#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fel h LEU 3 N 0.00 0.80 -9.12 1.04 3.38 -2.04 -3.44 115.31 105.93 2fel h LEU 3 Ca 0.00 -0.58 -0.63 0.00 0.09 0.00 0.00 57.88 56.76 2fel h LEU 3 Cb 0.00 -0.23 -0.16 0.00 0.09 0.00 0.00 40.66 40.36 2fel h LEU 3 CO 0.00 1.24 -0.58 -0.55 0.09 0.00 0.00 178.44 178.64 2fel s SER 4 N -6.81 5.54 0.57 -0.43 0.15 -1.26 -5.00 113.70 106.47 2fel s SER 4 Ca -0.12 0.09 0.28 0.00 0.70 0.00 0.00 55.95 56.90 2fel s SER 4 Cb 0.08 -1.90 1.51 0.00 -1.71 0.00 0.00 66.02 64.01 2fel s SER 4 CO 0.86 0.21 1.99 -0.65 1.20 0.00 0.00 173.24 176.85 2fel h PRO 5 N 6.40 0.00 -0.67 5.44 0.11 -1.93 -2.33 132.00 139.02 2fel h PRO 5 Ca -0.39 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.76 2fel h PRO 5 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2fel h PRO 5 CO 0.67 0.00 0.44 0.74 -0.21 0.00 0.00 178.00 179.65 2fel h PHE 6 N 0.00 0.77 -0.01 0.65 0.05 -1.87 -2.88 116.94 113.65 2fel h PHE 6 Ca 0.18 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.99 2fel h PHE 6 Cb 0.90 -0.26 0.00 0.00 2.00 0.00 0.00 35.95 38.60 2fel h PHE 6 CO 0.00 0.45 -0.16 0.39 -0.18 0.00 0.00 178.31 178.80 2fel n GLU 7 N -4.46 1.50 -2.14 1.51 1.02 -0.94 -4.10 120.64 113.03 2fel n GLU 7 Ca 0.08 -0.93 -0.42 0.00 -0.02 0.00 0.00 57.16 55.88 2fel n GLU 7 Cb 0.13 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 30.32 2fel n GLU 7 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2fel s HIS 8 N -1.42 3.19 0.54 -0.32 2.46 -0.92 -4.89 115.29 113.94 2fel s HIS 8 Ca 0.13 1.04 0.43 0.00 0.47 0.00 0.00 55.06 57.12 2fel s HIS 8 Cb 0.11 -3.70 1.63 0.00 -0.13 0.00 0.00 32.58 30.48 2fel s HIS 8 CO 0.26 -2.35 1.69 -1.35 -2.47 0.00 0.00 174.74 170.53 2fel h PRO 9 N 5.93 0.01 0.00 2.88 0.11 -1.92 -1.33 132.00 137.69 2fel h PRO 9 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2fel h PRO 9 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2fel h PRO 9 CO 0.82 0.01 -0.99 1.97 -0.21 0.00 0.00 178.00 179.59 2fel n PHE 10 N -4.10 0.00 0.27 0.65 1.16 -1.26 -4.72 117.46 109.46 2fel n PHE 10 Ca 0.35 0.00 0.17 0.00 -1.87 0.00 0.00 57.45 56.09 2fel n PHE 10 Cb 1.60 0.00 0.85 0.00 -1.61 0.00 0.00 39.48 40.33 2fel n PHE 10 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2fel h LEU 11 N 0.00 0.00 -0.23 5.98 3.38 -1.81 -0.73 115.31 121.90 2fel h LEU 11 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fel h LEU 11 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 2fel h LEU 11 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.99 2fel n SER 12 N -2.67 0.21 -0.04 -0.43 3.41 -0.51 -0.93 113.62 112.66 2fel n SER 12 Ca -0.02 0.55 0.07 0.00 -0.26 0.00 0.00 58.87 59.22 2fel n SER 12 Cb 0.09 -0.60 0.45 0.00 -0.26 0.00 0.00 64.21 63.89 2fel n SER 12 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2fel h GLY 13 N 2.30 0.60 0.00 5.00 0.00 -1.39 -0.07 103.07 109.51 2fel h GLY 13 Ca 0.00 -0.20 -0.43 0.00 0.00 0.00 0.00 47.33 46.70 2fel h GLY 13 CO 0.00 0.17 -2.50 -0.10 0.00 0.00 0.00 176.54 174.11 2fel n LEU 14 N -4.47 2.43 -0.90 3.11 7.94 -0.92 -4.73 117.00 119.46 2fel n LEU 14 Ca 0.06 0.11 0.12 0.00 -1.11 0.00 0.00 56.01 55.18 2fel n LEU 14 Cb 0.17 -0.85 0.09 0.00 0.53 0.00 0.00 43.42 43.36 2fel n LEU 14 CO 0.35 0.75 0.60 0.49 -1.11 0.00 0.00 177.39 178.46 2fel n PHE 15 N -3.76 0.00 -2.57 1.96 3.01 -0.11 -4.93 117.46 111.05 2fel n PHE 15 Ca -0.50 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 57.60 2fel n PHE 15 Cb 0.93 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 40.36 2fel n PHE 15 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2fel s GLY 16 N -1.96 2.70 -0.45 1.37 0.00 -0.04 -4.39 107.32 104.55 2fel s GLY 16 Ca 0.26 0.67 0.05 0.00 0.00 0.00 0.00 44.72 45.70 2fel s GLY 16 CO 0.31 1.08 0.49 -0.35 0.00 0.00 0.00 173.10 174.62 2fel s ASP 17 N -1.63 0.33 0.33 1.64 -1.08 -1.26 -4.88 116.67 110.12 2fel s ASP 17 Ca 0.58 -2.42 0.01 0.00 -0.52 0.00 0.00 52.55 50.20 2fel s ASP 17 Cb -0.21 0.53 0.56 0.00 -1.46 0.00 0.00 42.92 42.34 2fel s ASP 17 CO 0.26 -0.14 1.97 0.77 0.52 0.00 0.00 175.17 178.55 2fel h SER 18 N 5.56 0.77 -0.45 -0.34 4.64 -1.95 -1.30 113.55 120.48 2fel h SER 18 Ca 0.17 -0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.40 2fel h SER 18 Cb 1.00 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.88 2fel h SER 18 CO 0.22 0.60 0.10 -0.08 -0.87 0.00 0.00 176.83 176.79 2fel h GLU 19 N 0.89 0.73 -0.14 4.77 4.81 -2.00 -1.15 114.58 122.50 2fel h GLU 19 Ca 0.23 -0.18 -0.17 0.00 -0.13 0.00 0.00 59.36 59.10 2fel h GLU 19 Cb -0.02 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.27 2fel h GLU 19 CO -0.04 0.74 -0.59 0.82 -0.73 0.00 0.00 179.01 179.21 2fel h ILE 20 N 0.61 1.33 -0.00 2.32 1.08 -1.96 -3.33 117.51 117.55 2fel h ILE 20 Ca 0.14 -1.85 -0.08 0.00 -0.39 0.00 0.00 64.86 62.68 2fel h ILE 20 Cb 0.35 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 36.16 2fel h ILE 20 CO 0.00 0.57 -0.37 0.40 -0.69 0.00 0.00 178.15 178.07 2fel h ILE 21 N 0.30 1.26 0.00 -0.67 2.04 -1.06 -2.39 117.51 116.99 2fel h ILE 21 Ca -0.04 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.57 2fel h ILE 21 Cb 1.22 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.98 2fel h ILE 21 CO 0.12 0.36 0.00 -1.84 0.00 0.00 0.00 178.15 176.79 2fel n GLU 22 N -4.10 0.06 0.00 2.37 -0.00 -0.45 -0.84 120.64 117.68 2fel n GLU 22 Ca -0.02 0.22 0.13 0.00 -0.00 0.00 0.00 57.16 57.49 2fel n GLU 22 Cb 0.40 -1.60 0.63 0.00 -0.00 0.00 0.00 31.44 30.87 2fel n GLU 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2fel n LEU 23 N -1.71 0.00 -0.32 -1.84 4.32 -0.90 -2.96 117.00 113.60 2fel n LEU 23 Ca 0.04 0.33 0.05 0.00 -0.02 0.00 0.00 56.01 56.41 2fel n LEU 23 Cb 0.25 -0.33 0.11 0.00 -1.62 0.00 0.00 43.42 41.83 2fel n LEU 23 CO 0.20 -0.05 0.58 0.49 -1.22 0.00 0.00 177.39 177.39 2fel n PHE 24 N -1.33 0.26 -2.05 -1.77 3.72 -0.02 -4.70 117.46 111.57 2fel n PHE 24 Ca 0.11 -0.65 -0.33 0.00 -0.05 0.00 0.00 57.45 56.53 2fel n PHE 24 Cb 0.22 -0.10 0.01 0.00 -0.94 0.00 0.00 39.48 38.67 2fel n PHE 24 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2fel s SER 25 N -1.50 5.73 0.23 4.37 1.04 -1.15 -4.91 113.70 117.51 2fel s SER 25 Ca 0.19 1.86 -0.07 0.00 0.48 0.00 0.00 55.95 58.41 2fel s SER 25 Cb 0.14 -2.54 0.29 0.00 0.10 0.00 0.00 66.02 64.01 2fel s SER 25 CO 0.06 -1.20 1.83 0.00 0.98 0.00 0.00 173.24 174.91 2fel h ALA 26 N 0.48 1.06 -0.42 5.32 0.00 -1.96 -1.17 119.26 122.58 2fel h ALA 26 Ca -0.47 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2fel h ALA 26 Cb 1.23 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2fel h ALA 26 CO 0.57 0.18 0.19 -0.22 0.00 0.00 0.00 179.25 179.96 2fel h LYS 27 N 0.85 0.62 -0.62 0.00 3.64 -1.93 0.79 116.57 119.90 2fel h LYS 27 Ca 0.34 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.53 2fel h LYS 27 Cb 0.18 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2fel h LYS 27 CO -0.18 0.55 0.03 0.00 -2.27 0.00 0.00 179.45 177.59 2fel h ALA 28 N 1.03 0.87 0.05 5.00 0.00 -1.73 0.01 119.26 124.49 2fel h ALA 28 Ca 0.14 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2fel h ALA 28 Cb 0.15 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2fel h ALA 28 CO -0.01 0.67 -0.03 0.22 0.00 0.00 0.00 179.25 180.09 2fel h ASP 29 N 0.98 -0.07 -0.58 0.00 3.58 -0.90 -2.34 116.42 117.09 2fel h ASP 29 Ca 0.18 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 2fel h ASP 29 Cb 0.52 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 2fel h ASP 29 CO 0.03 -0.05 0.36 0.40 -2.88 0.00 0.00 179.24 177.09 2fel h ILE 30 N -0.08 1.17 -0.81 2.25 2.04 -0.44 -0.82 117.51 120.83 2fel h ILE 30 Ca -0.00 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.59 2fel h ILE 30 Cb 0.07 0.37 -0.08 0.00 -0.74 0.00 0.00 36.82 36.44 2fel h ILE 30 CO 0.00 0.17 0.44 0.44 0.00 0.00 0.00 178.15 179.21 2fel h ASP 31 N 0.79 0.59 -0.12 1.72 3.32 -0.95 0.27 116.42 122.04 2fel h ASP 31 Ca 0.21 0.06 -0.11 0.00 0.02 0.00 0.00 57.03 57.21 2fel h ASP 31 Cb -0.03 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2fel h ASP 31 CO -0.04 0.32 -0.30 0.00 -1.72 0.00 0.00 179.24 177.51 2fel h ALA 32 N 1.47 0.95 -0.41 3.45 0.00 -0.89 -1.85 119.26 121.99 2fel h ALA 32 Ca 0.40 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2fel h ALA 32 Cb 0.43 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2fel h ALA 32 CO -0.28 0.61 -0.21 0.52 0.00 0.00 0.00 179.25 179.89 2fel h MET 33 N 0.51 0.80 -0.83 0.00 2.86 0.09 -1.12 114.93 117.25 2fel h MET 33 Ca 0.06 -0.32 0.02 0.00 -2.06 0.00 0.00 59.70 57.40 2fel h MET 33 Cb 0.77 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.34 2fel h MET 33 CO 0.06 0.94 0.54 0.82 1.06 0.00 0.00 176.91 180.33 2fel h ILE 34 N 0.70 1.19 -0.63 -1.22 2.04 -0.36 -1.89 117.51 117.34 2fel h ILE 34 Ca 0.10 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.49 2fel h ILE 34 Cb 0.72 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 2fel h ILE 34 CO 0.06 0.20 0.03 0.03 0.00 0.00 0.00 178.15 178.47 2fel h ARG 35 N 1.10 1.09 0.20 2.37 3.08 -1.15 -1.13 114.38 119.94 2fel h ARG 35 Ca 0.31 -0.33 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2fel h ARG 35 Cb -0.09 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 2fel h ARG 35 CO -0.08 1.04 -0.21 0.35 -1.07 0.00 0.00 179.97 180.00 2fel h PHE 36 N 1.00 -0.56 -0.31 3.04 3.57 -0.86 -1.69 116.94 121.13 2fel h PHE 36 Ca 0.18 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.59 2fel h PHE 36 Cb 0.53 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2fel h PHE 36 CO 0.04 -0.32 -0.21 0.93 -2.23 0.00 0.00 178.31 176.52 2fel h GLU 37 N -0.45 0.59 0.25 1.11 4.39 -1.22 -0.13 114.58 119.11 2fel h GLU 37 Ca 0.00 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.48 2fel h GLU 37 Cb 0.43 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2fel h GLU 37 CO -0.06 0.76 -0.12 1.15 -1.16 0.00 0.00 179.01 179.58 2fel h THR 38 N 0.52 0.81 -0.11 1.13 2.02 -1.17 -2.67 112.91 113.43 2fel h THR 38 Ca 0.08 -0.32 -0.06 0.00 0.77 0.00 0.00 66.41 66.88 2fel h THR 38 Cb 0.66 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2fel h THR 38 CO 0.05 0.07 -0.21 0.00 0.37 0.00 0.00 175.52 175.80 2fel h ALA 39 N 0.22 1.44 -0.22 6.16 0.00 -1.19 -1.96 119.26 123.72 2fel h ALA 39 Ca -0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2fel h ALA 39 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2fel h ALA 39 CO 0.06 0.39 0.13 1.25 0.00 0.00 0.00 179.25 181.08 2fel h LEU 40 N 0.17 0.26 -0.48 0.00 5.85 -1.00 0.24 115.31 120.35 2fel h LEU 40 Ca 0.03 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2fel h LEU 40 Cb 0.48 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 2fel h LEU 40 CO 0.03 0.24 0.24 0.00 -0.34 0.00 0.00 178.44 178.61 2fel h ALA 41 N 1.03 0.60 -0.52 1.25 0.00 -1.11 -0.60 119.26 119.91 2fel h ALA 41 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2fel h ALA 41 Cb 0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2fel h ALA 41 CO -0.01 -0.11 0.15 1.96 0.00 0.00 0.00 179.25 181.24 2fel h GLN 42 N 0.48 0.83 -0.94 0.00 4.20 -1.21 -1.75 115.11 116.71 2fel h GLN 42 Ca 0.21 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 2fel h GLN 42 Cb 0.11 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 2fel h GLN 42 CO -0.14 0.78 0.57 0.00 -0.67 0.00 0.00 178.83 179.37 2fel h ALA 43 N 1.01 1.20 -0.03 3.87 0.00 -0.26 -1.29 119.26 123.76 2fel h ALA 43 Ca 0.17 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2fel h ALA 43 Cb 0.31 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2fel h ALA 43 CO -0.00 0.65 -0.83 0.93 0.00 0.00 0.00 179.25 180.00 2fel h GLU 44 N 1.29 0.32 -0.17 0.00 5.08 -0.99 -1.58 114.58 118.53 2fel h GLU 44 Ca 0.34 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 2fel h GLU 44 Cb -0.07 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2fel h GLU 44 CO -0.06 0.99 -0.27 0.00 -1.00 0.00 0.00 179.01 178.66 2fel h ALA 45 N 0.91 1.21 -0.25 3.43 0.00 -1.23 -0.55 119.26 122.78 2fel h ALA 45 Ca -0.05 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 2fel h ALA 45 Cb 1.43 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2fel h ALA 45 CO 0.14 0.52 -0.37 1.49 0.00 0.00 0.00 179.25 181.03 2fel h GLU 46 N 0.29 0.57 -0.57 0.00 4.57 -0.93 -2.48 114.58 116.04 2fel h GLU 46 Ca 0.04 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 2fel h GLU 46 Cb 0.64 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 2fel h GLU 46 CO 0.05 0.85 0.00 0.00 -1.18 0.00 0.00 179.01 178.73 2fel n ALA 47 N -2.50 2.68 -2.35 2.92 0.00 -0.62 -4.91 120.51 115.72 2fel n ALA 47 Ca -0.01 -0.42 -0.19 0.00 0.00 0.00 0.00 53.44 52.81 2fel n ALA 47 Cb 0.49 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.92 2fel n ALA 47 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2fel n SER 48 N 0.12 -5.51 -0.02 0.00 7.64 -0.93 -4.92 113.62 109.99 2fel n SER 48 Ca 0.07 -0.01 -0.16 0.00 1.01 0.00 0.00 58.87 59.78 2fel n SER 48 Cb 0.34 -4.55 -0.12 0.00 -1.01 0.00 0.00 64.21 58.86 2fel n SER 48 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2fel h ILE 49 N 0.00 1.60 -3.57 0.44 2.04 -1.32 -3.47 117.51 113.24 2fel h ILE 49 Ca -0.45 -2.16 -0.39 0.00 1.00 0.00 0.00 64.86 62.86 2fel h ILE 49 Cb 1.34 3.01 -0.14 0.00 -0.74 0.00 0.00 36.82 40.28 2fel h ILE 49 CO 0.54 0.59 -0.60 0.72 0.00 0.00 0.00 178.15 179.39 2fel s PHE 50 N -2.77 1.63 0.73 1.37 -0.71 -1.25 -5.03 117.98 111.96 2fel s PHE 50 Ca -0.16 -1.16 -0.11 0.00 -1.04 0.00 0.00 56.93 54.46 2fel s PHE 50 Cb -0.00 -0.98 0.03 0.00 -1.21 0.00 0.00 43.02 40.86 2fel s PHE 50 CO 0.75 -0.29 1.08 0.00 -1.34 0.00 0.00 175.22 175.42 2fel s ALA 51 N -3.64 2.56 0.28 1.99 0.00 -1.26 -4.32 121.76 117.37 2fel s ALA 51 Ca 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 52.22 2fel s ALA 51 Cb 0.08 -3.12 0.45 0.00 0.00 0.00 0.00 23.12 20.52 2fel s ALA 51 CO 0.14 -1.38 1.89 -0.44 0.00 0.00 0.00 175.76 175.97 2fel h ASP 52 N -0.83 1.00 0.43 0.00 5.19 -1.99 -2.29 116.42 117.93 2fel h ASP 52 Ca -0.45 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 55.92 2fel h ASP 52 Cb 1.24 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 2fel h ASP 52 CO 0.59 0.63 -0.25 -2.24 -3.12 0.00 0.00 179.24 174.85 2fel h ASP 53 N 1.13 0.00 0.20 6.45 2.03 -1.98 -0.35 116.42 123.90 2fel h ASP 53 Ca 0.43 0.00 -0.25 0.00 -0.73 0.00 0.00 57.03 56.48 2fel h ASP 53 Cb 0.20 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.72 2fel h ASP 53 CO -0.17 0.25 -1.02 -0.33 -1.03 0.00 0.00 179.24 176.94 2fel h GLU 54 N 0.00 0.54 -0.54 4.15 5.08 -1.79 -1.07 114.58 120.95 2fel h GLU 54 Ca -0.00 -0.60 -0.09 0.00 -1.00 0.00 0.00 59.36 57.66 2fel h GLU 54 Cb 0.54 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2fel h GLU 54 CO 0.03 1.22 -0.03 0.00 -1.00 0.00 0.00 179.01 179.23 2fel h ALA 55 N 0.57 0.73 -0.29 3.43 0.00 -1.39 -2.67 119.26 119.64 2fel h ALA 55 Ca -0.11 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 2fel h ALA 55 Cb 1.67 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 2fel h ALA 55 CO 0.19 0.58 -0.13 1.49 0.00 0.00 0.00 179.25 181.38 2fel h GLU 56 N 0.85 0.50 -0.97 0.00 4.57 -1.04 0.18 114.58 118.68 2fel h GLU 56 Ca 0.15 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2fel h GLU 56 Cb 0.58 -0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 29.07 2fel h GLU 56 CO 0.03 0.62 0.60 0.00 -1.18 0.00 0.00 179.01 179.09 2fel h ALA 57 N 1.41 1.24 -0.11 2.92 0.00 -1.11 -1.58 119.26 122.03 2fel h ALA 57 Ca 0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2fel h ALA 57 Cb 0.50 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2fel h ALA 57 CO 0.03 0.67 -0.12 0.82 0.00 0.00 0.00 179.25 180.65 2fel h ILE 58 N 1.33 1.36 0.13 0.00 2.04 -0.92 -2.57 117.51 118.87 2fel h ILE 58 Ca 0.35 -1.29 0.01 0.00 1.00 0.00 0.00 64.86 64.94 2fel h ILE 58 Cb -0.09 1.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 2fel h ILE 58 CO -0.07 0.37 -0.22 0.58 0.00 0.00 0.00 178.15 178.81 2fel h VAL 59 N -0.13 0.51 -0.14 1.67 2.07 -0.60 -0.35 116.25 119.28 2fel h VAL 59 Ca 0.02 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.43 2fel h VAL 59 Cb 0.64 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2fel h VAL 59 CO 0.03 0.00 -0.38 0.77 0.02 0.00 0.00 177.57 178.01 2fel h SER 60 N -0.42 0.31 -0.12 0.57 4.64 -1.40 -2.28 113.55 114.85 2fel h SER 60 Ca 0.02 -0.12 -0.08 0.00 -0.47 0.00 0.00 61.79 61.14 2fel h SER 60 Cb 0.43 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2fel h SER 60 CO -0.11 0.66 -0.17 1.23 -0.87 0.00 0.00 176.83 177.57 2fel h GLY 61 N 1.15 0.55 2.00 -0.77 0.00 -1.29 -3.00 103.07 101.72 2fel h GLY 61 Ca 0.03 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.95 2fel h GLY 61 CO 0.06 0.38 0.00 1.41 0.00 0.00 0.00 176.54 178.39 2fel h LEU 62 N 0.46 0.00 -0.81 3.11 3.38 -0.73 -3.15 115.31 117.57 2fel h LEU 62 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2fel h LEU 62 Cb 0.57 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2fel h LEU 62 CO 0.04 0.00 -0.14 0.77 0.09 0.00 0.00 178.44 179.20 2fel h SER 63 N 0.00 0.00 0.00 -0.43 4.64 -1.27 -3.04 113.55 113.46 2fel h SER 63 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fel h SER 63 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2fel h SER 63 CO 0.00 0.14 -0.03 -0.62 -0.87 0.00 0.00 176.83 175.45 2fel n GLU 64 N -3.21 1.76 -2.41 4.77 1.02 -1.24 -5.04 120.64 116.29 2fel n GLU 64 Ca 0.01 -2.05 -0.42 0.00 -0.02 0.00 0.00 57.16 54.69 2fel n GLU 64 Cb 0.45 -1.24 -0.03 0.00 -0.02 0.00 0.00 31.44 30.60 2fel n GLU 64 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2fel s PHE 65 N -1.98 3.44 -0.18 -0.32 5.36 -1.15 -5.04 117.98 118.12 2fel s PHE 65 Ca 0.18 1.33 0.01 0.00 -0.96 0.00 0.00 56.93 57.49 2fel s PHE 65 Cb 0.16 -3.42 0.03 0.00 -0.34 0.00 0.00 43.02 39.45 2fel s PHE 65 CO 0.02 -1.26 -0.14 0.00 -1.46 0.00 0.00 175.22 172.38 2fel s ALA 66 N 0.72 2.02 0.33 11.12 0.00 -1.26 -5.06 121.76 129.63 2fel s ALA 66 Ca 0.57 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 51.15 2fel s ALA 66 Cb -0.30 -1.18 -0.09 0.00 0.00 0.00 0.00 23.12 21.54 2fel s ALA 66 CO 0.31 -0.57 1.08 0.00 0.00 0.00 0.00 175.76 176.58 2fel s ALA 67 N 1.40 3.28 -0.34 0.00 0.00 -1.26 -5.02 121.76 119.82 2fel s ALA 67 Ca 0.02 0.83 -0.19 0.00 0.00 0.00 0.00 51.96 52.62 2fel s ALA 67 Cb -0.14 -3.31 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 2fel s ALA 67 CO -0.10 -0.19 0.54 0.34 0.00 0.00 0.00 175.76 176.34 2fel s ASP 68 N -1.14 6.35 0.12 0.00 -1.08 -1.26 -4.98 116.67 114.68 2fel s ASP 68 Ca 0.50 0.06 -0.10 0.00 -0.52 0.00 0.00 52.55 52.49 2fel s ASP 68 Cb -0.28 -2.28 -0.12 0.00 -1.46 0.00 0.00 42.92 38.78 2fel s ASP 68 CO 0.36 -0.48 1.31 -0.03 0.52 0.00 0.00 175.17 176.85 2fel h MET 69 N 8.41 0.67 -0.59 4.34 1.85 -1.99 -1.74 114.93 125.88 2fel h MET 69 Ca -0.28 -0.59 0.01 0.00 -0.61 0.00 0.00 59.70 58.24 2fel h MET 69 Cb 1.12 0.14 -0.03 0.00 0.43 0.00 0.00 31.60 33.26 2fel h MET 69 CO 0.78 1.20 0.38 0.77 -0.40 0.00 0.00 176.91 179.64 2fel h SER 70 N 0.44 0.65 -0.40 1.39 0.02 -1.99 -1.36 113.55 112.29 2fel h SER 70 Ca -0.06 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 2fel h SER 70 Cb 1.46 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.82 2fel h SER 70 CO 0.16 0.46 0.04 0.00 -1.14 0.00 0.00 176.83 176.36 2fel h ALA 71 N 1.23 1.18 -0.23 3.77 0.00 -1.97 -1.75 119.26 121.50 2fel h ALA 71 Ca 0.22 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 2fel h ALA 71 Cb -0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2fel h ALA 71 CO -0.06 0.54 -0.33 -0.07 0.00 0.00 0.00 179.25 179.33 2fel h LEU 72 N 0.72 0.69 -0.70 0.00 3.38 -0.83 -0.76 115.31 117.81 2fel h LEU 72 Ca 0.15 -0.51 0.07 0.00 0.09 0.00 0.00 57.88 57.68 2fel h LEU 72 Cb 0.38 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 2fel h LEU 72 CO 0.01 1.06 0.38 -0.09 0.09 0.00 0.00 178.44 179.90 2fel h ARG 73 N 0.33 0.67 -0.96 1.13 2.43 -1.22 -1.90 114.38 114.86 2fel h ARG 73 Ca 0.02 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 2fel h ARG 73 Cb 0.91 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 30.26 2fel h ARG 73 CO 0.08 0.44 0.64 1.25 -1.51 0.00 0.00 179.97 180.87 2fel h HIS 74 N 0.69 1.21 -0.71 2.20 2.76 -1.12 -1.98 115.15 118.19 2fel h HIS 74 Ca 0.32 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.52 2fel h HIS 74 Cb 0.24 -0.41 -0.03 0.00 1.55 0.00 0.00 27.41 28.76 2fel h HIS 74 CO -0.08 0.75 0.42 0.78 -1.30 0.00 0.00 177.93 178.51 2fel h GLY 75 N 1.30 1.03 1.69 5.26 0.00 -0.39 -1.14 103.07 110.82 2fel h GLY 75 Ca 0.36 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.17 2fel h GLY 75 CO -0.08 0.41 -0.69 -0.39 0.00 0.00 0.00 176.54 175.79 2fel h VAL 76 N 0.98 0.62 -0.21 4.60 -1.51 -1.08 0.94 116.25 120.58 2fel h VAL 76 Ca 0.26 -1.94 -0.00 0.00 -1.23 0.00 0.00 66.70 63.79 2fel h VAL 76 Cb -0.03 2.22 -0.01 0.00 -2.13 0.00 0.00 31.29 31.33 2fel h VAL 76 CO -0.05 0.35 0.13 0.00 -1.23 0.00 0.00 177.57 176.77 2fel h ALA 77 N 1.58 0.27 -0.07 5.19 0.00 -1.20 0.11 119.26 125.13 2fel h ALA 77 Ca -0.04 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2fel h ALA 77 Cb 1.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2fel h ALA 77 CO 0.05 -0.23 -0.36 -0.22 0.00 0.00 0.00 179.25 178.49 2fel h LYS 78 N 0.27 0.38 0.00 0.00 3.64 -1.13 -3.39 116.57 116.32 2fel h LYS 78 Ca 0.08 -0.30 -0.07 0.00 -1.27 0.00 0.00 60.65 59.08 2fel h LYS 78 Cb 0.01 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2fel h LYS 78 CO -0.01 0.94 -1.88 -0.25 -2.27 0.00 0.00 179.45 175.98 2fel n ASP 79 N -4.38 0.97 0.00 4.20 8.00 0.32 -4.99 116.55 120.65 2fel n ASP 79 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 2fel n ASP 79 Cb 0.52 1.60 0.00 0.00 -0.02 0.00 0.00 41.12 43.22 2fel n ASP 79 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fel n GLY 80 N 1.61 0.58 3.28 0.44 0.00 0.36 -5.01 105.19 106.46 2fel n GLY 80 Ca -0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 2fel n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fel s VAL 81 N -2.22 0.03 0.15 1.61 0.11 -1.26 -4.94 120.40 113.89 2fel s VAL 81 Ca 0.00 -0.27 0.07 0.00 -2.93 0.00 0.00 61.98 58.85 2fel s VAL 81 Cb 0.00 -0.63 -0.17 0.00 -1.53 0.00 0.00 36.38 34.05 2fel s VAL 81 CO 0.00 -0.15 1.35 -0.37 -3.33 0.00 0.00 175.10 172.60 2fel h VAL 82 N 4.00 1.64 -0.19 2.04 -1.51 -1.89 -3.33 116.25 117.01 2fel h VAL 82 Ca -0.28 -3.11 -0.11 0.00 -1.23 0.00 0.00 66.70 61.97 2fel h VAL 82 Cb 1.18 2.69 -0.01 0.00 -2.13 0.00 0.00 31.29 33.01 2fel h VAL 82 CO 0.35 0.89 -0.34 -0.37 -1.23 0.00 0.00 177.57 176.87 2fel h VAL 83 N 0.01 1.29 -0.63 7.19 -1.51 -1.95 -1.72 116.25 118.92 2fel h VAL 83 Ca -0.02 -1.42 0.09 0.00 -1.23 0.00 0.00 66.70 64.13 2fel h VAL 83 Cb 1.63 1.53 -0.07 0.00 -2.13 0.00 0.00 31.29 32.24 2fel h VAL 83 CO 0.12 0.44 0.26 -0.65 -1.23 0.00 0.00 177.57 176.51 2fel h PRO 84 N 0.34 0.44 -0.26 5.19 0.11 -1.95 0.42 132.00 136.29 2fel h PRO 84 Ca 0.04 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 65.96 2fel h PRO 84 Cb 0.77 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.77 2fel h PRO 84 CO 0.06 0.29 -0.50 1.49 -0.21 0.00 0.00 178.00 179.13 2fel h GLU 85 N 0.46 0.71 0.02 1.05 4.57 -1.80 -1.00 114.58 118.58 2fel h GLU 85 Ca 0.32 -0.42 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 2fel h GLU 85 Cb 0.38 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 2fel h GLU 85 CO -0.30 1.04 -0.04 1.25 -1.18 0.00 0.00 179.01 179.79 2fel h LEU 86 N 0.55 -0.10 -1.24 1.64 5.85 -0.65 -1.90 115.31 119.47 2fel h LEU 86 Ca 0.02 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.78 2fel h LEU 86 Cb 1.06 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2fel h LEU 86 CO 0.10 -0.06 0.52 0.40 -0.34 0.00 0.00 178.44 179.07 2fel h ILE 87 N -0.07 1.16 -0.35 4.05 1.08 -0.13 -0.68 117.51 122.57 2fel h ILE 87 Ca 0.01 -0.35 -0.00 0.00 -0.39 0.00 0.00 64.86 64.12 2fel h ILE 87 Cb 0.08 0.05 -0.02 0.00 -3.07 0.00 0.00 36.82 33.87 2fel h ILE 87 CO -0.02 0.19 0.20 -0.09 -0.69 0.00 0.00 178.15 177.74 2fel h ARG 88 N 1.02 0.48 -0.65 2.37 2.43 -0.96 -1.06 114.38 118.01 2fel h ARG 88 Ca 0.30 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.36 2fel h ARG 88 Cb -0.04 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 2fel h ARG 88 CO -0.08 0.38 0.14 1.96 -1.51 0.00 0.00 179.97 180.87 2fel h GLN 89 N 0.45 1.05 -0.52 0.20 4.20 -0.93 -2.96 115.11 116.60 2fel h GLN 89 Ca 0.13 -0.26 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 2fel h GLN 89 Cb 0.03 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2fel h GLN 89 CO -0.02 0.95 0.14 0.52 -0.67 0.00 0.00 178.83 179.75 2fel h MET 90 N 0.97 0.81 -0.92 1.46 2.86 -0.86 -2.47 114.93 116.78 2fel h MET 90 Ca 0.20 -0.19 0.13 0.00 -2.06 0.00 0.00 59.70 57.78 2fel h MET 90 Cb 0.38 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.86 2fel h MET 90 CO 0.00 0.77 0.59 0.00 1.06 0.00 0.00 176.91 179.33 2fel h ARG 91 N 0.71 0.79 0.00 1.72 3.08 -1.13 0.11 114.38 119.66 2fel h ARG 91 Ca 0.16 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2fel h ARG 91 Cb 0.31 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2fel h ARG 91 CO -0.00 0.52 -0.09 0.00 -1.07 0.00 0.00 179.97 179.33 2fel h ALA 92 N 1.57 1.11 -0.01 0.04 0.00 -1.28 -1.74 119.26 118.96 2fel h ALA 92 Ca 0.45 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2fel h ALA 92 Cb 0.58 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2fel h ALA 92 CO -0.22 0.11 -0.12 0.00 0.00 0.00 0.00 179.25 179.02 2fel n ALA 93 N -2.19 2.82 -3.04 0.00 0.00 0.01 -4.83 120.51 113.28 2fel n ALA 93 Ca -0.01 -0.40 -0.34 0.00 0.00 0.00 0.00 53.44 52.69 2fel n ALA 93 Cb 0.27 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.41 2fel n ALA 93 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2fel s VAL 94 N -2.27 3.84 0.27 0.00 1.01 -0.65 -4.55 120.40 118.05 2fel s VAL 94 Ca 0.31 -0.37 -0.21 0.00 0.00 0.00 0.00 61.98 61.72 2fel s VAL 94 Cb 0.20 -2.70 -0.09 0.00 0.00 0.00 0.00 36.38 33.79 2fel s VAL 94 CO 0.43 0.47 0.80 0.00 0.00 0.00 0.00 175.10 176.80 2fel s ALA 95 N 0.62 3.32 0.00 5.51 0.00 -1.26 -4.56 121.76 125.40 2fel s ALA 95 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2fel s ALA 95 Cb -0.14 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.04 2fel s ALA 95 CO 0.02 0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.47 2fel n GLY 96 N 0.46 -1.78 0.00 0.00 0.00 -1.26 -4.08 105.19 98.53 2fel n GLY 96 Ca 0.00 -1.36 0.14 0.00 0.00 0.00 0.00 46.02 44.80 2fel n GLY 96 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2fel n GLN 97 N -0.07 0.75 0.25 1.61 6.02 -1.26 -2.70 117.38 121.97 2fel n GLN 97 Ca 0.00 0.01 0.13 0.00 -0.01 0.00 0.00 57.00 57.13 2fel n GLN 97 Cb 0.00 -1.50 0.51 0.00 1.02 0.00 0.00 30.24 30.27 2fel n GLN 97 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2fel h ALA 98 N 3.63 1.00 -0.25 -1.58 0.00 -1.89 -2.84 119.26 117.32 2fel h ALA 98 Ca 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2fel h ALA 98 Cb 0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2fel h ALA 98 CO 0.00 0.12 0.12 0.00 0.00 0.00 0.00 179.25 179.49 2fel h ALA 99 N 1.90 1.75 0.00 0.00 0.00 -1.70 -0.74 119.26 120.48 2fel h ALA 99 Ca -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2fel h ALA 99 Cb 0.69 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2fel h ALA 99 CO 0.01 0.21 -0.01 -0.44 0.00 0.00 0.00 179.25 179.02 2fel h ASP 100 N 0.34 0.00 -0.01 0.00 3.32 -1.73 -3.18 116.42 115.16 2fel h ASP 100 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2fel h ASP 100 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2fel h ASP 100 CO -0.01 0.01 -0.60 0.29 -1.72 0.00 0.00 179.24 177.20 2fel n LYS 101 N -3.17 1.01 -2.03 3.56 5.02 -0.29 -4.84 118.16 117.41 2fel n LYS 101 Ca -0.02 -0.68 -0.41 0.00 -2.02 0.00 0.00 58.31 55.18 2fel n LYS 101 Cb 0.15 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.69 2fel n LYS 101 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2fel s VAL 102 N -2.54 2.60 0.00 -0.18 -7.23 -1.18 -2.76 120.40 109.11 2fel s VAL 102 Ca 0.15 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.88 2fel s VAL 102 Cb 0.17 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 33.75 2fel s VAL 102 CO 0.63 0.12 0.00 1.57 -0.31 0.00 0.00 175.10 177.11 2fel n HIS 103 N 1.25 0.00 -1.68 2.82 -0.00 -1.26 -4.96 115.22 111.38 2fel n HIS 103 Ca 0.02 0.00 -0.44 0.00 -0.00 0.00 0.00 57.72 57.31 2fel n HIS 103 Cb 0.41 -0.30 -0.03 0.00 -0.00 0.00 0.00 29.99 30.07 2fel n HIS 103 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2fel n PHE 104 N -2.59 2.53 -0.16 1.57 -0.00 -1.11 -1.43 117.46 116.27 2fel n PHE 104 Ca 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 2fel n PHE 104 Cb 0.06 -2.70 0.00 0.00 -0.00 0.00 0.00 39.48 36.84 2fel n PHE 104 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2fel n GLY 105 N 4.16 1.91 3.83 7.13 0.00 -1.26 -5.02 105.19 115.95 2fel n GLY 105 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 2fel n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fel s ALA 106 N -2.89 3.66 0.46 4.61 0.00 -0.52 -3.82 121.76 123.26 2fel s ALA 106 Ca 0.00 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.83 2fel s ALA 106 Cb 0.00 -1.46 -0.05 0.00 0.00 0.00 0.00 23.12 21.61 2fel s ALA 106 CO 0.00 0.51 0.01 -0.08 0.00 0.00 0.00 175.76 176.20 2fel s THR 107 N -1.75 1.60 0.29 0.00 -1.32 -1.26 -4.73 115.64 108.47 2fel s THR 107 Ca 0.32 -1.99 -0.01 0.00 -1.21 0.00 0.00 61.69 58.79 2fel s THR 107 Cb -0.10 -2.60 0.19 0.00 -1.51 0.00 0.00 72.50 68.48 2fel s THR 107 CO 0.25 0.00 1.87 0.28 -2.21 0.00 0.00 174.62 174.81 2fel h SER 108 N 1.56 0.82 0.25 8.08 0.02 -1.97 -2.71 113.55 119.59 2fel h SER 108 Ca -0.44 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.32 2fel h SER 108 Cb 1.28 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2fel h SER 108 CO 0.78 0.73 -0.34 -0.61 -1.14 0.00 0.00 176.83 176.24 2fel h GLN 109 N 0.89 0.15 -0.21 3.45 4.15 -1.97 -1.91 115.11 119.66 2fel h GLN 109 Ca 0.21 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.63 2fel h GLN 109 Cb 0.16 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 2fel h GLN 109 CO -0.02 0.48 -0.15 -0.44 -1.93 0.00 0.00 178.83 176.77 2fel h ASP 110 N 0.13 -0.50 0.94 -0.69 3.32 -1.71 -0.69 116.42 117.23 2fel h ASP 110 Ca 0.02 0.10 -0.22 0.00 0.02 0.00 0.00 57.03 56.95 2fel h ASP 110 Cb 0.67 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 2fel h ASP 110 CO 0.05 -0.19 -1.04 -0.37 -1.72 0.00 0.00 179.24 175.96 2fel h VAL 111 N -0.15 1.68 -0.22 -1.35 -1.51 -1.49 -2.66 116.25 110.55 2fel h VAL 111 Ca 0.12 -3.37 -0.16 0.00 -1.23 0.00 0.00 66.70 62.06 2fel h VAL 111 Cb 0.34 2.86 0.00 0.00 -2.13 0.00 0.00 31.29 32.36 2fel h VAL 111 CO -0.30 0.96 -0.50 0.40 -1.23 0.00 0.00 177.57 176.91 2fel h ILE 112 N 0.01 1.31 0.01 7.19 2.04 -1.33 -2.22 117.51 124.52 2fel h ILE 112 Ca -0.03 -1.71 -0.20 0.00 1.00 0.00 0.00 64.86 63.92 2fel h ILE 112 Cb 1.80 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 39.69 2fel h ILE 112 CO 0.14 0.54 -0.89 0.44 0.00 0.00 0.00 178.15 178.38 2fel h ASP 113 N 0.44 0.21 -0.26 1.72 3.32 -1.19 -2.44 116.42 118.23 2fel h ASP 113 Ca -0.00 -0.18 -0.18 0.00 0.02 0.00 0.00 57.03 56.69 2fel h ASP 113 Cb 1.11 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2fel h ASP 113 CO 0.11 1.00 -0.53 0.74 -1.72 0.00 0.00 179.24 178.84 2fel h THR 114 N 0.08 1.29 -0.74 0.35 2.02 -1.53 -0.49 112.91 113.90 2fel h THR 114 Ca -0.04 -1.72 0.02 0.00 0.77 0.00 0.00 66.41 65.44 2fel h THR 114 Cb 1.54 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 69.62 2fel h THR 114 CO 0.13 0.55 0.49 -1.28 0.37 0.00 0.00 175.52 175.79 2fel h SER 115 N 0.57 0.82 -0.33 4.18 0.87 -1.42 -0.37 113.55 117.87 2fel h SER 115 Ca 0.01 -0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.45 2fel h SER 115 Cb 1.14 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 2fel h SER 115 CO 0.12 0.58 -0.20 0.25 -0.53 0.00 0.00 176.83 177.05 2fel h LEU 116 N 0.96 0.75 -0.58 2.23 5.85 -0.96 -2.63 115.31 120.93 2fel h LEU 116 Ca 0.28 -0.42 -0.13 0.00 0.84 0.00 0.00 57.88 58.45 2fel h LEU 116 Cb -0.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 2fel h LEU 116 CO -0.07 1.01 -0.26 0.24 -0.34 0.00 0.00 178.44 179.02 2fel h MET 117 N 0.50 0.85 -0.54 1.25 2.86 -0.74 0.23 114.93 119.33 2fel h MET 117 Ca 0.07 -0.37 0.05 0.00 -2.06 0.00 0.00 59.70 57.39 2fel h MET 117 Cb 0.75 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.34 2fel h MET 117 CO 0.06 1.01 0.28 -0.07 1.06 0.00 0.00 176.91 179.24 2fel h LEU 118 N 0.73 0.40 0.08 1.22 3.38 -1.05 -1.46 115.31 118.59 2fel h LEU 118 Ca 0.09 0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.84 2fel h LEU 118 Cb 0.81 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2fel h LEU 118 CO 0.07 0.27 -1.15 0.03 0.09 0.00 0.00 178.44 177.74 2fel h ARG 119 N 0.53 0.16 -0.14 1.13 3.08 -1.23 -2.90 114.38 115.01 2fel h ARG 119 Ca 0.24 -0.27 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 2fel h ARG 119 Cb 0.15 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2fel h ARG 119 CO -0.17 1.13 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.59 2fel h LEU 120 N 0.04 0.22 -0.24 3.04 3.38 -0.53 -1.61 115.31 119.62 2fel h LEU 120 Ca -0.09 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2fel h LEU 120 Cb 1.89 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.57 2fel h LEU 120 CO 0.17 0.44 0.08 0.50 0.09 0.00 0.00 178.44 179.72 2fel h LYS 121 N 0.22 0.37 -0.24 1.13 3.64 -1.21 0.47 116.57 120.95 2fel h LYS 121 Ca 0.04 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 2fel h LYS 121 Cb 0.47 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 2fel h LYS 121 CO 0.03 0.43 -0.10 0.52 -2.27 0.00 0.00 179.45 178.06 2fel h MET 122 N 0.22 -0.07 -0.78 1.90 2.86 -1.31 -1.78 114.93 115.98 2fel h MET 122 Ca 0.08 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 2fel h MET 122 Cb 0.22 0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 2fel h MET 122 CO -0.00 -0.05 0.43 0.00 1.06 0.00 0.00 176.91 178.35 2fel h ALA 123 N 1.14 1.28 -0.41 6.32 0.00 -1.18 -2.32 119.26 124.10 2fel h ALA 123 Ca 0.12 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2fel h ALA 123 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2fel h ALA 123 CO -0.28 0.58 0.12 0.00 0.00 0.00 0.00 179.25 179.67 2fel h ALA 124 N 1.38 1.46 -0.31 0.00 0.00 -0.54 -0.10 119.26 121.15 2fel h ALA 124 Ca 0.27 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 2fel h ALA 124 Cb 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2fel h ALA 124 CO -0.04 0.40 -0.33 0.93 0.00 0.00 0.00 179.25 180.21 2fel h GLU 125 N 0.58 0.68 -0.01 0.00 5.08 -0.80 -1.42 114.58 118.69 2fel h GLU 125 Ca 0.14 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2fel h GLU 125 Cb 0.18 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2fel h GLU 125 CO -0.01 0.91 -0.01 0.82 -1.00 0.00 0.00 179.01 179.73 2fel h ILE 126 N 0.57 1.37 -0.70 3.13 2.04 -1.06 -2.60 117.51 120.26 2fel h ILE 126 Ca 0.06 -1.11 0.02 0.00 1.00 0.00 0.00 64.86 64.83 2fel h ILE 126 Cb 0.84 2.11 -0.04 0.00 -0.74 0.00 0.00 36.82 38.99 2fel h ILE 126 CO 0.07 0.29 0.45 0.40 0.00 0.00 0.00 178.15 179.36 2fel h ILE 127 N -0.44 1.13 -1.00 -0.67 2.04 -1.05 -0.80 117.51 116.71 2fel h ILE 127 Ca 0.00 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2fel h ILE 127 Cb 0.48 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 2fel h ILE 127 CO 0.00 0.16 0.66 0.00 0.00 0.00 0.00 178.15 178.98 2fel h ALA 128 N 1.28 1.29 -0.25 1.87 0.00 -1.30 -0.55 119.26 121.59 2fel h ALA 128 Ca 0.27 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2fel h ALA 128 Cb -0.04 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.35 2fel h ALA 128 CO -0.08 0.64 -0.31 1.15 0.00 0.00 0.00 179.25 180.64 2fel h THR 129 N 1.34 1.31 -0.20 0.00 2.02 -1.03 -1.96 112.91 114.39 2fel h THR 129 Ca 0.38 -1.50 -0.10 0.00 0.77 0.00 0.00 66.41 65.96 2fel h THR 129 Cb -0.12 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2fel h THR 129 CO -0.09 0.47 -0.33 0.03 0.37 0.00 0.00 175.52 175.97 2fel h ARG 130 N 0.38 0.41 -0.28 6.66 3.08 -0.91 -1.00 114.38 122.72 2fel h ARG 130 Ca 0.03 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2fel h ARG 130 Cb 0.89 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 2fel h ARG 130 CO 0.07 0.69 0.10 1.25 -1.07 0.00 0.00 179.97 181.01 2fel h LEU 131 N 0.35 0.40 -0.53 3.04 5.85 -1.08 -0.53 115.31 122.80 2fel h LEU 131 Ca 0.04 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.58 2fel h LEU 131 Cb 0.75 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 2fel h LEU 131 CO 0.06 0.48 0.35 1.23 -0.34 0.00 0.00 178.44 180.22 2fel h GLY 132 N 0.30 0.75 0.96 3.75 0.00 -1.00 -1.12 103.07 106.71 2fel h GLY 132 Ca 0.09 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 2fel h GLY 132 CO -0.00 0.26 0.13 0.84 0.00 0.00 0.00 176.54 177.76 2fel h HIS 133 N 0.71 0.77 -0.37 5.60 -0.00 -1.07 -2.87 115.15 117.91 2fel h HIS 133 Ca 0.20 -0.09 -0.09 0.00 -0.00 0.00 0.00 60.37 60.39 2fel h HIS 133 Cb -0.06 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.11 2fel h HIS 133 CO -0.04 0.69 -0.15 1.25 -0.00 0.00 0.00 177.93 179.68 2fel h LEU 134 N 0.62 0.66 -0.58 0.26 5.85 -0.91 -1.30 115.31 119.91 2fel h LEU 134 Ca 0.15 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.71 2fel h LEU 134 Cb 0.30 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2fel h LEU 134 CO -0.00 0.82 0.32 0.40 -0.34 0.00 0.00 178.44 179.65 2fel h ILE 135 N 0.60 0.99 -0.18 4.05 2.04 -1.14 -0.03 117.51 123.84 2fel h ILE 135 Ca 0.10 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2fel h ILE 135 Cb 0.60 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2fel h ILE 135 CO 0.04 0.11 0.09 0.44 0.00 0.00 0.00 178.15 178.83 2fel h ASP 136 N 0.62 0.23 -0.49 1.72 3.32 -1.26 0.21 116.42 120.77 2fel h ASP 136 Ca 0.25 -0.11 0.06 0.00 0.02 0.00 0.00 57.03 57.25 2fel h ASP 136 Cb 0.12 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.56 2fel h ASP 136 CO -0.15 0.28 0.20 0.74 -1.72 0.00 0.00 179.24 178.60 2fel h THR 137 N 0.17 0.88 0.00 0.35 2.02 -0.91 0.92 112.91 116.34 2fel h THR 137 Ca 0.06 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 2fel h THR 137 Cb 0.10 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2fel h THR 137 CO -0.01 0.07 -0.53 -0.07 0.37 0.00 0.00 175.52 175.36 2fel h LEU 138 N 0.40 0.00 -0.60 2.58 4.07 -0.96 -1.40 115.31 119.40 2fel h LEU 138 Ca 0.23 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 58.08 2fel h LEU 138 Cb 0.20 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 2fel h LEU 138 CO -0.20 0.53 -0.10 1.23 -1.08 0.00 0.00 178.44 178.81 2fel h GLY 139 N 1.95 1.09 2.00 0.83 0.00 -0.18 -2.62 103.07 106.14 2fel h GLY 139 Ca -0.01 -0.87 -0.08 0.00 0.00 0.00 0.00 47.33 46.38 2fel h GLY 139 CO 0.07 0.79 -0.36 -0.55 0.00 0.00 0.00 176.54 176.49 2fel h ASP 140 N 0.89 0.00 -0.54 0.19 3.32 -0.40 -0.42 116.42 119.46 2fel h ASP 140 Ca 0.14 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 2fel h ASP 140 Cb 0.66 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 2fel h ASP 140 CO 0.05 0.36 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.82 2fel h LEU 141 N 0.00 0.97 -0.26 1.55 3.38 -1.11 -2.76 115.31 117.08 2fel h LEU 141 Ca -0.00 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 2fel h LEU 141 Cb 0.75 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2fel h LEU 141 CO 0.05 1.06 -0.40 0.00 0.09 0.00 0.00 178.44 179.23 2fel h ALA 142 N 0.95 0.78 0.05 1.53 0.00 -1.13 -2.87 119.26 118.58 2fel h ALA 142 Ca 0.15 -0.37 -0.24 0.00 0.00 0.00 0.00 54.91 54.45 2fel h ALA 142 Cb 0.58 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2fel h ALA 142 CO 0.03 0.51 -1.13 0.66 0.00 0.00 0.00 179.25 179.32 2fel h SER 143 N 0.00 0.18 -0.01 0.00 4.64 -1.09 -0.38 113.55 116.89 2fel h SER 143 Ca -0.00 -0.20 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2fel h SER 143 Cb 1.21 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2fel h SER 143 CO 0.05 1.16 -0.00 -0.09 -0.87 0.00 0.00 176.83 177.08 2fel h ARG 144 N 0.03 0.01 -0.04 4.77 2.43 -1.51 -3.37 114.38 116.71 2fel h ARG 144 Ca -0.07 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2fel h ARG 144 Cb 1.87 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.41 2fel h ARG 144 CO 0.16 0.40 0.00 -0.25 -1.51 0.00 0.00 179.97 178.77 2fel n ASP 145 N -4.89 2.27 0.28 -3.80 8.00 -1.08 -4.84 116.55 112.47 2fel n ASP 145 Ca -0.08 -2.41 0.16 0.00 0.71 0.00 0.00 54.79 53.17 2fel n ASP 145 Cb 0.21 -0.19 0.75 0.00 -0.02 0.00 0.00 41.12 41.87 2fel n ASP 145 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2fel h GLY 146 N 0.22 0.00 -0.34 0.44 0.00 -1.23 -2.09 103.07 100.07 2fel h GLY 146 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2fel h GLY 146 CO 0.01 0.00 -0.15 1.42 0.00 0.00 0.00 176.54 177.82 2fel n HIS 147 N -3.26 0.00 -2.46 5.60 8.25 -1.26 -1.70 115.22 120.39 2fel n HIS 147 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 2fel n HIS 147 Cb 0.27 -0.05 -0.04 0.00 1.12 0.00 0.00 29.99 31.29 2fel n HIS 147 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2fel s LYS 148 N -2.26 4.59 0.52 -0.41 1.02 -0.78 -4.83 119.74 117.59 2fel s LYS 148 Ca 0.29 1.80 -0.22 0.00 0.02 0.00 0.00 55.97 57.87 2fel s LYS 148 Cb 0.20 -3.22 -0.06 0.00 -0.52 0.00 0.00 37.83 34.23 2fel s LYS 148 CO 0.43 0.10 1.25 -1.25 -0.92 0.00 0.00 175.35 174.96 2fel s PRO 149 N -0.89 3.36 0.03 -1.68 0.04 -1.26 -1.04 135.00 133.56 2fel s PRO 149 Ca 0.48 1.96 0.03 0.00 0.04 0.00 0.00 61.00 63.51 2fel s PRO 149 Cb -0.32 -2.25 -0.02 0.00 0.04 0.00 0.00 34.50 31.96 2fel s PRO 149 CO 0.39 -0.93 -0.10 -0.51 0.04 0.00 0.00 177.00 175.89 2fel s LEU 150 N -3.44 2.17 -0.22 -3.56 1.43 0.07 -2.86 118.68 112.28 2fel s LEU 150 Ca 0.70 -0.42 -0.29 0.00 -1.03 0.00 0.00 54.13 53.09 2fel s LEU 150 Cb -0.33 -0.35 0.01 0.00 0.03 0.00 0.00 46.19 45.54 2fel s LEU 150 CO 0.39 -0.06 1.09 -0.89 0.23 0.00 0.00 176.35 177.11 2fel s THR 151 N -0.91 4.59 0.57 5.49 2.01 -1.26 -0.91 115.64 125.22 2fel s THR 151 Ca -0.03 1.92 -0.19 0.00 0.31 0.00 0.00 61.69 63.70 2fel s THR 151 Cb -0.07 -4.25 -0.05 0.00 0.01 0.00 0.00 72.50 68.14 2fel s THR 151 CO 0.01 -0.18 1.14 -0.83 -0.69 0.00 0.00 174.62 174.07 2fel s GLY 152 N 1.38 2.59 -0.11 4.40 0.00 -0.78 -4.88 107.32 109.92 2fel s GLY 152 Ca 0.46 0.83 -0.04 0.00 0.00 0.00 0.00 44.72 45.97 2fel s GLY 152 CO 0.08 1.19 0.08 -0.19 0.00 0.00 0.00 173.10 174.26 2fel s TYR 153 N -1.81 0.13 -0.09 1.90 2.02 -1.26 0.65 117.35 118.89 2fel s TYR 153 Ca 0.73 -0.05 0.04 0.00 -0.37 0.00 0.00 57.07 57.43 2fel s TYR 153 Cb -0.25 -0.59 -0.00 0.00 -0.40 0.00 0.00 41.96 40.72 2fel s TYR 153 CO 0.30 -0.36 -0.23 0.95 -1.57 0.00 0.00 175.55 174.64 2fel s THR 154 N 2.15 1.95 -1.41 -0.71 -4.23 -0.14 -4.76 115.64 108.50 2fel s THR 154 Ca 0.03 -0.97 -0.00 0.00 -1.18 0.00 0.00 61.69 59.57 2fel s THR 154 Cb -0.14 -1.68 0.00 0.00 1.34 0.00 0.00 72.50 72.01 2fel s THR 154 CO -0.06 0.54 0.41 0.54 -0.54 0.00 0.00 174.62 175.50 2fel n ARG 155 N 3.43 -3.19 -2.28 3.99 1.74 -1.26 -1.81 116.66 117.27 2fel n ARG 155 Ca -0.19 0.40 -0.20 0.00 -0.77 0.00 0.00 57.85 57.09 2fel n ARG 155 Cb 0.53 -4.49 -0.02 0.00 -1.02 0.00 0.00 32.46 27.46 2fel n ARG 155 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2fel n MET 156 N -4.40 -1.57 -4.07 5.56 2.81 -1.26 -5.00 117.12 109.19 2fel n MET 156 Ca -0.31 0.99 -0.13 0.00 -1.81 0.00 0.00 57.70 56.44 2fel n MET 156 Cb 0.69 -5.57 -0.12 0.00 -0.71 0.00 0.00 33.22 27.50 2fel n MET 156 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2fel s GLN 157 N -4.84 0.45 0.19 0.03 -1.52 -0.75 -5.13 119.66 108.09 2fel s GLN 157 Ca 0.00 -0.54 -0.33 0.00 -1.95 0.00 0.00 55.36 52.54 2fel s GLN 157 Cb 0.00 -0.28 -0.13 0.00 -0.22 0.00 0.00 33.01 32.38 2fel s GLN 157 CO 0.00 0.06 1.66 0.00 -0.25 0.00 0.00 175.29 176.76 2fel n ALA 158 N 1.99 2.23 -2.35 6.09 0.00 -1.26 -0.97 120.51 126.24 2fel n ALA 158 Ca -0.19 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2fel n ALA 158 Cb 0.56 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2fel n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fel n ALA 159 N 3.68 0.00 -1.47 0.00 0.00 0.21 -4.79 120.51 118.15 2fel n ALA 159 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.31 2fel n ALA 159 Cb 0.32 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.89 2fel n ALA 159 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2fel s ILE 160 N 1.76 2.74 0.33 0.00 -4.36 -1.26 -4.39 121.20 116.02 2fel s ILE 160 Ca 0.00 0.24 -0.27 0.00 -0.26 0.00 0.00 60.65 60.36 2fel s ILE 160 Cb 0.00 -2.93 -0.09 0.00 1.25 0.00 0.00 42.46 40.69 2fel s ILE 160 CO 0.00 -0.31 1.11 -0.83 0.24 0.00 0.00 174.94 175.15 2fel s GLY 161 N -3.82 2.95 0.05 6.27 0.00 -1.26 -1.86 107.32 109.65 2fel s GLY 161 Ca 0.62 0.88 0.00 0.00 0.00 0.00 0.00 44.72 46.23 2fel s GLY 161 CO 0.55 1.43 0.02 0.29 0.00 0.00 0.00 173.10 175.38 2fel n ILE 162 N 0.66 0.00 -3.65 0.90 -5.35 -0.08 -4.83 119.36 107.00 2fel n ILE 162 Ca 0.01 -0.29 -0.21 0.00 -0.27 0.00 0.00 62.75 61.99 2fel n ILE 162 Cb 0.46 0.10 -0.04 0.00 -1.74 0.00 0.00 39.64 38.42 2fel n ILE 162 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2fel s THR 163 N -1.65 2.64 0.31 7.28 -4.23 -1.26 -0.75 115.64 117.99 2fel s THR 163 Ca 0.02 -1.40 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 2fel s THR 163 Cb 0.00 -3.00 0.20 0.00 1.34 0.00 0.00 72.50 71.04 2fel s THR 163 CO 0.02 -0.01 1.91 0.58 -0.54 0.00 0.00 174.62 176.58 2fel h VAL 164 N 1.10 1.20 0.00 2.29 2.07 -1.08 -2.80 116.25 119.02 2fel h VAL 164 Ca -0.42 -0.59 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 2fel h VAL 164 Cb 1.26 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2fel h VAL 164 CO 0.59 0.24 -0.24 0.00 0.02 0.00 0.00 177.57 178.18 2fel h ALA 165 N 1.47 1.10 -0.09 1.67 0.00 -1.60 0.68 119.26 122.48 2fel h ALA 165 Ca 0.20 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2fel h ALA 165 Cb 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2fel h ALA 165 CO -0.02 0.30 -0.02 -0.44 0.00 0.00 0.00 179.25 179.07 2fel h ASP 166 N 0.00 0.18 -0.23 0.00 3.32 -1.77 -2.69 116.42 115.24 2fel h ASP 166 Ca -0.00 -0.37 -0.20 0.00 0.02 0.00 0.00 57.03 56.48 2fel h ASP 166 Cb 0.67 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2fel h ASP 166 CO 0.03 0.51 -0.62 -0.09 -1.72 0.00 0.00 179.24 177.35 2fel h ARG 167 N -0.14 0.83 0.00 3.56 9.65 -1.40 -3.21 114.38 123.67 2fel h ARG 167 Ca 0.02 -0.58 -0.02 0.00 -1.10 0.00 0.00 59.98 58.29 2fel h ARG 167 Cb 0.43 0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 29.10 2fel h ARG 167 CO 0.01 1.21 -0.12 0.00 2.80 0.00 0.00 179.97 183.87 2fel h ALA 168 N 0.62 1.57 -0.00 2.80 0.00 -0.94 -2.59 119.26 120.72 2fel h ALA 168 Ca -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2fel h ALA 168 Cb 1.24 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 2fel h ALA 168 CO 0.13 0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.48 2fel h ALA 169 N 1.88 1.91 0.00 0.00 0.00 -1.47 0.30 119.26 121.87 2fel h ALA 169 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2fel h ALA 169 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2fel h ALA 169 CO 0.02 0.07 0.00 0.78 0.00 0.00 0.00 179.25 180.12 2fel h GLY 170 N 0.17 0.00 0.07 0.00 0.00 -1.60 -0.41 103.07 101.31 2fel h GLY 170 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 2fel h GLY 170 CO 0.01 0.00 -1.26 1.49 0.00 0.00 0.00 176.54 176.77 2fel h TRP 171 N 0.00 0.06 0.07 5.60 6.55 -1.21 -3.41 115.95 123.61 2fel h TRP 171 Ca 0.00 -0.04 -0.00 0.00 0.95 0.00 0.00 58.89 59.79 2fel h TRP 171 Cb 0.59 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.88 2fel h TRP 171 CO 0.00 1.49 -0.04 0.82 -1.05 0.00 0.00 178.44 179.67 2fel h ILE 172 N -0.88 1.18 -0.54 1.49 2.04 -1.00 -3.31 117.51 116.48 2fel h ILE 172 Ca -0.34 -0.97 0.03 0.00 1.00 0.00 0.00 64.86 64.58 2fel h ILE 172 Cb 1.37 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 39.21 2fel h ILE 172 CO -0.17 0.24 0.32 0.00 0.00 0.00 0.00 178.15 178.54 2fel h ALA 173 N 0.32 0.70 -0.31 1.87 0.00 -1.31 -2.13 119.26 118.41 2fel h ALA 173 Ca -0.01 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2fel h ALA 173 Cb 0.47 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2fel h ALA 173 CO 0.02 0.01 -0.14 -1.35 0.00 0.00 0.00 179.25 177.79 2fel h PRO 174 N 0.62 0.53 -0.50 0.00 0.11 -1.76 -2.69 132.00 128.30 2fel h PRO 174 Ca 0.23 -0.16 0.01 0.00 0.11 0.00 0.00 66.00 66.18 2fel h PRO 174 Cb 0.06 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.09 2fel h PRO 174 CO -0.11 0.66 0.33 -0.07 -0.21 0.00 0.00 178.00 178.60 2fel h LEU 175 N 0.49 0.57 -0.63 2.35 3.38 -1.52 -0.27 115.31 119.67 2fel h LEU 175 Ca 0.09 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 2fel h LEU 175 Cb 0.52 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2fel h LEU 175 CO 0.03 0.41 -0.23 -0.33 0.09 0.00 0.00 178.44 178.41 2fel h GLU 176 N 0.67 0.83 -0.42 1.13 5.08 -1.17 -0.83 114.58 119.86 2fel h GLU 176 Ca 0.19 -0.35 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 2fel h GLU 176 Cb -0.06 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2fel h GLU 176 CO -0.04 0.98 -0.08 0.00 -1.00 0.00 0.00 179.01 178.86 2fel h ARG 177 N 0.72 0.74 -0.16 2.33 3.08 -1.08 -2.73 114.38 117.27 2fel h ARG 177 Ca 0.09 -0.23 -0.16 0.00 0.07 0.00 0.00 59.98 59.75 2fel h ARG 177 Cb 0.76 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 2fel h ARG 177 CO 0.06 0.81 -0.58 0.45 -1.07 0.00 0.00 179.97 179.64 2fel h HIS 178 N 0.68 0.64 -0.39 3.04 3.86 -0.66 -0.79 115.15 121.52 2fel h HIS 178 Ca 0.12 -0.24 0.04 0.00 -1.16 0.00 0.00 60.37 59.14 2fel h HIS 178 Cb 0.54 -0.12 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 2fel h HIS 178 CO 0.03 0.96 0.14 1.25 0.86 0.00 0.00 177.93 181.17 2fel h LEU 179 N 0.38 0.16 -0.72 2.43 6.46 -1.14 -0.12 115.31 122.77 2fel h LEU 179 Ca 0.00 0.04 -0.12 0.00 -0.12 0.00 0.00 57.88 57.68 2fel h LEU 179 Cb 1.12 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.06 2fel h LEU 179 CO 0.11 0.13 -0.29 0.25 -0.62 0.00 0.00 178.44 178.02 2fel h LEU 180 N 0.31 0.69 -0.41 2.25 5.85 -1.31 -1.75 115.31 120.93 2fel h LEU 180 Ca 0.18 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2fel h LEU 180 Cb 0.15 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 2fel h LEU 180 CO -0.18 0.94 0.27 0.03 -0.34 0.00 0.00 178.44 179.16 2fel h ARG 181 N 0.58 0.55 0.05 1.25 3.08 -0.84 -1.65 114.38 117.40 2fel h ARG 181 Ca 0.07 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2fel h ARG 181 Cb 0.78 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.71 2fel h ARG 181 CO 0.06 0.38 -0.02 1.25 -1.07 0.00 0.00 179.97 180.57 2fel h LEU 182 N 0.55 -0.05 -1.04 3.04 6.46 -0.86 -0.20 115.31 123.21 2fel h LEU 182 Ca 0.15 -0.12 0.10 0.00 -0.12 0.00 0.00 57.88 57.89 2fel h LEU 182 Cb -0.04 0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 39.82 2fel h LEU 182 CO -0.03 0.09 0.63 -0.33 -0.62 0.00 0.00 178.44 178.18 2fel h GLU 183 N -0.19 1.01 -0.28 1.25 5.08 -1.28 0.11 114.58 120.28 2fel h GLU 183 Ca -0.01 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 2fel h GLU 183 Cb 0.17 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2fel h GLU 183 CO 0.01 0.67 -0.19 1.15 -1.00 0.00 0.00 179.01 179.64 2fel h THR 184 N 1.04 1.30 -0.37 1.13 2.02 -1.12 -2.91 112.91 113.99 2fel h THR 184 Ca 0.47 -1.32 0.01 0.00 0.77 0.00 0.00 66.41 66.34 2fel h THR 184 Cb 0.39 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 2fel h THR 184 CO -0.23 0.42 0.23 0.15 0.37 0.00 0.00 175.52 176.46 2fel h PHE 185 N 0.36 0.43 0.00 3.16 3.57 -0.39 -2.84 116.94 121.23 2fel h PHE 185 Ca 0.05 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2fel h PHE 185 Cb 0.73 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.33 2fel h PHE 185 CO 0.07 0.26 0.00 0.00 -2.23 0.00 0.00 178.31 176.41 2fel h ALA 186 N 1.15 1.00 0.10 2.41 0.00 -0.77 0.24 119.26 123.39 2fel h ALA 186 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2fel h ALA 186 Cb -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2fel h ALA 186 CO -0.05 0.00 -0.23 1.96 0.00 0.00 0.00 179.25 180.93 2fel h GLN 187 N 0.00 -0.35 -0.00 0.00 4.20 -1.30 -3.38 115.11 114.28 2fel h GLN 187 Ca 0.00 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2fel h GLN 187 Cb 0.17 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2fel h GLN 187 CO 0.00 -0.23 -0.02 0.09 -0.67 0.00 0.00 178.83 177.99 2fel n ASN 188 N -3.75 0.91 0.14 1.46 4.13 -1.21 -4.85 115.26 112.10 2fel n ASN 188 Ca -0.04 -0.96 0.13 0.00 1.68 0.00 0.00 54.58 55.39 2fel n ASN 188 Cb 0.19 0.26 0.45 0.00 -1.54 0.00 0.00 39.78 39.13 2fel n ASN 188 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 2fel h GLY 189 N 0.46 0.00 -7.13 7.41 0.00 -0.70 -3.40 103.07 99.71 2fel h GLY 189 Ca 0.00 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 46.57 2fel h GLY 189 CO 0.00 0.00 -0.22 -1.36 0.00 0.00 0.00 176.54 174.96 2fel s PHE 190 N -3.25 3.28 0.12 5.60 0.08 -1.26 -5.00 117.98 117.54 2fel s PHE 190 Ca 0.07 -1.36 0.05 0.00 0.12 0.00 0.00 56.93 55.81 2fel s PHE 190 Cb 0.10 -3.78 -0.04 0.00 -0.57 0.00 0.00 43.02 38.73 2fel s PHE 190 CO 0.52 -1.02 0.03 0.00 -0.10 0.00 0.00 175.22 174.65 2fel s ALA 191 N 1.53 3.35 0.30 5.36 0.00 -1.26 -0.88 121.76 130.16 2fel s ALA 191 Ca 0.04 -1.18 -0.29 0.00 0.00 0.00 0.00 51.96 50.53 2fel s ALA 191 Cb -0.29 -1.20 -0.10 0.00 0.00 0.00 0.00 23.12 21.53 2fel s ALA 191 CO 0.02 0.62 1.30 -1.17 0.00 0.00 0.00 175.76 176.54 2fel s LEU 192 N -2.59 4.43 -0.36 0.00 2.96 -0.35 -4.79 118.68 117.97 2fel s LEU 192 Ca 0.27 2.62 -0.10 0.00 -0.22 0.00 0.00 54.13 56.70 2fel s LEU 192 Cb -0.11 -3.64 0.03 0.00 0.50 0.00 0.00 46.19 42.97 2fel s LEU 192 CO 0.20 -0.52 0.18 -1.58 -1.32 0.00 0.00 176.35 173.30 2fel s GLN 193 N -1.40 2.77 -0.33 1.98 2.00 -1.26 -4.66 119.66 118.76 2fel s GLN 193 Ca 0.51 -1.10 0.02 0.00 -2.00 0.00 0.00 55.36 52.78 2fel s GLN 193 Cb -0.39 -3.65 0.15 0.00 0.80 0.00 0.00 33.01 29.92 2fel s GLN 193 CO 0.49 -0.69 0.37 0.12 -0.50 0.00 0.00 175.29 175.08 2fel s PHE 194 N 1.51 -0.58 0.00 1.67 5.36 -1.26 -4.49 117.98 120.19 2fel s PHE 194 Ca 0.01 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.67 2fel s PHE 194 Cb -0.19 -0.34 0.00 0.00 -0.34 0.00 0.00 43.02 42.15 2fel s PHE 194 CO 0.06 -0.97 0.00 0.41 -1.46 0.00 0.00 175.22 173.26 2fel n GLY 195 N 4.84 0.08 1.98 13.12 0.00 -1.26 -4.34 105.19 119.60 2fel n GLY 195 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 2fel n GLY 195 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fel n GLY 196 N 1.32 -2.16 0.30 -0.02 0.00 -1.25 -0.58 105.19 102.80 2fel n GLY 196 Ca 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 46.02 44.53 2fel n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fel h ALA 197 N -0.15 0.18 -0.02 4.61 0.00 -1.85 -2.72 119.26 119.31 2fel h ALA 197 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2fel h ALA 197 Cb 0.12 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2fel h ALA 197 CO 0.00 -0.56 -0.23 0.00 0.00 0.00 0.00 179.25 178.47 2fel n ALA 198 N -3.13 3.01 -0.80 0.00 0.00 -1.26 -4.96 120.51 113.37 2fel n ALA 198 Ca 0.06 -2.95 0.00 0.00 0.00 0.00 0.00 53.44 50.55 2fel n ALA 198 Cb 0.35 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2fel n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fel n GLY 199 N -1.25 0.95 0.88 0.00 0.00 -1.03 -4.93 105.19 99.81 2fel n GLY 199 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.29 2fel n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fel n THR 200 N -2.00 0.54 -4.19 2.61 -2.24 -0.91 -4.79 114.28 103.30 2fel n THR 200 Ca 0.00 -0.77 -0.36 0.00 -2.27 0.00 0.00 64.05 60.65 2fel n THR 200 Cb 0.00 0.90 -0.05 0.00 -2.10 0.00 0.00 70.33 69.08 2fel n THR 200 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2fel n LEU 201 N 1.06 -0.88 0.24 3.22 4.77 0.25 -4.84 117.00 120.82 2fel n LEU 201 Ca 0.15 -1.26 0.13 0.00 -0.03 0.00 0.00 56.01 55.00 2fel n LEU 201 Cb 0.49 -1.68 0.45 0.00 -2.33 0.00 0.00 43.42 40.35 2fel n LEU 201 CO 0.12 0.58 0.86 1.05 -1.33 0.00 0.00 177.39 178.67 2fel h GLU 202 N -2.09 0.00 -0.10 3.23 9.09 -1.90 -3.01 114.58 119.80 2fel h GLU 202 Ca -0.68 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 58.61 2fel h GLU 202 Cb 1.40 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.49 2fel h GLU 202 CO 0.63 0.10 -0.48 0.87 0.05 0.00 0.00 179.01 180.18 2fel h LYS 203 N 0.00 0.26 0.00 1.06 1.79 -1.90 -3.29 116.57 114.50 2fel h LYS 203 Ca -0.00 -0.15 -0.17 0.00 -2.18 0.00 0.00 60.65 58.15 2fel h LYS 203 Cb 0.76 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.39 2fel h LYS 203 CO 0.01 0.69 -1.14 -0.07 -1.08 0.00 0.00 179.45 177.86 2fel h LEU 204 N 0.21 0.00 0.00 2.94 3.38 -1.89 -3.49 115.31 116.46 2fel h LEU 204 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2fel h LEU 204 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2fel h LEU 204 CO 0.08 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.88 2fel n GLY 205 N 1.36 1.98 0.08 0.83 0.00 -1.21 -2.58 105.19 105.66 2fel n GLY 205 Ca -0.06 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.67 2fel n GLY 205 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fel n ASP 206 N 7.29 0.57 -0.68 1.61 8.00 -1.26 -3.28 116.55 128.79 2fel n ASP 206 Ca 0.00 0.58 0.09 0.00 0.71 0.00 0.00 54.79 56.17 2fel n ASP 206 Cb 0.00 -0.72 0.28 0.00 -0.02 0.00 0.00 41.12 40.66 2fel n ASP 206 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2fel n ASN 207 N -2.06 2.01 -0.25 -2.24 5.03 -1.06 -4.26 115.26 112.42 2fel n ASN 207 Ca 0.05 -1.85 -0.07 0.00 0.87 0.00 0.00 54.58 53.58 2fel n ASN 207 Cb 0.34 -0.18 0.05 0.00 -1.02 0.00 0.00 39.78 38.96 2fel n ASN 207 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2fel h ALA 208 N 3.97 0.92 -0.29 5.41 0.00 -1.70 -1.50 119.26 126.06 2fel h ALA 208 Ca 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2fel h ALA 208 Cb 0.55 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fel h ALA 208 CO 0.00 0.54 0.01 0.78 0.00 0.00 0.00 179.25 180.59 2fel h GLY 209 N 1.01 0.54 0.99 0.00 0.00 -1.87 -1.57 103.07 102.16 2fel h GLY 209 Ca 0.23 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.16 2fel h GLY 209 CO -0.02 0.35 0.28 0.00 0.00 0.00 0.00 176.54 177.16 2fel h ALA 210 N 0.84 0.76 -0.22 3.60 0.00 -1.81 -1.48 119.26 120.94 2fel h ALA 210 Ca 0.08 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2fel h ALA 210 Cb 0.40 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2fel h ALA 210 CO 0.01 0.33 -0.04 0.28 0.00 0.00 0.00 179.25 179.84 2fel h VAL 211 N 0.81 1.28 -0.57 0.00 2.07 -1.26 -2.45 116.25 116.12 2fel h VAL 211 Ca 0.20 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.74 2fel h VAL 211 Cb 0.12 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2fel h VAL 211 CO -0.02 0.31 0.37 -0.09 0.02 0.00 0.00 177.57 178.15 2fel h ARG 212 N 0.16 0.72 -0.73 1.57 2.43 -1.25 -0.98 114.38 116.30 2fel h ARG 212 Ca 0.06 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2fel h ARG 212 Cb 0.48 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 2fel h ARG 212 CO 0.02 0.48 0.45 0.00 -1.51 0.00 0.00 179.97 179.40 2fel h ALA 213 N 1.23 0.93 -0.08 2.80 0.00 -1.24 -1.45 119.26 121.45 2fel h ALA 213 Ca 0.22 -0.08 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 2fel h ALA 213 Cb -0.05 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.46 2fel h ALA 213 CO -0.07 0.39 -0.87 0.22 0.00 0.00 0.00 179.25 178.93 2fel h ASP 214 N 1.00 0.80 -0.35 0.00 -0.00 -1.22 -2.46 116.42 114.19 2fel h ASP 214 Ca 0.26 -0.58 -0.01 0.00 -0.00 0.00 0.00 57.03 56.70 2fel h ASP 214 Cb -0.05 -0.24 -0.02 0.00 -0.00 0.00 0.00 39.33 39.02 2fel h ASP 214 CO -0.05 1.37 0.17 0.25 -0.00 0.00 0.00 179.24 180.97 2fel h LEU 215 N 0.42 0.47 -0.57 2.28 5.85 -1.08 -0.95 115.31 121.72 2fel h LEU 215 Ca -0.07 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.52 2fel h LEU 215 Cb 1.50 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.38 2fel h LEU 215 CO 0.17 0.46 0.38 0.00 -0.34 0.00 0.00 178.44 179.11 2fel h ALA 216 N 1.02 0.73 0.06 1.25 0.00 -1.30 -2.10 119.26 118.92 2fel h ALA 216 Ca 0.12 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2fel h ALA 216 Cb 0.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2fel h ALA 216 CO -0.01 0.16 -0.08 -0.22 0.00 0.00 0.00 179.25 179.09 2fel h LYS 217 N 0.77 -0.17 -0.54 0.00 3.64 -1.22 0.56 116.57 119.61 2fel h LYS 217 Ca 0.21 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.65 2fel h LYS 217 Cb -0.08 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2fel h LYS 217 CO -0.05 -0.11 0.36 0.00 -2.27 0.00 0.00 179.45 177.38 2fel h ARG 218 N -0.18 0.54 -0.00 1.90 3.08 -1.02 -1.86 114.38 116.84 2fel h ARG 218 Ca 0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2fel h ARG 218 Cb 0.18 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2fel h ARG 218 CO -0.04 0.36 -0.47 1.28 -1.07 0.00 0.00 179.97 180.03 2fel n LEU 219 N -4.47 0.88 -1.32 3.04 4.77 -0.80 -4.96 117.00 114.13 2fel n LEU 219 Ca 0.07 -0.22 -0.10 0.00 -0.03 0.00 0.00 56.01 55.73 2fel n LEU 219 Cb 0.19 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2fel n LEU 219 CO 0.35 0.18 -0.07 0.61 -1.33 0.00 0.00 177.39 177.13 2fel n GLY 220 N 1.43 0.02 3.72 -0.72 0.00 0.03 -5.04 105.19 104.64 2fel n GLY 220 Ca 0.08 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 2fel n GLY 220 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2fel s LEU 221 N -3.12 3.13 0.34 0.99 1.43 -0.28 -5.03 118.68 116.14 2fel s LEU 221 Ca 0.06 -0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 51.92 2fel s LEU 221 Cb -0.03 -1.51 -0.09 0.00 0.03 0.00 0.00 46.19 44.59 2fel s LEU 221 CO 0.08 -0.41 1.06 0.00 0.23 0.00 0.00 176.35 177.30 2fel s ALA 222 N -2.53 3.24 -0.36 4.21 0.00 -0.06 -4.41 121.76 121.86 2fel s ALA 222 Ca 0.39 0.77 -0.23 0.00 0.00 0.00 0.00 51.96 52.88 2fel s ALA 222 Cb 0.01 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.85 2fel s ALA 222 CO 0.22 -0.14 0.80 0.34 0.00 0.00 0.00 175.76 176.97 2fel s ASP 223 N -1.26 6.58 -0.03 0.00 2.15 -1.26 -1.22 116.67 121.64 2fel s ASP 223 Ca 0.51 0.42 -0.11 0.00 0.43 0.00 0.00 52.55 53.80 2fel s ASP 223 Cb -0.26 -2.40 0.02 0.00 -0.30 0.00 0.00 42.92 39.97 2fel s ASP 223 CO 0.33 -0.73 0.24 -0.60 -0.17 0.00 0.00 175.17 174.25 2fel s ARG 224 N 3.11 0.52 0.42 4.34 3.52 -1.26 -5.02 118.95 124.58 2fel s ARG 224 Ca 0.32 -0.13 -0.23 0.00 -0.13 0.00 0.00 55.73 55.56 2fel s ARG 224 Cb -0.13 0.23 -0.12 0.00 -1.56 0.00 0.00 34.95 33.37 2fel s ARG 224 CO 0.16 -0.13 0.74 -2.30 -0.81 0.00 0.00 175.30 172.97 2fel n PRO 225 N 1.73 0.86 -1.49 5.12 -0.02 -1.26 -4.84 135.00 135.10 2fel n PRO 225 Ca -0.20 0.31 -0.40 0.00 -2.02 0.00 0.00 63.50 61.19 2fel n PRO 225 Cb 0.56 -1.72 0.02 0.00 -0.02 0.00 0.00 33.50 32.35 2fel n PRO 225 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fel n GLN 226 N 0.38 0.70 -2.54 -0.52 -0.00 -1.26 -4.95 117.38 109.19 2fel n GLN 226 Ca 0.11 0.26 -0.15 0.00 -0.00 0.00 0.00 57.00 57.22 2fel n GLN 226 Cb 0.39 -1.70 0.02 0.00 -0.00 0.00 0.00 30.24 28.96 2fel n GLN 226 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.06 174.39 2fel n TRP 227 N -1.13 2.07 -0.29 2.61 4.27 -1.26 -4.89 117.44 118.82 2fel n TRP 227 Ca 0.11 -2.64 0.06 0.00 -3.89 0.00 0.00 57.50 51.15 2fel n TRP 227 Cb 0.43 -0.26 0.28 0.00 -1.36 0.00 0.00 31.31 30.40 2fel n TRP 227 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 2fel h HIS 228 N 2.66 0.97 -0.05 -2.67 3.86 -1.92 -2.96 115.15 115.04 2fel h HIS 228 Ca 0.08 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 2fel h HIS 228 Cb 1.19 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 29.35 2fel h HIS 228 CO 0.65 0.47 0.00 0.27 0.86 0.00 0.00 177.93 180.18 2fel n ASN 229 N -4.52 1.69 -4.30 2.45 0.23 -1.26 -4.77 115.26 104.78 2fel n ASN 229 Ca 0.15 -1.44 -0.46 0.00 -0.53 0.00 0.00 54.58 52.30 2fel n ASN 229 Cb 0.27 -0.03 -0.05 0.00 -2.08 0.00 0.00 39.78 37.90 2fel n ASN 229 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2fel s GLN 230 N -0.57 3.13 -0.15 -3.83 -0.21 -1.12 -4.62 119.66 112.29 2fel s GLN 230 Ca 0.07 -1.98 0.16 0.00 0.02 0.00 0.00 55.36 53.62 2fel s GLN 230 Cb 0.04 -4.29 0.54 0.00 1.00 0.00 0.00 33.01 30.31 2fel s GLN 230 CO 0.06 -1.30 1.45 0.54 -2.12 0.00 0.00 175.29 173.92 2fel n ARG 231 N 4.75 3.21 0.05 2.91 5.12 -1.26 -4.61 116.66 126.82 2fel n ARG 231 Ca -0.04 -2.76 0.02 0.00 -1.93 0.00 0.00 57.85 53.14 2fel n ARG 231 Cb 0.42 -1.81 0.37 0.00 -1.16 0.00 0.00 32.46 30.28 2fel n ARG 231 CO 0.00 0.00 0.00 0.38 -1.93 0.00 0.00 177.63 176.08 2fel h ASP 232 N 2.25 0.38 -0.02 0.55 -0.00 -1.95 -2.01 116.42 115.63 2fel h ASP 232 Ca 0.00 -0.06 -0.08 0.00 -0.00 0.00 0.00 57.03 56.89 2fel h ASP 232 Cb 1.40 -0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 40.62 2fel h ASP 232 CO 0.22 0.43 -0.22 1.23 -0.00 0.00 0.00 179.24 180.90 2fel h GLY 233 N 0.71 0.43 0.95 7.15 0.00 -1.97 0.13 103.07 110.48 2fel h GLY 233 Ca 0.09 -0.33 -0.16 0.00 0.00 0.00 0.00 47.33 46.93 2fel h GLY 233 CO 0.00 0.30 -0.53 -2.22 0.00 0.00 0.00 176.54 174.10 2fel h ILE 234 N 0.36 1.34 -0.66 2.60 2.04 -1.78 -1.45 117.51 119.96 2fel h ILE 234 Ca 0.06 -1.81 -0.06 0.00 1.00 0.00 0.00 64.86 64.05 2fel h ILE 234 Cb 0.59 2.07 -0.03 0.00 -0.74 0.00 0.00 36.82 38.71 2fel h ILE 234 CO 0.04 0.55 0.16 0.00 0.00 0.00 0.00 178.15 178.91 2fel h ALA 235 N 0.52 1.04 -0.45 1.87 0.00 -1.22 -0.22 119.26 120.79 2fel h ALA 235 Ca -0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 2fel h ALA 235 Cb 1.16 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2fel h ALA 235 CO 0.11 0.63 0.13 1.49 0.00 0.00 0.00 179.25 181.61 2fel h GLU 236 N 1.00 0.71 -0.67 0.00 4.81 -0.74 -0.56 114.58 119.12 2fel h GLU 236 Ca 0.21 -0.16 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 2fel h GLU 236 Cb 0.35 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.60 2fel h GLU 236 CO 0.00 0.69 0.14 0.35 -0.73 0.00 0.00 179.01 179.47 2fel h PHE 237 N 0.59 1.14 -0.15 0.92 3.57 -1.06 -2.62 116.94 119.34 2fel h PHE 237 Ca 0.14 -0.14 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 2fel h PHE 237 Cb 0.29 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2fel h PHE 237 CO 0.02 0.94 -0.36 0.00 -2.23 0.00 0.00 178.31 176.67 2fel h ALA 238 N 1.12 1.12 -0.88 2.41 0.00 -0.90 -2.63 119.26 119.50 2fel h ALA 238 Ca 0.21 -0.39 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2fel h ALA 238 Cb 0.39 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 2fel h ALA 238 CO 0.01 0.57 0.54 -0.97 0.00 0.00 0.00 179.25 179.40 2fel h ASN 239 N 0.26 0.84 -0.27 0.00 -1.24 -0.72 -2.41 115.58 112.04 2fel h ASN 239 Ca 0.03 0.02 -0.14 0.00 0.71 0.00 0.00 56.30 56.93 2fel h ASN 239 Cb 0.76 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.65 2fel h ASN 239 CO 0.06 0.52 -0.33 -0.07 -1.29 0.00 0.00 177.43 176.32 2fel h LEU 240 N 0.96 0.82 -0.43 0.34 3.38 -1.32 -0.64 115.31 118.42 2fel h LEU 240 Ca 0.39 -0.34 0.06 0.00 0.09 0.00 0.00 57.88 58.08 2fel h LEU 240 Cb 0.23 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 2fel h LEU 240 CO -0.19 1.08 0.13 -0.07 0.09 0.00 0.00 178.44 179.47 2fel h LEU 241 N 0.66 0.10 -0.27 1.67 4.07 -1.21 -1.84 115.31 118.50 2fel h LEU 241 Ca 0.07 0.06 -0.13 0.00 0.08 0.00 0.00 57.88 57.96 2fel h LEU 241 Cb 0.87 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.65 2fel h LEU 241 CO 0.08 0.09 -0.60 -1.28 -1.08 0.00 0.00 178.44 175.65 2fel h SER 242 N 0.28 0.00 -0.19 -0.43 0.87 -1.30 -2.87 113.55 109.91 2fel h SER 242 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2fel h SER 242 Cb 0.22 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 2fel h SER 242 CO -0.23 0.60 0.13 -0.07 -0.53 0.00 0.00 176.83 176.72 2fel h LEU 243 N 0.00 0.22 0.21 2.23 4.07 -0.78 0.43 115.31 121.69 2fel h LEU 243 Ca -0.01 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 2fel h LEU 243 Cb 1.34 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 43.02 2fel h LEU 243 CO 0.08 0.17 -0.16 0.58 -1.08 0.00 0.00 178.44 178.03 2fel h VAL 244 N 0.26 0.65 -0.50 1.22 2.07 -1.31 -2.01 116.25 116.62 2fel h VAL 244 Ca 0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 2fel h VAL 244 Cb -0.02 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 2fel h VAL 244 CO -0.01 0.00 0.23 0.71 0.02 0.00 0.00 177.57 178.51 2fel h THR 245 N -0.38 1.17 -0.10 2.57 1.35 -1.51 -2.06 112.91 113.96 2fel h THR 245 Ca -0.01 -0.50 -0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2fel h THR 245 Cb 0.34 0.55 -0.00 0.00 -1.73 0.00 0.00 68.15 67.30 2fel h THR 245 CO -0.01 0.21 0.05 1.23 -0.25 0.00 0.00 175.52 176.75 2fel h GLY 246 N 0.82 0.15 0.99 5.82 0.00 -0.72 0.85 103.07 110.99 2fel h GLY 246 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 2fel h GLY 246 CO -0.02 0.07 0.33 -0.84 0.00 0.00 0.00 176.54 176.08 2fel h THR 247 N 0.06 1.19 0.00 4.70 2.02 -1.25 -1.94 112.91 117.69 2fel h THR 247 Ca 0.04 -0.48 -0.08 0.00 0.77 0.00 0.00 66.41 66.66 2fel h THR 247 Cb 0.10 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 2fel h THR 247 CO -0.01 0.21 -0.37 -0.07 0.37 0.00 0.00 175.52 175.66 2fel h LEU 248 N 0.81 0.00 -0.67 2.58 3.38 -1.24 -0.99 115.31 119.18 2fel h LEU 248 Ca 0.21 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.04 2fel h LEU 248 Cb 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2fel h LEU 248 CO -0.03 0.37 -0.53 1.23 0.09 0.00 0.00 178.44 179.56 2fel h GLY 249 N 1.15 0.40 0.94 0.83 0.00 -0.60 0.04 103.07 105.84 2fel h GLY 249 Ca -0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 2fel h GLY 249 CO 0.05 0.41 0.12 1.70 0.00 0.00 0.00 176.54 178.82 2fel h LYS 250 N 0.29 0.34 -0.25 4.80 3.11 -0.71 -0.20 116.57 123.95 2fel h LYS 250 Ca 0.01 -0.04 0.04 0.00 -2.81 0.00 0.00 60.65 57.85 2fel h LYS 250 Cb 1.03 -0.06 -0.04 0.00 -1.00 0.00 0.00 32.23 32.16 2fel h LYS 250 CO 0.09 0.32 0.00 0.35 -2.81 0.00 0.00 179.45 177.40 2fel h PHE 251 N 0.26 -0.01 -0.70 1.91 -0.00 -1.09 -1.07 116.94 116.24 2fel h PHE 251 Ca 0.08 0.02 -0.04 0.00 -0.00 0.00 0.00 57.97 58.03 2fel h PHE 251 Cb 0.09 0.04 -0.03 0.00 -0.00 0.00 0.00 35.95 36.05 2fel h PHE 251 CO -0.03 -0.04 0.27 0.78 -0.00 0.00 0.00 178.31 179.29 2fel h GLY 252 N 0.08 1.14 1.00 2.40 0.00 -0.88 -2.02 103.07 104.78 2fel h GLY 252 Ca 0.12 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2fel h GLY 252 CO -0.20 0.60 0.33 -1.61 0.00 0.00 0.00 176.54 175.66 2fel h GLN 253 N 1.01 0.68 -0.01 4.80 5.75 -0.84 -1.65 115.11 124.85 2fel h GLN 253 Ca 0.23 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.71 2fel h GLN 253 Cb 0.23 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.60 2fel h GLN 253 CO -0.02 0.47 -0.17 -0.44 -2.65 0.00 0.00 178.83 176.02 2fel h ASP 254 N 0.69 -0.50 -0.73 -0.69 5.19 -1.01 -1.73 116.42 117.64 2fel h ASP 254 Ca 0.19 0.07 0.01 0.00 -0.62 0.00 0.00 57.03 56.68 2fel h ASP 254 Cb -0.06 0.21 -0.04 0.00 0.18 0.00 0.00 39.33 39.63 2fel h ASP 254 CO -0.04 -0.23 0.48 0.40 -3.12 0.00 0.00 179.24 176.73 2fel h ILE 255 N -0.27 1.19 -0.38 0.35 1.08 -1.18 -0.36 117.51 117.94 2fel h ILE 255 Ca 0.06 -0.35 -0.02 0.00 -0.39 0.00 0.00 64.86 64.15 2fel h ILE 255 Cb 0.35 0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 34.20 2fel h ILE 255 CO -0.17 0.18 0.15 0.00 -0.69 0.00 0.00 178.15 177.62 2fel h ALA 256 N 1.26 0.49 -0.70 1.87 0.00 -1.22 0.18 119.26 121.16 2fel h ALA 256 Ca 0.27 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2fel h ALA 256 Cb -0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2fel h ALA 256 CO -0.06 0.10 0.39 -0.07 0.00 0.00 0.00 179.25 179.62 2fel h LEU 257 N 0.47 0.86 -1.22 0.00 3.38 -1.04 -0.53 115.31 117.22 2fel h LEU 257 Ca 0.13 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2fel h LEU 257 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2fel h LEU 257 CO -0.01 0.69 -0.18 0.24 0.09 0.00 0.00 178.44 179.28 2fel h MET 258 N 0.95 0.32 -0.25 1.13 2.86 -0.77 -2.23 114.93 116.94 2fel h MET 258 Ca 0.25 -0.09 -0.20 0.00 -2.06 0.00 0.00 59.70 57.60 2fel h MET 258 Cb 0.02 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.64 2fel h MET 258 CO -0.04 0.50 -0.61 0.00 1.06 0.00 0.00 176.91 177.81 2fel h ALA 259 N 1.53 0.41 -0.67 6.32 0.00 -0.17 -0.19 119.26 126.50 2fel h ALA 259 Ca 0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 2fel h ALA 259 Cb 0.49 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2fel h ALA 259 CO 0.03 0.67 0.14 1.49 0.00 0.00 0.00 179.25 181.58 2fel h GLU 260 N 0.63 1.08 -0.11 0.00 4.81 -0.94 -2.74 114.58 117.31 2fel h GLU 260 Ca -0.01 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 58.93 2fel h GLU 260 Cb 1.23 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2fel h GLU 260 CO 0.13 0.98 -0.03 0.82 -0.73 0.00 0.00 179.01 180.18 2fel h ILE 261 N 1.00 1.29 0.00 2.32 2.04 -1.44 -3.47 117.51 119.26 2fel h ILE 261 Ca 0.21 -0.98 0.00 0.00 1.00 0.00 0.00 64.86 65.09 2fel h ILE 261 Cb 0.40 1.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2fel h ILE 261 CO 0.01 0.28 0.00 0.61 0.00 0.00 0.00 178.15 179.05 2fel n GLY 262 N -0.10 2.42 0.03 5.37 0.00 -0.08 -4.87 105.19 107.96 2fel n GLY 262 Ca -0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.08 2fel n GLY 262 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2fel n SER 263 N 0.00 0.60 -0.75 1.61 3.41 -1.26 -4.33 113.62 112.90 2fel n SER 263 Ca 0.00 -0.10 0.05 0.00 -0.26 0.00 0.00 58.87 58.57 2fel n SER 263 Cb 0.00 0.32 0.10 0.00 -0.26 0.00 0.00 64.21 64.37 2fel n SER 263 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2fel n GLU 264 N -1.83 0.79 -3.65 4.33 1.02 -1.26 -4.68 120.64 115.35 2fel n GLU 264 Ca 0.04 -2.39 -0.15 0.00 -0.02 0.00 0.00 57.16 54.64 2fel n GLU 264 Cb 0.40 -0.92 -0.08 0.00 -0.02 0.00 0.00 31.44 30.82 2fel n GLU 264 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2fel s ILE 265 N -1.65 0.03 -0.23 -3.67 2.07 -1.26 -0.82 121.20 115.67 2fel s ILE 265 Ca 0.29 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.33 2fel s ILE 265 Cb 0.30 -0.80 0.06 0.00 0.13 0.00 0.00 42.46 42.15 2fel s ILE 265 CO -0.07 -0.11 -0.04 -0.13 -1.91 0.00 0.00 174.94 172.68 2fel s ARG 266 N -1.06 1.43 -0.10 3.50 0.52 -0.74 -4.92 118.95 117.58 2fel s ARG 266 Ca -0.11 -0.87 -0.10 0.00 -0.52 0.00 0.00 55.73 54.14 2fel s ARG 266 Cb -0.03 -2.49 -0.05 0.00 0.52 0.00 0.00 34.95 32.91 2fel s ARG 266 CO 0.06 -0.60 0.22 -0.51 0.02 0.00 0.00 175.30 174.49 2fel s LEU 267 N 1.49 4.38 0.11 2.53 1.43 -1.26 -0.26 118.68 127.10 2fel s LEU 267 Ca -0.05 0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 53.54 2fel s LEU 267 Cb -0.18 -2.23 -0.06 0.00 0.03 0.00 0.00 46.19 43.75 2fel s LEU 267 CO -0.07 0.34 0.41 -0.94 0.23 0.00 0.00 176.35 176.33 2fel s SER 268 N -0.80 6.62 0.00 2.29 1.04 0.08 -4.82 113.70 118.10 2fel s SER 268 Ca 0.17 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.37 2fel s SER 268 Cb -0.13 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.82 2fel s SER 268 CO 0.06 0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.01 2fel n GLY 269 N 0.65 0.78 3.74 7.32 0.00 -1.26 -4.89 105.19 111.52 2fel n GLY 269 Ca -0.06 -0.62 0.04 0.00 0.00 0.00 0.00 46.02 45.37 2fel n GLY 269 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fel s GLY 270 N -0.13 -0.38 0.44 -0.02 0.00 -1.26 -5.09 107.32 100.87 2fel s GLY 270 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2fel s GLY 270 CO 0.00 2.62 0.00 0.70 0.00 0.00 0.00 173.10 176.42 2fel n ASN 281 N -0.69 -3.97 -2.37 1.64 4.13 -1.26 -5.28 115.26 107.47 2fel n ASN 281 Ca -0.04 0.86 -0.25 0.00 1.68 0.00 0.00 54.58 56.83 2fel n ASN 281 Cb 0.62 3.71 -0.04 0.00 -1.54 0.00 0.00 39.78 42.54 2fel n ASN 281 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2fel n PRO 282 N -3.39 2.29 -0.24 3.52 -0.04 -1.26 -4.60 135.00 131.27 2fel n PRO 282 Ca 0.00 -2.21 0.03 0.00 -0.04 0.00 0.00 63.50 61.28 2fel n PRO 282 Cb 0.00 -2.04 0.15 0.00 -0.04 0.00 0.00 33.50 31.57 2fel n PRO 282 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2fel h VAL 283 N 1.77 0.73 -0.78 0.52 2.07 -2.02 -1.76 116.25 116.78 2fel h VAL 283 Ca 0.38 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 2fel h VAL 283 Cb 0.76 0.22 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2fel h VAL 283 CO 0.87 0.08 0.47 0.78 0.02 0.00 0.00 177.57 179.80 2fel h ASN 284 N 0.47 0.94 -0.23 0.57 2.35 -1.95 -0.58 115.58 117.15 2fel h ASN 284 Ca 0.37 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 56.05 2fel h ASN 284 Cb 0.50 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 2fel h ASN 284 CO -0.35 0.72 0.09 0.00 -1.65 0.00 0.00 177.43 176.24 2fel h ALA 285 N 1.44 0.30 -0.85 -0.83 0.00 -1.62 -2.67 119.26 115.03 2fel h ALA 285 Ca 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2fel h ALA 285 Cb -0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2fel h ALA 285 CO -0.05 -0.11 0.48 0.93 0.00 0.00 0.00 179.25 180.50 2fel h GLU 286 N 0.21 1.18 -0.67 0.00 5.08 -1.09 -2.89 114.58 116.40 2fel h GLU 286 Ca 0.08 -0.12 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2fel h GLU 286 Cb 0.18 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2fel h GLU 286 CO -0.01 0.85 0.44 1.15 -1.00 0.00 0.00 179.01 180.44 2fel h THR 287 N 1.19 1.17 -0.64 1.13 2.02 -1.02 0.13 112.91 116.88 2fel h THR 287 Ca 0.30 -0.31 0.08 0.00 0.77 0.00 0.00 66.41 67.25 2fel h THR 287 Cb 0.00 0.19 -0.06 0.00 -1.74 0.00 0.00 68.15 66.54 2fel h THR 287 CO -0.05 0.16 0.31 -0.07 0.37 0.00 0.00 175.52 176.25 2fel h LEU 288 N 0.90 0.42 -0.20 2.58 3.38 -1.28 -0.41 115.31 120.70 2fel h LEU 288 Ca 0.25 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2fel h LEU 288 Cb -0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2fel h LEU 288 CO -0.06 0.26 0.11 0.58 0.09 0.00 0.00 178.44 179.42 2fel h VAL 289 N 0.56 1.10 -0.37 1.22 2.07 -1.16 -1.62 116.25 118.05 2fel h VAL 289 Ca 0.30 -0.27 0.07 0.00 0.82 0.00 0.00 66.70 67.62 2fel h VAL 289 Cb 0.28 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.92 2fel h VAL 289 CO -0.23 0.10 -0.00 0.74 0.02 0.00 0.00 177.57 178.19 2fel h THR 290 N 0.22 0.72 -0.21 2.57 2.02 -0.61 -1.44 112.91 116.19 2fel h THR 290 Ca 0.07 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.13 2fel h THR 290 Cb 0.06 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 2fel h THR 290 CO -0.01 0.02 -0.23 -0.07 0.37 0.00 0.00 175.52 175.60 2fel h LEU 291 N 0.10 0.38 -0.30 2.58 3.38 -0.94 0.10 115.31 120.61 2fel h LEU 291 Ca 0.18 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2fel h LEU 291 Cb 0.25 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2fel h LEU 291 CO -0.30 0.62 0.15 0.00 0.09 0.00 0.00 178.44 179.00 2fel h ALA 292 N 1.41 0.39 -0.04 1.53 0.00 -0.81 -2.43 119.26 119.32 2fel h ALA 292 Ca 0.06 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2fel h ALA 292 Cb 0.60 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2fel h ALA 292 CO 0.04 -0.06 -0.67 0.00 0.00 0.00 0.00 179.25 178.56 2fel h ARG 293 N 0.36 0.16 0.20 0.00 3.08 -0.73 -1.74 114.38 115.71 2fel h ARG 293 Ca 0.10 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2fel h ARG 293 Cb 0.10 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 2fel h ARG 293 CO -0.01 0.77 -0.36 0.35 -1.07 0.00 0.00 179.97 179.65 2fel h PHE 294 N 0.11 -0.98 0.00 3.04 3.57 -0.74 -2.00 116.94 119.94 2fel h PHE 294 Ca -0.01 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 2fel h PHE 294 Cb 1.20 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 40.33 2fel h PHE 294 CO 0.02 -0.48 -0.45 -0.91 -2.23 0.00 0.00 178.31 174.26 2fel h ASN 295 N -0.64 0.00 0.31 0.41 -0.26 -1.39 -0.75 115.58 113.27 2fel h ASN 295 Ca 0.01 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 55.69 2fel h ASN 295 Cb 0.63 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.89 2fel h ASN 295 CO -0.16 0.45 -0.29 0.00 -1.06 0.00 0.00 177.43 176.36 2fel h ALA 296 N 1.55 1.49 0.03 -0.83 0.00 -1.25 -0.49 119.26 119.74 2fel h ALA 296 Ca -0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2fel h ALA 296 Cb 0.95 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2fel h ALA 296 CO 0.06 0.37 -0.01 0.28 0.00 0.00 0.00 179.25 179.94 2fel h VAL 297 N 0.00 1.39 0.00 0.00 2.07 -0.79 -3.38 116.25 115.54 2fel h VAL 297 Ca -0.00 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 65.73 2fel h VAL 297 Cb 0.53 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.81 2fel h VAL 297 CO 0.04 0.43 -0.02 1.56 0.02 0.00 0.00 177.57 179.60 2fel h GLN 298 N -0.88 0.00 -0.44 1.57 1.08 -0.99 -2.30 115.11 113.16 2fel h GLN 298 Ca -0.00 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.28 2fel h GLN 298 Cb 0.73 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.13 2fel h GLN 298 CO 0.01 0.02 0.30 0.97 -0.95 0.00 0.00 178.83 179.18 2fel h ILE 299 N 0.00 0.90 -0.69 2.54 6.09 -1.26 -1.98 117.51 123.11 2fel h ILE 299 Ca -0.00 -0.08 0.01 0.00 -1.37 0.00 0.00 64.86 63.41 2fel h ILE 299 Cb 0.04 0.63 -0.03 0.00 0.47 0.00 0.00 36.82 37.92 2fel h ILE 299 CO 0.00 0.04 0.45 -1.28 -3.07 0.00 0.00 178.15 174.30 2fel h SER 300 N 0.25 0.80 -0.62 2.19 0.87 -1.63 -2.73 113.55 112.67 2fel h SER 300 Ca 0.20 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2fel h SER 300 Cb 0.48 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2fel h SER 300 CO -0.04 0.58 0.40 0.00 -0.53 0.00 0.00 176.83 177.24 2fel h ALA 301 N 1.56 0.78 0.00 6.23 0.00 -1.52 -1.23 119.26 125.09 2fel h ALA 301 Ca 0.25 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2fel h ALA 301 Cb -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2fel h ALA 301 CO -0.05 0.23 -0.23 -0.07 0.00 0.00 0.00 179.25 179.13 2fel h LEU 302 N 0.84 0.00 0.03 0.00 3.38 -1.55 -2.36 115.31 115.65 2fel h LEU 302 Ca 0.22 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.93 2fel h LEU 302 Cb -0.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.69 2fel h LEU 302 CO -0.05 0.23 -1.16 0.45 0.09 0.00 0.00 178.44 178.01 2fel h HIS 303 N 0.00 0.60 -0.42 1.13 3.86 -1.25 -3.22 115.15 115.86 2fel h HIS 303 Ca -0.00 -0.40 -0.04 0.00 -1.16 0.00 0.00 60.37 58.77 2fel h HIS 303 Cb 0.92 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 29.33 2fel h HIS 303 CO 0.00 1.27 0.09 1.96 0.86 0.00 0.00 177.93 182.10 2fel h GLN 304 N 0.15 0.64 0.00 2.45 1.08 -0.99 -2.40 115.11 116.03 2fel h GLN 304 Ca -0.13 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 2fel h GLN 304 Cb 1.85 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 29.17 2fel h GLN 304 CO 0.20 0.60 0.00 0.43 -0.95 0.00 0.00 178.83 179.10 2fel n SER 305 N -4.30 0.00 0.19 1.46 7.64 -0.91 -2.72 113.62 114.98 2fel n SER 305 Ca 0.03 -0.84 0.06 0.00 1.01 0.00 0.00 58.87 59.12 2fel n SER 305 Cb 0.21 0.00 0.31 0.00 -1.01 0.00 0.00 64.21 63.72 2fel n SER 305 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2fel h LEU 306 N 0.00 0.00 -8.08 -3.43 3.38 -1.46 -3.37 115.31 102.35 2fel h LEU 306 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 2fel h LEU 306 Cb 0.00 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 2fel h LEU 306 CO 0.00 0.38 0.93 -0.69 0.09 0.00 0.00 178.44 179.14 2fel s VAL 307 N -3.55 4.42 -0.36 1.22 1.01 -1.10 -4.79 120.40 117.26 2fel s VAL 307 Ca 0.00 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 60.95 2fel s VAL 307 Cb 0.11 -4.83 0.11 0.00 0.00 0.00 0.00 36.38 31.77 2fel s VAL 307 CO 0.69 -1.61 0.10 -1.10 0.00 0.00 0.00 175.10 173.18 2fel s GLN 308 N 3.61 1.29 0.55 2.72 -0.21 -1.26 -4.68 119.66 121.67 2fel s GLN 308 Ca 0.33 -1.73 -0.20 0.00 0.02 0.00 0.00 55.36 53.79 2fel s GLN 308 Cb -0.06 -2.78 -0.05 0.00 1.00 0.00 0.00 33.01 31.11 2fel s GLN 308 CO -0.04 -0.99 1.18 -1.83 -2.12 0.00 0.00 175.29 171.49 2fel s GLU 309 N 0.95 3.26 2.92 2.91 1.03 -1.26 -4.78 118.70 123.72 2fel s GLU 309 Ca 0.12 1.76 0.00 0.00 0.03 0.00 0.00 54.97 56.88 2fel s GLU 309 Cb -0.20 -2.05 0.00 0.00 -0.80 0.00 0.00 34.13 31.08 2fel s GLU 309 CO -0.12 -0.96 0.00 1.04 -1.33 0.00 0.00 175.26 173.89 2fel n GLN 310 N -1.26 0.00 0.21 -4.83 6.02 -1.26 -3.46 117.38 112.80 2fel n GLN 310 Ca 0.12 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.24 2fel n GLN 310 Cb 0.50 0.00 0.29 0.00 1.02 0.00 0.00 30.24 32.05 2fel n GLN 310 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2fel h GLU 311 N 0.00 0.00 -1.81 -1.09 3.07 -1.93 -3.45 114.58 109.38 2fel h GLU 311 Ca 0.00 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.88 2fel h GLU 311 Cb 0.00 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 27.67 2fel h GLU 311 CO 0.00 0.00 0.25 0.50 -1.40 0.00 0.00 179.01 178.36 2fel s ARG 312 N -3.28 0.65 -0.30 2.33 3.52 -1.22 -4.45 118.95 116.18 2fel s ARG 312 Ca 0.06 0.86 0.00 0.00 -0.13 0.00 0.00 55.73 56.53 2fel s ARG 312 Cb 0.07 0.26 0.09 0.00 -1.56 0.00 0.00 34.95 33.82 2fel s ARG 312 CO 0.63 -0.09 0.07 0.45 -0.81 0.00 0.00 175.30 175.55 2fel s SER 313 N 0.68 4.10 0.17 -2.12 0.15 -1.24 -4.81 113.70 110.62 2fel s SER 313 Ca -0.02 -1.66 -0.15 0.00 0.70 0.00 0.00 55.95 54.83 2fel s SER 313 Cb -0.05 -1.02 0.14 0.00 -1.71 0.00 0.00 66.02 63.39 2fel s SER 313 CO -0.07 -0.39 1.69 1.23 1.20 0.00 0.00 173.24 176.90 2fel h GLY 314 N 8.00 0.44 0.33 9.45 0.00 -1.98 -1.60 103.07 117.71 2fel h GLY 314 Ca -0.12 0.05 0.07 0.00 0.00 0.00 0.00 47.33 47.33 2fel h GLY 314 CO 0.47 -0.11 -0.07 0.00 0.00 0.00 0.00 176.54 176.82 2fel h ALA 315 N 1.39 0.24 -0.06 3.60 0.00 -1.98 -0.76 119.26 121.69 2fel h ALA 315 Ca 0.22 0.13 -0.16 0.00 0.00 0.00 0.00 54.91 55.09 2fel h ALA 315 Cb 0.32 0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.36 2fel h ALA 315 CO -0.36 -0.45 -0.60 0.78 0.00 0.00 0.00 179.25 178.61 2fel h GLY 316 N 0.02 0.57 1.01 0.00 0.00 -1.82 -3.21 103.07 99.64 2fel h GLY 316 Ca 0.17 -0.89 -0.02 0.00 0.00 0.00 0.00 47.33 46.59 2fel h GLY 316 CO -0.34 0.79 0.39 -0.25 0.00 0.00 0.00 176.54 177.13 2fel h TRP 317 N 0.09 1.01 0.00 5.60 7.01 -1.19 -2.76 115.95 125.72 2fel h TRP 317 Ca -0.06 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.89 2fel h TRP 317 Cb 1.27 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 28.01 2fel h TRP 317 CO 0.12 0.72 -0.13 0.52 -2.79 0.00 0.00 178.44 176.88 2fel h MET 318 N 1.01 0.00 -0.76 2.65 2.86 -1.25 -2.50 114.93 116.94 2fel h MET 318 Ca 0.26 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.87 2fel h MET 318 Cb 0.05 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 2fel h MET 318 CO -0.04 0.13 0.38 1.25 1.06 0.00 0.00 176.91 179.69 2fel h LEU 319 N 0.00 0.99 -1.36 1.22 6.46 -1.49 -2.15 115.31 118.98 2fel h LEU 319 Ca -0.00 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 2fel h LEU 319 Cb 0.79 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.44 2fel h LEU 319 CO 0.02 0.84 0.31 -0.33 -0.62 0.00 0.00 178.44 178.66 2fel h GLU 320 N 1.07 0.74 -0.17 1.25 5.08 -1.42 -2.11 114.58 119.03 2fel h GLU 320 Ca 0.26 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2fel h GLU 320 Cb 0.11 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2fel h GLU 320 CO -0.03 0.54 -0.16 -1.49 -1.00 0.00 0.00 179.01 176.87 2fel h TRP 321 N 0.75 0.29 0.00 4.33 6.55 -1.24 -2.48 115.95 124.16 2fel h TRP 321 Ca 0.20 -0.04 -0.09 0.00 0.95 0.00 0.00 58.89 59.91 2fel h TRP 321 Cb 0.00 -0.08 -0.01 0.00 -0.86 0.00 0.00 29.16 28.21 2fel h TRP 321 CO 0.00 0.43 -0.43 -0.07 -1.05 0.00 0.00 178.44 177.32 2fel h LEU 322 N 0.26 0.00 0.00 -4.49 4.07 -0.88 -3.42 115.31 110.85 2fel h LEU 322 Ca 0.05 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.89 2fel h LEU 322 Cb 0.44 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 2fel h LEU 322 CO 0.03 0.43 -1.40 0.35 -1.08 0.00 0.00 178.44 176.77 2fel n THR 323 N -3.25 0.39 -0.12 0.22 -2.24 -1.05 -4.82 114.28 103.41 2fel n THR 323 Ca 0.02 -0.10 -0.04 0.00 -2.27 0.00 0.00 64.05 61.65 2fel n THR 323 Cb 0.68 -1.56 0.03 0.00 -2.10 0.00 0.00 70.33 67.38 2fel n THR 323 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2fel h LEU 324 N -0.25 -0.10 -1.27 3.22 5.85 -1.69 -2.88 115.31 118.19 2fel h LEU 324 Ca -0.18 0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.77 2fel h LEU 324 Cb 1.16 0.14 -0.07 0.00 0.37 0.00 0.00 40.66 42.26 2fel h LEU 324 CO -0.11 -0.02 0.58 -0.65 -0.34 0.00 0.00 178.44 177.90 2fel h PRO 325 N 0.14 0.69 0.00 5.25 0.11 -1.83 -0.45 132.00 135.91 2fel h PRO 325 Ca 0.20 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 2fel h PRO 325 Cb 0.27 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 2fel h PRO 325 CO -0.31 0.45 -0.29 1.96 -0.21 0.00 0.00 178.00 179.60 2fel h GLN 326 N 0.71 0.00 -0.11 1.05 4.20 -1.83 -1.74 115.11 117.39 2fel h GLN 326 Ca 0.45 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.12 2fel h GLN 326 Cb 0.71 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.49 2fel h GLN 326 CO -0.21 0.29 -0.10 0.52 -0.67 0.00 0.00 178.83 178.67 2fel h MET 327 N 0.00 0.26 -0.34 1.46 2.86 -0.93 -0.02 114.93 118.22 2fel h MET 327 Ca -0.00 -0.13 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 2fel h MET 327 Cb 0.79 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 2fel h MET 327 CO 0.04 0.66 -0.04 -0.39 1.06 0.00 0.00 176.91 178.24 2fel h VAL 328 N -0.14 1.21 -0.62 -2.22 -1.51 -1.33 -2.30 116.25 109.35 2fel h VAL 328 Ca 0.02 -0.89 -0.07 0.00 -1.23 0.00 0.00 66.70 64.53 2fel h VAL 328 Cb 0.61 1.00 -0.02 0.00 -2.13 0.00 0.00 31.29 30.75 2fel h VAL 328 CO 0.03 0.30 0.12 0.74 -1.23 0.00 0.00 177.57 177.52 2fel h THR 329 N 0.52 1.26 -0.28 7.19 2.02 -1.31 -0.17 112.91 122.14 2fel h THR 329 Ca 0.11 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.27 2fel h THR 329 Cb 0.40 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2fel h THR 329 CO 0.02 0.36 0.05 0.00 0.37 0.00 0.00 175.52 176.32 2fel h ALA 330 N 1.03 0.37 -0.64 6.16 0.00 -0.82 0.18 119.26 125.53 2fel h ALA 330 Ca 0.19 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2fel h ALA 330 Cb 0.41 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 2fel h ALA 330 CO 0.01 0.06 0.33 1.15 0.00 0.00 0.00 179.25 180.80 2fel h THR 331 N 0.28 0.92 0.00 0.00 2.02 -1.41 0.24 112.91 114.96 2fel h THR 331 Ca 0.09 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 2fel h THR 331 Cb 0.33 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 2fel h THR 331 CO 0.01 0.11 -0.00 1.23 0.37 0.00 0.00 175.52 177.23 2fel h GLY 332 N 0.60 -0.00 1.17 2.16 0.00 -0.65 -2.37 103.07 103.98 2fel h GLY 332 Ca 0.30 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.59 2fel h GLY 332 CO -0.21 -0.00 0.28 -0.84 0.00 0.00 0.00 176.54 175.77 2fel h THR 333 N -0.15 1.24 -0.37 4.70 2.02 -0.58 -2.26 112.91 117.53 2fel h THR 333 Ca -0.00 -0.76 0.02 0.00 0.77 0.00 0.00 66.41 66.43 2fel h THR 333 Cb 0.15 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 2fel h THR 333 CO 0.00 0.31 0.21 -1.28 0.37 0.00 0.00 175.52 175.13 2fel h SER 334 N 1.03 0.33 -0.86 4.18 0.87 -0.46 0.24 113.55 118.89 2fel h SER 334 Ca 0.24 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.86 2fel h SER 334 Cb 0.20 -0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.05 2fel h SER 334 CO -0.02 0.24 0.56 -0.07 -0.53 0.00 0.00 176.83 177.01 2fel h LEU 335 N 0.42 0.88 -0.06 2.23 3.38 -1.16 0.20 115.31 121.20 2fel h LEU 335 Ca 0.15 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2fel h LEU 335 Cb 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2fel h LEU 335 CO -0.08 0.58 0.01 -0.07 0.09 0.00 0.00 178.44 178.98 2fel h LEU 336 N 1.01 0.10 -0.87 1.67 4.07 -0.73 -2.77 115.31 117.79 2fel h LEU 336 Ca 0.35 -0.26 -0.08 0.00 0.08 0.00 0.00 57.88 57.97 2fel h LEU 336 Cb 0.12 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 2fel h LEU 336 CO -0.12 0.34 -0.06 0.58 -1.08 0.00 0.00 178.44 178.09 2fel h VAL 337 N -0.14 1.25 -0.36 1.22 2.07 -0.28 -2.11 116.25 117.90 2fel h VAL 337 Ca 0.02 -1.09 -0.06 0.00 0.82 0.00 0.00 66.70 66.39 2fel h VAL 337 Cb 0.28 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2fel h VAL 337 CO 0.00 0.38 -0.03 0.00 0.02 0.00 0.00 177.57 177.94 2fel h ALA 338 N 1.22 1.27 -0.20 1.67 0.00 -0.61 -0.71 119.26 121.90 2fel h ALA 338 Ca 0.13 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 2fel h ALA 338 Cb 0.53 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2fel h ALA 338 CO 0.03 0.49 -0.69 1.49 0.00 0.00 0.00 179.25 180.56 2fel h GLU 339 N 0.55 0.83 -0.70 0.00 4.57 -1.29 -1.88 114.58 116.67 2fel h GLU 339 Ca 0.11 -0.62 -0.01 0.00 -1.18 0.00 0.00 59.36 57.66 2fel h GLU 339 Cb 0.40 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 2fel h GLU 339 CO 0.02 1.23 0.39 0.00 -1.18 0.00 0.00 179.01 179.47 2fel h ARG 340 N 0.58 0.97 -0.38 1.92 3.08 -1.05 -2.36 114.38 117.15 2fel h ARG 340 Ca -0.03 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.82 2fel h ARG 340 Cb 1.31 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 2fel h ARG 340 CO 0.15 0.72 -0.13 1.25 -1.07 0.00 0.00 179.97 180.89 2fel h LEU 341 N 0.96 0.77 -1.28 3.04 5.85 -1.05 -2.85 115.31 120.75 2fel h LEU 341 Ca 0.25 -0.38 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 2fel h LEU 341 Cb 0.02 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 2fel h LEU 341 CO -0.04 0.98 -0.04 0.00 -0.34 0.00 0.00 178.44 179.00 2fel h ALA 342 N 0.82 1.42 0.00 1.25 0.00 -1.27 -0.92 119.26 120.55 2fel h ALA 342 Ca 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2fel h ALA 342 Cb 0.66 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2fel h ALA 342 CO 0.05 0.41 -0.03 0.00 0.00 0.00 0.00 179.25 179.68 2fel h ALA 343 N 1.55 1.01 0.00 0.00 0.00 -1.28 -2.65 119.26 117.88 2fel h ALA 343 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2fel h ALA 343 Cb 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2fel h ALA 343 CO 0.01 0.03 -0.22 1.96 0.00 0.00 0.00 179.25 181.04 2fel h GLN 344 N 0.00 0.00 -6.38 0.00 4.20 -0.94 -3.45 115.11 108.54 2fel h GLN 344 Ca -0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 2fel h GLN 344 Cb 0.54 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.26 2fel h GLN 344 CO 0.00 0.00 1.10 0.42 -0.67 0.00 0.00 178.83 179.69 2fel s ILE 345 N -3.24 3.76 -0.02 2.54 1.01 -1.00 -0.74 121.20 123.51 2fel s ILE 345 Ca 0.06 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.32 2fel s ILE 345 Cb 0.06 -4.50 -0.26 0.00 0.01 0.00 0.00 42.46 37.77 2fel s ILE 345 CO 0.69 -1.28 0.77 0.44 0.00 0.00 0.00 174.94 175.56 2fel h ASP 346 N 11.07 0.29 -4.36 3.58 3.32 -0.93 -3.48 116.42 125.91 2fel h ASP 346 Ca -0.27 -0.46 -0.15 0.00 0.02 0.00 0.00 57.03 56.17 2fel h ASP 346 Cb 1.09 -0.09 -0.23 0.00 0.22 0.00 0.00 39.33 40.31 2fel h ASP 346 CO 1.20 1.39 -0.43 -0.60 -1.72 0.00 0.00 179.24 179.08 2fel s ARG 347 N -2.61 0.40 -0.04 3.56 3.52 -1.20 -4.95 118.95 117.64 2fel s ARG 347 Ca -0.09 0.03 0.06 0.00 -0.13 0.00 0.00 55.73 55.59 2fel s ARG 347 Cb 0.07 0.18 -0.01 0.00 -1.56 0.00 0.00 34.95 33.63 2fel s ARG 347 CO 0.83 -0.08 -0.20 -0.51 -0.81 0.00 0.00 175.30 174.53 2fel s LEU 348 N -0.56 2.00 0.00 -0.88 1.43 -1.26 -1.79 118.68 117.61 2fel s LEU 348 Ca -0.07 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 2fel s LEU 348 Cb -0.04 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 45.09 2fel s LEU 348 CO 0.01 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.42 2fel n GLY 349 N 2.87 -3.08 0.31 -3.19 0.00 0.00 -4.85 105.19 97.25 2fel n GLY 349 Ca -0.17 -2.10 0.15 0.00 0.00 0.00 0.00 46.02 43.89 2fel n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32