#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ime n ILE 3 N 0.00 1.96 -1.31 0.00 5.41 -1.26 -4.96 119.36 119.20 3ime n ILE 3 Ca 0.00 -0.49 -0.35 0.00 1.00 0.00 0.00 62.75 62.91 3ime n ILE 3 Cb 0.00 -1.10 0.10 0.00 -0.71 0.00 0.00 39.64 37.93 3ime n ILE 3 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3ime n PRO 4 N 0.73 0.47 -1.86 0.38 -0.02 -1.26 -4.93 135.00 128.51 3ime n PRO 4 Ca 0.09 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 3ime n PRO 4 Cb 0.33 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 3ime n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ime s ALA 5 N -1.88 3.77 -0.15 3.55 0.00 -1.26 -4.89 121.76 120.90 3ime s ALA 5 Ca 0.75 1.36 -0.00 0.00 0.00 0.00 0.00 51.96 54.07 3ime s ALA 5 Cb -0.33 -3.68 0.03 0.00 0.00 0.00 0.00 23.12 19.14 3ime s ALA 5 CO 0.49 -0.99 -0.08 0.12 0.00 0.00 0.00 175.76 175.29 3ime s PHE 6 N 1.96 1.76 -0.37 0.00 5.36 -1.26 -5.03 117.98 120.40 3ime s PHE 6 Ca 0.74 -1.04 -0.12 0.00 -0.96 0.00 0.00 56.93 55.56 3ime s PHE 6 Cb -0.44 -1.36 0.02 0.00 -0.34 0.00 0.00 43.02 40.90 3ime s PHE 6 CO 0.33 -0.60 0.23 -1.01 -1.46 0.00 0.00 175.22 172.70 3ime s HIS 7 N 1.62 3.23 0.97 10.12 3.76 -1.26 -5.09 115.29 128.64 3ime s HIS 7 Ca 0.03 -0.78 -0.12 0.00 -0.15 0.00 0.00 55.06 54.03 3ime s HIS 7 Cb -0.14 -2.47 0.12 0.00 1.11 0.00 0.00 32.58 31.21 3ime s HIS 7 CO -0.08 -0.60 0.81 -2.30 -0.85 0.00 0.00 174.74 171.73 3ime n PRO 8 N 5.04 -0.71 -0.67 8.40 -0.02 -1.26 -2.64 135.00 143.14 3ime n PRO 8 Ca -0.12 -0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.21 3ime n PRO 8 Cb 0.47 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3ime n PRO 8 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ime n GLY 9 N 0.87 0.00 3.38 -1.23 0.00 -1.26 -4.94 105.19 102.02 3ime n GLY 9 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 3ime n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ime s GLU 10 N -1.34 1.43 -0.42 1.61 2.02 -1.08 -5.03 118.70 115.89 3ime s GLU 10 Ca 0.00 -1.67 -0.26 0.00 0.02 0.00 0.00 54.97 53.06 3ime s GLU 10 Cb 0.00 -1.19 0.02 0.00 0.10 0.00 0.00 34.13 33.07 3ime s GLU 10 CO 0.00 0.15 0.96 -1.17 0.02 0.00 0.00 175.26 175.22 3ime s LEU 11 N -3.38 3.94 -0.24 1.80 2.96 -1.25 -4.14 118.68 118.39 3ime s LEU 11 Ca 0.25 0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 54.46 3ime s LEU 11 Cb 0.00 -3.29 -0.05 0.00 0.50 0.00 0.00 46.19 43.36 3ime s LEU 11 CO 0.09 -1.00 0.14 0.20 -1.32 0.00 0.00 176.35 174.47 3ime s ASN 12 N 2.11 5.99 -0.13 3.68 0.01 -0.44 -4.98 114.94 121.19 3ime s ASN 12 Ca 0.39 0.08 -0.03 0.00 -0.71 0.00 0.00 52.86 52.59 3ime s ASN 12 Cb -0.10 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.45 3ime s ASN 12 CO 0.24 0.07 -0.00 -0.69 -1.51 0.00 0.00 177.10 175.20 3ime s VAL 13 N 1.04 4.23 -0.01 1.60 1.01 -1.26 -1.77 120.40 125.25 3ime s VAL 13 Ca 0.07 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.82 3ime s VAL 13 Cb -0.14 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.41 3ime s VAL 13 CO 0.04 0.54 -0.08 -0.31 0.00 0.00 0.00 175.10 175.29 3ime s TYR 14 N -0.20 0.72 -0.12 5.22 1.51 -0.81 -5.01 117.35 118.65 3ime s TYR 14 Ca 0.05 -0.14 0.09 0.00 -1.01 0.00 0.00 57.07 56.06 3ime s TYR 14 Cb -0.13 -0.47 -0.13 0.00 -0.11 0.00 0.00 41.96 41.12 3ime s TYR 14 CO 0.02 -0.02 0.25 0.43 -1.11 0.00 0.00 175.55 175.12 3ime n SER 15 N 2.95 2.21 -4.65 2.29 7.64 -1.26 -0.72 113.62 122.08 3ime n SER 15 Ca -0.14 -0.19 -0.42 0.00 1.01 0.00 0.00 58.87 59.14 3ime n SER 15 Cb 0.57 1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 65.04 3ime n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ime s ALA 16 N -2.44 3.61 0.23 -0.43 0.00 -1.26 -4.20 121.76 117.26 3ime s ALA 16 Ca -0.02 -0.10 -0.08 0.00 0.00 0.00 0.00 51.96 51.76 3ime s ALA 16 Cb 0.06 -3.25 0.37 0.00 0.00 0.00 0.00 23.12 20.31 3ime s ALA 16 CO 0.39 -0.84 1.67 -1.35 0.00 0.00 0.00 175.76 175.63 3ime h PRO 17 N 7.58 0.18 0.00 0.00 0.11 -1.93 -2.06 132.00 135.88 3ime h PRO 17 Ca -0.25 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.82 3ime h PRO 17 Cb 1.11 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 3ime h PRO 17 CO 0.86 0.12 -0.13 0.78 -0.21 0.00 0.00 178.00 179.41 3ime h GLY 18 N 0.18 0.00 0.30 -0.55 0.00 -1.96 -0.33 103.07 100.72 3ime h GLY 18 Ca 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 3ime h GLY 18 CO -0.53 0.00 -0.02 -0.55 0.00 0.00 0.00 176.54 175.45 3ime h ASP 19 N 0.00 -0.04 -0.06 0.19 5.19 -1.80 -2.07 116.42 117.83 3ime h ASP 19 Ca -0.00 -0.62 -0.04 0.00 -0.62 0.00 0.00 57.03 55.75 3ime h ASP 19 Cb 0.31 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.82 3ime h ASP 19 CO 0.02 0.63 -0.07 1.62 -3.12 0.00 0.00 179.24 178.32 3ime h VAL 20 N -0.74 1.17 -0.63 -1.35 3.04 -1.19 -0.08 116.25 116.47 3ime h VAL 20 Ca -0.00 -0.70 -0.07 0.00 -1.01 0.00 0.00 66.70 64.92 3ime h VAL 20 Cb 0.65 1.10 -0.03 0.00 -2.01 0.00 0.00 31.29 31.01 3ime h VAL 20 CO 0.01 0.22 0.14 0.00 -1.01 0.00 0.00 177.57 176.93 3ime h ALA 21 N 1.65 0.83 -0.07 3.17 0.00 -1.07 -0.63 119.26 123.13 3ime h ALA 21 Ca 0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3ime h ALA 21 Cb 0.31 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3ime h ALA 21 CO 0.01 0.55 -0.05 -0.44 0.00 0.00 0.00 179.25 179.33 3ime h ASP 22 N 0.93 0.17 0.32 0.00 3.32 -0.86 -2.22 116.42 118.08 3ime h ASP 22 Ca 0.19 -0.45 -0.00 0.00 0.02 0.00 0.00 57.03 56.79 3ime h ASP 22 Cb 0.38 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3ime h ASP 22 CO 0.01 0.59 -0.25 0.58 -1.72 0.00 0.00 179.24 178.44 3ime h VAL 23 N -0.24 0.47 -0.37 -1.35 2.07 -1.01 -1.93 116.25 113.88 3ime h VAL 23 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 3ime h VAL 23 Cb 0.53 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 3ime h VAL 23 CO 0.01 0.00 -0.01 -1.28 0.02 0.00 0.00 177.57 176.31 3ime h SER 24 N -0.58 -0.18 -0.33 0.57 0.87 -1.13 0.85 113.55 113.63 3ime h SER 24 Ca -0.02 0.09 0.02 0.00 -1.23 0.00 0.00 61.79 60.65 3ime h SER 24 Cb 0.51 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.60 3ime h SER 24 CO -0.01 -0.05 0.16 -0.09 -0.53 0.00 0.00 176.83 176.31 3ime h ARG 25 N 0.09 0.33 -0.60 2.24 2.43 -1.32 -1.82 114.38 115.73 3ime h ARG 25 Ca 0.18 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3ime h ARG 25 Cb 0.26 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 3ime h ARG 25 CO -0.31 0.22 0.30 0.00 -1.51 0.00 0.00 179.97 178.67 3ime h ALA 26 N 1.17 1.41 -0.28 2.80 0.00 -0.72 -2.85 119.26 120.78 3ime h ALA 26 Ca 0.14 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3ime h ALA 26 Cb 0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3ime h ALA 26 CO -0.10 0.48 -0.28 -0.07 0.00 0.00 0.00 179.25 179.28 3ime h LEU 27 N 0.84 0.74 -0.75 0.00 3.38 -0.32 -3.08 115.31 116.12 3ime h LEU 27 Ca 0.21 -0.47 0.02 0.00 0.09 0.00 0.00 57.88 57.73 3ime h LEU 27 Cb 0.07 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 3ime h LEU 27 CO -0.03 1.06 0.48 -0.09 0.09 0.00 0.00 178.44 179.95 3ime h ARG 28 N 0.43 0.93 -0.75 1.13 2.43 -1.30 -2.38 114.38 114.87 3ime h ARG 28 Ca 0.05 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 3ime h ARG 28 Cb 0.85 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 3ime h ARG 28 CO 0.07 0.61 0.49 -0.07 -1.51 0.00 0.00 179.97 179.57 3ime h LEU 29 N 0.96 0.55 -1.41 3.80 3.38 -1.53 -0.79 115.31 120.27 3ime h LEU 29 Ca 0.29 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3ime h LEU 29 Cb -0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3ime h LEU 29 CO -0.09 0.32 0.00 0.35 0.09 0.00 0.00 178.44 179.11 3ime n THR 30 N -4.50 0.58 -3.03 0.22 -2.24 -0.93 -4.91 114.28 99.47 3ime n THR 30 Ca 0.13 -0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.45 3ime n THR 30 Cb 0.38 -0.32 0.04 0.00 -2.10 0.00 0.00 70.33 68.33 3ime n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ime n GLY 31 N 0.30 0.06 3.90 3.38 0.00 -0.30 -5.05 105.19 107.47 3ime n GLY 31 Ca 0.07 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 3ime n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ime s ARG 32 N -5.63 3.30 -0.34 1.61 1.81 -0.98 -4.94 118.95 113.78 3ime s ARG 32 Ca 0.30 -0.61 -0.11 0.00 -1.72 0.00 0.00 55.73 53.59 3ime s ARG 32 Cb -0.13 -2.91 -0.01 0.00 -0.45 0.00 0.00 34.95 31.45 3ime s ARG 32 CO 0.37 0.54 0.20 1.03 -0.68 0.00 0.00 175.30 176.77 3ime s ARG 33 N -2.93 3.33 -0.15 3.54 1.81 -0.32 -4.15 118.95 120.09 3ime s ARG 33 Ca 0.34 -0.74 -0.29 0.00 -1.72 0.00 0.00 55.73 53.31 3ime s ARG 33 Cb -0.12 -3.71 -0.02 0.00 -0.45 0.00 0.00 34.95 30.66 3ime s ARG 33 CO 0.27 -0.48 1.23 0.08 -0.68 0.00 0.00 175.30 175.73 3ime s VAL 34 N 1.66 4.31 -0.15 3.52 1.01 -1.26 -1.74 120.40 127.75 3ime s VAL 34 Ca 0.05 1.59 -0.01 0.00 0.00 0.00 0.00 61.98 63.62 3ime s VAL 34 Cb -0.18 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.17 3ime s VAL 34 CO 0.08 -0.11 -0.12 -0.04 0.00 0.00 0.00 175.10 174.91 3ime s MET 35 N 3.23 3.36 -0.18 2.72 -1.94 -0.81 -0.17 119.30 125.51 3ime s MET 35 Ca 0.54 -0.69 -0.05 0.00 -1.71 0.00 0.00 55.69 53.78 3ime s MET 35 Cb -0.22 -2.68 -0.03 0.00 2.01 0.00 0.00 34.83 33.92 3ime s MET 35 CO 0.15 0.13 -0.01 -1.17 -0.01 0.00 0.00 175.02 174.12 3ime s LEU 36 N 0.57 3.35 -0.48 -0.03 2.96 0.33 -0.73 118.68 124.64 3ime s LEU 36 Ca -0.08 -0.12 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 3ime s LEU 36 Cb -0.16 -1.83 0.12 0.00 0.50 0.00 0.00 46.19 44.83 3ime s LEU 36 CO 0.03 0.13 0.22 -0.69 -1.32 0.00 0.00 176.35 174.73 3ime s VAL 37 N 0.59 2.61 -0.07 1.68 1.01 0.39 -1.26 120.40 125.34 3ime s VAL 37 Ca -0.01 -3.05 -0.30 0.00 0.00 0.00 0.00 61.98 58.62 3ime s VAL 37 Cb -0.14 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 3ime s VAL 37 CO 0.02 -0.76 1.43 -2.84 0.00 0.00 0.00 175.10 172.96 3ime s PRO 38 N 0.02 4.24 0.34 2.72 0.02 -1.26 -1.75 135.00 139.33 3ime s PRO 38 Ca 0.15 1.93 0.04 0.00 0.02 0.00 0.00 61.00 63.14 3ime s PRO 38 Cb -0.24 -3.76 -0.06 0.00 0.02 0.00 0.00 34.50 30.46 3ime s PRO 38 CO -0.02 -0.70 0.06 0.95 -0.33 0.00 0.00 177.00 176.96 3ime s THR 39 N 3.26 1.16 -0.21 0.99 -4.23 0.10 -4.89 115.64 111.83 3ime s THR 39 Ca 0.64 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.28 3ime s THR 39 Cb -0.29 -2.74 0.43 0.00 1.34 0.00 0.00 72.50 71.24 3ime s THR 39 CO 0.23 0.00 1.31 0.23 -0.54 0.00 0.00 174.62 175.85 3ime n MET 40 N -0.74 1.82 -0.01 3.99 2.81 -1.26 -1.59 117.12 122.13 3ime n MET 40 Ca -0.03 -3.00 0.00 0.00 -1.81 0.00 0.00 57.70 52.86 3ime n MET 40 Cb 0.66 -1.69 -0.00 0.00 -0.71 0.00 0.00 33.22 31.49 3ime n MET 40 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ime n GLY 41 N -1.10 -1.95 3.75 3.03 0.00 -1.26 -4.70 105.19 102.96 3ime n GLY 41 Ca 0.23 -1.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 3ime n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ime n ALA 42 N -0.07 -2.45 -1.96 4.61 0.00 -1.26 -4.85 120.51 114.53 3ime n ALA 42 Ca 0.00 -0.26 -0.41 0.00 0.00 0.00 0.00 53.44 52.77 3ime n ALA 42 Cb 0.01 -3.55 -0.03 0.00 0.00 0.00 0.00 19.45 15.87 3ime n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ime s LEU 43 N -6.62 4.44 0.00 0.00 1.43 -1.26 -4.92 118.68 111.76 3ime s LEU 43 Ca 0.38 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.86 3ime s LEU 43 Cb -0.14 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.46 3ime s LEU 43 CO 0.87 -0.44 0.01 0.00 0.23 0.00 0.00 176.35 177.02 3ime n HIS 44 N 2.20 0.11 -0.18 0.29 1.44 -1.26 -4.99 115.22 112.83 3ime n HIS 44 Ca 0.04 -0.31 0.02 0.00 -2.01 0.00 0.00 57.72 55.46 3ime n HIS 44 Cb 0.43 -0.03 0.29 0.00 0.12 0.00 0.00 29.99 30.80 3ime n HIS 44 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 3ime h GLU 45 N 0.00 0.88 -0.78 -1.40 4.39 -1.99 -0.81 114.58 114.88 3ime h GLU 45 Ca -0.05 -0.05 0.15 0.00 0.34 0.00 0.00 59.36 59.75 3ime h GLU 45 Cb 0.15 -0.20 -0.10 0.00 -0.10 0.00 0.00 28.75 28.50 3ime h GLU 45 CO 0.08 0.58 0.30 0.78 -1.16 0.00 0.00 179.01 179.60 3ime h GLY 46 N 0.91 1.19 0.80 -3.84 0.00 -1.93 0.28 103.07 100.48 3ime h GLY 46 Ca 0.26 -0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 3ime h GLY 46 CO -0.06 -0.13 0.00 0.45 0.00 0.00 0.00 176.54 176.80 3ime h HIS 47 N 0.43 0.32 -0.95 5.60 3.86 -1.55 -3.17 115.15 119.68 3ime h HIS 47 Ca 0.44 -0.05 0.18 0.00 -1.16 0.00 0.00 60.37 59.77 3ime h HIS 47 Cb 0.69 -0.08 -0.08 0.00 1.06 0.00 0.00 27.41 29.00 3ime h HIS 47 CO -0.17 0.50 0.61 -0.07 0.86 0.00 0.00 177.93 179.65 3ime h LEU 48 N 0.05 0.64 -1.68 2.43 3.38 -0.93 -0.47 115.31 118.73 3ime h LEU 48 Ca 0.05 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3ime h LEU 48 Cb 0.37 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3ime h LEU 48 CO 0.01 0.27 -0.15 0.00 0.09 0.00 0.00 178.44 178.66 3ime h ALA 49 N 1.61 1.74 0.15 1.53 0.00 -0.45 -0.02 119.26 123.82 3ime h ALA 49 Ca 0.51 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 3ime h ALA 49 Cb 0.93 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3ime h ALA 49 CO -0.27 0.20 -0.07 -0.07 0.00 0.00 0.00 179.25 179.04 3ime h LEU 50 N 0.01 -0.17 -0.92 0.00 4.07 -1.17 -2.60 115.31 114.53 3ime h LEU 50 Ca 0.00 -0.35 0.22 0.00 0.08 0.00 0.00 57.88 57.83 3ime h LEU 50 Cb 0.27 0.04 -0.12 0.00 1.08 0.00 0.00 40.66 41.94 3ime h LEU 50 CO 0.02 0.31 0.46 0.58 -1.08 0.00 0.00 178.44 178.73 3ime h VAL 51 N -0.71 0.53 -0.40 1.22 2.07 -1.16 -1.69 116.25 116.11 3ime h VAL 51 Ca -0.02 -0.17 -0.15 0.00 0.82 0.00 0.00 66.70 67.19 3ime h VAL 51 Cb 0.51 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3ime h VAL 51 CO 0.03 0.09 -0.33 0.03 0.02 0.00 0.00 177.57 177.41 3ime h ARG 52 N 0.48 0.91 -0.40 1.57 3.08 -0.96 -0.69 114.38 118.37 3ime h ARG 52 Ca 0.57 -0.44 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 3ime h ARG 52 Cb 1.06 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 3ime h ARG 52 CO -0.49 1.09 0.24 0.00 -1.07 0.00 0.00 179.97 179.75 3ime h ALA 53 N 0.86 0.51 -0.45 0.04 0.00 -1.12 -1.74 119.26 117.36 3ime h ALA 53 Ca 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3ime h ALA 53 Cb 0.91 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3ime h ALA 53 CO 0.08 -0.00 0.02 0.00 0.00 0.00 0.00 179.25 179.36 3ime h ALA 54 N 1.11 1.20 -0.19 0.00 0.00 -1.15 -2.50 119.26 117.74 3ime h ALA 54 Ca 0.14 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3ime h ALA 54 Cb -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3ime h ALA 54 CO -0.03 0.53 -0.20 0.87 0.00 0.00 0.00 179.25 180.42 3ime h LYS 55 N 0.68 0.33 -1.00 0.00 1.57 -0.90 -3.10 116.57 114.15 3ime h LYS 55 Ca 0.14 -0.10 0.21 0.00 -1.87 0.00 0.00 60.65 59.04 3ime h LYS 55 Cb 0.39 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.56 3ime h LYS 55 CO 0.01 0.52 0.62 0.00 -0.57 0.00 0.00 179.45 180.03 3ime h ARG 56 N 0.30 0.61 -6.38 3.15 3.08 -0.84 -3.42 114.38 110.88 3ime h ARG 56 Ca 0.05 -0.04 -0.53 0.00 0.07 0.00 0.00 59.98 59.54 3ime h ARG 56 Cb 0.53 -0.14 0.02 0.00 0.08 0.00 0.00 29.97 30.46 3ime h ARG 56 CO 0.03 0.40 1.22 0.08 -1.07 0.00 0.00 179.97 180.64 3ime s VAL 57 N -5.73 2.95 -0.30 2.04 1.01 -1.17 -4.89 120.40 114.32 3ime s VAL 57 Ca -0.10 0.03 -0.37 0.00 0.00 0.00 0.00 61.98 61.53 3ime s VAL 57 Cb 0.25 -3.02 -0.13 0.00 0.00 0.00 0.00 36.38 33.48 3ime s VAL 57 CO 0.80 -0.00 2.01 -2.65 0.00 0.00 0.00 175.10 175.25 3ime n PRO 58 N 7.29 1.21 0.00 2.72 -0.02 -1.26 -1.50 135.00 143.43 3ime n PRO 58 Ca 0.20 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 3ime n PRO 58 Cb 0.41 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 3ime n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ime n GLY 59 N 5.57 0.39 3.76 -1.23 0.00 -1.26 -4.76 105.19 107.65 3ime n GLY 59 Ca 0.35 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.98 3ime n GLY 59 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ime s SER 60 N -2.77 5.49 -0.10 1.61 1.04 -0.56 -1.17 113.70 117.23 3ime s SER 60 Ca 0.00 2.84 0.04 0.00 0.48 0.00 0.00 55.95 59.31 3ime s SER 60 Cb 0.00 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.48 3ime s SER 60 CO 0.00 -1.43 -0.23 0.54 0.98 0.00 0.00 173.24 173.10 3ime s VAL 61 N -1.26 1.95 -0.19 5.02 0.11 -0.71 -4.79 120.40 120.53 3ime s VAL 61 Ca 0.67 -0.95 -0.15 0.00 -2.93 0.00 0.00 61.98 58.62 3ime s VAL 61 Cb -0.42 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 32.69 3ime s VAL 61 CO 0.52 0.54 0.34 -0.69 -3.33 0.00 0.00 175.10 172.47 3ime s VAL 62 N 0.40 5.25 -0.21 2.04 1.01 -1.26 -1.92 120.40 125.70 3ime s VAL 62 Ca -0.18 0.60 -0.04 0.00 0.00 0.00 0.00 61.98 62.36 3ime s VAL 62 Cb -0.18 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 3ime s VAL 62 CO 0.08 0.30 -0.05 -0.69 0.00 0.00 0.00 175.10 174.75 3ime s VAL 63 N 1.04 3.39 -0.28 2.92 1.01 0.09 -1.76 120.40 126.81 3ime s VAL 63 Ca 0.17 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 3ime s VAL 63 Cb -0.14 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.74 3ime s VAL 63 CO 0.06 0.43 -0.00 -0.69 0.00 0.00 0.00 175.10 174.90 3ime s VAL 64 N 1.35 3.22 0.25 2.92 1.01 -0.14 -0.46 120.40 128.54 3ime s VAL 64 Ca 0.04 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 60.82 3ime s VAL 64 Cb -0.14 -2.70 -0.08 0.00 0.00 0.00 0.00 36.38 33.46 3ime s VAL 64 CO -0.02 0.08 0.71 -0.94 0.00 0.00 0.00 175.10 174.92 3ime s SER 65 N 1.36 6.92 -0.10 3.32 1.04 -0.72 -1.30 113.70 124.22 3ime s SER 65 Ca -0.01 1.32 -0.01 0.00 0.48 0.00 0.00 55.95 57.73 3ime s SER 65 Cb -0.18 -2.38 0.03 0.00 0.10 0.00 0.00 66.02 63.59 3ime s SER 65 CO -0.02 -0.05 -0.03 -0.51 0.98 0.00 0.00 173.24 173.61 3ime s ILE 66 N -1.70 0.70 -0.27 -1.02 2.07 0.13 0.02 121.20 121.13 3ime s ILE 66 Ca 0.47 -0.11 -0.13 0.00 -1.41 0.00 0.00 60.65 59.47 3ime s ILE 66 Cb -0.14 -0.81 0.09 0.00 0.13 0.00 0.00 42.46 41.74 3ime s ILE 66 CO 0.20 0.29 0.63 0.12 -1.91 0.00 0.00 174.94 174.26 3ime s PHE 67 N 1.84 -1.09 -0.31 3.50 5.36 -0.62 -4.20 117.98 122.45 3ime s PHE 67 Ca 0.05 2.07 -0.18 0.00 -0.96 0.00 0.00 56.93 57.90 3ime s PHE 67 Cb -0.13 0.63 -0.01 0.00 -0.34 0.00 0.00 43.02 43.17 3ime s PHE 67 CO -0.07 -0.55 0.53 0.08 -1.46 0.00 0.00 175.22 173.75 3ime s VAL 68 N 2.10 5.02 -0.42 3.12 1.01 -1.26 -4.36 120.40 125.62 3ime s VAL 68 Ca -0.08 0.63 -0.25 0.00 0.00 0.00 0.00 61.98 62.28 3ime s VAL 68 Cb -0.08 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.40 3ime s VAL 68 CO -0.18 -0.09 0.88 0.21 0.00 0.00 0.00 175.10 175.92 3ime s ASN 69 N 1.67 6.55 -1.33 3.32 2.47 -1.26 -4.98 114.94 121.38 3ime s ASN 69 Ca 0.21 0.26 -0.06 0.00 0.42 0.00 0.00 52.86 53.68 3ime s ASN 69 Cb -0.15 -2.44 0.06 0.00 -1.45 0.00 0.00 41.25 37.27 3ime s ASN 69 CO 0.12 -0.92 2.58 -0.81 -3.72 0.00 0.00 177.10 174.34 3ime n PRO 70 N 6.87 4.21 -0.92 0.43 -0.05 -1.26 -5.10 135.00 139.18 3ime n PRO 70 Ca 0.05 -3.04 0.00 0.00 -0.05 0.00 0.00 63.50 60.47 3ime n PRO 70 Cb 0.48 -2.64 0.00 0.00 -0.05 0.00 0.00 33.50 31.30 3ime n PRO 70 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 175.50 175.70 3ime n THR 85 N 2.16 0.00 -0.35 0.52 -2.24 -1.26 -5.04 114.28 108.07 3ime n THR 85 Ca 0.66 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 62.37 3ime n THR 85 Cb 0.27 -0.44 -0.05 0.00 -2.10 0.00 0.00 70.33 68.01 3ime n THR 85 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3ime n PRO 86 N -1.24 -0.32 0.15 -0.78 -0.02 -1.26 0.42 135.00 131.94 3ime n PRO 86 Ca 0.00 1.30 0.02 0.00 -2.02 0.00 0.00 63.50 62.80 3ime n PRO 86 Cb 0.18 -1.92 0.16 0.00 -0.02 0.00 0.00 33.50 31.90 3ime n PRO 86 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3ime h ASP 87 N 0.00 0.00 -0.10 2.55 5.19 -2.05 -3.09 116.42 118.92 3ime h ASP 87 Ca 0.19 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.55 3ime h ASP 87 Cb 0.40 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.91 3ime h ASP 87 CO -0.82 0.53 -0.12 -0.78 -3.12 0.00 0.00 179.24 174.93 3ime h ASP 88 N 0.00 0.28 -0.20 6.45 3.58 -1.27 -2.11 116.42 123.15 3ime h ASP 88 Ca -0.01 -0.50 0.05 0.00 0.42 0.00 0.00 57.03 56.99 3ime h ASP 88 Cb 1.20 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 42.12 3ime h ASP 88 CO 0.07 0.73 -0.11 0.44 -2.88 0.00 0.00 179.24 177.48 3ime h ASP 89 N -0.16 -0.37 -0.93 2.28 3.32 -0.09 -1.63 116.42 118.83 3ime h ASP 89 Ca 0.01 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ime h ASP 89 Cb 0.66 0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.36 3ime h ASP 89 CO 0.03 -0.15 0.58 -0.07 -1.72 0.00 0.00 179.24 177.91 3ime h LEU 90 N -0.10 1.10 -1.25 1.55 3.38 -1.60 -1.88 115.31 116.52 3ime h LEU 90 Ca 0.11 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.07 3ime h LEU 90 Cb 0.27 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 3ime h LEU 90 CO -0.26 0.83 0.53 0.00 0.09 0.00 0.00 178.44 179.63 3ime h ALA 91 N 1.32 1.55 -0.17 1.53 0.00 -1.09 0.29 119.26 122.70 3ime h ALA 91 Ca 0.34 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 3ime h ALA 91 Cb -0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3ime h ALA 91 CO -0.07 0.35 -0.43 1.96 0.00 0.00 0.00 179.25 181.06 3ime h GLN 92 N 0.95 0.40 0.00 0.00 4.20 -0.77 -0.00 115.11 119.89 3ime h GLN 92 Ca 0.33 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3ime h GLN 92 Cb 0.12 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.91 3ime h GLN 92 CO -0.11 0.76 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.74 3ime h LEU 93 N 0.33 -0.00 -0.40 1.46 3.38 -0.51 0.11 115.31 119.67 3ime h LEU 93 Ca 0.02 -0.65 0.08 0.00 0.09 0.00 0.00 57.88 57.43 3ime h LEU 93 Cb 0.90 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.56 3ime h LEU 93 CO 0.08 0.65 -0.20 -0.09 0.09 0.00 0.00 178.44 178.96 3ime h ARG 94 N -0.65 -0.12 -0.05 1.13 2.43 -0.55 0.56 114.38 117.12 3ime h ARG 94 Ca -0.00 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 3ime h ARG 94 Cb 0.65 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 3ime h ARG 94 CO 0.00 -0.08 0.15 0.00 -1.51 0.00 0.00 179.97 178.53 3ime h ALA 95 N 1.14 1.35 -0.01 2.80 0.00 -0.85 -0.10 119.26 123.59 3ime h ALA 95 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3ime h ALA 95 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3ime h ALA 95 CO -0.48 -0.18 -0.59 0.39 0.00 0.00 0.00 179.25 178.39 3ime n GLU 96 N -3.28 0.61 -0.79 0.00 -0.58 0.36 -4.96 120.64 112.00 3ime n GLU 96 Ca -0.01 -0.47 0.00 0.00 -0.42 0.00 0.00 57.16 56.26 3ime n GLU 96 Cb 0.23 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 3ime n GLU 96 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ime n GLY 97 N 1.44 0.52 3.77 0.62 0.00 -0.05 -5.04 105.19 106.45 3ime n GLY 97 Ca 0.08 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 3ime n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ime s VAL 98 N -2.00 2.61 -0.20 1.61 1.01 -0.59 -4.92 120.40 117.93 3ime s VAL 98 Ca 0.00 0.58 0.11 0.00 0.00 0.00 0.00 61.98 62.67 3ime s VAL 98 Cb 0.00 -3.35 -0.15 0.00 0.00 0.00 0.00 36.38 32.87 3ime s VAL 98 CO 0.00 0.11 0.33 -0.62 0.00 0.00 0.00 175.10 174.92 3ime n GLU 99 N 0.40 1.47 -3.72 2.72 1.02 -1.23 -3.75 120.64 117.56 3ime n GLU 99 Ca 0.02 -0.06 -0.17 0.00 -0.02 0.00 0.00 57.16 56.92 3ime n GLU 99 Cb 0.43 -1.17 -0.17 0.00 -0.02 0.00 0.00 31.44 30.50 3ime n GLU 99 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3ime s ILE 100 N -2.50 -0.10 -0.06 -3.67 1.01 -0.72 -1.32 121.20 113.83 3ime s ILE 100 Ca -0.01 0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.95 3ime s ILE 100 Cb 0.08 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.38 3ime s ILE 100 CO 0.46 0.14 0.01 0.00 0.00 0.00 0.00 174.94 175.54 3ime s ALA 101 N 1.67 3.31 -0.29 9.38 0.00 -0.73 -0.97 121.76 134.13 3ime s ALA 101 Ca -0.02 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.13 3ime s ALA 101 Cb -0.12 -1.46 0.08 0.00 0.00 0.00 0.00 23.12 21.61 3ime s ALA 101 CO -0.03 0.61 -0.02 0.12 0.00 0.00 0.00 175.76 176.44 3ime s PHE 102 N -0.95 3.26 -0.58 0.00 5.36 -0.42 -1.93 117.98 122.72 3ime s PHE 102 Ca 0.15 -2.50 0.06 0.00 -0.96 0.00 0.00 56.93 53.68 3ime s PHE 102 Cb -0.11 -2.30 0.27 0.00 -0.34 0.00 0.00 43.02 40.54 3ime s PHE 102 CO 0.05 -0.90 0.75 0.25 -1.46 0.00 0.00 175.22 173.91 3ime n THR 103 N 4.41 1.94 -2.03 0.12 -2.24 0.10 -0.69 114.28 115.90 3ime n THR 103 Ca -0.05 -5.09 -0.30 0.00 -2.27 0.00 0.00 64.05 56.34 3ime n THR 103 Cb 0.42 -1.87 0.02 0.00 -2.10 0.00 0.00 70.33 66.80 3ime n THR 103 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3ime s PRO 104 N -2.47 3.36 0.72 -0.78 0.04 -1.26 -4.49 135.00 130.11 3ime s PRO 104 Ca 0.41 0.54 -0.10 0.00 0.04 0.00 0.00 61.00 61.89 3ime s PRO 104 Cb 0.19 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.64 3ime s PRO 104 CO -0.05 -0.64 1.08 0.95 0.04 0.00 0.00 177.00 178.38 3ime s THR 105 N -3.14 2.90 0.17 1.26 -4.23 -1.26 -4.90 115.64 106.43 3ime s THR 105 Ca 0.55 0.15 -0.12 0.00 -1.18 0.00 0.00 61.69 61.09 3ime s THR 105 Cb -0.11 -3.26 0.07 0.00 1.34 0.00 0.00 72.50 70.54 3ime s THR 105 CO 0.51 -0.33 1.71 0.74 -0.54 0.00 0.00 174.62 176.71 3ime h THR 106 N -0.69 1.24 -0.05 3.99 2.02 -1.98 -2.60 112.91 114.84 3ime h THR 106 Ca -0.45 -0.80 -0.05 0.00 0.77 0.00 0.00 66.41 65.88 3ime h THR 106 Cb 1.29 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 3ime h THR 106 CO 0.63 0.30 -0.18 0.00 0.37 0.00 0.00 175.52 176.64 3ime h ALA 107 N 1.06 1.61 -0.30 6.16 0.00 -1.95 0.38 119.26 126.22 3ime h ALA 107 Ca 0.19 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3ime h ALA 107 Cb 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3ime h ALA 107 CO -0.01 0.29 -0.44 0.00 0.00 0.00 0.00 179.25 179.09 3ime h ALA 108 N 1.75 0.66 0.08 0.00 0.00 -1.89 -2.02 119.26 117.83 3ime h ALA 108 Ca 0.01 -0.47 -0.28 0.00 0.00 0.00 0.00 54.91 54.17 3ime h ALA 108 Cb 0.37 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3ime h ALA 108 CO 0.03 0.67 -1.45 0.52 0.00 0.00 0.00 179.25 179.02 3ime h MET 109 N 0.61 0.16 -1.88 0.00 2.86 -1.03 -3.38 114.93 112.27 3ime h MET 109 Ca 0.04 -0.28 -0.58 0.00 -2.06 0.00 0.00 59.70 56.82 3ime h MET 109 Cb 1.00 0.10 -0.42 0.00 0.06 0.00 0.00 31.60 32.35 3ime h MET 109 CO 0.10 1.00 -0.70 0.66 1.06 0.00 0.00 176.91 179.02 3ime n TYR 110 N -3.37 3.64 0.28 -0.22 4.01 0.13 -4.91 117.16 116.71 3ime n TYR 110 Ca -0.13 -3.54 0.18 0.00 -0.16 0.00 0.00 57.90 54.25 3ime n TYR 110 Cb 1.02 -0.28 0.90 0.00 -0.31 0.00 0.00 39.34 40.68 3ime n TYR 110 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ime h PRO 111 N 2.78 0.00 -0.08 -0.72 0.13 -1.55 -1.44 132.00 131.12 3ime h PRO 111 Ca 0.21 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.33 3ime h PRO 111 Cb 0.73 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3ime h PRO 111 CO 0.82 0.00 -0.10 -0.25 -0.23 0.00 0.00 178.00 178.25 3ime n ASP 112 N -2.74 2.52 -0.26 1.44 8.00 -1.26 -5.08 116.55 119.16 3ime n ASP 112 Ca -0.02 -3.29 0.00 0.00 0.71 0.00 0.00 54.79 52.20 3ime n ASP 112 Cb 0.09 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 3ime n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ime n GLY 113 N -1.19 -0.60 3.55 0.44 0.00 -0.54 -4.47 105.19 102.38 3ime n GLY 113 Ca 0.19 -1.08 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 3ime n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ime s LEU 114 N 0.00 4.02 0.00 0.99 1.43 -1.26 -4.87 118.68 119.00 3ime s LEU 114 Ca 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 3ime s LEU 114 Cb 0.00 -3.06 0.00 0.00 0.03 0.00 0.00 46.19 43.16 3ime s LEU 114 CO 0.00 -1.12 0.00 -1.14 0.23 0.00 0.00 176.35 174.32 3ime n ARG 115 N 7.30 0.00 -2.50 1.70 0.63 -1.26 -5.03 116.66 117.50 3ime n ARG 115 Ca 0.05 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.56 3ime n ARG 115 Cb 0.48 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 33.36 3ime n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 3ime s THR 116 N 0.20 4.12 0.26 5.15 2.01 -1.26 -5.04 115.64 121.09 3ime s THR 116 Ca 0.00 1.62 0.01 0.00 0.31 0.00 0.00 61.69 63.63 3ime s THR 116 Cb 0.00 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 3ime s THR 116 CO 0.00 0.18 0.09 0.42 -0.69 0.00 0.00 174.62 174.62 3ime s THR 117 N 0.62 0.60 -0.09 -0.82 -4.23 -1.26 -5.12 115.64 105.34 3ime s THR 117 Ca 0.54 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.81 3ime s THR 117 Cb -0.28 -2.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 3ime s THR 117 CO 0.31 -0.02 0.74 -0.69 -0.54 0.00 0.00 174.62 174.43 3ime s VAL 118 N -3.73 5.00 -0.46 2.29 1.01 -1.26 -5.06 120.40 118.19 3ime s VAL 118 Ca 0.37 1.51 -0.18 0.00 0.00 0.00 0.00 61.98 63.69 3ime s VAL 118 Cb 0.08 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.43 3ime s VAL 118 CO 0.13 0.19 0.50 -1.58 0.00 0.00 0.00 175.10 174.34 3ime s GLN 119 N 1.17 3.09 0.89 2.72 2.00 -1.26 -4.66 119.66 123.61 3ime s GLN 119 Ca 0.38 -0.90 -0.11 0.00 -2.00 0.00 0.00 55.36 52.73 3ime s GLN 119 Cb -0.18 -4.04 0.13 0.00 0.80 0.00 0.00 33.01 29.72 3ime s GLN 119 CO 0.17 -1.01 1.10 -2.14 -0.50 0.00 0.00 175.29 172.91 3ime s PRO 120 N 2.23 1.27 1.17 1.67 0.02 -1.26 -5.04 135.00 135.05 3ime s PRO 120 Ca 0.12 1.17 -0.18 0.00 0.02 0.00 0.00 61.00 62.13 3ime s PRO 120 Cb -0.19 -1.78 0.27 0.00 0.02 0.00 0.00 34.50 32.81 3ime s PRO 120 CO 0.12 -2.33 1.10 0.20 -0.33 0.00 0.00 177.00 175.76 3ime s GLY 121 N -3.08 1.57 0.55 0.52 0.00 -1.26 -4.88 107.32 100.75 3ime s GLY 121 Ca 0.64 -0.82 0.38 0.00 0.00 0.00 0.00 44.72 44.93 3ime s GLY 121 CO 0.58 0.01 1.76 -2.55 0.00 0.00 0.00 173.10 172.90 3ime h PRO 122 N -2.46 0.00 -0.01 2.90 0.10 -2.03 -2.17 132.00 128.33 3ime h PRO 122 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.63 3ime h PRO 122 Cb 1.30 0.00 -0.00 0.00 0.10 0.00 0.00 31.00 32.40 3ime h PRO 122 CO 0.39 0.00 0.01 1.25 0.10 0.00 0.00 178.00 179.76 3ime h LEU 123 N 0.00 0.00 -0.92 2.35 5.85 -1.96 -0.72 115.31 119.91 3ime h LEU 123 Ca 0.61 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.33 3ime h LEU 123 Cb 2.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.51 3ime h LEU 123 CO -0.01 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.09 3ime n ALA 124 N -2.38 1.44 0.52 1.25 0.00 -0.82 -2.69 120.51 117.83 3ime n ALA 124 Ca -0.03 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.65 3ime n ALA 124 Cb 0.10 -1.35 0.05 0.00 0.00 0.00 0.00 19.45 18.25 3ime n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ime n ALA 125 N -1.76 3.22 -2.04 0.00 0.00 -0.27 -4.18 120.51 115.47 3ime n ALA 125 Ca 0.01 -0.36 -0.22 0.00 0.00 0.00 0.00 53.44 52.87 3ime n ALA 125 Cb 0.16 -1.02 0.03 0.00 0.00 0.00 0.00 19.45 18.62 3ime n ALA 125 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3ime s GLU 126 N -3.21 2.64 2.44 0.00 2.02 -1.10 -2.78 118.70 118.71 3ime s GLU 126 Ca 0.04 -0.70 0.00 0.00 0.02 0.00 0.00 54.97 54.33 3ime s GLU 126 Cb 0.14 -2.49 0.00 0.00 0.10 0.00 0.00 34.13 31.88 3ime s GLU 126 CO 0.79 -0.64 0.00 1.28 0.02 0.00 0.00 175.26 176.70 3ime n LEU 127 N -2.31 0.00 0.09 1.80 4.77 -1.26 -3.27 117.00 116.81 3ime n LEU 127 Ca 0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 3ime n LEU 127 Cb 0.59 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.61 3ime n LEU 127 CO 0.46 0.00 0.10 -0.33 -1.33 0.00 0.00 177.39 176.29 3ime h GLU 128 N 0.00 0.30 0.00 3.23 4.39 -1.91 -3.18 114.58 117.42 3ime h GLU 128 Ca 0.00 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.31 3ime h GLU 128 Cb 0.00 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3ime h GLU 128 CO 0.00 1.12 0.00 0.41 -1.16 0.00 0.00 179.01 179.38 3ime n GLY 129 N 1.18 1.64 0.08 -3.84 0.00 -1.20 -2.91 105.19 100.13 3ime n GLY 129 Ca -0.07 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.46 3ime n GLY 129 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3ime h GLY 130 N 0.00 -0.10 0.83 -0.02 0.00 -1.49 -3.08 103.07 99.21 3ime h GLY 130 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.39 3ime h GLY 130 CO 0.00 -0.04 0.19 -0.56 0.00 0.00 0.00 176.54 176.14 3ime h PRO 131 N -0.37 0.38 -3.15 4.80 0.13 -1.77 -3.38 132.00 128.64 3ime h PRO 131 Ca -0.01 -0.02 -0.65 0.00 -0.87 0.00 0.00 66.00 64.45 3ime h PRO 131 Cb 0.32 -0.09 -0.40 0.00 0.13 0.00 0.00 31.00 30.97 3ime h PRO 131 CO 0.02 0.25 -0.42 1.03 -0.23 0.00 0.00 178.00 178.65 3ime s ARG 132 N -6.16 2.73 0.41 0.86 0.52 -1.15 -4.98 118.95 111.19 3ime s ARG 132 Ca -0.13 -3.34 0.24 0.00 -0.52 0.00 0.00 55.73 51.98 3ime s ARG 132 Cb 0.11 -3.60 1.32 0.00 0.52 0.00 0.00 34.95 33.31 3ime s ARG 132 CO 0.72 -1.28 1.72 -1.35 0.02 0.00 0.00 175.30 175.12 3ime h PRO 133 N 5.57 0.00 0.00 3.54 0.11 -1.73 -1.74 132.00 137.75 3ime h PRO 133 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 3ime h PRO 133 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3ime h PRO 133 CO 0.76 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.80 3ime n THR 134 N -2.40 0.18 -0.18 -1.15 -2.24 -1.26 -4.78 114.28 102.44 3ime n THR 134 Ca -0.02 -0.50 -0.02 0.00 -2.27 0.00 0.00 64.05 61.24 3ime n THR 134 Cb 0.14 1.05 0.08 0.00 -2.10 0.00 0.00 70.33 69.50 3ime n THR 134 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3ime h HIS 135 N 0.00 0.39 0.00 4.78 6.17 -1.68 -2.83 115.15 121.99 3ime h HIS 135 Ca 0.00 0.03 -0.17 0.00 0.71 0.00 0.00 60.37 60.94 3ime h HIS 135 Cb 0.19 -0.09 -0.02 0.00 2.52 0.00 0.00 27.41 30.01 3ime h HIS 135 CO 0.00 0.13 -0.83 0.74 0.71 0.00 0.00 177.93 178.68 3ime h PHE 136 N 0.42 0.00 -0.41 5.26 0.04 -1.86 -1.19 116.94 119.19 3ime h PHE 136 Ca 0.27 0.00 0.07 0.00 2.80 0.00 0.00 57.97 61.11 3ime h PHE 136 Cb 0.28 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.37 3ime h PHE 136 CO -0.15 0.80 0.03 0.00 -0.60 0.00 0.00 178.31 178.40 3ime h ALA 137 N 1.20 0.41 -0.08 2.45 0.00 -1.80 0.42 119.26 121.86 3ime h ALA 137 Ca -0.02 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3ime h ALA 137 Cb 1.63 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.57 3ime h ALA 137 CO 0.10 -0.36 0.02 0.78 0.00 0.00 0.00 179.25 179.79 3ime h GLY 138 N 0.15 0.09 0.84 0.00 0.00 -1.23 -1.74 103.07 101.17 3ime h GLY 138 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 3ime h GLY 138 CO -0.31 0.01 -0.39 -2.08 0.00 0.00 0.00 176.54 173.77 3ime h VAL 139 N 0.06 0.21 -0.70 4.60 2.07 -0.76 -2.21 116.25 119.51 3ime h VAL 139 Ca 0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 3ime h VAL 139 Cb 0.02 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 29.96 3ime h VAL 139 CO -0.04 0.00 0.46 -0.07 0.02 0.00 0.00 177.57 177.94 3ime h LEU 140 N -0.96 0.58 -0.50 2.57 3.38 -0.18 -1.37 115.31 118.83 3ime h LEU 140 Ca -0.08 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3ime h LEU 140 Cb 0.78 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3ime h LEU 140 CO 0.08 0.36 0.12 0.74 0.09 0.00 0.00 178.44 179.83 3ime h THR 141 N 0.66 1.24 -0.07 0.22 2.02 -1.10 0.13 112.91 116.01 3ime h THR 141 Ca 0.31 -0.84 -0.22 0.00 0.77 0.00 0.00 66.41 66.43 3ime h THR 141 Cb 0.37 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3ime h THR 141 CO -0.10 0.30 -0.84 1.62 0.37 0.00 0.00 175.52 176.87 3ime h VAL 142 N 0.68 1.34 -0.50 3.16 3.04 -0.86 -2.84 116.25 120.28 3ime h VAL 142 Ca 0.16 -2.19 -0.06 0.00 -1.01 0.00 0.00 66.70 63.60 3ime h VAL 142 Cb 0.33 2.19 -0.02 0.00 -2.01 0.00 0.00 31.29 31.78 3ime h VAL 142 CO 0.00 0.67 0.08 0.58 -1.01 0.00 0.00 177.57 177.90 3ime h VAL 143 N 0.35 1.25 -0.77 1.51 2.07 -1.16 -1.58 116.25 117.91 3ime h VAL 143 Ca -0.06 -0.92 0.14 0.00 0.82 0.00 0.00 66.70 66.67 3ime h VAL 143 Cb 1.45 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 32.01 3ime h VAL 143 CO 0.15 0.33 0.35 0.25 0.02 0.00 0.00 177.57 178.67 3ime h LEU 144 N 0.70 0.37 -0.35 2.57 5.85 -0.64 -1.81 115.31 122.00 3ime h LEU 144 Ca 0.15 0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.83 3ime h LEU 144 Cb 0.39 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 3ime h LEU 144 CO 0.01 0.16 -0.31 0.11 -0.34 0.00 0.00 178.44 178.07 3ime h LYS 145 N 0.51 0.84 -0.59 1.25 1.57 -1.24 -1.90 116.57 117.01 3ime h LYS 145 Ca 0.42 -0.43 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 3ime h LYS 145 Cb 0.60 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 3ime h LYS 145 CO -0.37 1.06 0.02 -0.07 -0.57 0.00 0.00 179.45 179.52 3ime h LEU 146 N 0.63 1.00 -1.56 2.94 3.38 -1.07 0.44 115.31 121.07 3ime h LEU 146 Ca 0.06 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.75 3ime h LEU 146 Cb 0.89 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 3ime h LEU 146 CO 0.08 1.05 0.32 -0.07 0.09 0.00 0.00 178.44 179.91 3ime h LEU 147 N 0.92 0.51 0.09 1.67 3.38 -1.06 0.09 115.31 120.91 3ime h LEU 147 Ca 0.17 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 3ime h LEU 147 Cb 0.52 -0.12 0.02 0.00 0.09 0.00 0.00 40.66 41.17 3ime h LEU 147 CO 0.03 0.36 -0.66 1.56 0.09 0.00 0.00 178.44 179.82 3ime h GLN 148 N 0.60 0.29 0.39 1.13 1.08 -0.55 0.13 115.11 118.19 3ime h GLN 148 Ca 0.18 -0.43 -0.00 0.00 -1.45 0.00 0.00 58.65 56.95 3ime h GLN 148 Cb -0.00 0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 3ime h GLN 148 CO -0.04 1.17 -0.42 0.82 -0.95 0.00 0.00 178.83 179.41 3ime h ILE 149 N -0.38 0.16 0.03 2.54 2.04 -0.84 -3.34 117.51 117.73 3ime h ILE 149 Ca -0.11 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.48 3ime h ILE 149 Cb 1.48 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 3ime h ILE 149 CO 0.13 0.00 -1.44 0.58 0.00 0.00 0.00 178.15 177.42 3ime h VAL 150 N -0.83 1.20 -6.47 1.67 2.07 -1.06 -3.36 116.25 109.46 3ime h VAL 150 Ca -0.03 -2.95 -0.40 0.00 0.82 0.00 0.00 66.70 64.13 3ime h VAL 150 Cb 0.75 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.17 3ime h VAL 150 CO -0.08 0.74 -0.88 0.54 0.02 0.00 0.00 177.57 177.92 3ime n ARG 151 N -3.26 -1.38 -2.16 1.57 1.74 0.46 -4.76 116.66 108.86 3ime n ARG 151 Ca -0.12 0.82 -0.29 0.00 -0.77 0.00 0.00 57.85 57.49 3ime n ARG 151 Cb 1.01 -3.07 0.02 0.00 -1.02 0.00 0.00 32.46 29.41 3ime n ARG 151 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3ime s PRO 152 N -4.85 3.25 0.20 5.56 0.04 -1.26 -4.91 135.00 133.03 3ime s PRO 152 Ca 0.07 0.39 -0.02 0.00 0.04 0.00 0.00 61.00 61.47 3ime s PRO 152 Cb -0.03 -2.17 0.14 0.00 0.04 0.00 0.00 34.50 32.47 3ime s PRO 152 CO 0.87 -0.64 1.52 -0.44 0.04 0.00 0.00 177.00 178.36 3ime h ASP 153 N -0.25 0.59 -4.66 6.66 3.32 -0.87 -3.44 116.42 117.77 3ime h ASP 153 Ca -0.45 -0.31 -0.18 0.00 0.02 0.00 0.00 57.03 56.12 3ime h ASP 153 Cb 1.22 -0.17 -0.23 0.00 0.22 0.00 0.00 39.33 40.38 3ime h ASP 153 CO 0.62 1.01 -0.64 -0.13 -1.72 0.00 0.00 179.24 178.38 3ime s ARG 154 N -4.02 0.29 -0.04 3.56 0.52 -1.16 -1.96 118.95 116.14 3ime s ARG 154 Ca -0.07 -0.38 0.03 0.00 -0.52 0.00 0.00 55.73 54.79 3ime s ARG 154 Cb 0.11 0.11 0.00 0.00 0.52 0.00 0.00 34.95 35.70 3ime s ARG 154 CO 0.83 -0.05 -0.13 0.54 0.02 0.00 0.00 175.30 176.51 3ime s VAL 155 N -1.06 1.12 -0.19 3.52 0.11 -0.17 -0.52 120.40 123.22 3ime s VAL 155 Ca -0.12 -0.53 -0.04 0.00 -2.93 0.00 0.00 61.98 58.37 3ime s VAL 155 Cb -0.07 -0.99 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 3ime s VAL 155 CO -0.00 0.34 -0.04 -0.36 -3.33 0.00 0.00 175.10 171.71 3ime s PHE 156 N 0.23 2.97 0.01 1.54 0.40 -0.39 0.87 117.98 123.61 3ime s PHE 156 Ca -0.06 -0.63 0.03 0.00 -0.60 0.00 0.00 56.93 55.67 3ime s PHE 156 Cb -0.11 -2.04 -0.01 0.00 0.51 0.00 0.00 43.02 41.37 3ime s PHE 156 CO 0.02 -0.31 -0.09 -0.06 0.70 0.00 0.00 175.22 175.48 3ime s PHE 157 N 0.98 0.76 0.45 0.36 0.08 0.95 -4.38 117.98 117.18 3ime s PHE 157 Ca 0.00 -0.24 -0.21 0.00 0.12 0.00 0.00 56.93 56.61 3ime s PHE 157 Cb -0.15 -0.48 -0.10 0.00 -0.57 0.00 0.00 43.02 41.73 3ime s PHE 157 CO 0.01 -0.02 0.98 0.20 -0.10 0.00 0.00 175.22 176.30 3ime s GLY 158 N -0.61 2.43 0.37 4.36 0.00 -1.26 -0.46 107.32 112.14 3ime s GLY 158 Ca 0.00 0.47 0.21 0.00 0.00 0.00 0.00 44.72 45.40 3ime s GLY 158 CO 0.00 0.77 1.50 0.83 0.00 0.00 0.00 173.10 176.19 3ime h GLU 159 N 1.75 0.00 -0.98 2.90 5.08 -1.53 -3.25 114.58 118.55 3ime h GLU 159 Ca -0.49 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.03 3ime h GLU 159 Cb 1.20 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.28 3ime h GLU 159 CO 0.60 0.14 -0.35 1.17 -1.00 0.00 0.00 179.01 179.57 3ime n LYS 160 N -3.09 -0.19 -2.79 2.33 4.81 -1.26 -1.76 118.16 116.21 3ime n LYS 160 Ca 0.03 1.52 -0.43 0.00 -0.87 0.00 0.00 58.31 58.55 3ime n LYS 160 Cb 0.59 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.39 3ime n LYS 160 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3ime n ASP 161 N -5.49 5.36 -0.02 3.14 8.00 -1.23 -4.71 116.55 121.60 3ime n ASP 161 Ca 0.12 -3.09 -0.16 0.00 0.71 0.00 0.00 54.79 52.37 3ime n ASP 161 Cb 0.42 -1.48 -0.09 0.00 -0.02 0.00 0.00 41.12 39.95 3ime n ASP 161 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3ime h TYR 162 N 6.38 0.58 -0.62 1.24 3.20 -1.57 -2.34 116.97 123.84 3ime h TYR 162 Ca 0.31 -0.27 0.11 0.00 3.14 0.00 0.00 58.73 62.02 3ime h TYR 162 Cb 0.76 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 38.86 3ime h TYR 162 CO 1.10 1.04 0.20 0.37 -1.64 0.00 0.00 178.16 179.22 3ime h GLN 163 N -0.05 0.34 -0.06 1.82 4.15 -1.89 -1.12 115.11 118.30 3ime h GLN 163 Ca -0.04 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.40 3ime h GLN 163 Cb 1.11 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.68 3ime h GLN 163 CO 0.09 0.23 -0.23 0.37 -1.93 0.00 0.00 178.83 177.36 3ime h GLN 164 N 0.35 -0.32 -0.72 1.69 4.15 -1.94 -1.68 115.11 116.64 3ime h GLN 164 Ca 0.32 0.02 0.11 0.00 0.77 0.00 0.00 58.65 59.88 3ime h GLN 164 Cb 0.44 0.07 -0.08 0.00 0.21 0.00 0.00 27.48 28.12 3ime h GLN 164 CO -0.35 -0.21 0.32 1.25 -1.93 0.00 0.00 178.83 177.90 3ime h LEU 165 N -0.33 0.36 -0.44 -2.39 5.85 -1.01 -1.04 115.31 116.31 3ime h LEU 165 Ca 0.08 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.89 3ime h LEU 165 Cb 0.44 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 3ime h LEU 165 CO -0.25 0.18 0.29 0.58 -0.34 0.00 0.00 178.44 178.90 3ime h VAL 166 N 0.51 1.11 -0.35 1.05 2.07 -1.01 -0.49 116.25 119.14 3ime h VAL 166 Ca 0.37 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.58 3ime h VAL 166 Cb 0.48 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3ime h VAL 166 CO -0.33 0.11 -0.23 -0.07 0.02 0.00 0.00 177.57 177.07 3ime h LEU 167 N 0.59 0.70 -0.75 2.57 3.38 -0.84 -1.47 115.31 119.50 3ime h LEU 167 Ca 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3ime h LEU 167 Cb -0.06 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 3ime h LEU 167 CO -0.04 0.92 0.41 0.40 0.09 0.00 0.00 178.44 180.22 3ime h ILE 168 N 0.61 1.23 -0.62 1.22 1.08 -0.98 0.48 117.51 120.53 3ime h ILE 168 Ca 0.08 -0.56 -0.03 0.00 -0.39 0.00 0.00 64.86 63.97 3ime h ILE 168 Cb 0.72 0.23 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 3ime h ILE 168 CO 0.06 0.25 0.28 0.03 -0.69 0.00 0.00 178.15 178.07 3ime h ARG 169 N 1.03 0.89 -0.28 2.37 3.08 -0.71 -1.27 114.38 119.49 3ime h ARG 169 Ca 0.26 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 3ime h ARG 169 Cb 0.03 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3ime h ARG 169 CO -0.04 0.71 0.03 1.96 -1.07 0.00 0.00 179.97 181.55 3ime h GLN 170 N 0.89 0.48 -0.44 0.04 4.20 -1.02 -2.11 115.11 117.15 3ime h GLN 170 Ca 0.21 -0.14 0.07 0.00 0.06 0.00 0.00 58.65 58.86 3ime h GLN 170 Cb 0.13 -0.05 -0.09 0.00 0.30 0.00 0.00 27.48 27.77 3ime h GLN 170 CO -0.02 0.61 -0.41 1.25 -0.67 0.00 0.00 178.83 179.58 3ime h LEU 171 N 0.28 -1.38 -0.23 1.46 5.85 -0.57 -0.67 115.31 120.06 3ime h LEU 171 Ca 0.08 0.22 0.02 0.00 0.84 0.00 0.00 57.88 59.04 3ime h LEU 171 Cb 0.37 0.61 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3ime h LEU 171 CO 0.01 -0.35 0.09 0.58 -0.34 0.00 0.00 178.44 178.42 3ime h VAL 172 N -0.30 0.96 -0.33 1.05 2.07 -1.16 0.45 116.25 118.99 3ime h VAL 172 Ca 0.15 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 3ime h VAL 172 Cb 0.57 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 3ime h VAL 172 CO -0.59 0.04 0.19 0.00 0.02 0.00 0.00 177.57 177.23 3ime h ALA 173 N 1.14 0.42 0.01 1.67 0.00 -1.31 0.92 119.26 122.10 3ime h ALA 173 Ca 0.10 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.72 3ime h ALA 173 Cb 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3ime h ALA 173 CO -0.09 -0.07 -0.95 -0.44 0.00 0.00 0.00 179.25 177.70 3ime h ASP 174 N 0.42 0.52 -0.42 0.00 3.32 -0.71 -3.05 116.42 116.50 3ime h ASP 174 Ca 0.12 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.75 3ime h ASP 174 Cb 0.03 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3ime h ASP 174 CO -0.02 1.22 0.00 0.49 -1.72 0.00 0.00 179.24 179.21 3ime n PHE 175 N -3.73 0.55 -2.76 4.55 3.72 0.11 -4.97 117.46 114.94 3ime n PHE 175 Ca -0.07 -0.28 -0.20 0.00 -0.05 0.00 0.00 57.45 56.86 3ime n PHE 175 Cb 0.84 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.40 3ime n PHE 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ime n ASN 176 N 1.22 -5.72 -4.77 4.37 4.13 -0.89 -4.96 115.26 108.65 3ime n ASN 176 Ca 0.19 -0.18 -0.41 0.00 1.68 0.00 0.00 54.58 55.86 3ime n ASN 176 Cb 0.53 -4.62 -0.02 0.00 -1.54 0.00 0.00 39.78 34.13 3ime n ASN 176 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ime s LEU 177 N -5.98 4.43 -1.15 3.41 1.43 0.27 -4.94 118.68 116.14 3ime s LEU 177 Ca 0.18 2.67 -0.07 0.00 -1.03 0.00 0.00 54.13 55.89 3ime s LEU 177 Cb -0.08 -3.65 0.26 0.00 0.03 0.00 0.00 46.19 42.75 3ime s LEU 177 CO 0.23 -0.54 1.52 -0.67 0.23 0.00 0.00 176.35 177.12 3ime n ASP 178 N 0.94 5.85 -3.63 2.29 2.03 -1.26 -4.83 116.55 117.93 3ime n ASP 178 Ca 0.00 -3.24 -0.11 0.00 0.52 0.00 0.00 54.79 51.96 3ime n ASP 178 Cb 0.42 -1.37 -0.07 0.00 -0.72 0.00 0.00 41.12 39.38 3ime n ASP 178 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3ime s VAL 179 N -1.40 0.00 -0.06 5.18 0.11 -1.26 -4.81 120.40 118.16 3ime s VAL 179 Ca 0.34 0.00 -0.23 0.00 -2.93 0.00 0.00 61.98 59.16 3ime s VAL 179 Cb 0.03 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 3ime s VAL 179 CO 0.04 0.00 0.69 0.00 -3.33 0.00 0.00 175.10 172.50 3ime s ALA 180 N 0.52 3.35 -0.18 1.54 0.00 -0.83 -4.98 121.76 121.18 3ime s ALA 180 Ca -0.01 0.13 -0.23 0.00 0.00 0.00 0.00 51.96 51.86 3ime s ALA 180 Cb -0.05 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 3ime s ALA 180 CO -0.04 -0.07 0.72 0.08 0.00 0.00 0.00 175.76 176.44 3ime s VAL 181 N 0.68 4.96 -0.19 0.00 1.01 -1.26 -1.00 120.40 124.61 3ime s VAL 181 Ca 0.37 1.39 -0.01 0.00 0.00 0.00 0.00 61.98 63.73 3ime s VAL 181 Cb -0.18 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3ime s VAL 181 CO 0.18 0.09 -0.13 -0.69 0.00 0.00 0.00 175.10 174.55 3ime s VAL 182 N 1.92 2.72 -0.27 2.92 1.01 0.25 -4.94 120.40 124.01 3ime s VAL 182 Ca 0.33 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.47 3ime s VAL 182 Cb -0.16 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 3ime s VAL 182 CO 0.12 0.49 0.21 -0.83 0.00 0.00 0.00 175.10 175.09 3ime s GLY 183 N 1.19 1.93 -0.19 4.51 0.00 -1.26 -0.03 107.32 113.48 3ime s GLY 183 Ca 0.02 -1.02 -0.05 0.00 0.00 0.00 0.00 44.72 43.67 3ime s GLY 183 CO -0.05 0.66 0.00 0.14 0.00 0.00 0.00 173.10 173.84 3ime s VAL 184 N 1.69 4.04 0.55 1.40 1.01 0.39 -4.89 120.40 124.60 3ime s VAL 184 Ca 0.08 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 3ime s VAL 184 Cb -0.16 -2.82 -0.10 0.00 0.00 0.00 0.00 36.38 33.31 3ime s VAL 184 CO 0.10 0.44 0.44 -2.65 0.00 0.00 0.00 175.10 173.43 3ime n PRO 185 N 4.01 0.45 -1.68 2.72 -0.02 -1.26 -1.45 135.00 137.76 3ime n PRO 185 Ca -0.17 0.17 -0.43 0.00 -2.02 0.00 0.00 63.50 61.05 3ime n PRO 185 Cb 0.52 -1.60 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 3ime n PRO 185 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3ime n THR 186 N -1.63 0.44 -2.47 3.45 -1.04 -1.26 -4.68 114.28 107.09 3ime n THR 186 Ca 0.11 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.05 61.62 3ime n THR 186 Cb 0.47 -2.08 -0.03 0.00 -1.82 0.00 0.00 70.33 66.87 3ime n THR 186 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3ime s VAL 187 N 3.10 4.13 0.17 12.58 1.01 -1.26 -5.01 120.40 135.11 3ime s VAL 187 Ca 0.85 1.55 0.10 0.00 0.00 0.00 0.00 61.98 64.48 3ime s VAL 187 Cb -0.52 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 3ime s VAL 187 CO 0.40 0.13 -0.23 -0.13 0.00 0.00 0.00 175.10 175.28 3ime s ARG 188 N 0.92 1.40 1.20 2.72 0.52 -1.26 -1.39 118.95 123.06 3ime s ARG 188 Ca 0.57 -1.43 -0.17 0.00 -0.52 0.00 0.00 55.73 54.18 3ime s ARG 188 Cb -0.28 -1.70 0.28 0.00 0.52 0.00 0.00 34.95 33.77 3ime s ARG 188 CO 0.30 0.37 1.05 -1.21 0.02 0.00 0.00 175.30 175.83 3ime s GLU 189 N -2.49 -1.16 0.45 3.54 0.41 -0.40 -4.85 118.70 114.19 3ime s GLU 189 Ca 0.17 0.32 0.16 0.00 -0.41 0.00 0.00 54.97 55.21 3ime s GLU 189 Cb -0.08 -1.57 1.05 0.00 -1.78 0.00 0.00 34.13 31.75 3ime s GLU 189 CO 0.08 -3.75 1.99 0.00 -0.49 0.00 0.00 175.26 173.08 3ime h ALA 190 N -2.62 1.59 -0.17 5.21 0.00 -2.01 -1.34 119.26 119.93 3ime h ALA 190 Ca -0.51 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.22 3ime h ALA 190 Cb 1.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3ime h ALA 190 CO 0.43 0.24 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 3ime n ASP 191 N -4.18 1.91 0.00 0.00 5.75 -1.26 -4.95 116.55 113.81 3ime n ASP 191 Ca -0.02 -1.73 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 3ime n ASP 191 Cb 0.26 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.25 3ime n ASP 191 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3ime n GLY 192 N 1.19 1.77 3.68 6.12 0.00 -0.50 -4.86 105.19 112.58 3ime n GLY 192 Ca 0.17 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.69 3ime n GLY 192 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3ime n LEU 193 N 0.00 3.08 -4.69 0.99 7.94 -1.26 -4.61 117.00 118.45 3ime n LEU 193 Ca 0.00 1.02 -0.42 0.00 -1.11 0.00 0.00 56.01 55.50 3ime n LEU 193 Cb 0.00 -1.34 -0.03 0.00 0.53 0.00 0.00 43.42 42.58 3ime n LEU 193 CO 0.00 -0.24 1.45 0.00 -1.11 0.00 0.00 177.39 177.49 3ime s ALA 194 N 3.01 3.75 0.43 1.96 0.00 -1.26 -1.28 121.76 128.37 3ime s ALA 194 Ca 0.90 1.40 -0.26 0.00 0.00 0.00 0.00 51.96 54.00 3ime s ALA 194 Cb -0.77 -3.75 -0.09 0.00 0.00 0.00 0.00 23.12 18.51 3ime s ALA 194 CO 0.50 -1.21 1.46 -1.64 0.00 0.00 0.00 175.76 174.87 3ime s MET 195 N 2.77 3.80 -0.20 0.00 -1.94 -0.48 -4.89 119.30 118.37 3ime s MET 195 Ca 0.80 2.49 -0.30 0.00 -1.71 0.00 0.00 55.69 56.96 3ime s MET 195 Cb -0.45 -2.75 0.15 0.00 2.01 0.00 0.00 34.83 33.79 3ime s MET 195 CO 0.36 -0.75 1.13 0.45 -0.01 0.00 0.00 175.02 176.20 3ime s SER 196 N -0.37 -0.24 0.45 3.03 0.15 -1.26 -4.97 113.70 110.48 3ime s SER 196 Ca 0.59 0.23 0.24 0.00 0.70 0.00 0.00 55.95 57.71 3ime s SER 196 Cb -0.45 0.20 0.96 0.00 -1.71 0.00 0.00 66.02 65.02 3ime s SER 196 CO 0.59 -0.25 1.84 0.77 1.20 0.00 0.00 173.24 177.40 3ime h SER 197 N 2.32 0.00 0.26 5.45 4.64 -1.94 -2.75 113.55 121.53 3ime h SER 197 Ca -0.14 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.13 3ime h SER 197 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 3ime h SER 197 CO 0.27 0.22 -0.21 0.03 -0.87 0.00 0.00 176.83 176.27 3ime h ARG 198 N 0.00 0.00 -0.15 4.77 3.08 -1.97 -3.23 114.38 116.88 3ime h ARG 198 Ca -0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 3ime h ARG 198 Cb 0.72 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.76 3ime h ARG 198 CO 0.03 0.21 0.43 -0.91 -1.07 0.00 0.00 179.97 178.67 3ime h ASN 199 N 0.00 0.00 1.45 7.04 2.35 -1.86 0.13 115.58 124.68 3ime h ASN 199 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3ime h ASN 199 Cb 0.40 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 3ime h ASN 199 CO 0.03 0.00 -0.15 0.08 -1.65 0.00 0.00 177.43 175.74 3ime h ARG 200 N 0.00 0.00 0.00 0.81 0.11 -1.79 -2.85 114.38 110.66 3ime h ARG 200 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 3ime h ARG 200 Cb 0.94 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.02 3ime h ARG 200 CO -0.00 0.15 0.00 1.88 0.10 0.00 0.00 179.97 182.10 3ime h TYR 201 N 0.00 0.00 -3.05 4.08 0.05 -0.98 -3.46 116.97 113.61 3ime h TYR 201 Ca -0.00 0.00 -0.55 0.00 0.05 0.00 0.00 58.73 58.23 3ime h TYR 201 Cb 0.92 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.64 3ime h TYR 201 CO 0.00 0.00 0.72 -0.51 -1.05 0.00 0.00 178.16 177.32 3ime s LEU 202 N -5.49 4.30 1.33 3.88 1.43 -1.08 -5.01 118.68 118.03 3ime s LEU 202 Ca 0.03 1.91 -0.22 0.00 -1.03 0.00 0.00 54.13 54.82 3ime s LEU 202 Cb 0.09 -3.56 0.33 0.00 0.03 0.00 0.00 46.19 43.08 3ime s LEU 202 CO 0.50 -0.61 1.03 1.51 0.23 0.00 0.00 176.35 179.01 3ime s ASP 203 N 1.54 -0.19 0.31 2.29 1.47 -1.26 -4.64 116.67 116.19 3ime s ASP 203 Ca 0.58 0.66 0.14 0.00 1.18 0.00 0.00 52.55 55.10 3ime s ASP 203 Cb -0.27 -0.89 0.49 0.00 -0.34 0.00 0.00 42.92 41.91 3ime s ASP 203 CO 0.24 -4.81 1.66 -0.65 0.68 0.00 0.00 175.17 172.29 3ime h PRO 204 N -3.05 0.00 -0.14 2.11 0.11 -1.99 -1.72 132.00 127.33 3ime h PRO 204 Ca -0.43 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.60 3ime h PRO 204 Cb 1.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.42 3ime h PRO 204 CO 0.28 0.52 -0.23 0.00 -0.21 0.00 0.00 178.00 178.36 3ime h ALA 205 N 1.48 0.21 -0.22 -0.75 0.00 -1.99 -2.03 119.26 115.97 3ime h ALA 205 Ca -0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 3ime h ALA 205 Cb 1.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3ime h ALA 205 CO 0.07 0.18 -0.06 1.96 0.00 0.00 0.00 179.25 181.40 3ime h GLN 206 N 0.00 0.33 0.04 0.00 4.20 -1.88 -0.98 115.11 116.83 3ime h GLN 206 Ca 0.01 -0.07 -0.25 0.00 0.06 0.00 0.00 58.65 58.41 3ime h GLN 206 Cb 0.81 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.55 3ime h GLN 206 CO 0.05 0.41 -1.04 -0.09 -0.67 0.00 0.00 178.83 177.49 3ime h ARG 207 N 0.32 0.43 -0.60 1.46 9.65 -1.21 -0.39 114.38 124.04 3ime h ARG 207 Ca 0.07 -0.51 -0.06 0.00 -1.10 0.00 0.00 59.98 58.37 3ime h ARG 207 Cb 0.32 0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.03 3ime h ARG 207 CO 0.01 1.17 0.12 0.00 2.80 0.00 0.00 179.97 184.08 3ime h ALA 208 N 0.64 0.79 0.00 2.80 0.00 -1.12 -3.16 119.26 119.20 3ime h ALA 208 Ca -0.11 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.46 3ime h ALA 208 Cb 1.70 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 3ime h ALA 208 CO 0.18 0.52 -0.47 0.00 0.00 0.00 0.00 179.25 179.48 3ime h ALA 209 N 1.02 0.78 0.00 0.00 0.00 -0.93 -3.24 119.26 116.89 3ime h ALA 209 Ca 0.18 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 3ime h ALA 209 Cb 0.39 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3ime h ALA 209 CO 0.01 0.59 -0.08 0.00 0.00 0.00 0.00 179.25 179.76 3ime h ALA 210 N 1.53 1.66 -0.14 0.00 0.00 -1.03 -2.20 119.26 119.07 3ime h ALA 210 Ca -0.00 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.87 3ime h ALA 210 Cb 1.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3ime h ALA 210 CO 0.06 0.10 0.36 -0.24 0.00 0.00 0.00 179.25 179.54 3ime h VAL 211 N 0.00 0.15 0.00 0.00 3.04 -1.64 -2.69 116.25 115.11 3ime h VAL 211 Ca -0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.65 3ime h VAL 211 Cb 0.17 0.67 -0.01 0.00 -2.01 0.00 0.00 31.29 30.11 3ime h VAL 211 CO 0.01 0.00 -0.20 0.00 -1.01 0.00 0.00 177.57 176.37 3ime h ALA 212 N 1.41 1.25 0.28 3.17 0.00 -1.65 -1.46 119.26 122.26 3ime h ALA 212 Ca 0.07 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3ime h ALA 212 Cb 0.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3ime h ALA 212 CO -0.00 0.25 -0.14 -0.07 0.00 0.00 0.00 179.25 179.29 3ime h LEU 213 N 0.00 -0.32 -0.62 0.00 4.07 -1.71 0.16 115.31 116.88 3ime h LEU 213 Ca -0.00 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.73 3ime h LEU 213 Cb 0.50 0.08 -0.03 0.00 1.08 0.00 0.00 40.66 42.30 3ime h LEU 213 CO 0.03 0.04 0.23 0.77 -1.08 0.00 0.00 178.44 178.42 3ime h SER 214 N -0.72 0.88 -0.59 -0.43 4.64 -1.76 -2.66 113.55 112.90 3ime h SER 214 Ca -0.04 -0.18 0.10 0.00 -0.47 0.00 0.00 61.79 61.20 3ime h SER 214 Cb 0.49 -0.23 -0.08 0.00 -0.31 0.00 0.00 62.40 62.27 3ime h SER 214 CO 0.06 0.82 0.17 0.00 -0.87 0.00 0.00 176.83 177.02 3ime h ALA 215 N 1.09 0.74 -0.10 5.18 0.00 -1.30 -1.02 119.26 123.84 3ime h ALA 215 Ca 0.20 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 3ime h ALA 215 Cb 0.24 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3ime h ALA 215 CO -0.01 -0.25 -0.33 0.00 0.00 0.00 0.00 179.25 178.66 3ime h ALA 216 N 1.44 1.27 0.17 0.00 0.00 -0.85 -1.25 119.26 120.04 3ime h ALA 216 Ca 0.31 -0.34 -0.30 0.00 0.00 0.00 0.00 54.91 54.58 3ime h ALA 216 Cb 0.42 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.14 3ime h ALA 216 CO -0.35 0.50 -1.34 -0.07 0.00 0.00 0.00 179.25 177.99 3ime h LEU 217 N 0.17 0.56 0.05 0.00 3.38 -0.99 -2.23 115.31 116.24 3ime h LEU 217 Ca 0.02 -0.61 -0.28 0.00 0.09 0.00 0.00 57.88 57.10 3ime h LEU 217 Cb 0.67 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 41.25 3ime h LEU 217 CO 0.05 1.48 -1.17 0.71 0.09 0.00 0.00 178.44 179.60 3ime h THR 218 N 0.10 1.33 -0.35 0.22 1.35 -1.19 -1.02 112.91 113.35 3ime h THR 218 Ca -0.18 -2.50 0.08 0.00 -0.55 0.00 0.00 66.41 63.25 3ime h THR 218 Cb 2.04 2.63 -0.08 0.00 -1.73 0.00 0.00 68.15 71.02 3ime h THR 218 CO 0.22 0.76 -0.21 0.00 -0.25 0.00 0.00 175.52 176.04 3ime h ALA 219 N 0.42 0.03 -0.23 6.62 0.00 -1.31 -2.52 119.26 122.27 3ime h ALA 219 Ca -0.16 0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3ime h ALA 219 Cb 1.84 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 20.08 3ime h ALA 219 CO 0.22 -0.59 0.08 0.00 0.00 0.00 0.00 179.25 178.96 3ime h ALA 220 N 1.05 0.26 -0.74 0.00 0.00 -1.26 -0.02 119.26 118.55 3ime h ALA 220 Ca 0.18 0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.28 3ime h ALA 220 Cb 0.43 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3ime h ALA 220 CO -0.45 -0.34 0.50 0.00 0.00 0.00 0.00 179.25 178.97 3ime h ALA 221 N 1.14 2.27 0.00 0.00 0.00 -1.02 -1.84 119.26 119.82 3ime h ALA 221 Ca 0.10 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 3ime h ALA 221 Cb 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3ime h ALA 221 CO -0.10 -0.48 -1.37 0.45 0.00 0.00 0.00 179.25 177.75 3ime h HIS 222 N 0.29 0.00 0.00 0.00 3.86 -0.96 -3.28 115.15 115.06 3ime h HIS 222 Ca 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 3ime h HIS 222 Cb 1.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.47 3ime h HIS 222 CO -0.00 0.61 0.00 0.00 0.86 0.00 0.00 177.93 179.40 3ime n ALA 223 N -2.39 2.13 0.41 2.45 0.00 -0.08 -4.12 120.51 118.91 3ime n ALA 223 Ca -0.09 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.40 3ime n ALA 223 Cb 0.85 -1.40 0.44 0.00 0.00 0.00 0.00 19.45 19.34 3ime n ALA 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ime h ALA 224 N 2.86 1.00 -0.68 0.00 0.00 -1.43 -2.52 119.26 118.49 3ime h ALA 224 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.05 3ime h ALA 224 Cb 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3ime h ALA 224 CO 0.00 0.00 0.46 1.79 0.00 0.00 0.00 179.25 181.50 3ime h THR 225 N 0.00 0.80 0.00 0.00 1.35 -1.70 0.24 112.91 113.61 3ime h THR 225 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3ime h THR 225 Cb 0.64 0.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 3ime h THR 225 CO 0.00 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.33 3ime n ALA 226 N -2.54 2.60 0.00 6.62 0.00 -0.95 -4.48 120.51 121.76 3ime n ALA 226 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3ime n ALA 226 Cb 0.51 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3ime n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ime n GLY 227 N 0.79 0.29 0.22 0.00 0.00 0.81 -4.61 105.19 102.68 3ime n GLY 227 Ca 0.15 -1.95 -0.08 0.00 0.00 0.00 0.00 46.02 44.14 3ime n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ime h ALA 228 N 0.00 0.80 -0.42 4.61 0.00 -1.91 -2.22 119.26 120.13 3ime h ALA 228 Ca 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 54.91 54.36 3ime h ALA 228 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3ime h ALA 228 CO 0.00 0.66 -0.06 0.37 0.00 0.00 0.00 179.25 180.22 3ime h GLN 229 N 0.43 0.78 -0.79 0.00 5.75 -1.97 -1.98 115.11 117.33 3ime h GLN 229 Ca 0.03 -0.28 -0.00 0.00 -0.15 0.00 0.00 58.65 58.24 3ime h GLN 229 Cb 0.98 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.44 3ime h GLN 229 CO 0.09 0.89 0.49 0.00 -2.65 0.00 0.00 178.83 177.64 3ime h ALA 230 N 0.87 1.00 0.20 3.38 0.00 -1.75 0.85 119.26 123.82 3ime h ALA 230 Ca 0.11 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3ime h ALA 230 Cb 0.57 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3ime h ALA 230 CO 0.03 0.46 -0.22 0.00 0.00 0.00 0.00 179.25 179.52 3ime h ALA 231 N 1.26 -0.44 -0.65 0.00 0.00 -1.35 -0.78 119.26 117.30 3ime h ALA 231 Ca 0.28 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.16 3ime h ALA 231 Cb -0.06 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3ime h ALA 231 CO -0.06 -0.78 0.41 -0.07 0.00 0.00 0.00 179.25 178.76 3ime h LEU 232 N -0.46 0.67 -0.78 0.00 3.38 -1.06 -1.51 115.31 115.55 3ime h LEU 232 Ca 0.00 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3ime h LEU 232 Cb 0.44 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3ime h LEU 232 CO -0.06 0.47 -0.36 0.44 0.09 0.00 0.00 178.44 179.01 3ime h ASP 233 N 0.80 0.53 -0.33 -0.43 5.19 -0.80 -1.28 116.42 120.10 3ime h ASP 233 Ca 0.26 -0.22 -0.10 0.00 -0.62 0.00 0.00 57.03 56.36 3ime h ASP 233 Cb 0.01 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.37 3ime h ASP 233 CO -0.10 0.84 -0.18 0.00 -3.12 0.00 0.00 179.24 176.69 3ime h ALA 234 N 1.19 0.47 -0.58 3.45 0.00 -0.85 -1.53 119.26 121.42 3ime h ALA 234 Ca 0.05 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.64 3ime h ALA 234 Cb 0.83 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3ime h ALA 234 CO 0.07 0.40 0.34 0.00 0.00 0.00 0.00 179.25 180.06 3ime h ALA 235 N 0.77 0.75 -0.32 0.00 0.00 -1.15 -2.61 119.26 116.70 3ime h ALA 235 Ca 0.07 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3ime h ALA 235 Cb 0.72 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3ime h ALA 235 CO 0.05 0.05 -0.27 -0.09 0.00 0.00 0.00 179.25 178.99 3ime h ARG 236 N 0.67 0.64 -0.54 0.00 9.65 -1.11 -2.30 114.38 121.39 3ime h ARG 236 Ca 0.24 -0.27 0.01 0.00 -1.10 0.00 0.00 59.98 58.86 3ime h ARG 236 Cb 0.05 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.58 3ime h ARG 236 CO -0.11 0.85 0.35 0.00 2.80 0.00 0.00 179.97 183.86 3ime h ALA 237 N 1.14 0.69 -0.22 2.80 0.00 -1.13 0.49 119.26 123.03 3ime h ALA 237 Ca 0.07 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3ime h ALA 237 Cb 0.76 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3ime h ALA 237 CO 0.06 0.10 0.05 0.28 0.00 0.00 0.00 179.25 179.74 3ime h VAL 238 N 0.71 1.21 -0.57 0.00 2.07 -1.24 -2.69 116.25 115.75 3ime h VAL 238 Ca 0.20 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 67.06 3ime h VAL 238 Cb -0.05 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 3ime h VAL 238 CO -0.06 0.22 0.33 -0.07 0.02 0.00 0.00 177.57 178.01 3ime h LEU 239 N 0.18 0.51 -2.05 2.57 3.38 -1.28 -2.42 115.31 116.20 3ime h LEU 239 Ca 0.07 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.07 3ime h LEU 239 Cb 0.29 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3ime h LEU 239 CO 0.00 0.35 0.33 0.44 0.09 0.00 0.00 178.44 179.65 3ime h ASP 240 N 0.64 0.00 -0.20 -0.43 3.32 -0.72 -0.80 116.42 118.23 3ime h ASP 240 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 3ime h ASP 240 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3ime h ASP 240 CO -0.12 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.40 3ime n ALA 241 N -1.98 2.48 -2.94 3.45 0.00 -0.91 -4.87 120.51 115.74 3ime n ALA 241 Ca -0.00 -0.70 -0.34 0.00 0.00 0.00 0.00 53.44 52.40 3ime n ALA 241 Cb 0.40 -0.98 -0.12 0.00 0.00 0.00 0.00 19.45 18.75 3ime n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ime s ALA 242 N -1.75 2.95 0.37 0.00 0.00 -0.31 -5.10 121.76 117.91 3ime s ALA 242 Ca 0.34 -0.83 -0.19 0.00 0.00 0.00 0.00 51.96 51.28 3ime s ALA 242 Cb 0.20 -1.48 -0.10 0.00 0.00 0.00 0.00 23.12 21.74 3ime s ALA 242 CO 0.30 0.26 0.86 -1.25 0.00 0.00 0.00 175.76 175.92 3ime s PRO 243 N 0.24 4.19 -0.89 0.00 0.04 -1.26 -4.26 135.00 133.06 3ime s PRO 243 Ca -0.04 0.97 0.00 0.00 0.04 0.00 0.00 61.00 61.97 3ime s PRO 243 Cb -0.14 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.01 3ime s PRO 243 CO 0.03 0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.58 3ime n GLY 244 N -0.31 1.02 3.11 0.56 0.00 -1.26 -4.86 105.19 103.45 3ime n GLY 244 Ca 0.05 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 3ime n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ime s VAL 245 N -2.29 3.08 -0.42 1.61 1.01 -1.26 -4.33 120.40 117.80 3ime s VAL 245 Ca 0.00 -2.05 -0.21 0.00 0.00 0.00 0.00 61.98 59.72 3ime s VAL 245 Cb 0.00 -3.11 0.02 0.00 0.00 0.00 0.00 36.38 33.29 3ime s VAL 245 CO 0.00 -0.62 0.66 0.00 0.00 0.00 0.00 175.10 175.13 3ime s ALA 246 N 1.11 3.37 -0.41 5.51 0.00 0.30 -4.86 121.76 126.78 3ime s ALA 246 Ca 0.08 -1.08 -0.27 0.00 0.00 0.00 0.00 51.96 50.68 3ime s ALA 246 Cb -0.22 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.64 3ime s ALA 246 CO -0.05 -1.68 1.02 0.08 0.00 0.00 0.00 175.76 175.14 3ime s VAL 247 N 2.84 4.44 0.09 0.00 1.01 -1.26 0.53 120.40 128.04 3ime s VAL 247 Ca 0.24 1.24 -0.10 0.00 0.00 0.00 0.00 61.98 63.36 3ime s VAL 247 Cb -0.14 -4.45 -0.24 0.00 0.00 0.00 0.00 36.38 31.55 3ime s VAL 247 CO 0.18 -0.72 1.19 0.44 0.00 0.00 0.00 175.10 176.20 3ime h ASP 248 N 8.72 0.71 -4.68 3.32 3.32 -0.68 -3.48 116.42 123.65 3ime h ASP 248 Ca -0.23 -0.62 0.03 0.00 0.02 0.00 0.00 57.03 56.23 3ime h ASP 248 Cb 1.07 -0.22 -0.18 0.00 0.22 0.00 0.00 39.33 40.22 3ime h ASP 248 CO 1.04 1.43 0.36 -0.72 -1.72 0.00 0.00 179.24 179.64 3ime s TYR 249 N -3.10 -0.48 -0.13 4.55 -0.85 -1.17 -4.97 117.35 111.19 3ime s TYR 249 Ca -0.07 0.62 -0.04 0.00 -0.52 0.00 0.00 57.07 57.06 3ime s TYR 249 Cb 0.07 0.48 0.05 0.00 0.38 0.00 0.00 41.96 42.94 3ime s TYR 249 CO 0.90 -0.57 0.06 -1.17 -1.52 0.00 0.00 175.55 173.26 3ime s LEU 250 N -1.78 0.45 -0.02 -3.49 2.96 -1.26 -1.79 118.68 113.74 3ime s LEU 250 Ca -0.02 -0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 53.45 3ime s LEU 250 Cb -0.01 -0.29 0.01 0.00 0.50 0.00 0.00 46.19 46.40 3ime s LEU 250 CO -0.01 -0.30 0.05 -1.61 -1.32 0.00 0.00 176.35 173.16 3ime s GLU 251 N 2.09 0.04 -0.24 1.98 2.02 0.61 -4.98 118.70 120.22 3ime s GLU 251 Ca 0.03 0.11 -0.09 0.00 0.02 0.00 0.00 54.97 55.04 3ime s GLU 251 Cb -0.15 -0.04 -0.04 0.00 0.10 0.00 0.00 34.13 34.00 3ime s GLU 251 CO -0.07 -0.05 0.12 -1.17 0.02 0.00 0.00 175.26 174.11 3ime s LEU 252 N 0.29 3.83 0.31 1.80 2.96 -1.26 0.40 118.68 127.01 3ime s LEU 252 Ca -0.02 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.89 3ime s LEU 252 Cb -0.03 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 3ime s LEU 252 CO -0.01 0.03 0.10 -0.13 -1.32 0.00 0.00 176.35 175.02 3ime s ARG 253 N 1.26 1.59 1.01 1.98 1.81 0.16 -4.15 118.95 122.62 3ime s ARG 253 Ca 0.06 -1.90 -0.15 0.00 -1.72 0.00 0.00 55.73 52.02 3ime s ARG 253 Cb -0.14 -0.48 0.20 0.00 -0.45 0.00 0.00 34.95 34.08 3ime s ARG 253 CO 0.05 -0.31 1.17 0.16 -0.68 0.00 0.00 175.30 175.69 3ime s ASP 254 N -3.42 2.61 0.52 0.23 1.47 0.19 -0.24 116.67 118.03 3ime s ASP 254 Ca 0.35 0.70 0.26 0.00 1.18 0.00 0.00 52.55 55.04 3ime s ASP 254 Cb 0.07 -1.04 1.44 0.00 -0.34 0.00 0.00 42.92 43.05 3ime s ASP 254 CO 0.15 -3.08 2.09 0.16 0.68 0.00 0.00 175.17 175.16 3ime h ILE 255 N -1.87 0.64 -0.40 2.11 3.07 -1.84 0.11 117.51 119.34 3ime h ILE 255 Ca -0.47 -0.46 0.00 0.00 1.55 0.00 0.00 64.86 65.47 3ime h ILE 255 Cb 1.30 1.29 0.00 0.00 -0.27 0.00 0.00 36.82 39.14 3ime h ILE 255 CO 0.48 0.11 0.00 0.61 -1.05 0.00 0.00 178.15 178.29 3ime n GLY 256 N -0.83 1.12 2.32 0.16 0.00 -1.26 -4.93 105.19 101.77 3ime n GLY 256 Ca -0.02 -0.46 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 3ime n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ime n LEU 257 N 0.66 0.26 0.00 0.99 4.77 0.39 -5.03 117.00 119.04 3ime n LEU 257 Ca 0.14 0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.86 3ime n LEU 257 Cb 0.41 -1.18 0.23 0.00 -2.33 0.00 0.00 43.42 40.54 3ime n LEU 257 CO 0.11 -0.34 0.59 0.61 -1.33 0.00 0.00 177.39 177.03 3ime n GLY 258 N -1.71 -2.60 3.76 -0.72 0.00 -1.26 -4.73 105.19 97.93 3ime n GLY 258 Ca -0.01 -1.52 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 3ime n GLY 258 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ime s PRO 259 N -5.33 2.70 0.02 1.61 0.02 -1.26 -0.64 135.00 132.13 3ime s PRO 259 Ca 0.66 1.50 -0.30 0.00 0.02 0.00 0.00 61.00 62.87 3ime s PRO 259 Cb -0.06 -1.93 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 3ime s PRO 259 CO 0.50 -1.35 1.90 1.41 -0.33 0.00 0.00 177.00 179.14 3ime s MET 260 N -3.97 4.15 0.65 5.54 1.75 -1.26 -3.76 119.30 122.40 3ime s MET 260 Ca 0.69 2.54 -0.13 0.00 -1.25 0.00 0.00 55.69 57.54 3ime s MET 260 Cb -0.23 -4.11 -0.01 0.00 2.84 0.00 0.00 34.83 33.33 3ime s MET 260 CO 0.41 -0.93 1.06 -1.25 -0.65 0.00 0.00 175.02 173.66 3ime s PRO 261 N 4.31 3.09 0.18 4.11 0.04 -1.26 -4.95 135.00 140.51 3ime s PRO 261 Ca 0.85 1.07 -0.12 0.00 0.04 0.00 0.00 61.00 62.85 3ime s PRO 261 Cb -0.41 -2.01 0.09 0.00 0.04 0.00 0.00 34.50 32.21 3ime s PRO 261 CO 0.39 -0.99 1.75 -0.07 0.04 0.00 0.00 177.00 178.12 3ime h LEU 262 N -0.22 0.83-10.20 -3.56 3.38 -1.99 -3.43 115.31 100.12 3ime h LEU 262 Ca -0.45 -0.15 -0.64 0.00 0.09 0.00 0.00 57.88 56.73 3ime h LEU 262 Cb 1.21 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.66 3ime h LEU 262 CO 0.57 0.75 -0.41 0.20 0.09 0.00 0.00 178.44 179.64 3ime s ASN 263 N -6.07 4.37 0.00 -0.43 0.01 -1.26 -4.91 114.94 106.65 3ime s ASN 263 Ca -0.13 -1.47 0.00 0.00 -0.71 0.00 0.00 52.86 50.55 3ime s ASN 263 Cb 0.13 0.50 0.00 0.00 0.41 0.00 0.00 41.25 42.29 3ime s ASN 263 CO 0.79 -0.99 0.00 0.61 -1.51 0.00 0.00 177.10 176.01 3ime n GLY 264 N -1.51 -2.86 3.77 0.66 0.00 -1.20 -4.89 105.19 99.16 3ime n GLY 264 Ca -0.11 -2.18 -0.41 0.00 0.00 0.00 0.00 46.02 43.32 3ime n GLY 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ime s SER 265 N -0.04 6.83 0.03 1.61 0.01 -1.26 -1.79 113.70 119.09 3ime s SER 265 Ca 0.00 2.63 0.00 0.00 1.31 0.00 0.00 55.95 59.90 3ime s SER 265 Cb 0.00 -2.65 -0.00 0.00 0.21 0.00 0.00 66.02 63.58 3ime s SER 265 CO 0.00 -0.49 0.04 0.61 0.41 0.00 0.00 173.24 173.81 3ime n GLY 266 N 0.84 3.53 2.91 3.44 0.00 0.10 -4.27 105.19 111.74 3ime n GLY 266 Ca -0.00 -1.56 -0.13 0.00 0.00 0.00 0.00 46.02 44.33 3ime n GLY 266 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ime s ARG 267 N -2.11 0.07 -0.20 1.61 6.06 0.67 -1.74 118.95 123.30 3ime s ARG 267 Ca 0.04 0.21 -0.03 0.00 -2.50 0.00 0.00 55.73 53.44 3ime s ARG 267 Cb 0.00 -0.08 -0.01 0.00 0.06 0.00 0.00 34.95 34.92 3ime s ARG 267 CO 0.03 -0.09 -0.06 -1.17 -2.50 0.00 0.00 175.30 171.51 3ime s LEU 268 N 0.59 2.91 0.06 -0.88 2.96 0.19 -0.67 118.68 123.84 3ime s LEU 268 Ca -0.05 -0.35 0.09 0.00 -0.22 0.00 0.00 54.13 53.60 3ime s LEU 268 Cb -0.06 -1.72 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 3ime s LEU 268 CO -0.02 0.04 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.05 3ime s LEU 269 N 1.14 2.38 0.01 -0.68 1.02 0.16 0.41 118.68 123.12 3ime s LEU 269 Ca 0.02 -0.55 0.01 0.00 0.02 0.00 0.00 54.13 53.63 3ime s LEU 269 Cb -0.14 -1.38 -0.01 0.00 0.02 0.00 0.00 46.19 44.68 3ime s LEU 269 CO -0.01 0.24 -0.03 0.54 0.02 0.00 0.00 176.35 177.11 3ime s VAL 270 N -0.90 0.21 0.00 -1.59 0.11 0.68 -0.28 120.40 118.64 3ime s VAL 270 Ca 0.13 -0.33 0.02 0.00 -2.93 0.00 0.00 61.98 58.88 3ime s VAL 270 Cb -0.10 -0.23 -0.01 0.00 -1.53 0.00 0.00 36.38 34.51 3ime s VAL 270 CO 0.04 -0.08 -0.07 0.00 -3.33 0.00 0.00 175.10 171.67 3ime s ALA 271 N -0.41 0.54 0.04 1.54 0.00 -0.74 -1.45 121.76 121.28 3ime s ALA 271 Ca -0.03 -0.35 -0.20 0.00 0.00 0.00 0.00 51.96 51.39 3ime s ALA 271 Cb -0.03 -0.11 0.04 0.00 0.00 0.00 0.00 23.12 23.02 3ime s ALA 271 CO -0.00 0.11 0.45 0.00 0.00 0.00 0.00 175.76 176.32 3ime s ALA 272 N -0.32 -1.13 -0.18 0.00 0.00 -0.21 0.12 121.76 120.03 3ime s ALA 272 Ca 0.01 0.44 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 3ime s ALA 272 Cb -0.03 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 3ime s ALA 272 CO -0.00 -0.46 -0.02 1.03 0.00 0.00 0.00 175.76 176.31 3ime s ARG 273 N -2.36 3.62 -0.30 0.00 0.52 0.19 -0.22 118.95 120.39 3ime s ARG 273 Ca -0.06 -0.53 0.03 0.00 -0.52 0.00 0.00 55.73 54.65 3ime s ARG 273 Cb -0.01 -3.01 0.08 0.00 0.52 0.00 0.00 34.95 32.54 3ime s ARG 273 CO -0.01 0.09 -0.00 -0.51 0.02 0.00 0.00 175.30 174.88 3ime s LEU 274 N 0.77 3.92 0.00 2.53 1.02 -0.03 -0.54 118.68 126.35 3ime s LEU 274 Ca -0.01 -1.78 0.00 0.00 0.02 0.00 0.00 54.13 52.36 3ime s LEU 274 Cb -0.14 -1.49 0.00 0.00 0.02 0.00 0.00 46.19 44.58 3ime s LEU 274 CO 0.02 -0.31 0.00 0.61 0.02 0.00 0.00 176.35 176.69 3ime n GLY 275 N 4.40 2.69 0.31 -3.19 0.00 -1.26 -0.94 105.19 107.20 3ime n GLY 275 Ca -0.04 0.28 0.11 0.00 0.00 0.00 0.00 46.02 46.38 3ime n GLY 275 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ime n THR 276 N 0.00 0.00 -3.60 2.61 -2.24 -1.26 -4.93 114.28 104.86 3ime n THR 276 Ca 0.00 -0.16 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 3ime n THR 276 Cb 0.00 0.95 -0.11 0.00 -2.10 0.00 0.00 70.33 69.08 3ime n THR 276 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3ime s THR 277 N -2.63 5.32 -0.28 4.28 2.01 -0.12 -5.05 115.64 119.17 3ime s THR 277 Ca 0.17 0.19 -0.17 0.00 0.31 0.00 0.00 61.69 62.19 3ime s THR 277 Cb 0.18 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 3ime s THR 277 CO 0.63 0.27 0.46 -0.60 -0.69 0.00 0.00 174.62 174.70 3ime s ARG 278 N 1.58 3.96 0.02 4.92 3.52 -1.26 -0.85 118.95 130.83 3ime s ARG 278 Ca 0.08 0.12 0.02 0.00 -0.13 0.00 0.00 55.73 55.82 3ime s ARG 278 Cb -0.15 -3.69 -0.04 0.00 -1.56 0.00 0.00 34.95 29.52 3ime s ARG 278 CO 0.09 -0.38 -0.01 -0.51 -0.81 0.00 0.00 175.30 173.68 3ime s LEU 279 N 2.23 3.44 0.09 -0.88 1.43 0.69 -4.98 118.68 120.72 3ime s LEU 279 Ca 0.18 -0.06 0.09 0.00 -1.03 0.00 0.00 54.13 53.31 3ime s LEU 279 Cb -0.16 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 3ime s LEU 279 CO 0.10 0.26 -0.22 -0.76 0.23 0.00 0.00 176.35 175.96 3ime s LEU 280 N -1.66 2.27 0.16 1.79 1.43 -1.26 -1.04 118.68 120.36 3ime s LEU 280 Ca 0.20 -0.66 -0.16 0.00 -1.03 0.00 0.00 54.13 52.48 3ime s LEU 280 Cb -0.11 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 45.15 3ime s LEU 280 CO 0.11 0.11 0.43 -0.62 0.23 0.00 0.00 176.35 176.61 3ime s ASP 281 N -1.76 -0.21 -0.10 2.29 -1.08 -0.53 -4.85 116.67 110.42 3ime s ASP 281 Ca 0.08 -0.45 -0.19 0.00 -0.52 0.00 0.00 52.55 51.48 3ime s ASP 281 Cb -0.10 0.51 0.04 0.00 -1.46 0.00 0.00 42.92 41.91 3ime s ASP 281 CO 0.04 -0.93 0.46 0.54 0.52 0.00 0.00 175.17 175.80 3ime s ASN 282 N -2.85 -0.43 0.05 -0.34 2.20 -1.26 -0.23 114.94 112.08 3ime s ASN 282 Ca 0.07 0.64 0.01 0.00 -0.94 0.00 0.00 52.86 52.65 3ime s ASN 282 Cb 0.01 0.69 -0.03 0.00 -2.00 0.00 0.00 41.25 39.92 3ime s ASN 282 CO -0.07 -0.33 -0.06 -0.51 -2.94 0.00 0.00 177.10 173.19 3ime s ILE 283 N -0.50 0.44 0.34 0.54 2.07 0.16 -4.94 121.20 119.31 3ime s ILE 283 Ca -0.06 -1.21 -0.27 0.00 -1.41 0.00 0.00 60.65 57.69 3ime s ILE 283 Cb -0.03 -0.75 -0.09 0.00 0.13 0.00 0.00 42.46 41.72 3ime s ILE 283 CO 0.03 -0.52 1.11 0.00 -1.91 0.00 0.00 174.94 173.65 3ime s ALA 284 N -1.90 3.28 -0.01 1.50 0.00 -1.26 -0.64 121.76 122.74 3ime s ALA 284 Ca -0.07 0.88 0.02 0.00 0.00 0.00 0.00 51.96 52.79 3ime s ALA 284 Cb -0.07 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 3ime s ALA 284 CO -0.01 -0.27 -0.06 0.42 0.00 0.00 0.00 175.76 175.84 3ime s ILE 285 N -1.33 0.45 -0.20 0.00 -1.09 -0.71 -4.80 121.20 113.51 3ime s ILE 285 Ca 0.50 -0.23 0.01 0.00 -2.23 0.00 0.00 60.65 58.71 3ime s ILE 285 Cb -0.30 -0.39 0.04 0.00 -1.58 0.00 0.00 42.46 40.24 3ime s ILE 285 CO 0.38 0.13 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.49 3ime s GLU 286 N -0.05 2.18 -0.31 2.79 0.41 -1.26 0.02 118.70 122.47 3ime s GLU 286 Ca 0.01 -0.90 -0.21 0.00 -0.41 0.00 0.00 54.97 53.46 3ime s GLU 286 Cb -0.03 -2.48 -0.01 0.00 -1.78 0.00 0.00 34.13 29.83 3ime s GLU 286 CO -0.00 -0.41 0.67 0.42 -0.49 0.00 0.00 175.26 175.44 3ime s ILE 287 N 1.35 4.90 0.00 -1.63 -1.09 -0.74 -4.49 121.20 119.49 3ime s ILE 287 Ca -0.01 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 59.31 3ime s ILE 287 Cb -0.16 -4.04 0.00 0.00 -1.58 0.00 0.00 42.46 36.67 3ime s ILE 287 CO -0.08 -0.19 0.00 0.61 -1.23 0.00 0.00 174.94 174.05