.19 -1.86 115.31 119.11 3g2o h LEU 242 Ca 0.28 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.14 3g2o h LEU 242 Cb 0.17 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3g2o h LEU 242 CO -0.03 0.25 0.08 0.58 0.09 0.00 0.00 178.44 179.40 3g2o h VAL 243 N 0.07 0.95 -0.36 1.22 2.07 -1.26 -1.29 116.25 117.65 3g2o h VAL 243 Ca 0.04 -0.06 0.10 0.00 0.82 0.00 0.00 66.70 67.61 3g2o h VAL 243 Cb 0.13 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3g2o h VAL 243 CO -0.01 0.03 0.28 -0.09 0.02 0.00 0.00 177.57 177.81 3g2o h ARG 244 N 0.18 0.00 -0.40 1.57 2.43 -1.21 -1.28 114.38 115.67 3g2o h ARG 244 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3g2o h ARG 244 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3g2o h ARG 244 CO -0.10 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.23 3g2o n SER 245 N -4.26 2.95 0.00 -3.80 3.41 -0.62 -4.94 113.62 106.36 3g2o n SER 245 Ca 0.06 -1.93 0.00 0.00 -0.26 0.00 0.00 58.87 56.73 3g2o n SER 245 Cb 0.46 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3g2o n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g2o n GLY 246 N 1.40 1.06 3.83 5.00 0.00 -0.48 -4.93 105.19 111.06 3g2o n GLY 246 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 3g2o n GLY 246 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g2o s PHE 247 N -2.03 3.38 -0.20 1.61 0.08 -0.58 -4.48 117.98 115.76 3g2o s PHE 247 Ca 0.00 1.52 -0.11 0.00 0.12 0.00 0.00 56.93 58.46 3g2o s PHE 247 Cb 0.00 -2.81 -0.05 0.00 -0.57 0.00 0.00 43.02 39.60 3g2o s PHE 247 CO 0.00 -0.22 0.19 -0.51 -0.10 0.00 0.00 175.22 174.58 3g2o s ASP 248 N -2.60 6.26 -0.50 1.36 1.01 0.10 -3.94 116.67 118.36 3g2o s ASP 248 Ca 0.60 0.29 -0.18 0.00 0.71 0.00 0.00 52.55 53.97 3g2o s ASP 248 Cb -0.09 -2.12 0.07 0.00 1.01 0.00 0.00 42.92 41.78 3g2o s ASP 248 CO 0.22 0.12 0.57 -0.69 0.21 0.00 0.00 175.17 175.60 3g2o s VAL 249 N 0.58 4.97 -0.39 -1.27 1.01 -1.26 -0.81 120.40 123.22 3g2o s VAL 249 Ca 0.11 -0.70 0.23 0.00 0.00 0.00 0.00 61.98 61.62 3g2o s VAL 249 Cb -0.12 -4.27 0.09 0.00 0.00 0.00 0.00 36.38 32.08 3g2o s VAL 249 CO 0.01 -0.77 1.25 0.16 0.00 0.00 0.00 175.10 175.76 3g2o h ILE 250 N 5.84 0.00 -1.86 2.22 3.07 -1.60 -3.48 117.51 121.70 3g2o h ILE 250 Ca -0.28 -0.85 -0.01 0.00 1.55 0.00 0.00 64.86 65.26 3g2o h ILE 250 Cb 1.10 1.49 -0.21 0.00 -0.27 0.00 0.00 36.82 38.93 3g2o h ILE 250 CO 0.95 0.00 0.29 0.00 -1.05 0.00 0.00 178.15 178.34 3g2o s ALA 251 N -3.28 -1.83 -0.23 0.16 0.00 -1.22 -5.01 121.76 110.36 3g2o s ALA 251 Ca 0.03 1.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.50 3g2o s ALA 251 Cb 0.10 -0.50 0.08 0.00 0.00 0.00 0.00 23.12 22.80 3g2o s ALA 251 CO 0.74 -0.34 0.11 -0.65 0.00 0.00 0.00 175.76 175.63 3g2o s GLN 252 N -0.78 0.13 -0.29 0.00 -0.21 -1.25 -1.28 119.66 115.99 3g2o s GLN 252 Ca -0.06 -0.30 -0.05 0.00 0.02 0.00 0.00 55.36 54.98 3g2o s GLN 252 Cb -0.01 -1.49 0.02 0.00 1.00 0.00 0.00 33.01 32.52 3g2o s GLN 252 CO 0.05 -0.84 0.03 0.99 -2.12 0.00 0.00 175.29 173.40 3g2o s THR 253 N 2.12 3.54 0.59 -0.19 2.01 0.08 -4.89 115.64 118.90 3g2o s THR 253 Ca 0.05 -0.90 -0.19 0.00 0.31 0.00 0.00 61.69 60.97 3g2o s THR 253 Cb -0.16 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.45 3g2o s THR 253 CO -0.23 0.07 1.18 -2.84 -0.69 0.00 0.00 174.62 172.11 3g2o s PRO 254 N 1.42 3.05 0.19 4.92 0.02 -1.26 -0.19 135.00 143.15 3g2o s PRO 254 Ca 0.01 1.74 -0.16 0.00 0.02 0.00 0.00 61.00 62.61 3g2o s PRO 254 Cb -0.17 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.42 3g2o s PRO 254 CO 0.00 -1.12 0.48 -0.59 -0.33 0.00 0.00 177.00 175.44 3g2o s PHE 255 N -1.69 -0.01 -0.25 6.54 -0.12 0.24 -4.86 117.98 117.83 3g2o s PHE 255 Ca 0.75 -0.34 -0.18 0.00 -0.05 0.00 0.00 56.93 57.12 3g2o s PHE 255 Cb -0.28 0.30 -0.03 0.00 -0.63 0.00 0.00 43.02 42.39 3g2o s PHE 255 CO 0.32 -0.88 0.52 0.00 -0.05 0.00 0.00 175.22 175.13 3g2o s ALA 256 N -3.89 3.59 0.25 1.99 0.00 -1.26 -1.56 121.76 120.87 3g2o s ALA 256 Ca 0.11 -0.56 -0.03 0.00 0.00 0.00 0.00 51.96 51.48 3g2o s ALA 256 Cb -0.00 -2.88 0.46 0.00 0.00 0.00 0.00 23.12 20.69 3g2o s ALA 256 CO -0.02 -0.69 1.78 0.66 0.00 0.00 0.00 175.76 177.49 3g2o h SER 257 N 7.92 0.58 -0.12 0.00 4.64 -1.89 -0.23 113.55 124.45 3g2o h SER 257 Ca -0.30 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3g2o h SER 257 Cb 1.14 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3g2o h SER 257 CO 0.72 0.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.58 3g2o n GLY 258 N -1.32 -0.00 1.79 -0.77 0.00 -1.26 -3.89 105.19 99.74 3g2o n GLY 258 Ca 0.15 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3g2o n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g2o n GLY 259 N 1.06 0.79 3.40 -0.02 0.00 -0.10 -4.92 105.19 105.40 3g2o n GLY 259 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 3g2o n GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g2o s ALA 260 N -3.04 -1.33 0.00 4.61 0.00 -1.26 -4.97 121.76 115.77 3g2o s ALA 260 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.86 3g2o s ALA 260 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3g2o s ALA 260 CO 0.00 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 175.85 3g2o n GLY 261 N 1.14 -1.12 3.76 0.00 0.00 -1.26 -4.86 105.19 102.86 3g2o n GLY 261 Ca -0.20 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 3g2o n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g2o n ARG 262 N 0.00 2.64 -2.56 1.61 1.74 -1.26 -4.75 116.66 114.09 3g2o n ARG 262 Ca 0.00 0.93 -0.43 0.00 -0.77 0.00 0.00 57.85 57.58 3g2o n ARG 262 Cb 0.00 -2.66 -0.02 0.00 -1.02 0.00 0.00 32.46 28.76 3g2o n ARG 262 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3g2o s LYS 263 N -1.67 3.73 -0.03 5.56 1.02 -1.26 -4.42 119.74 122.67 3g2o s LYS 263 Ca 0.56 0.68 0.08 0.00 0.02 0.00 0.00 55.97 57.31 3g2o s LYS 263 Cb -0.49 -3.91 0.20 0.00 -0.52 0.00 0.00 37.83 33.11 3g2o s LYS 263 CO 0.60 -1.37 1.16 -0.40 -0.92 0.00 0.00 175.35 174.41 3g2o n ASP 264 N 7.94 2.58 -4.00 2.83 5.75 -0.65 -4.80 116.55 126.20 3g2o n ASP 264 Ca 0.13 -2.24 -0.09 0.00 -0.01 0.00 0.00 54.79 52.58 3g2o n ASP 264 Cb 0.49 -0.19 -0.08 0.00 -1.03 0.00 0.00 41.12 40.30 3g2o n ASP 264 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 3g2o s MET 265 N -1.42 0.94 -0.04 0.11 -1.94 -0.60 -1.13 119.30 115.21 3g2o s MET 265 Ca 0.17 -1.18 0.03 0.00 -1.71 0.00 0.00 55.69 53.00 3g2o s MET 265 Cb 0.11 0.31 0.00 0.00 2.01 0.00 0.00 34.83 37.27 3g2o s MET 265 CO 0.07 -0.30 -0.13 0.08 -0.01 0.00 0.00 175.02 174.73 3g2o s VAL 266 N -3.95 1.15 -0.32 -6.03 1.01 0.10 -0.59 120.40 111.77 3g2o s VAL 266 Ca 0.14 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 3g2o s VAL 266 Cb 0.05 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 3g2o s VAL 266 CO -0.04 0.34 0.36 -0.22 0.00 0.00 0.00 175.10 175.54 3g2o s LEU 267 N 0.25 4.32 -0.23 3.92 2.96 0.74 -1.13 118.68 129.52 3g2o s LEU 267 Ca -0.06 -0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.66 3g2o s LEU 267 Cb -0.12 -2.35 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 3g2o s LEU 267 CO 0.02 -0.29 0.10 -0.69 -1.32 0.00 0.00 176.35 174.17 3g2o s VAL 268 N 2.02 4.79 -0.27 1.68 1.01 0.52 -0.74 120.40 129.42 3g2o s VAL 268 Ca 0.12 -0.02 -0.10 0.00 0.00 0.00 0.00 61.98 61.99 3g2o s VAL 268 Cb -0.16 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 3g2o s VAL 268 CO 0.11 0.37 0.16 -1.61 0.00 0.00 0.00 175.10 174.13 3g2o s GLU 269 N 1.10 3.89 0.02 2.72 2.02 -0.40 -1.30 118.70 126.75 3g2o s GLU 269 Ca 0.05 -0.35 0.08 0.00 0.02 0.00 0.00 54.97 54.77 3g2o s GLU 269 Cb -0.14 -3.56 -0.02 0.00 0.10 0.00 0.00 34.13 30.50 3g2o s GLU 269 CO 0.04 -0.16 -0.25 0.00 0.02 0.00 0.00 175.26 174.91 3g2o s ALA 270 N 1.65 2.13 0.10 5.21 0.00 0.15 -1.37 121.76 129.62 3g2o s ALA 270 Ca 0.07 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 50.89 3g2o s ALA 270 Cb -0.16 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 3g2o s ALA 270 CO 0.09 0.51 -0.08 0.14 0.00 0.00 0.00 175.76 176.41 3g2o s VAL 271 N -0.72 0.85 -0.25 0.00 -7.23 0.01 -0.35 120.40 112.70 3g2o s VAL 271 Ca 0.10 -1.81 -0.13 0.00 -1.81 0.00 0.00 61.98 58.33 3g2o s VAL 271 Cb -0.10 -1.53 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 3g2o s VAL 271 CO 0.01 -0.72 0.30 -0.32 -0.31 0.00 0.00 175.10 174.06 3g2o s MET 272 N -3.33 4.05 0.00 4.82 1.75 -1.26 -0.72 119.30 124.60 3g2o s MET 272 Ca 0.09 -0.06 0.25 0.00 -1.25 0.00 0.00 55.69 54.73 3g2o s MET 272 Cb 0.01 -3.61 1.52 0.00 2.84 0.00 0.00 34.83 35.59 3g2o s MET 272 CO -0.02 -0.15 1.88 -0.35 -0.65 0.00 0.00 175.02 175.73